*HEADER    TRANSCRIPTION                           05-JAN-17   5MSL              
*TITLE     SOLUTION STRUCTURE OF THE B. SUBTILIS ANTI-SIGMA-F FACTOR, FIN        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ANTI-SIGMA-F FACTOR FIN;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: SUPPRESSOR OF RECU AND RECB SUBA;                           
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS;                              
*SOURCE   3 ORGANISM_TAXID: 1423;                                                
*SOURCE   4 GENE: FIN, SUBA, YABK, BSU00540;                                     
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21;                            
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 511693                                      
*KEYWDS    ZINC FINGER, BACILLUS SUBTILIS, SIGMA FACTOR, SPORULATION,            
*KEYWDS   2 TRANSCRIPTION                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    S.MARTINEZ-LUMBRERAS,C.ALFANO,R.L.ISAACSON                            
*REVDAT   1   21-JUN-17 5MSL    0                                                
# Restraints file 1: NOEs.tbl
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name   HA) 2.900 1.051 1.051 weight 1.000 ! spec=S064_8, no=1, id=0, vol=4.167703e+06
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HB1) 2.651 0.878 0.878 weight 1.000 ! spec=S064_8, no=2, id=1, vol=7.135350e+06
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name  HB1) 2.447 0.748 0.748 weight 1.000 ! spec=S064_8, no=4, id=3, vol=1.154158e+07
    or (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    2 and name   HA) 2.599 0.844 0.844 weight 1.000 ! spec=S064_8, no=8, id=7, vol=8.042153e+06
    or (segid "   A" and resid    2 and name  HB3) (segid "   A" and resid    2 and name   HA)
    or (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid    2 and name   HA)
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    2 and name   HN) 2.674 0.893 0.893 weight 1.000 ! spec=S064_8, no=9, id=8, vol=6.782315e+06
    or (segid "   A" and resid    2 and name  HB3) (segid "   A" and resid    2 and name   HN)
    or (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid    2 and name   HN)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HA1) 2.945 1.084 1.084 weight 1.000 ! spec=S064_8, no=10, id=9, vol=3.793702e+06
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HA2) 3.068 1.176 1.176 weight 1.000 ! spec=S064_8, no=11, id=10, vol=2.972072e+06
assign (segid "   A" and resid   11 and name  HA2) (segid "   A" and resid   11 and name  HA1) 2.868 1.028 1.028 weight 1.000 ! spec=S064_8, no=13, id=12, vol=4.454030e+06
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name  HA1) 2.921 1.067 1.067 weight 1.000 ! spec=S064_8, no=14, id=13, vol=3.987149e+06
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name  HA2) 2.696 0.909 0.909 weight 1.000 ! spec=S064_8, no=15, id=14, vol=6.447762e+06
assign (segid "   A" and resid   47 and name  HA2) (segid "   A" and resid   47 and name  HA1) 2.791 0.974 0.974 weight 1.000 ! spec=S064_8, no=17, id=16, vol=5.236849e+06
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HA2) 2.740 0.938 0.938 weight 1.000 ! spec=S064_8, no=18, id=17, vol=5.854292e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HA1) 2.860 1.023 1.023 weight 1.000 ! spec=S064_8, no=19, id=18, vol=4.520776e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HA2) 2.768 0.958 0.958 weight 1.000 ! spec=S064_8, no=20, id=19, vol=5.509170e+06
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   73 and name HG22) 3.615 1.633 1.633 weight 1.000 ! spec=S064_8, no=21, id=20, vol=1.110270e+06
    or (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   73 and name HG23)
    or (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   73 and name HG21)
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   33 and name   HA) 2.606 0.849 0.849 weight 1.000 ! spec=S064_8, no=23, id=22, vol=7.900602e+06
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   33 and name   HA)
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   33 and name   HA)
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   33 and name   HB) 2.595 0.842 0.842 weight 1.000 ! spec=S064_8, no=24, id=23, vol=8.108250e+06
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   33 and name   HB)
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   33 and name   HB)
assign (segid "   A" and resid   24 and name HG22) (segid "   A" and resid   24 and name   HB) 2.429 0.737 0.737 weight 1.000 ! spec=S064_8, no=26, id=25, vol=1.206226e+07
    or (segid "   A" and resid   24 and name HG23) (segid "   A" and resid   24 and name   HB)
    or (segid "   A" and resid   24 and name HG21) (segid "   A" and resid   24 and name   HB)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HG22) 2.870 1.030 1.030 weight 1.000 ! spec=S064_8, no=27, id=26, vol=4.428063e+06
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HG23)
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HG21)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name HG23) 3.114 1.212 1.212 weight 1.000 ! spec=S064_8, no=29, id=28, vol=2.716622e+06
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name HG21)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name HG22)
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid   53 and name   HB) 2.738 0.937 0.937 weight 1.000 ! spec=S064_8, no=30, id=29, vol=5.875369e+06
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid   53 and name   HB)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid   53 and name   HB)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name   HA) 3.693 1.705 1.705 weight 1.000 ! spec=S064_8, no=31, id=30, vol=9.761370e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG11) 3.131 1.226 1.226 weight 1.000 ! spec=S064_8, no=32, id=31, vol=2.626884e+06
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   54 and name HG12) (segid "   A" and resid   54 and name   HA) 3.485 1.518 1.518 weight 1.000 ! spec=S064_8, no=34, id=33, vol=1.383290e+06
assign (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name   HA) 3.223 1.298 1.298 weight 1.000 ! spec=S064_8, no=35, id=34, vol=2.210307e+06
assign (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   54 and name   HA) 3.225 1.300 1.300 weight 1.000 ! spec=S064_8, no=36, id=35, vol=2.200140e+06
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   54 and name   HA)
    or (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   54 and name   HA)
assign (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name HD13) 2.767 0.957 0.957 weight 1.000 ! spec=S064_8, no=37, id=36, vol=5.523825e+06
    or (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name HD11)
    or (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name HD12)
assign (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name HG22) 2.694 0.907 0.907 weight 1.000 ! spec=S064_8, no=39, id=38, vol=6.481226e+06
    or (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name   HB) 3.371 1.420 1.420 weight 1.000 ! spec=S064_8, no=41, id=40, vol=1.687611e+06
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name   HA) 2.909 1.058 1.058 weight 1.000 ! spec=S064_8, no=42, id=41, vol=4.085199e+06
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   66 and name   HA) 3.153 1.243 1.243 weight 1.000 ! spec=S064_8, no=43, id=42, vol=2.521741e+06
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   66 and name  HB2) 2.365 0.699 0.699 weight 1.000 ! spec=S064_8, no=44, id=43, vol=1.414930e+07
assign (segid "   A" and resid   66 and name  HG2) (segid "   A" and resid   66 and name  HG1) 2.249 0.632 0.632 weight 1.000 ! spec=S064_8, no=47, id=46, vol=1.916034e+07
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   66 and name  HG2) 2.707 0.916 0.916 weight 1.000 ! spec=S064_8, no=48, id=47, vol=6.294167e+06
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name   HB) 2.858 1.021 1.021 weight 1.000 ! spec=S064_8, no=49, id=48, vol=4.547219e+06
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name HG23) 3.217 1.293 1.293 weight 1.000 ! spec=S064_8, no=50, id=49, vol=2.236427e+06
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name HG21)
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name HG11) 3.606 1.625 1.625 weight 1.000 ! spec=S064_8, no=51, id=50, vol=1.127184e+06
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name HG12) 3.372 1.421 1.421 weight 1.000 ! spec=S064_8, no=52, id=51, vol=1.685087e+06
assign (segid "   A" and resid   41 and name HG23) (segid "   A" and resid   41 and name   HA) 2.976 1.107 1.107 weight 1.000 ! spec=S064_8, no=54, id=53, vol=3.565919e+06
    or (segid "   A" and resid   41 and name HG22) (segid "   A" and resid   41 and name   HA)
    or (segid "   A" and resid   41 and name HG21) (segid "   A" and resid   41 and name   HA)
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG23) 2.686 0.902 0.902 weight 1.000 ! spec=S064_8, no=55, id=54, vol=6.589892e+06
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG21)
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG11) 3.132 1.226 1.226 weight 1.000 ! spec=S064_8, no=57, id=56, vol=2.624020e+06
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG11) 2.409 0.726 0.726 weight 1.000 ! spec=S064_8, no=58, id=57, vol=1.266076e+07
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name   HB) 2.856 1.020 1.020 weight 1.000 ! spec=S064_8, no=60, id=59, vol=4.561821e+06
assign (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   41 and name HG23) 2.886 1.041 1.041 weight 1.000 ! spec=S064_8, no=62, id=61, vol=4.281919e+06
    or (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   41 and name HG21)
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   58 and name   HA) 3.150 1.240 1.240 weight 1.000 ! spec=S064_8, no=63, id=62, vol=2.535232e+06
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   58 and name  HB2) 3.072 1.179 1.179 weight 1.000 ! spec=S064_8, no=64, id=63, vol=2.949308e+06
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   58 and name  HB1) 3.235 1.308 1.308 weight 1.000 ! spec=S064_8, no=65, id=64, vol=2.159583e+06
assign (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   58 and name  HB2) 3.250 1.320 1.320 weight 1.000 ! spec=S064_8, no=68, id=67, vol=2.102964e+06
assign (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   58 and name  HB1) 2.975 1.107 1.107 weight 1.000 ! spec=S064_8, no=69, id=68, vol=3.568726e+06
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   58 and name  HB1) 2.509 0.787 0.787 weight 1.000 ! spec=S064_8, no=73, id=72, vol=9.917019e+06
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   10 and name  HB1) 2.583 0.834 0.834 weight 1.000 ! spec=S064_8, no=76, id=75, vol=8.335249e+06
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   10 and name   HA) 3.064 1.174 1.174 weight 1.000 ! spec=S064_8, no=77, id=76, vol=2.993134e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name   HA) 3.464 1.500 1.500 weight 1.000 ! spec=S064_8, no=78, id=77, vol=1.433973e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HB2) 3.050 1.163 1.163 weight 1.000 ! spec=S064_8, no=79, id=78, vol=3.076807e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HB1) 3.066 1.175 1.175 weight 1.000 ! spec=S064_8, no=80, id=79, vol=2.980679e+06
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name  HB1) 2.465 0.760 0.760 weight 1.000 ! spec=S064_8, no=82, id=81, vol=1.102911e+07
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name   HA) 3.506 1.537 1.537 weight 1.000 ! spec=S064_8, no=83, id=82, vol=1.333006e+06
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name   HA) 3.381 1.429 1.429 weight 1.000 ! spec=S064_8, no=84, id=83, vol=1.658540e+06
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   55 and name  HB2) 3.430 1.470 1.470 weight 1.000 ! spec=S064_8, no=86, id=85, vol=1.521461e+06
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   55 and name   HA) 3.634 1.651 1.651 weight 1.000 ! spec=S064_8, no=87, id=86, vol=1.074946e+06
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name  HB1) 3.049 1.162 1.162 weight 1.000 ! spec=S064_8, no=89, id=88, vol=3.081160e+06
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name  HB2) 3.158 1.247 1.247 weight 1.000 ! spec=S064_8, no=90, id=89, vol=2.496133e+06
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   29 and name   HA) 3.052 1.164 1.164 weight 1.000 ! spec=S064_8, no=91, id=90, vol=3.066587e+06
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   29 and name   HA)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   29 and name  HB2) 2.881 1.038 1.038 weight 1.000 ! spec=S064_8, no=92, id=91, vol=4.329581e+06
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   29 and name  HB2)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   29 and name  HB1) 2.914 1.062 1.062 weight 1.000 ! spec=S064_8, no=93, id=92, vol=4.043005e+06
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   29 and name  HB1)
assign (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   29 and name   HA) 3.220 1.296 1.296 weight 1.000 ! spec=S064_8, no=94, id=93, vol=2.220575e+06
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   29 and name   HA) 3.118 1.215 1.215 weight 1.000 ! spec=S064_8, no=95, id=94, vol=2.697153e+06
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   29 and name   HN) 3.390 1.437 1.437 weight 1.000 ! spec=S064_8, no=99, id=98, vol=1.630397e+06
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   29 and name   HN)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   29 and name  HE1) 2.180 0.594 0.594 weight 1.000 ! spec=S064_8, no=101, id=100, vol=2.309740e+07
    or (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   29 and name  HE2)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   29 and name  HE1)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   29 and name  HE2)
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   43 and name   HA) 2.452 0.752 0.752 weight 1.000 ! spec=S064_8, no=103, id=102, vol=1.138777e+07
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   42 and name  HB2) 3.019 1.139 1.139 weight 1.000 ! spec=S064_8, no=104, id=103, vol=3.272218e+06
assign (segid "   A" and resid   42 and name  HB2) (segid "   A" and resid   42 and name   HA) 3.188 1.271 1.271 weight 1.000 ! spec=S064_8, no=105, id=104, vol=2.357765e+06
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HB1) 3.029 1.147 1.147 weight 1.000 ! spec=S064_8, no=107, id=106, vol=3.204553e+06
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HB2) 3.027 1.146 1.146 weight 1.000 ! spec=S064_8, no=108, id=107, vol=3.216358e+06
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name   HA) 2.790 0.973 0.973 weight 1.000 ! spec=S064_8, no=109, id=108, vol=5.250499e+06
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   26 and name   HA) 3.190 1.272 1.272 weight 1.000 ! spec=S064_8, no=110, id=109, vol=2.350289e+06
assign (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   26 and name   HA) 3.170 1.256 1.256 weight 1.000 ! spec=S064_8, no=111, id=110, vol=2.438430e+06
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name   HA) 3.250 1.321 1.321 weight 1.000 ! spec=S064_8, no=112, id=111, vol=2.100107e+06
assign (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   20 and name   HA) 3.173 1.258 1.258 weight 1.000 ! spec=S064_8, no=113, id=112, vol=2.427083e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name  HB1) 3.046 1.160 1.160 weight 1.000 ! spec=S064_8, no=114, id=113, vol=3.098580e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name  HB2) 2.944 1.083 1.083 weight 1.000 ! spec=S064_8, no=115, id=114, vol=3.806356e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name   HA) 2.933 1.075 1.075 weight 1.000 ! spec=S064_8, no=116, id=115, vol=3.889568e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HB2) 3.095 1.197 1.197 weight 1.000 ! spec=S064_8, no=117, id=116, vol=2.819235e+06
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name   HA) 3.339 1.393 1.393 weight 1.000 ! spec=S064_8, no=118, id=117, vol=1.787974e+06
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name   HA) 3.215 1.292 1.292 weight 1.000 ! spec=S064_8, no=119, id=118, vol=2.241150e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name  HB2) 3.206 1.285 1.285 weight 1.000 ! spec=S064_8, no=120, id=119, vol=2.281214e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name  HB1) 3.306 1.366 1.366 weight 1.000 ! spec=S064_8, no=121, id=120, vol=1.896863e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name   HA) 3.281 1.345 1.345 weight 1.000 ! spec=S064_8, no=122, id=121, vol=1.986936e+06
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HB1) 3.011 1.133 1.133 weight 1.000 ! spec=S064_8, no=123, id=122, vol=3.323170e+06
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name   HA) 3.443 1.482 1.482 weight 1.000 ! spec=S064_8, no=124, id=123, vol=1.486574e+06
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   23 and name   HA) 3.385 1.432 1.432 weight 1.000 ! spec=S064_8, no=125, id=124, vol=1.646505e+06
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HB2) 3.056 1.168 1.168 weight 1.000 ! spec=S064_8, no=126, id=125, vol=3.037629e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name   HG) 2.937 1.078 1.078 weight 1.000 ! spec=S064_8, no=127, id=126, vol=3.858031e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name  HB2) 2.873 1.032 1.032 weight 1.000 ! spec=S064_8, no=128, id=127, vol=4.407087e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name  HB1) 3.129 1.224 1.224 weight 1.000 ! spec=S064_8, no=129, id=128, vol=2.637404e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name   HA) 2.773 0.961 0.961 weight 1.000 ! spec=S064_8, no=130, id=129, vol=5.442113e+06
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name   HA) 2.964 1.098 1.098 weight 1.000 ! spec=S064_8, no=134, id=133, vol=3.649261e+06
assign (segid "   A" and resid   62 and name   HG) (segid "   A" and resid   62 and name   HA) 3.195 1.276 1.276 weight 1.000 ! spec=S064_8, no=135, id=134, vol=2.329534e+06
assign (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   62 and name   HA) 2.957 1.093 1.093 weight 1.000 ! spec=S064_8, no=136, id=135, vol=3.706251e+06
assign (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   62 and name   HG) 2.724 0.927 0.927 weight 1.000 ! spec=S064_8, no=138, id=137, vol=6.066258e+06
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name  HB1) 2.275 0.647 0.647 weight 1.000 ! spec=S064_8, no=139, id=138, vol=1.784356e+07
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name HD13) 3.220 1.296 1.296 weight 1.000 ! spec=S064_8, no=141, id=140, vol=2.222753e+06
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name HD11)
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name HD12)
assign (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   62 and name HD21) 2.686 0.902 0.902 weight 1.000 ! spec=S064_8, no=146, id=145, vol=6.591655e+06
    or (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   62 and name HD23)
assign (segid "   A" and resid   62 and name   HG) (segid "   A" and resid   62 and name HD21) 2.589 0.838 0.838 weight 1.000 ! spec=S064_8, no=147, id=146, vol=8.216512e+06
    or (segid "   A" and resid   62 and name   HG) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid   62 and name   HG) (segid "   A" and resid   62 and name HD23)
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name HD21) 2.635 0.868 0.868 weight 1.000 ! spec=S064_8, no=148, id=147, vol=7.393970e+06
    or (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name HD23)
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name HD21) 3.351 1.404 1.404 weight 1.000 ! spec=S064_8, no=149, id=148, vol=1.748731e+06
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name HD23)
assign (segid "   A" and resid   62 and name HD13) (segid "   A" and resid   62 and name  HB2) 2.716 0.922 0.922 weight 1.000 ! spec=S064_8, no=152, id=151, vol=6.165085e+06
    or (segid "   A" and resid   62 and name HD11) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   62 and name HD12) (segid "   A" and resid   62 and name  HB2)
assign (segid "   A" and resid   62 and name HD13) (segid "   A" and resid   62 and name  HB1) 2.713 0.920 0.920 weight 1.000 ! spec=S064_8, no=154, id=153, vol=6.204989e+06
    or (segid "   A" and resid   62 and name HD11) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   62 and name HD12) (segid "   A" and resid   62 and name  HB1)
assign (segid "   A" and resid   62 and name HD13) (segid "   A" and resid   62 and name   HG) 2.575 0.829 0.829 weight 1.000 ! spec=S064_8, no=155, id=154, vol=8.493508e+06
    or (segid "   A" and resid   62 and name HD11) (segid "   A" and resid   62 and name   HG)
    or (segid "   A" and resid   62 and name HD12) (segid "   A" and resid   62 and name   HG)
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name   HA) 2.844 1.011 1.011 weight 1.000 ! spec=S064_8, no=158, id=157, vol=4.675705e+06
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name  HB2) 2.990 1.117 1.117 weight 1.000 ! spec=S064_8, no=159, id=158, vol=3.468439e+06
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name   HG) 3.277 1.342 1.342 weight 1.000 ! spec=S064_8, no=161, id=160, vol=2.001197e+06
assign (segid "   A" and resid    3 and name HD11) (segid "   A" and resid    3 and name  HB1) 2.713 0.920 0.920 weight 1.000 ! spec=S064_8, no=163, id=162, vol=6.209205e+06
    or (segid "   A" and resid    3 and name HD13) (segid "   A" and resid    3 and name  HB1)
    or (segid "   A" and resid    3 and name HD12) (segid "   A" and resid    3 and name  HB1)
assign (segid "   A" and resid    3 and name HD21) (segid "   A" and resid    3 and name  HB1) 2.905 1.055 1.055 weight 1.000 ! spec=S064_8, no=164, id=163, vol=4.124259e+06
    or (segid "   A" and resid    3 and name HD22) (segid "   A" and resid    3 and name  HB1)
    or (segid "   A" and resid    3 and name HD23) (segid "   A" and resid    3 and name  HB1)
assign (segid "   A" and resid    3 and name HD11) (segid "   A" and resid    3 and name   HA) 3.364 1.415 1.415 weight 1.000 ! spec=S064_8, no=165, id=164, vol=1.707531e+06
    or (segid "   A" and resid    3 and name HD13) (segid "   A" and resid    3 and name   HA)
    or (segid "   A" and resid    3 and name HD12) (segid "   A" and resid    3 and name   HA)
assign (segid "   A" and resid    3 and name HD21) (segid "   A" and resid    3 and name   HA) 3.187 1.270 1.270 weight 1.000 ! spec=S064_8, no=166, id=165, vol=2.363425e+06
    or (segid "   A" and resid    3 and name HD22) (segid "   A" and resid    3 and name   HA)
    or (segid "   A" and resid    3 and name HD23) (segid "   A" and resid    3 and name   HA)
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name HD11) 3.327 1.384 1.384 weight 1.000 ! spec=S064_8, no=167, id=166, vol=1.824872e+06
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name HD13)
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name HD12)
assign (segid "   A" and resid    3 and name HD21) (segid "   A" and resid    3 and name   HN) 3.667 1.681 1.681 weight 1.000 ! spec=S064_8, no=168, id=167, vol=1.018385e+06
    or (segid "   A" and resid    3 and name HD22) (segid "   A" and resid    3 and name   HN)
    or (segid "   A" and resid    3 and name HD23) (segid "   A" and resid    3 and name   HN)
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name  HB1) 3.200 1.280 1.280 weight 1.000 ! spec=S064_8, no=169, id=168, vol=2.304387e+06
assign (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name   HA) 3.337 1.392 1.392 weight 1.000 ! spec=S064_8, no=172, id=171, vol=1.793707e+06
assign (segid "   A" and resid    3 and name   HG) (segid "   A" and resid    3 and name   HA) 3.668 1.682 1.682 weight 1.000 ! spec=S064_8, no=173, id=172, vol=1.016236e+06
assign (segid "   A" and resid    3 and name HD21) (segid "   A" and resid    3 and name   HG) 2.739 0.937 0.937 weight 1.000 ! spec=S064_8, no=174, id=173, vol=5.870717e+06
    or (segid "   A" and resid    3 and name HD22) (segid "   A" and resid    3 and name   HG)
    or (segid "   A" and resid    3 and name HD23) (segid "   A" and resid    3 and name   HG)
assign (segid "   A" and resid    3 and name HD11) (segid "   A" and resid    3 and name   HG) 2.410 0.726 0.726 weight 1.000 ! spec=S064_8, no=175, id=174, vol=1.265285e+07
    or (segid "   A" and resid    3 and name HD13) (segid "   A" and resid    3 and name   HG)
    or (segid "   A" and resid    3 and name HD12) (segid "   A" and resid    3 and name   HG)
assign (segid "   A" and resid   52 and name  HB1) (segid "   A" and resid   52 and name   HA) 3.512 1.541 1.541 weight 1.000 ! spec=S064_8, no=181, id=180, vol=1.320714e+06
assign (segid "   A" and resid   52 and name HD21) (segid "   A" and resid   52 and name   HA) 2.897 1.049 1.049 weight 1.000 ! spec=S064_8, no=183, id=182, vol=4.193047e+06
    or (segid "   A" and resid   52 and name HD23) (segid "   A" and resid   52 and name   HA)
    or (segid "   A" and resid   52 and name HD22) (segid "   A" and resid   52 and name   HA)
assign (segid "   A" and resid   52 and name  HB1) (segid "   A" and resid   52 and name  HB2) 2.646 0.875 0.875 weight 1.000 ! spec=S064_8, no=187, id=186, vol=7.212309e+06
assign (segid "   A" and resid   52 and name HD21) (segid "   A" and resid   52 and name  HB1) 2.896 1.049 1.049 weight 1.000 ! spec=S064_8, no=189, id=188, vol=4.195610e+06
    or (segid "   A" and resid   52 and name HD23) (segid "   A" and resid   52 and name  HB1)
    or (segid "   A" and resid   52 and name HD22) (segid "   A" and resid   52 and name  HB1)
assign (segid "   A" and resid   52 and name HD21) (segid "   A" and resid   52 and name   HG) 2.554 0.815 0.815 weight 1.000 ! spec=S064_8, no=190, id=189, vol=8.924199e+06
    or (segid "   A" and resid   52 and name HD23) (segid "   A" and resid   52 and name   HG)
    or (segid "   A" and resid   52 and name HD22) (segid "   A" and resid   52 and name   HG)
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HD21) 3.088 1.192 1.192 weight 1.000 ! spec=S064_8, no=192, id=191, vol=2.857274e+06
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HD23)
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HD22)
assign (segid "   A" and resid   52 and name  HB1) (segid "   A" and resid   52 and name   HN) 3.563 1.587 1.587 weight 1.000 ! spec=S064_8, no=193, id=192, vol=1.210965e+06
assign (segid "   A" and resid   52 and name   HG) (segid "   A" and resid   52 and name   HN) 3.207 1.285 1.285 weight 1.000 ! spec=S064_8, no=194, id=193, vol=2.278075e+06
assign (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid   52 and name   HN) 3.218 1.294 1.294 weight 1.000 ! spec=S064_8, no=195, id=194, vol=2.230681e+06
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name   HA) 3.689 1.701 1.701 weight 1.000 ! spec=S064_8, no=196, id=195, vol=9.824690e+05
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name  HB1) 3.079 1.185 1.185 weight 1.000 ! spec=S064_8, no=197, id=196, vol=2.906530e+06
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   32 and name   HA) 3.158 1.247 1.247 weight 1.000 ! spec=S064_8, no=199, id=198, vol=2.494963e+06
assign (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid   32 and name   HA) 2.760 0.952 0.952 weight 1.000 ! spec=S064_8, no=200, id=199, vol=5.605254e+06
assign (segid "   A" and resid   32 and name HD13) (segid "   A" and resid   32 and name   HA) 3.063 1.173 1.173 weight 1.000 ! spec=S064_8, no=201, id=200, vol=2.998117e+06
    or (segid "   A" and resid   32 and name HD11) (segid "   A" and resid   32 and name   HA)
    or (segid "   A" and resid   32 and name HD12) (segid "   A" and resid   32 and name   HA)
assign (segid "   A" and resid   32 and name HD21) (segid "   A" and resid   32 and name   HG) 2.313 0.669 0.669 weight 1.000 ! spec=S064_8, no=204, id=202, vol=1.617791e+07
    or (segid "   A" and resid   32 and name HD22) (segid "   A" and resid   32 and name   HG)
    or (segid "   A" and resid   32 and name HD23) (segid "   A" and resid   32 and name   HG)
assign (segid "   A" and resid   32 and name HD13) (segid "   A" and resid   32 and name   HG) 2.312 0.668 0.668 weight 1.000 ! spec=S064_8, no=206, id=204, vol=1.622153e+07
    or (segid "   A" and resid   32 and name HD11) (segid "   A" and resid   32 and name   HG)
    or (segid "   A" and resid   32 and name HD12) (segid "   A" and resid   32 and name   HG)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name HD13) 3.374 1.423 1.423 weight 1.000 ! spec=S064_8, no=207, id=205, vol=1.679485e+06
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name HD11)
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name HD12)
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name   HA) 2.989 1.117 1.117 weight 1.000 ! spec=S064_8, no=208, id=206, vol=3.474266e+06
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB2) 2.926 1.070 1.070 weight 1.000 ! spec=S064_8, no=209, id=207, vol=3.945675e+06
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name   HG) 3.011 1.133 1.133 weight 1.000 ! spec=S064_8, no=210, id=208, vol=3.322918e+06
assign (segid "   A" and resid   27 and name HD21) (segid "   A" and resid   27 and name   HA) 2.655 0.881 0.881 weight 1.000 ! spec=S064_8, no=212, id=210, vol=7.065405e+06
    or (segid "   A" and resid   27 and name HD23) (segid "   A" and resid   27 and name   HA)
    or (segid "   A" and resid   27 and name HD22) (segid "   A" and resid   27 and name   HA)
assign (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name   HA) 2.989 1.117 1.117 weight 1.000 ! spec=S064_8, no=213, id=211, vol=3.475098e+06
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name   HA) 3.029 1.147 1.147 weight 1.000 ! spec=S064_8, no=214, id=212, vol=3.206146e+06
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name HD21) 3.456 1.493 1.493 weight 1.000 ! spec=S064_8, no=215, id=213, vol=1.453956e+06
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name HD23)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name HD22)
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name HD11) 3.582 1.604 1.604 weight 1.000 ! spec=S064_8, no=216, id=214, vol=1.172449e+06
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name HD13)
assign (segid "   A" and resid   27 and name HD21) (segid "   A" and resid   27 and name   HG) 2.364 0.698 0.698 weight 1.000 ! spec=S064_8, no=217, id=215, vol=1.420517e+07
    or (segid "   A" and resid   27 and name HD23) (segid "   A" and resid   27 and name   HG)
    or (segid "   A" and resid   27 and name HD22) (segid "   A" and resid   27 and name   HG)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HA) 2.522 0.795 0.795 weight 1.000 ! spec=S064_8, no=219, id=217, vol=9.625279e+06
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name HD13) 3.017 1.138 1.138 weight 1.000 ! spec=S064_8, no=220, id=218, vol=3.286289e+06
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name HD11)
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name HD12)
assign (segid "   A" and resid   17 and name HD21) (segid "   A" and resid   17 and name   HG) 2.283 0.652 0.652 weight 1.000 ! spec=S064_8, no=221, id=219, vol=1.747389e+07
    or (segid "   A" and resid   17 and name HD22) (segid "   A" and resid   17 and name   HG)
    or (segid "   A" and resid   17 and name HD23) (segid "   A" and resid   17 and name   HG)
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name   HA) 2.821 0.995 0.995 weight 1.000 ! spec=S064_8, no=223, id=220, vol=4.914175e+06
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name   HA) 3.095 1.197 1.197 weight 1.000 ! spec=S064_8, no=224, id=221, vol=2.817410e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HB) 2.725 0.928 0.928 weight 1.000 ! spec=S064_8, no=228, id=225, vol=6.045953e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG11) 2.668 0.890 0.890 weight 1.000 ! spec=S064_8, no=229, id=226, vol=6.859181e+06
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG21) 2.726 0.929 0.929 weight 1.000 ! spec=S064_8, no=230, id=227, vol=6.035085e+06
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG22)
assign (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   12 and name   HB) 2.579 0.831 0.831 weight 1.000 ! spec=S064_8, no=231, id=228, vol=8.424236e+06
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   12 and name   HB)
assign (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   12 and name   HB) 2.586 0.836 0.836 weight 1.000 ! spec=S064_8, no=232, id=229, vol=8.274592e+06
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   12 and name   HB)
assign (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   12 and name HG21) 2.255 0.636 0.636 weight 1.000 ! spec=S064_8, no=233, id=230, vol=1.883792e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   12 and name HG22)
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG11) 2.787 0.971 0.971 weight 1.000 ! spec=S064_8, no=236, id=233, vol=5.288878e+06
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG13)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name HG12)
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name   HB) 2.940 1.080 1.080 weight 1.000 ! spec=S064_8, no=237, id=234, vol=3.838345e+06
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name   HA) 3.227 1.302 1.302 weight 1.000 ! spec=S064_8, no=238, id=235, vol=2.193793e+06
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name   HA) 2.700 0.911 0.911 weight 1.000 ! spec=S064_8, no=241, id=238, vol=6.392950e+06
assign (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name   HA) 2.647 0.876 0.876 weight 1.000 ! spec=S064_8, no=242, id=239, vol=7.200159e+06
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name   HA)
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name   HA)
assign (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   22 and name   HB) 2.342 0.685 0.685 weight 1.000 ! spec=S064_8, no=243, id=240, vol=1.502087e+07
    or (segid "   A" and resid   22 and name HG13) (segid "   A" and resid   22 and name   HB)
    or (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   22 and name   HB)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   22 and name HG11) 3.323 1.380 1.380 weight 1.000 ! spec=S064_8, no=245, id=242, vol=1.839188e+06
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   22 and name HG13)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   22 and name HG12)
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name   HA) 3.504 1.534 1.534 weight 1.000 ! spec=S064_8, no=248, id=245, vol=1.338770e+06
assign (segid "   A" and resid   51 and name HG12) (segid "   A" and resid   51 and name   HA) 2.926 1.070 1.070 weight 1.000 ! spec=S064_8, no=249, id=246, vol=3.944960e+06
    or (segid "   A" and resid   51 and name HG13) (segid "   A" and resid   51 and name   HA)
    or (segid "   A" and resid   51 and name HG11) (segid "   A" and resid   51 and name   HA)
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name   HB) 3.375 1.424 1.424 weight 1.000 ! spec=S064_8, no=250, id=247, vol=1.675437e+06
assign (segid "   A" and resid   51 and name HG23) (segid "   A" and resid   51 and name   HN) 3.264 1.332 1.332 weight 1.000 ! spec=S064_8, no=251, id=248, vol=2.047319e+06
    or (segid "   A" and resid   51 and name HG22) (segid "   A" and resid   51 and name   HN)
    or (segid "   A" and resid   51 and name HG21) (segid "   A" and resid   51 and name   HN)
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name HG12) 3.205 1.284 1.284 weight 1.000 ! spec=S064_8, no=252, id=249, vol=2.283231e+06
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name HG13)
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name HG11)
assign (segid "   A" and resid   51 and name HG23) (segid "   A" and resid   51 and name   HB) 2.713 0.920 0.920 weight 1.000 ! spec=S064_8, no=254, id=251, vol=6.210299e+06
    or (segid "   A" and resid   51 and name HG22) (segid "   A" and resid   51 and name   HB)
    or (segid "   A" and resid   51 and name HG21) (segid "   A" and resid   51 and name   HB)
assign (segid "   A" and resid   51 and name HG23) (segid "   A" and resid   51 and name   HA) 2.984 1.113 1.113 weight 1.000 ! spec=S064_8, no=255, id=252, vol=3.507902e+06
    or (segid "   A" and resid   51 and name HG22) (segid "   A" and resid   51 and name   HA)
    or (segid "   A" and resid   51 and name HG21) (segid "   A" and resid   51 and name   HA)
assign (segid "   A" and resid   51 and name HG23) (segid "   A" and resid   51 and name HG12) 2.179 0.594 0.594 weight 1.000 ! spec=S064_8, no=256, id=253, vol=2.312095e+07
    or (segid "   A" and resid   51 and name HG23) (segid "   A" and resid   51 and name HG13)
    or (segid "   A" and resid   51 and name HG23) (segid "   A" and resid   51 and name HG11)
    or (segid "   A" and resid   51 and name HG22) (segid "   A" and resid   51 and name HG12)
    or (segid "   A" and resid   51 and name HG22) (segid "   A" and resid   51 and name HG13)
    or (segid "   A" and resid   51 and name HG22) (segid "   A" and resid   51 and name HG11)
    or (segid "   A" and resid   51 and name HG21) (segid "   A" and resid   51 and name HG12)
    or (segid "   A" and resid   51 and name HG21) (segid "   A" and resid   51 and name HG13)
    or (segid "   A" and resid   51 and name HG21) (segid "   A" and resid   51 and name HG11)
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name   HB) 3.120 1.217 1.217 weight 1.000 ! spec=S064_8, no=258, id=255, vol=2.685514e+06
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG11) 2.354 0.693 0.693 weight 1.000 ! spec=S064_8, no=262, id=259, vol=1.455942e+07
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   14 and name HG11) 1.965 0.483 0.483 weight 1.000 ! spec=S064_8, no=263, id=260, vol=4.296522e+07
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name HG11) 2.807 0.985 0.985 weight 1.000 ! spec=S064_8, no=265, id=262, vol=5.060700e+06
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   14 and name   HA) 2.483 0.770 0.770 weight 1.000 ! spec=S064_8, no=266, id=263, vol=1.057587e+07
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name   HB) 2.988 1.116 1.116 weight 1.000 ! spec=S064_8, no=267, id=264, vol=3.483052e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG23) 3.006 1.129 1.129 weight 1.000 ! spec=S064_8, no=268, id=265, vol=3.359814e+06
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name   HA) 3.451 1.489 1.489 weight 1.000 ! spec=S064_8, no=269, id=266, vol=1.465902e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name   HB) 2.703 0.913 0.913 weight 1.000 ! spec=S064_8, no=270, id=267, vol=6.350072e+06
assign (segid "   A" and resid   49 and name   HB) (segid "   A" and resid   49 and name HG12) 2.525 0.797 0.797 weight 1.000 ! spec=S064_8, no=274, id=271, vol=9.567404e+06
    or (segid "   A" and resid   49 and name   HB) (segid "   A" and resid   49 and name HG13)
    or (segid "   A" and resid   49 and name   HB) (segid "   A" and resid   49 and name HG11)
assign (segid "   A" and resid   49 and name   HB) (segid "   A" and resid   49 and name HG21) 2.640 0.871 0.871 weight 1.000 ! spec=S064_8, no=275, id=272, vol=7.320339e+06
    or (segid "   A" and resid   49 and name   HB) (segid "   A" and resid   49 and name HG22)
    or (segid "   A" and resid   49 and name   HB) (segid "   A" and resid   49 and name HG23)
assign (segid "   A" and resid   49 and name HG12) (segid "   A" and resid   49 and name   HA) 2.890 1.044 1.044 weight 1.000 ! spec=S064_8, no=276, id=273, vol=4.250221e+06
    or (segid "   A" and resid   49 and name HG13) (segid "   A" and resid   49 and name   HA)
    or (segid "   A" and resid   49 and name HG11) (segid "   A" and resid   49 and name   HA)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   49 and name   HA) 3.055 1.167 1.167 weight 1.000 ! spec=S064_8, no=277, id=274, vol=3.044269e+06
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   49 and name   HA)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   49 and name   HA)
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name HG12) 3.016 1.137 1.137 weight 1.000 ! spec=S064_8, no=278, id=275, vol=3.287336e+06
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name HG13)
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name HG11)
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name  HB2) 2.634 0.867 0.867 weight 1.000 ! spec=S064_8, no=279, id=276, vol=7.416132e+06
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name   HA) 3.394 1.440 1.440 weight 1.000 ! spec=S064_8, no=280, id=277, vol=1.621139e+06
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name   HA) 3.468 1.503 1.503 weight 1.000 ! spec=S064_8, no=281, id=278, vol=1.423312e+06
assign (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   48 and name   HA) 2.935 1.077 1.077 weight 1.000 ! spec=S064_8, no=283, id=280, vol=3.872522e+06
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name  HB2) 2.925 1.069 1.069 weight 1.000 ! spec=S064_8, no=284, id=281, vol=3.955562e+06
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name   HA) 2.687 0.902 0.902 weight 1.000 ! spec=S064_8, no=286, id=283, vol=6.586907e+06
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name   HA) 3.051 1.163 1.163 weight 1.000 ! spec=S064_8, no=287, id=284, vol=3.073401e+06
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name   HA) 3.310 1.369 1.369 weight 1.000 ! spec=S064_8, no=289, id=286, vol=1.884895e+06
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HB2) 3.553 1.578 1.578 weight 1.000 ! spec=S064_8, no=290, id=287, vol=1.231583e+06
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HB1) 3.766 1.773 1.773 weight 1.000 ! spec=S064_8, no=291, id=288, vol=8.677400e+05
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name  HB1) 2.887 1.042 1.042 weight 1.000 ! spec=S064_8, no=292, id=289, vol=4.278926e+06
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    6 and name  HB1)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name  HB2) 2.679 0.897 0.897 weight 1.000 ! spec=S064_8, no=293, id=290, vol=6.697565e+06
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    6 and name  HB2)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name  HE2) 2.472 0.764 0.764 weight 1.000 ! spec=S064_8, no=294, id=291, vol=1.085970e+07
    or (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name  HE1)
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    6 and name  HE2)
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    6 and name  HE1)
assign (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    6 and name   HA) 3.219 1.295 1.295 weight 1.000 ! spec=S064_8, no=296, id=293, vol=2.225281e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name  HB1) 3.769 1.776 1.776 weight 1.000 ! spec=S064_8, no=298, id=295, vol=8.640670e+05
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name   HA) 3.173 1.259 1.259 weight 1.000 ! spec=S064_8, no=299, id=296, vol=2.425553e+06
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    5 and name   HA)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HB1) 2.775 0.963 0.963 weight 1.000 ! spec=S064_8, no=300, id=297, vol=5.421373e+06
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    5 and name  HB1)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HB2) 2.825 0.997 0.997 weight 1.000 ! spec=S064_8, no=301, id=298, vol=4.874404e+06
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    5 and name  HB2)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HE2) 2.229 0.621 0.621 weight 1.000 ! spec=S064_8, no=303, id=300, vol=2.021649e+07
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HE1)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    5 and name  HE2)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    5 and name  HE1)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name  HD1) 3.264 1.332 1.332 weight 1.000 ! spec=S064_8, no=305, id=302, vol=2.046520e+06
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name  HB2) 3.074 1.182 1.182 weight 1.000 ! spec=S064_8, no=307, id=304, vol=2.932643e+06
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name  HB1) 2.894 1.047 1.047 weight 1.000 ! spec=S064_8, no=308, id=305, vol=4.213076e+06
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name   HA) 3.124 1.220 1.220 weight 1.000 ! spec=S064_8, no=309, id=306, vol=2.666113e+06
assign (segid "   A" and resid   65 and name  HB2) (segid "   A" and resid   65 and name   HA) 3.413 1.456 1.456 weight 1.000 ! spec=S064_8, no=310, id=307, vol=1.566312e+06
assign (segid "   A" and resid   65 and name  HB1) (segid "   A" and resid   65 and name   HA) 3.188 1.270 1.270 weight 1.000 ! spec=S064_8, no=311, id=308, vol=2.360091e+06
assign (segid "   A" and resid   65 and name HD21) (segid "   A" and resid   65 and name  HB2) 3.328 1.384 1.384 weight 1.000 ! spec=S064_8, no=313, id=310, vol=1.822914e+06
assign (segid "   A" and resid   65 and name HD21) (segid "   A" and resid   65 and name HD22) 2.125 0.564 0.564 weight 1.000 ! spec=S064_8, no=315, id=312, vol=2.690680e+07
assign (segid "   A" and resid   65 and name HD21) (segid "   A" and resid   65 and name  HB1) 3.127 1.222 1.222 weight 1.000 ! spec=S064_8, no=316, id=313, vol=2.647820e+06
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   50 and name  HB2) 3.339 1.394 1.394 weight 1.000 ! spec=S064_8, no=318, id=315, vol=1.785561e+06
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   50 and name  HB1) 3.428 1.469 1.469 weight 1.000 ! spec=S064_8, no=319, id=316, vol=1.525893e+06
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   50 and name   HA) 2.982 1.111 1.111 weight 1.000 ! spec=S064_8, no=320, id=317, vol=3.522718e+06
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name   HA) 2.612 0.853 0.853 weight 1.000 ! spec=S064_8, no=323, id=320, vol=7.804690e+06
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name  HB1) 3.458 1.494 1.494 weight 1.000 ! spec=S064_8, no=324, id=321, vol=1.449489e+06
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name   HA) 3.017 1.138 1.138 weight 1.000 ! spec=S064_8, no=325, id=322, vol=3.283465e+06
assign (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   46 and name  HB2) 3.273 1.339 1.339 weight 1.000 ! spec=S064_8, no=327, id=324, vol=2.012831e+06
assign (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   46 and name  HB1) 3.307 1.367 1.367 weight 1.000 ! spec=S064_8, no=328, id=325, vol=1.894749e+06
assign (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   46 and name HD22) 2.199 0.604 0.604 weight 1.000 ! spec=S064_8, no=329, id=326, vol=2.190206e+07
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name  HB2) 2.479 0.768 0.768 weight 1.000 ! spec=S064_8, no=331, id=328, vol=1.067991e+07
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name  HG2) 3.603 1.623 1.623 weight 1.000 ! spec=S064_8, no=333, id=330, vol=1.132168e+06
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name   HA) 3.535 1.562 1.562 weight 1.000 ! spec=S064_8, no=334, id=331, vol=1.269259e+06
assign (segid "   A" and resid   60 and name  HG1) (segid "   A" and resid   60 and name  HB2) 2.198 0.604 0.604 weight 1.000 ! spec=S064_8, no=336, id=333, vol=2.195236e+07
assign (segid "   A" and resid   60 and name  HG1) (segid "   A" and resid   60 and name  HG2) 2.153 0.580 0.580 weight 1.000 ! spec=S064_8, no=337, id=334, vol=2.485473e+07
assign (segid "   A" and resid   60 and name  HG1) (segid "   A" and resid   60 and name   HA) 3.392 1.438 1.438 weight 1.000 ! spec=S064_8, no=338, id=335, vol=1.626046e+06
assign (segid "   A" and resid   60 and name   HA) (segid "   A" and resid   60 and name  HB2) 2.826 0.998 0.998 weight 1.000 ! spec=S064_8, no=339, id=336, vol=4.866270e+06
assign (segid "   A" and resid   60 and name  HG2) (segid "   A" and resid   60 and name   HA) 3.267 1.334 1.334 weight 1.000 ! spec=S064_8, no=340, id=337, vol=2.038452e+06
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name  HG1) 3.169 1.255 1.255 weight 1.000 ! spec=S064_8, no=342, id=339, vol=2.444738e+06
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name  HB2) 2.658 0.883 0.883 weight 1.000 ! spec=S064_8, no=343, id=340, vol=7.025327e+06
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name  HG2) 3.221 1.297 1.297 weight 1.000 ! spec=S064_8, no=344, id=341, vol=2.219379e+06
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name   HA) 3.018 1.139 1.139 weight 1.000 ! spec=S064_8, no=345, id=342, vol=3.277550e+06
assign (segid "   A" and resid   56 and name  HG2) (segid "   A" and resid   56 and name  HB2) 2.315 0.670 0.670 weight 1.000 ! spec=S064_8, no=349, id=346, vol=1.608441e+07
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB2) 2.602 0.846 0.846 weight 1.000 ! spec=S064_8, no=350, id=347, vol=7.978743e+06
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HG2) 3.079 1.185 1.185 weight 1.000 ! spec=S064_8, no=351, id=348, vol=2.907179e+06
assign (segid "   A" and resid   59 and name HE22) (segid "   A" and resid   59 and name  HG2) 3.434 1.474 1.474 weight 1.000 ! spec=S064_8, no=354, id=351, vol=1.511270e+06
assign (segid "   A" and resid   59 and name HE21) (segid "   A" and resid   59 and name  HG2) 2.930 1.073 1.073 weight 1.000 ! spec=S064_8, no=355, id=352, vol=3.916004e+06
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name   HA) 3.265 1.332 1.332 weight 1.000 ! spec=S064_8, no=356, id=353, vol=2.045447e+06
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name   HA) 2.683 0.900 0.900 weight 1.000 ! spec=S064_8, no=357, id=354, vol=6.639172e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   59 and name  HB2) 2.622 0.859 0.859 weight 1.000 ! spec=S064_8, no=360, id=356, vol=7.623855e+06
assign (segid "   A" and resid   59 and name HE21) (segid "   A" and resid   59 and name HE22) 2.185 0.597 0.597 weight 1.000 ! spec=S064_8, no=361, id=357, vol=2.275794e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name   HA) 2.615 0.855 0.855 weight 1.000 ! spec=S064_8, no=367, id=362, vol=7.742685e+06
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name  HG2) 3.080 1.186 1.186 weight 1.000 ! spec=S064_8, no=368, id=363, vol=2.902906e+06
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name  HB1) 2.806 0.984 0.984 weight 1.000 ! spec=S064_8, no=369, id=364, vol=5.077820e+06
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name  HB2) 3.020 1.140 1.140 weight 1.000 ! spec=S064_8, no=370, id=365, vol=3.264198e+06
assign (segid "   A" and resid   30 and name HE21) (segid "   A" and resid   30 and name HE22) 1.994 0.497 0.497 weight 1.000 ! spec=S064_8, no=371, id=366, vol=3.942846e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name  HB2) 3.463 1.499 1.499 weight 1.000 ! spec=S064_8, no=377, id=368, vol=1.435601e+06
assign (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   31 and name   HA) 3.336 1.391 1.391 weight 1.000 ! spec=S064_8, no=378, id=369, vol=1.797763e+06
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name   HA) 3.310 1.370 1.370 weight 1.000 ! spec=S064_8, no=379, id=370, vol=1.881603e+06
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name  HB2) 3.100 1.201 1.201 weight 1.000 ! spec=S064_8, no=380, id=371, vol=2.789006e+06
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name   HA) 3.359 1.411 1.411 weight 1.000 ! spec=S064_8, no=381, id=372, vol=1.723695e+06
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name   HA) 3.564 1.588 1.588 weight 1.000 ! spec=S064_8, no=382, id=373, vol=1.207693e+06
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid    9 and name   HA) 3.542 1.569 1.569 weight 1.000 ! spec=S064_8, no=383, id=374, vol=1.253238e+06
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name  HB2) 3.641 1.658 1.658 weight 1.000 ! spec=S064_8, no=385, id=376, vol=1.062139e+06
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name  HB1) 3.202 1.282 1.282 weight 1.000 ! spec=S064_8, no=386, id=377, vol=2.298327e+06
assign (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   67 and name   HA) 3.236 1.309 1.309 weight 1.000 ! spec=S064_8, no=387, id=378, vol=2.157989e+06
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   67 and name   HA) 3.074 1.181 1.181 weight 1.000 ! spec=S064_8, no=388, id=379, vol=2.935426e+06
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   72 and name  HB1) 3.725 1.735 1.735 weight 1.000 ! spec=S064_8, no=390, id=381, vol=9.264600e+05
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   72 and name   HA) 3.079 1.185 1.185 weight 1.000 ! spec=S064_8, no=391, id=382, vol=2.904690e+06
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   72 and name   HA) 3.044 1.159 1.159 weight 1.000 ! spec=S064_8, no=392, id=383, vol=3.110288e+06
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name  HB1) 3.169 1.255 1.255 weight 1.000 ! spec=S064_8, no=393, id=384, vol=2.446638e+06
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name  HB2) 3.257 1.326 1.326 weight 1.000 ! spec=S064_8, no=394, id=385, vol=2.072817e+06
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   44 and name   HA) 2.944 1.083 1.083 weight 1.000 ! spec=S064_8, no=395, id=386, vol=3.805332e+06
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   44 and name   HA) 3.217 1.294 1.294 weight 1.000 ! spec=S064_8, no=396, id=387, vol=2.234609e+06
assign (segid "   A" and resid   44 and name  HD2) (segid "   A" and resid   44 and name  HE2) 2.685 0.901 0.901 weight 1.000 ! spec=S064_8, no=398, id=389, vol=6.605075e+06
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   44 and name  HG2) 3.000 1.125 1.125 weight 1.000 ! spec=S064_8, no=399, id=390, vol=3.394387e+06
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   44 and name  HG2) 2.943 1.083 1.083 weight 1.000 ! spec=S064_8, no=400, id=391, vol=3.812193e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HB2) 2.862 1.024 1.024 weight 1.000 ! spec=S064_8, no=401, id=392, vol=4.510144e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HB1) 2.869 1.029 1.029 weight 1.000 ! spec=S064_8, no=402, id=393, vol=4.441449e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name   HA) 2.814 0.990 0.990 weight 1.000 ! spec=S064_8, no=403, id=394, vol=4.984929e+06
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   13 and name   HA) 3.248 1.318 1.318 weight 1.000 ! spec=S064_8, no=404, id=395, vol=2.110475e+06
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name   HA) 3.264 1.332 1.332 weight 1.000 ! spec=S064_8, no=405, id=396, vol=2.048121e+06
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   13 and name   HA) 3.219 1.295 1.295 weight 1.000 ! spec=S064_8, no=406, id=397, vol=2.227686e+06
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   13 and name  HG2) 2.761 0.953 0.953 weight 1.000 ! spec=S064_8, no=408, id=399, vol=5.586324e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB2) 3.590 1.611 1.611 weight 1.000 ! spec=S064_8, no=409, id=400, vol=1.157670e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name   HA) 3.386 1.433 1.433 weight 1.000 ! spec=S064_8, no=410, id=401, vol=1.643806e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name   HA) 2.844 1.011 1.011 weight 1.000 ! spec=S064_8, no=411, id=402, vol=4.683114e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB1) 3.318 1.376 1.376 weight 1.000 ! spec=S064_8, no=412, id=403, vol=1.855897e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HG2) 3.334 1.389 1.389 weight 1.000 ! spec=S064_8, no=413, id=404, vol=1.804261e+06
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid    8 and name  HD2) 3.294 1.356 1.356 weight 1.000 ! spec=S064_8, no=414, id=405, vol=1.938580e+06
assign (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    8 and name  HB2) 3.287 1.350 1.350 weight 1.000 ! spec=S064_8, no=419, id=410, vol=1.964940e+06
assign (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    8 and name  HG1) 3.272 1.338 1.338 weight 1.000 ! spec=S064_8, no=420, id=411, vol=2.017414e+06
assign (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    8 and name  HB1) 3.123 1.219 1.219 weight 1.000 ! spec=S064_8, no=421, id=412, vol=2.670906e+06
assign (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    8 and name  HG2) 3.045 1.159 1.159 weight 1.000 ! spec=S064_8, no=422, id=413, vol=3.106178e+06
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name  HG1) 3.236 1.309 1.309 weight 1.000 ! spec=S064_8, no=425, id=416, vol=2.157099e+06
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name   HA) 2.947 1.086 1.086 weight 1.000 ! spec=S064_8, no=426, id=417, vol=3.778101e+06
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name   HA) 2.668 0.890 0.890 weight 1.000 ! spec=S064_8, no=427, id=418, vol=6.868648e+06
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name   HA) 3.024 1.143 1.143 weight 1.000 ! spec=S064_8, no=430, id=421, vol=3.240639e+06
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name  HB1) 2.999 1.125 1.125 weight 1.000 ! spec=S064_8, no=431, id=422, vol=3.401190e+06
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name  HB2) 3.241 1.313 1.313 weight 1.000 ! spec=S064_8, no=432, id=423, vol=2.137949e+06
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name  HG2) 3.305 1.366 1.366 weight 1.000 ! spec=S064_8, no=433, id=424, vol=1.898990e+06
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name  HG1) 3.510 1.540 1.540 weight 1.000 ! spec=S064_8, no=434, id=425, vol=1.323998e+06
assign (segid "   A" and resid   64 and name  HB2) (segid "   A" and resid   64 and name  HG1) 2.565 0.823 0.823 weight 1.000 ! spec=S064_8, no=440, id=431, vol=8.686396e+06
assign (segid "   A" and resid   64 and name  HD2) (segid "   A" and resid   64 and name  HB2) 2.937 1.078 1.078 weight 1.000 ! spec=S064_8, no=441, id=432, vol=3.860390e+06
assign (segid "   A" and resid   64 and name  HD2) (segid "   A" and resid   64 and name  HB1) 2.978 1.109 1.109 weight 1.000 ! spec=S064_8, no=442, id=433, vol=3.550253e+06
assign (segid "   A" and resid   64 and name  HD2) (segid "   A" and resid   64 and name  HG2) 3.022 1.142 1.142 weight 1.000 ! spec=S064_8, no=443, id=434, vol=3.251710e+06
assign (segid "   A" and resid   64 and name  HD2) (segid "   A" and resid   64 and name  HG1) 2.709 0.917 0.917 weight 1.000 ! spec=S064_8, no=444, id=435, vol=6.268551e+06
assign (segid "   A" and resid   64 and name  HB2) (segid "   A" and resid   64 and name   HA) 2.861 1.023 1.023 weight 1.000 ! spec=S064_8, no=445, id=436, vol=4.511897e+06
assign (segid "   A" and resid   64 and name  HB1) (segid "   A" and resid   64 and name   HA) 2.989 1.117 1.117 weight 1.000 ! spec=S064_8, no=446, id=437, vol=3.469571e+06
assign (segid "   A" and resid   64 and name  HG1) (segid "   A" and resid   64 and name   HA) 2.903 1.053 1.053 weight 1.000 ! spec=S064_8, no=447, id=438, vol=4.140424e+06
assign (segid "   A" and resid   64 and name   HE) (segid "   A" and resid   64 and name  HD2) 3.094 1.197 1.197 weight 1.000 ! spec=S064_8, no=448, id=439, vol=2.823035e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name   HA) 2.368 0.701 0.701 weight 1.000 ! spec=S064_8, no=449, id=440, vol=1.403613e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name  HB2) 2.977 1.108 1.108 weight 1.000 ! spec=S064_8, no=450, id=441, vol=3.559387e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name  HB1) 2.844 1.011 1.011 weight 1.000 ! spec=S064_8, no=451, id=442, vol=4.676282e+06
assign (segid "   A" and resid   37 and name  HD2) (segid "   A" and resid   37 and name  HG2) 2.834 1.004 1.004 weight 1.000 ! spec=S064_8, no=453, id=444, vol=4.780329e+06
assign (segid "   A" and resid   37 and name  HD2) (segid "   A" and resid   37 and name  HG1) 3.024 1.143 1.143 weight 1.000 ! spec=S064_8, no=454, id=445, vol=3.238071e+06
assign (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   37 and name   HA) 3.100 1.201 1.201 weight 1.000 ! spec=S064_8, no=455, id=446, vol=2.791947e+06
assign (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name   HA) 2.848 1.014 1.014 weight 1.000 ! spec=S064_8, no=456, id=447, vol=4.638742e+06
assign (segid "   A" and resid   37 and name  HG1) (segid "   A" and resid   37 and name   HA) 3.294 1.356 1.356 weight 1.000 ! spec=S064_8, no=457, id=448, vol=1.938508e+06
assign (segid "   A" and resid   37 and name  HG2) (segid "   A" and resid   37 and name   HA) 3.348 1.401 1.401 weight 1.000 ! spec=S064_8, no=458, id=449, vol=1.759892e+06
assign (segid "   A" and resid   37 and name  HG2) (segid "   A" and resid   37 and name   HN) 3.077 1.184 1.184 weight 1.000 ! spec=S064_8, no=462, id=453, vol=2.917466e+06
assign (segid "   A" and resid   37 and name   HE) (segid "   A" and resid   37 and name  HD2) 3.102 1.202 1.202 weight 1.000 ! spec=S064_8, no=463, id=454, vol=2.781890e+06
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name  HB2) 3.098 1.200 1.200 weight 1.000 ! spec=S064_8, no=464, id=455, vol=2.799373e+06
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name   HA) 3.269 1.335 1.335 weight 1.000 ! spec=S064_8, no=465, id=456, vol=2.031263e+06
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   70 and name  HB2) 3.432 1.472 1.472 weight 1.000 ! spec=S064_8, no=466, id=457, vol=1.516567e+06
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   70 and name  HG2) 2.601 0.846 0.846 weight 1.000 ! spec=S064_8, no=467, id=458, vol=8.000910e+06
assign (segid "   A" and resid   70 and name  HG2) (segid "   A" and resid   70 and name   HA) 3.253 1.322 1.322 weight 1.000 ! spec=S064_8, no=468, id=459, vol=2.091432e+06
assign (segid "   A" and resid   68 and name  HE2) (segid "   A" and resid   68 and name  HD1) 2.280 0.650 0.650 weight 1.000 ! spec=S064_8, no=469, id=460, vol=1.765131e+07
    or (segid "   A" and resid   68 and name  HE2) (segid "   A" and resid   68 and name  HD2)
    or (segid "   A" and resid   68 and name  HE1) (segid "   A" and resid   68 and name  HD1)
    or (segid "   A" and resid   68 and name  HE1) (segid "   A" and resid   68 and name  HD2)
assign (segid "   A" and resid   71 and name  HE2) (segid "   A" and resid   71 and name  HD2) 2.313 0.669 0.669 weight 1.000 ! spec=S064_8, no=470, id=461, vol=1.616181e+07
    or (segid "   A" and resid   71 and name  HE2) (segid "   A" and resid   71 and name  HD1)
    or (segid "   A" and resid   71 and name  HE1) (segid "   A" and resid   71 and name  HD2)
    or (segid "   A" and resid   71 and name  HE1) (segid "   A" and resid   71 and name  HD1)
assign (segid "   A" and resid   43 and name  HE2) (segid "   A" and resid   43 and name  HD1) 2.302 0.663 0.663 weight 1.000 ! spec=S064_8, no=472, id=463, vol=1.663251e+07
    or (segid "   A" and resid   43 and name  HE2) (segid "   A" and resid   43 and name  HD2)
    or (segid "   A" and resid   43 and name  HE1) (segid "   A" and resid   43 and name  HD1)
    or (segid "   A" and resid   43 and name  HE1) (segid "   A" and resid   43 and name  HD2)
assign (segid "   A" and resid   68 and name  HD1) (segid "   A" and resid   68 and name   HA) 3.041 1.156 1.156 weight 1.000 ! spec=S064_8, no=475, id=466, vol=3.130090e+06
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   68 and name   HA)
assign (segid "   A" and resid   43 and name  HD1) (segid "   A" and resid   43 and name   HA) 3.065 1.174 1.174 weight 1.000 ! spec=S064_8, no=477, id=468, vol=2.986632e+06
    or (segid "   A" and resid   43 and name  HD2) (segid "   A" and resid   43 and name   HA)
assign (segid "   A" and resid   71 and name  HD2) (segid "   A" and resid   71 and name   HA) 3.211 1.289 1.289 weight 1.000 ! spec=S064_8, no=479, id=470, vol=2.258345e+06
    or (segid "   A" and resid   71 and name  HD1) (segid "   A" and resid   71 and name   HA)
assign (segid "   A" and resid   68 and name  HD1) (segid "   A" and resid   68 and name  HB2) 2.858 1.021 1.021 weight 1.000 ! spec=S064_8, no=480, id=471, vol=4.543563e+06
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   68 and name  HB2)
assign (segid "   A" and resid   68 and name  HD1) (segid "   A" and resid   68 and name  HB1) 2.715 0.921 0.921 weight 1.000 ! spec=S064_8, no=481, id=472, vol=6.182624e+06
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   68 and name  HB1)
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name  HB2) 3.076 1.183 1.183 weight 1.000 ! spec=S064_8, no=482, id=473, vol=2.921115e+06
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name  HB1) 3.013 1.135 1.135 weight 1.000 ! spec=S064_8, no=483, id=474, vol=3.308594e+06
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name   HA) 3.201 1.281 1.281 weight 1.000 ! spec=S064_8, no=484, id=475, vol=2.301485e+06
assign (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   68 and name   HA) 3.242 1.313 1.313 weight 1.000 ! spec=S064_8, no=485, id=476, vol=2.134588e+06
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   68 and name   HA) 3.273 1.339 1.339 weight 1.000 ! spec=S064_8, no=486, id=477, vol=2.013050e+06
assign (segid "   A" and resid   71 and name  HD2) (segid "   A" and resid   71 and name  HB1) 2.751 0.946 0.946 weight 1.000 ! spec=S064_8, no=491, id=482, vol=5.707750e+06
    or (segid "   A" and resid   71 and name  HD1) (segid "   A" and resid   71 and name  HB1)
assign (segid "   A" and resid   71 and name  HD2) (segid "   A" and resid   71 and name  HB2) 2.899 1.051 1.051 weight 1.000 ! spec=S064_8, no=492, id=483, vol=4.169700e+06
    or (segid "   A" and resid   71 and name  HD1) (segid "   A" and resid   71 and name  HB2)
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   71 and name   HA) 2.833 1.004 1.004 weight 1.000 ! spec=S064_8, no=493, id=484, vol=4.786063e+06
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   71 and name  HB2) 3.198 1.278 1.278 weight 1.000 ! spec=S064_8, no=494, id=485, vol=2.315843e+06
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   71 and name  HB1) 2.976 1.107 1.107 weight 1.000 ! spec=S064_8, no=495, id=486, vol=3.561747e+06
assign (segid "   A" and resid   71 and name  HB2) (segid "   A" and resid   71 and name   HA) 3.209 1.287 1.287 weight 1.000 ! spec=S064_8, no=496, id=487, vol=2.269719e+06
assign (segid "   A" and resid   71 and name  HB1) (segid "   A" and resid   71 and name   HA) 3.276 1.342 1.342 weight 1.000 ! spec=S064_8, no=497, id=488, vol=2.003341e+06
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   71 and name  HD2) 3.760 1.767 1.767 weight 1.000 ! spec=S064_8, no=502, id=493, vol=8.767910e+05
    or (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   71 and name  HD1)
assign (segid "   A" and resid   43 and name  HD1) (segid "   A" and resid   43 and name  HB2) 2.836 1.006 1.006 weight 1.000 ! spec=S064_8, no=503, id=494, vol=4.756265e+06
    or (segid "   A" and resid   43 and name  HD2) (segid "   A" and resid   43 and name  HB2)
assign (segid "   A" and resid   43 and name  HD1) (segid "   A" and resid   43 and name  HB1) 2.635 0.868 0.868 weight 1.000 ! spec=S064_8, no=504, id=495, vol=7.395249e+06
    or (segid "   A" and resid   43 and name  HD2) (segid "   A" and resid   43 and name  HB1)
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   43 and name  HB1) 3.126 1.222 1.222 weight 1.000 ! spec=S064_8, no=505, id=496, vol=2.652502e+06
assign (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   43 and name   HA) 3.025 1.144 1.144 weight 1.000 ! spec=S064_8, no=506, id=497, vol=3.234014e+06
assign (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   43 and name   HA) 2.746 0.943 0.943 weight 1.000 ! spec=S064_8, no=507, id=498, vol=5.770542e+06
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   43 and name  HD1) 3.355 1.407 1.407 weight 1.000 ! spec=S064_8, no=511, id=502, vol=1.737781e+06
    or (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   43 and name  HD2)
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name   HA) 2.693 0.907 0.907 weight 1.000 ! spec=S064_8, no=512, id=503, vol=6.490971e+06
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   63 and name   HA) 2.527 0.798 0.798 weight 1.000 ! spec=S064_8, no=513, id=504, vol=9.515877e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name   HA) 2.561 0.820 0.820 weight 1.000 ! spec=S064_8, no=515, id=506, vol=8.787569e+06
assign (segid "   A" and resid   40 and name  HG2) (segid "   A" and resid   40 and name  HB2) 2.854 1.018 1.018 weight 1.000 ! spec=S064_8, no=516, id=507, vol=4.580748e+06
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name   HA) 2.467 0.761 0.761 weight 1.000 ! spec=S064_8, no=517, id=508, vol=1.097583e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB1) 2.755 0.949 0.949 weight 1.000 ! spec=S064_8, no=518, id=509, vol=5.666438e+06
assign (segid "   A" and resid   34 and name HD21) (segid "   A" and resid   34 and name  HB2) 3.044 1.159 1.159 weight 1.000 ! spec=S064_8, no=519, id=510, vol=3.110862e+06
assign (segid "   A" and resid   34 and name HD22) (segid "   A" and resid   34 and name  HB2) 3.353 1.405 1.405 weight 1.000 ! spec=S064_8, no=520, id=511, vol=1.744181e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name   HA) 3.275 1.341 1.341 weight 1.000 ! spec=S064_8, no=521, id=512, vol=2.005707e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB2) 2.926 1.070 1.070 weight 1.000 ! spec=S064_8, no=522, id=513, vol=3.945234e+06
assign (segid "   A" and resid   38 and name HD22) (segid "   A" and resid   38 and name  HB2) 3.339 1.394 1.394 weight 1.000 ! spec=S064_8, no=523, id=514, vol=1.786778e+06
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name  HB2) 3.039 1.155 1.155 weight 1.000 ! spec=S064_8, no=524, id=515, vol=3.142164e+06
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name   HA) 2.376 0.706 0.706 weight 1.000 ! spec=S064_8, no=525, id=516, vol=1.377257e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name   HA) 2.716 0.922 0.922 weight 1.000 ! spec=S064_8, no=526, id=517, vol=6.174698e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name   HA) 3.204 1.283 1.283 weight 1.000 ! spec=S064_8, no=527, id=518, vol=2.289370e+06
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HB2) 2.823 0.996 0.996 weight 1.000 ! spec=S064_8, no=529, id=520, vol=4.895494e+06
assign (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   21 and name   HA) 2.914 1.062 1.062 weight 1.000 ! spec=S064_8, no=530, id=521, vol=4.044123e+06
assign (segid "   A" and resid   45 and name  HG2) (segid "   A" and resid   45 and name  HB2) 2.219 0.616 0.616 weight 1.000 ! spec=S064_8, no=534, id=525, vol=2.073240e+07
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HG2) 2.707 0.916 0.916 weight 1.000 ! spec=S064_8, no=535, id=526, vol=6.300400e+06
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HB2) 2.627 0.863 0.863 weight 1.000 ! spec=S064_8, no=536, id=527, vol=7.536222e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name   HA) 2.826 0.999 0.999 weight 1.000 ! spec=S064_8, no=537, id=528, vol=4.857824e+06
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB2) 2.946 1.085 1.085 weight 1.000 ! spec=S064_8, no=539, id=529, vol=3.788434e+06
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   55 and name   HN) 2.929 1.072 1.072 weight 1.000 ! spec=S064_8, no=543, id=532, vol=3.925388e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   54 and name   HA) 3.642 1.658 1.658 weight 1.000 ! spec=S064_8, no=544, id=533, vol=1.060407e+06
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid    7 and name   HA) 3.972 1.972 1.972 weight 1.000 ! spec=S064_8, no=545, id=534, vol=6.303660e+05
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   58 and name  HB2) 3.801 1.806 1.806 weight 1.000 ! spec=S064_8, no=546, id=535, vol=8.211360e+05
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   58 and name  HB1) 3.753 1.760 1.760 weight 1.000 ! spec=S064_8, no=547, id=536, vol=8.865270e+05
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   14 and name HG23) 3.961 1.961 1.961 weight 1.000 ! spec=S064_8, no=549, id=537, vol=6.412860e+05
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name HG22) 3.320 1.378 1.378 weight 1.000 ! spec=S064_8, no=550, id=538, vol=1.847769e+06
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name HG11) 3.846 1.849 1.849 weight 1.000 ! spec=S064_8, no=551, id=539, vol=7.648080e+05
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name HG12) 3.640 1.656 1.656 weight 1.000 ! spec=S064_8, no=552, id=540, vol=1.065415e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    9 and name   HN) 3.434 1.474 1.474 weight 1.000 ! spec=S064_8, no=554, id=542, vol=1.509959e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    8 and name   HN) 4.121 2.123 2.123 weight 1.000 ! spec=S064_8, no=555, id=543, vol=5.054860e+05
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   53 and name   HN) 3.920 1.921 1.921 weight 1.000 ! spec=S064_8, no=557, id=545, vol=6.820530e+05
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HD2) 4.009 2.009 2.009 weight 1.000 ! spec=S064_8, no=558, id=546, vol=5.969350e+05
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HG1) 3.796 1.802 1.802 weight 1.000 ! spec=S064_8, no=559, id=547, vol=8.272020e+05
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   53 and name HG23) 3.846 1.849 1.849 weight 1.000 ! spec=S064_8, no=560, id=548, vol=7.653460e+05
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   53 and name HG21)
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   53 and name HG22)
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    7 and name   HA) 3.766 1.773 1.773 weight 1.000 ! spec=S064_8, no=562, id=550, vol=8.680340e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name   HA) 3.686 1.699 1.699 weight 1.000 ! spec=S064_8, no=563, id=551, vol=9.871220e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HB1) 3.874 1.876 1.876 weight 1.000 ! spec=S064_8, no=564, id=552, vol=7.324030e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HG1) 3.923 1.924 1.924 weight 1.000 ! spec=S064_8, no=565, id=553, vol=6.795290e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   14 and name   HN) 3.964 1.964 1.964 weight 1.000 ! spec=S064_8, no=566, id=554, vol=6.381340e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   10 and name   HN) 4.034 2.034 2.034 weight 1.000 ! spec=S064_8, no=567, id=555, vol=5.745140e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HD2) 3.923 1.924 1.924 weight 1.000 ! spec=S064_8, no=569, id=557, vol=6.796960e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HD1)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name   HA) 2.834 1.004 1.004 weight 1.000 ! spec=S064_8, no=570, id=558, vol=4.782421e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   13 and name   HA) 3.692 1.703 1.703 weight 1.000 ! spec=S064_8, no=571, id=559, vol=9.785390e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HB1) 3.934 1.934 1.934 weight 1.000 ! spec=S064_8, no=572, id=560, vol=6.685280e+05
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   14 and name HG23) 3.319 1.377 1.377 weight 1.000 ! spec=S064_8, no=573, id=561, vol=1.853024e+06
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   12 and name HG21) 3.502 1.533 1.533 weight 1.000 ! spec=S064_8, no=574, id=562, vol=1.343699e+06
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   12 and name HG22)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   12 and name HG11) 4.012 2.012 2.012 weight 1.000 ! spec=S064_8, no=575, id=563, vol=5.941410e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   14 and name HG11) 3.992 1.992 1.992 weight 1.000 ! spec=S064_8, no=576, id=564, vol=6.119030e+05
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   59 and name   HN) 3.160 1.248 1.248 weight 1.000 ! spec=S064_8, no=578, id=566, vol=2.486406e+06
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   56 and name   HN) 3.527 1.555 1.555 weight 1.000 ! spec=S064_8, no=579, id=567, vol=1.285873e+06
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name   HA) 3.698 1.709 1.709 weight 1.000 ! spec=S064_8, no=581, id=569, vol=9.690700e+05
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name  HB2) 3.267 1.334 1.334 weight 1.000 ! spec=S064_8, no=582, id=570, vol=2.038163e+06
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name  HB1) 3.323 1.380 1.380 weight 1.000 ! spec=S064_8, no=583, id=571, vol=1.839695e+06
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   59 and name  HB2) 3.891 1.893 1.893 weight 1.000 ! spec=S064_8, no=584, id=572, vol=7.135580e+05
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   54 and name HG22) 3.914 1.915 1.915 weight 1.000 ! spec=S064_8, no=585, id=573, vol=6.886890e+05
    or (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name   HA) 2.783 0.968 0.968 weight 1.000 ! spec=S064_8, no=586, id=574, vol=5.325204e+06
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name   HA) 3.041 1.156 1.156 weight 1.000 ! spec=S064_8, no=587, id=575, vol=3.129904e+06
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid    3 and name   HA) 3.911 1.912 1.912 weight 1.000 ! spec=S064_8, no=588, id=576, vol=6.917580e+05
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   59 and name   HN) 3.702 1.713 1.713 weight 1.000 ! spec=S064_8, no=590, id=578, vol=9.615860e+05
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   52 and name   HN) 3.658 1.672 1.672 weight 1.000 ! spec=S064_8, no=591, id=579, vol=1.034527e+06
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name  HB2) 3.028 1.146 1.146 weight 1.000 ! spec=S064_8, no=592, id=580, vol=3.214939e+06
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name HG21) 3.164 1.252 1.252 weight 1.000 ! spec=S064_8, no=593, id=581, vol=2.466829e+06
    or (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name HG22)
    or (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name HG23)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name   HA) 2.857 1.020 1.020 weight 1.000 ! spec=S064_8, no=595, id=583, vol=4.552345e+06
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   14 and name HG23) 3.849 1.852 1.852 weight 1.000 ! spec=S064_8, no=598, id=585, vol=7.617090e+05
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   51 and name   HB) 3.828 1.832 1.832 weight 1.000 ! spec=S064_8, no=599, id=586, vol=7.866170e+05
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name  HB2) 3.887 1.888 1.888 weight 1.000 ! spec=S064_8, no=600, id=587, vol=7.182030e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name HD21) 3.488 1.521 1.521 weight 1.000 ! spec=S064_8, no=601, id=588, vol=1.375372e+06
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name HD23)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name HD22)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name  HB1) 3.735 1.744 1.744 weight 1.000 ! spec=S064_8, no=602, id=589, vol=9.124730e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name   HG) 4.011 2.011 2.011 weight 1.000 ! spec=S064_8, no=603, id=590, vol=5.951980e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name  HB2) 3.963 1.964 1.964 weight 1.000 ! spec=S064_8, no=604, id=591, vol=6.389480e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name   HB) 4.013 2.013 2.013 weight 1.000 ! spec=S064_8, no=605, id=592, vol=5.925940e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name   HA) 3.911 1.912 1.912 weight 1.000 ! spec=S064_8, no=606, id=593, vol=6.915370e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid    5 and name   HA) 3.986 1.986 1.986 weight 1.000 ! spec=S064_8, no=607, id=594, vol=6.176060e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name   HA) 2.793 0.975 0.975 weight 1.000 ! spec=S064_8, no=608, id=595, vol=5.215992e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name   HA) 3.817 1.821 1.821 weight 1.000 ! spec=S064_8, no=609, id=596, vol=8.005630e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name   HA) 2.797 0.978 0.978 weight 1.000 ! spec=S064_8, no=610, id=597, vol=5.173018e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name   HN) 3.187 1.269 1.269 weight 1.000 ! spec=S064_8, no=611, id=598, vol=2.364603e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name   HA) 2.708 0.917 0.917 weight 1.000 ! spec=S064_8, no=612, id=599, vol=6.273637e+06
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name   HA) 3.469 1.504 1.504 weight 1.000 ! spec=S064_8, no=613, id=600, vol=1.421572e+06
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name  HB2) 3.173 1.259 1.259 weight 1.000 ! spec=S064_8, no=614, id=601, vol=2.424744e+06
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   44 and name  HB2) 3.579 1.601 1.601 weight 1.000 ! spec=S064_8, no=615, id=602, vol=1.178692e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name  HB1) 2.997 1.123 1.123 weight 1.000 ! spec=S064_8, no=616, id=603, vol=3.418155e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name HG21) 3.844 1.847 1.847 weight 1.000 ! spec=S064_8, no=617, id=604, vol=7.681010e+05
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name HG23)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name HG22)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   35 and name  HG2) 3.979 1.979 1.979 weight 1.000 ! spec=S064_8, no=618, id=605, vol=6.240050e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name   HN) 3.511 1.541 1.541 weight 1.000 ! spec=S064_8, no=620, id=607, vol=1.322087e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid    6 and name   HA) 3.324 1.381 1.381 weight 1.000 ! spec=S064_8, no=621, id=608, vol=1.834730e+06
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name   HA) 2.691 0.905 0.905 weight 1.000 ! spec=S064_8, no=622, id=609, vol=6.518902e+06
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name   HB) 3.669 1.683 1.683 weight 1.000 ! spec=S064_8, no=623, id=610, vol=1.014438e+06
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   53 and name   HB) 3.615 1.633 1.633 weight 1.000 ! spec=S064_8, no=624, id=611, vol=1.110415e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name   HA) 2.867 1.028 1.028 weight 1.000 ! spec=S064_8, no=625, id=612, vol=4.458859e+06
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name   HB) 3.832 1.836 1.836 weight 1.000 ! spec=S064_8, no=626, id=613, vol=7.819070e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name  HB1) 3.874 1.876 1.876 weight 1.000 ! spec=S064_8, no=627, id=614, vol=7.326630e+05
assign (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   54 and name   HN) 2.871 1.030 1.030 weight 1.000 ! spec=S064_8, no=628, id=615, vol=4.426750e+06
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   54 and name   HN)
    or (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   54 and name   HN)
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   10 and name   HN) 3.090 1.193 1.193 weight 1.000 ! spec=S064_8, no=629, id=616, vol=2.846907e+06
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name   HN) 3.015 1.136 1.136 weight 1.000 ! spec=S064_8, no=632, id=619, vol=3.295226e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   48 and name   HA) 2.796 0.977 0.977 weight 1.000 ! spec=S064_8, no=633, id=620, vol=5.185283e+06
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name   HA) 3.181 1.265 1.265 weight 1.000 ! spec=S064_8, no=634, id=621, vol=2.392004e+06
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name   HA) 2.691 0.905 0.905 weight 1.000 ! spec=S064_8, no=635, id=622, vol=6.516822e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid    3 and name   HA) 3.266 1.334 1.334 weight 1.000 ! spec=S064_8, no=636, id=623, vol=2.039534e+06
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name  HA1) 3.612 1.631 1.631 weight 1.000 ! spec=S064_8, no=637, id=624, vol=1.115577e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   48 and name  HB1) 3.419 1.461 1.461 weight 1.000 ! spec=S064_8, no=640, id=626, vol=1.551229e+06
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   36 and name  HB1) 2.799 0.979 0.979 weight 1.000 ! spec=S064_8, no=641, id=627, vol=5.147661e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   54 and name HG11) 3.952 1.952 1.952 weight 1.000 ! spec=S064_8, no=644, id=630, vol=6.504850e+05
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   54 and name HG22) 3.412 1.455 1.455 weight 1.000 ! spec=S064_8, no=646, id=631, vol=1.570857e+06
    or (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name HG21) 3.479 1.513 1.513 weight 1.000 ! spec=S064_8, no=647, id=632, vol=1.395674e+06
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name HG22)
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name HG23)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   49 and name HG21) 3.131 1.225 1.225 weight 1.000 ! spec=S064_8, no=648, id=633, vol=2.628573e+06
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   49 and name HG22)
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   49 and name HG23)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name HD21) 3.310 1.369 1.369 weight 1.000 ! spec=S064_8, no=649, id=634, vol=1.884548e+06
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name HD22)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name HD23)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HG11) 3.080 1.186 1.186 weight 1.000 ! spec=S064_8, no=650, id=635, vol=2.900591e+06
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HG13)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name HG12)
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name  HB2) 2.951 1.089 1.089 weight 1.000 ! spec=S064_8, no=651, id=636, vol=3.746633e+06
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name  HB3)
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name  HB1)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name HD21) 3.597 1.617 1.617 weight 1.000 ! spec=S064_8, no=652, id=637, vol=1.143548e+06
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name HD23)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name HD22)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name HD11) 3.570 1.593 1.593 weight 1.000 ! spec=S064_8, no=653, id=638, vol=1.197048e+06
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name HD13)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   14 and name HG23) 3.784 1.790 1.790 weight 1.000 ! spec=S064_8, no=655, id=639, vol=8.436600e+05
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HG) 2.810 0.987 0.987 weight 1.000 ! spec=S064_8, no=656, id=640, vol=5.029421e+06
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB2) 3.051 1.164 1.164 weight 1.000 ! spec=S064_8, no=657, id=641, vol=3.067797e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB1) 3.550 1.575 1.575 weight 1.000 ! spec=S064_8, no=658, id=642, vol=1.238195e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name   HG) 3.618 1.637 1.637 weight 1.000 ! spec=S064_8, no=659, id=643, vol=1.103598e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB2) 3.374 1.423 1.423 weight 1.000 ! spec=S064_8, no=660, id=644, vol=1.678874e+06
assign (segid "   A" and resid   37 and name  HG1) (segid "   A" and resid   37 and name   HN) 3.122 1.218 1.218 weight 1.000 ! spec=S064_8, no=662, id=645, vol=2.674009e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name  HB1) 2.983 1.112 1.112 weight 1.000 ! spec=S064_8, no=663, id=646, vol=3.514806e+06
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   61 and name  HB1) 3.887 1.889 1.889 weight 1.000 ! spec=S064_8, no=664, id=647, vol=7.177420e+05
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   62 and name  HB1) 3.330 1.386 1.386 weight 1.000 ! spec=S064_8, no=665, id=648, vol=1.816569e+06
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   70 and name  HB2) 3.359 1.411 1.411 weight 1.000 ! spec=S064_8, no=666, id=649, vol=1.722846e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HB1) 2.908 1.057 1.057 weight 1.000 ! spec=S064_8, no=667, id=650, vol=4.092896e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HB2) 3.292 1.354 1.354 weight 1.000 ! spec=S064_8, no=668, id=651, vol=1.947253e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HB1) 3.120 1.216 1.216 weight 1.000 ! spec=S064_8, no=669, id=652, vol=2.687394e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HB2) 3.242 1.314 1.314 weight 1.000 ! spec=S064_8, no=670, id=653, vol=2.132344e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name  HB2) 2.826 0.998 0.998 weight 1.000 ! spec=S064_8, no=671, id=654, vol=4.867232e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   60 and name  HB2) 3.383 1.431 1.431 weight 1.000 ! spec=S064_8, no=673, id=656, vol=1.651312e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name  HG2) 3.558 1.582 1.582 weight 1.000 ! spec=S064_8, no=674, id=657, vol=1.220676e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name  HG1) 3.594 1.614 1.614 weight 1.000 ! spec=S064_8, no=676, id=659, vol=1.150053e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HG1) 3.582 1.603 1.603 weight 1.000 ! spec=S064_8, no=677, id=660, vol=1.173387e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid    7 and name  HB1) 3.122 1.219 1.219 weight 1.000 ! spec=S064_8, no=678, id=661, vol=2.672099e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name  HB2) 3.033 1.150 1.150 weight 1.000 ! spec=S064_8, no=679, id=662, vol=3.182246e+06
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name  HB1) 3.319 1.377 1.377 weight 1.000 ! spec=S064_8, no=681, id=664, vol=1.851617e+06
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name  HB2) 3.444 1.482 1.482 weight 1.000 ! spec=S064_8, no=682, id=665, vol=1.485186e+06
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HB2) 2.960 1.095 1.095 weight 1.000 ! spec=S064_8, no=683, id=666, vol=3.683019e+06
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   39 and name  HB2) 3.115 1.213 1.213 weight 1.000 ! spec=S064_8, no=684, id=667, vol=2.712603e+06
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   63 and name   HN) 2.532 0.801 0.801 weight 1.000 ! spec=S064_8, no=685, id=668, vol=9.396440e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   63 and name  HB2) 3.651 1.666 1.666 weight 1.000 ! spec=S064_8, no=686, id=669, vol=1.045734e+06
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name  HB1) 3.713 1.723 1.723 weight 1.000 ! spec=S064_8, no=688, id=670, vol=9.450380e+05
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   58 and name  HB2) 3.476 1.511 1.511 weight 1.000 ! spec=S064_8, no=689, id=671, vol=1.402876e+06
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   43 and name  HB2) 3.395 1.440 1.440 weight 1.000 ! spec=S064_8, no=690, id=672, vol=1.618573e+06
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   68 and name  HB1) 3.405 1.449 1.449 weight 1.000 ! spec=S064_8, no=691, id=673, vol=1.589248e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid    5 and name  HB2) 3.821 1.825 1.825 weight 1.000 ! spec=S064_8, no=692, id=674, vol=7.963180e+05
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid    7 and name  HB2) 3.387 1.434 1.434 weight 1.000 ! spec=S064_8, no=693, id=675, vol=1.641854e+06
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    7 and name  HB2) 3.380 1.428 1.428 weight 1.000 ! spec=S064_8, no=694, id=676, vol=1.660304e+06
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   55 and name  HB2) 4.007 2.007 2.007 weight 1.000 ! spec=S064_8, no=695, id=677, vol=5.984300e+05
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   47 and name  HA1) 3.217 1.293 1.293 weight 1.000 ! spec=S064_8, no=697, id=678, vol=2.235432e+06
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HA1) 3.163 1.251 1.251 weight 1.000 ! spec=S064_8, no=698, id=679, vol=2.472709e+06
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HA2) 3.235 1.308 1.308 weight 1.000 ! spec=S064_8, no=699, id=680, vol=2.162440e+06
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name   HA) 3.449 1.487 1.487 weight 1.000 ! spec=S064_8, no=700, id=681, vol=1.470403e+06
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HA2) 2.703 0.913 0.913 weight 1.000 ! spec=S064_8, no=701, id=682, vol=6.346008e+06
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   59 and name   HA) 2.916 1.063 1.063 weight 1.000 ! spec=S064_8, no=703, id=683, vol=4.030637e+06
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   56 and name   HA) 3.527 1.555 1.555 weight 1.000 ! spec=S064_8, no=704, id=684, vol=1.286149e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   60 and name   HA) 3.621 1.639 1.639 weight 1.000 ! spec=S064_8, no=705, id=685, vol=1.098802e+06
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   61 and name   HA) 3.491 1.523 1.523 weight 1.000 ! spec=S064_8, no=706, id=686, vol=1.368843e+06
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   58 and name   HA) 3.501 1.532 1.532 weight 1.000 ! spec=S064_8, no=707, id=687, vol=1.344171e+06
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   47 and name  HA2) 3.206 1.285 1.285 weight 1.000 ! spec=S064_8, no=708, id=688, vol=2.279969e+06
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name   HA) 2.951 1.089 1.089 weight 1.000 ! spec=S064_8, no=709, id=689, vol=3.750616e+06
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HA) 2.530 0.800 0.800 weight 1.000 ! spec=S064_8, no=711, id=690, vol=9.448681e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HA) 2.358 0.695 0.695 weight 1.000 ! spec=S064_8, no=712, id=691, vol=1.441365e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name   HA) 2.958 1.093 1.093 weight 1.000 ! spec=S064_8, no=714, id=692, vol=3.700389e+06
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name   HA) 2.961 1.096 1.096 weight 1.000 ! spec=S064_8, no=715, id=693, vol=3.677222e+06
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name   HA) 2.715 0.922 0.922 weight 1.000 ! spec=S064_8, no=716, id=694, vol=6.180326e+06
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   68 and name   HA) 2.626 0.862 0.862 weight 1.000 ! spec=S064_8, no=717, id=695, vol=7.555073e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name   HA) 2.842 1.009 1.009 weight 1.000 ! spec=S064_8, no=718, id=696, vol=4.704521e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name   HA) 2.948 1.086 1.086 weight 1.000 ! spec=S064_8, no=719, id=697, vol=3.775923e+06
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name   HA) 2.730 0.931 0.931 weight 1.000 ! spec=S064_8, no=720, id=698, vol=5.987164e+06
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name   HA) 2.771 0.960 0.960 weight 1.000 ! spec=S064_8, no=721, id=699, vol=5.470866e+06
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   72 and name   HA) 2.832 1.002 1.002 weight 1.000 ! spec=S064_8, no=725, id=701, vol=4.801234e+06
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name   HA) 3.141 1.234 1.234 weight 1.000 ! spec=S064_8, no=726, id=702, vol=2.576688e+06
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name   HA) 3.259 1.328 1.328 weight 1.000 ! spec=S064_8, no=727, id=703, vol=2.065413e+06
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   57 and name   HA) 3.616 1.634 1.634 weight 1.000 ! spec=S064_8, no=728, id=704, vol=1.108423e+06
assign (segid "   A" and resid   65 and name HD21) (segid "   A" and resid   65 and name   HA) 3.848 1.851 1.851 weight 1.000 ! spec=S064_8, no=729, id=705, vol=7.627800e+05
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name   HN) 2.696 0.908 0.908 weight 1.000 ! spec=S064_8, no=732, id=708, vol=6.454347e+06
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   61 and name   HN) 3.018 1.139 1.139 weight 1.000 ! spec=S064_8, no=733, id=709, vol=3.277345e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name   HN) 2.955 1.092 1.092 weight 1.000 ! spec=S064_8, no=734, id=710, vol=3.716572e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   60 and name   HN) 3.078 1.184 1.184 weight 1.000 ! spec=S064_8, no=737, id=713, vol=2.914983e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name   HN) 3.241 1.313 1.313 weight 1.000 ! spec=S064_8, no=739, id=715, vol=2.135871e+06
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name   HN) 3.041 1.156 1.156 weight 1.000 ! spec=S064_8, no=740, id=716, vol=3.128812e+06
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   57 and name   HN) 3.141 1.233 1.233 weight 1.000 ! spec=S064_8, no=741, id=717, vol=2.581297e+06
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   12 and name   HN) 3.755 1.763 1.763 weight 1.000 ! spec=S064_8, no=742, id=718, vol=8.831690e+05
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name   HN) 3.821 1.825 1.825 weight 1.000 ! spec=S064_8, no=743, id=719, vol=7.956640e+05
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HD2) 3.127 1.223 1.223 weight 1.000 ! spec=S064_8, no=746, id=722, vol=2.646887e+06
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HD1)
assign (segid "   A" and resid   38 and name HD21) (segid "   A" and resid   38 and name  HB2) 3.048 1.161 1.161 weight 1.000 ! spec=S064_8, no=748, id=724, vol=3.090089e+06
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   63 and name   HN) 3.597 1.617 1.617 weight 1.000 ! spec=S064_8, no=751, id=727, vol=1.143275e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   61 and name   HN) 3.884 1.886 1.886 weight 1.000 ! spec=S064_8, no=752, id=728, vol=7.209280e+05
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name  HB2) 2.988 1.116 1.116 weight 1.000 ! spec=S064_8, no=754, id=730, vol=3.483396e+06
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name  HG1) 3.992 1.992 1.992 weight 1.000 ! spec=S064_8, no=755, id=731, vol=6.123740e+05
assign (segid "   A" and resid   30 and name HE21) (segid "   A" and resid   30 and name  HG2) 3.052 1.165 1.165 weight 1.000 ! spec=S064_8, no=756, id=732, vol=3.062903e+06
assign (segid "   A" and resid   34 and name HD21) (segid "   A" and resid   34 and name HD22) 2.049 0.525 0.525 weight 1.000 ! spec=S064_8, no=757, id=733, vol=3.342119e+07
assign (segid "   A" and resid   38 and name HD21) (segid "   A" and resid   38 and name HD22) 1.999 0.500 0.500 weight 1.000 ! spec=S064_8, no=758, id=734, vol=3.877273e+07
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   29 and name  HD2) 4.275 2.284 2.284 weight 1.000 ! spec=S064_8, no=759, id=735, vol=4.057310e+05
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   29 and name  HD1)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name  HD2) 4.036 2.036 2.036 weight 1.000 ! spec=S064_8, no=760, id=736, vol=5.728610e+05
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name  HD1)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name HD22) 4.106 2.107 2.107 weight 1.000 ! spec=S064_8, no=761, id=737, vol=5.170000e+05
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid    6 and name  HD2) 4.023 2.023 2.023 weight 1.000 ! spec=S064_8, no=762, id=738, vol=5.844370e+05
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid    6 and name  HD1)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    5 and name  HD1) 3.923 1.923 1.923 weight 1.000 ! spec=S064_8, no=763, id=739, vol=6.796980e+05
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid    6 and name  HD2) 3.834 1.838 1.838 weight 1.000 ! spec=S064_8, no=764, id=740, vol=7.793730e+05
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid    6 and name  HD1)
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name  HD1) 4.056 2.057 2.057 weight 1.000 ! spec=S064_8, no=765, id=741, vol=5.561580e+05
    or (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name  HD2)
assign (segid "   A" and resid   37 and name   HE) (segid "   A" and resid   37 and name  HB2) 4.012 2.012 2.012 weight 1.000 ! spec=S064_8, no=766, id=742, vol=5.935960e+05
assign (segid "   A" and resid   64 and name   HE) (segid "   A" and resid   64 and name  HG2) 3.886 1.888 1.888 weight 1.000 ! spec=S064_8, no=767, id=743, vol=7.190250e+05
assign (segid "   A" and resid   37 and name   HE) (segid "   A" and resid   37 and name  HG2) 3.650 1.666 1.666 weight 1.000 ! spec=S064_8, no=768, id=744, vol=1.046829e+06
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   32 and name  HB2) 3.675 1.688 1.688 weight 1.000 ! spec=S064_8, no=769, id=745, vol=1.004858e+06
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   32 and name  HB2)
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   54 and name   HB) 3.723 1.732 1.732 weight 1.000 ! spec=S064_8, no=770, id=746, vol=9.302080e+05
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid    8 and name  HB1) 3.286 1.350 1.350 weight 1.000 ! spec=S064_8, no=771, id=747, vol=1.966830e+06
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   32 and name  HB2) 3.942 1.942 1.942 weight 1.000 ! spec=S064_8, no=772, id=748, vol=6.604130e+05
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   32 and name  HB2)
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid    8 and name  HG2) 3.720 1.730 1.730 weight 1.000 ! spec=S064_8, no=773, id=749, vol=9.341180e+05
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name   HG) 3.956 1.956 1.956 weight 1.000 ! spec=S064_8, no=774, id=750, vol=6.462410e+05
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name   HG)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   32 and name  HB1) 4.084 2.085 2.085 weight 1.000 ! spec=S064_8, no=775, id=751, vol=5.337190e+05
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   32 and name  HB1)
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   27 and name  HB1) 3.898 1.899 1.899 weight 1.000 ! spec=S064_8, no=776, id=752, vol=7.059200e+05
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   27 and name  HB1)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name  HB1) 3.999 1.999 1.999 weight 1.000 ! spec=S064_8, no=777, id=753, vol=6.058660e+05
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name  HB1)
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   27 and name HD11) 3.342 1.396 1.396 weight 1.000 ! spec=S064_8, no=778, id=754, vol=1.776251e+06
    or (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   27 and name HD13)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   27 and name HD11)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   27 and name HD13)
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   32 and name HD21) 3.482 1.515 1.515 weight 1.000 ! spec=S064_8, no=779, id=755, vol=1.390248e+06
    or (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   32 and name HD22)
    or (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   32 and name HD23)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   32 and name HD21)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   32 and name HD22)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   32 and name HD23)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name HD11) 3.112 1.210 1.210 weight 1.000 ! spec=S064_8, no=781, id=756, vol=2.727677e+06
    or (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name HD13)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name HD11)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name HD13)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   32 and name HD21) 3.327 1.384 1.384 weight 1.000 ! spec=S064_8, no=782, id=757, vol=1.826623e+06
    or (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   32 and name HD22)
    or (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   32 and name HD23)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   32 and name HD21)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   32 and name HD22)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   32 and name HD23)
assign (segid "   A" and resid   68 and name  HE2) (segid "   A" and resid   68 and name  HB1) 3.668 1.681 1.681 weight 1.000 ! spec=S064_8, no=783, id=758, vol=1.017579e+06
    or (segid "   A" and resid   68 and name  HE1) (segid "   A" and resid   68 and name  HB1)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    3 and name  HB2) 3.027 1.145 1.145 weight 1.000 ! spec=S064_8, no=784, id=759, vol=3.222675e+06
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    3 and name  HB2)
assign (segid "   A" and resid   43 and name  HE2) (segid "   A" and resid   43 and name   HA) 3.855 1.858 1.858 weight 1.000 ! spec=S064_8, no=785, id=760, vol=7.546000e+05
    or (segid "   A" and resid   43 and name  HE1) (segid "   A" and resid   43 and name   HA)
assign (segid "   A" and resid   43 and name  HE2) (segid "   A" and resid   43 and name  HB2) 3.786 1.792 1.792 weight 1.000 ! spec=S064_8, no=786, id=761, vol=8.407770e+05
    or (segid "   A" and resid   43 and name  HE1) (segid "   A" and resid   43 and name  HB2)
assign (segid "   A" and resid   68 and name  HE2) (segid "   A" and resid   69 and name  HB1) 3.924 1.924 1.924 weight 1.000 ! spec=S064_8, no=792, id=762, vol=6.787610e+05
    or (segid "   A" and resid   68 and name  HE1) (segid "   A" and resid   69 and name  HB1)
assign (segid "   A" and resid   68 and name  HD1) (segid "   A" and resid   69 and name  HB1) 3.881 1.883 1.883 weight 1.000 ! spec=S064_8, no=793, id=763, vol=7.248570e+05
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   69 and name  HB1)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name   HA) 3.321 1.379 1.379 weight 1.000 ! spec=S064_8, no=798, id=764, vol=1.845459e+06
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    6 and name   HA)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   53 and name   HB) 3.364 1.415 1.415 weight 1.000 ! spec=S064_8, no=799, id=765, vol=1.709078e+06
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   53 and name   HB)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid   13 and name   HA) 3.240 1.312 1.312 weight 1.000 ! spec=S064_8, no=800, id=766, vol=2.141580e+06
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid   13 and name   HA)
assign (segid "   A" and resid    6 and name  HE2) (segid "   A" and resid    4 and name  HB2) 3.250 1.320 1.320 weight 1.000 ! spec=S064_8, no=801, id=767, vol=2.103317e+06
    or (segid "   A" and resid    6 and name  HE1) (segid "   A" and resid    4 and name  HB2)
assign (segid "   A" and resid    6 and name  HE2) (segid "   A" and resid    4 and name  HB1) 3.293 1.356 1.356 weight 1.000 ! spec=S064_8, no=802, id=768, vol=1.942002e+06
    or (segid "   A" and resid    6 and name  HE1) (segid "   A" and resid    4 and name  HB1)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    4 and name  HB2) 3.232 1.305 1.305 weight 1.000 ! spec=S064_8, no=804, id=770, vol=2.174369e+06
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    4 and name  HB2)
assign (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   50 and name  HB2) 3.363 1.413 1.413 weight 1.000 ! spec=S064_8, no=805, id=771, vol=1.713432e+06
assign (segid "   A" and resid    6 and name  HE2) (segid "   A" and resid   13 and name  HB2) 3.726 1.735 1.735 weight 1.000 ! spec=S064_8, no=806, id=772, vol=9.260590e+05
    or (segid "   A" and resid    6 and name  HE1) (segid "   A" and resid   13 and name  HB2)
assign (segid "   A" and resid    6 and name  HE2) (segid "   A" and resid   13 and name  HB1) 3.265 1.333 1.333 weight 1.000 ! spec=S064_8, no=807, id=773, vol=2.044448e+06
    or (segid "   A" and resid    6 and name  HE1) (segid "   A" and resid   13 and name  HB1)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    3 and name  HB2) 3.252 1.322 1.322 weight 1.000 ! spec=S064_8, no=808, id=774, vol=2.093391e+06
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    3 and name  HB2)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   51 and name   HB) 3.078 1.184 1.184 weight 1.000 ! spec=S064_8, no=809, id=775, vol=2.914714e+06
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   51 and name   HB)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid   13 and name  HB2) 3.547 1.573 1.573 weight 1.000 ! spec=S064_8, no=810, id=776, vol=1.243943e+06
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid   13 and name  HB2)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   51 and name   HB) 3.244 1.316 1.316 weight 1.000 ! spec=S064_8, no=811, id=777, vol=2.124410e+06
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   51 and name   HB)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   53 and name HG23) 2.951 1.089 1.089 weight 1.000 ! spec=S064_8, no=812, id=778, vol=3.750593e+06
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   53 and name HG21)
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   53 and name HG22)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   53 and name HG23)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   53 and name HG21)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   53 and name HG22)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   53 and name HG23) 3.624 1.642 1.642 weight 1.000 ! spec=S064_8, no=813, id=779, vol=1.092706e+06
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   53 and name HG21)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   53 and name HG22)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   53 and name HG23)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   53 and name HG21)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   53 and name HG22)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   51 and name HG12) 2.809 0.986 0.986 weight 1.000 ! spec=S064_8, no=816, id=780, vol=5.041317e+06
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   51 and name HG13)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   51 and name HG11)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   51 and name HG12)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   51 and name HG13)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   51 and name HG11)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    3 and name HD11) 2.992 1.119 1.119 weight 1.000 ! spec=S064_8, no=817, id=781, vol=3.455523e+06
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    3 and name HD13)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    3 and name HD12)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    3 and name HD11)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    3 and name HD13)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    3 and name HD12)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   14 and name HG23) 3.364 1.414 1.414 weight 1.000 ! spec=S064_8, no=818, id=782, vol=1.709360e+06
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    3 and name  HB1) 3.556 1.581 1.581 weight 1.000 ! spec=S064_8, no=822, id=785, vol=1.224371e+06
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    3 and name  HB1)
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid    7 and name   HA) 3.975 1.975 1.975 weight 1.000 ! spec=S064_8, no=826, id=789, vol=6.277410e+05
assign (segid "   A" and resid   66 and name  HD2) (segid "   A" and resid   65 and name   HA) 3.089 1.192 1.192 weight 1.000 ! spec=S064_8, no=828, id=791, vol=2.852477e+06
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   65 and name   HA) 3.080 1.186 1.186 weight 1.000 ! spec=S064_8, no=829, id=792, vol=2.902369e+06
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid    6 and name   HA) 3.844 1.847 1.847 weight 1.000 ! spec=S064_8, no=830, id=793, vol=7.679690e+05
assign (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   63 and name  HB2) 3.732 1.741 1.741 weight 1.000 ! spec=S064_8, no=831, id=794, vol=9.167570e+05
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   52 and name  HB2) 3.612 1.631 1.631 weight 1.000 ! spec=S064_8, no=835, id=798, vol=1.114480e+06
assign (segid "   A" and resid   66 and name  HD2) (segid "   A" and resid   66 and name  HG2) 2.965 1.099 1.099 weight 1.000 ! spec=S064_8, no=845, id=807, vol=3.644144e+06
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name  HG1) 2.998 1.123 1.123 weight 1.000 ! spec=S064_8, no=846, id=808, vol=3.412861e+06
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   59 and name  HB2) 2.860 1.022 1.022 weight 1.000 ! spec=S064_8, no=847, id=809, vol=4.529581e+06
assign (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   61 and name  HB1) 2.846 1.012 1.012 weight 1.000 ! spec=S064_8, no=848, id=810, vol=4.665170e+06
    or (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name HG11) 2.725 0.928 0.928 weight 1.000 ! spec=S064_8, no=849, id=811, vol=6.045717e+06
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   12 and name   HA) 2.840 1.008 1.008 weight 1.000 ! spec=S064_8, no=850, id=812, vol=4.723419e+06
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   12 and name   HA)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   12 and name   HA)
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name   HA) 2.738 0.937 0.937 weight 1.000 ! spec=S064_8, no=851, id=813, vol=5.881712e+06
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name   HA) 2.351 0.691 0.691 weight 1.000 ! spec=S064_8, no=853, id=814, vol=1.465513e+07
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name   HA) 2.843 1.010 1.010 weight 1.000 ! spec=S064_8, no=854, id=815, vol=4.689410e+06
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name   HA) 2.693 0.906 0.906 weight 1.000 ! spec=S064_8, no=856, id=816, vol=6.499844e+06
assign (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   69 and name   HA) 2.941 1.081 1.081 weight 1.000 ! spec=S064_8, no=857, id=817, vol=3.828889e+06
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    4 and name   HA) 3.321 1.378 1.378 weight 1.000 ! spec=S064_8, no=858, id=818, vol=1.847662e+06
assign (segid "   A" and resid   54 and name HG12) (segid "   A" and resid   54 and name HG22) 3.052 1.165 1.165 weight 1.000 ! spec=S064_8, no=873, id=824, vol=3.062459e+06
    or (segid "   A" and resid   54 and name HG12) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   54 and name HG12) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name HD11) 2.555 0.816 0.816 weight 1.000 ! spec=S064_8, no=874, id=825, vol=8.899122e+06
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name HD13)
assign (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name HD21) 2.358 0.695 0.695 weight 1.000 ! spec=S064_8, no=875, id=826, vol=1.441129e+07
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name HD23)
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name HD22)
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid   14 and name HG23) 2.699 0.910 0.910 weight 1.000 ! spec=S064_8, no=877, id=828, vol=6.409177e+06
    or (segid "   A" and resid   53 and name HG23) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   53 and name HG23) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   14 and name HG23) 2.708 0.916 0.916 weight 1.000 ! spec=S064_8, no=878, id=829, vol=6.286991e+06
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   41 and name HD12) 2.673 0.893 0.893 weight 1.000 ! spec=S064_8, no=879, id=830, vol=6.788701e+06
    or (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   41 and name HD11)
assign (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   14 and name HG11) 2.615 0.855 0.855 weight 1.000 ! spec=S064_8, no=880, id=831, vol=7.745382e+06
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HD12) 2.851 1.016 1.016 weight 1.000 ! spec=S064_8, no=882, id=833, vol=4.615326e+06
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HD11)
assign (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   52 and name  HB2) 2.905 1.055 1.055 weight 1.000 ! spec=S064_8, no=883, id=834, vol=4.117545e+06
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   52 and name  HB2)
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   52 and name  HB2)
assign (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   59 and name  HB2) 3.009 1.132 1.132 weight 1.000 ! spec=S064_8, no=887, id=836, vol=3.334269e+06
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   59 and name  HB2)
    or (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   59 and name  HB2)
assign (segid "   A" and resid    8 and name  HG2) (segid "   A" and resid    8 and name  HG1) 2.694 0.907 0.907 weight 1.000 ! spec=S064_8, no=888, id=837, vol=6.481201e+06
assign (segid "   A" and resid   12 and name HG21) (segid "   A" and resid    7 and name  HB2) 3.104 1.204 1.204 weight 1.000 ! spec=S064_8, no=891, id=839, vol=2.769264e+06
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid    7 and name  HB2)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid    7 and name  HB2)
assign (segid "   A" and resid   14 and name HG23) (segid "   A" and resid    7 and name  HB2) 3.094 1.197 1.197 weight 1.000 ! spec=S064_8, no=892, id=840, vol=2.820814e+06
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid    7 and name  HB2)
    or (segid "   A" and resid   14 and name HG22) (segid "   A" and resid    7 and name  HB2)
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   41 and name   HA) 2.940 1.080 1.080 weight 1.000 ! spec=S064_8, no=895, id=841, vol=3.838883e+06
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   41 and name   HA)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   41 and name   HA)
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid   55 and name   HA) 3.340 1.394 1.394 weight 1.000 ! spec=S064_8, no=897, id=842, vol=1.784442e+06
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid   55 and name   HA)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid   55 and name   HA)
assign (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name   HA) 3.288 1.351 1.351 weight 1.000 ! spec=S064_8, no=898, id=843, vol=1.959887e+06
assign (segid "   A" and resid   44 and name  HG2) (segid "   A" and resid   44 and name   HA) 3.154 1.244 1.244 weight 1.000 ! spec=S064_8, no=899, id=844, vol=2.513542e+06
assign (segid "   A" and resid   52 and name  HB1) (segid "   A" and resid   52 and name HD11) 2.939 1.080 1.080 weight 1.000 ! spec=S064_8, no=900, id=845, vol=3.844096e+06
    or (segid "   A" and resid   52 and name  HB1) (segid "   A" and resid   52 and name HD13)
    or (segid "   A" and resid   52 and name  HB1) (segid "   A" and resid   52 and name HD12)
assign (segid "   A" and resid   51 and name HG23) (segid "   A" and resid    3 and name  HB1) 3.149 1.239 1.239 weight 1.000 ! spec=S064_8, no=903, id=848, vol=2.541943e+06
    or (segid "   A" and resid   51 and name HG22) (segid "   A" and resid    3 and name  HB1)
    or (segid "   A" and resid   51 and name HG21) (segid "   A" and resid    3 and name  HB1)
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name   HB) 3.893 1.895 1.895 weight 1.000 ! spec=S064_8, no=904, id=849, vol=7.112090e+05
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   14 and name HG11) 4.095 2.096 2.096 weight 1.000 ! spec=S064_8, no=905, id=850, vol=5.250770e+05
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   52 and name   HA) 4.247 2.254 2.254 weight 1.000 ! spec=S064_8, no=906, id=851, vol=4.222170e+05
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name  HB1) 4.078 2.079 2.079 weight 1.000 ! spec=S064_8, no=907, id=852, vol=5.384780e+05
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   52 and name HD21) 4.048 2.048 2.048 weight 1.000 ! spec=S064_8, no=908, id=853, vol=5.628270e+05
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   52 and name HD23)
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   52 and name HD22)
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   55 and name  HB2) 4.113 2.115 2.115 weight 1.000 ! spec=S064_8, no=911, id=855, vol=5.113980e+05
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name   HN) 4.203 2.208 2.208 weight 1.000 ! spec=S064_8, no=912, id=856, vol=4.490590e+05
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   14 and name HG11) 3.467 1.503 1.503 weight 1.000 ! spec=S064_8, no=913, id=857, vol=1.425825e+06
    or (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name   HN) 3.866 1.869 1.869 weight 1.000 ! spec=S064_8, no=914, id=858, vol=7.413630e+05
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    7 and name   HN) 4.142 2.145 2.145 weight 1.000 ! spec=S064_8, no=915, id=859, vol=4.904320e+05
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   14 and name HG23) 4.006 2.006 2.006 weight 1.000 ! spec=S064_8, no=916, id=860, vol=5.996410e+05
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   53 and name HG23) 3.814 1.819 1.819 weight 1.000 ! spec=S064_8, no=918, id=861, vol=8.040160e+05
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   53 and name HG21)
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   53 and name HG22)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    6 and name   HA) 3.756 1.763 1.763 weight 1.000 ! spec=S064_8, no=920, id=863, vol=8.820860e+05
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   44 and name  HB1) 3.627 1.644 1.644 weight 1.000 ! spec=S064_8, no=922, id=865, vol=1.088512e+06
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name HG11) 3.984 1.984 1.984 weight 1.000 ! spec=S064_8, no=926, id=867, vol=6.190870e+05
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid    7 and name   HA) 3.976 1.977 1.977 weight 1.000 ! spec=S064_8, no=928, id=869, vol=6.264330e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    8 and name   HA) 3.748 1.756 1.756 weight 1.000 ! spec=S064_8, no=930, id=870, vol=8.929910e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    7 and name  HB1) 3.505 1.535 1.535 weight 1.000 ! spec=S064_8, no=931, id=871, vol=1.336513e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   48 and name  HB2) 3.493 1.525 1.525 weight 1.000 ! spec=S064_8, no=933, id=873, vol=1.362767e+06
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name HD13) 3.142 1.234 1.234 weight 1.000 ! spec=S064_8, no=934, id=874, vol=2.572476e+06
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name HD11)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name HD12)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   36 and name  HB2) 2.778 0.965 0.965 weight 1.000 ! spec=S064_8, no=935, id=875, vol=5.385601e+06
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name   HN) 3.433 1.473 1.473 weight 1.000 ! spec=S064_8, no=937, id=876, vol=1.512783e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name   HA) 2.843 1.010 1.010 weight 1.000 ! spec=S064_8, no=938, id=877, vol=4.690211e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   33 and name   HA) 3.690 1.702 1.702 weight 1.000 ! spec=S064_8, no=939, id=878, vol=9.818470e+05
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   58 and name   HA) 3.202 1.281 1.281 weight 1.000 ! spec=S064_8, no=940, id=879, vol=2.299325e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   54 and name HG12) 3.815 1.819 1.819 weight 1.000 ! spec=S064_8, no=941, id=880, vol=8.039380e+05
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   62 and name HD13) 3.544 1.570 1.570 weight 1.000 ! spec=S064_8, no=942, id=881, vol=1.250034e+06
    or (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   62 and name HD11)
    or (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   62 and name HD12)
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   41 and name   HB) 3.677 1.690 1.690 weight 1.000 ! spec=S064_8, no=944, id=882, vol=1.002237e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name  HB1) 3.352 1.405 1.405 weight 1.000 ! spec=S064_8, no=945, id=883, vol=1.744609e+06
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   41 and name HG11) 3.981 1.981 1.981 weight 1.000 ! spec=S064_8, no=946, id=884, vol=6.223550e+05
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name HD21) 3.189 1.271 1.271 weight 1.000 ! spec=S064_8, no=948, id=886, vol=2.355517e+06
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name HD22)
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name HD23)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   50 and name   HA) 4.068 2.069 2.069 weight 1.000 ! spec=S064_8, no=950, id=888, vol=5.461950e+05
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   41 and name HG23) 3.131 1.225 1.225 weight 1.000 ! spec=S064_8, no=952, id=889, vol=2.628573e+06
    or (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   41 and name HG21)
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HB2) 3.625 1.643 1.643 weight 1.000 ! spec=S064_8, no=953, id=890, vol=1.090868e+06
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name   HA) 3.153 1.242 1.242 weight 1.000 ! spec=S064_8, no=954, id=891, vol=2.521941e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name   HA) 3.096 1.199 1.199 weight 1.000 ! spec=S064_8, no=955, id=892, vol=2.809656e+06
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name  HG1) 4.391 2.410 2.410 weight 1.000 ! spec=S064_8, no=957, id=894, vol=3.456080e+05
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name  HB1) 2.789 0.972 0.972 weight 1.000 ! spec=S064_8, no=959, id=896, vol=5.262990e+06
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    3 and name   HN) 2.978 1.108 1.108 weight 1.000 ! spec=S064_8, no=960, id=897, vol=3.552315e+06
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name   HA) 2.587 0.837 0.837 weight 1.000 ! spec=S064_8, no=962, id=899, vol=8.263947e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name   HA) 2.465 0.759 0.759 weight 1.000 ! spec=S064_8, no=963, id=900, vol=1.104494e+07
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid    5 and name   HA) 3.198 1.278 1.278 weight 1.000 ! spec=S064_8, no=964, id=901, vol=2.316928e+06
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid    5 and name  HD1) 3.605 1.624 1.624 weight 1.000 ! spec=S064_8, no=965, id=902, vol=1.128359e+06
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   52 and name   HA) 3.375 1.424 1.424 weight 1.000 ! spec=S064_8, no=966, id=903, vol=1.675176e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    4 and name  HB2) 3.538 1.564 1.564 weight 1.000 ! spec=S064_8, no=969, id=905, vol=1.263655e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name HD11) 3.268 1.335 1.335 weight 1.000 ! spec=S064_8, no=971, id=907, vol=2.032768e+06
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name HD13)
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name HD12)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   51 and name HG23) 3.653 1.668 1.668 weight 1.000 ! spec=S064_8, no=972, id=908, vol=1.041577e+06
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   51 and name HG22)
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   51 and name HG21)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   51 and name HG23) 3.482 1.516 1.516 weight 1.000 ! spec=S064_8, no=973, id=909, vol=1.389373e+06
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   51 and name HG22)
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   51 and name HG21)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   51 and name HG23)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   51 and name HG22)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   51 and name HG21)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    3 and name HD21) 3.416 1.458 1.458 weight 1.000 ! spec=S064_8, no=974, id=910, vol=1.559420e+06
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    3 and name HD22)
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    3 and name HD23)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    3 and name HD21)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    3 and name HD22)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    3 and name HD23)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   51 and name HG23) 3.314 1.373 1.373 weight 1.000 ! spec=S064_8, no=975, id=911, vol=1.869806e+06
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   51 and name HG22)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   51 and name HG21)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   51 and name HG23)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   51 and name HG22)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   51 and name HG21)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    3 and name HD21) 3.325 1.382 1.382 weight 1.000 ! spec=S064_8, no=976, id=912, vol=1.833499e+06
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    3 and name HD22)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    3 and name HD23)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    3 and name HD21)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    3 and name HD22)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    3 and name HD23)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   14 and name HG11) 2.832 1.003 1.003 weight 1.000 ! spec=S064_8, no=977, id=913, vol=4.800738e+06
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    3 and name  HB1) 3.896 1.898 1.898 weight 1.000 ! spec=S064_8, no=979, id=914, vol=7.077140e+05
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    3 and name  HB1)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   49 and name   HB) 4.198 2.203 2.203 weight 1.000 ! spec=S064_8, no=980, id=915, vol=4.525100e+05
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   49 and name   HB)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    5 and name  HB2) 4.060 2.061 2.061 weight 1.000 ! spec=S064_8, no=981, id=916, vol=5.527710e+05
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    5 and name  HB2)
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid    5 and name  HB1) 4.419 2.441 2.441 weight 1.000 ! spec=S064_8, no=982, id=917, vol=3.327500e+05
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid    5 and name  HB1)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    4 and name   HA) 3.398 1.443 1.443 weight 1.000 ! spec=S064_8, no=983, id=918, vol=1.609369e+06
    or (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    4 and name   HA)
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   14 and name HG23) 3.897 1.898 1.898 weight 1.000 ! spec=S064_8, no=985, id=920, vol=7.075620e+05
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid    6 and name  HE2) (segid "   A" and resid   13 and name  HG2) 4.115 2.117 2.117 weight 1.000 ! spec=S064_8, no=986, id=921, vol=5.101020e+05
    or (segid "   A" and resid    6 and name  HE1) (segid "   A" and resid   13 and name  HG2)
assign (segid "   A" and resid    6 and name  HE2) (segid "   A" and resid   13 and name  HG1) 4.316 2.329 2.329 weight 1.000 ! spec=S064_8, no=987, id=922, vol=3.831340e+05
    or (segid "   A" and resid    6 and name  HE1) (segid "   A" and resid   13 and name  HG1)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid   13 and name  HG1) 3.164 1.252 1.252 weight 1.000 ! spec=S064_8, no=988, id=923, vol=2.466547e+06
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid   13 and name  HG1)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid   13 and name  HG2) 3.717 1.727 1.727 weight 1.000 ! spec=S064_8, no=989, id=924, vol=9.385740e+05
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid   13 and name  HG2)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid   12 and name HG11) 3.955 1.955 1.955 weight 1.000 ! spec=S064_8, no=990, id=925, vol=6.469400e+05
    or (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid   13 and name  HB1) 3.252 1.322 1.322 weight 1.000 ! spec=S064_8, no=991, id=926, vol=2.093391e+06
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid   13 and name  HB1)
assign (segid "   A" and resid    6 and name  HE2) (segid "   A" and resid   13 and name   HA) 4.187 2.191 2.191 weight 1.000 ! spec=S064_8, no=992, id=927, vol=4.598630e+05
    or (segid "   A" and resid    6 and name  HE1) (segid "   A" and resid   13 and name   HA)
assign (segid "   A" and resid    6 and name  HE2) (segid "   A" and resid    5 and name   HA) 4.059 2.059 2.059 weight 1.000 ! spec=S064_8, no=993, id=928, vol=5.540690e+05
    or (segid "   A" and resid    6 and name  HE1) (segid "   A" and resid    5 and name   HA)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    5 and name   HA) 3.369 1.419 1.419 weight 1.000 ! spec=S064_8, no=994, id=929, vol=1.694186e+06
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    5 and name   HA)
assign (segid "   A" and resid    6 and name  HE2) (segid "   A" and resid    4 and name   HN) 4.083 2.084 2.084 weight 1.000 ! spec=S064_8, no=995, id=930, vol=5.342250e+05
    or (segid "   A" and resid    6 and name  HE1) (segid "   A" and resid    4 and name   HN)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    4 and name   HN) 3.788 1.794 1.794 weight 1.000 ! spec=S064_8, no=996, id=931, vol=8.382380e+05
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    4 and name   HN)
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid   12 and name   HN) 3.903 1.904 1.904 weight 1.000 ! spec=S064_8, no=998, id=932, vol=7.006900e+05
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid   12 and name   HN)
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HB2) 3.317 1.375 1.375 weight 1.000 ! spec=S064_8, no=999, id=933, vol=1.860551e+06
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid   14 and name HG11) 3.981 1.981 1.981 weight 1.000 ! spec=S064_8, no=1006, id=938, vol=6.217900e+05
    or (segid "   A" and resid    7 and name   HA) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid    7 and name   HA) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid    7 and name   HA) 3.908 1.909 1.909 weight 1.000 ! spec=S064_8, no=1007, id=939, vol=6.950880e+05
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   62 and name HD13) 3.672 1.686 1.686 weight 1.000 ! spec=S064_8, no=1008, id=940, vol=1.009624e+06
    or (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   62 and name HD11)
    or (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   62 and name HD12)
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   54 and name HD13) 3.197 1.277 1.277 weight 1.000 ! spec=S064_8, no=1009, id=941, vol=2.320970e+06
    or (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   54 and name HD11)
    or (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   54 and name HD12)
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   54 and name HG22) 3.372 1.421 1.421 weight 1.000 ! spec=S064_8, no=1010, id=942, vol=1.685411e+06
    or (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid    8 and name  HG1) 3.797 1.802 1.802 weight 1.000 ! spec=S064_8, no=1011, id=943, vol=8.269710e+05
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   62 and name HD21) 3.788 1.794 1.794 weight 1.000 ! spec=S064_8, no=1012, id=944, vol=8.379080e+05
    or (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   62 and name HD23)
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   54 and name HG11) 3.549 1.575 1.575 weight 1.000 ! spec=S064_8, no=1013, id=945, vol=1.239042e+06
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   58 and name  HB1) 3.596 1.616 1.616 weight 1.000 ! spec=S064_8, no=1014, id=946, vol=1.145585e+06
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid    9 and name  HB2) 3.802 1.807 1.807 weight 1.000 ! spec=S064_8, no=1015, id=947, vol=8.202550e+05
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid    9 and name  HB1) 3.800 1.805 1.805 weight 1.000 ! spec=S064_8, no=1016, id=948, vol=8.223510e+05
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid    9 and name   HN) 4.215 2.221 2.221 weight 1.000 ! spec=S064_8, no=1017, id=949, vol=4.413820e+05
assign (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid   54 and name HG11) 3.763 1.770 1.770 weight 1.000 ! spec=S064_8, no=1019, id=950, vol=8.716500e+05
assign (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    8 and name   HA) 3.791 1.797 1.797 weight 1.000 ! spec=S064_8, no=1021, id=952, vol=8.342310e+05
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name  HG1) 3.262 1.330 1.330 weight 1.000 ! spec=S064_8, no=1023, id=953, vol=2.056034e+06
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name  HB2) 2.462 0.758 0.758 weight 1.000 ! spec=S064_8, no=1024, id=954, vol=1.111959e+07
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HG2) 3.987 1.987 1.987 weight 1.000 ! spec=S064_8, no=1026, id=955, vol=6.162090e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HB2) 4.200 2.205 2.205 weight 1.000 ! spec=S064_8, no=1027, id=956, vol=4.510470e+05
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    7 and name  HB1) 4.239 2.247 2.247 weight 1.000 ! spec=S064_8, no=1029, id=957, vol=4.266200e+05
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid    9 and name   HN) 3.317 1.375 1.375 weight 1.000 ! spec=S064_8, no=1031, id=958, vol=1.859474e+06
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid   10 and name   HN) 3.430 1.470 1.470 weight 1.000 ! spec=S064_8, no=1035, id=962, vol=1.521825e+06
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   10 and name   HN) 3.283 1.347 1.347 weight 1.000 ! spec=S064_8, no=1036, id=963, vol=1.978930e+06
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name  HA2) 3.820 1.825 1.825 weight 1.000 ! spec=S064_8, no=1037, id=964, vol=7.964330e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HB2) 3.893 1.894 1.894 weight 1.000 ! spec=S064_8, no=1038, id=965, vol=7.119900e+05
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HB1) 2.957 1.093 1.093 weight 1.000 ! spec=S064_8, no=1039, id=966, vol=3.701516e+06
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   12 and name   HN) 3.675 1.689 1.689 weight 1.000 ! spec=S064_8, no=1040, id=967, vol=1.004571e+06
assign (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   12 and name   HN) 3.340 1.395 1.395 weight 1.000 ! spec=S064_8, no=1041, id=968, vol=1.782985e+06
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    7 and name  HB1) 3.650 1.665 1.665 weight 1.000 ! spec=S064_8, no=1042, id=969, vol=1.047120e+06
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name   HA) 3.985 1.985 1.985 weight 1.000 ! spec=S064_8, no=1043, id=970, vol=6.186940e+05
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name   HB) 2.776 0.963 0.963 weight 1.000 ! spec=S064_8, no=1048, id=975, vol=5.412639e+06
assign (segid "   A" and resid   12 and name HG11) (segid "   A" and resid    7 and name   HA) 4.005 2.005 2.005 weight 1.000 ! spec=S064_8, no=1049, id=976, vol=6.005230e+05
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid    7 and name   HA)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid    7 and name   HA)
assign (segid "   A" and resid   12 and name HG21) (segid "   A" and resid    7 and name   HA) 3.918 1.918 1.918 weight 1.000 ! spec=S064_8, no=1050, id=977, vol=6.851000e+05
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid    7 and name   HA)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid    7 and name   HA)
assign (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   14 and name   HA) 3.811 1.816 1.816 weight 1.000 ! spec=S064_8, no=1051, id=978, vol=8.083430e+05
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   14 and name   HA) 3.251 1.321 1.321 weight 1.000 ! spec=S064_8, no=1052, id=979, vol=2.096940e+06
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   13 and name   HA) 3.999 1.999 1.999 weight 1.000 ! spec=S064_8, no=1053, id=980, vol=6.058380e+05
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   13 and name   HA)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   13 and name   HA)
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid   12 and name HG11) 3.491 1.523 1.523 weight 1.000 ! spec=S064_8, no=1058, id=981, vol=1.369293e+06
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid   12 and name HG11) 3.259 1.328 1.328 weight 1.000 ! spec=S064_8, no=1060, id=982, vol=2.066722e+06
    or (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HA) 2.358 0.695 0.695 weight 1.000 ! spec=S064_8, no=1062, id=983, vol=1.441365e+07
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HB) 2.798 0.978 0.978 weight 1.000 ! spec=S064_8, no=1063, id=984, vol=5.165225e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HG2) 2.790 0.973 0.973 weight 1.000 ! spec=S064_8, no=1064, id=985, vol=5.249054e+06
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HG1) 3.270 1.337 1.337 weight 1.000 ! spec=S064_8, no=1066, id=986, vol=2.023914e+06
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HG1) 3.725 1.735 1.735 weight 1.000 ! spec=S064_8, no=1072, id=991, vol=9.265510e+05
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   14 and name HG11) 3.788 1.794 1.794 weight 1.000 ! spec=S064_8, no=1073, id=992, vol=8.381130e+05
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   13 and name  HG1) 2.681 0.899 0.899 weight 1.000 ! spec=S064_8, no=1082, id=1001, vol=6.665966e+06
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name  HG2) 3.005 1.129 1.129 weight 1.000 ! spec=S064_8, no=1083, id=1002, vol=3.364464e+06
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name  HG1) 2.572 0.827 0.827 weight 1.000 ! spec=S064_8, no=1084, id=1003, vol=8.550335e+06
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   15 and name   HN) 3.181 1.265 1.265 weight 1.000 ! spec=S064_8, no=1085, id=1004, vol=2.391254e+06
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG23) 2.543 0.808 0.808 weight 1.000 ! spec=S064_8, no=1090, id=1009, vol=9.165467e+06
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid   14 and name HG11) (segid "   A" and resid    5 and name  HB2) 3.326 1.382 1.382 weight 1.000 ! spec=S064_8, no=1092, id=1010, vol=1.830832e+06
    or (segid "   A" and resid   14 and name HG12) (segid "   A" and resid    5 and name  HB2)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid    5 and name  HB2)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG23) 3.488 1.520 1.520 weight 1.000 ! spec=S064_8, no=1095, id=1012, vol=1.376342e+06
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG11) 3.613 1.632 1.632 weight 1.000 ! spec=S064_8, no=1096, id=1013, vol=1.113088e+06
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HN) 3.054 1.166 1.166 weight 1.000 ! spec=S064_8, no=1098, id=1015, vol=3.051827e+06
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   68 and name   HN) 3.009 1.132 1.132 weight 1.000 ! spec=S064_8, no=1099, id=1016, vol=3.337009e+06
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   15 and name   HN) 3.952 1.952 1.952 weight 1.000 ! spec=S064_8, no=1104, id=1020, vol=6.502570e+05
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name   HA) 3.201 1.281 1.281 weight 1.000 ! spec=S064_8, no=1105, id=1021, vol=2.301311e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name   HA) 2.588 0.837 0.837 weight 1.000 ! spec=S064_8, no=1106, id=1022, vol=8.237049e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HB1) 3.195 1.276 1.276 weight 1.000 ! spec=S064_8, no=1107, id=1023, vol=2.328895e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name   HG) 2.956 1.092 1.092 weight 1.000 ! spec=S064_8, no=1108, id=1024, vol=3.709798e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HB2) 3.096 1.198 1.198 weight 1.000 ! spec=S064_8, no=1109, id=1025, vol=2.812024e+06
assign (segid "   A" and resid   17 and name HD13) (segid "   A" and resid   17 and name  HB2) 2.431 0.739 0.739 weight 1.000 ! spec=S064_8, no=1110, id=1026, vol=1.199734e+07
    or (segid "   A" and resid   17 and name HD11) (segid "   A" and resid   17 and name  HB2)
    or (segid "   A" and resid   17 and name HD12) (segid "   A" and resid   17 and name  HB2)
assign (segid "   A" and resid   17 and name HD21) (segid "   A" and resid   18 and name   HN) 3.085 1.189 1.189 weight 1.000 ! spec=S064_8, no=1111, id=1027, vol=2.874090e+06
    or (segid "   A" and resid   17 and name HD22) (segid "   A" and resid   18 and name   HN)
    or (segid "   A" and resid   17 and name HD23) (segid "   A" and resid   18 and name   HN)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name   HA) 3.096 1.199 1.199 weight 1.000 ! spec=S064_8, no=1114, id=1029, vol=2.809656e+06
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name HE21) 4.194 2.199 2.199 weight 1.000 ! spec=S064_8, no=1117, id=1030, vol=4.551700e+05
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name   HA) 2.582 0.833 0.833 weight 1.000 ! spec=S064_8, no=1118, id=1031, vol=8.354126e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HB1) 3.053 1.165 1.165 weight 1.000 ! spec=S064_8, no=1119, id=1032, vol=3.055597e+06
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   28 and name  HA2) 4.236 2.243 2.243 weight 1.000 ! spec=S064_8, no=1121, id=1034, vol=4.289150e+05
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   28 and name  HA2)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   28 and name  HA1) 4.297 2.309 2.309 weight 1.000 ! spec=S064_8, no=1122, id=1035, vol=3.931850e+05
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   28 and name  HA1)
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HB1) 3.220 1.296 1.296 weight 1.000 ! spec=S064_8, no=1123, id=1036, vol=2.223144e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HB2) 2.992 1.119 1.119 weight 1.000 ! spec=S064_8, no=1124, id=1037, vol=3.452844e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   22 and name   HN) 2.934 1.076 1.076 weight 1.000 ! spec=S064_8, no=1127, id=1040, vol=3.885706e+06
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   44 and name   HA) 3.399 1.444 1.444 weight 1.000 ! spec=S064_8, no=1128, id=1041, vol=1.606069e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   22 and name HG11) 3.570 1.593 1.593 weight 1.000 ! spec=S064_8, no=1129, id=1042, vol=1.197048e+06
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   22 and name HG13)
    or (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   22 and name HG12)
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   22 and name   HB) 3.342 1.396 1.396 weight 1.000 ! spec=S064_8, no=1130, id=1043, vol=1.777219e+06
assign (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   21 and name  HG1) 2.748 0.944 0.944 weight 1.000 ! spec=S064_8, no=1131, id=1044, vol=5.756866e+06
assign (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   21 and name  HG2) 2.775 0.963 0.963 weight 1.000 ! spec=S064_8, no=1132, id=1045, vol=5.423458e+06
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name  HG2) 2.805 0.984 0.984 weight 1.000 ! spec=S064_8, no=1133, id=1046, vol=5.084523e+06
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name  HG1) 2.752 0.946 0.946 weight 1.000 ! spec=S064_8, no=1134, id=1047, vol=5.705951e+06
assign (segid "   A" and resid   21 and name  HG2) (segid "   A" and resid   21 and name   HA) 3.051 1.163 1.163 weight 1.000 ! spec=S064_8, no=1139, id=1052, vol=3.072609e+06
assign (segid "   A" and resid   21 and name  HG1) (segid "   A" and resid   21 and name   HA) 3.287 1.351 1.351 weight 1.000 ! spec=S064_8, no=1140, id=1053, vol=1.962074e+06
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name   HA) 3.017 1.138 1.138 weight 1.000 ! spec=S064_8, no=1141, id=1054, vol=3.286378e+06
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HG2) 2.794 0.976 0.976 weight 1.000 ! spec=S064_8, no=1144, id=1057, vol=5.207711e+06
assign (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   19 and name   HA) 3.601 1.621 1.621 weight 1.000 ! spec=S064_8, no=1154, id=1065, vol=1.135011e+06
    or (segid "   A" and resid   22 and name HG13) (segid "   A" and resid   19 and name   HA)
    or (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   19 and name   HA)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name   HA) 2.840 1.008 1.008 weight 1.000 ! spec=S064_8, no=1156, id=1066, vol=4.723707e+06
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HN) 3.224 1.299 1.299 weight 1.000 ! spec=S064_8, no=1158, id=1068, vol=2.207026e+06
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name   HA) 2.604 0.847 0.847 weight 1.000 ! spec=S064_8, no=1159, id=1069, vol=7.948228e+06
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name  HB1) 3.265 1.332 1.332 weight 1.000 ! spec=S064_8, no=1162, id=1072, vol=2.044885e+06
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name  HB2) 3.099 1.200 1.200 weight 1.000 ! spec=S064_8, no=1163, id=1073, vol=2.798559e+06
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name   HA) 2.672 0.893 0.893 weight 1.000 ! spec=S064_8, no=1164, id=1074, vol=6.802943e+06
assign (segid "   A" and resid   24 and name   HB) (segid "   A" and resid   24 and name   HN) 3.516 1.546 1.546 weight 1.000 ! spec=S064_8, no=1166, id=1075, vol=1.309995e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name   HA) 2.575 0.829 0.829 weight 1.000 ! spec=S064_8, no=1167, id=1076, vol=8.505536e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   26 and name  HB1) 3.130 1.225 1.225 weight 1.000 ! spec=S064_8, no=1168, id=1077, vol=2.631689e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   26 and name  HB2) 3.075 1.182 1.182 weight 1.000 ! spec=S064_8, no=1169, id=1078, vol=2.928290e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HB2) 2.810 0.987 0.987 weight 1.000 ! spec=S064_8, no=1171, id=1079, vol=5.025791e+06
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB1) 3.122 1.219 1.219 weight 1.000 ! spec=S064_8, no=1184, id=1089, vol=2.673141e+06
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name   HG) 2.985 1.114 1.114 weight 1.000 ! spec=S064_8, no=1185, id=1090, vol=3.498018e+06
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name HD11) 2.974 1.106 1.106 weight 1.000 ! spec=S064_8, no=1186, id=1091, vol=3.577755e+06
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name HD13)
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name HD21) 2.469 0.762 0.762 weight 1.000 ! spec=S064_8, no=1187, id=1092, vol=1.092984e+07
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name HD23)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name HD22)
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name HD11) 2.430 0.738 0.738 weight 1.000 ! spec=S064_8, no=1188, id=1093, vol=1.203508e+07
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name HD13)
assign (segid "   A" and resid   27 and name   HG) (segid "   A" and resid   27 and name HD11) 2.541 0.807 0.807 weight 1.000 ! spec=S064_8, no=1190, id=1095, vol=9.209335e+06
    or (segid "   A" and resid   27 and name   HG) (segid "   A" and resid   27 and name HD12)
    or (segid "   A" and resid   27 and name   HG) (segid "   A" and resid   27 and name HD13)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   29 and name   HN) 2.886 1.041 1.041 weight 1.000 ! spec=S064_8, no=1196, id=1101, vol=4.289140e+06
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   30 and name   HN) 3.043 1.158 1.158 weight 1.000 ! spec=S064_8, no=1201, id=1106, vol=3.118394e+06
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name   HA) 2.899 1.051 1.051 weight 1.000 ! spec=S064_8, no=1202, id=1107, vol=4.170682e+06
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   62 and name   HG) 3.122 1.218 1.218 weight 1.000 ! spec=S064_8, no=1203, id=1108, vol=2.674224e+06
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   29 and name   HA) 4.193 2.198 2.198 weight 1.000 ! spec=S064_8, no=1204, id=1109, vol=4.555840e+05
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   29 and name   HA)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name   HA) 3.925 1.925 1.925 weight 1.000 ! spec=S064_8, no=1205, id=1110, vol=6.778580e+05
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name   HA)
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   29 and name  HB2) 4.175 2.179 2.179 weight 1.000 ! spec=S064_8, no=1206, id=1111, vol=4.675050e+05
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   29 and name  HB2)
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   29 and name  HB1) 4.133 2.135 2.135 weight 1.000 ! spec=S064_8, no=1207, id=1112, vol=4.970430e+05
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   29 and name  HB1)
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   27 and name   HA) 4.433 2.456 2.456 weight 1.000 ! spec=S064_8, no=1209, id=1114, vol=3.265590e+05
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   27 and name   HA)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name HD21) 3.209 1.287 1.287 weight 1.000 ! spec=S064_8, no=1210, id=1115, vol=2.269989e+06
    or (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name HD23)
    or (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name HD22)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name HD21)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name HD23)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name HD22)
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   32 and name HD13) 3.472 1.507 1.507 weight 1.000 ! spec=S064_8, no=1211, id=1116, vol=1.413847e+06
    or (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   32 and name HD11)
    or (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   32 and name HD12)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   32 and name HD13)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   32 and name HD11)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   32 and name HD12)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   32 and name HD13) 3.135 1.228 1.228 weight 1.000 ! spec=S064_8, no=1212, id=1117, vol=2.610717e+06
    or (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   32 and name HD11)
    or (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   32 and name HD12)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   32 and name HD13)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   32 and name HD11)
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   32 and name HD12)
assign (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   27 and name HD21) 3.555 1.580 1.580 weight 1.000 ! spec=S064_8, no=1213, id=1118, vol=1.226777e+06
    or (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   27 and name HD23)
    or (segid "   A" and resid   29 and name  HE1) (segid "   A" and resid   27 and name HD22)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   27 and name HD21)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   27 and name HD23)
    or (segid "   A" and resid   29 and name  HE2) (segid "   A" and resid   27 and name HD22)
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   32 and name HD13) 3.397 1.442 1.442 weight 1.000 ! spec=S064_8, no=1214, id=1119, vol=1.611916e+06
    or (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   32 and name HD11)
    or (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   32 and name HD12)
assign (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   32 and name HD13) 3.470 1.505 1.505 weight 1.000 ! spec=S064_8, no=1215, id=1120, vol=1.418033e+06
    or (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   32 and name HD11)
    or (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   32 and name HD12)
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   32 and name HD21) 3.480 1.514 1.514 weight 1.000 ! spec=S064_8, no=1216, id=1121, vol=1.394066e+06
    or (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   32 and name HD22)
    or (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   32 and name HD23)
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   29 and name  HB1) 3.549 1.575 1.575 weight 1.000 ! spec=S064_8, no=1221, id=1124, vol=1.239023e+06
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name  HB2) 3.546 1.571 1.571 weight 1.000 ! spec=S064_8, no=1222, id=1125, vol=1.246388e+06
assign (segid "   A" and resid   30 and name HE22) (segid "   A" and resid   30 and name  HG2) 3.894 1.896 1.896 weight 1.000 ! spec=S064_8, no=1223, id=1126, vol=7.099380e+05
assign (segid "   A" and resid   31 and name  HB1) (segid "   A" and resid   31 and name  HB2) 2.247 0.631 0.631 weight 1.000 ! spec=S064_8, no=1225, id=1127, vol=1.923924e+07
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    4 and name   HA) 3.628 1.645 1.645 weight 1.000 ! spec=S064_8, no=1227, id=1129, vol=1.086244e+06
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name   HA) 2.837 1.006 1.006 weight 1.000 ! spec=S064_8, no=1228, id=1130, vol=4.751163e+06
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name HD21) 3.421 1.463 1.463 weight 1.000 ! spec=S064_8, no=1230, id=1131, vol=1.545196e+06
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name HD22)
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name HD23)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HD21) 3.807 1.811 1.811 weight 1.000 ! spec=S064_8, no=1231, id=1132, vol=8.138050e+05
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HD22)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HD23)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name HG21) 4.065 2.065 2.065 weight 1.000 ! spec=S064_8, no=1233, id=1134, vol=5.492220e+05
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name HG23)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name HG22)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name   HB) 3.046 1.160 1.160 weight 1.000 ! spec=S064_8, no=1236, id=1135, vol=3.098208e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   36 and name   HN) 3.008 1.131 1.131 weight 1.000 ! spec=S064_8, no=1238, id=1136, vol=3.340890e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name   HB) 2.810 0.987 0.987 weight 1.000 ! spec=S064_8, no=1239, id=1137, vol=5.025940e+06
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name   HA) 3.319 1.377 1.377 weight 1.000 ! spec=S064_8, no=1241, id=1138, vol=1.854035e+06
assign (segid "   A" and resid   34 and name HD22) (segid "   A" and resid   33 and name HG21) 3.690 1.702 1.702 weight 1.000 ! spec=S064_8, no=1242, id=1139, vol=9.817690e+05
    or (segid "   A" and resid   34 and name HD22) (segid "   A" and resid   33 and name HG23)
    or (segid "   A" and resid   34 and name HD22) (segid "   A" and resid   33 and name HG22)
assign (segid "   A" and resid    3 and name HD11) (segid "   A" and resid    2 and name  HB2) 3.025 1.144 1.144 weight 1.000 ! spec=S064_8, no=1243, id=1140, vol=3.232890e+06
    or (segid "   A" and resid    3 and name HD11) (segid "   A" and resid    2 and name  HB3)
    or (segid "   A" and resid    3 and name HD11) (segid "   A" and resid    2 and name  HB1)
    or (segid "   A" and resid    3 and name HD13) (segid "   A" and resid    2 and name  HB2)
    or (segid "   A" and resid    3 and name HD13) (segid "   A" and resid    2 and name  HB3)
    or (segid "   A" and resid    3 and name HD13) (segid "   A" and resid    2 and name  HB1)
    or (segid "   A" and resid    3 and name HD12) (segid "   A" and resid    2 and name  HB2)
    or (segid "   A" and resid    3 and name HD12) (segid "   A" and resid    2 and name  HB3)
    or (segid "   A" and resid    3 and name HD12) (segid "   A" and resid    2 and name  HB1)
assign (segid "   A" and resid    3 and name HD21) (segid "   A" and resid    2 and name  HB2) 3.308 1.368 1.368 weight 1.000 ! spec=S064_8, no=1244, id=1141, vol=1.889239e+06
    or (segid "   A" and resid    3 and name HD21) (segid "   A" and resid    2 and name  HB3)
    or (segid "   A" and resid    3 and name HD21) (segid "   A" and resid    2 and name  HB1)
    or (segid "   A" and resid    3 and name HD22) (segid "   A" and resid    2 and name  HB2)
    or (segid "   A" and resid    3 and name HD22) (segid "   A" and resid    2 and name  HB3)
    or (segid "   A" and resid    3 and name HD22) (segid "   A" and resid    2 and name  HB1)
    or (segid "   A" and resid    3 and name HD23) (segid "   A" and resid    2 and name  HB2)
    or (segid "   A" and resid    3 and name HD23) (segid "   A" and resid    2 and name  HB3)
    or (segid "   A" and resid    3 and name HD23) (segid "   A" and resid    2 and name  HB1)
assign (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   34 and name   HA) 3.689 1.701 1.701 weight 1.000 ! spec=S064_8, no=1246, id=1142, vol=9.825820e+05
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   38 and name   HA) 3.615 1.634 1.634 weight 1.000 ! spec=S064_8, no=1247, id=1143, vol=1.109744e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name  HG2) 3.191 1.273 1.273 weight 1.000 ! spec=S064_8, no=1252, id=1148, vol=2.343793e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name   HA) 2.976 1.107 1.107 weight 1.000 ! spec=S064_8, no=1254, id=1150, vol=3.568172e+06
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HG2) 2.731 0.933 0.933 weight 1.000 ! spec=S064_8, no=1256, id=1152, vol=5.965069e+06
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HB2) 2.815 0.990 0.990 weight 1.000 ! spec=S064_8, no=1257, id=1153, vol=4.979196e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HB1) 2.917 1.063 1.063 weight 1.000 ! spec=S064_8, no=1258, id=1154, vol=4.024003e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HB2) 2.863 1.025 1.025 weight 1.000 ! spec=S064_8, no=1259, id=1155, vol=4.495349e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   32 and name  HB1) 3.568 1.592 1.592 weight 1.000 ! spec=S064_8, no=1260, id=1156, vol=1.199800e+06
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name  HB1) 3.241 1.313 1.313 weight 1.000 ! spec=S064_8, no=1261, id=1157, vol=2.138249e+06
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name  HB2) 3.386 1.433 1.433 weight 1.000 ! spec=S064_8, no=1262, id=1158, vol=1.642696e+06
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name  HG2) 3.443 1.482 1.482 weight 1.000 ! spec=S064_8, no=1263, id=1159, vol=1.486577e+06
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   60 and name   HA) 3.566 1.590 1.590 weight 1.000 ! spec=S064_8, no=1264, id=1160, vol=1.203998e+06
assign (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   60 and name   HA) 3.766 1.773 1.773 weight 1.000 ! spec=S064_8, no=1266, id=1161, vol=8.684940e+05
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name  HD2) 4.027 2.027 2.027 weight 1.000 ! spec=S064_8, no=1274, id=1162, vol=5.803890e+05
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name   HN) 2.755 0.948 0.948 weight 1.000 ! spec=S064_8, no=1276, id=1163, vol=5.668917e+06
assign (segid "   A" and resid   37 and name   HE) (segid "   A" and resid   37 and name  HB1) 4.119 2.121 2.121 weight 1.000 ! spec=S064_8, no=1277, id=1164, vol=5.073030e+05
assign (segid "   A" and resid   37 and name   HE) (segid "   A" and resid   37 and name  HG1) 4.321 2.333 2.333 weight 1.000 ! spec=S064_8, no=1278, id=1165, vol=3.806920e+05
assign (segid "   A" and resid   37 and name  HD2) (segid "   A" and resid   37 and name   HA) 3.830 1.834 1.834 weight 1.000 ! spec=S064_8, no=1281, id=1168, vol=7.845940e+05
assign (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name  HG1) 2.964 1.098 1.098 weight 1.000 ! spec=S064_8, no=1283, id=1170, vol=3.652974e+06
assign (segid "   A" and resid   37 and name  HG1) (segid "   A" and resid   37 and name  HB1) 2.738 0.937 0.937 weight 1.000 ! spec=S064_8, no=1284, id=1171, vol=5.873331e+06
assign (segid "   A" and resid   38 and name HD21) (segid "   A" and resid   38 and name   HN) 4.005 2.005 2.005 weight 1.000 ! spec=S064_8, no=1286, id=1173, vol=5.998040e+05
assign (segid "   A" and resid   38 and name HD22) (segid "   A" and resid   38 and name   HN) 4.184 2.189 2.189 weight 1.000 ! spec=S064_8, no=1287, id=1174, vol=4.613260e+05
assign (segid "   A" and resid   38 and name HD21) (segid "   A" and resid   38 and name   HA) 4.354 2.370 2.370 weight 1.000 ! spec=S064_8, no=1290, id=1175, vol=3.634440e+05
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   70 and name   HA) 2.714 0.921 0.921 weight 1.000 ! spec=S064_8, no=1293, id=1178, vol=6.190485e+06
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid   12 and name   HA) 3.396 1.442 1.442 weight 1.000 ! spec=S064_8, no=1294, id=1179, vol=1.614513e+06
assign (segid "   A" and resid   49 and name   HB) (segid "   A" and resid    3 and name   HA) 3.254 1.324 1.324 weight 1.000 ! spec=S064_8, no=1297, id=1181, vol=2.086275e+06
assign (segid "   A" and resid   49 and name HG12) (segid "   A" and resid    3 and name   HA) 3.525 1.553 1.553 weight 1.000 ! spec=S064_8, no=1304, id=1182, vol=1.290435e+06
    or (segid "   A" and resid   49 and name HG13) (segid "   A" and resid    3 and name   HA)
    or (segid "   A" and resid   49 and name HG11) (segid "   A" and resid    3 and name   HA)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid    3 and name   HA) 3.553 1.578 1.578 weight 1.000 ! spec=S064_8, no=1305, id=1183, vol=1.231596e+06
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid    3 and name   HA)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid    3 and name   HA)
assign (segid "   A" and resid   51 and name HG23) (segid "   A" and resid    3 and name   HA) 4.056 2.057 2.057 weight 1.000 ! spec=S064_8, no=1306, id=1184, vol=5.560480e+05
    or (segid "   A" and resid   51 and name HG22) (segid "   A" and resid    3 and name   HA)
    or (segid "   A" and resid   51 and name HG21) (segid "   A" and resid    3 and name   HA)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   41 and name   HB) 3.998 1.998 1.998 weight 1.000 ! spec=S064_8, no=1308, id=1186, vol=6.064230e+05
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name HD12) 3.579 1.601 1.601 weight 1.000 ! spec=S064_8, no=1311, id=1189, vol=1.178041e+06
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name HD11)
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name   HA) 2.984 1.113 1.113 weight 1.000 ! spec=S064_8, no=1312, id=1190, vol=3.510414e+06
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name   HA) 3.497 1.529 1.529 weight 1.000 ! spec=S064_8, no=1313, id=1191, vol=1.354110e+06
assign (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   41 and name   HA) 3.695 1.707 1.707 weight 1.000 ! spec=S064_8, no=1314, id=1192, vol=9.731150e+05
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG23) 2.841 1.009 1.009 weight 1.000 ! spec=S064_8, no=1317, id=1195, vol=4.706795e+06
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG21)
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HD12) 2.559 0.818 0.818 weight 1.000 ! spec=S064_8, no=1318, id=1196, vol=8.823204e+06
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HD11)
assign (segid "   A" and resid   42 and name  HB2) (segid "   A" and resid   43 and name  HB1) 4.097 2.098 2.098 weight 1.000 ! spec=S064_8, no=1323, id=1200, vol=5.235450e+05
assign (segid "   A" and resid   66 and name  HD2) (segid "   A" and resid   66 and name  HG1) 3.575 1.598 1.598 weight 1.000 ! spec=S064_8, no=1324, id=1201, vol=1.185674e+06
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name  HG2) 3.606 1.625 1.625 weight 1.000 ! spec=S064_8, no=1325, id=1202, vol=1.127313e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   51 and name   HN) 3.654 1.669 1.669 weight 1.000 ! spec=S064_8, no=1326, id=1203, vol=1.040074e+06
assign (segid "   A" and resid   71 and name  HD2) (segid "   A" and resid   70 and name   HA) 4.134 2.137 2.137 weight 1.000 ! spec=S064_8, no=1327, id=1204, vol=4.959470e+05
    or (segid "   A" and resid   71 and name  HD1) (segid "   A" and resid   70 and name   HA)
assign (segid "   A" and resid   43 and name  HE2) (segid "   A" and resid   43 and name  HB1) 4.211 2.217 2.217 weight 1.000 ! spec=S064_8, no=1328, id=1205, vol=4.441030e+05
    or (segid "   A" and resid   43 and name  HE1) (segid "   A" and resid   43 and name  HB1)
assign (segid "   A" and resid   43 and name  HE2) (segid "   A" and resid   44 and name  HB1) 4.190 2.194 2.194 weight 1.000 ! spec=S064_8, no=1329, id=1206, vol=4.578630e+05
    or (segid "   A" and resid   43 and name  HE1) (segid "   A" and resid   44 and name  HB1)
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name  HD2) 3.465 1.501 1.501 weight 1.000 ! spec=S064_8, no=1334, id=1207, vol=1.430414e+06
assign (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name  HB1) 2.312 0.668 0.668 weight 1.000 ! spec=S064_8, no=1337, id=1208, vol=1.622624e+07
assign (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   59 and name  HG2) 3.223 1.298 1.298 weight 1.000 ! spec=S064_8, no=1340, id=1210, vol=2.210069e+06
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   59 and name  HG2)
    or (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   59 and name  HG2)
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid    5 and name  HB1) 2.966 1.100 1.100 weight 1.000 ! spec=S064_8, no=1341, id=1211, vol=3.636039e+06
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid    5 and name  HB1)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid    5 and name  HB1)
assign (segid "   A" and resid   52 and name   HG) (segid "   A" and resid   52 and name HD11) 2.597 0.843 0.843 weight 1.000 ! spec=S064_8, no=1342, id=1212, vol=8.073683e+06
    or (segid "   A" and resid   52 and name   HG) (segid "   A" and resid   52 and name HD13)
    or (segid "   A" and resid   52 and name   HG) (segid "   A" and resid   52 and name HD12)
assign (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   54 and name HG22) 3.049 1.162 1.162 weight 1.000 ! spec=S064_8, no=1344, id=1214, vol=3.084986e+06
    or (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   54 and name HG22) 3.178 1.262 1.262 weight 1.000 ! spec=S064_8, no=1345, id=1215, vol=2.405594e+06
    or (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   14 and name HG23) (segid "   A" and resid    5 and name  HB1) 3.384 1.431 1.431 weight 1.000 ! spec=S064_8, no=1346, id=1216, vol=1.649686e+06
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid    5 and name  HB1)
    or (segid "   A" and resid   14 and name HG22) (segid "   A" and resid    5 and name  HB1)
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name  HD2) 3.684 1.697 1.697 weight 1.000 ! spec=S064_8, no=1348, id=1217, vol=9.905550e+05
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   50 and name  HB2) 4.220 2.226 2.226 weight 1.000 ! spec=S064_8, no=1351, id=1218, vol=4.385430e+05
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   50 and name  HB2)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   50 and name  HB2)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   50 and name  HB1) 4.218 2.224 2.224 weight 1.000 ! spec=S064_8, no=1352, id=1219, vol=4.395580e+05
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   50 and name  HB1)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   50 and name  HB1)
assign (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   50 and name   HA) 3.691 1.703 1.703 weight 1.000 ! spec=S064_8, no=1353, id=1220, vol=9.798290e+05
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name HD22) 3.533 1.560 1.560 weight 1.000 ! spec=S064_8, no=1357, id=1224, vol=1.273137e+06
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   48 and name   HN) 2.922 1.067 1.067 weight 1.000 ! spec=S064_8, no=1361, id=1227, vol=3.976879e+06
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name   HA) 2.879 1.036 1.036 weight 1.000 ! spec=S064_8, no=1362, id=1228, vol=4.352761e+06
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name  HB1) 3.116 1.214 1.214 weight 1.000 ! spec=S064_8, no=1364, id=1230, vol=2.705660e+06
assign (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid   52 and name HD21) 3.653 1.668 1.668 weight 1.000 ! spec=S064_8, no=1366, id=1231, vol=1.041958e+06
    or (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid   52 and name HD23)
    or (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid   52 and name HD22)
assign (segid "   A" and resid   49 and name   HB) (segid "   A" and resid   49 and name   HA) 3.375 1.424 1.424 weight 1.000 ! spec=S064_8, no=1368, id=1233, vol=1.675349e+06
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid   53 and name   HA) 3.664 1.678 1.678 weight 1.000 ! spec=S064_8, no=1369, id=1234, vol=1.023773e+06
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid   53 and name   HA)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid   53 and name   HA)
assign (segid "   A" and resid   42 and name  HB2) (segid "   A" and resid   41 and name HG23) 3.702 1.713 1.713 weight 1.000 ! spec=S064_8, no=1371, id=1235, vol=9.616520e+05
    or (segid "   A" and resid   42 and name  HB2) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   42 and name  HB2) (segid "   A" and resid   41 and name HG21)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   48 and name  HB1) 3.738 1.746 1.746 weight 1.000 ! spec=S064_8, no=1372, id=1236, vol=9.080510e+05
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   48 and name  HB1)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   48 and name  HB1)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid    3 and name  HB1) 3.196 1.277 1.277 weight 1.000 ! spec=S064_8, no=1373, id=1237, vol=2.324852e+06
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid    3 and name  HB1)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid    3 and name  HB1)
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name   HB) 3.975 1.975 1.975 weight 1.000 ! spec=S064_8, no=1374, id=1238, vol=6.279830e+05
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name   HA) 3.904 1.905 1.905 weight 1.000 ! spec=S064_8, no=1377, id=1241, vol=6.994500e+05
assign (segid "   A" and resid   51 and name   HB) (segid "   A" and resid    5 and name   HA) 3.816 1.820 1.820 weight 1.000 ! spec=S064_8, no=1380, id=1244, vol=8.024060e+05
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid   52 and name   HA) 3.597 1.617 1.617 weight 1.000 ! spec=S064_8, no=1381, id=1245, vol=1.144152e+06
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid   52 and name   HA)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid   52 and name   HA)
assign (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   52 and name   HA) 3.762 1.769 1.769 weight 1.000 ! spec=S064_8, no=1382, id=1246, vol=8.737860e+05
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   52 and name   HA)
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   52 and name   HA)
assign (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   51 and name   HA) 3.640 1.656 1.656 weight 1.000 ! spec=S064_8, no=1383, id=1247, vol=1.065090e+06
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   51 and name   HA)
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   51 and name   HA)
assign (segid "   A" and resid   54 and name HG11) (segid "   A" and resid   54 and name HD13) 2.726 0.929 0.929 weight 1.000 ! spec=S064_8, no=1384, id=1248, vol=6.037053e+06
    or (segid "   A" and resid   54 and name HG11) (segid "   A" and resid   54 and name HD11)
    or (segid "   A" and resid   54 and name HG11) (segid "   A" and resid   54 and name HD12)
assign (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   62 and name HD21) 2.759 0.951 0.951 weight 1.000 ! spec=S064_8, no=1385, id=1249, vol=5.618436e+06
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   62 and name HD23)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   62 and name HD21)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   62 and name HD23)
    or (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   62 and name HD21)
    or (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   62 and name HD23)
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   62 and name   HG) 4.182 2.186 2.186 weight 1.000 ! spec=S064_8, no=1386, id=1250, vol=4.629680e+05
assign (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid   52 and name   HA) 3.777 1.784 1.784 weight 1.000 ! spec=S064_8, no=1387, id=1251, vol=8.526390e+05
assign (segid "   A" and resid   52 and name   HG) (segid "   A" and resid   52 and name   HA) 3.899 1.900 1.900 weight 1.000 ! spec=S064_8, no=1388, id=1252, vol=7.051540e+05
assign (segid "   A" and resid   54 and name HG11) (segid "   A" and resid   54 and name   HA) 3.747 1.755 1.755 weight 1.000 ! spec=S064_8, no=1389, id=1253, vol=8.948850e+05
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   31 and name  HB2) 3.955 1.955 1.955 weight 1.000 ! spec=S064_8, no=1390, id=1254, vol=6.468850e+05
assign (segid "   A" and resid   52 and name HD21) (segid "   A" and resid   52 and name  HB2) 2.912 1.060 1.060 weight 1.000 ! spec=S064_8, no=1391, id=1255, vol=4.065560e+06
    or (segid "   A" and resid   52 and name HD23) (segid "   A" and resid   52 and name  HB2)
    or (segid "   A" and resid   52 and name HD22) (segid "   A" and resid   52 and name  HB2)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name HD11) 4.062 2.062 2.062 weight 1.000 ! spec=S064_8, no=1392, id=1256, vol=5.514450e+05
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name HD13)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name HD12)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid    5 and name  HB2) 4.207 2.212 2.212 weight 1.000 ! spec=S064_8, no=1393, id=1257, vol=4.466870e+05
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name   HN) 3.571 1.594 1.594 weight 1.000 ! spec=S064_8, no=1394, id=1258, vol=1.195148e+06
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid    3 and name  HB1) 4.074 2.074 2.074 weight 1.000 ! spec=S064_8, no=1396, id=1260, vol=5.420390e+05
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   53 and name HG23) 3.683 1.696 1.696 weight 1.000 ! spec=S064_8, no=1397, id=1261, vol=9.921130e+05
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   53 and name HG21)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   53 and name HG22)
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid   54 and name   HN) 3.038 1.153 1.153 weight 1.000 ! spec=S064_8, no=1398, id=1262, vol=3.151845e+06
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid   54 and name   HN)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid   54 and name   HN)
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid    5 and name   HA) 4.064 2.064 2.064 weight 1.000 ! spec=S064_8, no=1400, id=1264, vol=5.501100e+05
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid    5 and name   HA)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid    5 and name   HA)
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid   14 and name   HB) 2.968 1.101 1.101 weight 1.000 ! spec=S064_8, no=1401, id=1265, vol=3.622932e+06
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid   14 and name   HB)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid   14 and name   HB)
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid   14 and name HG11) 3.683 1.696 1.696 weight 1.000 ! spec=S064_8, no=1404, id=1268, vol=9.917560e+05
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   54 and name HG11) (segid "   A" and resid   54 and name HG22) 2.881 1.037 1.037 weight 1.000 ! spec=S064_8, no=1407, id=1271, vol=4.332043e+06
    or (segid "   A" and resid   54 and name HG11) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   54 and name HG11) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name HG12) 3.367 1.417 1.417 weight 1.000 ! spec=S064_8, no=1413, id=1277, vol=1.698357e+06
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid    8 and name   HN) 3.666 1.679 1.679 weight 1.000 ! spec=S064_8, no=1414, id=1278, vol=1.021065e+06
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   14 and name HG11) 4.160 2.163 2.163 weight 1.000 ! spec=S064_8, no=1415, id=1279, vol=4.779070e+05
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   14 and name HG11) 3.833 1.836 1.836 weight 1.000 ! spec=S064_8, no=1416, id=1280, vol=7.809640e+05
    or (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   14 and name HG13)
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   14 and name HG23) 3.435 1.475 1.475 weight 1.000 ! spec=S064_8, no=1417, id=1281, vol=1.508433e+06
    or (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   14 and name HG23) 3.978 1.978 1.978 weight 1.000 ! spec=S064_8, no=1418, id=1282, vol=6.252620e+05
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   12 and name HG21) 3.588 1.610 1.610 weight 1.000 ! spec=S064_8, no=1419, id=1283, vol=1.159828e+06
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   12 and name HG22)
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   12 and name HG21) 4.066 2.066 2.066 weight 1.000 ! spec=S064_8, no=1423, id=1285, vol=5.481510e+05
    or (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   12 and name HG22)
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   54 and name HG22) 3.625 1.642 1.642 weight 1.000 ! spec=S064_8, no=1427, id=1288, vol=1.091813e+06
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   54 and name HG22) 4.138 2.140 2.140 weight 1.000 ! spec=S064_8, no=1430, id=1289, vol=4.935480e+05
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name  HG2) 3.850 1.853 1.853 weight 1.000 ! spec=S064_8, no=1431, id=1290, vol=7.607680e+05
assign (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   54 and name HD13) 3.350 1.402 1.402 weight 1.000 ! spec=S064_8, no=1433, id=1291, vol=1.753644e+06
    or (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   54 and name HD11)
    or (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   54 and name HD12)
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   59 and name  HG2) 3.930 1.930 1.930 weight 1.000 ! spec=S064_8, no=1436, id=1293, vol=6.725600e+05
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   58 and name   HA) 3.836 1.839 1.839 weight 1.000 ! spec=S064_8, no=1437, id=1294, vol=7.777670e+05
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   58 and name   HA) 4.029 2.029 2.029 weight 1.000 ! spec=S064_8, no=1438, id=1295, vol=5.792170e+05
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name  HB2) 3.254 1.324 1.324 weight 1.000 ! spec=S064_8, no=1439, id=1296, vol=2.085386e+06
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name  HB1) 2.818 0.993 0.993 weight 1.000 ! spec=S064_8, no=1440, id=1297, vol=4.947358e+06
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   56 and name   HN) 3.671 1.685 1.685 weight 1.000 ! spec=S064_8, no=1443, id=1300, vol=1.011503e+06
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   56 and name   HN) 3.672 1.686 1.686 weight 1.000 ! spec=S064_8, no=1444, id=1301, vol=1.009964e+06
assign (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   54 and name HG11) 3.879 1.881 1.881 weight 1.000 ! spec=S064_8, no=1451, id=1308, vol=7.270340e+05
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   54 and name HD13) 3.450 1.488 1.488 weight 1.000 ! spec=S064_8, no=1452, id=1309, vol=1.469271e+06
    or (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   54 and name HD11)
    or (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   54 and name HD12)
assign (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   59 and name   HN) 3.260 1.328 1.328 weight 1.000 ! spec=S064_8, no=1453, id=1310, vol=2.063325e+06
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   59 and name   HA) 4.167 2.170 2.170 weight 1.000 ! spec=S064_8, no=1454, id=1311, vol=4.732630e+05
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   57 and name   HN) 3.337 1.392 1.392 weight 1.000 ! spec=S064_8, no=1456, id=1312, vol=1.794094e+06
assign (segid "   A" and resid   59 and name HE21) (segid "   A" and resid   56 and name   HA) 4.286 2.296 2.296 weight 1.000 ! spec=S064_8, no=1457, id=1313, vol=3.996930e+05
assign (segid "   A" and resid   59 and name HE21) (segid "   A" and resid   60 and name   HA) 4.117 2.118 2.118 weight 1.000 ! spec=S064_8, no=1458, id=1314, vol=5.087600e+05
assign (segid "   A" and resid   59 and name HE22) (segid "   A" and resid   56 and name   HA) 4.326 2.339 2.339 weight 1.000 ! spec=S064_8, no=1459, id=1315, vol=3.777710e+05
assign (segid "   A" and resid   59 and name HE21) (segid "   A" and resid   59 and name  HB2) 3.966 1.966 1.966 weight 1.000 ! spec=S064_8, no=1460, id=1316, vol=6.367120e+05
assign (segid "   A" and resid   30 and name HE21) (segid "   A" and resid   30 and name  HB1) 4.149 2.152 2.152 weight 1.000 ! spec=S064_8, no=1462, id=1318, vol=4.854370e+05
assign (segid "   A" and resid   59 and name HE21) (segid "   A" and resid   62 and name  HB2) 4.221 2.227 2.227 weight 1.000 ! spec=S064_8, no=1464, id=1319, vol=4.379390e+05
assign (segid "   A" and resid   59 and name HE21) (segid "   A" and resid   62 and name  HB1) 4.526 2.561 2.561 weight 1.000 ! spec=S064_8, no=1466, id=1320, vol=2.879730e+05
assign (segid "   A" and resid   59 and name HE22) (segid "   A" and resid   59 and name  HB2) 3.706 1.717 1.717 weight 1.000 ! spec=S064_8, no=1467, id=1321, vol=9.553450e+05
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   62 and name HD21) 3.673 1.686 1.686 weight 1.000 ! spec=S064_8, no=1469, id=1323, vol=1.009117e+06
    or (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   62 and name HD23)
assign (segid "   A" and resid   60 and name   HA) (segid "   A" and resid   59 and name   HN) 3.652 1.668 1.668 weight 1.000 ! spec=S064_8, no=1473, id=1327, vol=1.043091e+06
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   62 and name HD13) 4.268 2.277 2.277 weight 1.000 ! spec=S064_8, no=1475, id=1328, vol=4.099290e+05
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   62 and name HD11)
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   62 and name HD12)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HG2) 3.072 1.180 1.180 weight 1.000 ! spec=S064_8, no=1478, id=1330, vol=2.944973e+06
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   37 and name   HN) 3.531 1.558 1.558 weight 1.000 ! spec=S064_8, no=1479, id=1331, vol=1.278559e+06
assign (segid "   A" and resid   70 and name  HG2) (segid "   A" and resid   70 and name   HN) 3.139 1.232 1.232 weight 1.000 ! spec=S064_8, no=1484, id=1335, vol=2.587397e+06
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name  HB2) 2.885 1.041 1.041 weight 1.000 ! spec=S064_8, no=1485, id=1336, vol=4.291418e+06
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name  HB2) 3.097 1.199 1.199 weight 1.000 ! spec=S064_8, no=1486, id=1337, vol=2.809039e+06
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   42 and name   HN) 3.501 1.533 1.533 weight 1.000 ! spec=S064_8, no=1491, id=1341, vol=1.343963e+06
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name  HB1) 3.255 1.324 1.324 weight 1.000 ! spec=S064_8, no=1496, id=1345, vol=2.082396e+06
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name  HB2) 3.669 1.682 1.682 weight 1.000 ! spec=S064_8, no=1500, id=1348, vol=1.015713e+06
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   30 and name   HN) 3.868 1.870 1.870 weight 1.000 ! spec=S064_8, no=1503, id=1349, vol=7.394190e+05
assign (segid "   A" and resid   32 and name   HG) (segid "   A" and resid   32 and name   HN) 3.068 1.177 1.177 weight 1.000 ! spec=S064_8, no=1507, id=1353, vol=2.970065e+06
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   35 and name   HN) 2.954 1.091 1.091 weight 1.000 ! spec=S064_8, no=1509, id=1354, vol=3.724048e+06
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   35 and name   HN)
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   35 and name   HN)
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name HG23) 3.671 1.684 1.684 weight 1.000 ! spec=S064_8, no=1512, id=1357, vol=1.012297e+06
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name HG22)
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name HG21)
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   62 and name  HB2) 4.218 2.223 2.223 weight 1.000 ! spec=S064_8, no=1514, id=1358, vol=4.400720e+05
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   16 and name   HN) 3.615 1.634 1.634 weight 1.000 ! spec=S064_8, no=1515, id=1359, vol=1.109315e+06
assign (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   62 and name   HN) 3.301 1.362 1.362 weight 1.000 ! spec=S064_8, no=1516, id=1360, vol=1.912723e+06
assign (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   63 and name   HN) 3.649 1.665 1.665 weight 1.000 ! spec=S064_8, no=1518, id=1362, vol=1.048463e+06
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   63 and name   HN)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   63 and name   HN)
assign (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   60 and name  HB2) 3.413 1.456 1.456 weight 1.000 ! spec=S064_8, no=1523, id=1364, vol=1.565906e+06
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   60 and name  HB2)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   60 and name  HB2)
assign (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name HD13) 3.436 1.476 1.476 weight 1.000 ! spec=S064_8, no=1524, id=1365, vol=1.504300e+06
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name HD11)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name HD12)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name HD13)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name HD11)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name HD12)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name HD13)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name HD11)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name HD12)
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   54 and name HD13) 3.953 1.953 1.953 weight 1.000 ! spec=S064_8, no=1527, id=1367, vol=6.493110e+05
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   54 and name HD11)
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   54 and name HD12)
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   58 and name  HB1) 4.098 2.099 2.099 weight 1.000 ! spec=S064_8, no=1529, id=1368, vol=5.229080e+05
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   68 and name  HB2) 4.182 2.186 2.186 weight 1.000 ! spec=S064_8, no=1530, id=1369, vol=4.631480e+05
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   58 and name   HA) 3.540 1.567 1.567 weight 1.000 ! spec=S064_8, no=1531, id=1370, vol=1.258262e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   64 and name   HN) 3.604 1.624 1.624 weight 1.000 ! spec=S064_8, no=1533, id=1371, vol=1.130186e+06
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   59 and name   HN) 3.437 1.477 1.477 weight 1.000 ! spec=S064_8, no=1534, id=1372, vol=1.501672e+06
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   54 and name HG22) 4.051 2.051 2.051 weight 1.000 ! spec=S064_8, no=1537, id=1374, vol=5.604480e+05
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   54 and name HG23)
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   54 and name HG21)
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   54 and name HG11) 3.611 1.630 1.630 weight 1.000 ! spec=S064_8, no=1539, id=1376, vol=1.117781e+06
assign (segid "   A" and resid   62 and name HD21) (segid "   A" and resid   63 and name   HN) 3.717 1.727 1.727 weight 1.000 ! spec=S064_8, no=1545, id=1382, vol=9.396440e+05
    or (segid "   A" and resid   62 and name HD22) (segid "   A" and resid   63 and name   HN)
    or (segid "   A" and resid   62 and name HD23) (segid "   A" and resid   63 and name   HN)
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name HD21) 2.962 1.097 1.097 weight 1.000 ! spec=S064_8, no=1546, id=1383, vol=3.667513e+06
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name HD23)
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name HD13) 2.453 0.752 0.752 weight 1.000 ! spec=S064_8, no=1547, id=1384, vol=1.137040e+07
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name HD11)
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name HD12)
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   63 and name   HN) 2.995 1.121 1.121 weight 1.000 ! spec=S064_8, no=1553, id=1387, vol=3.433850e+06
assign (segid "   A" and resid   64 and name  HB2) (segid "   A" and resid   65 and name   HN) 3.437 1.476 1.476 weight 1.000 ! spec=S064_8, no=1554, id=1388, vol=1.502902e+06
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   59 and name  HG2) 4.122 2.124 2.124 weight 1.000 ! spec=S064_8, no=1555, id=1389, vol=5.046480e+05
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name  HG1) 4.035 2.036 2.036 weight 1.000 ! spec=S064_8, no=1556, id=1390, vol=5.735390e+05
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   66 and name  HD2) 3.675 1.689 1.689 weight 1.000 ! spec=S064_8, no=1557, id=1391, vol=1.004813e+06
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   62 and name  HB2) 3.696 1.707 1.707 weight 1.000 ! spec=S064_8, no=1559, id=1393, vol=9.717600e+05
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid   14 and name   HB) 3.294 1.356 1.356 weight 1.000 ! spec=S064_8, no=1560, id=1394, vol=1.938906e+06
assign (segid "   A" and resid   65 and name  HB2) (segid "   A" and resid   66 and name  HG1) 4.401 2.421 2.421 weight 1.000 ! spec=S064_8, no=1566, id=1396, vol=3.408470e+05
assign (segid "   A" and resid   65 and name  HB2) (segid "   A" and resid   66 and name  HD1) 3.683 1.696 1.696 weight 1.000 ! spec=S064_8, no=1568, id=1397, vol=9.921050e+05
assign (segid "   A" and resid   65 and name  HB1) (segid "   A" and resid   66 and name  HD1) 3.865 1.867 1.867 weight 1.000 ! spec=S064_8, no=1569, id=1398, vol=7.428990e+05
assign (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   10 and name   HA) 2.989 1.117 1.117 weight 1.000 ! spec=S064_8, no=1575, id=1402, vol=3.475350e+06
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   33 and name   HA) 3.290 1.353 1.353 weight 1.000 ! spec=S064_8, no=1576, id=1403, vol=1.954173e+06
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   66 and name  HD1) 3.640 1.657 1.657 weight 1.000 ! spec=S064_8, no=1577, id=1404, vol=1.064166e+06
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name   HA) 3.659 1.673 1.673 weight 1.000 ! spec=S064_8, no=1578, id=1405, vol=1.032580e+06
assign (segid "   A" and resid   66 and name  HD2) (segid "   A" and resid   66 and name   HA) 3.647 1.663 1.663 weight 1.000 ! spec=S064_8, no=1579, id=1406, vol=1.052697e+06
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name  HG1) 3.295 1.357 1.357 weight 1.000 ! spec=S064_8, no=1580, id=1407, vol=1.935194e+06
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name   HA) 2.629 0.864 0.864 weight 1.000 ! spec=S064_8, no=1581, id=1408, vol=7.497742e+06
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid   10 and name   HN) 3.600 1.620 1.620 weight 1.000 ! spec=S064_8, no=1597, id=1417, vol=1.137505e+06
assign (segid "   A" and resid   71 and name  HE2) (segid "   A" and resid   71 and name  HB1) 4.041 2.041 2.041 weight 1.000 ! spec=S064_8, no=1599, id=1418, vol=5.688700e+05
    or (segid "   A" and resid   71 and name  HE1) (segid "   A" and resid   71 and name  HB1)
assign (segid "   A" and resid   71 and name  HE2) (segid "   A" and resid   71 and name  HB2) 3.905 1.906 1.906 weight 1.000 ! spec=S064_8, no=1600, id=1419, vol=6.987910e+05
    or (segid "   A" and resid   71 and name  HE1) (segid "   A" and resid   71 and name  HB2)
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   72 and name  HB2) 4.212 2.217 2.217 weight 1.000 ! spec=S064_8, no=1601, id=1420, vol=4.438050e+05
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   73 and name   HN) 3.932 1.932 1.932 weight 1.000 ! spec=S064_8, no=1603, id=1422, vol=6.705140e+05
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   72 and name  HB1) 3.387 1.434 1.434 weight 1.000 ! spec=S064_8, no=1604, id=1423, vol=1.641350e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   15 and name   HN) 3.975 1.975 1.975 weight 1.000 ! spec=S064_8, no=1606, id=1425, vol=6.279440e+05
assign (segid "   A" and resid   43 and name  HD1) (segid "   A" and resid   44 and name  HB1) 3.880 1.882 1.882 weight 1.000 ! spec=S064_8, no=1609, id=1427, vol=7.261760e+05
    or (segid "   A" and resid   43 and name  HD2) (segid "   A" and resid   44 and name  HB1)
assign (segid "   A" and resid   29 and name  HD2) (segid "   A" and resid   27 and name  HB2) 3.438 1.477 1.477 weight 1.000 ! spec=S064_8, no=1611, id=1428, vol=1.500547e+06
    or (segid "   A" and resid   29 and name  HD1) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name HD22) 3.222 1.297 1.297 weight 1.000 ! spec=S064_8, no=1616, id=1432, vol=2.214732e+06
assign (segid "   A" and resid   65 and name HD22) (segid "   A" and resid   65 and name  HB1) 3.443 1.482 1.482 weight 1.000 ! spec=S064_8, no=1619, id=1433, vol=1.486885e+06
assign (segid "   A" and resid   71 and name  HD2) (segid "   A" and resid   72 and name  HB1) 3.493 1.525 1.525 weight 1.000 ! spec=S064_8, no=1624, id=1436, vol=1.362924e+06
    or (segid "   A" and resid   71 and name  HD1) (segid "   A" and resid   72 and name  HB1)
assign (segid "   A" and resid    8 and name   HE) (segid "   A" and resid   54 and name HG12) 3.286 1.350 1.350 weight 1.000 ! spec=S064_8, no=1629, id=1438, vol=1.966830e+06
assign (segid "   A" and resid   13 and name  HD2) (segid "   A" and resid   13 and name  HG1) 2.681 0.899 0.899 weight 1.000 ! spec=S064_8, no=1630, id=1439, vol=6.665966e+06
assign (segid "   A" and resid   17 and name HD13) (segid "   A" and resid   17 and name   HG) 2.283 0.652 0.652 weight 1.000 ! spec=S064_8, no=1631, id=1440, vol=1.747389e+07
    or (segid "   A" and resid   17 and name HD11) (segid "   A" and resid   17 and name   HG)
    or (segid "   A" and resid   17 and name HD12) (segid "   A" and resid   17 and name   HG)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name HD21) 2.425 0.735 0.735 weight 1.000 ! spec=S064_8, no=1632, id=1441, vol=1.219297e+07
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name HD22)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name HD23)
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name HD13) 2.306 0.665 0.665 weight 1.000 ! spec=S064_8, no=1633, id=1442, vol=1.647743e+07
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name HD11)
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name HD12)
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name HG21) 2.954 1.091 1.091 weight 1.000 ! spec=S064_8, no=1635, id=1444, vol=3.724048e+06
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name HG23)
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   33 and name HG22)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name   HA) 2.826 0.999 0.999 weight 1.000 ! spec=S064_8, no=1636, id=1445, vol=4.857824e+06
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid    6 and name   HA) 3.597 1.617 1.617 weight 1.000 ! spec=S064_8, no=1638, id=1446, vol=1.144152e+06
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid    6 and name   HA)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid    6 and name   HA)
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   56 and name   HA) 3.202 1.281 1.281 weight 1.000 ! spec=S064_8, no=1640, id=1447, vol=2.299325e+06
assign (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   58 and name  HB1) 3.666 1.680 1.680 weight 1.000 ! spec=S064_8, no=1641, id=1448, vol=1.020975e+06
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   58 and name  HB1)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   58 and name  HB1)
assign (segid "   A" and resid    3 and name   HG) (segid "   A" and resid    2 and name   HA) 3.814 1.818 1.818 weight 1.000 ! spec=S064_8, no=1650, id=1450, vol=8.044560e+05
assign (segid "   A" and resid    3 and name HD21) (segid "   A" and resid   49 and name   HA) 3.613 1.631 1.631 weight 1.000 ! spec=S064_8, no=1653, id=1451, vol=1.114165e+06
    or (segid "   A" and resid    3 and name HD22) (segid "   A" and resid   49 and name   HA)
    or (segid "   A" and resid    3 and name HD23) (segid "   A" and resid   49 and name   HA)
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    3 and name   HA) 3.731 1.740 1.740 weight 1.000 ! spec=S064_8, no=1654, id=1452, vol=9.188770e+05
    or (segid "   A" and resid    2 and name  HB3) (segid "   A" and resid    3 and name   HA)
    or (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid    3 and name   HA)
assign (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD11) 2.304 0.664 0.664 weight 1.000 ! spec=S064_8, no=1656, id=1453, vol=1.655128e+07
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD13)
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD12)
assign (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD21) 2.909 1.058 1.058 weight 1.000 ! spec=S064_8, no=1657, id=1454, vol=4.085521e+06
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD22)
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD23)
assign (segid "   A" and resid   49 and name HG12) (segid "   A" and resid    3 and name   HG) 2.853 1.017 1.017 weight 1.000 ! spec=S064_8, no=1658, id=1455, vol=4.596717e+06
    or (segid "   A" and resid   49 and name HG13) (segid "   A" and resid    3 and name   HG)
    or (segid "   A" and resid   49 and name HG11) (segid "   A" and resid    3 and name   HG)
assign (segid "   A" and resid    3 and name   HG) (segid "   A" and resid    3 and name  HB1) 2.923 1.068 1.068 weight 1.000 ! spec=S064_8, no=1659, id=1456, vol=3.972879e+06
assign (segid "   A" and resid    3 and name HD21) (segid "   A" and resid   49 and name   HB) 3.095 1.197 1.197 weight 1.000 ! spec=S064_8, no=1661, id=1458, vol=2.820139e+06
    or (segid "   A" and resid    3 and name HD22) (segid "   A" and resid   49 and name   HB)
    or (segid "   A" and resid    3 and name HD23) (segid "   A" and resid   49 and name   HB)
assign (segid "   A" and resid    3 and name HD11) (segid "   A" and resid   49 and name   HB) 2.903 1.053 1.053 weight 1.000 ! spec=S064_8, no=1662, id=1459, vol=4.140028e+06
    or (segid "   A" and resid    3 and name HD13) (segid "   A" and resid   49 and name   HB)
    or (segid "   A" and resid    3 and name HD12) (segid "   A" and resid   49 and name   HB)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    4 and name   HA) 3.295 1.357 1.357 weight 1.000 ! spec=S064_8, no=1663, id=1460, vol=1.934690e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    4 and name  HB1) 3.384 1.431 1.431 weight 1.000 ! spec=S064_8, no=1665, id=1462, vol=1.650155e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name  HB2) 2.896 1.048 1.048 weight 1.000 ! spec=S064_8, no=1666, id=1463, vol=4.201264e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   49 and name HG12) 3.163 1.251 1.251 weight 1.000 ! spec=S064_8, no=1668, id=1465, vol=2.472538e+06
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   49 and name HG13)
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   49 and name HG11)
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   51 and name HG12) 3.163 1.251 1.251 weight 1.000 ! spec=S064_8, no=1673, id=1469, vol=2.472538e+06
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   51 and name HG13)
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   51 and name HG11)
assign (segid "   A" and resid   51 and name HG12) (segid "   A" and resid    5 and name  HD1) 3.088 1.192 1.192 weight 1.000 ! spec=S064_8, no=1675, id=1471, vol=2.854852e+06
    or (segid "   A" and resid   51 and name HG12) (segid "   A" and resid    5 and name  HD2)
    or (segid "   A" and resid   51 and name HG13) (segid "   A" and resid    5 and name  HD1)
    or (segid "   A" and resid   51 and name HG13) (segid "   A" and resid    5 and name  HD2)
    or (segid "   A" and resid   51 and name HG11) (segid "   A" and resid    5 and name  HD1)
    or (segid "   A" and resid   51 and name HG11) (segid "   A" and resid    5 and name  HD2)
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    6 and name  HD2) 3.047 1.161 1.161 weight 1.000 ! spec=S064_8, no=1679, id=1473, vol=3.094712e+06
    or (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    6 and name  HD1)
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name  HB2) 3.871 1.873 1.873 weight 1.000 ! spec=S064_8, no=1681, id=1475, vol=7.360110e+05
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid   50 and name   HN) 4.243 2.250 2.250 weight 1.000 ! spec=S064_8, no=1683, id=1477, vol=4.246810e+05
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid   51 and name   HN) 3.857 1.860 1.860 weight 1.000 ! spec=S064_8, no=1684, id=1478, vol=7.518890e+05
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name   HN) 3.006 1.130 1.130 weight 1.000 ! spec=S064_8, no=1686, id=1479, vol=3.356398e+06
assign (segid "   A" and resid   14 and name HG23) (segid "   A" and resid    5 and name  HB2) 3.330 1.386 1.386 weight 1.000 ! spec=S064_8, no=1691, id=1484, vol=1.815677e+06
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid    5 and name  HB2)
    or (segid "   A" and resid   14 and name HG22) (segid "   A" and resid    5 and name  HB2)
assign (segid "   A" and resid   14 and name HG11) (segid "   A" and resid    5 and name  HB1) 3.340 1.394 1.394 weight 1.000 ! spec=S064_8, no=1693, id=1485, vol=1.784290e+06
    or (segid "   A" and resid   14 and name HG12) (segid "   A" and resid    5 and name  HB1)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid    5 and name  HB1)
assign (segid "   A" and resid   53 and name HG23) (segid "   A" and resid    5 and name  HB2) 3.166 1.253 1.253 weight 1.000 ! spec=S064_8, no=1695, id=1486, vol=2.457723e+06
    or (segid "   A" and resid   53 and name HG21) (segid "   A" and resid    5 and name  HB2)
    or (segid "   A" and resid   53 and name HG22) (segid "   A" and resid    5 and name  HB2)
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name  HB1) 2.792 0.975 0.975 weight 1.000 ! spec=S064_8, no=1697, id=1488, vol=5.226406e+06
assign (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   14 and name HG23) 3.398 1.444 1.444 weight 1.000 ! spec=S064_8, no=1702, id=1490, vol=1.607905e+06
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid    5 and name  HE2) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid    5 and name  HE1) (segid "   A" and resid   14 and name HG22)
assign (segid "   A" and resid    4 and name  HD2) (segid "   A" and resid    4 and name  HB2) 2.941 1.081 1.081 weight 1.000 ! spec=S064_8, no=1705, id=1491, vol=3.829839e+06
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   67 and name  HB1) 3.271 1.337 1.337 weight 1.000 ! spec=S064_8, no=1706, id=1492, vol=2.022682e+06
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   67 and name  HB2) 3.606 1.626 1.626 weight 1.000 ! spec=S064_8, no=1707, id=1493, vol=1.125523e+06
assign (segid "   A" and resid    4 and name  HD2) (segid "   A" and resid    4 and name  HB1) 3.556 1.580 1.580 weight 1.000 ! spec=S064_8, no=1709, id=1494, vol=1.225863e+06
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   66 and name  HG1) 3.798 1.803 1.803 weight 1.000 ! spec=S064_8, no=1714, id=1495, vol=8.248400e+05
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   66 and name  HB1) 3.584 1.606 1.606 weight 1.000 ! spec=S064_8, no=1715, id=1496, vol=1.167654e+06
assign (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   50 and name  HB1) 3.258 1.327 1.327 weight 1.000 ! spec=S064_8, no=1718, id=1497, vol=2.069747e+06
assign (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   52 and name HD21) 3.129 1.223 1.223 weight 1.000 ! spec=S064_8, no=1719, id=1498, vol=2.641463e+06
    or (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   52 and name HD23)
    or (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   52 and name HD22)
assign (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   52 and name HD11) 3.550 1.575 1.575 weight 1.000 ! spec=S064_8, no=1721, id=1499, vol=1.237724e+06
    or (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   52 and name HD13)
    or (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   52 and name HD12)
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name  HB2) 2.956 1.092 1.092 weight 1.000 ! spec=S064_8, no=1733, id=1501, vol=3.715654e+06
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   17 and name HD21) 3.447 1.486 1.486 weight 1.000 ! spec=S064_8, no=1735, id=1502, vol=1.475175e+06
    or (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   17 and name HD22)
    or (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   17 and name HD23)
assign (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   17 and name HD13) 3.543 1.569 1.569 weight 1.000 ! spec=S064_8, no=1736, id=1503, vol=1.252691e+06
    or (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   17 and name HD11)
    or (segid "   A" and resid   18 and name  HG2) (segid "   A" and resid   17 and name HD12)
assign (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name  HG2) 2.604 0.848 0.848 weight 1.000 ! spec=S064_8, no=1738, id=1504, vol=7.939034e+06
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   62 and name   HA) 2.709 0.917 0.917 weight 1.000 ! spec=S064_8, no=1740, id=1505, vol=6.272754e+06
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name   HA) 2.554 0.815 0.815 weight 1.000 ! spec=S064_8, no=1742, id=1507, vol=8.930080e+06
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   15 and name   HN) 3.109 1.208 1.208 weight 1.000 ! spec=S064_8, no=1744, id=1508, vol=2.743504e+06
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name  HB2) 3.109 1.208 1.208 weight 1.000 ! spec=S064_8, no=1745, id=1509, vol=2.743504e+06
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name  HB2) 2.784 0.969 0.969 weight 1.000 ! spec=S064_8, no=1746, id=1510, vol=5.320320e+06
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name  HG2) 3.080 1.186 1.186 weight 1.000 ! spec=S064_8, no=1747, id=1511, vol=2.902906e+06
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name  HB1) 2.890 1.044 1.044 weight 1.000 ! spec=S064_8, no=1748, id=1512, vol=4.250240e+06
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name  HB2) 3.019 1.139 1.139 weight 1.000 ! spec=S064_8, no=1749, id=1513, vol=3.273992e+06
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name  HB2) 2.990 1.117 1.117 weight 1.000 ! spec=S064_8, no=1751, id=1514, vol=3.468219e+06
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name  HB1) 2.854 1.018 1.018 weight 1.000 ! spec=S064_8, no=1752, id=1515, vol=4.586572e+06
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   34 and name   HA) 3.213 1.290 1.290 weight 1.000 ! spec=S064_8, no=1753, id=1516, vol=2.251129e+06
assign (segid "   A" and resid   11 and name  HA1) (segid "   A" and resid   12 and name   HN) 3.545 1.571 1.571 weight 1.000 ! spec=S064_8, no=1757, id=1519, vol=1.246829e+06
assign (segid "   A" and resid   11 and name  HA2) (segid "   A" and resid   12 and name   HN) 3.516 1.546 1.546 weight 1.000 ! spec=S064_8, no=1758, id=1520, vol=1.309995e+06
assign (segid "   A" and resid    4 and name  HD2) (segid "   A" and resid    4 and name   HA) 3.609 1.628 1.628 weight 1.000 ! spec=S064_8, no=1762, id=1523, vol=1.120449e+06
# Restraints file 2: TALOS.tbl
 ASSIGN  (segid "   A" and resid 1    and name N   ) (segid "   A" and resid 1    and name CA  )
         (segid "   A" and resid 1    and name C   ) (segid "   A" and resid 2    and name N   )  1.00 138.77 36.02 2

 ASSIGN  (segid "   A" and resid 0    and name C   ) (segid "   A" and resid 1    and name N   )
         (segid "   A" and resid 1    and name CA  ) (segid "   A" and resid 1    and name C   )  1.00 -83.10 66.80 2

 ASSIGN  (segid "   A" and resid 3    and name N   ) (segid "   A" and resid 3    and name CA  )
         (segid "   A" and resid 3    and name C   ) (segid "   A" and resid 4    and name N   )  1.00 127.33 26.81 2

 ASSIGN  (segid "   A" and resid 2    and name C   ) (segid "   A" and resid 3    and name N   )
         (segid "   A" and resid 3    and name CA  ) (segid "   A" and resid 3    and name C   )  1.00 -105.95 37.35 2

 ASSIGN  (segid "   A" and resid 4    and name N   ) (segid "   A" and resid 4    and name CA  )
         (segid "   A" and resid 4    and name C   ) (segid "   A" and resid 5    and name N   )  1.00 143.16 18.24 2

 ASSIGN  (segid "   A" and resid 3    and name C   ) (segid "   A" and resid 4    and name N   )
         (segid "   A" and resid 4    and name CA  ) (segid "   A" and resid 4    and name C   )  1.00 -127.88 49.25 2

 ASSIGN  (segid "   A" and resid 5    and name N   ) (segid "   A" and resid 5    and name CA  )
         (segid "   A" and resid 5    and name C   ) (segid "   A" and resid 6    and name N   )  1.00 130.87 22.66 2

 ASSIGN  (segid "   A" and resid 4    and name C   ) (segid "   A" and resid 5    and name N   )
         (segid "   A" and resid 5    and name CA  ) (segid "   A" and resid 5    and name C   )  1.00 -116.34 33.61 2

 ASSIGN  (segid "   A" and resid 6    and name N   ) (segid "   A" and resid 6    and name CA  )
         (segid "   A" and resid 6    and name C   ) (segid "   A" and resid 7    and name N   )  1.00 146.36 30.71 2

 ASSIGN  (segid "   A" and resid 5    and name C   ) (segid "   A" and resid 6    and name N   )
         (segid "   A" and resid 6    and name CA  ) (segid "   A" and resid 6    and name C   )  1.00 -132.02 19.53 2

 ASSIGN  (segid "   A" and resid 7    and name N   ) (segid "   A" and resid 7    and name CA  )
         (segid "   A" and resid 7    and name C   ) (segid "   A" and resid 8    and name N   )  1.00 127.40 19.59 2

 ASSIGN  (segid "   A" and resid 6    and name C   ) (segid "   A" and resid 7    and name N   )
         (segid "   A" and resid 7    and name CA  ) (segid "   A" and resid 7    and name C   )  1.00 -116.30 42.39 2

 ASSIGN  (segid "   A" and resid 8    and name N   ) (segid "   A" and resid 8    and name CA  )
         (segid "   A" and resid 8    and name C   ) (segid "   A" and resid 9    and name N   )  1.00 129.03 20.15 2

 ASSIGN  (segid "   A" and resid 7    and name C   ) (segid "   A" and resid 8    and name N   )
         (segid "   A" and resid 8    and name CA  ) (segid "   A" and resid 8    and name C   )  1.00 -71.50 21.30 2

 ASSIGN  (segid "   A" and resid 10   and name N   ) (segid "   A" and resid 10   and name CA  )
         (segid "   A" and resid 10   and name C   ) (segid "   A" and resid 11   and name N   )  1.00 -10.77 32.64 2

 ASSIGN  (segid "   A" and resid 9    and name C   ) (segid "   A" and resid 10   and name N   )
         (segid "   A" and resid 10   and name CA  ) (segid "   A" and resid 10   and name C   )  1.00 -99.28 28.37 2

 ASSIGN  (segid "   A" and resid 13   and name N   ) (segid "   A" and resid 13   and name CA  )
         (segid "   A" and resid 13   and name C   ) (segid "   A" and resid 14   and name N   )  1.00 127.76 32.00 2

 ASSIGN  (segid "   A" and resid 12   and name C   ) (segid "   A" and resid 13   and name N   )
         (segid "   A" and resid 13   and name CA  ) (segid "   A" and resid 13   and name C   )  1.00 -85.59 26.73 2

 ASSIGN  (segid "   A" and resid 14   and name N   ) (segid "   A" and resid 14   and name CA  )
         (segid "   A" and resid 14   and name C   ) (segid "   A" and resid 15   and name N   )  1.00 -31.16 43.44 2

 ASSIGN  (segid "   A" and resid 13   and name C   ) (segid "   A" and resid 14   and name N   )
         (segid "   A" and resid 14   and name CA  ) (segid "   A" and resid 14   and name C   )  1.00 -96.62 46.91 2

 ASSIGN  (segid "   A" and resid 25   and name N   ) (segid "   A" and resid 25   and name CA  )
         (segid "   A" and resid 25   and name C   ) (segid "   A" and resid 26   and name N   )  1.00 -35.97 36.85 2

 ASSIGN  (segid "   A" and resid 24   and name C   ) (segid "   A" and resid 25   and name N   )
         (segid "   A" and resid 25   and name CA  ) (segid "   A" and resid 25   and name C   )  1.00 -67.75 27.85 2

 ASSIGN  (segid "   A" and resid 34   and name N   ) (segid "   A" and resid 34   and name CA  )
         (segid "   A" and resid 34   and name C   ) (segid "   A" and resid 35   and name N   )  1.00 -29.73 38.77 2

 ASSIGN  (segid "   A" and resid 33   and name C   ) (segid "   A" and resid 34   and name N   )
         (segid "   A" and resid 34   and name CA  ) (segid "   A" and resid 34   and name C   )  1.00 -64.33 36.93 2

 ASSIGN  (segid "   A" and resid 35   and name N   ) (segid "   A" and resid 35   and name CA  )
         (segid "   A" and resid 35   and name C   ) (segid "   A" and resid 36   and name N   )  1.00 -40.51 14.14 2

 ASSIGN  (segid "   A" and resid 34   and name C   ) (segid "   A" and resid 35   and name N   )
         (segid "   A" and resid 35   and name CA  ) (segid "   A" and resid 35   and name C   )  1.00 -63.65 13.10 2

 ASSIGN  (segid "   A" and resid 36   and name N   ) (segid "   A" and resid 36   and name CA  )
         (segid "   A" and resid 36   and name C   ) (segid "   A" and resid 37   and name N   )  1.00 -39.13 11.58 2

 ASSIGN  (segid "   A" and resid 35   and name C   ) (segid "   A" and resid 36   and name N   )
         (segid "   A" and resid 36   and name CA  ) (segid "   A" and resid 36   and name C   )  1.00 -65.15 12.96 2

 ASSIGN  (segid "   A" and resid 37   and name N   ) (segid "   A" and resid 37   and name CA  )
         (segid "   A" and resid 37   and name C   ) (segid "   A" and resid 38   and name N   )  1.00 -34.52 27.08 2

 ASSIGN  (segid "   A" and resid 36   and name C   ) (segid "   A" and resid 37   and name N   )
         (segid "   A" and resid 37   and name CA  ) (segid "   A" and resid 37   and name C   )  1.00 -67.31 29.51 2

 ASSIGN  (segid "   A" and resid 38   and name N   ) (segid "   A" and resid 38   and name CA  )
         (segid "   A" and resid 38   and name C   ) (segid "   A" and resid 39   and name N   )  1.00 -36.87 22.80 2

 ASSIGN  (segid "   A" and resid 37   and name C   ) (segid "   A" and resid 38   and name N   )
         (segid "   A" and resid 38   and name CA  ) (segid "   A" and resid 38   and name C   )  1.00 -64.35 13.27 2

 ASSIGN  (segid "   A" and resid 39   and name N   ) (segid "   A" and resid 39   and name CA  )
         (segid "   A" and resid 39   and name C   ) (segid "   A" and resid 40   and name N   )  1.00 -35.62 22.07 2

 ASSIGN  (segid "   A" and resid 38   and name C   ) (segid "   A" and resid 39   and name N   )
         (segid "   A" and resid 39   and name CA  ) (segid "   A" and resid 39   and name C   )  1.00 -65.57 12.56 2

 ASSIGN  (segid "   A" and resid 40   and name N   ) (segid "   A" and resid 40   and name CA  )
         (segid "   A" and resid 40   and name C   ) (segid "   A" and resid 41   and name N   )  1.00 -10.73 32.45 2

 ASSIGN  (segid "   A" and resid 39   and name C   ) (segid "   A" and resid 40   and name N   )
         (segid "   A" and resid 40   and name CA  ) (segid "   A" and resid 40   and name C   )  1.00 -92.93 28.39 2

 ASSIGN  (segid "   A" and resid 44   and name N   ) (segid "   A" and resid 44   and name CA  )
         (segid "   A" and resid 44   and name C   ) (segid "   A" and resid 45   and name N   )  1.00 132.51 49.82 2

 ASSIGN  (segid "   A" and resid 43   and name C   ) (segid "   A" and resid 44   and name N   )
         (segid "   A" and resid 44   and name CA  ) (segid "   A" and resid 44   and name C   )  1.00 -96.22 59.82 2

 ASSIGN  (segid "   A" and resid 45   and name N   ) (segid "   A" and resid 45   and name CA  )
         (segid "   A" and resid 45   and name C   ) (segid "   A" and resid 46   and name N   )  1.00 -32.60 20.87 2

 ASSIGN  (segid "   A" and resid 44   and name C   ) (segid "   A" and resid 45   and name N   )
         (segid "   A" and resid 45   and name CA  ) (segid "   A" and resid 45   and name C   )  1.00 -60.46 13.41 2

 ASSIGN  (segid "   A" and resid 46   and name N   ) (segid "   A" and resid 46   and name CA  )
         (segid "   A" and resid 46   and name C   ) (segid "   A" and resid 47   and name N   )  1.00  -0.78 19.22 2

 ASSIGN  (segid "   A" and resid 45   and name C   ) (segid "   A" and resid 46   and name N   )
         (segid "   A" and resid 46   and name CA  ) (segid "   A" and resid 46   and name C   )  1.00 -83.06 25.98 2

 ASSIGN  (segid "   A" and resid 47   and name N   ) (segid "   A" and resid 47   and name CA  )
         (segid "   A" and resid 47   and name C   ) (segid "   A" and resid 48   and name N   )  1.00  -3.80 29.54 2

 ASSIGN  (segid "   A" and resid 46   and name C   ) (segid "   A" and resid 47   and name N   )
         (segid "   A" and resid 47   and name CA  ) (segid "   A" and resid 47   and name C   )  1.00  89.24 16.38 2

 ASSIGN  (segid "   A" and resid 49   and name N   ) (segid "   A" and resid 49   and name CA  )
         (segid "   A" and resid 49   and name C   ) (segid "   A" and resid 50   and name N   )  1.00 133.57 38.35 2

 ASSIGN  (segid "   A" and resid 48   and name C   ) (segid "   A" and resid 49   and name N   )
         (segid "   A" and resid 49   and name CA  ) (segid "   A" and resid 49   and name C   )  1.00 -95.55 57.87 2

 ASSIGN  (segid "   A" and resid 50   and name N   ) (segid "   A" and resid 50   and name CA  )
         (segid "   A" and resid 50   and name C   ) (segid "   A" and resid 51   and name N   )  1.00 125.91 33.16 2

 ASSIGN  (segid "   A" and resid 49   and name C   ) (segid "   A" and resid 50   and name N   )
         (segid "   A" and resid 50   and name CA  ) (segid "   A" and resid 50   and name C   )  1.00 -105.79 30.83 2

 ASSIGN  (segid "   A" and resid 51   and name N   ) (segid "   A" and resid 51   and name CA  )
         (segid "   A" and resid 51   and name C   ) (segid "   A" and resid 52   and name N   )  1.00 132.57 10.47 2

 ASSIGN  (segid "   A" and resid 50   and name C   ) (segid "   A" and resid 51   and name N   )
         (segid "   A" and resid 51   and name CA  ) (segid "   A" and resid 51   and name C   )  1.00 -108.20 29.60 2

 ASSIGN  (segid "   A" and resid 52   and name N   ) (segid "   A" and resid 52   and name CA  )
         (segid "   A" and resid 52   and name C   ) (segid "   A" and resid 53   and name N   )  1.00 122.57 13.30 2

 ASSIGN  (segid "   A" and resid 51   and name C   ) (segid "   A" and resid 52   and name N   )
         (segid "   A" and resid 52   and name CA  ) (segid "   A" and resid 52   and name C   )  1.00 -106.76 27.48 2

 ASSIGN  (segid "   A" and resid 53   and name N   ) (segid "   A" and resid 53   and name CA  )
         (segid "   A" and resid 53   and name C   ) (segid "   A" and resid 54   and name N   )  1.00 143.74 44.49 2

 ASSIGN  (segid "   A" and resid 52   and name C   ) (segid "   A" and resid 53   and name N   )
         (segid "   A" and resid 53   and name CA  ) (segid "   A" and resid 53   and name C   )  1.00 -115.39 41.89 2

 ASSIGN  (segid "   A" and resid 54   and name N   ) (segid "   A" and resid 54   and name CA  )
         (segid "   A" and resid 54   and name C   ) (segid "   A" and resid 55   and name N   )  1.00 122.61 13.64 2

 ASSIGN  (segid "   A" and resid 53   and name C   ) (segid "   A" and resid 54   and name N   )
         (segid "   A" and resid 54   and name CA  ) (segid "   A" and resid 54   and name C   )  1.00 -112.33 24.84 2

 ASSIGN  (segid "   A" and resid 55   and name N   ) (segid "   A" and resid 55   and name CA  )
         (segid "   A" and resid 55   and name C   ) (segid "   A" and resid 56   and name N   )  1.00 166.94 19.84 2

 ASSIGN  (segid "   A" and resid 54   and name C   ) (segid "   A" and resid 55   and name N   )
         (segid "   A" and resid 55   and name CA  ) (segid "   A" and resid 55   and name C   )  1.00 -87.79 44.59 2

 ASSIGN  (segid "   A" and resid 57   and name N   ) (segid "   A" and resid 57   and name CA  )
         (segid "   A" and resid 57   and name C   ) (segid "   A" and resid 58   and name N   )  1.00 -39.03 10.51 2

 ASSIGN  (segid "   A" and resid 56   and name C   ) (segid "   A" and resid 57   and name N   )
         (segid "   A" and resid 57   and name CA  ) (segid "   A" and resid 57   and name C   )  1.00 -66.82 14.98 2

 ASSIGN  (segid "   A" and resid 58   and name N   ) (segid "   A" and resid 58   and name CA  )
         (segid "   A" and resid 58   and name C   ) (segid "   A" and resid 59   and name N   )  1.00 -44.11  8.62 2

 ASSIGN  (segid "   A" and resid 57   and name C   ) (segid "   A" and resid 58   and name N   )
         (segid "   A" and resid 58   and name CA  ) (segid "   A" and resid 58   and name C   )  1.00 -66.03  7.92 2

 ASSIGN  (segid "   A" and resid 59   and name N   ) (segid "   A" and resid 59   and name CA  )
         (segid "   A" and resid 59   and name C   ) (segid "   A" and resid 60   and name N   )  1.00 -41.47  5.50 2

 ASSIGN  (segid "   A" and resid 58   and name C   ) (segid "   A" and resid 59   and name N   )
         (segid "   A" and resid 59   and name CA  ) (segid "   A" and resid 59   and name C   )  1.00 -63.20 10.20 2

 ASSIGN  (segid "   A" and resid 60   and name N   ) (segid "   A" and resid 60   and name CA  )
         (segid "   A" and resid 60   and name C   ) (segid "   A" and resid 61   and name N   )  1.00 -42.97 12.21 2

 ASSIGN  (segid "   A" and resid 59   and name C   ) (segid "   A" and resid 60   and name N   )
         (segid "   A" and resid 60   and name CA  ) (segid "   A" and resid 60   and name C   )  1.00 -65.57 10.23 2

 ASSIGN  (segid "   A" and resid 61   and name N   ) (segid "   A" and resid 61   and name CA  )
         (segid "   A" and resid 61   and name C   ) (segid "   A" and resid 62   and name N   )  1.00 -40.21  6.08 2

 ASSIGN  (segid "   A" and resid 60   and name C   ) (segid "   A" and resid 61   and name N   )
         (segid "   A" and resid 61   and name CA  ) (segid "   A" and resid 61   and name C   )  1.00 -63.01  9.15 2

 ASSIGN  (segid "   A" and resid 62   and name N   ) (segid "   A" and resid 62   and name CA  )
         (segid "   A" and resid 62   and name C   ) (segid "   A" and resid 63   and name N   )  1.00 -39.66 18.56 2

 ASSIGN  (segid "   A" and resid 61   and name C   ) (segid "   A" and resid 62   and name N   )
         (segid "   A" and resid 62   and name CA  ) (segid "   A" and resid 62   and name C   )  1.00 -66.01 20.53 2

 ASSIGN  (segid "   A" and resid 63   and name N   ) (segid "   A" and resid 63   and name CA  )
         (segid "   A" and resid 63   and name C   ) (segid "   A" and resid 64   and name N   )  1.00 -35.79 20.14 2

 ASSIGN  (segid "   A" and resid 62   and name C   ) (segid "   A" and resid 63   and name N   )
         (segid "   A" and resid 63   and name CA  ) (segid "   A" and resid 63   and name C   )  1.00 -61.95 10.66 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLN  -1           H1       GLN  -1  -4.659  12.972  -0.910
    2    H2   GLN  -1           H2       GLN  -1  -5.653  11.746  -1.520
    3    H3   GLN  -1           H3       GLN  -1  -6.313  12.956  -0.546
    4    HA   GLN  -1           HA       GLN  -1  -6.831  13.255  -2.898
    5    HB2  GLN  -1           HB2      GLN  -1  -5.033  15.351  -1.667
    6    HB3  GLN  -1           HB3      GLN  -1  -6.108  15.624  -3.031
    7    HG2  GLN  -1           HG2      GLN  -1  -8.029  15.071  -1.602
    8    HG3  GLN  -1           HG3      GLN  -1  -6.931  14.859  -0.238
    9   HE21  GLN  -1          HE21      GLN  -1  -7.903  16.497   0.941
   10   HE22  GLN  -1          HE22      GLN  -1  -7.708  18.167   0.541
   11    H    SER   0           H        SER   0  -6.194  13.004  -4.919
   12    HA   SER   0           HA       SER   0  -4.923  12.686  -6.751
   13    HB2  SER   0           HB2      SER   0  -2.848  14.265  -5.221
   14    HB3  SER   0           HB3      SER   0  -2.777  13.889  -6.944
   15    HG   SER   0           HG       SER   0  -4.884  14.982  -7.063
   16    H    MET   1           H        MET   1  -5.084  10.593  -5.040
   17    HA   MET   1           HA       MET   1  -2.463   9.321  -5.481
   18    HB2  MET   1           HB2      MET   1  -4.520   8.596  -3.386
   19    HB3  MET   1           HB3      MET   1  -3.026   7.729  -3.685
   20    HG2  MET   1           HG2      MET   1  -1.754   9.738  -3.064
   21    HG3  MET   1           HG3      MET   1  -3.269  10.561  -2.697
   22    HE1  MET   1           HE1      MET   1  -4.601   8.552   0.371
   23    HE2  MET   1           HE2      MET   1  -5.001   8.271  -1.324
   24    HE3  MET   1           HE3      MET   1  -4.864   9.920  -0.711
   25    H    ALA   2           H        ALA   2  -2.512   7.208  -6.313
   26    HA   ALA   2           HA       ALA   2  -5.050   6.517  -7.627
   27    HB1  ALA   2           HB1      ALA   2  -2.264   6.103  -8.696
   28    HB2  ALA   2           HB2      ALA   2  -3.390   7.355  -9.221
   29    HB3  ALA   2           HB3      ALA   2  -3.765   5.656  -9.507
   30    H    LEU   3           H        LEU   3  -1.953   5.146  -6.710
   31    HA   LEU   3           HA       LEU   3  -3.361   2.705  -5.837
   32    HB2  LEU   3           HB2      LEU   3  -0.606   3.024  -7.040
   33    HB3  LEU   3           HB3      LEU   3  -1.086   1.583  -6.170
   34    HG   LEU   3           HG       LEU   3  -2.944   1.306  -7.860
   35   HD11  LEU   3          HD11      LEU   3  -2.993   3.598  -8.691
   36   HD12  LEU   3          HD12      LEU   3  -2.711   2.443  -9.994
   37   HD13  LEU   3          HD13      LEU   3  -1.371   3.393  -9.352
   38   HD21  LEU   3          HD21      LEU   3  -0.080   1.223  -8.786
   39   HD22  LEU   3          HD22      LEU   3  -1.423   0.420  -9.598
   40   HD23  LEU   3          HD23      LEU   3  -0.968  -0.057  -7.962
   41    H    HIS   4           H        HIS   4  -2.507   1.706  -3.915
   42    HA   HIS   4           HA       HIS   4  -1.295   3.689  -2.133
   43    HB2  HIS   4           HB2      HIS   4  -2.633   1.058  -1.559
   44    HB3  HIS   4           HB3      HIS   4  -1.847   2.019  -0.333
   45    HD1  HIS   4           HD1      HIS   4  -4.728   1.426   0.102
   46    HD2  HIS   4           HD2      HIS   4  -3.449   4.732  -2.068
   47    HE1  HIS   4           HE1      HIS   4  -6.620   3.075   0.208
   48    HE2  HIS   4           HE2      HIS   4  -5.925   4.931  -1.347
   49    H    TYR   5           H        TYR   5   0.733   3.591  -1.668
   50    HA   TYR   5           HA       TYR   5   2.303   1.307  -2.576
   51    HB2  TYR   5           HB2      TYR   5   2.920   4.184  -2.007
   52    HB3  TYR   5           HB3      TYR   5   4.220   2.992  -1.936
   53    HD1  TYR   5           HD1      TYR   5   1.523   2.539  -4.379
   54    HD2  TYR   5           HD2      TYR   5   5.398   4.150  -3.700
   55    HE1  TYR   5           HE1      TYR   5   1.862   2.742  -6.805
   56    HE2  TYR   5           HE2      TYR   5   5.753   4.344  -6.112
   57    HH   TYR   5           HH       TYR   5   3.307   4.176  -8.360
   58    H    TYR   6           H        TYR   6   2.985  -0.147  -1.183
   59    HA   TYR   6           HA       TYR   6   3.655   0.736   1.541
   60    HB2  TYR   6           HB2      TYR   6   2.456  -1.948   0.811
   61    HB3  TYR   6           HB3      TYR   6   2.874  -1.391   2.429
   62    HD1  TYR   6           HD1      TYR   6   1.574   0.501   3.443
   63    HD2  TYR   6           HD2      TYR   6   0.380  -1.386  -0.176
   64    HE1  TYR   6           HE1      TYR   6  -0.684   1.443   3.699
   65    HE2  TYR   6           HE2      TYR   6  -1.876  -0.446   0.069
   66    HH   TYR   6           HH       TYR   6  -2.624   1.989   2.368
   67    H    CYS   7           H        CYS   7   5.649   0.033   2.262
   68    HA   CYS   7           HA       CYS   7   7.344  -0.839   0.115
   69    HB2  CYS   7           HB2      CYS   7   7.996   0.931   1.826
   70    HB3  CYS   7           HB3      CYS   7   8.251  -0.395   2.928
   71    H    ARG   8           H        ARG   8   8.259  -2.674  -0.250
   72    HA   ARG   8           HA       ARG   8   7.642  -4.975   1.272
   73    HB2  ARG   8           HB2      ARG   8   9.196  -6.148  -0.181
   74    HB3  ARG   8           HB3      ARG   8   8.188  -5.076  -1.135
   75    HG2  ARG   8           HG2      ARG   8  10.185  -4.626  -2.098
   76    HG3  ARG   8           HG3      ARG   8  10.257  -3.446  -0.782
   77    HD2  ARG   8           HD2      ARG   8  11.489  -5.128   0.576
   78    HD3  ARG   8           HD3      ARG   8  11.516  -6.188  -0.832
   79    HE   ARG   8           HE       ARG   8  12.569  -3.681  -1.524
   80   HH11  ARG   8          HH11      ARG   8  13.367  -6.496   0.383
   81   HH12  ARG   8          HH12      ARG   8  15.080  -6.316   0.177
   82   HH21  ARG   8          HH21      ARG   8  14.840  -3.429  -1.783
   83   HH22  ARG   8          HH22      ARG   8  15.917  -4.577  -1.048
   84    H    HIS   9           H        HIS   9   8.408  -5.484   3.107
   85    HA   HIS   9           HA       HIS   9   9.960  -6.259   4.616
   86    HB2  HIS   9           HB2      HIS   9  11.684  -6.348   2.839
   87    HB3  HIS   9           HB3      HIS   9  12.037  -4.648   3.116
   88    HD1  HIS   9           HD1      HIS   9  14.118  -4.398   4.420
   89    HD2  HIS   9           HD2      HIS   9  11.976  -7.762   5.580
   90    HE1  HIS   9           HE1      HIS   9  15.459  -5.444   6.271
   91    HE2  HIS   9           HE2      HIS   9  14.091  -7.419   7.028
   92    H    CYS  10           H        CYS  10   9.068  -3.115   3.961
   93    HA   CYS  10           HA       CYS  10   9.917  -2.304   6.667
   94    HB2  CYS  10           HB2      CYS  10   9.165  -0.511   4.370
   95    HB3  CYS  10           HB3      CYS  10   9.677   0.022   5.957
   96    H    GLY  11           H        GLY  11   7.281  -2.345   4.333
   97    HA2  GLY  11           HA2      GLY  11   5.000  -2.439   4.748
   98    HA3  GLY  11           HA3      GLY  11   5.337  -2.242   6.476
   99    H    VAL  12           H        VAL  12   7.106   0.110   5.107
  100    HA   VAL  12           HA       VAL  12   5.443   2.124   6.031
  101    HB   VAL  12           HB       VAL  12   7.691   2.677   6.136
  102   HG11  VAL  12          HG11      VAL  12   8.013   2.435   3.170
  103   HG12  VAL  12          HG12      VAL  12   8.329   1.091   4.259
  104   HG13  VAL  12          HG13      VAL  12   9.267   2.572   4.402
  105   HG21  VAL  12          HG21      VAL  12   6.649   4.192   3.777
  106   HG22  VAL  12          HG22      VAL  12   7.901   4.721   4.902
  107   HG23  VAL  12          HG23      VAL  12   6.238   4.531   5.455
  108    H    LYS  13           H        LYS  13   4.010   3.371   5.224
  109    HA   LYS  13           HA       LYS  13   2.892   2.761   2.655
  110    HB2  LYS  13           HB2      LYS  13   2.177   4.938   4.633
  111    HB3  LYS  13           HB3      LYS  13   1.214   4.467   3.244
  112    HG2  LYS  13           HG2      LYS  13   0.180   3.474   5.085
  113    HG3  LYS  13           HG3      LYS  13   1.072   2.167   4.321
  114    HD2  LYS  13           HD2      LYS  13   2.844   2.398   5.976
  115    HD3  LYS  13           HD3      LYS  13   1.998   3.757   6.715
  116    HE2  LYS  13           HE2      LYS  13   1.540   1.866   8.058
  117    HE3  LYS  13           HE3      LYS  13   0.076   2.184   7.133
  118    HZ1  LYS  13           HZ1      LYS  13   0.602   0.394   5.660
  119    HZ2  LYS  13           HZ2      LYS  13   0.710  -0.189   7.244
  120    HZ3  LYS  13           HZ3      LYS  13   2.118   0.165   6.379
  121    H    VAL  14           H        VAL  14   4.189   3.382   1.035
  122    HA   VAL  14           HA       VAL  14   5.886   5.671   1.230
  123    HB   VAL  14           HB       VAL  14   5.499   4.495  -1.452
  124   HG11  VAL  14          HG11      VAL  14   7.949   4.927   0.242
  125   HG12  VAL  14          HG12      VAL  14   7.285   6.091  -0.911
  126   HG13  VAL  14          HG13      VAL  14   7.918   4.545  -1.480
  127   HG21  VAL  14          HG21      VAL  14   6.528   2.824   0.837
  128   HG22  VAL  14          HG22      VAL  14   6.865   2.482  -0.862
  129   HG23  VAL  14          HG23      VAL  14   5.206   2.442  -0.272
  130    H    GLY  15           H        GLY  15   2.847   4.952  -0.392
  131    HA2  GLY  15           HA2      GLY  15   2.950   7.588  -1.703
  132    HA3  GLY  15           HA3      GLY  15   1.937   6.248  -2.211
  133    H    SER  16           H        SER  16   0.745   5.526   0.151
  134    HA   SER  16           HA       SER  16  -1.108   7.726   0.459
  135    HB2  SER  16           HB2      SER  16  -2.299   5.862   1.874
  136    HB3  SER  16           HB3      SER  16  -2.271   5.753   0.114
  137    HG   SER  16           HG       SER  16  -1.192   4.089   1.959
  138    H    LEU  17           H        LEU  17   0.253   9.121   1.659
  139    HA   LEU  17           HA       LEU  17   0.947   8.239   4.363
  140    HB2  LEU  17           HB2      LEU  17   2.533  10.004   4.459
  141    HB3  LEU  17           HB3      LEU  17   2.747   9.220   2.908
  142    HG   LEU  17           HG       LEU  17   1.126  11.742   3.213
  143   HD11  LEU  17          HD11      LEU  17   4.054  11.492   2.572
  144   HD12  LEU  17          HD12      LEU  17   3.372  12.151   4.058
  145   HD13  LEU  17          HD13      LEU  17   3.099  12.973   2.523
  146   HD21  LEU  17          HD21      LEU  17   0.718  10.609   1.145
  147   HD22  LEU  17          HD22      LEU  17   2.443  10.369   0.876
  148   HD23  LEU  17          HD23      LEU  17   1.757  11.992   0.812
  149    H    GLU  18           H        GLU  18  -1.044  10.250   2.513
  150    HA   GLU  18           HA       GLU  18  -1.874  12.110   4.409
  151    HB2  GLU  18           HB2      GLU  18  -3.404  10.896   2.113
  152    HB3  GLU  18           HB3      GLU  18  -3.960  12.278   3.045
  153    HG2  GLU  18           HG2      GLU  18  -2.020  13.559   2.321
  154    HG3  GLU  18           HG3      GLU  18  -1.440  12.169   1.404
  155    H    SER  19           H        SER  19  -2.725   8.818   3.847
  156    HA   SER  19           HA       SER  19  -3.955   8.683   6.466
  157    HB2  SER  19           HB2      SER  19  -5.356   7.530   4.064
  158    HB3  SER  19           HB3      SER  19  -5.940   7.551   5.721
  159    HG   SER  19           HG       SER  19  -5.476  10.045   5.167
  160    H    SER  20           H        SER  20  -2.801   7.191   7.403
  161    HA   SER  20           HA       SER  20  -2.002   4.814   5.871
  162    HB2  SER  20           HB2      SER  20  -0.458   6.116   8.121
  163    HB3  SER  20           HB3      SER  20   0.055   4.726   7.166
  164    HG   SER  20           HG       SER  20  -0.249   6.279   5.305
  165    H    MET  21           H        MET  21  -3.481   6.065   8.733
  166    HA   MET  21           HA       MET  21  -4.396   3.369   9.350
  167    HB2  MET  21           HB2      MET  21  -3.930   3.581  11.730
  168    HB3  MET  21           HB3      MET  21  -2.436   3.620  10.809
  169    HG2  MET  21           HG2      MET  21  -2.368   6.050  11.040
  170    HG3  MET  21           HG3      MET  21  -3.867   6.004  11.965
  171    HE1  MET  21           HE1      MET  21  -1.318   6.911  14.744
  172    HE2  MET  21           HE2      MET  21  -2.881   7.284  14.018
  173    HE3  MET  21           HE3      MET  21  -1.400   7.505  13.085
  174    H    VAL  22           H        VAL  22  -5.262   5.974   8.311
  175    HA   VAL  22           HA       VAL  22  -7.550   6.480  10.057
  176    HB   VAL  22           HB       VAL  22  -7.280   8.914   9.692
  177   HG11  VAL  22          HG11      VAL  22  -4.998   7.552  11.086
  178   HG12  VAL  22          HG12      VAL  22  -6.553   8.000  11.786
  179   HG13  VAL  22          HG13      VAL  22  -5.420   9.252  11.280
  180   HG21  VAL  22          HG21      VAL  22  -5.944   8.935   7.696
  181   HG22  VAL  22          HG22      VAL  22  -4.617   8.138   8.539
  182   HG23  VAL  22          HG23      VAL  22  -5.080   9.782   8.978
  183    H    SER  23           H        SER  23  -7.041   5.103   7.508
  184    HA   SER  23           HA       SER  23  -7.924   6.768   5.364
  185    HB2  SER  23           HB2      SER  23  -7.837   3.749   5.473
  186    HB3  SER  23           HB3      SER  23  -7.823   4.764   4.030
  187    HG   SER  23           HG       SER  23  -5.728   4.060   4.554
  188    H    THR  24           H        THR  24  -9.937   7.506   5.265
  189    HA   THR  24           HA       THR  24 -12.139   6.050   6.433
  190    HB   THR  24           HB       THR  24 -13.488   8.003   5.537
  191    HG1  THR  24           HG1      THR  24 -12.497   9.468   4.362
  192   HG21  THR  24          HG21      THR  24 -11.155   8.591   7.362
  193   HG22  THR  24          HG22      THR  24 -12.713   7.920   7.846
  194   HG23  THR  24          HG23      THR  24 -12.615   9.567   7.223
  195    H    ASP  25           H        ASP  25 -10.521   5.493   3.777
  196    HA   ASP  25           HA       ASP  25 -12.693   5.112   1.895
  197    HB2  ASP  25           HB2      ASP  25 -10.501   5.704   1.029
  198    HB3  ASP  25           HB3      ASP  25  -9.766   4.334   1.844
  199    H    SER  26           H        SER  26 -11.158   3.529   4.432
  200    HA   SER  26           HA       SER  26 -11.699   0.820   3.721
  201    HB2  SER  26           HB2      SER  26  -9.876   1.516   5.251
  202    HB3  SER  26           HB3      SER  26 -11.080   2.060   6.413
  203    HG   SER  26           HG       SER  26 -10.278  -0.057   6.861
  204    H    LEU  27           H        LEU  27 -13.926   0.753   3.219
  205    HA   LEU  27           HA       LEU  27 -15.753   1.210   5.475
  206    HB2  LEU  27           HB2      LEU  27 -16.330   0.800   2.541
  207    HB3  LEU  27           HB3      LEU  27 -17.565   0.924   3.776
  208    HG   LEU  27           HG       LEU  27 -15.641   3.076   2.940
  209   HD11  LEU  27          HD11      LEU  27 -17.427   2.726   1.349
  210   HD12  LEU  27          HD12      LEU  27 -17.684   4.234   2.224
  211   HD13  LEU  27          HD13      LEU  27 -18.621   2.803   2.645
  212   HD21  LEU  27          HD21      LEU  27 -15.990   3.277   5.304
  213   HD22  LEU  27          HD22      LEU  27 -17.727   3.050   5.105
  214   HD23  LEU  27          HD23      LEU  27 -16.954   4.510   4.489
  215    H    GLY  28           H        GLY  28 -15.884  -1.075   2.762
  216    HA2  GLY  28           HA2      GLY  28 -16.472  -3.294   2.710
  217    HA3  GLY  28           HA3      GLY  28 -15.761  -3.428   4.313
  218    H    PHE  29           H        PHE  29 -18.668  -3.469   2.554
  219    HA   PHE  29           HA       PHE  29 -20.353  -2.614   4.692
  220    HB2  PHE  29           HB2      PHE  29 -21.044  -3.999   2.089
  221    HB3  PHE  29           HB3      PHE  29 -22.198  -3.307   3.216
  222    HD1  PHE  29           HD1      PHE  29 -20.272  -0.794   3.720
  223    HD2  PHE  29           HD2      PHE  29 -21.938  -2.690   0.283
  224    HE1  PHE  29           HE1      PHE  29 -20.216   1.340   2.513
  225    HE2  PHE  29           HE2      PHE  29 -21.871  -0.554  -0.924
  226    HZ   PHE  29           HZ       PHE  29 -21.005   1.464   0.185
  227    H    GLN  30           H        GLN  30 -22.181  -4.156   5.167
  228    HA   GLN  30           HA       GLN  30 -21.028  -6.757   5.889
  229    HB2  GLN  30           HB2      GLN  30 -22.138  -6.555   8.116
  230    HB3  GLN  30           HB3      GLN  30 -20.834  -5.414   7.852
  231    HG2  GLN  30           HG2      GLN  30 -22.418  -3.644   7.417
  232    HG3  GLN  30           HG3      GLN  30 -23.758  -4.778   7.578
  233   HE21  GLN  30          HE21      GLN  30 -24.673  -3.605   9.249
  234   HE22  GLN  30          HE22      GLN  30 -23.999  -3.586  10.841
  235    H    HIS  31           H        HIS  31 -24.071  -4.917   5.651
  236    HA   HIS  31           HA       HIS  31 -25.411  -7.494   5.159
  237    HB2  HIS  31           HB2      HIS  31 -25.850  -6.487   7.430
  238    HB3  HIS  31           HB3      HIS  31 -26.640  -5.149   6.610
  239    HD1  HIS  31           HD1      HIS  31 -29.099  -5.407   6.610
  240    HD2  HIS  31           HD2      HIS  31 -27.166  -9.084   6.468
  241    HE1  HIS  31           HE1      HIS  31 -30.925  -7.132   6.623
  242    HE2  HIS  31           HE2      HIS  31 -29.726  -9.342   6.712
  243    H    LEU  32           H        LEU  32 -24.352  -5.222   3.401
  244    HA   LEU  32           HA       LEU  32 -26.817  -4.507   2.025
  245    HB2  LEU  32           HB2      LEU  32 -23.960  -3.892   1.258
  246    HB3  LEU  32           HB3      LEU  32 -25.391  -3.266   0.471
  247    HG   LEU  32           HG       LEU  32 -24.235  -2.526   3.126
  248   HD11  LEU  32          HD11      LEU  32 -23.622  -1.217   1.176
  249   HD12  LEU  32          HD12      LEU  32 -24.609  -0.269   2.288
  250   HD13  LEU  32          HD13      LEU  32 -25.325  -0.931   0.819
  251   HD21  LEU  32          HD21      LEU  32 -27.082  -2.050   2.282
  252   HD22  LEU  32          HD22      LEU  32 -26.281  -1.328   3.678
  253   HD23  LEU  32          HD23      LEU  32 -26.546  -3.071   3.617
  254    H    THR  33           H        THR  33 -26.922  -4.952  -0.373
  255    HA   THR  33           HA       THR  33 -26.644  -7.807  -0.565
  256    HB   THR  33           HB       THR  33 -28.715  -6.560  -1.282
  257    HG1  THR  33           HG1      THR  33 -28.635  -8.610  -2.030
  258   HG21  THR  33          HG21      THR  33 -27.741  -4.716  -2.476
  259   HG22  THR  33          HG22      THR  33 -28.689  -5.679  -3.610
  260   HG23  THR  33          HG23      THR  33 -26.930  -5.816  -3.591
  261    H    ASN  34           H        ASN  34 -26.256  -8.504  -3.027
  262    HA   ASN  34           HA       ASN  34 -23.488  -8.545  -3.274
  263    HB2  ASN  34           HB2      ASN  34 -23.860  -9.626  -5.456
  264    HB3  ASN  34           HB3      ASN  34 -24.900 -10.296  -4.208
  265   HD21  ASN  34          HD21      ASN  34 -25.144 -10.244  -7.136
  266   HD22  ASN  34          HD22      ASN  34 -26.694  -9.551  -7.459
  267    H    GLU  35           H        GLU  35 -25.825  -6.746  -5.275
  268    HA   GLU  35           HA       GLU  35 -23.885  -5.526  -6.903
  269    HB2  GLU  35           HB2      GLU  35 -25.684  -4.023  -7.616
  270    HB3  GLU  35           HB3      GLU  35 -26.192  -5.707  -7.610
  271    HG2  GLU  35           HG2      GLU  35 -27.239  -5.323  -5.406
  272    HG3  GLU  35           HG3      GLU  35 -26.828  -3.619  -5.564
  273    H    GLU  36           H        GLU  36 -25.035  -4.762  -3.733
  274    HA   GLU  36           HA       GLU  36 -24.080  -2.051  -3.734
  275    HB2  GLU  36           HB2      GLU  36 -24.884  -3.928  -1.508
  276    HB3  GLU  36           HB3      GLU  36 -24.430  -2.252  -1.251
  277    HG2  GLU  36           HG2      GLU  36 -26.717  -3.164  -2.971
  278    HG3  GLU  36           HG3      GLU  36 -26.863  -2.617  -1.302
  279    H    ARG  37           H        ARG  37 -22.798  -5.202  -2.993
  280    HA   ARG  37           HA       ARG  37 -20.448  -4.146  -1.672
  281    HB2  ARG  37           HB2      ARG  37 -21.036  -6.976  -2.555
  282    HB3  ARG  37           HB3      ARG  37 -19.746  -6.474  -1.475
  283    HG2  ARG  37           HG2      ARG  37 -21.442  -5.707   0.145
  284    HG3  ARG  37           HG3      ARG  37 -22.704  -6.311  -0.932
  285    HD2  ARG  37           HD2      ARG  37 -21.560  -8.559  -0.799
  286    HD3  ARG  37           HD3      ARG  37 -20.580  -7.886   0.500
  287    HE   ARG  37           HE       ARG  37 -23.401  -7.574   0.941
  288   HH11  ARG  37          HH11      ARG  37 -20.674  -9.745   1.302
  289   HH12  ARG  37          HH12      ARG  37 -21.438 -10.707   2.526
  290   HH21  ARG  37          HH21      ARG  37 -24.403  -8.825   2.572
  291   HH22  ARG  37          HH22      ARG  37 -23.556 -10.176   3.258
  292    H    ASN  38           H        ASN  38 -21.255  -5.642  -4.777
  293    HA   ASN  38           HA       ASN  38 -18.523  -5.759  -5.629
  294    HB2  ASN  38           HB2      ASN  38 -21.124  -6.267  -7.060
  295    HB3  ASN  38           HB3      ASN  38 -19.566  -6.361  -7.873
  296   HD21  ASN  38          HD21      ASN  38 -18.087  -7.967  -7.234
  297   HD22  ASN  38          HD22      ASN  38 -18.611  -9.391  -6.401
  298    H    ASP  39           H        ASP  39 -21.172  -3.488  -6.147
  299    HA   ASP  39           HA       ASP  39 -19.789  -2.082  -8.232
  300    HB2  ASP  39           HB2      ASP  39 -22.232  -1.992  -8.111
  301    HB3  ASP  39           HB3      ASP  39 -22.136  -1.208  -6.535
  302    H    MET  40           H        MET  40 -20.365  -1.523  -4.786
  303    HA   MET  40           HA       MET  40 -18.615   0.784  -4.784
  304    HB2  MET  40           HB2      MET  40 -20.112  -0.609  -2.561
  305    HB3  MET  40           HB3      MET  40 -19.087   0.795  -2.315
  306    HG2  MET  40           HG2      MET  40 -21.279   1.610  -2.407
  307    HG3  MET  40           HG3      MET  40 -20.560   2.005  -3.965
  308    HE1  MET  40           HE1      MET  40 -24.347   1.317  -4.781
  309    HE2  MET  40           HE2      MET  40 -23.021   2.464  -4.955
  310    HE3  MET  40           HE3      MET  40 -23.659   2.094  -3.356
  311    H    ILE  41           H        ILE  41 -17.621  -1.968  -5.403
  312    HA   ILE  41           HA       ILE  41 -16.121  -2.989  -3.251
  313    HB   ILE  41           HB       ILE  41 -16.716  -4.151  -5.434
  314   HG12  ILE  41          HG12      ILE  41 -13.805  -4.337  -4.638
  315   HG13  ILE  41          HG13      ILE  41 -15.125  -5.069  -3.731
  316   HG21  ILE  41          HG21      ILE  41 -14.300  -2.649  -6.424
  317   HG22  ILE  41          HG22      ILE  41 -15.962  -2.433  -6.972
  318   HG23  ILE  41          HG23      ILE  41 -15.121  -3.953  -7.281
  319   HD11  ILE  41          HD11      ILE  41 -14.373  -5.705  -6.573
  320   HD12  ILE  41          HD12      ILE  41 -15.677  -6.454  -5.652
  321   HD13  ILE  41          HD13      ILE  41 -14.001  -6.683  -5.155
  322    H    SER  42           H        SER  42 -13.588  -3.158  -3.526
  323    HA   SER  42           HA       SER  42 -11.518  -2.203  -3.635
  324    HB2  SER  42           HB2      SER  42 -13.021   0.085  -4.869
  325    HB3  SER  42           HB3      SER  42 -11.333   0.240  -4.405
  326    HG   SER  42           HG       SER  42 -12.520  -1.324  -6.415
  327    H    TYR  43           H        TYR  43 -14.194  -0.909  -2.059
  328    HA   TYR  43           HA       TYR  43 -12.889   1.081  -0.494
  329    HB2  TYR  43           HB2      TYR  43 -15.023   1.251   0.626
  330    HB3  TYR  43           HB3      TYR  43 -15.257   1.171  -1.104
  331    HD1  TYR  43           HD1      TYR  43 -14.560  -2.088  -0.572
  332    HD2  TYR  43           HD2      TYR  43 -17.555   0.730   0.517
  333    HE1  TYR  43           HE1      TYR  43 -16.170  -3.918  -0.301
  334    HE2  TYR  43           HE2      TYR  43 -19.165  -1.100   0.795
  335    HH   TYR  43           HH       TYR  43 -19.474  -3.430  -0.069
  336    H    LYS  44           H        LYS  44 -11.366  -1.178  -0.107
  337    HA   LYS  44           HA       LYS  44 -12.259  -2.291   2.460
  338    HB2  LYS  44           HB2      LYS  44 -10.183  -3.339   0.534
  339    HB3  LYS  44           HB3      LYS  44 -10.676  -4.120   2.029
  340    HG2  LYS  44           HG2      LYS  44 -12.940  -4.384   1.152
  341    HG3  LYS  44           HG3      LYS  44 -12.449  -3.595  -0.347
  342    HD2  LYS  44           HD2      LYS  44 -12.433  -5.959  -0.708
  343    HD3  LYS  44           HD3      LYS  44 -10.761  -5.401  -0.662
  344    HE2  LYS  44           HE2      LYS  44 -10.544  -6.174   1.630
  345    HE3  LYS  44           HE3      LYS  44 -12.237  -6.665   1.645
  346    HZ1  LYS  44           HZ1      LYS  44 -11.732  -8.256  -0.119
  347    HZ2  LYS  44           HZ2      LYS  44 -10.806  -8.555   1.262
  348    HZ3  LYS  44           HZ3      LYS  44 -10.103  -7.803  -0.078
  349    H    GLU  45           H        GLU  45 -10.041  -3.104   3.685
  350    HA   GLU  45           HA       GLU  45  -9.074  -0.712   4.802
  351    HB2  GLU  45           HB2      GLU  45  -8.020  -3.529   5.072
  352    HB3  GLU  45           HB3      GLU  45  -7.527  -2.179   6.069
  353    HG2  GLU  45           HG2      GLU  45  -9.892  -1.911   6.769
  354    HG3  GLU  45           HG3      GLU  45 -10.228  -3.402   5.910
  355    H    ASN  46           H        ASN  46  -7.614  -2.954   2.486
  356    HA   ASN  46           HA       ASN  46  -5.157  -1.442   2.386
  357    HB2  ASN  46           HB2      ASN  46  -6.150  -3.682   0.614
  358    HB3  ASN  46           HB3      ASN  46  -4.539  -2.982   0.545
  359   HD21  ASN  46          HD21      ASN  46  -5.421  -5.719   1.114
  360   HD22  ASN  46          HD22      ASN  46  -4.747  -6.115   2.656
  361    H    GLY  47           H        GLY  47  -8.216  -1.282   0.925
  362    HA2  GLY  47           HA2      GLY  47  -9.075   0.363  -0.449
  363    HA3  GLY  47           HA3      GLY  47  -7.452   1.047  -0.576
  364    H    ASP  48           H        ASP  48  -8.024  -2.297  -1.321
  365    HA   ASP  48           HA       ASP  48  -7.904  -3.533  -3.205
  366    HB2  ASP  48           HB2      ASP  48  -9.740  -2.333  -4.136
  367    HB3  ASP  48           HB3      ASP  48  -8.725  -0.951  -4.521
  368    H    VAL  49           H        VAL  49  -6.605  -0.371  -4.223
  369    HA   VAL  49           HA       VAL  49  -4.453  -1.476  -5.635
  370    HB   VAL  49           HB       VAL  49  -3.522   0.862  -5.516
  371   HG11  VAL  49          HG11      VAL  49  -5.260   1.778  -6.996
  372   HG12  VAL  49          HG12      VAL  49  -6.356   0.494  -6.484
  373   HG13  VAL  49          HG13      VAL  49  -4.885   0.098  -7.373
  374   HG21  VAL  49          HG21      VAL  49  -6.167   1.502  -4.186
  375   HG22  VAL  49          HG22      VAL  49  -4.922   2.647  -4.655
  376   HG23  VAL  49          HG23      VAL  49  -4.611   1.495  -3.360
  377    H    HIS  50           H        HIS  50  -3.257  -2.860  -4.481
  378    HA   HIS  50           HA       HIS  50  -1.829  -1.823  -2.130
  379    HB2  HIS  50           HB2      HIS  50  -3.545  -3.521  -1.519
  380    HB3  HIS  50           HB3      HIS  50  -2.770  -4.665  -2.603
  381    HD1  HIS  50           HD1      HIS  50  -1.202  -6.221  -1.485
  382    HD2  HIS  50           HD2      HIS  50  -1.615  -2.668   0.623
  383    HE1  HIS  50           HE1      HIS  50   0.109  -6.533   0.634
  384    HE2  HIS  50           HE2      HIS  50  -0.360  -4.466   1.988
  385    H    VAL  51           H        VAL  51  -0.030  -1.238  -3.288
  386    HA   VAL  51           HA       VAL  51   1.306  -3.389  -4.777
  387    HB   VAL  51           HB       VAL  51   2.594  -1.449  -5.869
  388   HG11  VAL  51          HG11      VAL  51   0.874  -1.132  -7.553
  389   HG12  VAL  51          HG12      VAL  51  -0.358  -1.707  -6.431
  390   HG13  VAL  51          HG13      VAL  51   0.887  -2.814  -7.015
  391   HG21  VAL  51          HG21      VAL  51   0.246   0.064  -4.758
  392   HG22  VAL  51          HG22      VAL  51   1.346   0.662  -5.999
  393   HG23  VAL  51          HG23      VAL  51   1.948   0.326  -4.376
  394    H    LEU  52           H        LEU  52   3.144  -4.117  -4.056
  395    HA   LEU  52           HA       LEU  52   4.365  -2.826  -1.751
  396    HB2  LEU  52           HB2      LEU  52   4.777  -5.542  -3.010
  397    HB3  LEU  52           HB3      LEU  52   5.735  -4.944  -1.668
  398    HG   LEU  52           HG       LEU  52   4.082  -6.445  -0.808
  399   HD11  LEU  52          HD11      LEU  52   2.856  -5.003   0.750
  400   HD12  LEU  52          HD12      LEU  52   3.312  -3.599  -0.211
  401   HD13  LEU  52          HD13      LEU  52   4.554  -4.553   0.599
  402   HD21  LEU  52          HD21      LEU  52   2.452  -6.424  -2.585
  403   HD22  LEU  52          HD22      LEU  52   2.017  -4.755  -2.213
  404   HD23  LEU  52          HD23      LEU  52   1.660  -6.037  -1.057
  405    H    THR  53           H        THR  53   5.972  -1.478  -2.047
  406    HA   THR  53           HA       THR  53   7.727  -1.834  -4.375
  407    HB   THR  53           HB       THR  53   5.940  -0.154  -4.873
  408    HG1  THR  53           HG1      THR  53   7.712   0.236  -6.059
  409   HG21  THR  53          HG21      THR  53   5.686   0.746  -2.606
  410   HG22  THR  53          HG22      THR  53   6.014   2.019  -3.781
  411   HG23  THR  53          HG23      THR  53   7.298   1.455  -2.712
  412    H    ILE  54           H        ILE  54   9.357   0.304  -4.065
  413    HA   ILE  54           HA       ILE  54  10.653  -0.307  -1.507
  414    HB   ILE  54           HB       ILE  54  11.619   0.036  -4.231
  415   HG12  ILE  54          HG12      ILE  54  13.064  -0.985  -1.796
  416   HG13  ILE  54          HG13      ILE  54  11.850  -1.924  -2.641
  417   HG21  ILE  54          HG21      ILE  54  12.365   2.212  -3.441
  418   HG22  ILE  54          HG22      ILE  54  13.732   1.129  -3.696
  419   HG23  ILE  54          HG23      ILE  54  13.156   1.452  -2.062
  420   HD11  ILE  54          HD11      ILE  54  14.073  -2.562  -3.334
  421   HD12  ILE  54          HD12      ILE  54  14.422  -0.898  -3.800
  422   HD13  ILE  54          HD13      ILE  54  13.201  -1.820  -4.675
  423    H    CYS  55           H        CYS  55  10.830   1.182  -0.004
  424    HA   CYS  55           HA       CYS  55   9.687   3.770  -0.373
  425    HB2  CYS  55           HB2      CYS  55  10.067   4.113   1.985
  426    HB3  CYS  55           HB3      CYS  55   9.461   2.483   1.747
  427    H    GLU  56           H        GLU  56  10.872   5.741   0.502
  428    HA   GLU  56           HA       GLU  56  13.034   6.392  -1.100
  429    HB2  GLU  56           HB2      GLU  56  11.601   8.043   0.015
  430    HB3  GLU  56           HB3      GLU  56  12.251   7.569   1.575
  431    HG2  GLU  56           HG2      GLU  56  13.249   9.632   0.867
  432    HG3  GLU  56           HG3      GLU  56  14.462   8.357   0.866
  433    H    ASP  57           H        ASP  57  12.970   5.194   2.220
  434    HA   ASP  57           HA       ASP  57  15.713   5.401   2.768
  435    HB2  ASP  57           HB2      ASP  57  13.953   4.990   4.470
  436    HB3  ASP  57           HB3      ASP  57  13.771   3.354   3.848
  437    H    CYS  58           H        CYS  58  13.825   2.645   1.558
  438    HA   CYS  58           HA       CYS  58  15.977   0.873   1.200
  439    HB2  CYS  58           HB2      CYS  58  13.256   1.091  -0.057
  440    HB3  CYS  58           HB3      CYS  58  14.407  -0.119  -0.610
  441    H    GLN  59           H        GLN  59  14.339   2.982  -1.138
  442    HA   GLN  59           HA       GLN  59  15.879   2.466  -3.370
  443    HB2  GLN  59           HB2      GLN  59  13.786   3.768  -3.387
  444    HB3  GLN  59           HB3      GLN  59  14.617   5.103  -2.602
  445    HG2  GLN  59           HG2      GLN  59  15.993   4.258  -4.998
  446    HG3  GLN  59           HG3      GLN  59  14.323   4.690  -5.323
  447   HE21  GLN  59          HE21      GLN  59  17.410   5.815  -4.277
  448   HE22  GLN  59          HE22      GLN  59  17.049   7.501  -4.357
  449    H    GLU  60           H        GLU  60  16.582   4.603  -0.663
  450    HA   GLU  60           HA       GLU  60  18.703   5.967  -1.907
  451    HB2  GLU  60           HB2      GLU  60  17.506   5.770   0.749
  452    HB3  GLU  60           HB3      GLU  60  19.226   6.032   0.779
  453    HG2  GLU  60           HG2      GLU  60  17.317   7.711  -0.739
  454    HG3  GLU  60           HG3      GLU  60  17.892   8.098   0.871
  455    H    ALA  61           H        ALA  61  18.622   3.155   0.252
  456    HA   ALA  61           HA       ALA  61  21.445   2.795   0.355
  457    HB1  ALA  61           HB1      ALA  61  19.953   1.804   2.026
  458    HB2  ALA  61           HB2      ALA  61  20.909   0.558   1.221
  459    HB3  ALA  61           HB3      ALA  61  19.216   0.793   0.782
  460    H    LEU  62           H        LEU  62  18.869   1.822  -1.661
  461    HA   LEU  62           HA       LEU  62  20.078  -0.114  -3.265
  462    HB2  LEU  62           HB2      LEU  62  17.632   1.222  -2.974
  463    HB3  LEU  62           HB3      LEU  62  18.133   1.519  -4.626
  464    HG   LEU  62           HG       LEU  62  18.556  -1.025  -4.638
  465   HD11  LEU  62          HD11      LEU  62  18.225  -1.458  -2.307
  466   HD12  LEU  62          HD12      LEU  62  16.962  -2.271  -3.231
  467   HD13  LEU  62          HD13      LEU  62  16.602  -0.771  -2.376
  468   HD21  LEU  62          HD21      LEU  62  15.829   0.231  -4.746
  469   HD22  LEU  62          HD22      LEU  62  16.174  -1.405  -5.307
  470   HD23  LEU  62          HD23      LEU  62  16.945  -0.024  -6.087
  471    H    ASP  63           H        ASP  63  19.352   3.256  -3.955
  472    HA   ASP  63           HA       ASP  63  20.639   3.483  -6.402
  473    HB2  ASP  63           HB2      ASP  63  19.034   5.122  -5.661
  474    HB3  ASP  63           HB3      ASP  63  20.049   5.577  -4.301
  475    H    ARG  64           H        ARG  64  21.901   3.984  -3.133
  476    HA   ARG  64           HA       ARG  64  24.440   4.934  -3.869
  477    HB2  ARG  64           HB2      ARG  64  23.710   5.076  -1.570
  478    HB3  ARG  64           HB3      ARG  64  23.574   3.327  -1.458
  479    HG2  ARG  64           HG2      ARG  64  25.920   3.047  -1.519
  480    HG3  ARG  64           HG3      ARG  64  26.180   4.726  -1.990
  481    HD2  ARG  64           HD2      ARG  64  25.029   3.803   0.640
  482    HD3  ARG  64           HD3      ARG  64  26.690   4.338   0.384
  483    HE   ARG  64           HE       ARG  64  25.626   6.518  -0.337
  484   HH11  ARG  64          HH11      ARG  64  24.172   4.389   2.032
  485   HH12  ARG  64          HH12      ARG  64  23.258   5.647   2.788
  486   HH21  ARG  64          HH21      ARG  64  24.426   8.179   0.666
  487   HH22  ARG  64          HH22      ARG  64  23.405   7.810   2.020
  488    H    ASN  65           H        ASN  65  23.611   1.623  -2.818
  489    HA   ASN  65           HA       ASN  65  25.007   0.461  -5.030
  490    HB2  ASN  65           HB2      ASN  65  26.908   1.034  -3.511
  491    HB3  ASN  65           HB3      ASN  65  26.180   0.014  -2.273
  492   HD21  ASN  65          HD21      ASN  65  27.880   0.090  -5.288
  493   HD22  ASN  65          HD22      ASN  65  28.241  -1.599  -5.363
  494    HA   PRO  66           HA       PRO  66  21.690  -2.375  -4.286
  495    HB2  PRO  66           HB2      PRO  66  23.505  -4.219  -5.756
  496    HB3  PRO  66           HB3      PRO  66  21.808  -3.831  -6.055
  497    HG2  PRO  66           HG2      PRO  66  23.727  -2.820  -7.593
  498    HG3  PRO  66           HG3      PRO  66  22.315  -1.849  -7.138
  499    HD2  PRO  66           HD2      PRO  66  25.111  -1.729  -6.112
  500    HD3  PRO  66           HD3      PRO  66  23.938  -0.422  -6.362
  501    H    HIS  67           H        HIS  67  25.000  -3.048  -3.412
  502    HA   HIS  67           HA       HIS  67  24.293  -5.453  -1.955
  503    HB2  HIS  67           HB2      HIS  67  26.912  -3.956  -2.181
  504    HB3  HIS  67           HB3      HIS  67  26.698  -5.439  -1.256
  505    HD1  HIS  67           HD1      HIS  67  26.760  -7.622  -2.531
  506    HD2  HIS  67           HD2      HIS  67  26.664  -4.297  -5.021
  507    HE1  HIS  67           HE1      HIS  67  27.163  -8.504  -4.848
  508    HE2  HIS  67           HE2      HIS  67  27.110  -6.477  -6.340
  509    H    TYR  68           H        TYR  68  22.666  -3.992  -0.849
  510    HA   TYR  68           HA       TYR  68  23.748  -2.437   1.356
  511    HB2  TYR  68           HB2      TYR  68  21.379  -1.932   1.853
  512    HB3  TYR  68           HB3      TYR  68  21.786  -1.566   0.181
  513    HD1  TYR  68           HD1      TYR  68  20.179  -4.136   2.334
  514    HD2  TYR  68           HD2      TYR  68  20.544  -2.511  -1.578
  515    HE1  TYR  68           HE1      TYR  68  18.324  -5.549   1.593
  516    HE2  TYR  68           HE2      TYR  68  18.677  -3.917  -2.337
  517    HH   TYR  68           HH       TYR  68  17.606  -6.089  -1.639
  518    H    HIS  69           H        HIS  69  24.051  -5.391   1.082
  519    HA   HIS  69           HA       HIS  69  24.273  -7.134   2.508
  520    HB2  HIS  69           HB2      HIS  69  22.901  -5.280   4.427
  521    HB3  HIS  69           HB3      HIS  69  23.174  -6.968   4.833
  522    HD1  HIS  69           HD1      HIS  69  24.722  -3.743   5.084
  523    HD2  HIS  69           HD2      HIS  69  26.088  -7.631   4.560
  524    HE1  HIS  69           HE1      HIS  69  27.161  -3.687   5.682
  525    HE2  HIS  69           HE2      HIS  69  27.924  -6.082   5.516
  526    H    GLU  70           H        GLU  70  23.048  -8.188   0.931
  527    HA   GLU  70           HA       GLU  70  20.225  -8.548   1.276
  528    HB2  GLU  70           HB2      GLU  70  20.515 -10.338  -0.452
  529    HB3  GLU  70           HB3      GLU  70  21.096  -8.757  -0.947
  530    HG2  GLU  70           HG2      GLU  70  23.401  -9.487  -0.391
  531    HG3  GLU  70           HG3      GLU  70  22.767 -11.091  -0.037
  532    H    TYR  71           H        TYR  71  19.669  -9.393   3.175
  533    HA   TYR  71           HA       TYR  71  21.218 -11.235   4.636
  534    HB2  TYR  71           HB2      TYR  71  19.134 -11.447   6.053
  535    HB3  TYR  71           HB3      TYR  71  19.757  -9.815   5.850
  536    HD1  TYR  71           HD1      TYR  71  18.483  -8.136   4.711
  537    HD2  TYR  71           HD2      TYR  71  17.061 -12.146   4.893
  538    HE1  TYR  71           HE1      TYR  71  16.279  -7.384   3.926
  539    HE2  TYR  71           HE2      TYR  71  14.850 -11.398   4.116
  540    HH   TYR  71           HH       TYR  71  14.305  -8.440   2.701
  541    H    HIS  72           H        HIS  72  18.418 -11.705   2.508
  542    HA   HIS  72           HA       HIS  72  17.356 -13.567   1.741
  543    HB2  HIS  72           HB2      HIS  72  20.044 -14.816   2.302
  544    HB3  HIS  72           HB3      HIS  72  18.715 -15.675   1.549
  545    HD1  HIS  72           HD1      HIS  72  18.359 -15.324  -0.931
  546    HD2  HIS  72           HD2      HIS  72  21.178 -12.742   0.696
  547    HE1  HIS  72           HE1      HIS  72  19.482 -14.224  -2.896
  548    HE2  HIS  72           HE2      HIS  72  21.195 -12.663  -1.890
  549    H    THR  73           H        THR  73  15.883 -13.555   3.507
  550    HA   THR  73           HA       THR  73  16.124 -15.955   5.130
  551    HB   THR  73           HB       THR  73  15.484 -13.294   6.426
  552    HG1  THR  73           HG1      THR  73  17.870 -14.510   5.901
  553   HG21  THR  73          HG21      THR  73  15.646 -14.569   8.519
  554   HG22  THR  73          HG22      THR  73  15.937 -16.044   7.597
  555   HG23  THR  73          HG23      THR  73  14.384 -15.219   7.472
  Start of MODEL    2
    1    H1   GLN  -1           H1       GLN  -1  -5.603  13.064 -11.375
    2    H2   GLN  -1           H2       GLN  -1  -6.161  13.790  -9.954
    3    H3   GLN  -1           H3       GLN  -1  -7.177  12.769 -10.834
    4    HA   GLN  -1           HA       GLN  -1  -6.324  11.673  -8.866
    5    HB2  GLN  -1           HB2      GLN  -1  -5.203  10.583 -11.458
    6    HB3  GLN  -1           HB3      GLN  -1  -5.429   9.659  -9.981
    7    HG2  GLN  -1           HG2      GLN  -1  -7.643  10.988 -11.521
    8    HG3  GLN  -1           HG3      GLN  -1  -7.193   9.291 -11.665
    9   HE21  GLN  -1          HE21      GLN  -1  -7.713   7.873 -10.042
   10   HE22  GLN  -1          HE22      GLN  -1  -8.789   8.278  -8.747
   11    H    SER   0           H        SER   0  -4.833  13.203  -7.839
   12    HA   SER   0           HA       SER   0  -2.038  13.055  -8.480
   13    HB2  SER   0           HB2      SER   0  -3.369  14.007  -5.930
   14    HB3  SER   0           HB3      SER   0  -1.708  14.333  -6.425
   15    HG   SER   0           HG       SER   0  -3.381  15.058  -8.390
   16    H    MET   1           H        MET   1  -4.281  11.361  -6.455
   17    HA   MET   1           HA       MET   1  -2.180   9.403  -5.853
   18    HB2  MET   1           HB2      MET   1  -2.504  10.521  -3.789
   19    HB3  MET   1           HB3      MET   1  -4.252  10.501  -3.952
   20    HG2  MET   1           HG2      MET   1  -4.174   8.032  -3.737
   21    HG3  MET   1           HG3      MET   1  -2.440   8.150  -3.447
   22    HE1  MET   1           HE1      MET   1  -3.816   7.272   0.109
   23    HE2  MET   1           HE2      MET   1  -2.599   6.885  -1.105
   24    HE3  MET   1           HE3      MET   1  -4.308   6.639  -1.463
   25    H    ALA   2           H        ALA   2  -2.832   7.291  -5.876
   26    HA   ALA   2           HA       ALA   2  -5.605   6.706  -6.554
   27    HB1  ALA   2           HB1      ALA   2  -4.552   7.100  -8.712
   28    HB2  ALA   2           HB2      ALA   2  -4.988   5.402  -8.529
   29    HB3  ALA   2           HB3      ALA   2  -3.311   5.907  -8.331
   30    H    LEU   3           H        LEU   3  -2.525   5.000  -6.669
   31    HA   LEU   3           HA       LEU   3  -3.761   2.742  -5.315
   32    HB2  LEU   3           HB2      LEU   3  -1.066   3.022  -6.638
   33    HB3  LEU   3           HB3      LEU   3  -1.611   1.576  -5.837
   34    HG   LEU   3           HG       LEU   3  -3.587   1.641  -7.490
   35   HD11  LEU   3          HD11      LEU   3  -3.182   3.871  -8.284
   36   HD12  LEU   3          HD12      LEU   3  -3.046   2.711  -9.606
   37   HD13  LEU   3          HD13      LEU   3  -1.594   3.395  -8.870
   38   HD21  LEU   3          HD21      LEU   3  -0.785   1.013  -8.397
   39   HD22  LEU   3          HD22      LEU   3  -2.259   0.449  -9.181
   40   HD23  LEU   3          HD23      LEU   3  -1.875  -0.073  -7.540
   41    H    HIS   4           H        HIS   4  -2.766   1.680  -3.535
   42    HA   HIS   4           HA       HIS   4  -1.490   3.597  -1.718
   43    HB2  HIS   4           HB2      HIS   4  -2.803   0.937  -1.278
   44    HB3  HIS   4           HB3      HIS   4  -1.852   1.707  -0.034
   45    HD1  HIS   4           HD1      HIS   4  -3.252   2.849   1.607
   46    HD2  HIS   4           HD2      HIS   4  -4.960   2.951  -2.180
   47    HE1  HIS   4           HE1      HIS   4  -5.456   4.014   1.894
   48    HE2  HIS   4           HE2      HIS   4  -6.561   3.862  -0.359
   49    H    TYR   5           H        TYR   5   0.565   3.523  -1.420
   50    HA   TYR   5           HA       TYR   5   2.130   1.271  -2.418
   51    HB2  TYR   5           HB2      TYR   5   2.790   4.118  -1.718
   52    HB3  TYR   5           HB3      TYR   5   4.066   2.904  -1.836
   53    HD1  TYR   5           HD1      TYR   5   1.291   2.467  -4.124
   54    HD2  TYR   5           HD2      TYR   5   5.028   4.397  -3.548
   55    HE1  TYR   5           HE1      TYR   5   1.447   2.868  -6.542
   56    HE2  TYR   5           HE2      TYR   5   5.205   4.796  -5.953
   57    HH   TYR   5           HH       TYR   5   4.305   3.844  -8.062
   58    H    TYR   6           H        TYR   6   2.975  -0.175  -1.093
   59    HA   TYR   6           HA       TYR   6   3.669   0.662   1.641
   60    HB2  TYR   6           HB2      TYR   6   2.513  -2.029   0.863
   61    HB3  TYR   6           HB3      TYR   6   3.009  -1.543   2.480
   62    HD1  TYR   6           HD1      TYR   6   0.365  -1.485   0.022
   63    HD2  TYR   6           HD2      TYR   6   1.714   0.286   3.658
   64    HE1  TYR   6           HE1      TYR   6  -1.897  -0.641   0.447
   65    HE2  TYR   6           HE2      TYR   6  -0.559   1.125   4.085
   66    HH   TYR   6           HH       TYR   6  -3.261   0.035   2.473
   67    H    CYS   7           H        CYS   7   5.695  -0.046   2.332
   68    HA   CYS   7           HA       CYS   7   7.367  -0.683   0.093
   69    HB2  CYS   7           HB2      CYS   7   8.077   1.007   1.782
   70    HB3  CYS   7           HB3      CYS   7   8.295  -0.287   2.922
   71    H    ARG   8           H        ARG   8   8.381  -2.391  -0.415
   72    HA   ARG   8           HA       ARG   8   8.155  -4.928   0.671
   73    HB2  ARG   8           HB2      ARG   8   9.083  -4.521  -1.533
   74    HB3  ARG   8           HB3      ARG   8  10.412  -3.600  -0.846
   75    HG2  ARG   8           HG2      ARG   8  10.951  -5.824   0.393
   76    HG3  ARG   8           HG3      ARG   8   9.974  -6.547  -0.893
   77    HD2  ARG   8           HD2      ARG   8  12.352  -6.522  -1.480
   78    HD3  ARG   8           HD3      ARG   8  11.408  -5.515  -2.577
   79    HE   ARG   8           HE       ARG   8  12.563  -3.687  -1.835
   80   HH11  ARG   8          HH11      ARG   8  13.076  -6.329   0.399
   81   HH12  ARG   8          HH12      ARG   8  14.277  -5.476   1.331
   82   HH21  ARG   8          HH21      ARG   8  14.162  -2.568  -0.593
   83   HH22  ARG   8          HH22      ARG   8  14.878  -3.359   0.776
   84    H    HIS   9           H        HIS   9   8.613  -5.470   2.674
   85    HA   HIS   9           HA       HIS   9   9.988  -6.218   4.349
   86    HB2  HIS   9           HB2      HIS   9  11.979  -6.141   3.004
   87    HB3  HIS   9           HB3      HIS   9  12.056  -4.389   3.118
   88    HD1  HIS   9           HD1      HIS   9  14.427  -4.464   4.109
   89    HD2  HIS   9           HD2      HIS   9  11.590  -6.475   6.397
   90    HE1  HIS   9           HE1      HIS   9  15.512  -4.872   6.345
   91    HE2  HIS   9           HE2      HIS   9  13.723  -5.945   7.755
   92    H    CYS  10           H        CYS  10  10.193  -2.696   3.782
   93    HA   CYS  10           HA       CYS  10  10.269  -2.090   6.563
   94    HB2  CYS  10           HB2      CYS  10   9.386  -0.335   4.285
   95    HB3  CYS  10           HB3      CYS  10   9.806   0.216   5.895
   96    H    GLY  11           H        GLY  11   7.705  -2.388   4.178
   97    HA2  GLY  11           HA2      GLY  11   5.430  -2.616   4.464
   98    HA3  GLY  11           HA3      GLY  11   5.686  -2.568   6.218
   99    H    VAL  12           H        VAL  12   7.238   0.025   4.808
  100    HA   VAL  12           HA       VAL  12   5.459   1.820   6.027
  101    HB   VAL  12           HB       VAL  12   7.700   2.464   6.152
  102   HG11  VAL  12          HG11      VAL  12   8.520   1.225   4.201
  103   HG12  VAL  12          HG12      VAL  12   9.122   2.874   4.235
  104   HG13  VAL  12          HG13      VAL  12   7.807   2.439   3.145
  105   HG21  VAL  12          HG21      VAL  12   7.742   4.655   5.155
  106   HG22  VAL  12          HG22      VAL  12   6.144   4.302   5.809
  107   HG23  VAL  12          HG23      VAL  12   6.432   4.195   4.074
  108    H    LYS  13           H        LYS  13   3.980   3.125   5.293
  109    HA   LYS  13           HA       LYS  13   2.839   2.606   2.728
  110    HB2  LYS  13           HB2      LYS  13   2.181   4.810   4.686
  111    HB3  LYS  13           HB3      LYS  13   1.180   4.293   3.348
  112    HG2  LYS  13           HG2      LYS  13   0.152   3.291   5.126
  113    HG3  LYS  13           HG3      LYS  13   1.200   2.000   4.566
  114    HD2  LYS  13           HD2      LYS  13   1.298   2.121   6.966
  115    HD3  LYS  13           HD3      LYS  13   2.842   2.647   6.305
  116    HE2  LYS  13           HE2      LYS  13   2.229   4.122   8.099
  117    HE3  LYS  13           HE3      LYS  13   2.096   5.004   6.581
  118    HZ1  LYS  13           HZ1      LYS  13   0.217   5.431   8.040
  119    HZ2  LYS  13           HZ2      LYS  13  -0.167   3.785   8.069
  120    HZ3  LYS  13           HZ3      LYS  13  -0.294   4.655   6.627
  121    H    VAL  14           H        VAL  14   4.244   3.210   1.124
  122    HA   VAL  14           HA       VAL  14   5.723   5.662   1.201
  123    HB   VAL  14           HB       VAL  14   5.365   4.466  -1.465
  124   HG11  VAL  14          HG11      VAL  14   7.806   4.625  -1.482
  125   HG12  VAL  14          HG12      VAL  14   7.780   5.097   0.218
  126   HG13  VAL  14          HG13      VAL  14   7.046   6.144  -1.006
  127   HG21  VAL  14          HG21      VAL  14   6.584   2.822   0.745
  128   HG22  VAL  14          HG22      VAL  14   6.855   2.539  -0.975
  129   HG23  VAL  14          HG23      VAL  14   5.235   2.380  -0.302
  130    H    GLY  15           H        GLY  15   2.594   4.738   0.196
  131    HA2  GLY  15           HA2      GLY  15   2.307   7.210  -1.389
  132    HA3  GLY  15           HA3      GLY  15   1.368   5.751  -1.656
  133    H    SER  16           H        SER  16   1.950   6.709   1.603
  134    HA   SER  16           HA       SER  16  -0.461   8.300   1.745
  135    HB2  SER  16           HB2      SER  16  -1.182   5.910   1.984
  136    HB3  SER  16           HB3      SER  16  -0.233   5.827   3.465
  137    HG   SER  16           HG       SER  16  -2.112   7.895   3.138
  138    H    LEU  17           H        LEU  17   1.229   9.758   2.145
  139    HA   LEU  17           HA       LEU  17   1.862   9.910   4.998
  140    HB2  LEU  17           HB2      LEU  17   4.109  10.710   4.588
  141    HB3  LEU  17           HB3      LEU  17   3.907   9.128   3.871
  142    HG   LEU  17           HG       LEU  17   3.682  11.650   2.234
  143   HD11  LEU  17          HD11      LEU  17   5.869  11.629   3.336
  144   HD12  LEU  17          HD12      LEU  17   6.009  11.340   1.602
  145   HD13  LEU  17          HD13      LEU  17   6.152   9.996   2.733
  146   HD21  LEU  17          HD21      LEU  17   2.785   9.600   1.236
  147   HD22  LEU  17          HD22      LEU  17   4.328   8.791   1.508
  148   HD23  LEU  17          HD23      LEU  17   4.229  10.149   0.388
  149    H    GLU  18           H        GLU  18   1.166  11.330   1.999
  150    HA   GLU  18           HA       GLU  18   0.995  14.030   3.116
  151    HB2  GLU  18           HB2      GLU  18   0.294  14.298   0.496
  152    HB3  GLU  18           HB3      GLU  18   1.937  14.441   1.098
  153    HG2  GLU  18           HG2      GLU  18   1.819  13.031  -0.889
  154    HG3  GLU  18           HG3      GLU  18   2.388  12.131   0.511
  155    H    SER  19           H        SER  19  -0.840  11.337   2.107
  156    HA   SER  19           HA       SER  19  -3.339  12.667   1.694
  157    HB2  SER  19           HB2      SER  19  -4.072  10.135   1.904
  158    HB3  SER  19           HB3      SER  19  -3.184  10.711   0.504
  159    HG   SER  19           HG       SER  19  -1.408   9.709   1.146
  160    H    SER  20           H        SER  20  -1.626  11.470   4.360
  161    HA   SER  20           HA       SER  20  -3.541  10.631   6.147
  162    HB2  SER  20           HB2      SER  20  -1.131  12.289   6.899
  163    HB3  SER  20           HB3      SER  20  -1.942  11.066   7.876
  164    HG   SER  20           HG       SER  20  -1.155   9.482   6.554
  165    H    MET  21           H        MET  21  -2.718  13.946   5.254
  166    HA   MET  21           HA       MET  21  -4.605  14.920   7.296
  167    HB2  MET  21           HB2      MET  21  -2.335  16.332   5.897
  168    HB3  MET  21           HB3      MET  21  -3.504  17.139   6.928
  169    HG2  MET  21           HG2      MET  21  -2.803  15.727   8.807
  170    HG3  MET  21           HG3      MET  21  -1.597  14.970   7.767
  171    HE1  MET  21           HE1      MET  21   0.336  15.547   9.470
  172    HE2  MET  21           HE2      MET  21  -0.837  16.288  10.560
  173    HE3  MET  21           HE3      MET  21   0.629  17.162  10.115
  174    H    VAL  22           H        VAL  22  -4.949  13.867   4.485
  175    HA   VAL  22           HA       VAL  22  -6.406  16.157   3.354
  176    HB   VAL  22           HB       VAL  22  -5.157  13.779   1.963
  177   HG11  VAL  22          HG11      VAL  22  -7.278  14.363   0.930
  178   HG12  VAL  22          HG12      VAL  22  -5.916  14.771  -0.112
  179   HG13  VAL  22          HG13      VAL  22  -6.749  16.038   0.787
  180   HG21  VAL  22          HG21      VAL  22  -4.559  16.727   1.809
  181   HG22  VAL  22          HG22      VAL  22  -3.777  15.464   0.857
  182   HG23  VAL  22          HG23      VAL  22  -3.569  15.507   2.608
  183    H    SER  23           H        SER  23  -8.554  15.965   3.194
  184    HA   SER  23           HA       SER  23  -9.887  13.729   4.315
  185    HB2  SER  23           HB2      SER  23 -11.015  15.990   2.649
  186    HB3  SER  23           HB3      SER  23 -11.938  14.909   3.696
  187    HG   SER  23           HG       SER  23  -9.851  16.058   5.011
  188    H    THR  24           H        THR  24 -10.082  11.820   3.364
  189    HA   THR  24           HA       THR  24  -9.569  11.259   0.682
  190    HB   THR  24           HB       THR  24 -11.331   9.586   2.474
  191    HG1  THR  24           HG1      THR  24  -9.125   8.634   2.969
  192   HG21  THR  24          HG21      THR  24 -11.132   8.823   0.152
  193   HG22  THR  24          HG22      THR  24 -10.310   7.718   1.254
  194   HG23  THR  24          HG23      THR  24  -9.373   8.859   0.288
  195    H    ASP  25           H        ASP  25 -10.700  11.766  -1.059
  196    HA   ASP  25           HA       ASP  25 -13.544  12.425  -0.799
  197    HB2  ASP  25           HB2      ASP  25 -13.319  13.534  -2.940
  198    HB3  ASP  25           HB3      ASP  25 -12.000  14.054  -1.896
  199    H    SER  26           H        SER  26 -11.435  10.044  -2.007
  200    HA   SER  26           HA       SER  26 -12.995   9.034  -4.133
  201    HB2  SER  26           HB2      SER  26 -10.595   8.602  -3.947
  202    HB3  SER  26           HB3      SER  26 -10.852   7.703  -2.458
  203    HG   SER  26           HG       SER  26 -12.108   6.962  -4.887
  204    H    LEU  27           H        LEU  27 -12.189   6.884  -1.476
  205    HA   LEU  27           HA       LEU  27 -13.393   5.504  -0.158
  206    HB2  LEU  27           HB2      LEU  27 -15.633   7.470  -0.589
  207    HB3  LEU  27           HB3      LEU  27 -15.552   6.261   0.665
  208    HG   LEU  27           HG       LEU  27 -13.601   8.541   0.410
  209   HD11  LEU  27          HD11      LEU  27 -14.811   9.572   2.261
  210   HD12  LEU  27          HD12      LEU  27 -16.019   8.288   2.196
  211   HD13  LEU  27          HD13      LEU  27 -15.842   9.404   0.841
  212   HD21  LEU  27          HD21      LEU  27 -13.078   7.930   2.735
  213   HD22  LEU  27          HD22      LEU  27 -12.721   6.640   1.586
  214   HD23  LEU  27          HD23      LEU  27 -14.168   6.551   2.587
  215    H    GLY  28           H        GLY  28 -14.965   3.833  -0.186
  216    HA2  GLY  28           HA2      GLY  28 -15.902   3.124  -2.841
  217    HA3  GLY  28           HA3      GLY  28 -16.003   2.130  -1.392
  218    H    PHE  29           H        PHE  29 -17.107   5.412  -1.332
  219    HA   PHE  29           HA       PHE  29 -19.822   4.826  -1.939
  220    HB2  PHE  29           HB2      PHE  29 -20.713   5.411   0.295
  221    HB3  PHE  29           HB3      PHE  29 -19.778   3.925   0.326
  222    HD1  PHE  29           HD1      PHE  29 -19.968   7.387   1.441
  223    HD2  PHE  29           HD2      PHE  29 -17.637   3.830   1.466
  224    HE1  PHE  29           HE1      PHE  29 -18.633   8.278   3.302
  225    HE2  PHE  29           HE2      PHE  29 -16.294   4.717   3.322
  226    HZ   PHE  29           HZ       PHE  29 -16.790   6.947   4.244
  227    H    GLN  30           H        GLN  30 -21.161   6.839  -1.456
  228    HA   GLN  30           HA       GLN  30 -19.557   9.068  -2.465
  229    HB2  GLN  30           HB2      GLN  30 -21.702  10.043  -3.202
  230    HB3  GLN  30           HB3      GLN  30 -21.430   8.436  -3.857
  231    HG2  GLN  30           HG2      GLN  30 -22.996   7.479  -2.322
  232    HG3  GLN  30           HG3      GLN  30 -23.153   9.003  -1.460
  233   HE21  GLN  30          HE21      GLN  30 -23.017   8.814  -4.956
  234   HE22  GLN  30          HE22      GLN  30 -24.664   9.257  -5.225
  235    H    HIS  31           H        HIS  31 -22.058   8.434  -0.043
  236    HA   HIS  31           HA       HIS  31 -20.860  10.018   1.931
  237    HB2  HIS  31           HB2      HIS  31 -21.737  11.842   0.380
  238    HB3  HIS  31           HB3      HIS  31 -23.358  11.294   0.797
  239    HD1  HIS  31           HD1      HIS  31 -24.288  11.990   3.064
  240    HD2  HIS  31           HD2      HIS  31 -20.317  13.083   2.510
  241    HE1  HIS  31           HE1      HIS  31 -23.739  13.531   4.972
  242    HE2  HIS  31           HE2      HIS  31 -21.390  14.313   4.513
  243    H    LEU  32           H        LEU  32 -21.535   7.602   2.170
  244    HA   LEU  32           HA       LEU  32 -24.287   7.182   2.897
  245    HB2  LEU  32           HB2      LEU  32 -21.846   5.487   2.653
  246    HB3  LEU  32           HB3      LEU  32 -23.153   4.907   3.648
  247    HG   LEU  32           HG       LEU  32 -24.663   4.813   1.804
  248   HD11  LEU  32          HD11      LEU  32 -24.055   6.873   0.669
  249   HD12  LEU  32          HD12      LEU  32 -24.045   5.516  -0.458
  250   HD13  LEU  32          HD13      LEU  32 -22.526   6.160   0.161
  251   HD21  LEU  32          HD21      LEU  32 -23.141   2.940   1.979
  252   HD22  LEU  32          HD22      LEU  32 -21.958   3.778   0.977
  253   HD23  LEU  32          HD23      LEU  32 -23.503   3.277   0.287
  254    H    THR  33           H        THR  33 -24.256   5.633   5.120
  255    HA   THR  33           HA       THR  33 -24.133   7.648   7.083
  256    HB   THR  33           HB       THR  33 -24.622   5.569   8.608
  257    HG1  THR  33           HG1      THR  33 -25.664   4.459   6.267
  258   HG21  THR  33          HG21      THR  33 -26.519   6.631   6.520
  259   HG22  THR  33          HG22      THR  33 -26.246   7.285   8.135
  260   HG23  THR  33          HG23      THR  33 -27.001   5.705   7.940
  261    H    ASN  34           H        ASN  34 -23.215   7.142   9.282
  262    HA   ASN  34           HA       ASN  34 -20.415   7.165   9.152
  263    HB2  ASN  34           HB2      ASN  34 -22.080   6.471  11.586
  264    HB3  ASN  34           HB3      ASN  34 -20.429   7.077  11.581
  265   HD21  ASN  34          HD21      ASN  34 -23.771   7.865  11.276
  266   HD22  ASN  34          HD22      ASN  34 -23.583   9.585  11.278
  267    H    GLU  35           H        GLU  35 -22.725   4.627   9.834
  268    HA   GLU  35           HA       GLU  35 -20.941   2.684  10.773
  269    HB2  GLU  35           HB2      GLU  35 -22.742   1.068  10.195
  270    HB3  GLU  35           HB3      GLU  35 -23.284   2.432  11.165
  271    HG2  GLU  35           HG2      GLU  35 -24.170   3.509   9.181
  272    HG3  GLU  35           HG3      GLU  35 -23.589   2.172   8.194
  273    H    GLU  36           H        GLU  36 -21.645   3.742   7.532
  274    HA   GLU  36           HA       GLU  36 -20.650   1.418   6.217
  275    HB2  GLU  36           HB2      GLU  36 -22.162   3.098   5.156
  276    HB3  GLU  36           HB3      GLU  36 -20.828   4.242   5.153
  277    HG2  GLU  36           HG2      GLU  36 -21.096   3.217   2.976
  278    HG3  GLU  36           HG3      GLU  36 -19.551   2.764   3.694
  279    H    ARG  37           H        ARG  37 -19.232   4.564   7.080
  280    HA   ARG  37           HA       ARG  37 -16.698   3.890   5.914
  281    HB2  ARG  37           HB2      ARG  37 -15.882   5.962   6.858
  282    HB3  ARG  37           HB3      ARG  37 -17.415   6.229   6.047
  283    HG2  ARG  37           HG2      ARG  37 -18.559   6.384   8.138
  284    HG3  ARG  37           HG3      ARG  37 -17.113   5.883   9.019
  285    HD2  ARG  37           HD2      ARG  37 -17.440   8.417   7.415
  286    HD3  ARG  37           HD3      ARG  37 -17.419   8.291   9.174
  287    HE   ARG  37           HE       ARG  37 -15.054   7.165   8.224
  288   HH11  ARG  37          HH11      ARG  37 -16.609  10.297   8.301
  289   HH12  ARG  37          HH12      ARG  37 -15.115  11.180   8.306
  290   HH21  ARG  37          HH21      ARG  37 -13.088   8.320   8.234
  291   HH22  ARG  37          HH22      ARG  37 -13.112  10.055   8.293
  292    H    ASN  38           H        ASN  38 -18.147   3.588   9.049
  293    HA   ASN  38           HA       ASN  38 -15.719   3.006  10.431
  294    HB2  ASN  38           HB2      ASN  38 -18.561   2.232  11.138
  295    HB3  ASN  38           HB3      ASN  38 -17.177   2.073  12.206
  296   HD21  ASN  38          HD21      ASN  38 -16.049   4.688  11.302
  297   HD22  ASN  38          HD22      ASN  38 -17.032   5.879  12.066
  298    H    ASP  39           H        ASP  39 -18.128   1.055   8.748
  299    HA   ASP  39           HA       ASP  39 -16.899  -1.433   9.488
  300    HB2  ASP  39           HB2      ASP  39 -19.261  -1.440   9.058
  301    HB3  ASP  39           HB3      ASP  39 -19.024  -0.762   7.451
  302    H    MET  40           H        MET  40 -17.227   0.288   6.375
  303    HA   MET  40           HA       MET  40 -15.388  -1.587   5.153
  304    HB2  MET  40           HB2      MET  40 -17.453  -0.749   4.010
  305    HB3  MET  40           HB3      MET  40 -16.709   0.840   3.931
  306    HG2  MET  40           HG2      MET  40 -14.957   0.002   2.512
  307    HG3  MET  40           HG3      MET  40 -15.560  -1.644   2.680
  308    HE1  MET  40           HE1      MET  40 -17.893   1.703   0.519
  309    HE2  MET  40           HE2      MET  40 -16.356   1.955   1.347
  310    HE3  MET  40           HE3      MET  40 -17.806   1.570   2.276
  311    H    ILE  41           H        ILE  41 -15.072   1.182   6.914
  312    HA   ILE  41           HA       ILE  41 -13.311   2.484   7.477
  313    HB   ILE  41           HB       ILE  41 -11.688   0.795   5.570
  314   HG12  ILE  41          HG12      ILE  41 -12.663  -0.557   7.353
  315   HG13  ILE  41          HG13      ILE  41 -10.930  -0.381   7.603
  316   HG21  ILE  41          HG21      ILE  41 -10.809   2.677   7.757
  317   HG22  ILE  41          HG22      ILE  41 -10.625   2.935   6.022
  318   HG23  ILE  41          HG23      ILE  41  -9.747   1.628   6.818
  319   HD11  ILE  41          HD11      ILE  41 -12.097  -0.185   9.696
  320   HD12  ILE  41          HD12      ILE  41 -13.110   1.104   9.050
  321   HD13  ILE  41          HD13      ILE  41 -11.380   1.370   9.272
  322    H    SER  42           H        SER  42 -12.443   1.847   4.097
  323    HA   SER  42           HA       SER  42 -13.404   4.465   3.296
  324    HB2  SER  42           HB2      SER  42 -10.487   3.686   2.995
  325    HB3  SER  42           HB3      SER  42 -11.235   5.140   2.335
  326    HG   SER  42           HG       SER  42 -11.784   4.987   4.946
  327    H    TYR  43           H        TYR  43 -11.184   1.959   2.146
  328    HA   TYR  43           HA       TYR  43 -11.174   0.563   0.382
  329    HB2  TYR  43           HB2      TYR  43 -13.441  -0.061   1.175
  330    HB3  TYR  43           HB3      TYR  43 -14.123   1.169   0.118
  331    HD1  TYR  43           HD1      TYR  43 -14.524   0.706  -2.168
  332    HD2  TYR  43           HD2      TYR  43 -12.190  -1.992   0.149
  333    HE1  TYR  43           HE1      TYR  43 -14.598  -0.927  -4.004
  334    HE2  TYR  43           HE2      TYR  43 -12.257  -3.631  -1.682
  335    HH   TYR  43           HH       TYR  43 -13.624  -4.175  -3.621
  336    H    LYS  44           H        LYS  44 -10.314   0.925  -1.534
  337    HA   LYS  44           HA       LYS  44 -10.978   3.364  -2.952
  338    HB2  LYS  44           HB2      LYS  44  -8.851   1.265  -3.304
  339    HB3  LYS  44           HB3      LYS  44  -9.136   2.498  -4.522
  340    HG2  LYS  44           HG2      LYS  44  -8.469   3.069  -1.644
  341    HG3  LYS  44           HG3      LYS  44  -7.296   3.040  -2.962
  342    HD2  LYS  44           HD2      LYS  44  -9.708   4.848  -2.844
  343    HD3  LYS  44           HD3      LYS  44  -8.074   5.320  -2.386
  344    HE2  LYS  44           HE2      LYS  44  -7.289   4.927  -4.640
  345    HE3  LYS  44           HE3      LYS  44  -8.872   4.316  -5.117
  346    HZ1  LYS  44           HZ1      LYS  44  -9.795   6.519  -4.632
  347    HZ2  LYS  44           HZ2      LYS  44  -8.618   6.572  -5.844
  348    HZ3  LYS  44           HZ3      LYS  44  -8.239   7.090  -4.282
  349    H    GLU  45           H        GLU  45 -12.402   3.453  -4.500
  350    HA   GLU  45           HA       GLU  45 -13.907   1.260  -5.395
  351    HB2  GLU  45           HB2      GLU  45 -14.721   3.590  -5.328
  352    HB3  GLU  45           HB3      GLU  45 -13.621   4.000  -6.621
  353    HG2  GLU  45           HG2      GLU  45 -14.786   2.466  -8.111
  354    HG3  GLU  45           HG3      GLU  45 -15.901   2.101  -6.806
  355    H    ASN  46           H        ASN  46 -10.832   2.272  -6.295
  356    HA   ASN  46           HA       ASN  46 -10.870   1.539  -9.056
  357    HB2  ASN  46           HB2      ASN  46  -8.552   1.922  -7.151
  358    HB3  ASN  46           HB3      ASN  46  -8.399   1.718  -8.892
  359   HD21  ASN  46          HD21      ASN  46  -8.961   3.394 -10.252
  360   HD22  ASN  46          HD22      ASN  46  -9.248   5.000  -9.679
  361    H    GLY  47           H        GLY  47 -11.676  -0.452  -6.867
  362    HA2  GLY  47           HA2      GLY  47 -11.739  -2.778  -6.973
  363    HA3  GLY  47           HA3      GLY  47 -10.411  -2.731  -8.133
  364    H    ASP  48           H        ASP  48 -10.267  -1.046  -5.104
  365    HA   ASP  48           HA       ASP  48  -8.781  -1.082  -3.408
  366    HB2  ASP  48           HB2      ASP  48  -9.906  -3.134  -2.752
  367    HB3  ASP  48           HB3      ASP  48  -8.887  -4.065  -3.845
  368    H    VAL  49           H        VAL  49  -6.824  -0.288  -3.620
  369    HA   VAL  49           HA       VAL  49  -5.066  -1.516  -5.623
  370    HB   VAL  49           HB       VAL  49  -4.091   0.895  -5.703
  371   HG11  VAL  49          HG11      VAL  49  -5.736   1.488  -7.462
  372   HG12  VAL  49          HG12      VAL  49  -6.747   0.148  -6.919
  373   HG13  VAL  49          HG13      VAL  49  -5.148  -0.169  -7.592
  374   HG21  VAL  49          HG21      VAL  49  -6.882   1.416  -4.678
  375   HG22  VAL  49          HG22      VAL  49  -5.804   2.634  -5.348
  376   HG23  VAL  49          HG23      VAL  49  -5.379   1.812  -3.845
  377    H    HIS  50           H        HIS  50  -3.874  -2.770  -4.332
  378    HA   HIS  50           HA       HIS  50  -2.308  -1.488  -2.193
  379    HB2  HIS  50           HB2      HIS  50  -3.996  -3.182  -1.422
  380    HB3  HIS  50           HB3      HIS  50  -3.165  -4.388  -2.391
  381    HD1  HIS  50           HD1      HIS  50  -3.343  -3.135   0.944
  382    HD2  HIS  50           HD2      HIS  50  -0.318  -4.676  -1.454
  383    HE1  HIS  50           HE1      HIS  50  -1.555  -3.905   2.526
  384    HE2  HIS  50           HE2      HIS  50   0.173  -5.005   1.064
  385    H    VAL  51           H        VAL  51  -0.375  -1.094  -3.153
  386    HA   VAL  51           HA       VAL  51   0.843  -3.303  -4.677
  387    HB   VAL  51           HB       VAL  51   2.185  -1.465  -5.830
  388   HG11  VAL  51          HG11      VAL  51   0.426  -2.701  -6.973
  389   HG12  VAL  51          HG12      VAL  51   0.402  -1.001  -7.449
  390   HG13  VAL  51          HG13      VAL  51  -0.788  -1.612  -6.300
  391   HG21  VAL  51          HG21      VAL  51  -0.031   0.210  -4.691
  392   HG22  VAL  51          HG22      VAL  51   1.100   0.722  -5.944
  393   HG23  VAL  51          HG23      VAL  51   1.688   0.347  -4.325
  394    H    LEU  52           H        LEU  52   2.923  -3.835  -4.293
  395    HA   LEU  52           HA       LEU  52   4.181  -2.592  -1.952
  396    HB2  LEU  52           HB2      LEU  52   4.761  -5.241  -3.286
  397    HB3  LEU  52           HB3      LEU  52   5.525  -4.641  -1.822
  398    HG   LEU  52           HG       LEU  52   2.590  -5.303  -2.107
  399   HD11  LEU  52          HD11      LEU  52   4.037  -7.279  -2.182
  400   HD12  LEU  52          HD12      LEU  52   3.075  -7.212  -0.707
  401   HD13  LEU  52          HD13      LEU  52   4.781  -6.777  -0.664
  402   HD21  LEU  52          HD21      LEU  52   2.513  -5.007   0.310
  403   HD22  LEU  52          HD22      LEU  52   3.022  -3.520  -0.490
  404   HD23  LEU  52          HD23      LEU  52   4.213  -4.539   0.316
  405    H    THR  53           H        THR  53   6.100  -1.571  -2.128
  406    HA   THR  53           HA       THR  53   7.716  -1.860  -4.516
  407    HB   THR  53           HB       THR  53   5.973  -0.183  -5.139
  408    HG1  THR  53           HG1      THR  53   7.826   1.569  -5.428
  409   HG21  THR  53          HG21      THR  53   6.041   2.045  -4.132
  410   HG22  THR  53          HG22      THR  53   7.255   1.493  -2.979
  411   HG23  THR  53          HG23      THR  53   5.625   0.819  -2.933
  412    H    ILE  54           H        ILE  54   9.530  -0.029  -4.327
  413    HA   ILE  54           HA       ILE  54  10.670  -0.394  -1.672
  414    HB   ILE  54           HB       ILE  54  11.720  -0.150  -4.363
  415   HG12  ILE  54          HG12      ILE  54  12.991  -0.999  -1.756
  416   HG13  ILE  54          HG13      ILE  54  12.054  -2.029  -2.814
  417   HG21  ILE  54          HG21      ILE  54  12.321   2.124  -3.693
  418   HG22  ILE  54          HG22      ILE  54  13.747   1.106  -3.889
  419   HG23  ILE  54          HG23      ILE  54  13.150   1.485  -2.274
  420   HD11  ILE  54          HD11      ILE  54  14.656  -0.707  -3.501
  421   HD12  ILE  54          HD12      ILE  54  13.713  -1.739  -4.575
  422   HD13  ILE  54          HD13      ILE  54  14.422  -2.409  -3.104
  423    H    CYS  55           H        CYS  55  10.771   1.176  -0.205
  424    HA   CYS  55           HA       CYS  55   9.611   3.724  -0.726
  425    HB2  CYS  55           HB2      CYS  55  10.026   4.241   1.590
  426    HB3  CYS  55           HB3      CYS  55   9.476   2.575   1.495
  427    H    GLU  56           H        GLU  56  10.781   5.804  -0.207
  428    HA   GLU  56           HA       GLU  56  12.877   6.201  -1.979
  429    HB2  GLU  56           HB2      GLU  56  11.351   7.934  -0.943
  430    HB3  GLU  56           HB3      GLU  56  12.328   7.834   0.512
  431    HG2  GLU  56           HG2      GLU  56  13.046   9.727  -0.681
  432    HG3  GLU  56           HG3      GLU  56  14.298   8.501  -0.869
  433    H    ASP  57           H        ASP  57  12.938   5.519   1.489
  434    HA   ASP  57           HA       ASP  57  15.697   5.886   1.889
  435    HB2  ASP  57           HB2      ASP  57  14.138   5.799   3.751
  436    HB3  ASP  57           HB3      ASP  57  13.751   4.121   3.381
  437    H    CYS  58           H        CYS  58  13.833   2.920   1.216
  438    HA   CYS  58           HA       CYS  58  15.983   1.148   1.041
  439    HB2  CYS  58           HB2      CYS  58  13.277   1.219  -0.240
  440    HB3  CYS  58           HB3      CYS  58  14.446   0.013  -0.759
  441    H    GLN  59           H        GLN  59  14.405   3.026  -1.509
  442    HA   GLN  59           HA       GLN  59  16.009   2.463  -3.670
  443    HB2  GLN  59           HB2      GLN  59  14.105   3.765  -4.081
  444    HB3  GLN  59           HB3      GLN  59  14.488   4.897  -2.800
  445    HG2  GLN  59           HG2      GLN  59  14.755   5.928  -4.970
  446    HG3  GLN  59           HG3      GLN  59  16.298   5.811  -4.137
  447   HE21  GLN  59          HE21      GLN  59  14.770   3.088  -5.647
  448   HE22  GLN  59          HE22      GLN  59  15.909   2.924  -6.920
  449    H    GLU  60           H        GLU  60  16.556   4.850  -1.115
  450    HA   GLU  60           HA       GLU  60  18.819   5.994  -2.295
  451    HB2  GLU  60           HB2      GLU  60  17.395   6.115   0.262
  452    HB3  GLU  60           HB3      GLU  60  19.097   6.436   0.370
  453    HG2  GLU  60           HG2      GLU  60  18.839   8.171  -1.370
  454    HG3  GLU  60           HG3      GLU  60  17.110   7.881  -1.282
  455    H    ALA  61           H        ALA  61  18.415   3.510   0.179
  456    HA   ALA  61           HA       ALA  61  21.189   3.220   0.742
  457    HB1  ALA  61           HB1      ALA  61  19.490   2.522   2.347
  458    HB2  ALA  61           HB2      ALA  61  20.503   1.153   1.890
  459    HB3  ALA  61           HB3      ALA  61  18.884   1.320   1.208
  460    H    LEU  62           H        LEU  62  18.908   1.897  -1.443
  461    HA   LEU  62           HA       LEU  62  20.255  -0.298  -2.449
  462    HB2  LEU  62           HB2      LEU  62  17.881   1.067  -2.844
  463    HB3  LEU  62           HB3      LEU  62  18.701   1.206  -4.391
  464    HG   LEU  62           HG       LEU  62  19.084  -1.310  -4.090
  465   HD11  LEU  62          HD11      LEU  62  18.333  -1.562  -1.842
  466   HD12  LEU  62          HD12      LEU  62  17.234  -2.446  -2.902
  467   HD13  LEU  62          HD13      LEU  62  16.759  -0.880  -2.250
  468   HD21  LEU  62          HD21      LEU  62  17.752  -0.366  -5.877
  469   HD22  LEU  62          HD22      LEU  62  16.382  -0.191  -4.780
  470   HD23  LEU  62          HD23      LEU  62  16.954  -1.799  -5.228
  471    H    ASP  63           H        ASP  63  20.016   2.969  -3.814
  472    HA   ASP  63           HA       ASP  63  21.920   2.504  -5.854
  473    HB2  ASP  63           HB2      ASP  63  20.188   4.277  -5.959
  474    HB3  ASP  63           HB3      ASP  63  21.052   5.162  -4.705
  475    H    ARG  64           H        ARG  64  22.185   3.638  -2.567
  476    HA   ARG  64           HA       ARG  64  24.869   4.590  -2.788
  477    HB2  ARG  64           HB2      ARG  64  23.369   5.390  -1.034
  478    HB3  ARG  64           HB3      ARG  64  23.239   3.767  -0.377
  479    HG2  ARG  64           HG2      ARG  64  25.570   3.803   0.261
  480    HG3  ARG  64           HG3      ARG  64  25.770   5.394  -0.479
  481    HD2  ARG  64           HD2      ARG  64  24.238   6.376   1.091
  482    HD3  ARG  64           HD3      ARG  64  23.840   4.794   1.755
  483    HE   ARG  64           HE       ARG  64  26.621   5.313   1.976
  484   HH11  ARG  64          HH11      ARG  64  23.536   6.204   3.377
  485   HH12  ARG  64          HH12      ARG  64  24.194   6.506   4.951
  486   HH21  ARG  64          HH21      ARG  64  27.487   5.705   4.059
  487   HH22  ARG  64          HH22      ARG  64  26.440   6.221   5.342
  488    H    ASN  65           H        ASN  65  23.401   1.595  -1.568
  489    HA   ASN  65           HA       ASN  65  25.966   0.229  -1.952
  490    HB2  ASN  65           HB2      ASN  65  25.914   0.788   0.408
  491    HB3  ASN  65           HB3      ASN  65  24.288   0.136   0.554
  492   HD21  ASN  65          HD21      ASN  65  24.918  -1.276   2.163
  493   HD22  ASN  65          HD22      ASN  65  25.844  -2.696   1.832
  494    HA   PRO  66           HA       PRO  66  22.989  -2.442  -4.054
  495    HB2  PRO  66           HB2      PRO  66  25.444  -4.005  -4.539
  496    HB3  PRO  66           HB3      PRO  66  24.284  -3.350  -5.696
  497    HG2  PRO  66           HG2      PRO  66  26.741  -2.303  -5.384
  498    HG3  PRO  66           HG3      PRO  66  25.338  -1.310  -5.802
  499    HD2  PRO  66           HD2      PRO  66  26.750  -1.618  -3.196
  500    HD3  PRO  66           HD3      PRO  66  25.987  -0.182  -3.908
  501    H    HIS  67           H        HIS  67  25.288  -3.156  -1.571
  502    HA   HIS  67           HA       HIS  67  24.133  -5.800  -1.062
  503    HB2  HIS  67           HB2      HIS  67  26.485  -4.392   0.233
  504    HB3  HIS  67           HB3      HIS  67  25.955  -6.026   0.608
  505    HD1  HIS  67           HD1      HIS  67  27.084  -7.831  -0.668
  506    HD2  HIS  67           HD2      HIS  67  27.363  -4.155  -2.592
  507    HE1  HIS  67           HE1      HIS  67  28.576  -8.216  -2.655
  508    HE2  HIS  67           HE2      HIS  67  28.850  -5.946  -3.715
  509    H    TYR  68           H        TYR  68  22.241  -4.074  -0.684
  510    HA   TYR  68           HA       TYR  68  22.117  -2.472   1.567
  511    HB2  TYR  68           HB2      TYR  68  20.503  -2.442  -0.313
  512    HB3  TYR  68           HB3      TYR  68  19.841  -3.968   0.249
  513    HD1  TYR  68           HD1      TYR  68  20.744  -1.779   2.949
  514    HD2  TYR  68           HD2      TYR  68  17.676  -2.625   0.125
  515    HE1  TYR  68           HE1      TYR  68  19.133  -0.551   4.338
  516    HE2  TYR  68           HE2      TYR  68  16.057  -1.400   1.509
  517    HH   TYR  68           HH       TYR  68  17.023   0.574   4.142
  518    H    HIS  69           H        HIS  69  22.386  -2.987   3.594
  519    HA   HIS  69           HA       HIS  69  22.066  -5.610   4.655
  520    HB2  HIS  69           HB2      HIS  69  23.706  -4.109   5.603
  521    HB3  HIS  69           HB3      HIS  69  22.471  -2.916   5.964
  522    HD1  HIS  69           HD1      HIS  69  21.470  -3.001   8.238
  523    HD2  HIS  69           HD2      HIS  69  23.471  -6.514   7.270
  524    HE1  HIS  69           HE1      HIS  69  21.501  -4.363  10.350
  525    HE2  HIS  69           HE2      HIS  69  22.780  -6.455   9.762
  526    H    GLU  70           H        GLU  70  20.082  -6.488   4.779
  527    HA   GLU  70           HA       GLU  70  17.959  -4.846   6.003
  528    HB2  GLU  70           HB2      GLU  70  17.679  -6.995   3.902
  529    HB3  GLU  70           HB3      GLU  70  16.332  -6.218   4.722
  530    HG2  GLU  70           HG2      GLU  70  17.229  -4.029   3.834
  531    HG3  GLU  70           HG3      GLU  70  18.294  -4.994   2.812
  532    H    TYR  71           H        TYR  71  20.020  -7.187   6.691
  533    HA   TYR  71           HA       TYR  71  20.178  -8.732   8.341
  534    HB2  TYR  71           HB2      TYR  71  18.780  -7.131   9.655
  535    HB3  TYR  71           HB3      TYR  71  17.344  -7.973   9.088
  536    HD1  TYR  71           HD1      TYR  71  20.163  -8.045  11.382
  537    HD2  TYR  71           HD2      TYR  71  16.853 -10.256   9.885
  538    HE1  TYR  71           HE1      TYR  71  20.330  -9.581  13.293
  539    HE2  TYR  71           HE2      TYR  71  17.014 -11.797  11.794
  540    HH   TYR  71           HH       TYR  71  18.886 -11.127  14.541
  541    H    HIS  72           H        HIS  72  16.711  -9.038   7.644
  542    HA   HIS  72           HA       HIS  72  15.436 -10.725   6.829
  543    HB2  HIS  72           HB2      HIS  72  16.718 -10.274   4.782
  544    HB3  HIS  72           HB3      HIS  72  17.941 -11.429   5.292
  545    HD1  HIS  72           HD1      HIS  72  17.506 -13.882   4.833
  546    HD2  HIS  72           HD2      HIS  72  14.241 -11.456   3.978
  547    HE1  HIS  72           HE1      HIS  72  15.883 -15.347   3.598
  548    HE2  HIS  72           HE2      HIS  72  13.842 -13.910   3.267
  549    H    THR  73           H        THR  73  15.074 -11.886   8.684
  550    HA   THR  73           HA       THR  73  16.885 -13.744   9.802
  551    HB   THR  73           HB       THR  73  13.872 -13.831  10.041
  552    HG1  THR  73           HG1      THR  73  15.184 -11.753  10.567
  553   HG21  THR  73          HG21      THR  73  14.352 -14.800  12.246
  554   HG22  THR  73          HG22      THR  73  16.080 -14.718  11.905
  555   HG23  THR  73          HG23      THR  73  15.043 -15.778  10.952
  Start of MODEL    3
    1    H1   GLN  -1           H1       GLN  -1  -6.735  14.954  -3.288
    2    H2   GLN  -1           H2       GLN  -1  -6.202  13.700  -2.285
    3    H3   GLN  -1           H3       GLN  -1  -7.831  14.163  -2.271
    4    HA   GLN  -1           HA       GLN  -1  -7.580  12.125  -3.498
    5    HB2  GLN  -1           HB2      GLN  -1  -8.067  14.458  -5.359
    6    HB3  GLN  -1           HB3      GLN  -1  -8.652  12.819  -5.574
    7    HG2  GLN  -1           HG2      GLN  -1 -10.103  13.035  -3.669
    8    HG3  GLN  -1           HG3      GLN  -1  -9.446  14.631  -3.309
    9   HE21  GLN  -1          HE21      GLN  -1  -9.319  15.363  -6.150
   10   HE22  GLN  -1          HE22      GLN  -1 -10.949  15.693  -6.625
   11    H    SER   0           H        SER   0  -5.029  12.116  -3.218
   12    HA   SER   0           HA       SER   0  -3.853  12.465  -5.901
   13    HB2  SER   0           HB2      SER   0  -2.235  12.638  -3.373
   14    HB3  SER   0           HB3      SER   0  -1.877  13.307  -4.967
   15    HG   SER   0           HG       SER   0  -3.781  14.206  -3.061
   16    H    MET   1           H        MET   1  -5.092  10.085  -5.184
   17    HA   MET   1           HA       MET   1  -2.835   8.272  -5.242
   18    HB2  MET   1           HB2      MET   1  -3.776   6.840  -3.427
   19    HB3  MET   1           HB3      MET   1  -3.160   8.386  -2.871
   20    HG2  MET   1           HG2      MET   1  -5.143   8.057  -1.690
   21    HG3  MET   1           HG3      MET   1  -5.556   9.208  -2.955
   22    HE1  MET   1           HE1      MET   1  -5.879   5.551  -1.647
   23    HE2  MET   1           HE2      MET   1  -5.101   5.265  -3.203
   24    HE3  MET   1           HE3      MET   1  -6.767   4.751  -2.943
   25    H    ALA   2           H        ALA   2  -3.415   6.102  -5.824
   26    HA   ALA   2           HA       ALA   2  -6.135   5.700  -6.813
   27    HB1  ALA   2           HB1      ALA   2  -3.665   5.227  -8.477
   28    HB2  ALA   2           HB2      ALA   2  -4.868   6.488  -8.746
   29    HB3  ALA   2           HB3      ALA   2  -5.312   4.793  -8.935
   30    H    LEU   3           H        LEU   3  -2.957   4.249  -6.538
   31    HA   LEU   3           HA       LEU   3  -4.167   1.795  -5.426
   32    HB2  LEU   3           HB2      LEU   3  -1.496   2.229  -6.772
   33    HB3  LEU   3           HB3      LEU   3  -1.935   0.762  -5.945
   34    HG   LEU   3           HG       LEU   3  -3.910   0.651  -7.585
   35   HD11  LEU   3          HD11      LEU   3  -2.081   2.568  -8.978
   36   HD12  LEU   3          HD12      LEU   3  -3.714   2.895  -8.405
   37   HD13  LEU   3          HD13      LEU   3  -3.454   1.747  -9.719
   38   HD21  LEU   3          HD21      LEU   3  -2.533  -0.489  -9.236
   39   HD22  LEU   3          HD22      LEU   3  -2.005  -0.885  -7.601
   40   HD23  LEU   3          HD23      LEU   3  -1.086   0.267  -8.569
   41    H    HIS   4           H        HIS   4  -3.046   0.853  -3.609
   42    HA   HIS   4           HA       HIS   4  -1.983   2.946  -1.877
   43    HB2  HIS   4           HB2      HIS   4  -2.698   0.077  -1.296
   44    HB3  HIS   4           HB3      HIS   4  -2.059   1.187  -0.102
   45    HD1  HIS   4           HD1      HIS   4  -5.165  -0.054  -1.417
   46    HD2  HIS   4           HD2      HIS   4  -3.856   3.521   0.260
   47    HE1  HIS   4           HE1      HIS   4  -7.249   1.175  -0.720
   48    HE2  HIS   4           HE2      HIS   4  -6.435   3.324   0.310
   49    H    TYR   5           H        TYR   5   0.042   3.256  -1.655
   50    HA   TYR   5           HA       TYR   5   1.958   1.357  -2.741
   51    HB2  TYR   5           HB2      TYR   5   1.947   4.273  -2.164
   52    HB3  TYR   5           HB3      TYR   5   3.491   3.437  -2.011
   53    HD1  TYR   5           HD1      TYR   5   4.376   4.865  -3.760
   54    HD2  TYR   5           HD2      TYR   5   1.134   2.223  -4.526
   55    HE1  TYR   5           HE1      TYR   5   4.777   5.084  -6.168
   56    HE2  TYR   5           HE2      TYR   5   1.512   2.443  -6.941
   57    HH   TYR   5           HH       TYR   5   4.336   3.838  -8.234
   58    H    TYR   6           H        TYR   6   2.804  -0.078  -1.397
   59    HA   TYR   6           HA       TYR   6   3.490   0.881   1.290
   60    HB2  TYR   6           HB2      TYR   6   2.529  -1.856   0.466
   61    HB3  TYR   6           HB3      TYR   6   3.323  -1.541   2.009
   62    HD1  TYR   6           HD1      TYR   6   0.233  -1.500   0.240
   63    HD2  TYR   6           HD2      TYR   6   2.290   0.264   3.529
   64    HE1  TYR   6           HE1      TYR   6  -1.912  -0.777   1.191
   65    HE2  TYR   6           HE2      TYR   6   0.140   0.980   4.487
   66    HH   TYR   6           HH       TYR   6  -2.141   1.461   3.738
   67    H    CYS   7           H        CYS   7   5.434   0.265   2.125
   68    HA   CYS   7           HA       CYS   7   7.456   0.131   0.102
   69    HB2  CYS   7           HB2      CYS   7   8.116   1.671   1.658
   70    HB3  CYS   7           HB3      CYS   7   7.208   0.880   2.921
   71    H    ARG   8           H        ARG   8   8.201  -1.656  -0.614
   72    HA   ARG   8           HA       ARG   8   8.334  -4.116   0.691
   73    HB2  ARG   8           HB2      ARG   8  10.250  -4.573  -0.920
   74    HB3  ARG   8           HB3      ARG   8   8.713  -4.130  -1.645
   75    HG2  ARG   8           HG2      ARG   8   9.555  -1.821  -1.941
   76    HG3  ARG   8           HG3      ARG   8  11.108  -2.335  -1.278
   77    HD2  ARG   8           HD2      ARG   8   9.960  -3.854  -3.556
   78    HD3  ARG   8           HD3      ARG   8  10.640  -2.265  -3.877
   79    HE   ARG   8           HE       ARG   8  12.728  -3.112  -2.877
   80   HH11  ARG   8          HH11      ARG   8  10.372  -5.365  -4.157
   81   HH12  ARG   8          HH12      ARG   8  11.522  -6.636  -4.399
   82   HH21  ARG   8          HH21      ARG   8  14.258  -4.785  -3.209
   83   HH22  ARG   8          HH22      ARG   8  13.739  -6.311  -3.850
   84    H    HIS   9           H        HIS   9   9.373  -4.652   2.423
   85    HA   HIS   9           HA       HIS   9  11.239  -5.302   3.587
   86    HB2  HIS   9           HB2      HIS   9  12.648  -4.759   1.619
   87    HB3  HIS   9           HB3      HIS   9  12.768  -3.102   2.194
   88    HD1  HIS   9           HD1      HIS   9  14.204  -6.466   2.629
   89    HD2  HIS   9           HD2      HIS   9  14.325  -2.807   4.594
   90    HE1  HIS   9           HE1      HIS   9  16.168  -6.603   4.195
   91    HE2  HIS   9           HE2      HIS   9  16.125  -4.435   5.480
   92    H    CYS  10           H        CYS  10  11.120  -1.677   3.349
   93    HA   CYS  10           HA       CYS  10  12.007  -1.611   6.111
   94    HB2  CYS  10           HB2      CYS  10  11.137   0.960   4.966
   95    HB3  CYS  10           HB3      CYS  10  12.616   0.548   5.815
   96    H    GLY  11           H        GLY  11   9.009  -1.395   4.394
   97    HA2  GLY  11           HA2      GLY  11   6.942  -1.880   5.331
   98    HA3  GLY  11           HA3      GLY  11   7.649  -1.680   6.937
   99    H    VAL  12           H        VAL  12   8.057   0.905   4.630
  100    HA   VAL  12           HA       VAL  12   6.306   2.509   6.268
  101    HB   VAL  12           HB       VAL  12   8.357   3.570   6.081
  102   HG11  VAL  12          HG11      VAL  12   9.275   2.289   4.231
  103   HG12  VAL  12          HG12      VAL  12   9.500   4.017   3.968
  104   HG13  VAL  12          HG13      VAL  12   8.232   3.153   3.104
  105   HG21  VAL  12          HG21      VAL  12   6.580   4.848   4.027
  106   HG22  VAL  12          HG22      VAL  12   7.914   5.634   4.869
  107   HG23  VAL  12          HG23      VAL  12   6.496   5.095   5.769
  108    H    LYS  13           H        LYS  13   4.535   3.546   5.622
  109    HA   LYS  13           HA       LYS  13   3.268   2.523   3.244
  110    HB2  LYS  13           HB2      LYS  13   2.214   4.634   5.122
  111    HB3  LYS  13           HB3      LYS  13   1.288   3.664   3.999
  112    HG2  LYS  13           HG2      LYS  13   0.833   2.735   6.072
  113    HG3  LYS  13           HG3      LYS  13   2.050   1.658   5.397
  114    HD2  LYS  13           HD2      LYS  13   3.749   2.590   6.771
  115    HD3  LYS  13           HD3      LYS  13   2.715   3.936   7.250
  116    HE2  LYS  13           HE2      LYS  13   2.216   1.042   7.932
  117    HE3  LYS  13           HE3      LYS  13   2.962   2.219   9.011
  118    HZ1  LYS  13           HZ1      LYS  13   0.934   3.521   8.938
  119    HZ2  LYS  13           HZ2      LYS  13   0.603   1.953   9.471
  120    HZ3  LYS  13           HZ3      LYS  13   0.219   2.405   7.890
  121    H    VAL  14           H        VAL  14   3.811   3.390   1.340
  122    HA   VAL  14           HA       VAL  14   4.706   6.169   1.228
  123    HB   VAL  14           HB       VAL  14   4.882   5.097  -1.358
  124   HG11  VAL  14          HG11      VAL  14   6.985   5.412   0.774
  125   HG12  VAL  14          HG12      VAL  14   6.456   6.640  -0.375
  126   HG13  VAL  14          HG13      VAL  14   7.302   5.205  -0.949
  127   HG21  VAL  14          HG21      VAL  14   6.172   3.054  -1.082
  128   HG22  VAL  14          HG22      VAL  14   4.544   2.850  -0.439
  129   HG23  VAL  14          HG23      VAL  14   5.903   3.099   0.659
  130    H    GLY  15           H        GLY  15   1.837   4.566   0.864
  131    HA2  GLY  15           HA2      GLY  15   0.938   6.223  -1.390
  132    HA3  GLY  15           HA3      GLY  15   0.101   4.816  -0.758
  133    H    SER  16           H        SER  16   1.174   6.690   1.772
  134    HA   SER  16           HA       SER  16  -1.388   8.115   1.914
  135    HB2  SER  16           HB2      SER  16  -1.197   7.578   4.456
  136    HB3  SER  16           HB3      SER  16  -1.797   6.336   3.357
  137    HG   SER  16           HG       SER  16   0.781   6.574   4.511
  138    H    LEU  17           H        LEU  17  -0.294  10.011   1.277
  139    HA   LEU  17           HA       LEU  17   1.448  11.132   3.365
  140    HB2  LEU  17           HB2      LEU  17   2.322  12.676   1.691
  141    HB3  LEU  17           HB3      LEU  17   2.577  11.013   1.203
  142    HG   LEU  17           HG       LEU  17   0.160  12.421   0.170
  143   HD11  LEU  17          HD11      LEU  17   1.917  14.061  -0.150
  144   HD12  LEU  17          HD12      LEU  17   1.470  13.330  -1.690
  145   HD13  LEU  17          HD13      LEU  17   2.954  12.835  -0.878
  146   HD21  LEU  17          HD21      LEU  17   0.554  10.046  -0.320
  147   HD22  LEU  17          HD22      LEU  17   2.102  10.464  -1.053
  148   HD23  LEU  17          HD23      LEU  17   0.601  11.036  -1.779
  149    H    GLU  18           H        GLU  18  -1.502  11.277   1.764
  150    HA   GLU  18           HA       GLU  18  -2.093  14.021   2.349
  151    HB2  GLU  18           HB2      GLU  18  -3.891  11.774   1.431
  152    HB3  GLU  18           HB3      GLU  18  -4.364  13.465   1.535
  153    HG2  GLU  18           HG2      GLU  18  -2.711  14.052  -0.142
  154    HG3  GLU  18           HG3      GLU  18  -2.175  12.376  -0.222
  155    H    SER  19           H        SER  19  -1.450  13.625   4.661
  156    HA   SER  19           HA       SER  19  -3.851  12.891   6.201
  157    HB2  SER  19           HB2      SER  19  -2.279  12.332   8.075
  158    HB3  SER  19           HB3      SER  19  -2.125  11.268   6.678
  159    HG   SER  19           HG       SER  19  -0.138  12.217   7.707
  160    H    SER  20           H        SER  20  -3.750  14.014   8.450
  161    HA   SER  20           HA       SER  20  -3.740  15.891   9.718
  162    HB2  SER  20           HB2      SER  20  -1.336  16.098   9.226
  163    HB3  SER  20           HB3      SER  20  -1.713  16.971   7.744
  164    HG   SER  20           HG       SER  20  -2.613  17.865  10.276
  165    H    MET  21           H        MET  21  -3.979  16.340   6.246
  166    HA   MET  21           HA       MET  21  -5.700  18.665   6.544
  167    HB2  MET  21           HB2      MET  21  -4.803  17.167   4.080
  168    HB3  MET  21           HB3      MET  21  -5.715  18.666   4.083
  169    HG2  MET  21           HG2      MET  21  -3.853  19.808   5.161
  170    HG3  MET  21           HG3      MET  21  -2.944  18.300   5.198
  171    HE1  MET  21           HE1      MET  21  -4.030  20.632   1.370
  172    HE2  MET  21           HE2      MET  21  -4.423  21.156   3.007
  173    HE3  MET  21           HE3      MET  21  -5.238  19.757   2.308
  174    H    VAL  22           H        VAL  22  -6.284  15.704   7.221
  175    HA   VAL  22           HA       VAL  22  -9.017  15.745   6.216
  176    HB   VAL  22           HB       VAL  22  -7.888  14.364   4.579
  177   HG11  VAL  22          HG11      VAL  22  -5.921  13.753   5.880
  178   HG12  VAL  22          HG12      VAL  22  -6.688  12.325   5.185
  179   HG13  VAL  22          HG13      VAL  22  -6.908  12.700   6.894
  180   HG21  VAL  22          HG21      VAL  22  -9.437  12.648   6.514
  181   HG22  VAL  22          HG22      VAL  22  -9.128  12.272   4.820
  182   HG23  VAL  22          HG23      VAL  22 -10.125  13.662   5.247
  183    H    SER  23           H        SER  23 -10.436  15.216   7.777
  184    HA   SER  23           HA       SER  23  -9.407  13.791  10.145
  185    HB2  SER  23           HB2      SER  23 -10.084  16.235  10.419
  186    HB3  SER  23           HB3      SER  23 -11.738  15.711  10.131
  187    HG   SER  23           HG       SER  23 -10.022  14.802  12.210
  188    H    THR  24           H        THR  24 -10.778  13.049   7.540
  189    HA   THR  24           HA       THR  24 -12.779  11.280   8.747
  190    HB   THR  24           HB       THR  24 -13.067  12.628   6.051
  191    HG1  THR  24           HG1      THR  24 -14.744  13.044   8.298
  192   HG21  THR  24          HG21      THR  24 -14.939  10.829   7.598
  193   HG22  THR  24          HG22      THR  24 -14.102  10.426   6.100
  194   HG23  THR  24          HG23      THR  24 -15.345  11.677   6.105
  195    H    ASP  25           H        ASP  25 -11.169   9.655   8.790
  196    HA   ASP  25           HA       ASP  25 -10.139   8.709   6.225
  197    HB2  ASP  25           HB2      ASP  25  -9.660   7.842   9.078
  198    HB3  ASP  25           HB3      ASP  25  -9.101   6.891   7.708
  199    H    SER  26           H        SER  26 -12.429   7.952   8.710
  200    HA   SER  26           HA       SER  26 -13.248   5.416   7.793
  201    HB2  SER  26           HB2      SER  26 -13.752   6.342  10.046
  202    HB3  SER  26           HB3      SER  26 -14.839   7.508   9.297
  203    HG   SER  26           HG       SER  26 -15.139   4.741   9.636
  204    H    LEU  27           H        LEU  27 -13.798   5.189   5.724
  205    HA   LEU  27           HA       LEU  27 -14.818   5.401   3.729
  206    HB2  LEU  27           HB2      LEU  27 -16.862   7.013   5.251
  207    HB3  LEU  27           HB3      LEU  27 -17.054   6.410   3.614
  208    HG   LEU  27           HG       LEU  27 -16.905   4.808   6.157
  209   HD11  LEU  27          HD11      LEU  27 -18.975   5.024   3.990
  210   HD12  LEU  27          HD12      LEU  27 -19.072   5.748   5.594
  211   HD13  LEU  27          HD13      LEU  27 -19.077   3.993   5.418
  212   HD21  LEU  27          HD21      LEU  27 -15.549   3.632   4.557
  213   HD22  LEU  27          HD22      LEU  27 -16.776   3.831   3.308
  214   HD23  LEU  27          HD23      LEU  27 -17.099   2.806   4.706
  215    H    GLY  28           H        GLY  28 -13.439   6.460   2.549
  216    HA2  GLY  28           HA2      GLY  28 -12.988   9.305   3.038
  217    HA3  GLY  28           HA3      GLY  28 -11.940   8.235   2.122
  218    H    PHE  29           H        PHE  29 -15.076   9.864   2.032
  219    HA   PHE  29           HA       PHE  29 -14.516  10.614  -0.709
  220    HB2  PHE  29           HB2      PHE  29 -16.625   9.939  -1.604
  221    HB3  PHE  29           HB3      PHE  29 -15.935   8.531  -0.819
  222    HD1  PHE  29           HD1      PHE  29 -16.702   8.237   1.716
  223    HD2  PHE  29           HD2      PHE  29 -18.822  10.411  -1.260
  224    HE1  PHE  29           HE1      PHE  29 -18.785   7.947   2.987
  225    HE2  PHE  29           HE2      PHE  29 -20.904  10.129  -0.005
  226    HZ   PHE  29           HZ       PHE  29 -20.893   8.891   2.132
  227    H    GLN  30           H        GLN  30 -16.946  11.855  -1.228
  228    HA   GLN  30           HA       GLN  30 -17.225  13.735   0.993
  229    HB2  GLN  30           HB2      GLN  30 -17.077  15.579  -0.898
  230    HB3  GLN  30           HB3      GLN  30 -15.655  14.988  -0.060
  231    HG2  GLN  30           HG2      GLN  30 -15.093  13.549  -1.879
  232    HG3  GLN  30           HG3      GLN  30 -16.603  13.930  -2.702
  233   HE21  GLN  30          HE21      GLN  30 -14.715  16.381  -1.056
  234   HE22  GLN  30          HE22      GLN  30 -14.181  17.189  -2.485
  235    H    HIS  31           H        HIS  31 -18.273  12.932  -2.273
  236    HA   HIS  31           HA       HIS  31 -20.988  12.766  -1.439
  237    HB2  HIS  31           HB2      HIS  31 -20.902  15.213  -1.665
  238    HB3  HIS  31           HB3      HIS  31 -20.287  15.048  -3.304
  239    HD1  HIS  31           HD1      HIS  31 -21.968  14.838  -5.149
  240    HD2  HIS  31           HD2      HIS  31 -23.670  14.284  -1.395
  241    HE1  HIS  31           HE1      HIS  31 -24.445  14.710  -5.543
  242    HE2  HIS  31           HE2      HIS  31 -25.434  14.204  -3.284
  243    H    LEU  32           H        LEU  32 -21.325  10.884  -2.384
  244    HA   LEU  32           HA       LEU  32 -20.695  10.631  -5.241
  245    HB2  LEU  32           HB2      LEU  32 -20.113   8.598  -3.084
  246    HB3  LEU  32           HB3      LEU  32 -19.959   8.306  -4.792
  247    HG   LEU  32           HG       LEU  32 -18.272  10.114  -3.099
  248   HD11  LEU  32          HD11      LEU  32 -17.699   7.675  -4.762
  249   HD12  LEU  32          HD12      LEU  32 -17.717   7.770  -3.000
  250   HD13  LEU  32          HD13      LEU  32 -16.486   8.637  -3.920
  251   HD21  LEU  32          HD21      LEU  32 -17.039  10.669  -5.134
  252   HD22  LEU  32          HD22      LEU  32 -18.701  11.251  -5.207
  253   HD23  LEU  32          HD23      LEU  32 -18.236   9.802  -6.099
  254    H    THR  33           H        THR  33 -22.021   9.053  -6.363
  255    HA   THR  33           HA       THR  33 -24.446   8.282  -4.872
  256    HB   THR  33           HB       THR  33 -24.324   9.583  -7.595
  257    HG1  THR  33           HG1      THR  33 -25.190  10.368  -5.028
  258   HG21  THR  33          HG21      THR  33 -26.730   8.455  -6.170
  259   HG22  THR  33          HG22      THR  33 -25.942   7.742  -7.579
  260   HG23  THR  33          HG23      THR  33 -26.731   9.313  -7.710
  261    H    ASN  34           H        ASN  34 -23.696   7.882  -8.322
  262    HA   ASN  34           HA       ASN  34 -23.970   5.008  -8.075
  263    HB2  ASN  34           HB2      ASN  34 -23.569   4.965 -10.514
  264    HB3  ASN  34           HB3      ASN  34 -24.854   6.086 -10.093
  265   HD21  ASN  34          HD21      ASN  34 -24.565   8.265 -10.429
  266   HD22  ASN  34          HD22      ASN  34 -23.233   8.902 -11.332
  267    H    GLU  35           H        GLU  35 -21.584   7.436  -8.183
  268    HA   GLU  35           HA       GLU  35 -19.261   5.849  -8.606
  269    HB2  GLU  35           HB2      GLU  35 -19.355   8.249  -6.801
  270    HB3  GLU  35           HB3      GLU  35 -18.036   7.701  -7.821
  271    HG2  GLU  35           HG2      GLU  35 -18.731   9.436  -9.027
  272    HG3  GLU  35           HG3      GLU  35 -19.782   8.223  -9.729
  273    H    GLU  36           H        GLU  36 -21.029   6.953  -5.827
  274    HA   GLU  36           HA       GLU  36 -19.680   5.904  -3.683
  275    HB2  GLU  36           HB2      GLU  36 -21.681   7.191  -3.355
  276    HB3  GLU  36           HB3      GLU  36 -22.649   6.023  -4.234
  277    HG2  GLU  36           HG2      GLU  36 -23.205   5.661  -2.015
  278    HG3  GLU  36           HG3      GLU  36 -22.042   4.387  -2.367
  279    H    ARG  37           H        ARG  37 -21.896   4.211  -5.844
  280    HA   ARG  37           HA       ARG  37 -21.840   1.729  -4.502
  281    HB2  ARG  37           HB2      ARG  37 -22.473   2.391  -7.381
  282    HB3  ARG  37           HB3      ARG  37 -22.789   0.841  -6.620
  283    HG2  ARG  37           HG2      ARG  37 -24.298   1.944  -5.028
  284    HG3  ARG  37           HG3      ARG  37 -24.000   3.483  -5.838
  285    HD2  ARG  37           HD2      ARG  37 -26.089   2.511  -6.597
  286    HD3  ARG  37           HD3      ARG  37 -24.917   2.557  -7.912
  287    HE   ARG  37           HE       ARG  37 -24.764   0.064  -6.617
  288   HH11  ARG  37          HH11      ARG  37 -26.897   1.888  -8.701
  289   HH12  ARG  37          HH12      ARG  37 -27.600   0.482  -9.430
  290   HH21  ARG  37          HH21      ARG  37 -25.684  -1.793  -7.567
  291   HH22  ARG  37          HH22      ARG  37 -26.910  -1.618  -8.782
  292    H    ASN  38           H        ASN  38 -19.957   3.034  -7.202
  293    HA   ASN  38           HA       ASN  38 -18.590   0.551  -7.667
  294    HB2  ASN  38           HB2      ASN  38 -19.032   2.067  -9.524
  295    HB3  ASN  38           HB3      ASN  38 -18.066   3.322  -8.755
  296   HD21  ASN  38          HD21      ASN  38 -15.877   3.286  -8.961
  297   HD22  ASN  38          HD22      ASN  38 -15.019   2.115  -9.902
  298    H    ASP  39           H        ASP  39 -17.768   3.624  -6.137
  299    HA   ASP  39           HA       ASP  39 -15.014   3.027  -5.804
  300    HB2  ASP  39           HB2      ASP  39 -16.837   5.145  -4.727
  301    HB3  ASP  39           HB3      ASP  39 -15.212   4.967  -4.073
  302    H    MET  40           H        MET  40 -17.847   2.365  -3.893
  303    HA   MET  40           HA       MET  40 -16.341   1.775  -1.510
  304    HB2  MET  40           HB2      MET  40 -18.766   2.572  -1.605
  305    HB3  MET  40           HB3      MET  40 -19.180   0.929  -2.076
  306    HG2  MET  40           HG2      MET  40 -19.486   1.365   0.329
  307    HG3  MET  40           HG3      MET  40 -18.348   0.061  -0.003
  308    HE1  MET  40           HE1      MET  40 -16.996   4.318   1.174
  309    HE2  MET  40           HE2      MET  40 -18.674   3.875   0.860
  310    HE3  MET  40           HE3      MET  40 -17.504   3.886  -0.458
  311    H    ILE  41           H        ILE  41 -15.822   0.359  -4.114
  312    HA   ILE  41           HA       ILE  41 -16.201  -2.411  -3.205
  313    HB   ILE  41           HB       ILE  41 -15.509  -1.370  -5.953
  314   HG12  ILE  41          HG12      ILE  41 -17.838  -0.944  -5.247
  315   HG13  ILE  41          HG13      ILE  41 -17.728  -2.067  -6.591
  316   HG21  ILE  41          HG21      ILE  41 -14.472  -3.524  -5.540
  317   HG22  ILE  41          HG22      ILE  41 -15.793  -3.683  -6.700
  318   HG23  ILE  41          HG23      ILE  41 -16.023  -4.190  -5.027
  319   HD11  ILE  41          HD11      ILE  41 -18.083  -3.935  -5.053
  320   HD12  ILE  41          HD12      ILE  41 -19.408  -2.774  -4.987
  321   HD13  ILE  41          HD13      ILE  41 -18.193  -2.798  -3.710
  322    H    SER  42           H        SER  42 -13.785  -0.783  -5.250
  323    HA   SER  42           HA       SER  42 -11.721  -2.347  -3.864
  324    HB2  SER  42           HB2      SER  42 -11.581  -1.078  -6.604
  325    HB3  SER  42           HB3      SER  42 -10.453  -2.242  -5.911
  326    HG   SER  42           HG       SER  42 -12.498  -3.596  -5.745
  327    H    TYR  43           H        TYR  43 -12.911   0.770  -4.310
  328    HA   TYR  43           HA       TYR  43 -10.362   2.120  -3.974
  329    HB2  TYR  43           HB2      TYR  43 -11.851   3.275  -5.379
  330    HB3  TYR  43           HB3      TYR  43 -13.207   3.040  -4.286
  331    HD1  TYR  43           HD1      TYR  43 -10.065   4.934  -4.782
  332    HD2  TYR  43           HD2      TYR  43 -13.700   4.613  -2.597
  333    HE1  TYR  43           HE1      TYR  43  -9.689   7.171  -3.833
  334    HE2  TYR  43           HE2      TYR  43 -13.335   6.841  -1.638
  335    HH   TYR  43           HH       TYR  43 -11.696   8.447  -1.270
  336    H    LYS  44           H        LYS  44 -12.736   0.804  -1.944
  337    HA   LYS  44           HA       LYS  44 -12.580   2.700   0.179
  338    HB2  LYS  44           HB2      LYS  44 -13.899   1.096   1.452
  339    HB3  LYS  44           HB3      LYS  44 -14.567   1.334  -0.150
  340    HG2  LYS  44           HG2      LYS  44 -13.588  -0.771  -0.888
  341    HG3  LYS  44           HG3      LYS  44 -12.887  -1.012   0.715
  342    HD2  LYS  44           HD2      LYS  44 -15.108  -1.076   1.700
  343    HD3  LYS  44           HD3      LYS  44 -15.835  -0.762   0.123
  344    HE2  LYS  44           HE2      LYS  44 -14.865  -2.874  -0.706
  345    HE3  LYS  44           HE3      LYS  44 -14.229  -3.192   0.908
  346    HZ1  LYS  44           HZ1      LYS  44 -17.097  -2.932   0.179
  347    HZ2  LYS  44           HZ2      LYS  44 -16.513  -3.174   1.746
  348    HZ3  LYS  44           HZ3      LYS  44 -16.292  -4.367   0.567
  349    H    GLU  45           H        GLU  45 -12.248   1.480   2.491
  350    HA   GLU  45           HA       GLU  45  -9.425   1.621   2.661
  351    HB2  GLU  45           HB2      GLU  45 -11.034   2.526   4.335
  352    HB3  GLU  45           HB3      GLU  45 -11.356   0.886   4.855
  353    HG2  GLU  45           HG2      GLU  45  -9.075   0.643   5.531
  354    HG3  GLU  45           HG3      GLU  45  -8.682   2.245   4.931
  355    H    ASN  46           H        ASN  46 -11.445  -1.060   2.139
  356    HA   ASN  46           HA       ASN  46 -10.143  -3.106   3.520
  357    HB2  ASN  46           HB2      ASN  46 -12.242  -3.394   2.204
  358    HB3  ASN  46           HB3      ASN  46 -11.295  -3.281   0.728
  359   HD21  ASN  46          HD21      ASN  46 -11.758  -5.315  -0.004
  360   HD22  ASN  46          HD22      ASN  46 -11.193  -6.754   0.774
  361    H    GLY  47           H        GLY  47  -9.165  -1.275   0.750
  362    HA2  GLY  47           HA2      GLY  47  -6.814  -0.817   0.623
  363    HA3  GLY  47           HA3      GLY  47  -6.510  -2.491   1.087
  364    H    ASP  48           H        ASP  48  -8.379  -3.652  -0.764
  365    HA   ASP  48           HA       ASP  48  -7.810  -4.852  -2.685
  366    HB2  ASP  48           HB2      ASP  48  -9.816  -3.594  -3.146
  367    HB3  ASP  48           HB3      ASP  48  -8.869  -2.203  -3.660
  368    H    VAL  49           H        VAL  49  -7.053  -1.720  -4.123
  369    HA   VAL  49           HA       VAL  49  -4.837  -2.633  -5.551
  370    HB   VAL  49           HB       VAL  49  -4.313  -0.109  -5.731
  371   HG11  VAL  49          HG11      VAL  49  -6.181   0.225  -7.304
  372   HG12  VAL  49          HG12      VAL  49  -6.967  -1.211  -6.645
  373   HG13  VAL  49          HG13      VAL  49  -5.423  -1.356  -7.483
  374   HG21  VAL  49          HG21      VAL  49  -5.576   0.554  -3.680
  375   HG22  VAL  49          HG22      VAL  49  -7.074   0.122  -4.505
  376   HG23  VAL  49          HG23      VAL  49  -6.084   1.429  -5.123
  377    H    HIS  50           H        HIS  50  -3.333  -3.631  -4.314
  378    HA   HIS  50           HA       HIS  50  -1.922  -2.009  -2.299
  379    HB2  HIS  50           HB2      HIS  50  -3.307  -3.840  -1.307
  380    HB3  HIS  50           HB3      HIS  50  -2.389  -5.003  -2.250
  381    HD1  HIS  50           HD1      HIS  50  -2.573  -3.716   1.022
  382    HD2  HIS  50           HD2      HIS  50   0.565  -4.717  -1.506
  383    HE1  HIS  50           HE1      HIS  50  -0.596  -4.100   2.521
  384    HE2  HIS  50           HE2      HIS  50   1.213  -4.934   0.988
  385    H    VAL  51           H        VAL  51  -0.058  -1.450  -3.281
  386    HA   VAL  51           HA       VAL  51   1.364  -3.560  -4.767
  387    HB   VAL  51           HB       VAL  51   2.422  -1.646  -6.066
  388   HG11  VAL  51          HG11      VAL  51   0.705  -3.117  -7.019
  389   HG12  VAL  51          HG12      VAL  51   0.543  -1.460  -7.609
  390   HG13  VAL  51          HG13      VAL  51  -0.549  -2.064  -6.361
  391   HG21  VAL  51          HG21      VAL  51   0.116  -0.156  -4.846
  392   HG22  VAL  51          HG22      VAL  51   1.088   0.411  -6.204
  393   HG23  VAL  51          HG23      VAL  51   1.833   0.184  -4.621
  394    H    LEU  52           H        LEU  52   3.438  -3.933  -4.305
  395    HA   LEU  52           HA       LEU  52   4.649  -2.445  -2.102
  396    HB2  LEU  52           HB2      LEU  52   5.325  -5.056  -3.444
  397    HB3  LEU  52           HB3      LEU  52   6.444  -4.268  -2.350
  398    HG   LEU  52           HG       LEU  52   5.265  -6.015  -1.182
  399   HD11  LEU  52          HD11      LEU  52   4.214  -3.327  -0.315
  400   HD12  LEU  52          HD12      LEU  52   5.809  -3.975   0.064
  401   HD13  LEU  52          HD13      LEU  52   4.363  -4.770   0.686
  402   HD21  LEU  52          HD21      LEU  52   2.842  -5.967  -0.867
  403   HD22  LEU  52          HD22      LEU  52   3.273  -6.149  -2.567
  404   HD23  LEU  52          HD23      LEU  52   2.727  -4.588  -1.958
  405    H    THR  53           H        THR  53   5.903  -0.782  -2.585
  406    HA   THR  53           HA       THR  53   7.402  -0.865  -5.122
  407    HB   THR  53           HB       THR  53   5.420   0.645  -5.241
  408    HG1  THR  53           HG1      THR  53   7.374   1.087  -6.442
  409   HG21  THR  53          HG21      THR  53   5.446   2.743  -3.977
  410   HG22  THR  53          HG22      THR  53   6.888   2.207  -3.115
  411   HG23  THR  53          HG23      THR  53   5.362   1.347  -2.900
  412    H    ILE  54           H        ILE  54   9.126   0.920  -5.107
  413    HA   ILE  54           HA       ILE  54  10.752   0.547  -2.740
  414    HB   ILE  54           HB       ILE  54  11.222   1.491  -5.525
  415   HG12  ILE  54          HG12      ILE  54  12.950  -0.195  -3.743
  416   HG13  ILE  54          HG13      ILE  54  11.610  -0.840  -4.657
  417   HG21  ILE  54          HG21      ILE  54  12.152   3.330  -4.188
  418   HG22  ILE  54          HG22      ILE  54  13.403   2.410  -5.024
  419   HG23  ILE  54          HG23      ILE  54  13.132   2.163  -3.300
  420   HD11  ILE  54          HD11      ILE  54  12.673  -0.090  -6.726
  421   HD12  ILE  54          HD12      ILE  54  13.692  -1.206  -5.817
  422   HD13  ILE  54          HD13      ILE  54  14.030   0.525  -5.784
  423    H    CYS  55           H        CYS  55  10.398   1.837  -1.085
  424    HA   CYS  55           HA       CYS  55   9.493   4.547  -1.369
  425    HB2  CYS  55           HB2      CYS  55   9.428   4.627   0.980
  426    HB3  CYS  55           HB3      CYS  55   9.071   2.945   0.625
  427    H    GLU  56           H        GLU  56  10.979   6.243   0.005
  428    HA   GLU  56           HA       GLU  56  13.346   6.494  -1.536
  429    HB2  GLU  56           HB2      GLU  56  13.836   8.402  -0.040
  430    HB3  GLU  56           HB3      GLU  56  12.208   8.451  -0.685
  431    HG2  GLU  56           HG2      GLU  56  11.446   7.434   1.482
  432    HG3  GLU  56           HG3      GLU  56  13.072   7.726   2.095
  433    H    ASP  57           H        ASP  57  12.697   5.150   1.655
  434    HA   ASP  57           HA       ASP  57  15.438   4.849   2.388
  435    HB2  ASP  57           HB2      ASP  57  13.432   4.729   3.956
  436    HB3  ASP  57           HB3      ASP  57  13.168   3.102   3.342
  437    H    CYS  58           H        CYS  58  13.083   2.857   0.691
  438    HA   CYS  58           HA       CYS  58  14.675   0.568   0.266
  439    HB2  CYS  58           HB2      CYS  58  12.499   1.856  -1.380
  440    HB3  CYS  58           HB3      CYS  58  13.322   0.405  -1.909
  441    H    GLN  59           H        GLN  59  14.111   3.422  -1.710
  442    HA   GLN  59           HA       GLN  59  15.897   3.154  -3.757
  443    HB2  GLN  59           HB2      GLN  59  14.255   4.984  -3.506
  444    HB3  GLN  59           HB3      GLN  59  15.232   5.676  -2.221
  445    HG2  GLN  59           HG2      GLN  59  15.643   6.912  -4.204
  446    HG3  GLN  59           HG3      GLN  59  17.078   5.946  -3.871
  447   HE21  GLN  59          HE21      GLN  59  17.509   4.158  -5.138
  448   HE22  GLN  59          HE22      GLN  59  16.787   3.955  -6.684
  449    H    GLU  60           H        GLU  60  16.544   4.162  -0.456
  450    HA   GLU  60           HA       GLU  60  19.218   4.955  -0.983
  451    HB2  GLU  60           HB2      GLU  60  17.433   5.280   1.052
  452    HB3  GLU  60           HB3      GLU  60  18.601   4.202   1.768
  453    HG2  GLU  60           HG2      GLU  60  19.142   6.511   2.236
  454    HG3  GLU  60           HG3      GLU  60  20.353   5.742   1.229
  455    H    ALA  61           H        ALA  61  17.681   2.087   0.362
  456    HA   ALA  61           HA       ALA  61  20.012   0.645   1.009
  457    HB1  ALA  61           HB1      ALA  61  17.788  -0.054   1.767
  458    HB2  ALA  61           HB2      ALA  61  18.587  -1.348   0.876
  459    HB3  ALA  61           HB3      ALA  61  17.322  -0.395   0.100
  460    H    LEU  62           H        LEU  62  18.258   1.307  -1.851
  461    HA   LEU  62           HA       LEU  62  19.478  -0.552  -3.614
  462    HB2  LEU  62           HB2      LEU  62  17.590   1.627  -3.663
  463    HB3  LEU  62           HB3      LEU  62  18.686   1.739  -5.027
  464    HG   LEU  62           HG       LEU  62  18.139  -0.682  -5.425
  465   HD11  LEU  62          HD11      LEU  62  15.951  -1.450  -4.633
  466   HD12  LEU  62          HD12      LEU  62  15.843  -0.011  -3.616
  467   HD13  LEU  62          HD13      LEU  62  17.101  -1.211  -3.319
  468   HD21  LEU  62          HD21      LEU  62  16.081  -0.110  -6.670
  469   HD22  LEU  62          HD22      LEU  62  17.378   1.062  -6.899
  470   HD23  LEU  62          HD23      LEU  62  16.039   1.430  -5.811
  471    H    ASP  63           H        ASP  63  19.786   2.911  -3.321
  472    HA   ASP  63           HA       ASP  63  21.967   3.273  -5.013
  473    HB2  ASP  63           HB2      ASP  63  20.499   5.092  -4.391
  474    HB3  ASP  63           HB3      ASP  63  20.990   4.973  -2.709
  475    H    ARG  64           H        ARG  64  21.912   2.804  -1.489
  476    HA   ARG  64           HA       ARG  64  24.705   3.214  -1.143
  477    HB2  ARG  64           HB2      ARG  64  23.197   3.476   0.737
  478    HB3  ARG  64           HB3      ARG  64  22.673   1.805   0.596
  479    HG2  ARG  64           HG2      ARG  64  24.209   2.068   2.448
  480    HG3  ARG  64           HG3      ARG  64  24.919   1.049   1.195
  481    HD2  ARG  64           HD2      ARG  64  26.124   3.062   0.344
  482    HD3  ARG  64           HD3      ARG  64  25.516   3.952   1.737
  483    HE   ARG  64           HE       ARG  64  26.779   1.679   2.713
  484   HH11  ARG  64          HH11      ARG  64  27.628   4.584   0.954
  485   HH12  ARG  64          HH12      ARG  64  29.267   4.603   1.522
  486   HH21  ARG  64          HH21      ARG  64  28.930   1.697   3.462
  487   HH22  ARG  64          HH22      ARG  64  30.010   2.954   2.947
  488    H    ASN  65           H        ASN  65  22.798   0.206  -0.918
  489    HA   ASN  65           HA       ASN  65  25.269  -1.269  -1.493
  490    HB2  ASN  65           HB2      ASN  65  22.736  -2.162  -0.115
  491    HB3  ASN  65           HB3      ASN  65  24.095  -3.219  -0.479
  492   HD21  ASN  65          HD21      ASN  65  22.909  -2.413   2.099
  493   HD22  ASN  65          HD22      ASN  65  24.212  -1.740   3.016
  494    HA   PRO  66           HA       PRO  66  23.381  -1.949  -5.497
  495    HB2  PRO  66           HB2      PRO  66  25.615  -3.788  -5.963
  496    HB3  PRO  66           HB3      PRO  66  25.201  -2.293  -6.800
  497    HG2  PRO  66           HG2      PRO  66  27.336  -2.487  -5.169
  498    HG3  PRO  66           HG3      PRO  66  26.408  -0.988  -5.344
  499    HD2  PRO  66           HD2      PRO  66  26.341  -3.022  -3.154
  500    HD3  PRO  66           HD3      PRO  66  26.264  -1.250  -3.062
  501    H    HIS  67           H        HIS  67  22.048  -3.369  -3.650
  502    HA   HIS  67           HA       HIS  67  21.845  -6.006  -4.943
  503    HB2  HIS  67           HB2      HIS  67  21.544  -5.337  -2.015
  504    HB3  HIS  67           HB3      HIS  67  20.867  -6.803  -2.716
  505    HD1  HIS  67           HD1      HIS  67  22.359  -8.778  -2.616
  506    HD2  HIS  67           HD2      HIS  67  24.501  -5.209  -2.540
  507    HE1  HIS  67           HE1      HIS  67  24.761  -9.435  -2.265
  508    HE2  HIS  67           HE2      HIS  67  26.012  -7.257  -2.071
  509    H    TYR  68           H        TYR  68  20.358  -5.278  -6.370
  510    HA   TYR  68           HA       TYR  68  17.687  -4.740  -5.335
  511    HB2  TYR  68           HB2      TYR  68  17.383  -2.762  -6.688
  512    HB3  TYR  68           HB3      TYR  68  18.841  -2.531  -5.730
  513    HD1  TYR  68           HD1      TYR  68  21.097  -2.970  -6.868
  514    HD2  TYR  68           HD2      TYR  68  17.452  -2.573  -9.022
  515    HE1  TYR  68           HE1      TYR  68  22.368  -2.519  -8.924
  516    HE2  TYR  68           HE2      TYR  68  18.707  -2.125 -11.083
  517    HH   TYR  68           HH       TYR  68  22.065  -2.673 -11.348
  518    H    HIS  69           H        HIS  69  16.221  -4.506  -7.483
  519    HA   HIS  69           HA       HIS  69  16.655  -6.978  -8.904
  520    HB2  HIS  69           HB2      HIS  69  14.458  -4.922  -8.957
  521    HB3  HIS  69           HB3      HIS  69  14.505  -6.263 -10.093
  522    HD1  HIS  69           HD1      HIS  69  12.849  -7.931  -9.325
  523    HD2  HIS  69           HD2      HIS  69  14.968  -6.284  -6.154
  524    HE1  HIS  69           HE1      HIS  69  12.068  -9.164  -7.277
  525    HE2  HIS  69           HE2      HIS  69  13.513  -8.289  -5.410
  526    H    GLU  70           H        GLU  70  18.645  -6.356  -9.894
  527    HA   GLU  70           HA       GLU  70  18.855  -4.234 -11.731
  528    HB2  GLU  70           HB2      GLU  70  20.881  -5.458 -12.555
  529    HB3  GLU  70           HB3      GLU  70  20.860  -5.150 -10.826
  530    HG2  GLU  70           HG2      GLU  70  20.047  -7.487 -10.502
  531    HG3  GLU  70           HG3      GLU  70  20.309  -7.753 -12.224
  532    H    TYR  71           H        TYR  71  17.714  -4.004 -13.476
  533    HA   TYR  71           HA       TYR  71  16.485  -6.217 -14.825
  534    HB2  TYR  71           HB2      TYR  71  15.600  -4.467 -16.358
  535    HB3  TYR  71           HB3      TYR  71  15.263  -4.131 -14.665
  536    HD1  TYR  71           HD1      TYR  71  16.909  -2.976 -17.677
  537    HD2  TYR  71           HD2      TYR  71  16.571  -2.360 -13.481
  538    HE1  TYR  71           HE1      TYR  71  17.920  -0.749 -17.927
  539    HE2  TYR  71           HE2      TYR  71  17.580  -0.133 -13.721
  540    HH   TYR  71           HH       TYR  71  19.142   1.008 -15.378
  541    H    HIS  72           H        HIS  72  19.317  -4.264 -15.215
  542    HA   HIS  72           HA       HIS  72  20.363  -6.023 -17.214
  543    HB2  HIS  72           HB2      HIS  72  18.962  -4.593 -18.639
  544    HB3  HIS  72           HB3      HIS  72  19.748  -3.161 -17.989
  545    HD1  HIS  72           HD1      HIS  72  21.437  -2.246 -19.525
  546    HD2  HIS  72           HD2      HIS  72  21.109  -6.371 -19.893
  547    HE1  HIS  72           HE1      HIS  72  23.048  -2.892 -21.345
  548    HE2  HIS  72           HE2      HIS  72  22.710  -5.367 -21.657
  549    H    THR  73           H        THR  73  22.180  -6.332 -16.056
  550    HA   THR  73           HA       THR  73  23.998  -4.053 -15.869
  551    HB   THR  73           HB       THR  73  23.564  -5.947 -13.543
  552    HG1  THR  73           HG1      THR  73  21.951  -4.137 -14.099
  553   HG21  THR  73          HG21      THR  73  25.866  -5.120 -13.737
  554   HG22  THR  73          HG22      THR  73  25.057  -4.420 -12.335
  555   HG23  THR  73          HG23      THR  73  25.268  -3.463 -13.800
  Start of MODEL    4
    1    H1   GLN  -1           H1       GLN  -1   1.053  12.183  -6.563
    2    H2   GLN  -1           H2       GLN  -1   1.207  11.281  -5.141
    3    H3   GLN  -1           H3       GLN  -1  -0.140  11.066  -6.139
    4    HA   GLN  -1           HA       GLN  -1   1.197  10.159  -7.877
    5    HB2  GLN  -1           HB2      GLN  -1   3.496  10.558  -5.953
    6    HB3  GLN  -1           HB3      GLN  -1   3.594   9.726  -7.497
    7    HG2  GLN  -1           HG2      GLN  -1   3.010  11.806  -8.647
    8    HG3  GLN  -1           HG3      GLN  -1   2.939  12.635  -7.092
    9   HE21  GLN  -1          HE21      GLN  -1   4.846  13.031  -5.966
   10   HE22  GLN  -1          HE22      GLN  -1   6.392  12.965  -6.739
   11    H    SER   0           H        SER   0  -0.337   9.413  -5.405
   12    HA   SER   0           HA       SER   0   0.409   6.621  -5.399
   13    HB2  SER   0           HB2      SER   0   0.378   8.174  -2.800
   14    HB3  SER   0           HB3      SER   0   0.635   6.440  -2.973
   15    HG   SER   0           HG       SER   0   2.403   7.475  -4.540
   16    H    MET   1           H        MET   1  -1.854   8.177  -6.283
   17    HA   MET   1           HA       MET   1  -3.955   7.197  -4.485
   18    HB2  MET   1           HB2      MET   1  -4.058   9.573  -5.177
   19    HB3  MET   1           HB3      MET   1  -4.186   9.070  -6.852
   20    HG2  MET   1           HG2      MET   1  -6.303   7.943  -6.321
   21    HG3  MET   1           HG3      MET   1  -6.168   8.505  -4.658
   22    HE1  MET   1           HE1      MET   1  -4.985  11.436  -5.050
   23    HE2  MET   1           HE2      MET   1  -6.303  11.060  -3.939
   24    HE3  MET   1           HE3      MET   1  -6.467  12.388  -5.087
   25    H    ALA   2           H        ALA   2  -5.850   6.213  -5.568
   26    HA   ALA   2           HA       ALA   2  -6.817   4.589  -6.811
   27    HB1  ALA   2           HB1      ALA   2  -6.012   4.047  -9.069
   28    HB2  ALA   2           HB2      ALA   2  -4.608   5.079  -8.794
   29    HB3  ALA   2           HB3      ALA   2  -6.225   5.780  -8.823
   30    H    LEU   3           H        LEU   3  -3.332   4.122  -7.181
   31    HA   LEU   3           HA       LEU   3  -3.662   1.410  -6.128
   32    HB2  LEU   3           HB2      LEU   3  -1.056   2.551  -7.060
   33    HB3  LEU   3           HB3      LEU   3  -1.454   0.897  -6.816
   34    HG   LEU   3           HG       LEU   3  -3.068   1.166  -8.781
   35   HD11  LEU   3          HD11      LEU   3  -3.196   3.459  -9.057
   36   HD12  LEU   3          HD12      LEU   3  -2.144   2.933 -10.373
   37   HD13  LEU   3          HD13      LEU   3  -1.454   3.660  -8.921
   38   HD21  LEU   3          HD21      LEU   3  -1.287   0.728 -10.383
   39   HD22  LEU   3          HD22      LEU   3  -0.977  -0.116  -8.867
   40   HD23  LEU   3          HD23      LEU   3  -0.094   1.361  -9.250
   41    H    HIS   4           H        HIS   4  -2.090   0.733  -4.470
   42    HA   HIS   4           HA       HIS   4  -1.844   2.937  -2.525
   43    HB2  HIS   4           HB2      HIS   4  -2.527   0.033  -2.060
   44    HB3  HIS   4           HB3      HIS   4  -2.104   1.149  -0.767
   45    HD1  HIS   4           HD1      HIS   4  -3.885   2.808  -0.010
   46    HD2  HIS   4           HD2      HIS   4  -5.024   0.522  -3.279
   47    HE1  HIS   4           HE1      HIS   4  -6.325   3.284  -0.344
   48    HE2  HIS   4           HE2      HIS   4  -6.942   2.055  -2.450
   49    H    TYR   5           H        TYR   5   0.036   3.240  -1.555
   50    HA   TYR   5           HA       TYR   5   2.230   1.630  -2.612
   51    HB2  TYR   5           HB2      TYR   5   1.923   4.492  -1.826
   52    HB3  TYR   5           HB3      TYR   5   3.528   3.751  -1.736
   53    HD1  TYR   5           HD1      TYR   5   0.775   3.265  -4.229
   54    HD2  TYR   5           HD2      TYR   5   4.731   4.622  -3.479
   55    HE1  TYR   5           HE1      TYR   5   1.102   3.623  -6.638
   56    HE2  TYR   5           HE2      TYR   5   5.070   4.982  -5.874
   57    HH   TYR   5           HH       TYR   5   4.182   4.241  -7.992
   58    H    TYR   6           H        TYR   6   2.644   0.053  -1.253
   59    HA   TYR   6           HA       TYR   6   3.338   0.830   1.496
   60    HB2  TYR   6           HB2      TYR   6   2.440  -1.835   0.400
   61    HB3  TYR   6           HB3      TYR   6   3.134  -1.628   2.004
   62    HD1  TYR   6           HD1      TYR   6   1.973   0.040   3.585
   63    HD2  TYR   6           HD2      TYR   6   0.163  -1.552   0.068
   64    HE1  TYR   6           HE1      TYR   6  -0.268   0.593   4.473
   65    HE2  TYR   6           HE2      TYR   6  -2.064  -0.998   0.944
   66    HH   TYR   6           HH       TYR   6  -3.142  -0.609   3.096
   67    H    CYS   7           H        CYS   7   5.345   0.409   2.186
   68    HA   CYS   7           HA       CYS   7   7.339   0.099   0.185
   69    HB2  CYS   7           HB2      CYS   7   7.982   1.509   1.970
   70    HB3  CYS   7           HB3      CYS   7   7.364   0.366   3.145
   71    H    ARG   8           H        ARG   8   8.147  -1.710  -0.568
   72    HA   ARG   8           HA       ARG   8   8.113  -4.171   0.914
   73    HB2  ARG   8           HB2      ARG   8   9.809  -4.841  -0.930
   74    HB3  ARG   8           HB3      ARG   8   8.136  -4.562  -1.387
   75    HG2  ARG   8           HG2      ARG   8   8.649  -2.450  -2.325
   76    HG3  ARG   8           HG3      ARG   8  10.270  -2.457  -1.620
   77    HD2  ARG   8           HD2      ARG   8   9.333  -4.510  -3.608
   78    HD3  ARG   8           HD3      ARG   8  10.104  -2.999  -4.088
   79    HE   ARG   8           HE       ARG   8  11.939  -3.892  -2.431
   80   HH11  ARG   8          HH11      ARG   8  10.052  -5.705  -4.768
   81   HH12  ARG   8          HH12      ARG   8  11.297  -6.873  -5.061
   82   HH21  ARG   8          HH21      ARG   8  13.582  -5.433  -2.827
   83   HH22  ARG   8          HH22      ARG   8  13.309  -6.723  -3.956
   84    H    HIS   9           H        HIS   9   9.377  -4.551   2.544
   85    HA   HIS   9           HA       HIS   9  11.455  -5.130   3.445
   86    HB2  HIS   9           HB2      HIS   9  12.718  -4.246   1.474
   87    HB3  HIS   9           HB3      HIS   9  12.663  -2.652   2.217
   88    HD1  HIS   9           HD1      HIS   9  14.322  -2.183   4.124
   89    HD2  HIS   9           HD2      HIS   9  14.378  -6.123   2.797
   90    HE1  HIS   9           HE1      HIS   9  16.328  -3.233   5.204
   91    HE2  HIS   9           HE2      HIS   9  16.221  -5.658   4.548
   92    H    CYS  10           H        CYS  10  10.990  -1.536   3.399
   93    HA   CYS  10           HA       CYS  10  11.721  -1.532   6.203
   94    HB2  CYS  10           HB2      CYS  10  10.623   0.964   5.027
   95    HB3  CYS  10           HB3      CYS  10  12.000   0.734   6.090
   96    H    GLY  11           H        GLY  11   8.803  -1.687   4.357
   97    HA2  GLY  11           HA2      GLY  11   6.715  -2.282   5.148
   98    HA3  GLY  11           HA3      GLY  11   7.365  -2.219   6.790
   99    H    VAL  12           H        VAL  12   7.792   0.598   4.908
  100    HA   VAL  12           HA       VAL  12   5.868   1.993   6.508
  101    HB   VAL  12           HB       VAL  12   7.978   3.024   6.553
  102   HG11  VAL  12          HG11      VAL  12   8.899   1.981   4.537
  103   HG12  VAL  12          HG12      VAL  12   9.201   3.716   4.576
  104   HG13  VAL  12          HG13      VAL  12   7.928   3.068   3.543
  105   HG21  VAL  12          HG21      VAL  12   7.566   5.233   5.638
  106   HG22  VAL  12          HG22      VAL  12   6.115   4.578   6.393
  107   HG23  VAL  12          HG23      VAL  12   6.269   4.582   4.638
  108    H    LYS  13           H        LYS  13   4.210   3.194   5.776
  109    HA   LYS  13           HA       LYS  13   3.129   2.426   3.200
  110    HB2  LYS  13           HB2      LYS  13   1.982   4.395   5.183
  111    HB3  LYS  13           HB3      LYS  13   1.119   3.537   3.917
  112    HG2  LYS  13           HG2      LYS  13   1.537   1.420   5.097
  113    HG3  LYS  13           HG3      LYS  13   2.348   2.314   6.382
  114    HD2  LYS  13           HD2      LYS  13  -0.525   2.711   5.548
  115    HD3  LYS  13           HD3      LYS  13  -0.002   1.743   6.924
  116    HE2  LYS  13           HE2      LYS  13   0.495   4.699   6.569
  117    HE3  LYS  13           HE3      LYS  13  -0.757   3.988   7.584
  118    HZ1  LYS  13           HZ1      LYS  13   1.169   4.618   8.884
  119    HZ2  LYS  13           HZ2      LYS  13   2.168   3.634   7.944
  120    HZ3  LYS  13           HZ3      LYS  13   0.972   2.939   8.911
  121    H    VAL  14           H        VAL  14   3.686   3.517   1.388
  122    HA   VAL  14           HA       VAL  14   5.058   6.061   1.739
  123    HB   VAL  14           HB       VAL  14   4.860   5.139  -1.016
  124   HG11  VAL  14          HG11      VAL  14   7.184   5.714   0.812
  125   HG12  VAL  14          HG12      VAL  14   6.397   6.863  -0.274
  126   HG13  VAL  14          HG13      VAL  14   7.282   5.489  -0.935
  127   HG21  VAL  14          HG21      VAL  14   6.181   3.315   0.989
  128   HG22  VAL  14          HG22      VAL  14   6.410   3.238  -0.759
  129   HG23  VAL  14          HG23      VAL  14   4.820   2.922  -0.066
  130    H    GLY  15           H        GLY  15   1.966   4.982   0.799
  131    HA2  GLY  15           HA2      GLY  15   1.530   7.371  -0.858
  132    HA3  GLY  15           HA3      GLY  15   0.481   5.961  -0.800
  133    H    SER  16           H        SER  16  -0.164   5.560   1.665
  134    HA   SER  16           HA       SER  16  -1.478   8.030   2.490
  135    HB2  SER  16           HB2      SER  16  -2.016   5.137   3.185
  136    HB3  SER  16           HB3      SER  16  -2.933   6.506   3.810
  137    HG   SER  16           HG       SER  16  -3.645   5.295   1.770
  138    H    LEU  17           H        LEU  17  -0.629   9.140   4.088
  139    HA   LEU  17           HA       LEU  17   1.027   7.734   6.068
  140    HB2  LEU  17           HB2      LEU  17   2.037   9.969   6.517
  141    HB3  LEU  17           HB3      LEU  17   2.345   9.350   4.909
  142    HG   LEU  17           HG       LEU  17   0.017  11.169   5.210
  143   HD11  LEU  17          HD11      LEU  17   1.482  13.139   5.039
  144   HD12  LEU  17          HD12      LEU  17   2.881  12.105   5.328
  145   HD13  LEU  17          HD13      LEU  17   1.655  12.301   6.580
  146   HD21  LEU  17          HD21      LEU  17   0.781  11.924   3.026
  147   HD22  LEU  17          HD22      LEU  17   0.641  10.167   3.055
  148   HD23  LEU  17          HD23      LEU  17   2.229  10.927   3.170
  149    H    GLU  18           H        GLU  18  -1.847   9.324   5.522
  150    HA   GLU  18           HA       GLU  18  -2.207  10.407   8.153
  151    HB2  GLU  18           HB2      GLU  18  -4.158  10.010   5.887
  152    HB3  GLU  18           HB3      GLU  18  -4.519  10.865   7.377
  153    HG2  GLU  18           HG2      GLU  18  -2.932  12.571   6.859
  154    HG3  GLU  18           HG3      GLU  18  -2.351  11.668   5.459
  155    H    SER  19           H        SER  19  -3.086   9.419   9.877
  156    HA   SER  19           HA       SER  19  -4.542   6.899   9.426
  157    HB2  SER  19           HB2      SER  19  -3.055   7.836  11.889
  158    HB3  SER  19           HB3      SER  19  -3.991   6.347  11.785
  159    HG   SER  19           HG       SER  19  -1.631   6.222  11.396
  160    H    SER  20           H        SER  20  -4.820  10.138  10.435
  161    HA   SER  20           HA       SER  20  -6.972   9.897  12.263
  162    HB2  SER  20           HB2      SER  20  -6.236  12.222  10.471
  163    HB3  SER  20           HB3      SER  20  -7.338  12.296  11.843
  164    HG   SER  20           HG       SER  20  -4.813  11.250  12.348
  165    H    MET  21           H        MET  21  -7.067  11.122   8.907
  166    HA   MET  21           HA       MET  21  -9.742   9.921   8.662
  167    HB2  MET  21           HB2      MET  21  -8.483  12.090   6.997
  168    HB3  MET  21           HB3      MET  21 -10.113  11.476   6.806
  169    HG2  MET  21           HG2      MET  21 -10.690  12.295   9.031
  170    HG3  MET  21           HG3      MET  21  -9.054  12.919   9.223
  171    HE1  MET  21           HE1      MET  21 -10.004  15.338   9.822
  172    HE2  MET  21           HE2      MET  21 -11.628  14.662   9.685
  173    HE3  MET  21           HE3      MET  21 -11.222  16.158   8.846
  174    H    VAL  22           H        VAL  22  -9.113   7.898   8.148
  175    HA   VAL  22           HA       VAL  22  -7.494   7.562   5.714
  176    HB   VAL  22           HB       VAL  22  -6.238   7.064   7.805
  177   HG11  VAL  22          HG11      VAL  22  -8.018   6.219   9.185
  178   HG12  VAL  22          HG12      VAL  22  -6.750   5.001   9.036
  179   HG13  VAL  22          HG13      VAL  22  -8.241   4.843   8.109
  180   HG21  VAL  22          HG21      VAL  22  -6.686   4.660   6.047
  181   HG22  VAL  22          HG22      VAL  22  -5.278   4.964   7.064
  182   HG23  VAL  22          HG23      VAL  22  -5.612   6.014   5.687
  183    H    SER  23           H        SER  23 -10.508   7.301   6.760
  184    HA   SER  23           HA       SER  23 -11.249   4.644   6.101
  185    HB2  SER  23           HB2      SER  23 -12.681   6.156   7.447
  186    HB3  SER  23           HB3      SER  23 -12.945   7.154   6.018
  187    HG   SER  23           HG       SER  23 -13.585   4.809   5.201
  188    H    THR  24           H        THR  24 -10.447   7.390   4.221
  189    HA   THR  24           HA       THR  24 -11.766   6.533   1.816
  190    HB   THR  24           HB       THR  24 -11.327   8.924   2.242
  191    HG1  THR  24           HG1      THR  24 -11.273   7.872   0.019
  192   HG21  THR  24          HG21      THR  24  -9.191   8.729   3.406
  193   HG22  THR  24          HG22      THR  24  -9.050   9.819   2.026
  194   HG23  THR  24          HG23      THR  24  -8.418   8.176   1.920
  195    H    ASP  25           H        ASP  25  -9.108   5.400   3.472
  196    HA   ASP  25           HA       ASP  25  -7.541   4.782   1.070
  197    HB2  ASP  25           HB2      ASP  25  -6.357   5.780   2.996
  198    HB3  ASP  25           HB3      ASP  25  -6.889   4.452   4.011
  199    H    SER  26           H        SER  26  -9.841   3.598   3.156
  200    HA   SER  26           HA       SER  26  -9.622   0.898   2.192
  201    HB2  SER  26           HB2      SER  26  -7.950   1.168   4.076
  202    HB3  SER  26           HB3      SER  26  -9.328   1.404   5.145
  203    HG   SER  26           HG       SER  26  -9.429  -0.688   5.236
  204    H    LEU  27           H        LEU  27 -11.706   0.988   1.518
  205    HA   LEU  27           HA       LEU  27 -13.923   0.664   1.596
  206    HB2  LEU  27           HB2      LEU  27 -13.540   0.439   4.564
  207    HB3  LEU  27           HB3      LEU  27 -14.999   0.038   3.696
  208    HG   LEU  27           HG       LEU  27 -12.359  -1.371   3.612
  209   HD11  LEU  27          HD11      LEU  27 -13.822  -1.905   5.472
  210   HD12  LEU  27          HD12      LEU  27 -13.699  -3.266   4.357
  211   HD13  LEU  27          HD13      LEU  27 -15.135  -2.242   4.349
  212   HD21  LEU  27          HD21      LEU  27 -14.767  -1.785   1.867
  213   HD22  LEU  27          HD22      LEU  27 -13.377  -2.868   1.959
  214   HD23  LEU  27          HD23      LEU  27 -13.179  -1.224   1.351
  215    H    GLY  28           H        GLY  28 -14.548   2.538   0.845
  216    HA2  GLY  28           HA2      GLY  28 -15.099   4.707   2.767
  217    HA3  GLY  28           HA3      GLY  28 -14.763   4.957   1.059
  218    H    PHE  29           H        PHE  29 -17.092   3.474   3.273
  219    HA   PHE  29           HA       PHE  29 -19.133   3.450   1.233
  220    HB2  PHE  29           HB2      PHE  29 -19.386   2.775   4.173
  221    HB3  PHE  29           HB3      PHE  29 -20.506   2.342   2.890
  222    HD1  PHE  29           HD1      PHE  29 -17.788   1.259   4.853
  223    HD2  PHE  29           HD2      PHE  29 -19.560   0.829   1.007
  224    HE1  PHE  29           HE1      PHE  29 -16.655  -0.892   4.578
  225    HE2  PHE  29           HE2      PHE  29 -18.414  -1.328   0.722
  226    HZ   PHE  29           HZ       PHE  29 -16.960  -2.194   2.510
  227    H    GLN  30           H        GLN  30 -21.337   4.077   2.732
  228    HA   GLN  30           HA       GLN  30 -20.932   6.846   3.632
  229    HB2  GLN  30           HB2      GLN  30 -23.120   5.834   1.801
  230    HB3  GLN  30           HB3      GLN  30 -23.114   7.420   2.553
  231    HG2  GLN  30           HG2      GLN  30 -20.940   6.455   0.720
  232    HG3  GLN  30           HG3      GLN  30 -22.363   7.337   0.170
  233   HE21  GLN  30          HE21      GLN  30 -19.413   7.514   2.006
  234   HE22  GLN  30          HE22      GLN  30 -19.335   9.241   2.081
  235    H    HIS  31           H        HIS  31 -23.598   4.586   3.230
  236    HA   HIS  31           HA       HIS  31 -24.435   5.025   6.003
  237    HB2  HIS  31           HB2      HIS  31 -26.151   5.238   4.268
  238    HB3  HIS  31           HB3      HIS  31 -25.785   3.622   3.678
  239    HD1  HIS  31           HD1      HIS  31 -26.748   1.625   5.001
  240    HD2  HIS  31           HD2      HIS  31 -27.696   5.344   6.607
  241    HE1  HIS  31           HE1      HIS  31 -28.570   1.195   6.679
  242    HE2  HIS  31           HE2      HIS  31 -29.079   3.445   7.689
  243    H    LEU  32           H        LEU  32 -22.969   3.735   7.199
  244    HA   LEU  32           HA       LEU  32 -23.566   0.936   6.963
  245    HB2  LEU  32           HB2      LEU  32 -21.306   0.124   6.917
  246    HB3  LEU  32           HB3      LEU  32 -21.675   1.054   5.500
  247    HG   LEU  32           HG       LEU  32 -19.464   1.594   6.017
  248   HD11  LEU  32          HD11      LEU  32 -20.991   3.794   7.357
  249   HD12  LEU  32          HD12      LEU  32 -20.799   3.603   5.615
  250   HD13  LEU  32          HD13      LEU  32 -19.388   3.900   6.631
  251   HD21  LEU  32          HD21      LEU  32 -20.248   1.890   8.902
  252   HD22  LEU  32          HD22      LEU  32 -18.642   2.187   8.237
  253   HD23  LEU  32          HD23      LEU  32 -19.329   0.562   8.191
  254    H    THR  33           H        THR  33 -23.251  -0.296   8.619
  255    HA   THR  33           HA       THR  33 -21.927   0.631  11.020
  256    HB   THR  33           HB       THR  33 -24.310   1.200  11.362
  257    HG1  THR  33           HG1      THR  33 -24.265   0.466  13.363
  258   HG21  THR  33          HG21      THR  33 -26.007  -0.567  11.473
  259   HG22  THR  33          HG22      THR  33 -24.814  -1.740  10.917
  260   HG23  THR  33          HG23      THR  33 -25.319  -0.428   9.855
  261    H    ASN  34           H        ASN  34 -22.728  -1.748  12.494
  262    HA   ASN  34           HA       ASN  34 -20.766  -3.530  11.719
  263    HB2  ASN  34           HB2      ASN  34 -23.325  -4.145  13.205
  264    HB3  ASN  34           HB3      ASN  34 -21.942  -5.227  13.105
  265   HD21  ASN  34          HD21      ASN  34 -23.243  -3.924  15.388
  266   HD22  ASN  34          HD22      ASN  34 -21.983  -3.067  16.203
  267    H    GLU  35           H        GLU  35 -24.226  -3.662  10.908
  268    HA   GLU  35           HA       GLU  35 -23.997  -6.111   9.499
  269    HB2  GLU  35           HB2      GLU  35 -26.289  -5.722   8.771
  270    HB3  GLU  35           HB3      GLU  35 -26.108  -5.432  10.494
  271    HG2  GLU  35           HG2      GLU  35 -26.103  -3.051  10.132
  272    HG3  GLU  35           HG3      GLU  35 -26.150  -3.296   8.389
  273    H    GLU  36           H        GLU  36 -23.897  -2.719   8.444
  274    HA   GLU  36           HA       GLU  36 -24.085  -3.409   5.666
  275    HB2  GLU  36           HB2      GLU  36 -23.111  -0.841   6.904
  276    HB3  GLU  36           HB3      GLU  36 -23.679  -1.063   5.260
  277    HG2  GLU  36           HG2      GLU  36 -25.438  -1.530   7.644
  278    HG3  GLU  36           HG3      GLU  36 -25.271   0.049   6.886
  279    H    ARG  37           H        ARG  37 -21.582  -2.949   8.023
  280    HA   ARG  37           HA       ARG  37 -19.366  -2.488   6.445
  281    HB2  ARG  37           HB2      ARG  37 -19.363  -2.294   8.858
  282    HB3  ARG  37           HB3      ARG  37 -19.696  -4.008   9.035
  283    HG2  ARG  37           HG2      ARG  37 -17.542  -4.539   8.101
  284    HG3  ARG  37           HG3      ARG  37 -17.199  -2.825   7.874
  285    HD2  ARG  37           HD2      ARG  37 -16.131  -3.708   9.903
  286    HD3  ARG  37           HD3      ARG  37 -17.320  -2.461  10.273
  287    HE   ARG  37           HE       ARG  37 -18.287  -5.192  10.397
  288   HH11  ARG  37          HH11      ARG  37 -16.920  -2.498  12.165
  289   HH12  ARG  37          HH12      ARG  37 -17.515  -3.038  13.702
  290   HH21  ARG  37          HH21      ARG  37 -19.074  -5.906  12.426
  291   HH22  ARG  37          HH22      ARG  37 -18.741  -4.974  13.851
  292    H    ASN  38           H        ASN  38 -20.827  -5.570   7.443
  293    HA   ASN  38           HA       ASN  38 -18.920  -7.133   5.959
  294    HB2  ASN  38           HB2      ASN  38 -19.984  -7.971   8.038
  295    HB3  ASN  38           HB3      ASN  38 -21.535  -7.993   7.209
  296   HD21  ASN  38          HD21      ASN  38 -21.786 -10.200   7.492
  297   HD22  ASN  38          HD22      ASN  38 -20.852 -11.358   6.611
  298    H    ASP  39           H        ASP  39 -22.207  -5.981   5.449
  299    HA   ASP  39           HA       ASP  39 -22.689  -7.727   3.227
  300    HB2  ASP  39           HB2      ASP  39 -24.559  -7.041   4.589
  301    HB3  ASP  39           HB3      ASP  39 -24.225  -5.342   4.267
  302    H    MET  40           H        MET  40 -21.797  -4.329   3.577
  303    HA   MET  40           HA       MET  40 -22.128  -3.793   0.771
  304    HB2  MET  40           HB2      MET  40 -21.040  -2.177   3.063
  305    HB3  MET  40           HB3      MET  40 -21.014  -1.589   1.408
  306    HG2  MET  40           HG2      MET  40 -23.487  -2.400   2.917
  307    HG3  MET  40           HG3      MET  40 -22.924  -0.743   2.702
  308    HE1  MET  40           HE1      MET  40 -23.214  -0.293  -1.179
  309    HE2  MET  40           HE2      MET  40 -21.803  -0.891  -0.312
  310    HE3  MET  40           HE3      MET  40 -22.736   0.452   0.345
  311    H    ILE  41           H        ILE  41 -19.493  -4.793   2.828
  312    HA   ILE  41           HA       ILE  41 -17.383  -3.847   1.227
  313    HB   ILE  41           HB       ILE  41 -17.084  -4.719   3.563
  314   HG12  ILE  41          HG12      ILE  41 -15.315  -5.876   1.399
  315   HG13  ILE  41          HG13      ILE  41 -15.172  -4.274   2.109
  316   HG21  ILE  41          HG21      ILE  41 -18.357  -6.760   3.435
  317   HG22  ILE  41          HG22      ILE  41 -16.678  -7.155   3.806
  318   HG23  ILE  41          HG23      ILE  41 -17.300  -7.381   2.167
  319   HD11  ILE  41          HD11      ILE  41 -14.790  -6.870   3.581
  320   HD12  ILE  41          HD12      ILE  41 -14.580  -5.251   4.244
  321   HD13  ILE  41          HD13      ILE  41 -13.502  -5.828   2.976
  322    H    SER  42           H        SER  42 -16.451  -4.568  -0.528
  323    HA   SER  42           HA       SER  42 -16.608  -7.242  -1.468
  324    HB2  SER  42           HB2      SER  42 -17.778  -6.524  -3.640
  325    HB3  SER  42           HB3      SER  42 -18.799  -6.732  -2.221
  326    HG   SER  42           HG       SER  42 -18.819  -4.499  -1.943
  327    H    TYR  43           H        TYR  43 -14.427  -6.183  -0.905
  328    HA   TYR  43           HA       TYR  43 -12.358  -5.548  -1.606
  329    HB2  TYR  43           HB2      TYR  43 -12.961  -6.712  -3.767
  330    HB3  TYR  43           HB3      TYR  43 -13.530  -5.163  -4.372
  331    HD1  TYR  43           HD1      TYR  43 -10.461  -6.439  -2.648
  332    HD2  TYR  43           HD2      TYR  43 -12.087  -4.136  -5.834
  333    HE1  TYR  43           HE1      TYR  43  -8.191  -5.952  -3.450
  334    HE2  TYR  43           HE2      TYR  43  -9.819  -3.641  -6.641
  335    HH   TYR  43           HH       TYR  43  -7.561  -3.598  -5.890
  336    H    LYS  44           H        LYS  44 -11.278  -3.487  -2.616
  337    HA   LYS  44           HA       LYS  44 -12.597  -1.261  -1.412
  338    HB2  LYS  44           HB2      LYS  44  -9.967  -1.713  -2.734
  339    HB3  LYS  44           HB3      LYS  44 -10.551  -0.059  -2.610
  340    HG2  LYS  44           HG2      LYS  44  -9.068  -0.686  -0.751
  341    HG3  LYS  44           HG3      LYS  44 -10.683  -0.237  -0.204
  342    HD2  LYS  44           HD2      LYS  44 -11.258  -2.646  -0.083
  343    HD3  LYS  44           HD3      LYS  44  -9.595  -3.033  -0.514
  344    HE2  LYS  44           HE2      LYS  44 -10.426  -1.448   1.913
  345    HE3  LYS  44           HE3      LYS  44 -10.042  -3.167   1.917
  346    HZ1  LYS  44           HZ1      LYS  44  -7.803  -2.625   1.175
  347    HZ2  LYS  44           HZ2      LYS  44  -8.161  -1.853   2.636
  348    HZ3  LYS  44           HZ3      LYS  44  -8.172  -0.976   1.191
  349    H    GLU  45           H        GLU  45 -13.646   0.389  -2.303
  350    HA   GLU  45           HA       GLU  45 -15.223  -0.260  -4.511
  351    HB2  GLU  45           HB2      GLU  45 -15.951   1.129  -2.632
  352    HB3  GLU  45           HB3      GLU  45 -14.874   2.409  -3.141
  353    HG2  GLU  45           HG2      GLU  45 -16.149   2.549  -5.231
  354    HG3  GLU  45           HG3      GLU  45 -17.277   1.360  -4.602
  355    H    ASN  46           H        ASN  46 -12.202   1.439  -4.460
  356    HA   ASN  46           HA       ASN  46 -12.862   2.995  -6.828
  357    HB2  ASN  46           HB2      ASN  46 -10.276   2.889  -5.266
  358    HB3  ASN  46           HB3      ASN  46 -10.671   4.041  -6.535
  359   HD21  ASN  46          HD21      ASN  46 -11.119   3.134  -3.252
  360   HD22  ASN  46          HD22      ASN  46 -11.978   4.549  -2.751
  361    H    GLY  47           H        GLY  47 -11.999  -0.117  -6.466
  362    HA2  GLY  47           HA2      GLY  47 -10.978  -1.640  -7.890
  363    HA3  GLY  47           HA3      GLY  47 -10.755  -0.318  -9.049
  364    H    ASP  48           H        ASP  48  -9.747  -0.108  -5.776
  365    HA   ASP  48           HA       ASP  48  -7.297   1.009  -6.193
  366    HB2  ASP  48           HB2      ASP  48  -8.167  -0.724  -3.878
  367    HB3  ASP  48           HB3      ASP  48  -6.820   0.401  -3.859
  368    H    VAL  49           H        VAL  49  -5.135   0.245  -5.784
  369    HA   VAL  49           HA       VAL  49  -4.743  -2.577  -6.487
  370    HB   VAL  49           HB       VAL  49  -2.859  -0.436  -7.379
  371   HG11  VAL  49          HG11      VAL  49  -2.142  -2.122  -8.986
  372   HG12  VAL  49          HG12      VAL  49  -3.365  -3.236  -8.378
  373   HG13  VAL  49          HG13      VAL  49  -2.028  -2.745  -7.339
  374   HG21  VAL  49          HG21      VAL  49  -3.950  -0.566  -9.594
  375   HG22  VAL  49          HG22      VAL  49  -4.979   0.139  -8.348
  376   HG23  VAL  49          HG23      VAL  49  -5.238  -1.526  -8.868
  377    H    HIS  50           H        HIS  50  -3.927  -3.577  -4.722
  378    HA   HIS  50           HA       HIS  50  -2.337  -2.164  -2.794
  379    HB2  HIS  50           HB2      HIS  50  -3.811  -4.137  -2.245
  380    HB3  HIS  50           HB3      HIS  50  -2.653  -5.165  -3.081
  381    HD1  HIS  50           HD1      HIS  50  -3.388  -3.688   0.168
  382    HD2  HIS  50           HD2      HIS  50  -0.031  -5.196  -1.770
  383    HE1  HIS  50           HE1      HIS  50  -1.695  -4.115   1.978
  384    HE2  HIS  50           HE2      HIS  50   0.258  -5.187   0.801
  385    H    VAL  51           H        VAL  51  -0.266  -1.681  -3.020
  386    HA   VAL  51           HA       VAL  51   1.313  -3.183  -4.994
  387    HB   VAL  51           HB       VAL  51   0.798  -0.231  -4.796
  388   HG11  VAL  51          HG11      VAL  51   3.230  -0.494  -4.834
  389   HG12  VAL  51          HG12      VAL  51   2.607   0.233  -6.314
  390   HG13  VAL  51          HG13      VAL  51   3.096  -1.463  -6.301
  391   HG21  VAL  51          HG21      VAL  51   0.371  -0.449  -7.181
  392   HG22  VAL  51          HG22      VAL  51  -0.615  -1.578  -6.251
  393   HG23  VAL  51          HG23      VAL  51   0.811  -2.157  -7.112
  394    H    LEU  52           H        LEU  52   3.193  -3.858  -4.232
  395    HA   LEU  52           HA       LEU  52   4.381  -2.575  -1.889
  396    HB2  LEU  52           HB2      LEU  52   5.169  -5.100  -3.354
  397    HB3  LEU  52           HB3      LEU  52   5.959  -4.479  -1.917
  398    HG   LEU  52           HG       LEU  52   3.076  -5.375  -2.032
  399   HD11  LEU  52          HD11      LEU  52   5.509  -6.773  -0.924
  400   HD12  LEU  52          HD12      LEU  52   4.583  -7.260  -2.344
  401   HD13  LEU  52          HD13      LEU  52   3.840  -7.313  -0.746
  402   HD21  LEU  52          HD21      LEU  52   3.253  -5.267   0.425
  403   HD22  LEU  52          HD22      LEU  52   3.441  -3.693  -0.343
  404   HD23  LEU  52          HD23      LEU  52   4.857  -4.555   0.259
  405    H    THR  53           H        THR  53   5.636  -0.927  -2.299
  406    HA   THR  53           HA       THR  53   7.282  -0.950  -4.746
  407    HB   THR  53           HB       THR  53   5.420   0.601  -5.019
  408    HG1  THR  53           HG1      THR  53   7.014   1.613  -6.017
  409   HG21  THR  53          HG21      THR  53   5.133   2.524  -3.532
  410   HG22  THR  53          HG22      THR  53   6.423   1.916  -2.495
  411   HG23  THR  53          HG23      THR  53   4.923   1.004  -2.665
  412    H    ILE  54           H        ILE  54   9.215   0.413  -4.594
  413    HA   ILE  54           HA       ILE  54  10.415   0.138  -1.972
  414    HB   ILE  54           HB       ILE  54  11.439   0.375  -4.727
  415   HG12  ILE  54          HG12      ILE  54  12.646  -0.853  -2.255
  416   HG13  ILE  54          HG13      ILE  54  11.439  -1.652  -3.239
  417   HG21  ILE  54          HG21      ILE  54  13.035   1.529  -2.448
  418   HG22  ILE  54          HG22      ILE  54  12.363   2.440  -3.801
  419   HG23  ILE  54          HG23      ILE  54  13.619   1.236  -4.086
  420   HD11  ILE  54          HD11      ILE  54  12.973  -1.527  -5.161
  421   HD12  ILE  54          HD12      ILE  54  13.621  -2.458  -3.811
  422   HD13  ILE  54          HD13      ILE  54  14.187  -0.812  -4.098
  423    H    CYS  55           H        CYS  55  10.181   1.660  -0.582
  424    HA   CYS  55           HA       CYS  55   9.600   4.369  -1.318
  425    HB2  CYS  55           HB2      CYS  55   9.196   4.764   0.954
  426    HB3  CYS  55           HB3      CYS  55   8.729   3.084   0.753
  427    H    GLU  56           H        GLU  56  10.979   6.167  -0.300
  428    HA   GLU  56           HA       GLU  56  13.398   6.198  -1.622
  429    HB2  GLU  56           HB2      GLU  56  12.180   8.177  -0.757
  430    HB3  GLU  56           HB3      GLU  56  12.702   7.773   0.867
  431    HG2  GLU  56           HG2      GLU  56  15.053   8.011   0.084
  432    HG3  GLU  56           HG3      GLU  56  14.418   8.614  -1.447
  433    H    ASP  57           H        ASP  57  12.777   5.206   1.724
  434    HA   ASP  57           HA       ASP  57  15.412   5.151   2.636
  435    HB2  ASP  57           HB2      ASP  57  13.332   4.870   4.034
  436    HB3  ASP  57           HB3      ASP  57  13.274   3.198   3.482
  437    H    CYS  58           H        CYS  58  13.531   2.509   1.129
  438    HA   CYS  58           HA       CYS  58  15.813   0.769   1.165
  439    HB2  CYS  58           HB2      CYS  58  14.260  -0.532  -0.555
  440    HB3  CYS  58           HB3      CYS  58  13.968  -0.596   1.173
  441    H    GLN  59           H        GLN  59  14.267   2.885  -1.154
  442    HA   GLN  59           HA       GLN  59  15.769   2.397  -3.436
  443    HB2  GLN  59           HB2      GLN  59  13.885   3.873  -3.431
  444    HB3  GLN  59           HB3      GLN  59  14.677   4.969  -2.309
  445    HG2  GLN  59           HG2      GLN  59  14.816   5.981  -4.429
  446    HG3  GLN  59           HG3      GLN  59  16.420   5.335  -4.098
  447   HE21  GLN  59          HE21      GLN  59  17.177   3.643  -5.259
  448   HE22  GLN  59          HE22      GLN  59  16.428   3.092  -6.705
  449    H    GLU  60           H        GLU  60  16.673   4.300  -0.591
  450    HA   GLU  60           HA       GLU  60  19.139   5.099  -1.770
  451    HB2  GLU  60           HB2      GLU  60  17.693   5.959   0.347
  452    HB3  GLU  60           HB3      GLU  60  18.941   5.068   1.167
  453    HG2  GLU  60           HG2      GLU  60  20.601   6.379   0.076
  454    HG3  GLU  60           HG3      GLU  60  19.393   7.279  -0.809
  455    H    ALA  61           H        ALA  61  18.152   2.668   0.584
  456    HA   ALA  61           HA       ALA  61  20.530   1.319   1.023
  457    HB1  ALA  61           HB1      ALA  61  19.167  -0.643   1.389
  458    HB2  ALA  61           HB2      ALA  61  17.846   0.064   0.455
  459    HB3  ALA  61           HB3      ALA  61  18.306   0.771   2.006
  460    H    LEU  62           H        LEU  62  18.494   1.553  -1.700
  461    HA   LEU  62           HA       LEU  62  19.497  -0.591  -3.303
  462    HB2  LEU  62           HB2      LEU  62  17.864   1.860  -3.716
  463    HB3  LEU  62           HB3      LEU  62  18.469   1.014  -5.104
  464    HG   LEU  62           HG       LEU  62  16.186   0.466  -3.451
  465   HD11  LEU  62          HD11      LEU  62  15.642  -0.982  -5.388
  466   HD12  LEU  62          HD12      LEU  62  17.247  -0.632  -6.029
  467   HD13  LEU  62          HD13      LEU  62  16.077   0.672  -5.821
  468   HD21  LEU  62          HD21      LEU  62  18.024  -1.873  -3.905
  469   HD22  LEU  62          HD22      LEU  62  16.360  -1.953  -3.322
  470   HD23  LEU  62          HD23      LEU  62  17.602  -1.177  -2.340
  471    H    ASP  63           H        ASP  63  19.804   2.914  -3.573
  472    HA   ASP  63           HA       ASP  63  21.651   2.798  -5.718
  473    HB2  ASP  63           HB2      ASP  63  20.195   4.662  -5.622
  474    HB3  ASP  63           HB3      ASP  63  20.622   5.025  -3.953
  475    H    ARG  64           H        ARG  64  21.999   3.283  -2.240
  476    HA   ARG  64           HA       ARG  64  24.905   3.247  -2.609
  477    HB2  ARG  64           HB2      ARG  64  23.957   5.439  -1.903
  478    HB3  ARG  64           HB3      ARG  64  23.318   4.659  -0.465
  479    HG2  ARG  64           HG2      ARG  64  25.322   5.815   0.076
  480    HG3  ARG  64           HG3      ARG  64  25.613   4.084   0.206
  481    HD2  ARG  64           HD2      ARG  64  26.658   4.103  -2.008
  482    HD3  ARG  64           HD3      ARG  64  26.382   5.840  -2.124
  483    HE   ARG  64           HE       ARG  64  27.803   5.483   0.195
  484   HH11  ARG  64          HH11      ARG  64  28.277   4.722  -3.179
  485   HH12  ARG  64          HH12      ARG  64  30.005   4.881  -3.110
  486   HH21  ARG  64          HH21      ARG  64  30.084   5.674   0.309
  487   HH22  ARG  64          HH22      ARG  64  31.036   5.410  -1.119
  488    H    ASN  65           H        ASN  65  24.764   0.928  -2.403
  489    HA   ASN  65           HA       ASN  65  23.822  -0.408  -0.127
  490    HB2  ASN  65           HB2      ASN  65  25.887  -1.085  -2.186
  491    HB3  ASN  65           HB3      ASN  65  25.760  -2.082  -0.745
  492   HD21  ASN  65          HD21      ASN  65  22.997  -0.518  -2.221
  493   HD22  ASN  65          HD22      ASN  65  22.260  -1.969  -2.805
  494    HA   PRO  66           HA       PRO  66  28.283   0.323   1.814
  495    HB2  PRO  66           HB2      PRO  66  28.887   2.893   0.453
  496    HB3  PRO  66           HB3      PRO  66  29.979   1.585   0.920
  497    HG2  PRO  66           HG2      PRO  66  29.313   1.948  -1.629
  498    HG3  PRO  66           HG3      PRO  66  29.475   0.318  -0.952
  499    HD2  PRO  66           HD2      PRO  66  26.999   1.887  -1.549
  500    HD3  PRO  66           HD3      PRO  66  27.323   0.159  -1.786
  501    H    HIS  67           H        HIS  67  28.231   1.328   3.734
  502    HA   HIS  67           HA       HIS  67  27.587   2.648   5.439
  503    HB2  HIS  67           HB2      HIS  67  27.019   4.539   3.186
  504    HB3  HIS  67           HB3      HIS  67  26.507   4.935   4.824
  505    HD1  HIS  67           HD1      HIS  67  28.189   6.088   6.215
  506    HD2  HIS  67           HD2      HIS  67  29.940   3.989   3.086
  507    HE1  HIS  67           HE1      HIS  67  30.641   6.639   6.320
  508    HE2  HIS  67           HE2      HIS  67  31.698   5.178   4.557
  509    H    TYR  68           H        TYR  68  25.638   0.973   3.584
  510    HA   TYR  68           HA       TYR  68  23.410   1.510   5.419
  511    HB2  TYR  68           HB2      TYR  68  22.942   2.048   2.910
  512    HB3  TYR  68           HB3      TYR  68  22.943   0.299   2.699
  513    HD1  TYR  68           HD1      TYR  68  21.137   3.160   4.030
  514    HD2  TYR  68           HD2      TYR  68  21.212  -1.086   3.794
  515    HE1  TYR  68           HE1      TYR  68  18.808   3.083   4.811
  516    HE2  TYR  68           HE2      TYR  68  18.880  -1.175   4.569
  517    HH   TYR  68           HH       TYR  68  16.894   1.627   4.771
  518    H    HIS  69           H        HIS  69  22.694  -0.212   6.533
  519    HA   HIS  69           HA       HIS  69  24.186  -2.662   6.378
  520    HB2  HIS  69           HB2      HIS  69  21.928  -1.705   8.124
  521    HB3  HIS  69           HB3      HIS  69  22.487  -3.372   8.180
  522    HD1  HIS  69           HD1      HIS  69  24.059  -3.723  10.048
  523    HD2  HIS  69           HD2      HIS  69  24.422   0.090   8.436
  524    HE1  HIS  69           HE1      HIS  69  25.860  -2.590  11.386
  525    HE2  HIS  69           HE2      HIS  69  26.131  -0.321  10.327
  526    H    GLU  70           H        GLU  70  23.798  -3.794   4.583
  527    HA   GLU  70           HA       GLU  70  21.139  -3.959   3.485
  528    HB2  GLU  70           HB2      GLU  70  22.173  -5.206   1.666
  529    HB3  GLU  70           HB3      GLU  70  23.077  -3.735   2.001
  530    HG2  GLU  70           HG2      GLU  70  24.732  -5.033   3.237
  531    HG3  GLU  70           HG3      GLU  70  23.823  -6.507   2.902
  532    H    TYR  71           H        TYR  71  20.139  -5.977   2.937
  533    HA   TYR  71           HA       TYR  71  20.867  -8.268   4.603
  534    HB2  TYR  71           HB2      TYR  71  18.239  -6.810   4.607
  535    HB3  TYR  71           HB3      TYR  71  18.306  -8.530   4.977
  536    HD1  TYR  71           HD1      TYR  71  19.620  -9.305   6.943
  537    HD2  TYR  71           HD2      TYR  71  18.880  -5.180   6.219
  538    HE1  TYR  71           HE1      TYR  71  20.172  -8.799   9.285
  539    HE2  TYR  71           HE2      TYR  71  19.433  -4.663   8.559
  540    HH   TYR  71           HH       TYR  71  19.462  -5.834  10.743
  541    H    HIS  72           H        HIS  72  19.449 -10.192   3.956
  542    HA   HIS  72           HA       HIS  72  19.685 -10.500   1.114
  543    HB2  HIS  72           HB2      HIS  72  20.185 -12.286   2.842
  544    HB3  HIS  72           HB3      HIS  72  18.449 -12.445   3.065
  545    HD1  HIS  72           HD1      HIS  72  21.092 -12.927   0.399
  546    HD2  HIS  72           HD2      HIS  72  17.186 -14.062   1.249
  547    HE1  HIS  72           HE1      HIS  72  20.493 -14.638  -1.340
  548    HE2  HIS  72           HE2      HIS  72  18.186 -15.428  -0.701
  549    H    THR  73           H        THR  73  18.071  -8.594   1.004
  550    HA   THR  73           HA       THR  73  15.308  -9.276   1.304
  551    HB   THR  73           HB       THR  73  15.980  -6.962   1.588
  552    HG1  THR  73           HG1      THR  73  13.989  -7.765   0.072
  553   HG21  THR  73          HG21      THR  73  16.806  -7.030  -1.314
  554   HG22  THR  73          HG22      THR  73  17.869  -6.828   0.077
  555   HG23  THR  73          HG23      THR  73  16.694  -5.577  -0.322
  Start of MODEL    5
    1    H1   GLN  -1           H1       GLN  -1  -7.294  15.465  -3.260
    2    H2   GLN  -1           H2       GLN  -1  -6.312  15.966  -1.979
    3    H3   GLN  -1           H3       GLN  -1  -7.968  15.742  -1.733
    4    HA   GLN  -1           HA       GLN  -1  -6.674  13.928  -0.808
    5    HB2  GLN  -1           HB2      GLN  -1  -8.291  13.117  -3.231
    6    HB3  GLN  -1           HB3      GLN  -1  -7.905  12.091  -1.859
    7    HG2  GLN  -1           HG2      GLN  -1  -9.195  13.619  -0.409
    8    HG3  GLN  -1           HG3      GLN  -1  -9.650  14.540  -1.842
    9   HE21  GLN  -1          HE21      GLN  -1 -11.336  13.112   0.044
   10   HE22  GLN  -1          HE22      GLN  -1 -12.216  11.940  -0.876
   11    H    SER   0           H        SER   0  -6.593  13.725  -4.383
   12    HA   SER   0           HA       SER   0  -5.062  12.887  -5.823
   13    HB2  SER   0           HB2      SER   0  -3.125  13.767  -3.668
   14    HB3  SER   0           HB3      SER   0  -2.673  13.318  -5.314
   15    HG   SER   0           HG       SER   0  -3.561  15.673  -4.400
   16    H    MET   1           H        MET   1  -6.283  10.894  -4.797
   17    HA   MET   1           HA       MET   1  -4.252   8.998  -3.822
   18    HB2  MET   1           HB2      MET   1  -7.254   8.689  -3.698
   19    HB3  MET   1           HB3      MET   1  -6.054   7.669  -2.924
   20    HG2  MET   1           HG2      MET   1  -6.537  10.563  -2.266
   21    HG3  MET   1           HG3      MET   1  -7.181   9.196  -1.361
   22    HE1  MET   1           HE1      MET   1  -4.034   7.616   0.243
   23    HE2  MET   1           HE2      MET   1  -4.869   7.118  -1.227
   24    HE3  MET   1           HE3      MET   1  -5.795   7.641   0.180
   25    H    ALA   2           H        ALA   2  -4.062   6.996  -4.848
   26    HA   ALA   2           HA       ALA   2  -5.693   6.408  -7.153
   27    HB1  ALA   2           HB1      ALA   2  -3.875   6.310  -8.751
   28    HB2  ALA   2           HB2      ALA   2  -2.741   6.865  -7.524
   29    HB3  ALA   2           HB3      ALA   2  -4.022   7.936  -8.089
   30    H    LEU   3           H        LEU   3  -2.442   5.457  -6.193
   31    HA   LEU   3           HA       LEU   3  -3.472   2.770  -5.567
   32    HB2  LEU   3           HB2      LEU   3  -0.810   3.408  -6.835
   33    HB3  LEU   3           HB3      LEU   3  -1.264   1.846  -6.245
   34    HG   LEU   3           HG       LEU   3  -3.174   1.917  -7.932
   35   HD11  LEU   3          HD11      LEU   3  -2.782   3.375  -9.845
   36   HD12  LEU   3          HD12      LEU   3  -1.443   4.125  -8.975
   37   HD13  LEU   3          HD13      LEU   3  -3.086   4.281  -8.363
   38   HD21  LEU   3          HD21      LEU   3  -1.711   1.203  -9.768
   39   HD22  LEU   3          HD22      LEU   3  -1.228   0.493  -8.230
   40   HD23  LEU   3          HD23      LEU   3  -0.318   1.847  -8.900
   41    H    HIS   4           H        HIS   4  -2.092   1.581  -3.995
   42    HA   HIS   4           HA       HIS   4  -1.225   3.540  -1.961
   43    HB2  HIS   4           HB2      HIS   4  -2.431   0.806  -1.524
   44    HB3  HIS   4           HB3      HIS   4  -1.928   1.909  -0.264
   45    HD1  HIS   4           HD1      HIS   4  -4.853   0.672  -1.036
   46    HD2  HIS   4           HD2      HIS   4  -3.522   4.590  -1.428
   47    HE1  HIS   4           HE1      HIS   4  -6.924   2.092  -1.000
   48    HE2  HIS   4           HE2      HIS   4  -6.106   4.441  -1.390
   49    H    TYR   5           H        TYR   5   0.827   3.396  -1.469
   50    HA   TYR   5           HA       TYR   5   2.305   1.036  -2.368
   51    HB2  TYR   5           HB2      TYR   5   3.256   3.797  -1.588
   52    HB3  TYR   5           HB3      TYR   5   4.326   2.458  -2.006
   53    HD1  TYR   5           HD1      TYR   5   5.281   4.063  -3.630
   54    HD2  TYR   5           HD2      TYR   5   1.287   2.650  -3.975
   55    HE1  TYR   5           HE1      TYR   5   5.254   4.741  -5.973
   56    HE2  TYR   5           HE2      TYR   5   1.247   3.328  -6.337
   57    HH   TYR   5           HH       TYR   5   2.372   4.883  -7.822
   58    H    TYR   6           H        TYR   6   3.072  -0.362  -0.964
   59    HA   TYR   6           HA       TYR   6   3.635   0.520   1.783
   60    HB2  TYR   6           HB2      TYR   6   2.397  -2.139   0.994
   61    HB3  TYR   6           HB3      TYR   6   2.810  -1.634   2.630
   62    HD1  TYR   6           HD1      TYR   6   1.592   0.411   3.591
   63    HD2  TYR   6           HD2      TYR   6   0.287  -1.618   0.076
   64    HE1  TYR   6           HE1      TYR   6  -0.643   1.402   3.846
   65    HE2  TYR   6           HE2      TYR   6  -1.944  -0.622   0.328
   66    HH   TYR   6           HH       TYR   6  -3.349   0.328   2.122
   67    H    CYS   7           H        CYS   7   5.691   0.003   2.396
   68    HA   CYS   7           HA       CYS   7   7.314  -0.682   0.169
   69    HB2  CYS   7           HB2      CYS   7   7.998   1.061   1.791
   70    HB3  CYS   7           HB3      CYS   7   8.264  -0.191   2.973
   71    H    ARG   8           H        ARG   8   8.527  -2.313  -0.284
   72    HA   ARG   8           HA       ARG   8   8.356  -4.871   0.794
   73    HB2  ARG   8           HB2      ARG   8   9.307  -4.407  -1.400
   74    HB3  ARG   8           HB3      ARG   8  10.607  -3.474  -0.675
   75    HG2  ARG   8           HG2      ARG   8  11.235  -5.658   0.522
   76    HG3  ARG   8           HG3      ARG   8  10.197  -6.438  -0.680
   77    HD2  ARG   8           HD2      ARG   8  12.477  -6.448  -1.470
   78    HD3  ARG   8           HD3      ARG   8  11.525  -5.354  -2.465
   79    HE   ARG   8           HE       ARG   8  12.547  -3.514  -1.282
   80   HH11  ARG   8          HH11      ARG   8  14.032  -6.651  -0.801
   81   HH12  ARG   8          HH12      ARG   8  15.573  -5.993  -0.350
   82   HH21  ARG   8          HH21      ARG   8  14.584  -2.650  -0.681
   83   HH22  ARG   8          HH22      ARG   8  15.882  -3.724  -0.282
   84    H    HIS   9           H        HIS   9   8.796  -5.334   2.868
   85    HA   HIS   9           HA       HIS   9  10.191  -6.025   4.545
   86    HB2  HIS   9           HB2      HIS   9  12.153  -5.988   3.143
   87    HB3  HIS   9           HB3      HIS   9  12.257  -4.237   3.257
   88    HD1  HIS   9           HD1      HIS   9  14.203  -3.659   4.643
   89    HD2  HIS   9           HD2      HIS   9  12.212  -6.990   6.128
   90    HE1  HIS   9           HE1      HIS   9  15.417  -4.285   6.747
   91    HE2  HIS   9           HE2      HIS   9  14.284  -6.384   7.555
   92    H    CYS  10           H        CYS  10   9.708  -2.654   3.842
   93    HA   CYS  10           HA       CYS  10  10.073  -1.966   6.658
   94    HB2  CYS  10           HB2      CYS  10   9.280  -0.207   4.361
   95    HB3  CYS  10           HB3      CYS  10   9.690   0.342   5.970
   96    H    GLY  11           H        GLY  11   7.584  -2.482   4.286
   97    HA2  GLY  11           HA2      GLY  11   5.300  -2.564   4.466
   98    HA3  GLY  11           HA3      GLY  11   5.495  -2.444   6.223
   99    H    VAL  12           H        VAL  12   7.157   0.094   4.880
  100    HA   VAL  12           HA       VAL  12   5.336   1.917   5.973
  101    HB   VAL  12           HB       VAL  12   7.598   2.512   6.199
  102   HG11  VAL  12          HG11      VAL  12   7.815   2.570   3.195
  103   HG12  VAL  12          HG12      VAL  12   8.474   1.321   4.244
  104   HG13  VAL  12          HG13      VAL  12   9.089   2.961   4.350
  105   HG21  VAL  12          HG21      VAL  12   7.689   4.724   5.178
  106   HG22  VAL  12          HG22      VAL  12   6.122   4.383   5.912
  107   HG23  VAL  12          HG23      VAL  12   6.321   4.285   4.161
  108    H    LYS  13           H        LYS  13   3.982   3.315   5.158
  109    HA   LYS  13           HA       LYS  13   2.854   2.651   2.605
  110    HB2  LYS  13           HB2      LYS  13   2.105   4.975   4.372
  111    HB3  LYS  13           HB3      LYS  13   1.100   4.165   3.187
  112    HG2  LYS  13           HG2      LYS  13   1.049   2.169   4.585
  113    HG3  LYS  13           HG3      LYS  13   2.079   2.973   5.771
  114    HD2  LYS  13           HD2      LYS  13   0.331   4.730   6.006
  115    HD3  LYS  13           HD3      LYS  13  -0.708   3.779   4.944
  116    HE2  LYS  13           HE2      LYS  13   0.398   2.908   7.612
  117    HE3  LYS  13           HE3      LYS  13  -1.261   3.400   7.287
  118    HZ1  LYS  13           HZ1      LYS  13  -1.465   1.504   5.778
  119    HZ2  LYS  13           HZ2      LYS  13  -1.083   1.012   7.347
  120    HZ3  LYS  13           HZ3      LYS  13   0.113   1.022   6.155
  121    H    VAL  14           H        VAL  14   4.242   3.239   0.981
  122    HA   VAL  14           HA       VAL  14   5.536   5.826   0.959
  123    HB   VAL  14           HB       VAL  14   5.561   4.424  -1.599
  124   HG11  VAL  14          HG11      VAL  14   7.742   5.222   0.308
  125   HG12  VAL  14          HG12      VAL  14   7.092   6.208  -1.010
  126   HG13  VAL  14          HG13      VAL  14   7.961   4.715  -1.368
  127   HG21  VAL  14          HG21      VAL  14   6.608   2.947   0.806
  128   HG22  VAL  14          HG22      VAL  14   7.036   2.587  -0.867
  129   HG23  VAL  14          HG23      VAL  14   5.371   2.402  -0.329
  130    H    GLY  15           H        GLY  15   2.529   4.641   0.056
  131    HA2  GLY  15           HA2      GLY  15   2.069   6.976  -1.680
  132    HA3  GLY  15           HA3      GLY  15   1.547   5.378  -2.197
  133    H    SER  16           H        SER  16   1.442   6.911   0.970
  134    HA   SER  16           HA       SER  16  -1.346   7.456   0.886
  135    HB2  SER  16           HB2      SER  16  -1.349   4.975   1.181
  136    HB3  SER  16           HB3      SER  16  -0.471   5.184   2.688
  137    HG   SER  16           HG       SER  16  -2.260   6.418   3.452
  138    H    LEU  17           H        LEU  17  -0.592   9.445   1.504
  139    HA   LEU  17           HA       LEU  17   0.598   9.600   4.183
  140    HB2  LEU  17           HB2      LEU  17   1.570  11.758   3.537
  141    HB3  LEU  17           HB3      LEU  17   2.156  10.447   2.538
  142    HG   LEU  17           HG       LEU  17  -0.121  12.137   1.562
  143   HD11  LEU  17          HD11      LEU  17   2.807  12.832   1.401
  144   HD12  LEU  17          HD12      LEU  17   1.561  13.741   2.255
  145   HD13  LEU  17          HD13      LEU  17   1.519  13.625   0.496
  146   HD21  LEU  17          HD21      LEU  17   2.161  10.762   0.151
  147   HD22  LEU  17          HD22      LEU  17   0.779  11.553  -0.605
  148   HD23  LEU  17          HD23      LEU  17   0.546  10.088   0.347
  149    H    GLU  18           H        GLU  18  -1.948  10.457   2.129
  150    HA   GLU  18           HA       GLU  18  -2.998  12.508   3.856
  151    HB2  GLU  18           HB2      GLU  18  -4.095  11.175   1.382
  152    HB3  GLU  18           HB3      GLU  18  -4.979  12.394   2.290
  153    HG2  GLU  18           HG2      GLU  18  -2.268  12.826   1.057
  154    HG3  GLU  18           HG3      GLU  18  -3.798  13.278   0.304
  155    H    SER  19           H        SER  19  -2.544  10.202   5.228
  156    HA   SER  19           HA       SER  19  -5.166   8.946   5.625
  157    HB2  SER  19           HB2      SER  19  -2.433   8.181   6.681
  158    HB3  SER  19           HB3      SER  19  -3.915   7.262   6.879
  159    HG   SER  19           HG       SER  19  -3.980   7.204   4.501
  160    H    SER  20           H        SER  20  -3.484  11.467   6.691
  161    HA   SER  20           HA       SER  20  -3.270  11.358   9.441
  162    HB2  SER  20           HB2      SER  20  -3.971  13.847   7.886
  163    HB3  SER  20           HB3      SER  20  -3.028  13.729   9.371
  164    HG   SER  20           HG       SER  20  -1.540  12.400   8.038
  165    H    MET  21           H        MET  21  -5.967  12.882   7.619
  166    HA   MET  21           HA       MET  21  -7.518  12.867  10.109
  167    HB2  MET  21           HB2      MET  21  -8.988  14.488   9.045
  168    HB3  MET  21           HB3      MET  21  -7.320  15.035   8.946
  169    HG2  MET  21           HG2      MET  21  -7.184  14.417   6.642
  170    HG3  MET  21           HG3      MET  21  -8.763  13.636   6.706
  171    HE1  MET  21           HE1      MET  21 -11.199  16.644   7.057
  172    HE2  MET  21           HE2      MET  21 -10.510  15.708   8.382
  173    HE3  MET  21           HE3      MET  21 -11.033  14.895   6.907
  174    H    VAL  22           H        VAL  22  -7.168  11.229   7.194
  175    HA   VAL  22           HA       VAL  22  -9.736   9.898   7.616
  176    HB   VAL  22           HB       VAL  22 -10.133  11.409   5.792
  177   HG11  VAL  22          HG11      VAL  22  -8.867  11.302   3.686
  178   HG12  VAL  22          HG12      VAL  22  -7.722  10.203   4.457
  179   HG13  VAL  22          HG13      VAL  22  -7.893  11.856   5.048
  180   HG21  VAL  22          HG21      VAL  22 -11.208   9.262   5.601
  181   HG22  VAL  22          HG22      VAL  22  -9.782   8.579   4.822
  182   HG23  VAL  22          HG23      VAL  22 -10.729   9.815   3.996
  183    H    SER  23           H        SER  23  -9.101   7.984   8.334
  184    HA   SER  23           HA       SER  23  -6.698   6.699   7.702
  185    HB2  SER  23           HB2      SER  23  -9.289   5.465   8.672
  186    HB3  SER  23           HB3      SER  23  -7.691   4.723   8.762
  187    HG   SER  23           HG       SER  23  -7.596   7.171   9.849
  188    H    THR  24           H        THR  24  -6.071   5.744   5.916
  189    HA   THR  24           HA       THR  24  -7.931   5.438   3.726
  190    HB   THR  24           HB       THR  24  -5.013   4.683   3.684
  191    HG1  THR  24           HG1      THR  24  -6.210   7.180   4.002
  192   HG21  THR  24          HG21      THR  24  -5.167   5.420   1.353
  193   HG22  THR  24          HG22      THR  24  -6.860   5.849   1.592
  194   HG23  THR  24          HG23      THR  24  -6.357   4.161   1.688
  195    H    ASP  25           H        ASP  25  -7.893   3.665   6.166
  196    HA   ASP  25           HA       ASP  25  -7.440   1.026   5.003
  197    HB2  ASP  25           HB2      ASP  25  -8.392   1.854   7.762
  198    HB3  ASP  25           HB3      ASP  25  -8.062   0.201   7.260
  199    H    SER  26           H        SER  26  -9.793   3.364   5.400
  200    HA   SER  26           HA       SER  26 -12.163   1.955   5.763
  201    HB2  SER  26           HB2      SER  26 -11.956   4.390   5.956
  202    HB3  SER  26           HB3      SER  26 -11.640   4.511   4.228
  203    HG   SER  26           HG       SER  26 -13.715   4.448   3.889
  204    H    LEU  27           H        LEU  27 -13.561   0.953   4.420
  205    HA   LEU  27           HA       LEU  27 -12.620  -0.042   1.914
  206    HB2  LEU  27           HB2      LEU  27 -15.228  -0.295   3.382
  207    HB3  LEU  27           HB3      LEU  27 -14.993  -0.969   1.782
  208    HG   LEU  27           HG       LEU  27 -12.976  -2.198   2.821
  209   HD11  LEU  27          HD11      LEU  27 -14.521  -1.542   5.324
  210   HD12  LEU  27          HD12      LEU  27 -12.899  -0.975   4.923
  211   HD13  LEU  27          HD13      LEU  27 -13.190  -2.692   5.198
  212   HD21  LEU  27          HD21      LEU  27 -15.789  -2.930   3.591
  213   HD22  LEU  27          HD22      LEU  27 -14.412  -4.029   3.511
  214   HD23  LEU  27          HD23      LEU  27 -15.013  -3.261   2.043
  215    H    GLY  28           H        GLY  28 -14.060   0.092  -0.062
  216    HA2  GLY  28           HA2      GLY  28 -14.198   2.889  -0.721
  217    HA3  GLY  28           HA3      GLY  28 -14.438   1.544  -1.822
  218    H    PHE  29           H        PHE  29 -16.085   2.852   1.054
  219    HA   PHE  29           HA       PHE  29 -18.587   2.838  -0.511
  220    HB2  PHE  29           HB2      PHE  29 -18.350   2.603   2.498
  221    HB3  PHE  29           HB3      PHE  29 -19.824   2.495   1.552
  222    HD1  PHE  29           HD1      PHE  29 -18.089   0.549   3.517
  223    HD2  PHE  29           HD2      PHE  29 -19.057   0.701  -0.623
  224    HE1  PHE  29           HE1      PHE  29 -17.787  -1.885   3.362
  225    HE2  PHE  29           HE2      PHE  29 -18.758  -1.735  -0.784
  226    HZ   PHE  29           HZ       PHE  29 -18.123  -3.029   1.210
  227    H    GLN  30           H        GLN  30 -19.345   4.289   2.297
  228    HA   GLN  30           HA       GLN  30 -18.319   6.905   1.447
  229    HB2  GLN  30           HB2      GLN  30 -21.096   6.307   2.485
  230    HB3  GLN  30           HB3      GLN  30 -20.459   7.917   2.192
  231    HG2  GLN  30           HG2      GLN  30 -20.549   5.878   0.008
  232    HG3  GLN  30           HG3      GLN  30 -21.972   6.826   0.426
  233   HE21  GLN  30          HE21      GLN  30 -18.787   8.209   0.704
  234   HE22  GLN  30          HE22      GLN  30 -18.917   9.264  -0.654
  235    H    HIS  31           H        HIS  31 -20.374   6.107   4.195
  236    HA   HIS  31           HA       HIS  31 -18.102   6.703   5.968
  237    HB2  HIS  31           HB2      HIS  31 -19.817   8.557   5.849
  238    HB3  HIS  31           HB3      HIS  31 -20.987   7.431   6.525
  239    HD1  HIS  31           HD1      HIS  31 -18.383   9.814   7.470
  240    HD2  HIS  31           HD2      HIS  31 -20.298   6.570   9.231
  241    HE1  HIS  31           HE1      HIS  31 -17.914  10.004   9.930
  242    HE2  HIS  31           HE2      HIS  31 -18.950   7.948  10.951
  243    H    LEU  32           H        LEU  32 -17.656   4.547   6.303
  244    HA   LEU  32           HA       LEU  32 -19.849   2.850   7.237
  245    HB2  LEU  32           HB2      LEU  32 -18.235   0.969   6.867
  246    HB3  LEU  32           HB3      LEU  32 -18.761   1.801   5.428
  247    HG   LEU  32           HG       LEU  32 -16.203   2.688   6.675
  248   HD11  LEU  32          HD11      LEU  32 -14.979   0.914   5.516
  249   HD12  LEU  32          HD12      LEU  32 -16.508   0.149   5.082
  250   HD13  LEU  32          HD13      LEU  32 -16.029   0.267   6.776
  251   HD21  LEU  32          HD21      LEU  32 -16.857   2.165   3.792
  252   HD22  LEU  32          HD22      LEU  32 -15.589   3.192   4.458
  253   HD23  LEU  32          HD23      LEU  32 -17.280   3.674   4.590
  254    H    THR  33           H        THR  33 -19.339   1.280   8.871
  255    HA   THR  33           HA       THR  33 -17.371   2.175  10.852
  256    HB   THR  33           HB       THR  33 -19.049   1.598  12.622
  257    HG1  THR  33           HG1      THR  33 -21.306   1.861  11.338
  258   HG21  THR  33          HG21      THR  33 -19.913   3.774  10.711
  259   HG22  THR  33          HG22      THR  33 -18.693   3.939  11.974
  260   HG23  THR  33          HG23      THR  33 -20.377   3.646  12.407
  261    H    ASN  34           H        ASN  34 -17.670   0.239  12.728
  262    HA   ASN  34           HA       ASN  34 -16.649  -2.119  11.625
  263    HB2  ASN  34           HB2      ASN  34 -17.023  -3.142  13.793
  264    HB3  ASN  34           HB3      ASN  34 -16.464  -1.492  14.031
  265   HD21  ASN  34          HD21      ASN  34 -17.834   0.016  14.937
  266   HD22  ASN  34          HD22      ASN  34 -19.344  -0.414  15.667
  267    H    GLU  35           H        GLU  35 -19.879  -0.969  11.970
  268    HA   GLU  35           HA       GLU  35 -21.202  -3.492  11.699
  269    HB2  GLU  35           HB2      GLU  35 -22.444  -0.833  11.059
  270    HB3  GLU  35           HB3      GLU  35 -23.200  -2.263  11.748
  271    HG2  GLU  35           HG2      GLU  35 -21.940  -1.904  13.814
  272    HG3  GLU  35           HG3      GLU  35 -21.246  -0.443  13.130
  273    H    GLU  36           H        GLU  36 -20.736  -0.686   9.600
  274    HA   GLU  36           HA       GLU  36 -22.151  -1.752   7.409
  275    HB2  GLU  36           HB2      GLU  36 -20.044   0.404   7.345
  276    HB3  GLU  36           HB3      GLU  36 -21.337   0.156   6.180
  277    HG2  GLU  36           HG2      GLU  36 -21.645   0.988   9.055
  278    HG3  GLU  36           HG3      GLU  36 -21.855   2.011   7.635
  279    H    ARG  37           H        ARG  37 -18.763  -1.905   8.327
  280    HA   ARG  37           HA       ARG  37 -17.856  -2.879   5.797
  281    HB2  ARG  37           HB2      ARG  37 -15.788  -3.428   6.943
  282    HB3  ARG  37           HB3      ARG  37 -16.307  -1.804   7.366
  283    HG2  ARG  37           HG2      ARG  37 -17.123  -2.608   9.503
  284    HG3  ARG  37           HG3      ARG  37 -16.689  -4.263   9.066
  285    HD2  ARG  37           HD2      ARG  37 -14.767  -1.955   9.335
  286    HD3  ARG  37           HD3      ARG  37 -15.016  -3.221  10.536
  287    HE   ARG  37           HE       ARG  37 -14.261  -4.784   8.687
  288   HH11  ARG  37          HH11      ARG  37 -13.168  -1.469   8.940
  289   HH12  ARG  37          HH12      ARG  37 -11.663  -1.768   8.133
  290   HH21  ARG  37          HH21      ARG  37 -12.266  -5.184   7.634
  291   HH22  ARG  37          HH22      ARG  37 -11.152  -3.872   7.394
  292    H    ASN  38           H        ASN  38 -19.313  -4.267   8.554
  293    HA   ASN  38           HA       ASN  38 -18.441  -6.949   8.143
  294    HB2  ASN  38           HB2      ASN  38 -19.107  -6.241  10.359
  295    HB3  ASN  38           HB3      ASN  38 -20.717  -5.821   9.785
  296   HD21  ASN  38          HD21      ASN  38 -22.232  -7.415   9.510
  297   HD22  ASN  38          HD22      ASN  38 -21.983  -9.055  10.004
  298    H    ASP  39           H        ASP  39 -21.544  -5.273   7.516
  299    HA   ASP  39           HA       ASP  39 -22.632  -7.657   6.316
  300    HB2  ASP  39           HB2      ASP  39 -24.672  -6.491   6.087
  301    HB3  ASP  39           HB3      ASP  39 -23.983  -5.922   7.599
  302    H    MET  40           H        MET  40 -21.092  -4.740   5.178
  303    HA   MET  40           HA       MET  40 -21.683  -5.513   2.409
  304    HB2  MET  40           HB2      MET  40 -20.638  -2.932   3.573
  305    HB3  MET  40           HB3      MET  40 -20.762  -3.243   1.848
  306    HG2  MET  40           HG2      MET  40 -23.052  -3.223   3.797
  307    HG3  MET  40           HG3      MET  40 -22.633  -1.926   2.679
  308    HE1  MET  40           HE1      MET  40 -25.920  -3.289   1.110
  309    HE2  MET  40           HE2      MET  40 -25.035  -1.850   1.614
  310    HE3  MET  40           HE3      MET  40 -25.521  -3.049   2.812
  311    H    ILE  41           H        ILE  41 -19.631  -6.773   4.231
  312    HA   ILE  41           HA       ILE  41 -17.074  -5.895   3.499
  313    HB   ILE  41           HB       ILE  41 -17.536  -7.440   5.420
  314   HG12  ILE  41          HG12      ILE  41 -15.456  -8.785   5.111
  315   HG13  ILE  41          HG13      ILE  41 -15.428  -8.291   3.423
  316   HG21  ILE  41          HG21      ILE  41 -17.677  -9.521   3.253
  317   HG22  ILE  41          HG22      ILE  41 -19.006  -9.016   4.300
  318   HG23  ILE  41          HG23      ILE  41 -17.610  -9.848   4.985
  319   HD11  ILE  41          HD11      ILE  41 -13.894  -6.990   4.816
  320   HD12  ILE  41          HD12      ILE  41 -15.262  -6.420   5.772
  321   HD13  ILE  41          HD13      ILE  41 -15.134  -5.985   4.069
  322    H    SER  42           H        SER  42 -16.135  -5.891   1.640
  323    HA   SER  42           HA       SER  42 -16.085  -8.189  -0.067
  324    HB2  SER  42           HB2      SER  42 -18.212  -7.036  -0.699
  325    HB3  SER  42           HB3      SER  42 -17.275  -5.626  -1.165
  326    HG   SER  42           HG       SER  42 -16.977  -6.558  -3.005
  327    H    TYR  43           H        TYR  43 -14.454  -6.359   1.530
  328    HA   TYR  43           HA       TYR  43 -12.439  -5.322   1.482
  329    HB2  TYR  43           HB2      TYR  43 -11.980  -7.491   0.271
  330    HB3  TYR  43           HB3      TYR  43 -12.099  -6.590  -1.227
  331    HD1  TYR  43           HD1      TYR  43 -10.433  -5.756   2.017
  332    HD2  TYR  43           HD2      TYR  43 -10.003  -6.435  -2.158
  333    HE1  TYR  43           HE1      TYR  43  -8.060  -5.130   2.165
  334    HE2  TYR  43           HE2      TYR  43  -7.633  -5.813  -2.022
  335    HH   TYR  43           HH       TYR  43  -6.198  -4.396  -0.534
  336    H    LYS  44           H        LYS  44 -12.403  -5.148  -1.958
  337    HA   LYS  44           HA       LYS  44 -13.444  -2.416  -1.993
  338    HB2  LYS  44           HB2      LYS  44 -10.804  -3.214  -3.235
  339    HB3  LYS  44           HB3      LYS  44 -11.592  -1.661  -3.434
  340    HG2  LYS  44           HG2      LYS  44 -10.608  -2.746  -0.806
  341    HG3  LYS  44           HG3      LYS  44  -9.699  -1.647  -1.841
  342    HD2  LYS  44           HD2      LYS  44 -12.028  -0.300  -1.624
  343    HD3  LYS  44           HD3      LYS  44 -11.988  -1.126  -0.063
  344    HE2  LYS  44           HE2      LYS  44 -10.013   0.822  -1.213
  345    HE3  LYS  44           HE3      LYS  44 -10.893   0.919   0.309
  346    HZ1  LYS  44           HZ1      LYS  44  -8.626  -0.886  -0.355
  347    HZ2  LYS  44           HZ2      LYS  44  -9.572  -1.051   1.043
  348    HZ3  LYS  44           HZ3      LYS  44  -8.660   0.351   0.802
  349    H    GLU  45           H        GLU  45 -14.806  -2.185  -3.658
  350    HA   GLU  45           HA       GLU  45 -15.338  -4.332  -5.429
  351    HB2  GLU  45           HB2      GLU  45 -16.314  -1.480  -5.352
  352    HB3  GLU  45           HB3      GLU  45 -16.888  -2.660  -6.509
  353    HG2  GLU  45           HG2      GLU  45 -17.102  -2.900  -3.553
  354    HG3  GLU  45           HG3      GLU  45 -18.404  -2.434  -4.636
  355    H    ASN  46           H        ASN  46 -13.096  -1.801  -5.543
  356    HA   ASN  46           HA       ASN  46 -12.855  -1.854  -8.451
  357    HB2  ASN  46           HB2      ASN  46 -11.300  -0.314  -6.363
  358    HB3  ASN  46           HB3      ASN  46 -11.088  -0.153  -8.101
  359   HD21  ASN  46          HD21      ASN  46 -13.900  -0.333  -8.734
  360   HD22  ASN  46          HD22      ASN  46 -14.617   1.154  -8.210
  361    H    GLY  47           H        GLY  47 -11.925  -3.844  -6.063
  362    HA2  GLY  47           HA2      GLY  47 -10.430  -5.639  -6.229
  363    HA3  GLY  47           HA3      GLY  47  -9.621  -4.810  -7.565
  364    H    ASP  48           H        ASP  48  -9.830  -2.427  -5.548
  365    HA   ASP  48           HA       ASP  48  -8.557  -1.323  -4.052
  366    HB2  ASP  48           HB2      ASP  48  -8.941  -3.302  -2.607
  367    HB3  ASP  48           HB3      ASP  48  -7.503  -4.033  -3.289
  368    H    VAL  49           H        VAL  49  -6.453  -0.473  -3.827
  369    HA   VAL  49           HA       VAL  49  -4.518  -1.484  -5.790
  370    HB   VAL  49           HB       VAL  49  -3.579   0.907  -5.541
  371   HG11  VAL  49          HG11      VAL  49  -4.555   0.107  -7.592
  372   HG12  VAL  49          HG12      VAL  49  -5.139   1.741  -7.283
  373   HG13  VAL  49          HG13      VAL  49  -6.181   0.356  -6.959
  374   HG21  VAL  49          HG21      VAL  49  -6.406   1.327  -4.545
  375   HG22  VAL  49          HG22      VAL  49  -5.326   2.614  -5.043
  376   HG23  VAL  49          HG23      VAL  49  -4.924   1.626  -3.639
  377    H    HIS  50           H        HIS  50  -3.590  -2.936  -4.367
  378    HA   HIS  50           HA       HIS  50  -2.226  -1.792  -2.034
  379    HB2  HIS  50           HB2      HIS  50  -3.879  -3.723  -1.693
  380    HB3  HIS  50           HB3      HIS  50  -2.706  -4.732  -2.533
  381    HD1  HIS  50           HD1      HIS  50  -3.607  -3.612   0.767
  382    HD2  HIS  50           HD2      HIS  50  -0.083  -4.719  -1.135
  383    HE1  HIS  50           HE1      HIS  50  -1.977  -4.110   2.610
  384    HE2  HIS  50           HE2      HIS  50   0.061  -5.001   1.430
  385    H    VAL  51           H        VAL  51  -0.333  -1.161  -2.755
  386    HA   VAL  51           HA       VAL  51   1.018  -2.781  -4.799
  387    HB   VAL  51           HB       VAL  51   0.942   0.198  -4.322
  388   HG11  VAL  51          HG11      VAL  51   2.468  -1.288  -6.439
  389   HG12  VAL  51          HG12      VAL  51   3.165  -0.426  -5.065
  390   HG13  VAL  51          HG13      VAL  51   2.284   0.463  -6.309
  391   HG21  VAL  51          HG21      VAL  51  -0.089  -1.515  -6.569
  392   HG22  VAL  51          HG22      VAL  51  -0.097   0.248  -6.550
  393   HG23  VAL  51          HG23      VAL  51  -1.050  -0.650  -5.369
  394    H    LEU  52           H        LEU  52   2.856  -3.724  -4.105
  395    HA   LEU  52           HA       LEU  52   4.270  -2.542  -1.829
  396    HB2  LEU  52           HB2      LEU  52   4.901  -5.149  -3.216
  397    HB3  LEU  52           HB3      LEU  52   5.537  -4.581  -1.688
  398    HG   LEU  52           HG       LEU  52   2.657  -5.338  -2.189
  399   HD11  LEU  52          HD11      LEU  52   4.865  -6.777  -0.726
  400   HD12  LEU  52          HD12      LEU  52   4.136  -7.264  -2.256
  401   HD13  LEU  52          HD13      LEU  52   3.173  -7.271  -0.778
  402   HD21  LEU  52          HD21      LEU  52   4.106  -4.572   0.344
  403   HD22  LEU  52          HD22      LEU  52   2.450  -5.169   0.250
  404   HD23  LEU  52          HD23      LEU  52   2.871  -3.620  -0.479
  405    H    THR  53           H        THR  53   6.154  -1.520  -2.042
  406    HA   THR  53           HA       THR  53   7.778  -1.845  -4.402
  407    HB   THR  53           HB       THR  53   6.010  -0.214  -5.113
  408    HG1  THR  53           HG1      THR  53   7.848   1.532  -5.486
  409   HG21  THR  53          HG21      THR  53   6.046   2.047  -4.204
  410   HG22  THR  53          HG22      THR  53   7.285   1.573  -3.042
  411   HG23  THR  53          HG23      THR  53   5.668   0.876  -2.940
  412    H    ILE  54           H        ILE  54   9.478   0.174  -4.224
  413    HA   ILE  54           HA       ILE  54  10.644  -0.231  -1.583
  414    HB   ILE  54           HB       ILE  54  11.678   0.090  -4.285
  415   HG12  ILE  54          HG12      ILE  54  13.019  -0.901  -1.772
  416   HG13  ILE  54          HG13      ILE  54  11.904  -1.852  -2.722
  417   HG21  ILE  54          HG21      ILE  54  13.097   1.585  -2.095
  418   HG22  ILE  54          HG22      ILE  54  12.364   2.284  -3.536
  419   HG23  ILE  54          HG23      ILE  54  13.761   1.220  -3.686
  420   HD11  ILE  54          HD11      ILE  54  14.496  -0.721  -3.708
  421   HD12  ILE  54          HD12      ILE  54  13.382  -1.726  -4.635
  422   HD13  ILE  54          HD13      ILE  54  14.215  -2.393  -3.230
  423    H    CYS  55           H        CYS  55  10.701   1.293  -0.107
  424    HA   CYS  55           HA       CYS  55   9.640   3.898  -0.576
  425    HB2  CYS  55           HB2      CYS  55  10.015   4.308   1.758
  426    HB3  CYS  55           HB3      CYS  55   9.453   2.649   1.609
  427    H    GLU  56           H        GLU  56  10.890   5.909   0.026
  428    HA   GLU  56           HA       GLU  56  13.148   6.237  -1.579
  429    HB2  GLU  56           HB2      GLU  56  11.740   8.085  -0.710
  430    HB3  GLU  56           HB3      GLU  56  12.396   7.818   0.896
  431    HG2  GLU  56           HG2      GLU  56  14.637   8.350   0.029
  432    HG3  GLU  56           HG3      GLU  56  13.918   8.712  -1.539
  433    H    ASP  57           H        ASP  57  12.900   5.454   1.870
  434    HA   ASP  57           HA       ASP  57  15.581   5.574   2.592
  435    HB2  ASP  57           HB2      ASP  57  13.950   5.259   4.300
  436    HB3  ASP  57           HB3      ASP  57  13.335   3.796   3.539
  437    H    CYS  58           H        CYS  58  13.765   2.788   1.317
  438    HA   CYS  58           HA       CYS  58  16.004   1.060   1.109
  439    HB2  CYS  58           HB2      CYS  58  13.291   1.085  -0.191
  440    HB3  CYS  58           HB3      CYS  58  14.488  -0.148  -0.570
  441    H    GLN  59           H        GLN  59  14.356   3.128  -1.200
  442    HA   GLN  59           HA       GLN  59  15.784   2.774  -3.506
  443    HB2  GLN  59           HB2      GLN  59  13.862   4.209  -3.410
  444    HB3  GLN  59           HB3      GLN  59  14.649   5.273  -2.258
  445    HG2  GLN  59           HG2      GLN  59  14.605   6.345  -4.381
  446    HG3  GLN  59           HG3      GLN  59  16.271   5.894  -4.020
  447   HE21  GLN  59          HE21      GLN  59  16.808   5.968  -6.188
  448   HE22  GLN  59          HE22      GLN  59  16.320   4.735  -7.284
  449    H    GLU  60           H        GLU  60  16.714   4.598  -0.649
  450    HA   GLU  60           HA       GLU  60  18.972   5.793  -1.852
  451    HB2  GLU  60           HB2      GLU  60  17.727   5.682   0.792
  452    HB3  GLU  60           HB3      GLU  60  19.453   5.873   0.799
  453    HG2  GLU  60           HG2      GLU  60  19.186   7.798  -0.748
  454    HG3  GLU  60           HG3      GLU  60  17.458   7.636  -0.505
  455    H    ALA  61           H        ALA  61  18.489   2.940   0.172
  456    HA   ALA  61           HA       ALA  61  21.233   2.258   0.440
  457    HB1  ALA  61           HB1      ALA  61  20.387   0.010   1.003
  458    HB2  ALA  61           HB2      ALA  61  18.773   0.497   0.488
  459    HB3  ALA  61           HB3      ALA  61  19.528   1.275   1.880
  460    H    LEU  62           H        LEU  62  18.765   1.781  -1.891
  461    HA   LEU  62           HA       LEU  62  19.894  -0.124  -3.590
  462    HB2  LEU  62           HB2      LEU  62  17.694   1.717  -3.495
  463    HB3  LEU  62           HB3      LEU  62  18.411   1.742  -5.093
  464    HG   LEU  62           HG       LEU  62  18.217  -0.728  -5.087
  465   HD11  LEU  62          HD11      LEU  62  16.589  -1.745  -3.558
  466   HD12  LEU  62          HD12      LEU  62  16.509  -0.219  -2.677
  467   HD13  LEU  62          HD13      LEU  62  18.016  -1.131  -2.725
  468   HD21  LEU  62          HD21      LEU  62  15.818  -0.717  -5.648
  469   HD22  LEU  62          HD22      LEU  62  16.678   0.660  -6.339
  470   HD23  LEU  62          HD23      LEU  62  15.682   0.875  -4.901
  471    H    ASP  63           H        ASP  63  19.676   3.341  -4.018
  472    HA   ASP  63           HA       ASP  63  21.486   3.529  -6.168
  473    HB2  ASP  63           HB2      ASP  63  19.794   5.209  -5.803
  474    HB3  ASP  63           HB3      ASP  63  20.443   5.598  -4.218
  475    H    ARG  64           H        ARG  64  22.046   3.082  -2.855
  476    HA   ARG  64           HA       ARG  64  24.462   4.558  -2.583
  477    HB2  ARG  64           HB2      ARG  64  23.058   4.006  -0.662
  478    HB3  ARG  64           HB3      ARG  64  23.366   2.295  -0.915
  479    HG2  ARG  64           HG2      ARG  64  25.696   2.586  -0.379
  480    HG3  ARG  64           HG3      ARG  64  25.480   4.334  -0.256
  481    HD2  ARG  64           HD2      ARG  64  25.520   3.325   1.952
  482    HD3  ARG  64           HD3      ARG  64  23.932   4.009   1.608
  483    HE   ARG  64           HE       ARG  64  24.297   1.167   1.085
  484   HH11  ARG  64          HH11      ARG  64  23.043   3.668   3.191
  485   HH12  ARG  64          HH12      ARG  64  22.018   2.582   4.074
  486   HH21  ARG  64          HH21      ARG  64  22.945  -0.255   2.229
  487   HH22  ARG  64          HH22      ARG  64  21.968   0.343   3.535
  488    H    ASN  65           H        ASN  65  24.113   0.989  -2.332
  489    HA   ASN  65           HA       ASN  65  26.764   0.842  -3.590
  490    HB2  ASN  65           HB2      ASN  65  25.854  -0.650  -1.137
  491    HB3  ASN  65           HB3      ASN  65  27.275  -1.103  -2.062
  492   HD21  ASN  65          HD21      ASN  65  27.025  -0.218   0.694
  493   HD22  ASN  65          HD22      ASN  65  28.037   1.178   0.837
  494    HA   PRO  66           HA       PRO  66  24.998  -3.340  -4.756
  495    HB2  PRO  66           HB2      PRO  66  22.743  -4.371  -3.828
  496    HB3  PRO  66           HB3      PRO  66  24.159  -4.257  -2.776
  497    HG2  PRO  66           HG2      PRO  66  21.763  -2.470  -2.921
  498    HG3  PRO  66           HG3      PRO  66  22.578  -3.142  -1.499
  499    HD2  PRO  66           HD2      PRO  66  23.008  -0.607  -2.486
  500    HD3  PRO  66           HD3      PRO  66  24.164  -1.509  -1.496
  501    H    HIS  67           H        HIS  67  22.314  -4.282  -5.393
  502    HA   HIS  67           HA       HIS  67  21.184  -2.221  -7.071
  503    HB2  HIS  67           HB2      HIS  67  21.508  -3.496  -9.169
  504    HB3  HIS  67           HB3      HIS  67  23.025  -2.942  -8.476
  505    HD1  HIS  67           HD1      HIS  67  21.938  -5.660 -10.249
  506    HD2  HIS  67           HD2      HIS  67  23.849  -5.359  -6.560
  507    HE1  HIS  67           HE1      HIS  67  23.064  -7.881  -9.885
  508    HE2  HIS  67           HE2      HIS  67  24.074  -7.731  -7.580
  509    H    TYR  68           H        TYR  68  19.112  -2.438  -6.706
  510    HA   TYR  68           HA       TYR  68  17.935  -5.140  -6.719
  511    HB2  TYR  68           HB2      TYR  68  17.509  -3.883  -4.626
  512    HB3  TYR  68           HB3      TYR  68  16.832  -2.563  -5.568
  513    HD1  TYR  68           HD1      TYR  68  14.664  -2.820  -6.702
  514    HD2  TYR  68           HD2      TYR  68  16.201  -5.865  -4.161
  515    HE1  TYR  68           HE1      TYR  68  12.434  -3.832  -6.585
  516    HE2  TYR  68           HE2      TYR  68  13.968  -6.890  -4.037
  517    HH   TYR  68           HH       TYR  68  11.400  -5.964  -6.114
  518    H    HIS  69           H        HIS  69  17.401  -1.801  -7.666
  519    HA   HIS  69           HA       HIS  69  15.594  -2.627  -9.803
  520    HB2  HIS  69           HB2      HIS  69  14.896  -0.764  -8.359
  521    HB3  HIS  69           HB3      HIS  69  16.360   0.115  -8.763
  522    HD1  HIS  69           HD1      HIS  69  13.019  -0.850 -10.148
  523    HD2  HIS  69           HD2      HIS  69  16.317   1.438 -11.215
  524    HE1  HIS  69           HE1      HIS  69  12.274   0.535 -12.109
  525    HE2  HIS  69           HE2      HIS  69  14.233   2.037 -12.617
  526    H    GLU  70           H        GLU  70  16.675  -3.319 -11.529
  527    HA   GLU  70           HA       GLU  70  19.333  -2.499 -12.150
  528    HB2  GLU  70           HB2      GLU  70  17.332  -4.117 -13.736
  529    HB3  GLU  70           HB3      GLU  70  19.022  -3.919 -14.170
  530    HG2  GLU  70           HG2      GLU  70  18.122  -5.122 -11.568
  531    HG3  GLU  70           HG3      GLU  70  18.421  -6.068 -13.023
  532    H    TYR  71           H        TYR  71  19.090  -0.204 -12.397
  533    HA   TYR  71           HA       TYR  71  17.524   0.788 -14.613
  534    HB2  TYR  71           HB2      TYR  71  18.719   2.981 -14.032
  535    HB3  TYR  71           HB3      TYR  71  17.621   2.317 -12.833
  536    HD1  TYR  71           HD1      TYR  71  21.263   2.272 -13.725
  537    HD2  TYR  71           HD2      TYR  71  18.328   2.212 -10.642
  538    HE1  TYR  71           HE1      TYR  71  23.040   2.414 -12.029
  539    HE2  TYR  71           HE2      TYR  71  20.098   2.343  -8.943
  540    HH   TYR  71           HH       TYR  71  22.491   1.817  -8.734
  541    H    HIS  72           H        HIS  72  20.842  -0.023 -13.943
  542    HA   HIS  72           HA       HIS  72  22.721  -0.140 -15.209
  543    HB2  HIS  72           HB2      HIS  72  20.698  -0.632 -17.399
  544    HB3  HIS  72           HB3      HIS  72  22.422  -0.950 -17.519
  545    HD1  HIS  72           HD1      HIS  72  19.794  -2.962 -17.515
  546    HD2  HIS  72           HD2      HIS  72  22.793  -2.558 -14.666
  547    HE1  HIS  72           HE1      HIS  72  19.821  -5.130 -16.256
  548    HE2  HIS  72           HE2      HIS  72  21.466  -4.766 -14.382
  549    H    THR  73           H        THR  73  23.370   2.022 -14.964
  550    HA   THR  73           HA       THR  73  23.009   3.609 -17.407
  551    HB   THR  73           HB       THR  73  21.781   4.645 -15.528
  552    HG1  THR  73           HG1      THR  73  22.581   6.048 -17.069
  553   HG21  THR  73          HG21      THR  73  23.180   3.902 -13.665
  554   HG22  THR  73          HG22      THR  73  22.999   5.656 -13.660
  555   HG23  THR  73          HG23      THR  73  24.497   4.926 -14.237
  Start of MODEL    6
    1    H1   GLN  -1           H1       GLN  -1  -9.000  13.327  -7.296
    2    H2   GLN  -1           H2       GLN  -1  -9.907  13.438  -5.875
    3    H3   GLN  -1           H3       GLN  -1 -10.594  12.765  -7.260
    4    HA   GLN  -1           HA       GLN  -1  -9.968  11.090  -5.624
    5    HB2  GLN  -1           HB2      GLN  -1  -8.454  11.091  -8.242
    6    HB3  GLN  -1           HB3      GLN  -1  -8.541   9.696  -7.179
    7    HG2  GLN  -1           HG2      GLN  -1 -10.161   9.371  -8.859
    8    HG3  GLN  -1           HG3      GLN  -1 -11.034   9.801  -7.392
    9   HE21  GLN  -1          HE21      GLN  -1  -9.318  12.071  -9.459
   10   HE22  GLN  -1          HE22      GLN  -1 -10.727  12.914 -10.007
   11    H    SER   0           H        SER   0  -8.245   9.956  -4.549
   12    HA   SER   0           HA       SER   0  -6.254  11.794  -3.591
   13    HB2  SER   0           HB2      SER   0  -6.665   8.872  -2.918
   14    HB3  SER   0           HB3      SER   0  -5.691  10.027  -2.005
   15    HG   SER   0           HG       SER   0  -8.046  11.139  -2.254
   16    H    MET   1           H        MET   1  -5.739   8.394  -4.527
   17    HA   MET   1           HA       MET   1  -3.718   9.215  -6.463
   18    HB2  MET   1           HB2      MET   1  -3.126   7.373  -4.135
   19    HB3  MET   1           HB3      MET   1  -2.083   7.557  -5.536
   20    HG2  MET   1           HG2      MET   1  -1.785   9.924  -4.995
   21    HG3  MET   1           HG3      MET   1  -2.813   9.723  -3.579
   22    HE1  MET   1           HE1      MET   1   0.703  10.187  -1.965
   23    HE2  MET   1           HE2      MET   1  -0.984  10.699  -1.953
   24    HE3  MET   1           HE3      MET   1   0.021  11.013  -3.367
   25    H    ALA   2           H        ALA   2  -2.942   7.272  -7.734
   26    HA   ALA   2           HA       ALA   2  -5.226   5.792  -8.580
   27    HB1  ALA   2           HB1      ALA   2  -3.484   6.573 -10.142
   28    HB2  ALA   2           HB2      ALA   2  -3.774   4.838 -10.260
   29    HB3  ALA   2           HB3      ALA   2  -2.354   5.439  -9.404
   30    H    LEU   3           H        LEU   3  -2.154   4.883  -7.129
   31    HA   LEU   3           HA       LEU   3  -3.456   2.489  -6.027
   32    HB2  LEU   3           HB2      LEU   3  -0.739   2.623  -7.329
   33    HB3  LEU   3           HB3      LEU   3  -1.215   1.316  -6.265
   34    HG   LEU   3           HG       LEU   3  -3.212   1.044  -7.918
   35   HD11  LEU   3          HD11      LEU   3  -2.662   1.653 -10.209
   36   HD12  LEU   3          HD12      LEU   3  -1.213   2.482  -9.640
   37   HD13  LEU   3          HD13      LEU   3  -2.809   3.073  -9.174
   38   HD21  LEU   3          HD21      LEU   3  -1.835  -0.444  -9.333
   39   HD22  LEU   3          HD22      LEU   3  -1.543  -0.656  -7.607
   40   HD23  LEU   3          HD23      LEU   3  -0.389   0.242  -8.592
   41    H    HIS   4           H        HIS   4  -2.493   1.676  -4.098
   42    HA   HIS   4           HA       HIS   4  -1.235   3.806  -2.509
   43    HB2  HIS   4           HB2      HIS   4  -2.745   1.340  -1.664
   44    HB3  HIS   4           HB3      HIS   4  -1.922   2.396  -0.541
   45    HD1  HIS   4           HD1      HIS   4  -5.055   1.824  -0.660
   46    HD2  HIS   4           HD2      HIS   4  -3.092   5.199  -2.082
   47    HE1  HIS   4           HE1      HIS   4  -6.794   3.635  -0.727
   48    HE2  HIS   4           HE2      HIS   4  -5.630   5.601  -1.792
   49    H    TYR   5           H        TYR   5   0.766   3.614  -1.890
   50    HA   TYR   5           HA       TYR   5   2.248   1.212  -2.614
   51    HB2  TYR   5           HB2      TYR   5   3.061   4.012  -1.875
   52    HB3  TYR   5           HB3      TYR   5   4.232   2.697  -1.931
   53    HD1  TYR   5           HD1      TYR   5   1.807   2.127  -4.440
   54    HD2  TYR   5           HD2      TYR   5   5.202   4.505  -3.521
   55    HE1  TYR   5           HE1      TYR   5   2.178   2.509  -6.840
   56    HE2  TYR   5           HE2      TYR   5   5.592   4.892  -5.892
   57    HH   TYR   5           HH       TYR   5   5.073   3.900  -8.044
   58    H    TYR   6           H        TYR   6   3.043  -0.189  -1.196
   59    HA   TYR   6           HA       TYR   6   3.454   0.653   1.588
   60    HB2  TYR   6           HB2      TYR   6   2.291  -2.006   0.716
   61    HB3  TYR   6           HB3      TYR   6   2.662  -1.538   2.374
   62    HD1  TYR   6           HD1      TYR   6   0.244  -1.395  -0.291
   63    HD2  TYR   6           HD2      TYR   6   1.361   0.364   3.422
   64    HE1  TYR   6           HE1      TYR   6  -2.003  -0.427  -0.081
   65    HE2  TYR   6           HE2      TYR   6  -0.888   1.315   3.639
   66    HH   TYR   6           HH       TYR   6  -3.499   0.387   1.737
   67    H    CYS   7           H        CYS   7   5.482   0.129   2.314
   68    HA   CYS   7           HA       CYS   7   7.226  -0.569   0.178
   69    HB2  CYS   7           HB2      CYS   7   7.757   1.185   1.937
   70    HB3  CYS   7           HB3      CYS   7   8.156  -0.161   2.985
   71    H    ARG   8           H        ARG   8   8.404  -2.181  -0.232
   72    HA   ARG   8           HA       ARG   8   8.175  -4.712   0.968
   73    HB2  ARG   8           HB2      ARG   8   8.867  -4.579  -1.306
   74    HB3  ARG   8           HB3      ARG   8  10.141  -3.432  -0.933
   75    HG2  ARG   8           HG2      ARG   8  10.342  -6.112   0.306
   76    HG3  ARG   8           HG3      ARG   8  10.597  -6.002  -1.440
   77    HD2  ARG   8           HD2      ARG   8  12.041  -4.316   0.606
   78    HD3  ARG   8           HD3      ARG   8  12.679  -5.807  -0.075
   79    HE   ARG   8           HE       ARG   8  11.990  -3.560  -1.857
   80   HH11  ARG   8          HH11      ARG   8  14.383  -5.699  -0.448
   81   HH12  ARG   8          HH12      ARG   8  15.620  -5.269  -1.581
   82   HH21  ARG   8          HH21      ARG   8  13.626  -3.003  -3.357
   83   HH22  ARG   8          HH22      ARG   8  15.196  -3.728  -3.225
   84    H    HIS   9           H        HIS   9   8.819  -5.177   2.934
   85    HA   HIS   9           HA       HIS   9  10.333  -5.832   4.524
   86    HB2  HIS   9           HB2      HIS   9  12.119  -5.880   2.844
   87    HB3  HIS   9           HB3      HIS   9  12.343  -4.144   3.006
   88    HD1  HIS   9           HD1      HIS   9  14.354  -3.619   4.317
   89    HD2  HIS   9           HD2      HIS   9  12.541  -7.111   5.654
   90    HE1  HIS   9           HE1      HIS   9  15.761  -4.417   6.230
   91    HE2  HIS   9           HE2      HIS   9  14.536  -6.418   7.146
   92    H    CYS  10           H        CYS  10   8.941  -3.005   4.094
   93    HA   CYS  10           HA       CYS  10   9.898  -2.013   6.692
   94    HB2  CYS  10           HB2      CYS  10   9.066  -0.279   4.386
   95    HB3  CYS  10           HB3      CYS  10   9.565   0.290   5.965
   96    H    GLY  11           H        GLY  11   7.244  -2.296   4.407
   97    HA2  GLY  11           HA2      GLY  11   4.981  -2.465   4.824
   98    HA3  GLY  11           HA3      GLY  11   5.321  -2.278   6.551
   99    H    VAL  12           H        VAL  12   6.906   0.190   5.090
  100    HA   VAL  12           HA       VAL  12   5.049   2.065   6.063
  101    HB   VAL  12           HB       VAL  12   7.216   2.787   6.381
  102   HG11  VAL  12          HG11      VAL  12   7.827   2.448   3.452
  103   HG12  VAL  12          HG12      VAL  12   8.260   1.282   4.701
  104   HG13  VAL  12          HG13      VAL  12   8.949   2.899   4.736
  105   HG21  VAL  12          HG21      VAL  12   5.777   4.576   5.595
  106   HG22  VAL  12          HG22      VAL  12   6.285   4.242   3.939
  107   HG23  VAL  12          HG23      VAL  12   7.455   4.833   5.116
  108    H    LYS  13           H        LYS  13   3.591   3.236   5.162
  109    HA   LYS  13           HA       LYS  13   2.677   2.603   2.527
  110    HB2  LYS  13           HB2      LYS  13   1.764   4.951   4.177
  111    HB3  LYS  13           HB3      LYS  13   0.844   4.042   2.993
  112    HG2  LYS  13           HG2      LYS  13   0.686   2.168   4.482
  113    HG3  LYS  13           HG3      LYS  13   1.773   2.940   5.636
  114    HD2  LYS  13           HD2      LYS  13  -0.190   3.532   6.612
  115    HD3  LYS  13           HD3      LYS  13  -0.075   4.861   5.460
  116    HE2  LYS  13           HE2      LYS  13  -1.664   2.317   5.132
  117    HE3  LYS  13           HE3      LYS  13  -2.310   3.923   5.446
  118    HZ1  LYS  13           HZ1      LYS  13  -0.853   3.099   2.994
  119    HZ2  LYS  13           HZ2      LYS  13  -1.484   4.641   3.283
  120    HZ3  LYS  13           HZ3      LYS  13  -2.524   3.317   3.120
  121    H    VAL  14           H        VAL  14   4.166   3.243   0.990
  122    HA   VAL  14           HA       VAL  14   5.451   5.825   1.148
  123    HB   VAL  14           HB       VAL  14   5.650   4.547  -1.459
  124   HG11  VAL  14          HG11      VAL  14   7.144   6.280  -0.709
  125   HG12  VAL  14          HG12      VAL  14   8.039   4.796  -1.022
  126   HG13  VAL  14          HG13      VAL  14   7.679   5.271   0.640
  127   HG21  VAL  14          HG21      VAL  14   6.510   2.939   0.936
  128   HG22  VAL  14          HG22      VAL  14   7.063   2.663  -0.717
  129   HG23  VAL  14          HG23      VAL  14   5.360   2.466  -0.316
  130    H    GLY  15           H        GLY  15   2.532   4.668  -0.000
  131    HA2  GLY  15           HA2      GLY  15   2.157   7.111  -1.596
  132    HA3  GLY  15           HA3      GLY  15   1.629   5.553  -2.219
  133    H    SER  16           H        SER  16   0.930   8.179  -0.183
  134    HA   SER  16           HA       SER  16  -1.002   8.888   0.764
  135    HB2  SER  16           HB2      SER  16  -2.256   7.875  -1.069
  136    HB3  SER  16           HB3      SER  16  -2.176   6.300  -0.283
  137    HG   SER  16           HG       SER  16  -3.303   8.464   1.110
  138    H    LEU  17           H        LEU  17  -0.591   8.989   2.859
  139    HA   LEU  17           HA       LEU  17  -0.955   6.538   4.442
  140    HB2  LEU  17           HB2      LEU  17   0.433   7.524   6.183
  141    HB3  LEU  17           HB3      LEU  17   1.317   7.411   4.676
  142    HG   LEU  17           HG       LEU  17  -0.028   9.990   5.382
  143   HD11  LEU  17          HD11      LEU  17   1.975  10.707   6.570
  144   HD12  LEU  17          HD12      LEU  17   2.652   9.085   6.422
  145   HD13  LEU  17          HD13      LEU  17   1.202   9.351   7.391
  146   HD21  LEU  17          HD21      LEU  17   2.525   9.306   3.928
  147   HD22  LEU  17          HD22      LEU  17   1.833  10.917   4.113
  148   HD23  LEU  17          HD23      LEU  17   0.984   9.695   3.167
  149    H    GLU  18           H        GLU  18  -1.958   9.663   3.716
  150    HA   GLU  18           HA       GLU  18  -3.766   9.797   5.994
  151    HB2  GLU  18           HB2      GLU  18  -3.306  11.782   3.760
  152    HB3  GLU  18           HB3      GLU  18  -4.319  12.045   5.169
  153    HG2  GLU  18           HG2      GLU  18  -2.338  11.851   6.607
  154    HG3  GLU  18           HG3      GLU  18  -1.336  11.652   5.170
  155    H    SER  19           H        SER  19  -6.070  10.281   5.526
  156    HA   SER  19           HA       SER  19  -8.069   9.949   4.497
  157    HB2  SER  19           HB2      SER  19  -6.370   9.652   2.023
  158    HB3  SER  19           HB3      SER  19  -8.126   9.630   2.031
  159    HG   SER  19           HG       SER  19  -6.710  11.763   3.210
  160    H    SER  20           H        SER  20  -5.970   7.733   5.167
  161    HA   SER  20           HA       SER  20  -6.695   5.442   3.688
  162    HB2  SER  20           HB2      SER  20  -5.529   4.232   5.594
  163    HB3  SER  20           HB3      SER  20  -4.572   5.456   4.760
  164    HG   SER  20           HG       SER  20  -4.587   5.465   7.164
  165    H    MET  21           H        MET  21  -7.790   6.710   6.818
  166    HA   MET  21           HA       MET  21  -9.911   4.661   6.763
  167    HB2  MET  21           HB2      MET  21  -9.947   4.630   9.178
  168    HB3  MET  21           HB3      MET  21  -8.318   4.292   8.616
  169    HG2  MET  21           HG2      MET  21  -7.621   6.529   9.148
  170    HG3  MET  21           HG3      MET  21  -9.266   6.969   9.600
  171    HE1  MET  21           HE1      MET  21  -9.845   4.912  12.856
  172    HE2  MET  21           HE2      MET  21 -10.277   4.419  11.221
  173    HE3  MET  21           HE3      MET  21 -10.512   6.091  11.727
  174    H    VAL  22           H        VAL  22  -9.309   7.728   6.184
  175    HA   VAL  22           HA       VAL  22 -11.365   9.115   7.535
  176    HB   VAL  22           HB       VAL  22 -10.052   9.741   4.884
  177   HG11  VAL  22          HG11      VAL  22 -12.157  10.927   5.099
  178   HG12  VAL  22          HG12      VAL  22 -10.799  12.039   5.254
  179   HG13  VAL  22          HG13      VAL  22 -11.680  11.518   6.689
  180   HG21  VAL  22          HG21      VAL  22  -8.679  11.300   6.190
  181   HG22  VAL  22          HG22      VAL  22  -8.459   9.631   6.710
  182   HG23  VAL  22          HG23      VAL  22  -9.451  10.727   7.670
  183    H    SER  23           H        SER  23 -11.292   6.993   4.870
  184    HA   SER  23           HA       SER  23 -13.731   7.621   3.626
  185    HB2  SER  23           HB2      SER  23 -13.616   5.151   2.927
  186    HB3  SER  23           HB3      SER  23 -12.282   6.192   2.443
  187    HG   SER  23           HG       SER  23 -12.212   4.683   4.834
  188    H    THR  24           H        THR  24 -15.471   7.888   4.864
  189    HA   THR  24           HA       THR  24 -15.977   5.980   7.029
  190    HB   THR  24           HB       THR  24 -15.888   8.408   7.589
  191    HG1  THR  24           HG1      THR  24 -18.544   7.572   8.045
  192   HG21  THR  24          HG21      THR  24 -18.414   8.539   5.941
  193   HG22  THR  24          HG22      THR  24 -16.884   9.332   5.571
  194   HG23  THR  24          HG23      THR  24 -17.811   9.821   6.988
  195    H    ASP  25           H        ASP  25 -16.668   5.990   3.954
  196    HA   ASP  25           HA       ASP  25 -19.539   5.454   4.201
  197    HB2  ASP  25           HB2      ASP  25 -17.845   5.476   1.686
  198    HB3  ASP  25           HB3      ASP  25 -19.601   5.402   1.770
  199    H    SER  26           H        SER  26 -16.689   4.034   2.642
  200    HA   SER  26           HA       SER  26 -15.907   1.918   2.523
  201    HB2  SER  26           HB2      SER  26 -15.589   2.114   4.873
  202    HB3  SER  26           HB3      SER  26 -17.302   1.868   5.197
  203    HG   SER  26           HG       SER  26 -17.023  -0.286   4.376
  204    H    LEU  27           H        LEU  27 -17.813   2.201   0.839
  205    HA   LEU  27           HA       LEU  27 -19.533  -0.180   1.136
  206    HB2  LEU  27           HB2      LEU  27 -20.109   2.341  -0.428
  207    HB3  LEU  27           HB3      LEU  27 -21.136   0.923  -0.379
  208    HG   LEU  27           HG       LEU  27 -20.522   2.746   1.947
  209   HD11  LEU  27          HD11      LEU  27 -22.880   3.347   1.775
  210   HD12  LEU  27          HD12      LEU  27 -23.043   2.320   0.352
  211   HD13  LEU  27          HD13      LEU  27 -22.007   3.746   0.298
  212   HD21  LEU  27          HD21      LEU  27 -22.197   1.423   3.147
  213   HD22  LEU  27          HD22      LEU  27 -20.807   0.442   2.680
  214   HD23  LEU  27          HD23      LEU  27 -22.315   0.329   1.772
  215    H    GLY  28           H        GLY  28 -17.260   1.595  -0.757
  216    HA2  GLY  28           HA2      GLY  28 -16.007   0.872  -2.562
  217    HA3  GLY  28           HA3      GLY  28 -16.940  -0.620  -2.574
  218    H    PHE  29           H        PHE  29 -18.941   2.082  -2.472
  219    HA   PHE  29           HA       PHE  29 -19.044   2.655  -5.244
  220    HB2  PHE  29           HB2      PHE  29 -21.025   1.566  -5.889
  221    HB3  PHE  29           HB3      PHE  29 -20.085   0.328  -5.075
  222    HD1  PHE  29           HD1      PHE  29 -23.171   2.097  -5.222
  223    HD2  PHE  29           HD2      PHE  29 -20.692  -0.217  -2.654
  224    HE1  PHE  29           HE1      PHE  29 -25.101   1.648  -3.780
  225    HE2  PHE  29           HE2      PHE  29 -22.622  -0.668  -1.197
  226    HZ   PHE  29           HZ       PHE  29 -24.831   0.263  -1.758
  227    H    GLN  30           H        GLN  30 -20.593   4.182  -5.776
  228    HA   GLN  30           HA       GLN  30 -22.232   5.307  -3.623
  229    HB2  GLN  30           HB2      GLN  30 -21.541   7.552  -4.090
  230    HB3  GLN  30           HB3      GLN  30 -20.078   6.607  -3.900
  231    HG2  GLN  30           HG2      GLN  30 -20.213   6.394  -6.490
  232    HG3  GLN  30           HG3      GLN  30 -21.220   7.834  -6.348
  233   HE21  GLN  30          HE21      GLN  30 -18.054   6.489  -5.970
  234   HE22  GLN  30          HE22      GLN  30 -17.213   7.996  -5.774
  235    H    HIS  31           H        HIS  31 -21.448   4.903  -6.987
  236    HA   HIS  31           HA       HIS  31 -24.317   4.892  -7.581
  237    HB2  HIS  31           HB2      HIS  31 -23.199   7.021  -8.364
  238    HB3  HIS  31           HB3      HIS  31 -22.240   6.032  -9.451
  239    HD1  HIS  31           HD1      HIS  31 -23.353   7.321 -11.475
  240    HD2  HIS  31           HD2      HIS  31 -25.990   5.107  -9.143
  241    HE1  HIS  31           HE1      HIS  31 -25.499   7.224 -12.782
  242    HE2  HIS  31           HE2      HIS  31 -27.101   5.941 -11.320
  243    H    LEU  32           H        LEU  32 -21.197   3.550  -7.808
  244    HA   LEU  32           HA       LEU  32 -20.897   1.290  -7.663
  245    HB2  LEU  32           HB2      LEU  32 -23.642   1.382  -8.221
  246    HB3  LEU  32           HB3      LEU  32 -22.932   0.188  -9.274
  247    HG   LEU  32           HG       LEU  32 -22.750   0.224  -6.268
  248   HD11  LEU  32          HD11      LEU  32 -24.098  -1.796  -6.434
  249   HD12  LEU  32          HD12      LEU  32 -24.177  -1.593  -8.183
  250   HD13  LEU  32          HD13      LEU  32 -24.927  -0.401  -7.122
  251   HD21  LEU  32          HD21      LEU  32 -21.650  -1.940  -6.484
  252   HD22  LEU  32          HD22      LEU  32 -20.704  -0.679  -7.271
  253   HD23  LEU  32          HD23      LEU  32 -21.672  -1.788  -8.239
  254    H    THR  33           H        THR  33 -19.482   0.240  -8.680
  255    HA   THR  33           HA       THR  33 -18.150  -0.627 -10.240
  256    HB   THR  33           HB       THR  33 -19.624  -2.377 -10.293
  257    HG1  THR  33           HG1      THR  33 -19.924  -2.722 -12.747
  258   HG21  THR  33          HG21      THR  33 -21.772  -1.505 -10.227
  259   HG22  THR  33          HG22      THR  33 -21.729  -2.330 -11.783
  260   HG23  THR  33          HG23      THR  33 -21.564  -0.578 -11.704
  261    H    ASN  34           H        ASN  34 -20.169  -0.257 -13.046
  262    HA   ASN  34           HA       ASN  34 -18.158   0.880 -14.555
  263    HB2  ASN  34           HB2      ASN  34 -20.018   1.561 -16.146
  264    HB3  ASN  34           HB3      ASN  34 -19.950  -0.143 -15.714
  265   HD21  ASN  34          HD21      ASN  34 -21.741   2.820 -15.424
  266   HD22  ASN  34          HD22      ASN  34 -23.164   2.119 -14.734
  267    H    GLU  35           H        GLU  35 -20.563   2.455 -12.581
  268    HA   GLU  35           HA       GLU  35 -19.943   5.107 -13.481
  269    HB2  GLU  35           HB2      GLU  35 -21.362   4.135 -11.007
  270    HB3  GLU  35           HB3      GLU  35 -21.305   5.803 -11.558
  271    HG2  GLU  35           HG2      GLU  35 -22.492   3.513 -13.093
  272    HG3  GLU  35           HG3      GLU  35 -23.382   4.683 -12.132
  273    H    GLU  36           H        GLU  36 -19.360   3.260 -10.529
  274    HA   GLU  36           HA       GLU  36 -17.709   4.964  -9.129
  275    HB2  GLU  36           HB2      GLU  36 -17.673   1.966  -9.391
  276    HB3  GLU  36           HB3      GLU  36 -16.597   2.795  -8.293
  277    HG2  GLU  36           HG2      GLU  36 -19.541   2.504  -8.196
  278    HG3  GLU  36           HG3      GLU  36 -18.339   2.212  -6.941
  279    H    ARG  37           H        ARG  37 -16.703   2.546 -11.496
  280    HA   ARG  37           HA       ARG  37 -13.964   2.822 -11.298
  281    HB2  ARG  37           HB2      ARG  37 -15.254   0.990 -12.377
  282    HB3  ARG  37           HB3      ARG  37 -15.613   2.071 -13.713
  283    HG2  ARG  37           HG2      ARG  37 -13.245   2.230 -14.217
  284    HG3  ARG  37           HG3      ARG  37 -12.887   1.135 -12.881
  285    HD2  ARG  37           HD2      ARG  37 -14.494   0.523 -15.356
  286    HD3  ARG  37           HD3      ARG  37 -12.915  -0.133 -14.928
  287    HE   ARG  37           HE       ARG  37 -14.093  -1.176 -12.977
  288   HH11  ARG  37          HH11      ARG  37 -15.857  -0.386 -15.903
  289   HH12  ARG  37          HH12      ARG  37 -17.055  -1.612 -15.657
  290   HH21  ARG  37          HH21      ARG  37 -15.679  -2.762 -12.641
  291   HH22  ARG  37          HH22      ARG  37 -16.965  -2.956 -13.787
  292    H    ASN  38           H        ASN  38 -16.280   4.476 -13.368
  293    HA   ASN  38           HA       ASN  38 -14.249   5.873 -14.839
  294    HB2  ASN  38           HB2      ASN  38 -16.411   5.261 -15.854
  295    HB3  ASN  38           HB3      ASN  38 -17.236   6.331 -14.730
  296   HD21  ASN  38          HD21      ASN  38 -15.211   6.123 -17.530
  297   HD22  ASN  38          HD22      ASN  38 -15.364   7.776 -18.013
  298    H    ASP  39           H        ASP  39 -16.487   6.641 -12.210
  299    HA   ASP  39           HA       ASP  39 -15.983   9.459 -12.424
  300    HB2  ASP  39           HB2      ASP  39 -18.185   8.582 -11.767
  301    HB3  ASP  39           HB3      ASP  39 -17.477   7.923 -10.296
  302    H    MET  40           H        MET  40 -15.374   7.126  -9.728
  303    HA   MET  40           HA       MET  40 -13.411   9.114  -8.794
  304    HB2  MET  40           HB2      MET  40 -15.474   9.236  -7.471
  305    HB3  MET  40           HB3      MET  40 -15.293   7.541  -7.040
  306    HG2  MET  40           HG2      MET  40 -13.156   8.073  -5.944
  307    HG3  MET  40           HG3      MET  40 -13.408   9.775  -6.324
  308    HE1  MET  40           HE1      MET  40 -13.959   9.567  -2.442
  309    HE2  MET  40           HE2      MET  40 -13.040  10.330  -3.740
  310    HE3  MET  40           HE3      MET  40 -12.829   8.612  -3.401
  311    H    ILE  41           H        ILE  41 -14.283   5.643  -8.643
  312    HA   ILE  41           HA       ILE  41 -11.488   5.127  -7.885
  313    HB   ILE  41           HB       ILE  41 -13.749   3.628  -6.566
  314   HG12  ILE  41          HG12      ILE  41 -12.216   5.979  -5.424
  315   HG13  ILE  41          HG13      ILE  41 -13.893   6.034  -5.953
  316   HG21  ILE  41          HG21      ILE  41 -11.551   2.547  -6.626
  317   HG22  ILE  41          HG22      ILE  41 -12.005   2.985  -4.980
  318   HG23  ILE  41          HG23      ILE  41 -10.832   3.964  -5.862
  319   HD11  ILE  41          HD11      ILE  41 -13.730   5.850  -3.541
  320   HD12  ILE  41          HD12      ILE  41 -12.805   4.358  -3.704
  321   HD13  ILE  41          HD13      ILE  41 -14.487   4.414  -4.231
  322    H    SER  42           H        SER  42 -10.580   3.438  -8.873
  323    HA   SER  42           HA       SER  42 -11.930   2.242 -11.078
  324    HB2  SER  42           HB2      SER  42  -9.659   0.955 -11.138
  325    HB3  SER  42           HB3      SER  42  -9.681   2.686 -11.456
  326    HG   SER  42           HG       SER  42  -8.086   1.835  -9.863
  327    H    TYR  43           H        TYR  43 -12.379   1.508  -7.989
  328    HA   TYR  43           HA       TYR  43 -13.110  -1.200  -8.387
  329    HB2  TYR  43           HB2      TYR  43 -10.488  -1.090  -8.183
  330    HB3  TYR  43           HB3      TYR  43 -10.817  -0.905  -6.469
  331    HD1  TYR  43           HD1      TYR  43 -11.012  -2.832  -5.157
  332    HD2  TYR  43           HD2      TYR  43 -11.653  -3.111  -9.353
  333    HE1  TYR  43           HE1      TYR  43 -11.182  -5.276  -4.964
  334    HE2  TYR  43           HE2      TYR  43 -11.828  -5.554  -9.168
  335    HH   TYR  43           HH       TYR  43 -12.126  -7.159  -6.169
  336    H    LYS  44           H        LYS  44 -12.527  -1.808  -5.503
  337    HA   LYS  44           HA       LYS  44 -14.879  -0.656  -4.370
  338    HB2  LYS  44           HB2      LYS  44 -12.695  -2.356  -3.154
  339    HB3  LYS  44           HB3      LYS  44 -14.168  -1.904  -2.317
  340    HG2  LYS  44           HG2      LYS  44 -13.940  -3.610  -4.780
  341    HG3  LYS  44           HG3      LYS  44 -14.420  -4.122  -3.162
  342    HD2  LYS  44           HD2      LYS  44 -16.397  -2.646  -3.318
  343    HD3  LYS  44           HD3      LYS  44 -15.930  -2.230  -4.966
  344    HE2  LYS  44           HE2      LYS  44 -16.021  -4.710  -5.464
  345    HE3  LYS  44           HE3      LYS  44 -16.801  -4.901  -3.898
  346    HZ1  LYS  44           HZ1      LYS  44 -18.494  -4.743  -5.518
  347    HZ2  LYS  44           HZ2      LYS  44 -17.799  -3.381  -6.238
  348    HZ3  LYS  44           HZ3      LYS  44 -18.489  -3.264  -4.699
  349    H    GLU  45           H        GLU  45 -14.351  -0.061  -1.784
  350    HA   GLU  45           HA       GLU  45 -14.151   2.642  -1.924
  351    HB2  GLU  45           HB2      GLU  45 -14.962   1.167  -0.028
  352    HB3  GLU  45           HB3      GLU  45 -13.299   1.094   0.512
  353    HG2  GLU  45           HG2      GLU  45 -14.362   2.762   1.774
  354    HG3  GLU  45           HG3      GLU  45 -13.354   3.576   0.592
  355    H    ASN  46           H        ASN  46 -11.494   0.525  -0.791
  356    HA   ASN  46           HA       ASN  46  -9.710   2.837  -0.843
  357    HB2  ASN  46           HB2      ASN  46  -9.596   0.141   0.427
  358    HB3  ASN  46           HB3      ASN  46  -8.082   0.965   0.074
  359   HD21  ASN  46          HD21      ASN  46 -10.979   2.738   0.854
  360   HD22  ASN  46          HD22      ASN  46 -10.464   3.269   2.417
  361    H    GLY  47           H        GLY  47 -10.750   0.906  -3.127
  362    HA2  GLY  47           HA2      GLY  47  -9.964   0.725  -5.289
  363    HA3  GLY  47           HA3      GLY  47  -8.425   1.400  -4.751
  364    H    ASP  48           H        ASP  48  -8.660  -0.904  -2.613
  365    HA   ASP  48           HA       ASP  48  -7.607  -2.875  -2.272
  366    HB2  ASP  48           HB2      ASP  48  -9.452  -3.696  -3.703
  367    HB3  ASP  48           HB3      ASP  48  -8.438  -3.453  -5.114
  368    H    VAL  49           H        VAL  49  -6.391  -0.540  -3.899
  369    HA   VAL  49           HA       VAL  49  -4.284  -1.737  -5.394
  370    HB   VAL  49           HB       VAL  49  -3.443   0.676  -5.448
  371   HG11  VAL  49          HG11      VAL  49  -5.231   1.348  -7.026
  372   HG12  VAL  49          HG12      VAL  49  -6.199  -0.014  -6.462
  373   HG13  VAL  49          HG13      VAL  49  -4.668  -0.302  -7.286
  374   HG21  VAL  49          HG21      VAL  49  -4.870   2.425  -4.697
  375   HG22  VAL  49          HG22      VAL  49  -4.776   1.298  -3.348
  376   HG23  VAL  49          HG23      VAL  49  -6.198   1.317  -4.390
  377    H    HIS  50           H        HIS  50  -3.071  -2.994  -4.095
  378    HA   HIS  50           HA       HIS  50  -1.567  -1.679  -1.934
  379    HB2  HIS  50           HB2      HIS  50  -3.278  -3.286  -1.065
  380    HB3  HIS  50           HB3      HIS  50  -2.504  -4.562  -1.992
  381    HD1  HIS  50           HD1      HIS  50  -2.598  -3.224   1.306
  382    HD2  HIS  50           HD2      HIS  50   0.386  -4.828  -1.106
  383    HE1  HIS  50           HE1      HIS  50  -0.759  -3.916   2.871
  384    HE2  HIS  50           HE2      HIS  50   0.993  -4.967   1.405
  385    H    VAL  51           H        VAL  51   0.236  -1.286  -3.182
  386    HA   VAL  51           HA       VAL  51   1.473  -3.619  -4.488
  387    HB   VAL  51           HB       VAL  51   2.787  -1.891  -5.790
  388   HG11  VAL  51          HG11      VAL  51   0.905  -1.347  -7.316
  389   HG12  VAL  51          HG12      VAL  51  -0.207  -1.995  -6.107
  390   HG13  VAL  51          HG13      VAL  51   0.984  -3.053  -6.869
  391   HG21  VAL  51          HG21      VAL  51   1.821   0.343  -5.947
  392   HG22  VAL  51          HG22      VAL  51   2.448  -0.005  -4.335
  393   HG23  VAL  51          HG23      VAL  51   0.710  -0.056  -4.636
  394    H    LEU  52           H        LEU  52   3.422  -4.289  -3.854
  395    HA   LEU  52           HA       LEU  52   4.739  -2.938  -1.654
  396    HB2  LEU  52           HB2      LEU  52   5.499  -5.455  -3.150
  397    HB3  LEU  52           HB3      LEU  52   6.283  -4.857  -1.697
  398    HG   LEU  52           HG       LEU  52   3.432  -5.839  -1.898
  399   HD11  LEU  52          HD11      LEU  52   5.036  -7.645  -2.023
  400   HD12  LEU  52          HD12      LEU  52   4.239  -7.654  -0.449
  401   HD13  LEU  52          HD13      LEU  52   5.880  -7.026  -0.604
  402   HD21  LEU  52          HD21      LEU  52   4.989  -4.881   0.500
  403   HD22  LEU  52          HD22      LEU  52   3.373  -5.587   0.527
  404   HD23  LEU  52          HD23      LEU  52   3.643  -4.036  -0.266
  405    H    THR  53           H        THR  53   6.295  -1.492  -1.927
  406    HA   THR  53           HA       THR  53   7.922  -1.549  -4.353
  407    HB   THR  53           HB       THR  53   5.945  -0.103  -4.818
  408    HG1  THR  53           HG1      THR  53   7.452   0.720  -6.057
  409   HG21  THR  53          HG21      THR  53   5.727   2.039  -3.703
  410   HG22  THR  53          HG22      THR  53   7.099   1.660  -2.662
  411   HG23  THR  53          HG23      THR  53   5.608   0.728  -2.530
  412    H    ILE  54           H        ILE  54   9.294   0.770  -4.061
  413    HA   ILE  54           HA       ILE  54  10.813   0.181  -1.621
  414    HB   ILE  54           HB       ILE  54  11.539   1.126  -4.354
  415   HG12  ILE  54          HG12      ILE  54  13.523  -0.467  -3.094
  416   HG13  ILE  54          HG13      ILE  54  11.955  -1.174  -2.729
  417   HG21  ILE  54          HG21      ILE  54  13.704   1.902  -3.672
  418   HG22  ILE  54          HG22      ILE  54  13.312   1.602  -1.983
  419   HG23  ILE  54          HG23      ILE  54  12.454   2.857  -2.875
  420   HD11  ILE  54          HD11      ILE  54  11.433  -1.316  -5.081
  421   HD12  ILE  54          HD12      ILE  54  12.985  -2.092  -4.759
  422   HD13  ILE  54          HD13      ILE  54  12.936  -0.491  -5.488
  423    H    CYS  55           H        CYS  55  10.898   1.600  -0.018
  424    HA   CYS  55           HA       CYS  55   9.772   4.239  -0.276
  425    HB2  CYS  55           HB2      CYS  55  10.081   4.439   2.102
  426    HB3  CYS  55           HB3      CYS  55   9.461   2.827   1.776
  427    H    GLU  56           H        GLU  56  11.130   6.044   0.942
  428    HA   GLU  56           HA       GLU  56  13.335   6.667  -0.659
  429    HB2  GLU  56           HB2      GLU  56  12.646   7.702   2.096
  430    HB3  GLU  56           HB3      GLU  56  13.737   8.472   0.954
  431    HG2  GLU  56           HG2      GLU  56  11.989   8.990  -0.531
  432    HG3  GLU  56           HG3      GLU  56  10.865   7.922   0.303
  433    H    ASP  57           H        ASP  57  13.145   5.271   2.574
  434    HA   ASP  57           HA       ASP  57  15.865   5.146   3.188
  435    HB2  ASP  57           HB2      ASP  57  14.060   4.728   4.816
  436    HB3  ASP  57           HB3      ASP  57  13.662   3.227   3.988
  437    H    CYS  58           H        CYS  58  13.791   2.869   1.442
  438    HA   CYS  58           HA       CYS  58  15.872   0.937   1.071
  439    HB2  CYS  58           HB2      CYS  58  13.123   1.242  -0.122
  440    HB3  CYS  58           HB3      CYS  58  14.232  -0.027  -0.633
  441    H    GLN  59           H        GLN  59  14.489   3.530  -0.832
  442    HA   GLN  59           HA       GLN  59  15.739   3.123  -3.264
  443    HB2  GLN  59           HB2      GLN  59  13.987   4.789  -2.854
  444    HB3  GLN  59           HB3      GLN  59  15.128   5.777  -1.954
  445    HG2  GLN  59           HG2      GLN  59  15.707   5.032  -4.790
  446    HG3  GLN  59           HG3      GLN  59  14.583   6.335  -4.433
  447   HE21  GLN  59          HE21      GLN  59  17.155   6.435  -5.769
  448   HE22  GLN  59          HE22      GLN  59  18.125   7.538  -4.860
  449    H    GLU  60           H        GLU  60  17.092   4.376  -0.289
  450    HA   GLU  60           HA       GLU  60  19.454   5.328  -1.464
  451    HB2  GLU  60           HB2      GLU  60  18.548   4.579   1.289
  452    HB3  GLU  60           HB3      GLU  60  20.216   4.933   0.989
  453    HG2  GLU  60           HG2      GLU  60  18.176   6.850   0.118
  454    HG3  GLU  60           HG3      GLU  60  18.606   6.785   1.819
  455    H    ALA  61           H        ALA  61  18.723   2.302   0.277
  456    HA   ALA  61           HA       ALA  61  21.129   0.958  -0.148
  457    HB1  ALA  61           HB1      ALA  61  18.335  -0.201  -0.240
  458    HB2  ALA  61           HB2      ALA  61  19.276   0.077   1.227
  459    HB3  ALA  61           HB3      ALA  61  19.828  -1.103   0.038
  460    H    LEU  62           H        LEU  62  18.430   1.609  -2.155
  461    HA   LEU  62           HA       LEU  62  18.927   0.010  -4.401
  462    HB2  LEU  62           HB2      LEU  62  17.521   2.539  -3.774
  463    HB3  LEU  62           HB3      LEU  62  17.654   2.070  -5.432
  464    HG   LEU  62           HG       LEU  62  15.813   1.212  -3.412
  465   HD11  LEU  62          HD11      LEU  62  14.616   0.286  -5.308
  466   HD12  LEU  62          HD12      LEU  62  16.041   0.519  -6.321
  467   HD13  LEU  62          HD13      LEU  62  15.200   1.916  -5.646
  468   HD21  LEU  62          HD21      LEU  62  17.401  -0.660  -3.100
  469   HD22  LEU  62          HD22      LEU  62  17.186  -1.074  -4.803
  470   HD23  LEU  62          HD23      LEU  62  15.818  -1.158  -3.693
  471    H    ASP  63           H        ASP  63  19.513   3.473  -3.980
  472    HA   ASP  63           HA       ASP  63  20.895   3.693  -6.465
  473    HB2  ASP  63           HB2      ASP  63  19.543   5.527  -5.724
  474    HB3  ASP  63           HB3      ASP  63  20.441   5.659  -4.217
  475    H    ARG  64           H        ARG  64  21.936   3.814  -3.077
  476    HA   ARG  64           HA       ARG  64  24.599   4.608  -3.823
  477    HB2  ARG  64           HB2      ARG  64  23.384   3.888  -1.157
  478    HB3  ARG  64           HB3      ARG  64  25.032   4.465  -1.370
  479    HG2  ARG  64           HG2      ARG  64  24.283   6.577  -2.151
  480    HG3  ARG  64           HG3      ARG  64  22.617   6.008  -2.274
  481    HD2  ARG  64           HD2      ARG  64  22.952   7.408  -0.299
  482    HD3  ARG  64           HD3      ARG  64  22.500   5.762   0.136
  483    HE   ARG  64           HE       ARG  64  25.297   5.963   0.126
  484   HH11  ARG  64          HH11      ARG  64  22.536   7.148   1.913
  485   HH12  ARG  64          HH12      ARG  64  23.391   7.227   3.425
  486   HH21  ARG  64          HH21      ARG  64  26.437   6.090   2.106
  487   HH22  ARG  64          HH22      ARG  64  25.613   6.628   3.533
  488    H    ASN  65           H        ASN  65  23.608   1.896  -1.719
  489    HA   ASN  65           HA       ASN  65  25.315   0.088  -3.204
  490    HB2  ASN  65           HB2      ASN  65  26.924   1.194  -1.725
  491    HB3  ASN  65           HB3      ASN  65  25.931   0.801  -0.327
  492   HD21  ASN  65          HD21      ASN  65  25.964  -1.264   0.500
  493   HD22  ASN  65          HD22      ASN  65  27.103  -2.462  -0.016
  494    HA   PRO  66           HA       PRO  66  21.870  -2.545  -2.387
  495    HB2  PRO  66           HB2      PRO  66  24.039  -4.602  -2.332
  496    HB3  PRO  66           HB3      PRO  66  22.491  -4.626  -3.184
  497    HG2  PRO  66           HG2      PRO  66  24.763  -4.065  -4.470
  498    HG3  PRO  66           HG3      PRO  66  23.245  -3.246  -4.875
  499    HD2  PRO  66           HD2      PRO  66  25.632  -2.209  -3.465
  500    HD3  PRO  66           HD3      PRO  66  24.409  -1.341  -4.411
  501    H    HIS  67           H        HIS  67  24.788  -3.676  -0.674
  502    HA   HIS  67           HA       HIS  67  23.275  -4.499   1.617
  503    HB2  HIS  67           HB2      HIS  67  26.221  -4.335   1.019
  504    HB3  HIS  67           HB3      HIS  67  25.634  -4.747   2.626
  505    HD1  HIS  67           HD1      HIS  67  25.000  -7.128   3.029
  506    HD2  HIS  67           HD2      HIS  67  25.417  -6.257  -1.016
  507    HE1  HIS  67           HE1      HIS  67  24.860  -9.339   1.836
  508    HE2  HIS  67           HE2      HIS  67  24.909  -8.757  -0.612
  509    H    TYR  68           H        TYR  68  22.223  -2.768   2.453
  510    HA   TYR  68           HA       TYR  68  23.906  -0.619   3.550
  511    HB2  TYR  68           HB2      TYR  68  22.370   0.014   1.607
  512    HB3  TYR  68           HB3      TYR  68  21.024  -0.293   2.699
  513    HD1  TYR  68           HD1      TYR  68  20.266   1.393   4.118
  514    HD2  TYR  68           HD2      TYR  68  24.112   1.753   2.348
  515    HE1  TYR  68           HE1      TYR  68  20.449   3.679   4.999
  516    HE2  TYR  68           HE2      TYR  68  24.307   4.044   3.222
  517    HH   TYR  68           HH       TYR  68  22.113   5.310   5.550
  518    H    HIS  69           H        HIS  69  22.872   0.437   5.471
  519    HA   HIS  69           HA       HIS  69  22.320   0.273   7.646
  520    HB2  HIS  69           HB2      HIS  69  20.024  -0.391   8.165
  521    HB3  HIS  69           HB3      HIS  69  20.084   0.618   6.732
  522    HD1  HIS  69           HD1      HIS  69  18.774  -0.214   4.798
  523    HD2  HIS  69           HD2      HIS  69  19.702  -3.260   7.466
  524    HE1  HIS  69           HE1      HIS  69  17.650  -2.271   3.893
  525    HE2  HIS  69           HE2      HIS  69  18.425  -4.132   5.398
  526    H    GLU  70           H        GLU  70  24.008  -1.846   6.692
  527    HA   GLU  70           HA       GLU  70  23.469  -3.756   8.848
  528    HB2  GLU  70           HB2      GLU  70  24.156  -5.630   7.376
  529    HB3  GLU  70           HB3      GLU  70  22.654  -4.867   6.874
  530    HG2  GLU  70           HG2      GLU  70  23.818  -3.662   5.125
  531    HG3  GLU  70           HG3      GLU  70  25.355  -4.344   5.654
  532    H    TYR  71           H        TYR  71  25.580  -1.705   7.287
  533    HA   TYR  71           HA       TYR  71  27.804  -2.691   8.890
  534    HB2  TYR  71           HB2      TYR  71  27.745  -3.432   6.298
  535    HB3  TYR  71           HB3      TYR  71  28.496  -1.850   6.126
  536    HD1  TYR  71           HD1      TYR  71  28.999  -5.282   6.957
  537    HD2  TYR  71           HD2      TYR  71  30.614  -1.386   7.497
  538    HE1  TYR  71           HE1      TYR  71  31.164  -6.273   7.557
  539    HE2  TYR  71           HE2      TYR  71  32.787  -2.368   8.100
  540    HH   TYR  71           HH       TYR  71  33.687  -4.464   8.959
  541    H    HIS  72           H        HIS  72  29.117  -1.064   9.612
  542    HA   HIS  72           HA       HIS  72  27.964   1.561   9.538
  543    HB2  HIS  72           HB2      HIS  72  30.452   0.504  10.882
  544    HB3  HIS  72           HB3      HIS  72  29.854   2.147  11.068
  545    HD1  HIS  72           HD1      HIS  72  29.633  -1.134  12.546
  546    HD2  HIS  72           HD2      HIS  72  27.123   2.166  12.236
  547    HE1  HIS  72           HE1      HIS  72  27.887  -1.443  14.330
  548    HE2  HIS  72           HE2      HIS  72  26.309   0.500  14.038
  549    H    THR  73           H        THR  73  30.921   0.077   8.317
  550    HA   THR  73           HA       THR  73  31.490   2.560   6.859
  551    HB   THR  73           HB       THR  73  33.762   1.495   6.475
  552    HG1  THR  73           HG1      THR  73  33.007  -0.655   7.055
  553   HG21  THR  73          HG21      THR  73  32.929   2.050   9.326
  554   HG22  THR  73          HG22      THR  73  33.428   3.254   8.138
  555   HG23  THR  73          HG23      THR  73  34.586   2.060   8.722
  Start of MODEL    7
    1    H1   GLN  -1           H1       GLN  -1  -4.905  15.382  -7.555
    2    H2   GLN  -1           H2       GLN  -1  -5.941  15.017  -6.273
    3    H3   GLN  -1           H3       GLN  -1  -6.071  14.172  -7.731
    4    HA   GLN  -1           HA       GLN  -1  -3.741  14.093  -5.904
    5    HB2  GLN  -1           HB2      GLN  -1  -5.732  11.908  -6.534
    6    HB3  GLN  -1           HB3      GLN  -1  -4.429  11.845  -5.358
    7    HG2  GLN  -1           HG2      GLN  -1  -5.555  13.563  -4.029
    8    HG3  GLN  -1           HG3      GLN  -1  -6.869  13.597  -5.204
    9   HE21  GLN  -1          HE21      GLN  -1  -5.375  11.849  -2.618
   10   HE22  GLN  -1          HE22      GLN  -1  -6.640  10.678  -2.419
   11    H    SER   0           H        SER   0  -1.911  13.492  -6.906
   12    HA   SER   0           HA       SER   0  -1.987  12.709  -9.670
   13    HB2  SER   0           HB2      SER   0   0.349  12.897  -7.756
   14    HB3  SER   0           HB3      SER   0   0.471  12.680  -9.503
   15    HG   SER   0           HG       SER   0  -1.095  14.751  -9.134
   16    H    MET   1           H        MET   1  -1.340  11.130  -6.587
   17    HA   MET   1           HA       MET   1  -0.870   8.585  -7.895
   18    HB2  MET   1           HB2      MET   1  -0.663   7.668  -5.632
   19    HB3  MET   1           HB3      MET   1   0.370   9.066  -5.857
   20    HG2  MET   1           HG2      MET   1  -1.332  10.448  -4.701
   21    HG3  MET   1           HG3      MET   1  -2.255   8.981  -4.394
   22    HE1  MET   1           HE1      MET   1  -2.278   9.561  -1.817
   23    HE2  MET   1           HE2      MET   1  -1.326  11.017  -2.105
   24    HE3  MET   1           HE3      MET   1  -0.829   9.868  -0.862
   25    H    ALA   2           H        ALA   2  -2.163   6.743  -7.535
   26    HA   ALA   2           HA       ALA   2  -4.948   7.291  -6.745
   27    HB1  ALA   2           HB1      ALA   2  -4.132   5.692  -9.165
   28    HB2  ALA   2           HB2      ALA   2  -4.774   7.332  -9.195
   29    HB3  ALA   2           HB3      ALA   2  -5.781   6.003  -8.622
   30    H    LEU   3           H        LEU   3  -2.229   5.309  -6.441
   31    HA   LEU   3           HA       LEU   3  -3.845   3.070  -5.404
   32    HB2  LEU   3           HB2      LEU   3  -1.064   2.911  -6.603
   33    HB3  LEU   3           HB3      LEU   3  -2.000   1.566  -5.987
   34    HG   LEU   3           HG       LEU   3  -3.707   2.182  -7.832
   35   HD11  LEU   3          HD11      LEU   3  -2.698   4.346  -8.367
   36   HD12  LEU   3          HD12      LEU   3  -2.775   3.278  -9.771
   37   HD13  LEU   3          HD13      LEU   3  -1.245   3.519  -8.925
   38   HD21  LEU   3          HD21      LEU   3  -2.295   0.164  -7.799
   39   HD22  LEU   3          HD22      LEU   3  -1.013   1.072  -8.605
   40   HD23  LEU   3          HD23      LEU   3  -2.548   0.788  -9.428
   41    H    HIS   4           H        HIS   4  -2.908   1.911  -3.665
   42    HA   HIS   4           HA       HIS   4  -1.428   3.676  -1.863
   43    HB2  HIS   4           HB2      HIS   4  -3.110   1.262  -1.456
   44    HB3  HIS   4           HB3      HIS   4  -1.908   1.655  -0.255
   45    HD1  HIS   4           HD1      HIS   4  -2.524   3.368   1.452
   46    HD2  HIS   4           HD2      HIS   4  -5.151   3.324  -1.769
   47    HE1  HIS   4           HE1      HIS   4  -4.394   4.913   2.091
   48    HE2  HIS   4           HE2      HIS   4  -6.084   4.657   0.248
   49    H    TYR   5           H        TYR   5   0.583   3.399  -1.438
   50    HA   TYR   5           HA       TYR   5   2.014   1.081  -2.511
   51    HB2  TYR   5           HB2      TYR   5   2.994   3.760  -1.490
   52    HB3  TYR   5           HB3      TYR   5   4.069   2.440  -1.944
   53    HD1  TYR   5           HD1      TYR   5   4.918   4.513  -3.300
   54    HD2  TYR   5           HD2      TYR   5   1.334   2.414  -4.150
   55    HE1  TYR   5           HE1      TYR   5   4.997   5.335  -5.606
   56    HE2  TYR   5           HE2      TYR   5   1.397   3.212  -6.466
   57    HH   TYR   5           HH       TYR   5   2.441   5.296  -7.665
   58    H    TYR   6           H        TYR   6   2.761  -0.468  -1.196
   59    HA   TYR   6           HA       TYR   6   3.362   0.251   1.595
   60    HB2  TYR   6           HB2      TYR   6   2.075  -2.307   0.611
   61    HB3  TYR   6           HB3      TYR   6   2.715  -2.085   2.239
   62    HD1  TYR   6           HD1      TYR   6   0.030  -1.221  -0.079
   63    HD2  TYR   6           HD2      TYR   6   1.596  -0.625   3.829
   64    HE1  TYR   6           HE1      TYR   6  -2.106  -0.240   0.619
   65    HE2  TYR   6           HE2      TYR   6  -0.547   0.358   4.540
   66    HH   TYR   6           HH       TYR   6  -2.495   1.456   3.529
   67    H    CYS   7           H        CYS   7   5.364  -0.448   2.305
   68    HA   CYS   7           HA       CYS   7   7.051  -1.054   0.054
   69    HB2  CYS   7           HB2      CYS   7   7.615   0.765   1.722
   70    HB3  CYS   7           HB3      CYS   7   8.040  -0.523   2.836
   71    H    ARG   8           H        ARG   8   8.419  -2.624  -0.260
   72    HA   ARG   8           HA       ARG   8   8.123  -5.092   1.116
   73    HB2  ARG   8           HB2      ARG   8   9.912  -5.903  -0.274
   74    HB3  ARG   8           HB3      ARG   8   8.877  -4.891  -1.273
   75    HG2  ARG   8           HG2      ARG   8  10.443  -3.135  -1.295
   76    HG3  ARG   8           HG3      ARG   8  11.379  -3.851   0.021
   77    HD2  ARG   8           HD2      ARG   8  11.649  -5.840  -1.647
   78    HD3  ARG   8           HD3      ARG   8  11.249  -4.623  -2.861
   79    HE   ARG   8           HE       ARG   8  13.245  -3.595  -1.178
   80   HH11  ARG   8          HH11      ARG   8  12.815  -6.006  -3.670
   81   HH12  ARG   8          HH12      ARG   8  14.488  -6.012  -4.128
   82   HH21  ARG   8          HH21      ARG   8  15.444  -3.618  -1.757
   83   HH22  ARG   8          HH22      ARG   8  15.984  -4.653  -3.042
   84    H    HIS   9           H        HIS   9   8.904  -5.472   3.043
   85    HA   HIS   9           HA       HIS   9  10.512  -5.987   4.581
   86    HB2  HIS   9           HB2      HIS   9  12.180  -5.874   2.687
   87    HB3  HIS   9           HB3      HIS   9  12.469  -4.198   3.141
   88    HD1  HIS   9           HD1      HIS   9  13.219  -7.693   4.131
   89    HD2  HIS   9           HD2      HIS   9  13.820  -3.862   5.633
   90    HE1  HIS   9           HE1      HIS   9  14.912  -7.946   5.973
   91    HE2  HIS   9           HE2      HIS   9  15.358  -5.602   6.778
   92    H    CYS  10           H        CYS  10  10.542  -2.514   3.621
   93    HA   CYS  10           HA       CYS  10  11.017  -1.644   6.299
   94    HB2  CYS  10           HB2      CYS  10   9.539  -0.061   4.194
   95    HB3  CYS  10           HB3      CYS  10  10.364   0.567   5.610
   96    H    GLY  11           H        GLY  11   8.166  -2.325   4.369
   97    HA2  GLY  11           HA2      GLY  11   6.041  -2.927   5.047
   98    HA3  GLY  11           HA3      GLY  11   6.554  -2.701   6.725
   99    H    VAL  12           H        VAL  12   7.197  -0.072   4.652
  100    HA   VAL  12           HA       VAL  12   5.181   1.444   6.076
  101    HB   VAL  12           HB       VAL  12   7.143   2.573   6.448
  102   HG11  VAL  12          HG11      VAL  12   7.898   1.943   3.607
  103   HG12  VAL  12          HG12      VAL  12   8.578   1.246   5.081
  104   HG13  VAL  12          HG13      VAL  12   8.854   2.945   4.698
  105   HG21  VAL  12          HG21      VAL  12   5.495   4.111   5.411
  106   HG22  VAL  12          HG22      VAL  12   6.276   3.822   3.853
  107   HG23  VAL  12          HG23      VAL  12   7.171   4.601   5.159
  108    H    LYS  13           H        LYS  13   3.598   2.577   5.204
  109    HA   LYS  13           HA       LYS  13   2.898   2.040   2.475
  110    HB2  LYS  13           HB2      LYS  13   1.042   3.859   3.259
  111    HB3  LYS  13           HB3      LYS  13   0.909   2.130   3.518
  112    HG2  LYS  13           HG2      LYS  13   0.330   3.216   5.546
  113    HG3  LYS  13           HG3      LYS  13   1.904   2.463   5.785
  114    HD2  LYS  13           HD2      LYS  13   2.971   4.655   5.366
  115    HD3  LYS  13           HD3      LYS  13   1.368   5.380   5.220
  116    HE2  LYS  13           HE2      LYS  13   2.512   4.021   7.660
  117    HE3  LYS  13           HE3      LYS  13   2.282   5.755   7.442
  118    HZ1  LYS  13           HZ1      LYS  13   0.142   3.701   7.578
  119    HZ2  LYS  13           HZ2      LYS  13  -0.117   5.339   7.267
  120    HZ3  LYS  13           HZ3      LYS  13   0.506   4.854   8.759
  121    H    VAL  14           H        VAL  14   4.254   3.016   1.109
  122    HA   VAL  14           HA       VAL  14   5.181   5.704   1.497
  123    HB   VAL  14           HB       VAL  14   5.562   4.826  -1.224
  124   HG11  VAL  14          HG11      VAL  14   7.853   5.231  -0.741
  125   HG12  VAL  14          HG12      VAL  14   7.577   5.085   0.999
  126   HG13  VAL  14          HG13      VAL  14   6.904   6.459   0.103
  127   HG21  VAL  14          HG21      VAL  14   7.031   2.886  -0.758
  128   HG22  VAL  14          HG22      VAL  14   5.331   2.552  -0.460
  129   HG23  VAL  14          HG23      VAL  14   6.419   2.854   0.895
  130    H    GLY  15           H        GLY  15   2.363   4.369   0.267
  131    HA2  GLY  15           HA2      GLY  15   1.912   6.602  -1.597
  132    HA3  GLY  15           HA3      GLY  15   1.013   5.092  -1.584
  133    H    SER  16           H        SER  16   1.821   7.287   1.063
  134    HA   SER  16           HA       SER  16  -0.884   8.279   1.220
  135    HB2  SER  16           HB2      SER  16   0.244   6.601   3.480
  136    HB3  SER  16           HB3      SER  16  -1.271   7.504   3.530
  137    HG   SER  16           HG       SER  16  -1.267   5.973   1.348
  138    H    LEU  17           H        LEU  17   0.269  10.223   0.830
  139    HA   LEU  17           HA       LEU  17   1.971  11.140   3.034
  140    HB2  LEU  17           HB2      LEU  17   2.814  12.824   1.432
  141    HB3  LEU  17           HB3      LEU  17   3.111  11.179   0.907
  142    HG   LEU  17           HG       LEU  17   0.819  11.606  -0.403
  143   HD11  LEU  17          HD11      LEU  17   0.505  13.867   0.432
  144   HD12  LEU  17          HD12      LEU  17   0.773  13.872  -1.311
  145   HD13  LEU  17          HD13      LEU  17   2.075  14.339  -0.218
  146   HD21  LEU  17          HD21      LEU  17   3.538  12.523  -1.315
  147   HD22  LEU  17          HD22      LEU  17   2.169  12.155  -2.363
  148   HD23  LEU  17          HD23      LEU  17   2.908  10.878  -1.396
  149    H    GLU  18           H        GLU  18  -1.028  11.428   1.583
  150    HA   GLU  18           HA       GLU  18  -1.533  14.145   2.326
  151    HB2  GLU  18           HB2      GLU  18  -3.371  11.968   1.337
  152    HB3  GLU  18           HB3      GLU  18  -3.893  13.613   1.669
  153    HG2  GLU  18           HG2      GLU  18  -2.271  14.416  -0.023
  154    HG3  GLU  18           HG3      GLU  18  -1.899  12.734  -0.404
  155    H    SER  19           H        SER  19  -2.326  14.863   4.204
  156    HA   SER  19           HA       SER  19  -3.657  12.950   5.983
  157    HB2  SER  19           HB2      SER  19  -2.489  14.143   7.905
  158    HB3  SER  19           HB3      SER  19  -1.472  13.102   6.912
  159    HG   SER  19           HG       SER  19  -0.282  14.794   6.615
  160    H    SER  20           H        SER  20  -5.498  13.667   6.823
  161    HA   SER  20           HA       SER  20  -6.016  16.434   7.317
  162    HB2  SER  20           HB2      SER  20  -6.452  16.397   4.899
  163    HB3  SER  20           HB3      SER  20  -7.570  15.056   5.112
  164    HG   SER  20           HG       SER  20  -8.910  16.723   5.157
  165    H    MET  21           H        MET  21  -8.216  13.772   6.434
  166    HA   MET  21           HA       MET  21  -9.086  13.726   9.249
  167    HB2  MET  21           HB2      MET  21 -10.729  13.078   6.790
  168    HB3  MET  21           HB3      MET  21 -11.292  12.988   8.452
  169    HG2  MET  21           HG2      MET  21 -10.879  15.418   8.668
  170    HG3  MET  21           HG3      MET  21 -10.471  15.459   6.954
  171    HE1  MET  21           HE1      MET  21 -12.258  17.278   6.404
  172    HE2  MET  21           HE2      MET  21 -12.648  17.366   8.121
  173    HE3  MET  21           HE3      MET  21 -13.939  17.200   6.933
  174    H    VAL  22           H        VAL  22  -9.593  11.591   6.469
  175    HA   VAL  22           HA       VAL  22  -9.470   9.344   6.241
  176    HB   VAL  22           HB       VAL  22  -6.934   9.426   7.846
  177   HG11  VAL  22          HG11      VAL  22  -7.627   7.279   7.004
  178   HG12  VAL  22          HG12      VAL  22  -6.210   7.829   6.108
  179   HG13  VAL  22          HG13      VAL  22  -7.815   7.943   5.383
  180   HG21  VAL  22          HG21      VAL  22  -6.883  11.417   6.433
  181   HG22  VAL  22          HG22      VAL  22  -7.262  10.432   5.020
  182   HG23  VAL  22          HG23      VAL  22  -5.730  10.208   5.866
  183    H    SER  23           H        SER  23 -11.310   9.491   7.902
  184    HA   SER  23           HA       SER  23 -10.778   8.714  10.584
  185    HB2  SER  23           HB2      SER  23 -13.325   8.366  10.582
  186    HB3  SER  23           HB3      SER  23 -12.730   9.994  10.260
  187    HG   SER  23           HG       SER  23 -14.330   9.398   8.759
  188    H    THR  24           H        THR  24 -11.193   7.001   7.639
  189    HA   THR  24           HA       THR  24 -10.705   4.492   8.900
  190    HB   THR  24           HB       THR  24 -13.062   4.576   9.407
  191    HG1  THR  24           HG1      THR  24 -13.716   2.844   7.659
  192   HG21  THR  24          HG21      THR  24 -14.773   4.797   7.660
  193   HG22  THR  24          HG22      THR  24 -13.506   5.101   6.472
  194   HG23  THR  24          HG23      THR  24 -13.770   6.243   7.788
  195    H    ASP  25           H        ASP  25  -9.978   2.979   7.475
  196    HA   ASP  25           HA       ASP  25  -9.603   3.813   4.695
  197    HB2  ASP  25           HB2      ASP  25  -7.675   2.948   6.010
  198    HB3  ASP  25           HB3      ASP  25  -8.513   1.419   6.204
  199    H    SER  26           H        SER  26 -11.595   1.963   6.635
  200    HA   SER  26           HA       SER  26 -12.391   0.131   4.497
  201    HB2  SER  26           HB2      SER  26 -11.886  -0.767   6.772
  202    HB3  SER  26           HB3      SER  26 -13.227   0.185   7.408
  203    HG   SER  26           HG       SER  26 -13.243  -2.110   5.805
  204    H    LEU  27           H        LEU  27 -13.706   1.330   3.153
  205    HA   LEU  27           HA       LEU  27 -16.329   1.913   4.265
  206    HB2  LEU  27           HB2      LEU  27 -14.541   3.945   3.038
  207    HB3  LEU  27           HB3      LEU  27 -16.255   4.032   2.673
  208    HG   LEU  27           HG       LEU  27 -15.113   4.048   5.468
  209   HD11  LEU  27          HD11      LEU  27 -15.598   6.419   5.486
  210   HD12  LEU  27          HD12      LEU  27 -16.157   6.341   3.816
  211   HD13  LEU  27          HD13      LEU  27 -14.459   6.045   4.192
  212   HD21  LEU  27          HD21      LEU  27 -17.374   4.805   6.078
  213   HD22  LEU  27          HD22      LEU  27 -17.386   3.194   5.365
  214   HD23  LEU  27          HD23      LEU  27 -17.886   4.586   4.405
  215    H    GLY  28           H        GLY  28 -14.895   2.762   1.124
  216    HA2  GLY  28           HA2      GLY  28 -15.431   2.007  -0.994
  217    HA3  GLY  28           HA3      GLY  28 -16.299   0.668  -0.257
  218    H    PHE  29           H        PHE  29 -16.598   3.618  -1.872
  219    HA   PHE  29           HA       PHE  29 -19.347   4.015  -1.001
  220    HB2  PHE  29           HB2      PHE  29 -17.381   5.787  -2.449
  221    HB3  PHE  29           HB3      PHE  29 -19.097   6.161  -2.360
  222    HD1  PHE  29           HD1      PHE  29 -16.102   5.544  -0.258
  223    HD2  PHE  29           HD2      PHE  29 -19.970   7.290  -0.544
  224    HE1  PHE  29           HE1      PHE  29 -15.738   6.692   1.884
  225    HE2  PHE  29           HE2      PHE  29 -19.616   8.434   1.601
  226    HZ   PHE  29           HZ       PHE  29 -17.499   8.137   2.820
  227    H    GLN  30           H        GLN  30 -20.665   4.923  -2.822
  228    HA   GLN  30           HA       GLN  30 -20.203   3.986  -5.475
  229    HB2  GLN  30           HB2      GLN  30 -22.328   2.663  -5.528
  230    HB3  GLN  30           HB3      GLN  30 -21.026   1.910  -4.628
  231    HG2  GLN  30           HG2      GLN  30 -22.050   2.633  -2.543
  232    HG3  GLN  30           HG3      GLN  30 -23.337   3.432  -3.443
  233   HE21  GLN  30          HE21      GLN  30 -23.467   1.287  -1.466
  234   HE22  GLN  30          HE22      GLN  30 -24.273  -0.027  -2.249
  235    H    HIS  31           H        HIS  31 -22.208   5.458  -3.054
  236    HA   HIS  31           HA       HIS  31 -23.367   7.233  -5.096
  237    HB2  HIS  31           HB2      HIS  31 -25.088   5.759  -4.133
  238    HB3  HIS  31           HB3      HIS  31 -24.625   6.263  -2.513
  239    HD1  HIS  31           HD1      HIS  31 -25.982   8.084  -1.557
  240    HD2  HIS  31           HD2      HIS  31 -26.124   8.069  -5.710
  241    HE1  HIS  31           HE1      HIS  31 -27.647   9.864  -2.184
  242    HE2  HIS  31           HE2      HIS  31 -27.816   9.738  -4.693
  243    H    LEU  32           H        LEU  32 -21.734   8.772  -4.856
  244    HA   LEU  32           HA       LEU  32 -21.581  10.042  -2.209
  245    HB2  LEU  32           HB2      LEU  32 -19.174  10.468  -2.608
  246    HB3  LEU  32           HB3      LEU  32 -19.552   8.787  -2.372
  247    HG   LEU  32           HG       LEU  32 -19.305   9.894  -5.152
  248   HD11  LEU  32          HD11      LEU  32 -17.024   8.999  -3.393
  249   HD12  LEU  32          HD12      LEU  32 -17.304  10.638  -3.980
  250   HD13  LEU  32          HD13      LEU  32 -16.921   9.349  -5.119
  251   HD21  LEU  32          HD21      LEU  32 -18.625   7.194  -3.996
  252   HD22  LEU  32          HD22      LEU  32 -18.647   7.643  -5.698
  253   HD23  LEU  32          HD23      LEU  32 -20.152   7.591  -4.782
  254    H    THR  33           H        THR  33 -20.277  12.089  -2.386
  255    HA   THR  33           HA       THR  33 -20.649  13.539  -4.904
  256    HB   THR  33           HB       THR  33 -20.962  14.771  -2.149
  257    HG1  THR  33           HG1      THR  33 -22.805  13.469  -3.802
  258   HG21  THR  33          HG21      THR  33 -21.661  15.786  -4.910
  259   HG22  THR  33          HG22      THR  33 -20.353  16.370  -3.880
  260   HG23  THR  33          HG23      THR  33 -22.032  16.615  -3.401
  261    H    ASN  34           H        ASN  34 -18.985  15.359  -5.022
  262    HA   ASN  34           HA       ASN  34 -16.424  14.532  -4.712
  263    HB2  ASN  34           HB2      ASN  34 -15.785  17.002  -4.641
  264    HB3  ASN  34           HB3      ASN  34 -16.754  16.466  -6.005
  265   HD21  ASN  34          HD21      ASN  34 -17.452  18.569  -6.381
  266   HD22  ASN  34          HD22      ASN  34 -18.636  19.335  -5.380
  267    H    GLU  35           H        GLU  35 -18.335  16.139  -2.233
  268    HA   GLU  35           HA       GLU  35 -16.235  16.578  -0.423
  269    HB2  GLU  35           HB2      GLU  35 -18.040  16.858   1.267
  270    HB3  GLU  35           HB3      GLU  35 -18.233  17.837  -0.180
  271    HG2  GLU  35           HG2      GLU  35 -19.883  16.312  -1.037
  272    HG3  GLU  35           HG3      GLU  35 -19.648  15.235   0.339
  273    H    GLU  36           H        GLU  36 -18.228  13.704  -0.978
  274    HA   GLU  36           HA       GLU  36 -17.804  12.541   1.575
  275    HB2  GLU  36           HB2      GLU  36 -18.446  11.253  -1.079
  276    HB3  GLU  36           HB3      GLU  36 -18.521  10.436   0.474
  277    HG2  GLU  36           HG2      GLU  36 -20.150  12.867  -0.216
  278    HG3  GLU  36           HG3      GLU  36 -20.712  11.210  -0.435
  279    H    ARG  37           H        ARG  37 -16.040  12.518  -1.443
  280    HA   ARG  37           HA       ARG  37 -14.252  10.435  -0.766
  281    HB2  ARG  37           HB2      ARG  37 -14.717  11.032  -3.072
  282    HB3  ARG  37           HB3      ARG  37 -14.084  12.651  -2.809
  283    HG2  ARG  37           HG2      ARG  37 -11.897  11.829  -2.491
  284    HG3  ARG  37           HG3      ARG  37 -12.461  10.163  -2.473
  285    HD2  ARG  37           HD2      ARG  37 -13.062  10.288  -4.800
  286    HD3  ARG  37           HD3      ARG  37 -12.686  12.010  -4.843
  287    HE   ARG  37           HE       ARG  37 -10.334  11.264  -4.272
  288   HH11  ARG  37          HH11      ARG  37 -12.547   9.267  -6.130
  289   HH12  ARG  37          HH12      ARG  37 -11.274   8.435  -6.966
  290   HH21  ARG  37          HH21      ARG  37  -8.680  10.182  -5.371
  291   HH22  ARG  37          HH22      ARG  37  -9.074   8.966  -6.551
  292    H    ASN  38           H        ASN  38 -14.192  13.929  -0.495
  293    HA   ASN  38           HA       ASN  38 -11.466  14.039   0.404
  294    HB2  ASN  38           HB2      ASN  38 -12.573  15.903  -0.807
  295    HB3  ASN  38           HB3      ASN  38 -13.628  16.148   0.578
  296   HD21  ASN  38          HD21      ASN  38 -12.925  18.216   0.943
  297   HD22  ASN  38          HD22      ASN  38 -11.350  18.580   1.556
  298    H    ASP  39           H        ASP  39 -14.634  14.026   1.909
  299    HA   ASP  39           HA       ASP  39 -13.661  14.762   4.508
  300    HB2  ASP  39           HB2      ASP  39 -15.958  15.276   3.588
  301    HB3  ASP  39           HB3      ASP  39 -16.350  13.576   3.813
  302    H    MET  40           H        MET  40 -15.130  11.757   3.215
  303    HA   MET  40           HA       MET  40 -14.133  10.394   5.621
  304    HB2  MET  40           HB2      MET  40 -16.334   9.607   3.712
  305    HB3  MET  40           HB3      MET  40 -15.812   8.649   5.091
  306    HG2  MET  40           HG2      MET  40 -16.458  10.465   6.592
  307    HG3  MET  40           HG3      MET  40 -16.991  11.414   5.207
  308    HE1  MET  40           HE1      MET  40 -18.986   7.486   6.581
  309    HE2  MET  40           HE2      MET  40 -17.601   8.223   7.384
  310    HE3  MET  40           HE3      MET  40 -17.418   7.521   5.777
  311    H    ILE  41           H        ILE  41 -13.383  10.788   2.433
  312    HA   ILE  41           HA       ILE  41 -11.826   9.843   1.086
  313    HB   ILE  41           HB       ILE  41 -11.393   8.043   3.458
  314   HG12  ILE  41          HG12      ILE  41  -9.086   9.027   3.285
  315   HG13  ILE  41          HG13      ILE  41  -9.687  10.080   2.012
  316   HG21  ILE  41          HG21      ILE  41 -11.119   6.612   1.521
  317   HG22  ILE  41          HG22      ILE  41  -9.551   6.957   2.251
  318   HG23  ILE  41          HG23      ILE  41 -10.040   7.792   0.777
  319   HD11  ILE  41          HD11      ILE  41 -10.737  10.020   4.829
  320   HD12  ILE  41          HD12      ILE  41 -11.194  11.147   3.552
  321   HD13  ILE  41          HD13      ILE  41  -9.557  11.173   4.208
  322    H    SER  42           H        SER  42 -12.505   8.927  -0.711
  323    HA   SER  42           HA       SER  42 -14.411   6.724  -0.533
  324    HB2  SER  42           HB2      SER  42 -13.575   8.415  -2.890
  325    HB3  SER  42           HB3      SER  42 -14.746   7.099  -2.945
  326    HG   SER  42           HG       SER  42 -15.591   8.546  -1.009
  327    H    TYR  43           H        TYR  43 -12.671   5.346   0.213
  328    HA   TYR  43           HA       TYR  43 -11.208   4.213  -2.069
  329    HB2  TYR  43           HB2      TYR  43  -9.610   5.066  -0.534
  330    HB3  TYR  43           HB3      TYR  43 -10.495   4.416   0.839
  331    HD1  TYR  43           HD1      TYR  43  -9.748   2.442   1.792
  332    HD2  TYR  43           HD2      TYR  43  -8.738   3.271  -2.255
  333    HE1  TYR  43           HE1      TYR  43  -8.371   0.413   1.726
  334    HE2  TYR  43           HE2      TYR  43  -7.355   1.237  -2.331
  335    HH   TYR  43           HH       TYR  43  -7.475  -1.133   0.161
  336    H    LYS  44           H        LYS  44 -11.301   2.014  -2.369
  337    HA   LYS  44           HA       LYS  44 -13.683   0.766  -1.335
  338    HB2  LYS  44           HB2      LYS  44 -11.594  -0.189  -3.296
  339    HB3  LYS  44           HB3      LYS  44 -13.061  -1.071  -2.903
  340    HG2  LYS  44           HG2      LYS  44 -14.421   0.689  -3.823
  341    HG3  LYS  44           HG3      LYS  44 -12.994   1.685  -4.102
  342    HD2  LYS  44           HD2      LYS  44 -12.137   0.057  -5.690
  343    HD3  LYS  44           HD3      LYS  44 -13.515  -0.998  -5.375
  344    HE2  LYS  44           HE2      LYS  44 -13.778   0.281  -7.456
  345    HE3  LYS  44           HE3      LYS  44 -15.032   0.655  -6.276
  346    HZ1  LYS  44           HZ1      LYS  44 -14.198   2.654  -7.329
  347    HZ2  LYS  44           HZ2      LYS  44 -12.622   2.305  -6.826
  348    HZ3  LYS  44           HZ3      LYS  44 -13.816   2.663  -5.683
  349    H    GLU  45           H        GLU  45 -13.838  -0.841   0.094
  350    HA   GLU  45           HA       GLU  45 -11.647  -1.654   1.713
  351    HB2  GLU  45           HB2      GLU  45 -13.917  -1.604   2.576
  352    HB3  GLU  45           HB3      GLU  45 -14.405  -2.827   1.413
  353    HG2  GLU  45           HG2      GLU  45 -14.091  -3.800   3.581
  354    HG3  GLU  45           HG3      GLU  45 -12.899  -4.433   2.462
  355    H    ASN  46           H        ASN  46 -12.679  -2.529  -1.350
  356    HA   ASN  46           HA       ASN  46 -12.077  -5.267  -1.458
  357    HB2  ASN  46           HB2      ASN  46 -11.936  -3.150  -3.611
  358    HB3  ASN  46           HB3      ASN  46 -11.742  -4.870  -3.916
  359   HD21  ASN  46          HD21      ASN  46 -13.511  -4.948  -5.260
  360   HD22  ASN  46          HD22      ASN  46 -15.133  -4.839  -4.669
  361    H    GLY  47           H        GLY  47 -10.030  -2.529  -1.155
  362    HA2  GLY  47           HA2      GLY  47  -7.731  -2.388  -0.999
  363    HA3  GLY  47           HA3      GLY  47  -7.673  -4.152  -1.114
  364    H    ASP  48           H        ASP  48  -9.232  -2.077  -3.436
  365    HA   ASP  48           HA       ASP  48  -8.422  -3.548  -5.598
  366    HB2  ASP  48           HB2      ASP  48  -9.244  -1.692  -6.966
  367    HB3  ASP  48           HB3      ASP  48 -10.339  -2.065  -5.649
  368    H    VAL  49           H        VAL  49  -6.977  -0.420  -4.539
  369    HA   VAL  49           HA       VAL  49  -4.757  -1.061  -6.318
  370    HB   VAL  49           HB       VAL  49  -4.157   1.349  -6.018
  371   HG11  VAL  49          HG11      VAL  49  -6.845   0.739  -7.226
  372   HG12  VAL  49          HG12      VAL  49  -5.281   0.536  -8.013
  373   HG13  VAL  49          HG13      VAL  49  -5.855   2.151  -7.595
  374   HG21  VAL  49          HG21      VAL  49  -5.418   1.789  -3.945
  375   HG22  VAL  49          HG22      VAL  49  -6.927   1.541  -4.823
  376   HG23  VAL  49          HG23      VAL  49  -5.886   2.900  -5.233
  377    H    HIS  50           H        HIS  50  -3.601  -2.421  -5.066
  378    HA   HIS  50           HA       HIS  50  -2.301  -1.271  -2.701
  379    HB2  HIS  50           HB2      HIS  50  -4.064  -2.873  -1.985
  380    HB3  HIS  50           HB3      HIS  50  -3.305  -4.120  -2.961
  381    HD1  HIS  50           HD1      HIS  50  -3.393  -2.831   0.398
  382    HD2  HIS  50           HD2      HIS  50  -0.560  -4.721  -1.981
  383    HE1  HIS  50           HE1      HIS  50  -1.691  -3.758   1.987
  384    HE2  HIS  50           HE2      HIS  50  -0.126  -5.093   0.538
  385    H    VAL  51           H        VAL  51  -0.320  -0.939  -3.516
  386    HA   VAL  51           HA       VAL  51   0.939  -3.141  -5.019
  387    HB   VAL  51           HB       VAL  51   2.299  -1.355  -6.158
  388   HG11  VAL  51          HG11      VAL  51   0.566  -0.669  -7.710
  389   HG12  VAL  51          HG12      VAL  51  -0.679  -1.083  -6.532
  390   HG13  VAL  51          HG13      VAL  51   0.315  -2.353  -7.248
  391   HG21  VAL  51          HG21      VAL  51   2.040   0.395  -4.547
  392   HG22  VAL  51          HG22      VAL  51   0.302   0.449  -4.851
  393   HG23  VAL  51          HG23      VAL  51   1.436   0.919  -6.120
  394    H    LEU  52           H        LEU  52   3.016  -3.720  -4.467
  395    HA   LEU  52           HA       LEU  52   4.100  -2.407  -2.078
  396    HB2  LEU  52           HB2      LEU  52   5.101  -5.001  -3.244
  397    HB3  LEU  52           HB3      LEU  52   5.361  -4.357  -1.636
  398    HG   LEU  52           HG       LEU  52   2.735  -5.395  -2.700
  399   HD11  LEU  52          HD11      LEU  52   4.373  -7.150  -2.287
  400   HD12  LEU  52          HD12      LEU  52   3.072  -7.199  -1.098
  401   HD13  LEU  52          HD13      LEU  52   4.642  -6.526  -0.662
  402   HD21  LEU  52          HD21      LEU  52   1.975  -5.140  -0.368
  403   HD22  LEU  52          HD22      LEU  52   2.363  -3.597  -1.127
  404   HD23  LEU  52          HD23      LEU  52   3.491  -4.326   0.017
  405    H    THR  53           H        THR  53   6.008  -1.349  -2.132
  406    HA   THR  53           HA       THR  53   7.722  -1.514  -4.455
  407    HB   THR  53           HB       THR  53   5.907   0.030  -5.172
  408    HG1  THR  53           HG1      THR  53   7.370   1.144  -6.226
  409   HG21  THR  53          HG21      THR  53   5.366   0.992  -2.986
  410   HG22  THR  53          HG22      THR  53   5.740   2.248  -4.165
  411   HG23  THR  53          HG23      THR  53   6.935   1.794  -2.950
  412    H    ILE  54           H        ILE  54   9.168   0.780  -4.125
  413    HA   ILE  54           HA       ILE  54  10.346   0.344  -1.463
  414    HB   ILE  54           HB       ILE  54  11.462   0.203  -4.135
  415   HG12  ILE  54          HG12      ILE  54  12.815  -0.409  -1.520
  416   HG13  ILE  54          HG13      ILE  54  11.570  -1.452  -2.197
  417   HG21  ILE  54          HG21      ILE  54  12.931   1.965  -2.187
  418   HG22  ILE  54          HG22      ILE  54  12.316   2.424  -3.776
  419   HG23  ILE  54          HG23      ILE  54  13.631   1.255  -3.640
  420   HD11  ILE  54          HD11      ILE  54  12.937  -1.795  -4.183
  421   HD12  ILE  54          HD12      ILE  54  13.814  -2.241  -2.720
  422   HD13  ILE  54          HD13      ILE  54  14.166  -0.713  -3.529
  423    H    CYS  55           H        CYS  55  10.953   2.081  -0.252
  424    HA   CYS  55           HA       CYS  55   9.640   4.575  -0.713
  425    HB2  CYS  55           HB2      CYS  55  11.773   4.259   1.371
  426    HB3  CYS  55           HB3      CYS  55  10.304   5.213   1.429
  427    H    GLU  56           H        GLU  56  11.244   6.541   0.118
  428    HA   GLU  56           HA       GLU  56  13.257   6.857  -1.928
  429    HB2  GLU  56           HB2      GLU  56  11.898   8.767  -1.164
  430    HB3  GLU  56           HB3      GLU  56  12.498   8.557   0.472
  431    HG2  GLU  56           HG2      GLU  56  14.799   9.006  -0.446
  432    HG3  GLU  56           HG3      GLU  56  14.004   9.485  -1.944
  433    H    ASP  57           H        ASP  57  12.916   5.919   1.343
  434    HA   ASP  57           HA       ASP  57  15.564   6.329   2.241
  435    HB2  ASP  57           HB2      ASP  57  14.718   5.750   4.257
  436    HB3  ASP  57           HB3      ASP  57  13.183   5.927   3.448
  437    H    CYS  58           H        CYS  58  13.833   3.333   1.282
  438    HA   CYS  58           HA       CYS  58  16.175   1.741   1.643
  439    HB2  CYS  58           HB2      CYS  58  14.714   0.013   0.360
  440    HB3  CYS  58           HB3      CYS  58  14.211   0.518   1.964
  441    H    GLN  59           H        GLN  59  14.634   3.323  -1.109
  442    HA   GLN  59           HA       GLN  59  16.104   2.135  -3.179
  443    HB2  GLN  59           HB2      GLN  59  14.120   3.769  -3.346
  444    HB3  GLN  59           HB3      GLN  59  15.308   5.046  -3.181
  445    HG2  GLN  59           HG2      GLN  59  15.469   2.938  -5.325
  446    HG3  GLN  59           HG3      GLN  59  14.579   4.434  -5.532
  447   HE21  GLN  59          HE21      GLN  59  16.424   6.196  -4.254
  448   HE22  GLN  59          HE22      GLN  59  17.836   6.266  -5.241
  449    H    GLU  60           H        GLU  60  16.899   4.673  -0.941
  450    HA   GLU  60           HA       GLU  60  19.200   5.642  -2.267
  451    HB2  GLU  60           HB2      GLU  60  17.688   6.489  -0.238
  452    HB3  GLU  60           HB3      GLU  60  18.984   5.769   0.690
  453    HG2  GLU  60           HG2      GLU  60  19.531   7.771  -1.471
  454    HG3  GLU  60           HG3      GLU  60  19.124   8.260   0.170
  455    H    ALA  61           H        ALA  61  18.740   3.410   0.447
  456    HA   ALA  61           HA       ALA  61  21.474   2.757   0.797
  457    HB1  ALA  61           HB1      ALA  61  20.617   0.789   2.019
  458    HB2  ALA  61           HB2      ALA  61  18.990   1.163   1.453
  459    HB3  ALA  61           HB3      ALA  61  19.827   2.280   2.533
  460    H    LEU  62           H        LEU  62  18.943   1.803  -1.289
  461    HA   LEU  62           HA       LEU  62  20.009  -0.612  -2.263
  462    HB2  LEU  62           HB2      LEU  62  17.683   0.892  -2.511
  463    HB3  LEU  62           HB3      LEU  62  18.355   0.835  -4.132
  464    HG   LEU  62           HG       LEU  62  18.643  -1.682  -3.511
  465   HD11  LEU  62          HD11      LEU  62  17.838  -1.516  -1.257
  466   HD12  LEU  62          HD12      LEU  62  16.755  -2.528  -2.210
  467   HD13  LEU  62          HD13      LEU  62  16.302  -0.866  -1.828
  468   HD21  LEU  62          HD21      LEU  62  16.509  -2.163  -4.620
  469   HD22  LEU  62          HD22      LEU  62  17.406  -0.878  -5.431
  470   HD23  LEU  62          HD23      LEU  62  16.037  -0.477  -4.395
  471    H    ASP  63           H        ASP  63  19.753   2.573  -3.740
  472    HA   ASP  63           HA       ASP  63  21.329   1.939  -6.004
  473    HB2  ASP  63           HB2      ASP  63  19.566   3.635  -6.036
  474    HB3  ASP  63           HB3      ASP  63  20.465   4.631  -4.903
  475    H    ARG  64           H        ARG  64  22.059   3.399  -2.897
  476    HA   ARG  64           HA       ARG  64  24.718   4.222  -3.550
  477    HB2  ARG  64           HB2      ARG  64  23.457   5.160  -1.650
  478    HB3  ARG  64           HB3      ARG  64  23.457   3.587  -0.870
  479    HG2  ARG  64           HG2      ARG  64  25.124   4.827   0.208
  480    HG3  ARG  64           HG3      ARG  64  25.985   3.735  -0.879
  481    HD2  ARG  64           HD2      ARG  64  26.334   5.499  -2.465
  482    HD3  ARG  64           HD3      ARG  64  25.306   6.594  -1.541
  483    HE   ARG  64           HE       ARG  64  27.566   5.573  -0.072
  484   HH11  ARG  64          HH11      ARG  64  26.413   8.088  -2.211
  485   HH12  ARG  64          HH12      ARG  64  27.602   9.246  -1.702
  486   HH21  ARG  64          HH21      ARG  64  29.140   7.087   0.602
  487   HH22  ARG  64          HH22      ARG  64  29.162   8.670  -0.108
  488    H    ASN  65           H        ASN  65  23.250   1.358  -2.182
  489    HA   ASN  65           HA       ASN  65  24.093  -0.544  -1.275
  490    HB2  ASN  65           HB2      ASN  65  25.155  -1.975  -2.971
  491    HB3  ASN  65           HB3      ASN  65  23.693  -1.176  -3.510
  492   HD21  ASN  65          HD21      ASN  65  27.101  -1.513  -3.943
  493   HD22  ASN  65          HD22      ASN  65  27.223  -0.585  -5.397
  494    HA   PRO  66           HA       PRO  66  28.282   0.650   0.132
  495    HB2  PRO  66           HB2      PRO  66  27.114   0.714   2.780
  496    HB3  PRO  66           HB3      PRO  66  27.893   2.025   1.894
  497    HG2  PRO  66           HG2      PRO  66  25.219   1.971   2.457
  498    HG3  PRO  66           HG3      PRO  66  25.906   2.817   1.065
  499    HD2  PRO  66           HD2      PRO  66  24.579   0.139   1.211
  500    HD3  PRO  66           HD3      PRO  66  24.407   1.422  -0.010
  501    H    HIS  67           H        HIS  67  25.991  -1.047   2.255
  502    HA   HIS  67           HA       HIS  67  27.245  -3.594   1.706
  503    HB2  HIS  67           HB2      HIS  67  27.685  -4.150   4.050
  504    HB3  HIS  67           HB3      HIS  67  28.621  -2.741   3.575
  505    HD1  HIS  67           HD1      HIS  67  26.183  -3.921   6.037
  506    HD2  HIS  67           HD2      HIS  67  27.600  -0.260   4.674
  507    HE1  HIS  67           HE1      HIS  67  25.492  -2.237   7.776
  508    HE2  HIS  67           HE2      HIS  67  26.342  -0.027   6.920
  509    H    TYR  68           H        TYR  68  24.812  -2.623   0.986
  510    HA   TYR  68           HA       TYR  68  22.894  -3.735   2.919
  511    HB2  TYR  68           HB2      TYR  68  22.611  -1.325   2.382
  512    HB3  TYR  68           HB3      TYR  68  22.377  -1.755   0.692
  513    HD1  TYR  68           HD1      TYR  68  20.963  -2.237   4.089
  514    HD2  TYR  68           HD2      TYR  68  20.243  -2.339  -0.103
  515    HE1  TYR  68           HE1      TYR  68  18.562  -2.528   4.514
  516    HE2  TYR  68           HE2      TYR  68  17.837  -2.632   0.315
  517    HH   TYR  68           HH       TYR  68  16.421  -2.120   3.338
  518    H    HIS  69           H        HIS  69  23.102  -3.211  -0.570
  519    HA   HIS  69           HA       HIS  69  22.722  -5.992  -1.159
  520    HB2  HIS  69           HB2      HIS  69  20.382  -5.090  -0.631
  521    HB3  HIS  69           HB3      HIS  69  20.540  -4.114  -2.087
  522    HD1  HIS  69           HD1      HIS  69  20.681  -5.454  -4.382
  523    HD2  HIS  69           HD2      HIS  69  19.698  -7.720  -1.039
  524    HE1  HIS  69           HE1      HIS  69  19.726  -7.595  -5.275
  525    HE2  HIS  69           HE2      HIS  69  18.982  -8.875  -3.242
  526    H    GLU  70           H        GLU  70  24.756  -5.403  -2.104
  527    HA   GLU  70           HA       GLU  70  24.955  -3.409  -4.120
  528    HB2  GLU  70           HB2      GLU  70  26.813  -5.705  -3.467
  529    HB3  GLU  70           HB3      GLU  70  27.197  -4.376  -4.543
  530    HG2  GLU  70           HG2      GLU  70  28.229  -4.067  -2.370
  531    HG3  GLU  70           HG3      GLU  70  27.045  -2.805  -2.688
  532    H    TYR  71           H        TYR  71  25.415  -6.925  -4.396
  533    HA   TYR  71           HA       TYR  71  23.425  -7.338  -6.308
  534    HB2  TYR  71           HB2      TYR  71  25.337  -5.971  -7.577
  535    HB3  TYR  71           HB3      TYR  71  26.050  -7.576  -7.709
  536    HD1  TYR  71           HD1      TYR  71  24.603  -9.430  -8.740
  537    HD2  TYR  71           HD2      TYR  71  23.660  -5.295  -9.048
  538    HE1  TYR  71           HE1      TYR  71  23.133  -9.912 -10.647
  539    HE2  TYR  71           HE2      TYR  71  22.190  -5.768 -10.958
  540    HH   TYR  71           HH       TYR  71  21.922  -7.514 -12.693
  541    H    HIS  72           H        HIS  72  23.167  -9.519  -6.718
  542    HA   HIS  72           HA       HIS  72  25.020 -11.281  -5.290
  543    HB2  HIS  72           HB2      HIS  72  22.197 -11.688  -6.269
  544    HB3  HIS  72           HB3      HIS  72  23.189 -13.005  -5.656
  545    HD1  HIS  72           HD1      HIS  72  23.763 -12.961  -3.102
  546    HD2  HIS  72           HD2      HIS  72  21.099 -10.027  -4.347
  547    HE1  HIS  72           HE1      HIS  72  22.694 -12.085  -1.003
  548    HE2  HIS  72           HE2      HIS  72  20.950 -10.455  -1.801
  549    H    THR  73           H        THR  73  26.525 -10.851  -7.106
  550    HA   THR  73           HA       THR  73  27.631 -11.422  -8.994
  551    HB   THR  73           HB       THR  73  27.628 -13.868  -9.549
  552    HG1  THR  73           HG1      THR  73  25.306 -13.872  -8.385
  553   HG21  THR  73          HG21      THR  73  27.945 -13.164  -6.633
  554   HG22  THR  73          HG22      THR  73  29.154 -12.913  -7.890
  555   HG23  THR  73          HG23      THR  73  28.669 -14.550  -7.450
  Start of MODEL    8
    1    H1   GLN  -1           H1       GLN  -1 -12.617  10.269   3.335
    2    H2   GLN  -1           H2       GLN  -1 -11.442  10.432   4.541
    3    H3   GLN  -1           H3       GLN  -1 -12.007   8.897   4.112
    4    HA   GLN  -1           HA       GLN  -1 -10.549  10.721   2.310
    5    HB2  GLN  -1           HB2      GLN  -1  -8.643   9.180   2.585
    6    HB3  GLN  -1           HB3      GLN  -1  -9.069   9.975   4.089
    7    HG2  GLN  -1           HG2      GLN  -1 -10.273   7.930   4.780
    8    HG3  GLN  -1           HG3      GLN  -1  -9.716   7.144   3.303
    9   HE21  GLN  -1          HE21      GLN  -1  -9.193   6.419   6.066
   10   HE22  GLN  -1          HE22      GLN  -1  -7.476   6.451   6.260
   11    H    SER   0           H        SER   0 -10.239   9.954   0.253
   12    HA   SER   0           HA       SER   0 -11.718   7.509  -0.434
   13    HB2  SER   0           HB2      SER   0 -12.303   8.793  -2.592
   14    HB3  SER   0           HB3      SER   0 -13.166   9.233  -1.118
   15    HG   SER   0           HG       SER   0 -11.125  10.617  -2.475
   16    H    MET   1           H        MET   1  -9.606   6.534  -0.315
   17    HA   MET   1           HA       MET   1  -7.668   7.288  -2.369
   18    HB2  MET   1           HB2      MET   1  -7.535   5.170  -0.211
   19    HB3  MET   1           HB3      MET   1  -6.208   5.656  -1.258
   20    HG2  MET   1           HG2      MET   1  -6.175   7.851  -0.275
   21    HG3  MET   1           HG3      MET   1  -7.608   7.480   0.682
   22    HE1  MET   1           HE1      MET   1  -7.091   4.544   1.670
   23    HE2  MET   1           HE2      MET   1  -7.663   5.849   2.710
   24    HE3  MET   1           HE3      MET   1  -6.302   4.849   3.217
   25    H    ALA   2           H        ALA   2  -6.806   5.662  -3.819
   26    HA   ALA   2           HA       ALA   2  -8.877   3.725  -4.584
   27    HB1  ALA   2           HB1      ALA   2  -6.815   5.095  -6.294
   28    HB2  ALA   2           HB2      ALA   2  -8.544   5.441  -6.255
   29    HB3  ALA   2           HB3      ALA   2  -7.968   3.890  -6.865
   30    H    LEU   3           H        LEU   3  -5.392   4.176  -4.772
   31    HA   LEU   3           HA       LEU   3  -5.047   1.270  -4.461
   32    HB2  LEU   3           HB2      LEU   3  -2.953   3.190  -5.441
   33    HB3  LEU   3           HB3      LEU   3  -2.838   1.475  -5.406
   34    HG   LEU   3           HG       LEU   3  -4.673   1.430  -7.143
   35   HD11  LEU   3          HD11      LEU   3  -5.488   3.663  -6.780
   36   HD12  LEU   3          HD12      LEU   3  -4.932   3.470  -8.444
   37   HD13  LEU   3          HD13      LEU   3  -3.933   4.324  -7.269
   38   HD21  LEU   3          HD21      LEU   3  -2.350   0.989  -7.696
   39   HD22  LEU   3          HD22      LEU   3  -2.029   2.720  -7.800
   40   HD23  LEU   3          HD23      LEU   3  -3.106   1.953  -8.966
   41    H    HIS   4           H        HIS   4  -3.299   0.573  -3.103
   42    HA   HIS   4           HA       HIS   4  -2.412   2.617  -1.178
   43    HB2  HIS   4           HB2      HIS   4  -3.564  -0.023  -0.676
   44    HB3  HIS   4           HB3      HIS   4  -2.134   0.332   0.246
   45    HD1  HIS   4           HD1      HIS   4  -5.620   0.477   0.664
   46    HD2  HIS   4           HD2      HIS   4  -2.524   3.151   1.435
   47    HE1  HIS   4           HE1      HIS   4  -6.488   2.031   2.430
   48    HE2  HIS   4           HE2      HIS   4  -4.546   3.529   3.000
   49    H    TYR   5           H        TYR   5  -0.414   2.899  -1.193
   50    HA   TYR   5           HA       TYR   5   1.414   0.947  -2.392
   51    HB2  TYR   5           HB2      TYR   5   1.635   3.896  -1.816
   52    HB3  TYR   5           HB3      TYR   5   3.065   2.921  -2.123
   53    HD1  TYR   5           HD1      TYR   5   3.932   3.198  -4.152
   54    HD2  TYR   5           HD2      TYR   5  -0.297   3.350  -3.805
   55    HE1  TYR   5           HE1      TYR   5   3.773   3.653  -6.534
   56    HE2  TYR   5           HE2      TYR   5  -0.484   3.807  -6.216
   57    HH   TYR   5           HH       TYR   5   2.145   3.433  -8.365
   58    H    TYR   6           H        TYR   6   2.461  -0.352  -1.026
   59    HA   TYR   6           HA       TYR   6   3.351   0.787   1.544
   60    HB2  TYR   6           HB2      TYR   6   2.400  -2.044   1.031
   61    HB3  TYR   6           HB3      TYR   6   3.126  -1.486   2.531
   62    HD1  TYR   6           HD1      TYR   6   0.082  -1.842   0.668
   63    HD2  TYR   6           HD2      TYR   6   1.901   0.354   3.835
   64    HE1  TYR   6           HE1      TYR   6  -2.135  -1.232   1.515
   65    HE2  TYR   6           HE2      TYR   6  -0.329   0.967   4.681
   66    HH   TYR   6           HH       TYR   6  -3.149  -0.541   3.681
   67    H    CYS   7           H        CYS   7   5.507   0.240   2.140
   68    HA   CYS   7           HA       CYS   7   7.021  -0.436  -0.229
   69    HB2  CYS   7           HB2      CYS   7   7.643   1.504   1.342
   70    HB3  CYS   7           HB3      CYS   7   8.327   0.269   2.381
   71    H    ARG   8           H        ARG   8   7.897  -2.229  -0.691
   72    HA   ARG   8           HA       ARG   8   7.959  -4.534   0.860
   73    HB2  ARG   8           HB2      ARG   8   9.923  -5.132  -0.727
   74    HB3  ARG   8           HB3      ARG   8   8.319  -4.898  -1.408
   75    HG2  ARG   8           HG2      ARG   8   8.879  -2.838  -2.345
   76    HG3  ARG   8           HG3      ARG   8  10.282  -2.639  -1.288
   77    HD2  ARG   8           HD2      ARG   8  10.120  -4.867  -3.290
   78    HD3  ARG   8           HD3      ARG   8  10.708  -3.265  -3.738
   79    HE   ARG   8           HE       ARG   8  12.427  -3.570  -1.981
   80   HH11  ARG   8          HH11      ARG   8  10.843  -6.382  -3.340
   81   HH12  ARG   8          HH12      ARG   8  12.148  -7.459  -2.968
   82   HH21  ARG   8          HH21      ARG   8  14.145  -4.989  -1.469
   83   HH22  ARG   8          HH22      ARG   8  14.026  -6.665  -1.898
   84    H    HIS   9           H        HIS   9   8.919  -4.778   2.722
   85    HA   HIS   9           HA       HIS   9  10.741  -5.443   3.964
   86    HB2  HIS   9           HB2      HIS   9  12.237  -5.457   2.034
   87    HB3  HIS   9           HB3      HIS   9  12.404  -3.708   2.125
   88    HD1  HIS   9           HD1      HIS   9  14.433  -2.945   3.301
   89    HD2  HIS   9           HD2      HIS   9  13.248  -6.718   4.574
   90    HE1  HIS   9           HE1      HIS   9  16.182  -3.679   4.944
   91    HE2  HIS   9           HE2      HIS   9  15.388  -5.914   5.785
   92    H    CYS  10           H        CYS  10  10.087  -2.110   3.185
   93    HA   CYS  10           HA       CYS  10  11.118  -1.260   5.788
   94    HB2  CYS  10           HB2      CYS  10   9.748   0.473   3.755
   95    HB3  CYS  10           HB3      CYS  10  10.810   0.980   5.056
   96    H    GLY  11           H        GLY  11   8.123  -1.786   4.073
   97    HA2  GLY  11           HA2      GLY  11   5.985  -2.064   4.876
   98    HA3  GLY  11           HA3      GLY  11   6.615  -1.819   6.513
   99    H    VAL  12           H        VAL  12   7.557   0.689   4.500
  100    HA   VAL  12           HA       VAL  12   5.885   2.497   5.909
  101    HB   VAL  12           HB       VAL  12   8.031   3.350   5.628
  102   HG11  VAL  12          HG11      VAL  12   7.862   3.001   2.650
  103   HG12  VAL  12          HG12      VAL  12   8.622   1.829   3.717
  104   HG13  VAL  12          HG13      VAL  12   9.267   3.460   3.610
  105   HG21  VAL  12          HG21      VAL  12   7.781   5.349   4.285
  106   HG22  VAL  12          HG22      VAL  12   6.314   5.021   5.213
  107   HG23  VAL  12          HG23      VAL  12   6.380   4.639   3.491
  108    H    LYS  13           H        LYS  13   4.237   3.718   5.235
  109    HA   LYS  13           HA       LYS  13   2.820   2.682   2.936
  110    HB2  LYS  13           HB2      LYS  13   1.968   4.878   4.825
  111    HB3  LYS  13           HB3      LYS  13   0.942   3.977   3.720
  112    HG2  LYS  13           HG2      LYS  13   1.386   1.934   4.993
  113    HG3  LYS  13           HG3      LYS  13   2.377   2.861   6.119
  114    HD2  LYS  13           HD2      LYS  13   0.448   4.207   6.731
  115    HD3  LYS  13           HD3      LYS  13  -0.550   3.339   5.564
  116    HE2  LYS  13           HE2      LYS  13  -0.111   1.248   6.813
  117    HE3  LYS  13           HE3      LYS  13   0.783   2.184   8.010
  118    HZ1  LYS  13           HZ1      LYS  13  -2.077   2.588   7.328
  119    HZ2  LYS  13           HZ2      LYS  13  -1.212   3.399   8.536
  120    HZ3  LYS  13           HZ3      LYS  13  -1.512   1.742   8.678
  121    H    VAL  14           H        VAL  14   3.691   3.377   1.113
  122    HA   VAL  14           HA       VAL  14   4.736   6.027   0.785
  123    HB   VAL  14           HB       VAL  14   4.265   4.667  -1.729
  124   HG11  VAL  14          HG11      VAL  14   5.928   6.436  -1.297
  125   HG12  VAL  14          HG12      VAL  14   6.631   4.990  -2.021
  126   HG13  VAL  14          HG13      VAL  14   6.836   5.300  -0.293
  127   HG21  VAL  14          HG21      VAL  14   4.303   2.579  -0.568
  128   HG22  VAL  14          HG22      VAL  14   5.697   3.075   0.396
  129   HG23  VAL  14          HG23      VAL  14   5.873   2.795  -1.336
  130    H    GLY  15           H        GLY  15   1.742   4.395   0.212
  131    HA2  GLY  15           HA2      GLY  15   0.629   6.888  -0.876
  132    HA3  GLY  15           HA3      GLY  15   0.327   5.370  -1.705
  133    H    SER  16           H        SER  16   0.008   6.897   1.468
  134    HA   SER  16           HA       SER  16  -2.787   6.128   1.469
  135    HB2  SER  16           HB2      SER  16  -1.474   4.349   2.738
  136    HB3  SER  16           HB3      SER  16  -1.097   5.598   3.920
  137    HG   SER  16           HG       SER  16  -3.400   5.893   4.148
  138    H    LEU  17           H        LEU  17  -1.355   8.507   1.029
  139    HA   LEU  17           HA       LEU  17  -2.611  10.372   2.682
  140    HB2  LEU  17           HB2      LEU  17  -0.844  11.234   4.035
  141    HB3  LEU  17           HB3      LEU  17  -0.953   9.515   4.340
  142    HG   LEU  17           HG       LEU  17   1.092  10.728   2.488
  143   HD11  LEU  17          HD11      LEU  17   2.686  10.477   4.316
  144   HD12  LEU  17          HD12      LEU  17   1.374   9.990   5.389
  145   HD13  LEU  17          HD13      LEU  17   1.406  11.620   4.720
  146   HD21  LEU  17          HD21      LEU  17   0.919   8.026   3.813
  147   HD22  LEU  17          HD22      LEU  17   2.267   8.603   2.836
  148   HD23  LEU  17          HD23      LEU  17   0.683   8.367   2.099
  149    H    GLU  18           H        GLU  18  -0.204   9.472   0.454
  150    HA   GLU  18           HA       GLU  18  -0.281  12.139  -0.779
  151    HB2  GLU  18           HB2      GLU  18   1.979  10.156  -0.633
  152    HB3  GLU  18           HB3      GLU  18   1.968  11.504  -1.760
  153    HG2  GLU  18           HG2      GLU  18   2.018  13.089  -0.001
  154    HG3  GLU  18           HG3      GLU  18   1.702  11.851   1.210
  155    H    SER  19           H        SER  19   1.215   9.334  -2.169
  156    HA   SER  19           HA       SER  19  -0.412   9.535  -4.533
  157    HB2  SER  19           HB2      SER  19   1.635   7.419  -3.847
  158    HB3  SER  19           HB3      SER  19   1.041   7.859  -5.446
  159    HG   SER  19           HG       SER  19   1.935  10.003  -4.972
  160    H    SER  20           H        SER  20  -2.454   9.069  -3.532
  161    HA   SER  20           HA       SER  20  -2.855   6.216  -2.929
  162    HB2  SER  20           HB2      SER  20  -4.523   8.287  -1.563
  163    HB3  SER  20           HB3      SER  20  -4.044   6.685  -1.005
  164    HG   SER  20           HG       SER  20  -2.912   9.034  -0.473
  165    H    MET  21           H        MET  21  -4.129   9.175  -4.294
  166    HA   MET  21           HA       MET  21  -6.505   7.707  -5.239
  167    HB2  MET  21           HB2      MET  21  -7.670   9.863  -5.290
  168    HB3  MET  21           HB3      MET  21  -7.057   9.492  -3.687
  169    HG2  MET  21           HG2      MET  21  -5.209  11.005  -3.988
  170    HG3  MET  21           HG3      MET  21  -5.710  11.324  -5.647
  171    HE1  MET  21           HE1      MET  21  -8.092  10.929  -2.522
  172    HE2  MET  21           HE2      MET  21  -8.170  12.596  -1.950
  173    HE3  MET  21           HE3      MET  21  -6.653  11.701  -1.855
  174    H    VAL  22           H        VAL  22  -3.643   8.592  -6.263
  175    HA   VAL  22           HA       VAL  22  -4.205   9.957  -8.695
  176    HB   VAL  22           HB       VAL  22  -1.993  10.136  -7.778
  177   HG11  VAL  22          HG11      VAL  22  -1.835   8.019  -6.603
  178   HG12  VAL  22          HG12      VAL  22  -0.437   8.244  -7.657
  179   HG13  VAL  22          HG13      VAL  22  -1.737   7.153  -8.138
  180   HG21  VAL  22          HG21      VAL  22  -0.623   9.548  -9.722
  181   HG22  VAL  22          HG22      VAL  22  -2.158  10.275 -10.198
  182   HG23  VAL  22          HG23      VAL  22  -1.928   8.531 -10.330
  183    H    SER  23           H        SER  23  -5.402   9.132 -10.226
  184    HA   SER  23           HA       SER  23  -6.445   7.735 -11.658
  185    HB2  SER  23           HB2      SER  23  -5.028   6.179 -12.916
  186    HB3  SER  23           HB3      SER  23  -4.213   7.721 -12.685
  187    HG   SER  23           HG       SER  23  -3.474   6.311 -10.645
  188    H    THR  24           H        THR  24  -6.519   5.083 -12.188
  189    HA   THR  24           HA       THR  24  -6.604   3.650  -9.658
  190    HB   THR  24           HB       THR  24  -8.871   4.563  -9.865
  191    HG1  THR  24           HG1      THR  24  -9.742   2.713  -9.230
  192   HG21  THR  24          HG21      THR  24 -10.367   3.836 -11.660
  193   HG22  THR  24          HG22      THR  24  -9.027   3.003 -12.447
  194   HG23  THR  24          HG23      THR  24  -9.009   4.759 -12.300
  195    H    ASP  25           H        ASP  25  -5.597   1.816  -9.916
  196    HA   ASP  25           HA       ASP  25  -5.464   0.588 -12.574
  197    HB2  ASP  25           HB2      ASP  25  -3.749   0.394 -10.127
  198    HB3  ASP  25           HB3      ASP  25  -3.743  -0.915 -11.304
  199    H    SER  26           H        SER  26  -7.326   0.516  -9.974
  200    HA   SER  26           HA       SER  26  -7.493  -2.227  -9.310
  201    HB2  SER  26           HB2      SER  26  -8.204  -0.504  -7.751
  202    HB3  SER  26           HB3      SER  26  -9.423   0.062  -8.884
  203    HG   SER  26           HG       SER  26  -9.440  -2.622  -8.030
  204    H    LEU  27           H        LEU  27 -10.094  -0.264 -10.720
  205    HA   LEU  27           HA       LEU  27 -11.820  -0.798 -12.083
  206    HB2  LEU  27           HB2      LEU  27  -9.528  -2.169 -13.437
  207    HB3  LEU  27           HB3      LEU  27 -11.149  -2.232 -14.103
  208    HG   LEU  27           HG       LEU  27 -11.069   0.351 -13.948
  209   HD11  LEU  27          HD11      LEU  27  -9.036   0.524 -12.630
  210   HD12  LEU  27          HD12      LEU  27  -8.837   1.299 -14.201
  211   HD13  LEU  27          HD13      LEU  27  -8.127  -0.288 -13.903
  212   HD21  LEU  27          HD21      LEU  27  -9.421  -1.172 -15.946
  213   HD22  LEU  27          HD22      LEU  27 -10.060   0.457 -16.165
  214   HD23  LEU  27          HD23      LEU  27 -11.163  -0.910 -16.003
  215    H    GLY  28           H        GLY  28 -12.996  -1.930 -10.520
  216    HA2  GLY  28           HA2      GLY  28 -12.716  -4.783 -10.226
  217    HA3  GLY  28           HA3      GLY  28 -13.986  -3.781  -9.533
  218    H    PHE  29           H        PHE  29 -12.860  -4.825 -12.731
  219    HA   PHE  29           HA       PHE  29 -15.646  -5.361 -13.496
  220    HB2  PHE  29           HB2      PHE  29 -13.603  -3.972 -15.239
  221    HB3  PHE  29           HB3      PHE  29 -15.268  -4.326 -15.664
  222    HD1  PHE  29           HD1      PHE  29 -17.033  -3.318 -13.925
  223    HD2  PHE  29           HD2      PHE  29 -13.097  -1.848 -14.584
  224    HE1  PHE  29           HE1      PHE  29 -17.703  -1.128 -13.029
  225    HE2  PHE  29           HE2      PHE  29 -13.758   0.344 -13.689
  226    HZ   PHE  29           HZ       PHE  29 -16.065   0.704 -12.907
  227    H    GLN  30           H        GLN  30 -15.857  -7.350 -14.272
  228    HA   GLN  30           HA       GLN  30 -13.578  -8.989 -14.874
  229    HB2  GLN  30           HB2      GLN  30 -16.517  -9.526 -15.369
  230    HB3  GLN  30           HB3      GLN  30 -15.231 -10.722 -15.427
  231    HG2  GLN  30           HG2      GLN  30 -15.696  -9.149 -12.938
  232    HG3  GLN  30           HG3      GLN  30 -16.730 -10.515 -13.328
  233   HE21  GLN  30          HE21      GLN  30 -13.352 -10.512 -14.220
  234   HE22  GLN  30          HE22      GLN  30 -12.850 -11.687 -13.061
  235    H    HIS  31           H        HIS  31 -16.398  -8.062 -16.850
  236    HA   HIS  31           HA       HIS  31 -14.538  -7.486 -19.045
  237    HB2  HIS  31           HB2      HIS  31 -16.935  -9.282 -19.161
  238    HB3  HIS  31           HB3      HIS  31 -16.441  -8.381 -20.590
  239    HD1  HIS  31           HD1      HIS  31 -14.282  -9.117 -21.775
  240    HD2  HIS  31           HD2      HIS  31 -15.180 -11.342 -18.378
  241    HE1  HIS  31           HE1      HIS  31 -12.736 -11.100 -21.832
  242    HE2  HIS  31           HE2      HIS  31 -13.198 -12.350 -19.695
  243    H    LEU  32           H        LEU  32 -15.398  -5.547 -17.450
  244    HA   LEU  32           HA       LEU  32 -17.429  -4.168 -19.073
  245    HB2  LEU  32           HB2      LEU  32 -16.837  -3.574 -16.172
  246    HB3  LEU  32           HB3      LEU  32 -18.084  -2.872 -17.152
  247    HG   LEU  32           HG       LEU  32 -19.086  -5.226 -17.299
  248   HD11  LEU  32          HD11      LEU  32 -17.312  -5.596 -14.900
  249   HD12  LEU  32          HD12      LEU  32 -17.104  -6.394 -16.457
  250   HD13  LEU  32          HD13      LEU  32 -18.539  -6.720 -15.484
  251   HD21  LEU  32          HD21      LEU  32 -20.198  -4.946 -15.118
  252   HD22  LEU  32          HD22      LEU  32 -20.113  -3.445 -16.038
  253   HD23  LEU  32          HD23      LEU  32 -19.005  -3.717 -14.693
  254    H    THR  33           H        THR  33 -17.091  -1.630 -18.320
  255    HA   THR  33           HA       THR  33 -14.259  -0.965 -18.503
  256    HB   THR  33           HB       THR  33 -15.113   0.720 -20.417
  257    HG1  THR  33           HG1      THR  33 -16.690  -1.637 -20.637
  258   HG21  THR  33          HG21      THR  33 -13.149  -0.707 -20.582
  259   HG22  THR  33          HG22      THR  33 -14.105  -0.792 -22.061
  260   HG23  THR  33          HG23      THR  33 -14.174  -2.108 -20.889
  261    H    ASN  34           H        ASN  34 -14.262   1.641 -18.958
  262    HA   ASN  34           HA       ASN  34 -15.216   2.821 -16.620
  263    HB2  ASN  34           HB2      ASN  34 -14.693   5.005 -17.773
  264    HB3  ASN  34           HB3      ASN  34 -13.375   3.850 -17.705
  265   HD21  ASN  34          HD21      ASN  34 -12.283   4.707 -19.413
  266   HD22  ASN  34          HD22      ASN  34 -12.844   4.614 -21.047
  267    H    GLU  35           H        GLU  35 -16.760   2.368 -19.698
  268    HA   GLU  35           HA       GLU  35 -18.844   4.249 -19.319
  269    HB2  GLU  35           HB2      GLU  35 -20.039   2.980 -21.079
  270    HB3  GLU  35           HB3      GLU  35 -18.397   3.418 -21.531
  271    HG2  GLU  35           HG2      GLU  35 -17.641   1.170 -21.007
  272    HG3  GLU  35           HG3      GLU  35 -19.276   0.738 -20.518
  273    H    GLU  36           H        GLU  36 -18.394   0.915 -18.325
  274    HA   GLU  36           HA       GLU  36 -21.066   0.642 -17.304
  275    HB2  GLU  36           HB2      GLU  36 -18.580  -1.008 -16.844
  276    HB3  GLU  36           HB3      GLU  36 -20.194  -1.446 -16.304
  277    HG2  GLU  36           HG2      GLU  36 -19.369  -1.064 -19.171
  278    HG3  GLU  36           HG3      GLU  36 -19.529  -2.614 -18.351
  279    H    ARG  37           H        ARG  37 -17.997   1.749 -16.157
  280    HA   ARG  37           HA       ARG  37 -18.356   1.517 -13.409
  281    HB2  ARG  37           HB2      ARG  37 -16.201   1.981 -14.477
  282    HB3  ARG  37           HB3      ARG  37 -16.787   3.561 -14.986
  283    HG2  ARG  37           HG2      ARG  37 -16.986   4.270 -12.724
  284    HG3  ARG  37           HG3      ARG  37 -16.545   2.671 -12.134
  285    HD2  ARG  37           HD2      ARG  37 -14.339   2.912 -13.188
  286    HD3  ARG  37           HD3      ARG  37 -14.785   4.529 -13.732
  287    HE   ARG  37           HE       ARG  37 -15.073   4.218 -10.906
  288   HH11  ARG  37          HH11      ARG  37 -12.707   4.756 -13.429
  289   HH12  ARG  37          HH12      ARG  37 -11.631   5.654 -12.401
  290   HH21  ARG  37          HH21      ARG  37 -13.652   5.398  -9.550
  291   HH22  ARG  37          HH22      ARG  37 -12.170   6.021 -10.205
  292    H    ASN  38           H        ASN  38 -19.256   4.104 -15.665
  293    HA   ASN  38           HA       ASN  38 -20.358   5.732 -13.559
  294    HB2  ASN  38           HB2      ASN  38 -20.620   5.928 -16.564
  295    HB3  ASN  38           HB3      ASN  38 -21.266   7.111 -15.432
  296   HD21  ASN  38          HD21      ASN  38 -19.324   7.495 -17.515
  297   HD22  ASN  38          HD22      ASN  38 -17.886   8.075 -16.748
  298    H    ASP  39           H        ASP  39 -21.455   3.186 -15.586
  299    HA   ASP  39           HA       ASP  39 -24.245   3.801 -15.467
  300    HB2  ASP  39           HB2      ASP  39 -23.508   2.561 -17.353
  301    HB3  ASP  39           HB3      ASP  39 -22.697   1.370 -16.345
  302    H    MET  40           H        MET  40 -22.308   1.174 -14.008
  303    HA   MET  40           HA       MET  40 -24.462   0.874 -12.015
  304    HB2  MET  40           HB2      MET  40 -24.174  -1.054 -13.560
  305    HB3  MET  40           HB3      MET  40 -22.529  -1.243 -12.969
  306    HG2  MET  40           HG2      MET  40 -23.996  -2.838 -11.909
  307    HG3  MET  40           HG3      MET  40 -23.394  -1.680 -10.723
  308    HE1  MET  40           HE1      MET  40 -26.960  -2.437  -9.344
  309    HE2  MET  40           HE2      MET  40 -25.237  -2.359  -8.978
  310    HE3  MET  40           HE3      MET  40 -25.845  -3.572 -10.105
  311    H    ILE  41           H        ILE  41 -21.155   1.515 -12.530
  312    HA   ILE  41           HA       ILE  41 -19.502   2.208 -11.141
  313    HB   ILE  41           HB       ILE  41 -21.451   1.738  -8.879
  314   HG12  ILE  41          HG12      ILE  41 -20.597   4.284 -10.279
  315   HG13  ILE  41          HG13      ILE  41 -22.159   3.495 -10.455
  316   HG21  ILE  41          HG21      ILE  41 -19.915   3.135  -7.550
  317   HG22  ILE  41          HG22      ILE  41 -18.774   3.125  -8.895
  318   HG23  ILE  41          HG23      ILE  41 -19.173   1.623  -8.067
  319   HD11  ILE  41          HD11      ILE  41 -21.065   4.712  -7.931
  320   HD12  ILE  41          HD12      ILE  41 -22.626   3.910  -8.094
  321   HD13  ILE  41          HD13      ILE  41 -22.307   5.403  -8.975
  322    H    SER  42           H        SER  42 -21.267  -0.605  -9.924
  323    HA   SER  42           HA       SER  42 -20.651  -2.768  -9.711
  324    HB2  SER  42           HB2      SER  42 -17.961  -1.908 -10.785
  325    HB3  SER  42           HB3      SER  42 -18.512  -3.573 -10.597
  326    HG   SER  42           HG       SER  42 -20.034  -3.248 -12.167
  327    H    TYR  43           H        TYR  43 -18.921  -0.255  -8.221
  328    HA   TYR  43           HA       TYR  43 -18.133   0.030  -6.123
  329    HB2  TYR  43           HB2      TYR  43 -19.976  -1.279  -5.272
  330    HB3  TYR  43           HB3      TYR  43 -19.166  -2.781  -5.694
  331    HD1  TYR  43           HD1      TYR  43 -18.576   0.281  -3.622
  332    HD2  TYR  43           HD2      TYR  43 -18.086  -3.925  -4.013
  333    HE1  TYR  43           HE1      TYR  43 -17.574   0.194  -1.378
  334    HE2  TYR  43           HE2      TYR  43 -17.080  -4.025  -1.773
  335    HH   TYR  43           HH       TYR  43 -15.977  -2.611  -0.185
  336    H    LYS  44           H        LYS  44 -16.176  -0.142  -5.122
  337    HA   LYS  44           HA       LYS  44 -14.106  -1.611  -6.432
  338    HB2  LYS  44           HB2      LYS  44 -14.094  -0.118  -3.800
  339    HB3  LYS  44           HB3      LYS  44 -12.667  -0.736  -4.616
  340    HG2  LYS  44           HG2      LYS  44 -13.002   0.780  -6.454
  341    HG3  LYS  44           HG3      LYS  44 -14.532   1.329  -5.764
  342    HD2  LYS  44           HD2      LYS  44 -12.802   2.944  -5.277
  343    HD3  LYS  44           HD3      LYS  44 -13.306   2.152  -3.783
  344    HE2  LYS  44           HE2      LYS  44 -11.341   0.590  -4.109
  345    HE3  LYS  44           HE3      LYS  44 -10.798   1.684  -5.379
  346    HZ1  LYS  44           HZ1      LYS  44 -10.797   3.480  -3.710
  347    HZ2  LYS  44           HZ2      LYS  44  -9.719   2.235  -3.328
  348    HZ3  LYS  44           HZ3      LYS  44 -11.192   2.350  -2.518
  349    H    GLU  45           H        GLU  45 -14.629  -3.779  -6.282
  350    HA   GLU  45           HA       GLU  45 -15.595  -5.084  -4.015
  351    HB2  GLU  45           HB2      GLU  45 -15.634  -5.949  -6.358
  352    HB3  GLU  45           HB3      GLU  45 -13.931  -6.323  -6.209
  353    HG2  GLU  45           HG2      GLU  45 -14.518  -7.776  -4.303
  354    HG3  GLU  45           HG3      GLU  45 -16.213  -7.496  -4.660
  355    H    ASN  46           H        ASN  46 -12.258  -4.655  -5.150
  356    HA   ASN  46           HA       ASN  46 -11.189  -6.177  -2.939
  357    HB2  ASN  46           HB2      ASN  46  -9.872  -4.484  -5.069
  358    HB3  ASN  46           HB3      ASN  46  -8.972  -5.301  -3.799
  359   HD21  ASN  46          HD21      ASN  46  -7.845  -6.509  -5.300
  360   HD22  ASN  46          HD22      ASN  46  -8.568  -7.830  -6.152
  361    H    GLY  47           H        GLY  47 -12.040  -2.921  -3.598
  362    HA2  GLY  47           HA2      GLY  47 -12.169  -1.100  -2.193
  363    HA3  GLY  47           HA3      GLY  47 -11.554  -2.122  -0.891
  364    H    ASP  48           H        ASP  48  -9.129  -2.864  -2.286
  365    HA   ASP  48           HA       ASP  48  -7.675  -0.322  -2.245
  366    HB2  ASP  48           HB2      ASP  48  -6.925  -3.013  -1.099
  367    HB3  ASP  48           HB3      ASP  48  -5.843  -1.647  -1.212
  368    H    VAL  49           H        VAL  49  -5.648  -0.364  -3.434
  369    HA   VAL  49           HA       VAL  49  -5.326  -2.659  -5.223
  370    HB   VAL  49           HB       VAL  49  -4.261   0.091  -5.779
  371   HG11  VAL  49          HG11      VAL  49  -2.968  -1.738  -6.760
  372   HG12  VAL  49          HG12      VAL  49  -3.809  -0.815  -8.005
  373   HG13  VAL  49          HG13      VAL  49  -4.433  -2.384  -7.494
  374   HG21  VAL  49          HG21      VAL  49  -6.715  -1.305  -6.819
  375   HG22  VAL  49          HG22      VAL  49  -6.005   0.117  -7.579
  376   HG23  VAL  49          HG23      VAL  49  -6.643   0.222  -5.937
  377    H    HIS  50           H        HIS  50  -3.884  -3.936  -4.369
  378    HA   HIS  50           HA       HIS  50  -1.966  -3.030  -2.456
  379    HB2  HIS  50           HB2      HIS  50  -3.155  -5.251  -2.419
  380    HB3  HIS  50           HB3      HIS  50  -2.166  -5.734  -3.788
  381    HD1  HIS  50           HD1      HIS  50  -0.631  -7.432  -2.853
  382    HD2  HIS  50           HD2      HIS  50  -0.916  -4.076  -0.417
  383    HE1  HIS  50           HE1      HIS  50   1.013  -7.807  -0.988
  384    HE2  HIS  50           HE2      HIS  50   0.709  -5.836   0.555
  385    H    VAL  51           H        VAL  51  -0.600  -1.622  -3.502
  386    HA   VAL  51           HA       VAL  51   1.165  -2.833  -5.524
  387    HB   VAL  51           HB       VAL  51   1.757  -0.372  -6.032
  388   HG11  VAL  51          HG11      VAL  51  -0.194  -0.115  -7.530
  389   HG12  VAL  51          HG12      VAL  51  -0.936  -1.510  -6.740
  390   HG13  VAL  51          HG13      VAL  51   0.574  -1.701  -7.635
  391   HG21  VAL  51          HG21      VAL  51  -0.069   1.209  -5.624
  392   HG22  VAL  51          HG22      VAL  51   0.672   0.640  -4.130
  393   HG23  VAL  51          HG23      VAL  51  -0.885  -0.009  -4.643
  394    H    LEU  52           H        LEU  52   3.174  -3.181  -4.930
  395    HA   LEU  52           HA       LEU  52   4.180  -1.815  -2.528
  396    HB2  LEU  52           HB2      LEU  52   5.151  -4.430  -3.686
  397    HB3  LEU  52           HB3      LEU  52   5.628  -3.713  -2.156
  398    HG   LEU  52           HG       LEU  52   2.927  -4.874  -2.842
  399   HD11  LEU  52          HD11      LEU  52   4.672  -6.518  -2.367
  400   HD12  LEU  52          HD12      LEU  52   3.447  -6.483  -1.098
  401   HD13  LEU  52          HD13      LEU  52   5.012  -5.714  -0.835
  402   HD21  LEU  52          HD21      LEU  52   2.294  -4.366  -0.543
  403   HD22  LEU  52          HD22      LEU  52   2.653  -2.896  -1.448
  404   HD23  LEU  52          HD23      LEU  52   3.829  -3.534  -0.298
  405    H    THR  53           H        THR  53   5.987  -0.619  -2.686
  406    HA   THR  53           HA       THR  53   7.607  -0.768  -5.118
  407    HB   THR  53           HB       THR  53   5.881   0.933  -5.577
  408    HG1  THR  53           HG1      THR  53   7.308   2.313  -6.414
  409   HG21  THR  53          HG21      THR  53   6.935   2.212  -3.060
  410   HG22  THR  53          HG22      THR  53   5.279   1.699  -3.398
  411   HG23  THR  53          HG23      THR  53   5.973   3.076  -4.256
  412    H    ILE  54           H        ILE  54   9.534   0.824  -4.858
  413    HA   ILE  54           HA       ILE  54  10.572   0.487  -2.145
  414    HB   ILE  54           HB       ILE  54  11.794   0.465  -4.810
  415   HG12  ILE  54          HG12      ILE  54  12.803  -0.505  -2.136
  416   HG13  ILE  54          HG13      ILE  54  11.695  -1.406  -3.155
  417   HG21  ILE  54          HG21      ILE  54  12.722   2.603  -4.103
  418   HG22  ILE  54          HG22      ILE  54  13.967   1.354  -4.122
  419   HG23  ILE  54          HG23      ILE  54  13.267   1.878  -2.590
  420   HD11  ILE  54          HD11      ILE  54  14.505  -0.601  -3.850
  421   HD12  ILE  54          HD12      ILE  54  13.399  -1.462  -4.919
  422   HD13  ILE  54          HD13      ILE  54  13.948  -2.220  -3.426
  423    H    CYS  55           H        CYS  55  10.718   2.102  -0.818
  424    HA   CYS  55           HA       CYS  55  10.059   4.787  -1.655
  425    HB2  CYS  55           HB2      CYS  55   9.794   5.293   0.673
  426    HB3  CYS  55           HB3      CYS  55   9.054   3.724   0.386
  427    H    GLU  56           H        GLU  56  11.354   6.397   0.080
  428    HA   GLU  56           HA       GLU  56  13.776   6.919  -1.199
  429    HB2  GLU  56           HB2      GLU  56  12.337   8.533   0.071
  430    HB3  GLU  56           HB3      GLU  56  12.950   7.828   1.559
  431    HG2  GLU  56           HG2      GLU  56  14.141   9.838   1.113
  432    HG3  GLU  56           HG3      GLU  56  15.234   8.475   0.874
  433    H    ASP  57           H        ASP  57  13.201   5.599   2.058
  434    HA   ASP  57           HA       ASP  57  15.797   5.507   2.976
  435    HB2  ASP  57           HB2      ASP  57  14.028   5.116   4.510
  436    HB3  ASP  57           HB3      ASP  57  13.440   3.733   3.590
  437    H    CYS  58           H        CYS  58  14.090   2.913   1.236
  438    HA   CYS  58           HA       CYS  58  16.301   1.125   1.482
  439    HB2  CYS  58           HB2      CYS  58  14.917  -0.210  -0.235
  440    HB3  CYS  58           HB3      CYS  58  14.240   0.040   1.372
  441    H    GLN  59           H        GLN  59  14.911   2.913  -1.286
  442    HA   GLN  59           HA       GLN  59  16.622   2.292  -3.282
  443    HB2  GLN  59           HB2      GLN  59  14.684   3.788  -3.509
  444    HB3  GLN  59           HB3      GLN  59  15.568   5.044  -2.673
  445    HG2  GLN  59           HG2      GLN  59  16.591   3.817  -5.216
  446    HG3  GLN  59           HG3      GLN  59  15.433   5.130  -5.234
  447   HE21  GLN  59          HE21      GLN  59  16.538   6.647  -3.056
  448   HE22  GLN  59          HE22      GLN  59  18.046   7.277  -3.591
  449    H    GLU  60           H        GLU  60  17.314   4.359  -0.526
  450    HA   GLU  60           HA       GLU  60  19.648   5.476  -1.630
  451    HB2  GLU  60           HB2      GLU  60  18.186   6.162   0.417
  452    HB3  GLU  60           HB3      GLU  60  19.272   5.140   1.310
  453    HG2  GLU  60           HG2      GLU  60  21.128   6.455   0.517
  454    HG3  GLU  60           HG3      GLU  60  20.035   7.519  -0.347
  455    H    ALA  61           H        ALA  61  19.163   2.988   0.832
  456    HA   ALA  61           HA       ALA  61  21.766   1.984   0.998
  457    HB1  ALA  61           HB1      ALA  61  19.149   0.492   1.208
  458    HB2  ALA  61           HB2      ALA  61  19.941   1.368   2.518
  459    HB3  ALA  61           HB3      ALA  61  20.708  -0.060   1.824
  460    H    LEU  62           H        LEU  62  19.248   1.620  -1.253
  461    HA   LEU  62           HA       LEU  62  20.030  -0.671  -2.714
  462    HB2  LEU  62           HB2      LEU  62  18.216   1.585  -2.861
  463    HB3  LEU  62           HB3      LEU  62  18.751   1.087  -4.438
  464    HG   LEU  62           HG       LEU  62  16.553   0.175  -3.551
  465   HD11  LEU  62          HD11      LEU  62  16.885  -1.993  -4.567
  466   HD12  LEU  62          HD12      LEU  62  18.631  -1.759  -4.498
  467   HD13  LEU  62          HD13      LEU  62  17.635  -0.706  -5.506
  468   HD21  LEU  62          HD21      LEU  62  18.412  -1.572  -1.954
  469   HD22  LEU  62          HD22      LEU  62  16.682  -1.839  -2.167
  470   HD23  LEU  62          HD23      LEU  62  17.256  -0.408  -1.306
  471    H    ASP  63           H        ASP  63  20.186   2.722  -3.625
  472    HA   ASP  63           HA       ASP  63  21.986   2.476  -5.742
  473    HB2  ASP  63           HB2      ASP  63  20.757   4.478  -5.621
  474    HB3  ASP  63           HB3      ASP  63  21.223   4.781  -3.953
  475    H    ARG  64           H        ARG  64  22.598   3.197  -2.320
  476    HA   ARG  64           HA       ARG  64  24.248   2.510  -0.959
  477    HB2  ARG  64           HB2      ARG  64  24.068   0.431  -2.361
  478    HB3  ARG  64           HB3      ARG  64  25.412   1.040  -3.318
  479    HG2  ARG  64           HG2      ARG  64  26.766   1.108  -1.260
  480    HG3  ARG  64           HG3      ARG  64  25.439   0.334  -0.398
  481    HD2  ARG  64           HD2      ARG  64  27.070  -1.331  -1.061
  482    HD3  ARG  64           HD3      ARG  64  25.563  -1.572  -1.939
  483    HE   ARG  64           HE       ARG  64  27.632  -0.023  -3.281
  484   HH11  ARG  64          HH11      ARG  64  25.987  -3.087  -2.901
  485   HH12  ARG  64          HH12      ARG  64  26.556  -3.727  -4.406
  486   HH21  ARG  64          HH21      ARG  64  28.397  -0.878  -5.275
  487   HH22  ARG  64          HH22      ARG  64  27.916  -2.477  -5.754
  488    H    ASN  65           H        ASN  65  24.677   4.676  -3.342
  489    HA   ASN  65           HA       ASN  65  27.554   4.833  -3.243
  490    HB2  ASN  65           HB2      ASN  65  26.326   5.404  -5.307
  491    HB3  ASN  65           HB3      ASN  65  25.624   6.793  -4.489
  492   HD21  ASN  65          HD21      ASN  65  28.503   5.416  -5.832
  493   HD22  ASN  65          HD22      ASN  65  29.434   6.874  -5.860
  494    HA   PRO  66           HA       PRO  66  26.659   8.889  -0.764
  495    HB2  PRO  66           HB2      PRO  66  24.059   8.448   0.517
  496    HB3  PRO  66           HB3      PRO  66  24.638   9.857  -0.374
  497    HG2  PRO  66           HG2      PRO  66  22.740   8.215  -1.358
  498    HG3  PRO  66           HG3      PRO  66  23.913   9.041  -2.399
  499    HD2  PRO  66           HD2      PRO  66  23.893   6.202  -1.445
  500    HD3  PRO  66           HD3      PRO  66  24.300   6.849  -3.042
  501    H    HIS  67           H        HIS  67  24.684   6.354   0.778
  502    HA   HIS  67           HA       HIS  67  26.755   5.440   2.448
  503    HB2  HIS  67           HB2      HIS  67  26.082   6.228   4.595
  504    HB3  HIS  67           HB3      HIS  67  26.183   7.650   3.570
  505    HD1  HIS  67           HD1      HIS  67  24.025   6.030   5.939
  506    HD2  HIS  67           HD2      HIS  67  23.471   8.450   2.607
  507    HE1  HIS  67           HE1      HIS  67  21.692   6.942   6.148
  508    HE2  HIS  67           HE2      HIS  67  21.298   8.173   3.984
  509    H    TYR  68           H        TYR  68  26.110   3.623   3.634
  510    HA   TYR  68           HA       TYR  68  23.341   2.772   3.587
  511    HB2  TYR  68           HB2      TYR  68  23.679   0.760   2.345
  512    HB3  TYR  68           HB3      TYR  68  24.368   2.052   1.374
  513    HD1  TYR  68           HD1      TYR  68  24.909  -1.158   2.684
  514    HD2  TYR  68           HD2      TYR  68  26.969   2.435   1.719
  515    HE1  TYR  68           HE1      TYR  68  27.019  -2.410   2.564
  516    HE2  TYR  68           HE2      TYR  68  29.089   1.192   1.598
  517    HH   TYR  68           HH       TYR  68  30.055  -0.906   2.484
  518    H    HIS  69           H        HIS  69  23.239   0.497   4.696
  519    HA   HIS  69           HA       HIS  69  24.825   0.662   7.085
  520    HB2  HIS  69           HB2      HIS  69  22.620  -1.139   6.161
  521    HB3  HIS  69           HB3      HIS  69  23.624  -1.632   7.522
  522    HD1  HIS  69           HD1      HIS  69  21.955  -1.335   9.395
  523    HD2  HIS  69           HD2      HIS  69  22.319   2.043   7.000
  524    HE1  HIS  69           HE1      HIS  69  20.660   0.471  10.568
  525    HE2  HIS  69           HE2      HIS  69  20.745   2.448   9.009
  526    H    GLU  70           H        GLU  70  26.889   0.429   6.424
  527    HA   GLU  70           HA       GLU  70  27.872  -1.640   4.781
  528    HB2  GLU  70           HB2      GLU  70  30.109  -0.910   5.698
  529    HB3  GLU  70           HB3      GLU  70  29.149   0.348   4.931
  530    HG2  GLU  70           HG2      GLU  70  28.469   1.195   7.092
  531    HG3  GLU  70           HG3      GLU  70  29.322  -0.116   7.900
  532    H    TYR  71           H        TYR  71  26.967  -1.629   8.049
  533    HA   TYR  71           HA       TYR  71  28.623  -3.960   8.645
  534    HB2  TYR  71           HB2      TYR  71  28.362  -2.030  10.269
  535    HB3  TYR  71           HB3      TYR  71  26.699  -2.560  10.498
  536    HD1  TYR  71           HD1      TYR  71  30.202  -3.732  10.707
  537    HD2  TYR  71           HD2      TYR  71  26.206  -4.215  12.064
  538    HE1  TYR  71           HE1      TYR  71  30.978  -5.352  12.397
  539    HE2  TYR  71           HE2      TYR  71  26.961  -5.833  13.756
  540    HH   TYR  71           HH       TYR  71  30.223  -6.249  14.564
  541    H    HIS  72           H        HIS  72  25.429  -3.081   7.775
  542    HA   HIS  72           HA       HIS  72  24.581  -5.874   7.933
  543    HB2  HIS  72           HB2      HIS  72  23.756  -4.666   9.981
  544    HB3  HIS  72           HB3      HIS  72  22.857  -3.588   8.920
  545    HD1  HIS  72           HD1      HIS  72  20.856  -4.690   7.558
  546    HD2  HIS  72           HD2      HIS  72  22.554  -7.074  10.512
  547    HE1  HIS  72           HE1      HIS  72  19.206  -6.544   7.971
  548    HE2  HIS  72           HE2      HIS  72  20.301  -8.027   9.687
  549    H    THR  73           H        THR  73  24.983  -5.706   5.654
  550    HA   THR  73           HA       THR  73  23.482  -3.754   4.128
  551    HB   THR  73           HB       THR  73  25.253  -5.953   3.056
  552    HG1  THR  73           HG1      THR  73  25.869  -3.628   4.452
  553   HG21  THR  73          HG21      THR  73  23.843  -4.749   1.422
  554   HG22  THR  73          HG22      THR  73  25.560  -4.431   1.177
  555   HG23  THR  73          HG23      THR  73  24.544  -3.224   1.965
  Start of MODEL    9
    1    H1   GLN  -1           H1       GLN  -1  -8.279  16.082  -1.747
    2    H2   GLN  -1           H2       GLN  -1  -7.218  15.819  -3.033
    3    H3   GLN  -1           H3       GLN  -1  -6.791  16.885  -1.794
    4    HA   GLN  -1           HA       GLN  -1  -5.618  14.799  -1.565
    5    HB2  GLN  -1           HB2      GLN  -1  -7.764  15.223   0.525
    6    HB3  GLN  -1           HB3      GLN  -1  -6.300  14.278   0.753
    7    HG2  GLN  -1           HG2      GLN  -1  -4.943  16.269   0.440
    8    HG3  GLN  -1           HG3      GLN  -1  -6.397  17.227   0.159
    9   HE21  GLN  -1          HE21      GLN  -1  -4.319  17.453   2.229
   10   HE22  GLN  -1          HE22      GLN  -1  -5.162  17.381   3.737
   11    H    SER   0           H        SER   0  -5.653  12.807  -2.341
   12    HA   SER   0           HA       SER   0  -7.705  10.941  -1.749
   13    HB2  SER   0           HB2      SER   0  -8.861  12.282  -3.518
   14    HB3  SER   0           HB3      SER   0  -7.571  11.848  -4.639
   15    HG   SER   0           HG       SER   0  -9.630  10.524  -4.525
   16    H    MET   1           H        MET   1  -7.317   8.870  -3.081
   17    HA   MET   1           HA       MET   1  -4.491   8.617  -3.812
   18    HB2  MET   1           HB2      MET   1  -4.357   6.505  -2.483
   19    HB3  MET   1           HB3      MET   1  -4.506   7.957  -1.510
   20    HG2  MET   1           HG2      MET   1  -6.874   7.514  -1.183
   21    HG3  MET   1           HG3      MET   1  -6.751   6.078  -2.194
   22    HE1  MET   1           HE1      MET   1  -7.930   4.720  -0.155
   23    HE2  MET   1           HE2      MET   1  -7.963   6.229   0.756
   24    HE3  MET   1           HE3      MET   1  -7.310   4.768   1.495
   25    H    ALA   2           H        ALA   2  -4.020   6.870  -5.124
   26    HA   ALA   2           HA       ALA   2  -6.317   5.906  -6.652
   27    HB1  ALA   2           HB1      ALA   2  -4.514   7.108  -7.852
   28    HB2  ALA   2           HB2      ALA   2  -4.763   5.465  -8.442
   29    HB3  ALA   2           HB3      ALA   2  -3.396   5.826  -7.387
   30    H    LEU   3           H        LEU   3  -3.176   4.679  -5.696
   31    HA   LEU   3           HA       LEU   3  -4.400   2.092  -5.039
   32    HB2  LEU   3           HB2      LEU   3  -1.754   2.580  -6.413
   33    HB3  LEU   3           HB3      LEU   3  -2.199   1.043  -5.701
   34    HG   LEU   3           HG       LEU   3  -4.188   1.039  -7.288
   35   HD11  LEU   3          HD11      LEU   3  -4.161   3.396  -7.858
   36   HD12  LEU   3          HD12      LEU   3  -3.967   2.394  -9.298
   37   HD13  LEU   3          HD13      LEU   3  -2.570   3.208  -8.595
   38   HD21  LEU   3          HD21      LEU   3  -2.226  -0.364  -7.594
   39   HD22  LEU   3          HD22      LEU   3  -1.405   0.952  -8.433
   40   HD23  LEU   3          HD23      LEU   3  -2.837   0.211  -9.145
   41    H    HIS   4           H        HIS   4  -3.289   0.901  -3.375
   42    HA   HIS   4           HA       HIS   4  -2.118   2.734  -1.417
   43    HB2  HIS   4           HB2      HIS   4  -2.926  -0.159  -1.191
   44    HB3  HIS   4           HB3      HIS   4  -2.211   0.749   0.115
   45    HD1  HIS   4           HD1      HIS   4  -5.382  -0.273  -1.147
   46    HD2  HIS   4           HD2      HIS   4  -3.955   3.098   0.817
   47    HE1  HIS   4           HE1      HIS   4  -7.409   0.845  -0.177
   48    HE2  HIS   4           HE2      HIS   4  -6.489   2.747   1.196
   49    H    TYR   5           H        TYR   5  -0.050   2.915  -1.193
   50    HA   TYR   5           HA       TYR   5   1.732   1.026  -2.552
   51    HB2  TYR   5           HB2      TYR   5   1.991   3.888  -1.694
   52    HB3  TYR   5           HB3      TYR   5   3.440   2.909  -1.915
   53    HD1  TYR   5           HD1      TYR   5   0.537   2.422  -4.133
   54    HD2  TYR   5           HD2      TYR   5   4.259   4.394  -3.585
   55    HE1  TYR   5           HE1      TYR   5   0.556   3.031  -6.510
   56    HE2  TYR   5           HE2      TYR   5   4.306   4.997  -5.952
   57    HH   TYR   5           HH       TYR   5   1.606   4.810  -7.953
   58    H    TYR   6           H        TYR   6   2.586  -0.496  -1.300
   59    HA   TYR   6           HA       TYR   6   3.359   0.293   1.422
   60    HB2  TYR   6           HB2      TYR   6   2.380  -2.371   0.417
   61    HB3  TYR   6           HB3      TYR   6   3.161  -2.165   1.984
   62    HD1  TYR   6           HD1      TYR   6   0.091  -1.871   0.133
   63    HD2  TYR   6           HD2      TYR   6   2.104  -0.586   3.656
   64    HE1  TYR   6           HE1      TYR   6  -2.059  -1.203   1.116
   65    HE2  TYR   6           HE2      TYR   6  -0.047   0.072   4.650
   66    HH   TYR   6           HH       TYR   6  -3.033  -0.856   3.320
   67    H    CYS   7           H        CYS   7   5.424   0.042   2.006
   68    HA   CYS   7           HA       CYS   7   7.170  -0.246  -0.254
   69    HB2  CYS   7           HB2      CYS   7   7.105   1.370   1.943
   70    HB3  CYS   7           HB3      CYS   7   8.450   0.337   2.297
   71    H    ARG   8           H        ARG   8   8.100  -1.940  -0.841
   72    HA   ARG   8           HA       ARG   8   7.989  -4.443   0.284
   73    HB2  ARG   8           HB2      ARG   8   8.495  -4.176  -2.028
   74    HB3  ARG   8           HB3      ARG   8   9.916  -3.208  -1.679
   75    HG2  ARG   8           HG2      ARG   8  10.320  -5.689  -0.418
   76    HG3  ARG   8           HG3      ARG   8   9.694  -6.033  -2.036
   77    HD2  ARG   8           HD2      ARG   8  12.108  -5.907  -2.107
   78    HD3  ARG   8           HD3      ARG   8  11.421  -4.551  -2.992
   79    HE   ARG   8           HE       ARG   8  11.888  -3.217  -0.931
   80   HH11  ARG   8          HH11      ARG   8  13.740  -6.102  -1.646
   81   HH12  ARG   8          HH12      ARG   8  15.117  -5.603  -0.718
   82   HH21  ARG   8          HH21      ARG   8  13.698  -2.559   0.300
   83   HH22  ARG   8          HH22      ARG   8  15.097  -3.577   0.381
   84    H    HIS   9           H        HIS   9   8.719  -4.986   2.244
   85    HA   HIS   9           HA       HIS   9  10.233  -5.690   3.815
   86    HB2  HIS   9           HB2      HIS   9  11.452  -6.545   1.821
   87    HB3  HIS   9           HB3      HIS   9  12.293  -5.008   1.689
   88    HD1  HIS   9           HD1      HIS   9  12.135  -8.117   3.798
   89    HD2  HIS   9           HD2      HIS   9  14.482  -4.715   3.375
   90    HE1  HIS   9           HE1      HIS   9  14.185  -8.528   5.193
   91    HE2  HIS   9           HE2      HIS   9  15.658  -6.532   4.782
   92    H    CYS  10           H        CYS  10   9.356  -2.903   3.542
   93    HA   CYS  10           HA       CYS  10  11.645  -1.548   4.774
   94    HB2  CYS  10           HB2      CYS  10  11.565  -0.930   2.484
   95    HB3  CYS  10           HB3      CYS  10   9.846  -0.644   2.552
   96    H    GLY  11           H        GLY  11   8.158  -1.958   4.608
   97    HA2  GLY  11           HA2      GLY  11   6.772  -1.962   6.460
   98    HA3  GLY  11           HA3      GLY  11   8.101  -1.301   7.415
   99    H    VAL  12           H        VAL  12   7.686   0.638   4.727
  100    HA   VAL  12           HA       VAL  12   6.044   2.480   6.301
  101    HB   VAL  12           HB       VAL  12   8.117   3.519   5.943
  102   HG11  VAL  12          HG11      VAL  12   9.231   3.667   3.783
  103   HG12  VAL  12          HG12      VAL  12   7.930   2.736   3.045
  104   HG13  VAL  12          HG13      VAL  12   8.979   1.983   4.247
  105   HG21  VAL  12          HG21      VAL  12   6.371   4.484   3.706
  106   HG22  VAL  12          HG22      VAL  12   7.673   5.385   4.482
  107   HG23  VAL  12          HG23      VAL  12   6.223   4.973   5.396
  108    H    LYS  13           H        LYS  13   4.347   3.561   5.386
  109    HA   LYS  13           HA       LYS  13   3.216   2.283   3.011
  110    HB2  LYS  13           HB2      LYS  13   1.893   4.203   4.929
  111    HB3  LYS  13           HB3      LYS  13   1.101   3.202   3.719
  112    HG2  LYS  13           HG2      LYS  13   1.759   1.194   4.925
  113    HG3  LYS  13           HG3      LYS  13   2.588   2.182   6.129
  114    HD2  LYS  13           HD2      LYS  13  -0.362   2.313   5.514
  115    HD3  LYS  13           HD3      LYS  13   0.351   1.434   6.867
  116    HE2  LYS  13           HE2      LYS  13   0.528   4.408   6.386
  117    HE3  LYS  13           HE3      LYS  13  -0.501   3.611   7.574
  118    HZ1  LYS  13           HZ1      LYS  13   2.469   3.566   7.546
  119    HZ2  LYS  13           HZ2      LYS  13   1.489   2.786   8.680
  120    HZ3  LYS  13           HZ3      LYS  13   1.503   4.474   8.594
  121    H    VAL  14           H        VAL  14   3.670   3.234   1.169
  122    HA   VAL  14           HA       VAL  14   4.167   6.123   1.121
  123    HB   VAL  14           HB       VAL  14   4.700   5.030  -1.428
  124   HG11  VAL  14          HG11      VAL  14   5.835   6.918  -0.332
  125   HG12  VAL  14          HG12      VAL  14   6.977   5.717  -0.939
  126   HG13  VAL  14          HG13      VAL  14   6.604   5.787   0.783
  127   HG21  VAL  14          HG21      VAL  14   4.755   2.808  -0.433
  128   HG22  VAL  14          HG22      VAL  14   5.898   3.368   0.789
  129   HG23  VAL  14          HG23      VAL  14   6.376   3.311  -0.910
  130    H    GLY  15           H        GLY  15   1.575   4.416   1.017
  131    HA2  GLY  15           HA2      GLY  15   0.300   4.818  -1.438
  132    HA3  GLY  15           HA3      GLY  15  -0.512   4.678   0.115
  133    H    SER  16           H        SER  16   0.316   6.855   1.464
  134    HA   SER  16           HA       SER  16   0.161   9.104   1.729
  135    HB2  SER  16           HB2      SER  16   1.880   9.153  -0.050
  136    HB3  SER  16           HB3      SER  16   0.608   9.187  -1.269
  137    HG   SER  16           HG       SER  16   1.717  11.238  -0.084
  138    H    LEU  17           H        LEU  17  -0.985  11.114   0.552
  139    HA   LEU  17           HA       LEU  17  -3.726  10.320  -0.196
  140    HB2  LEU  17           HB2      LEU  17  -4.500  12.328   1.040
  141    HB3  LEU  17           HB3      LEU  17  -3.782  11.107   2.072
  142    HG   LEU  17           HG       LEU  17  -1.933  13.200   1.127
  143   HD11  LEU  17          HD11      LEU  17  -2.721  14.793   2.823
  144   HD12  LEU  17          HD12      LEU  17  -4.154  13.794   3.065
  145   HD13  LEU  17          HD13      LEU  17  -3.867  14.564   1.505
  146   HD21  LEU  17          HD21      LEU  17  -1.247  11.453   2.690
  147   HD22  LEU  17          HD22      LEU  17  -2.496  11.971   3.822
  148   HD23  LEU  17          HD23      LEU  17  -1.154  13.049   3.437
  149    H    GLU  18           H        GLU  18  -0.933  11.809  -1.017
  150    HA   GLU  18           HA       GLU  18  -2.155  13.775  -2.819
  151    HB2  GLU  18           HB2      GLU  18   0.773  13.239  -2.284
  152    HB3  GLU  18           HB3      GLU  18   0.095  14.616  -3.140
  153    HG2  GLU  18           HG2      GLU  18  -0.466  14.025  -0.250
  154    HG3  GLU  18           HG3      GLU  18   0.853  15.055  -0.798
  155    H    SER  19           H        SER  19  -1.453  10.584  -2.853
  156    HA   SER  19           HA       SER  19   0.210  10.212  -5.085
  157    HB2  SER  19           HB2      SER  19  -0.799   7.871  -5.050
  158    HB3  SER  19           HB3      SER  19  -0.012   8.419  -3.574
  159    HG   SER  19           HG       SER  19  -1.830   7.880  -2.681
  160    H    SER  20           H        SER  20  -3.187  10.796  -4.838
  161    HA   SER  20           HA       SER  20  -4.084   9.750  -7.258
  162    HB2  SER  20           HB2      SER  20  -5.860  11.599  -7.051
  163    HB3  SER  20           HB3      SER  20  -5.738  10.431  -5.733
  164    HG   SER  20           HG       SER  20  -4.926  11.927  -4.444
  165    H    MET  21           H        MET  21  -2.136  12.581  -6.697
  166    HA   MET  21           HA       MET  21  -2.717  13.524  -9.428
  167    HB2  MET  21           HB2      MET  21  -1.789  15.675  -8.784
  168    HB3  MET  21           HB3      MET  21  -3.045  15.211  -7.647
  169    HG2  MET  21           HG2      MET  21  -1.378  14.548  -6.028
  170    HG3  MET  21           HG3      MET  21  -0.090  14.901  -7.179
  171    HE1  MET  21           HE1      MET  21  -3.381  17.022  -6.619
  172    HE2  MET  21           HE2      MET  21  -2.845  18.146  -5.371
  173    HE3  MET  21           HE3      MET  21  -2.993  16.428  -5.004
  174    H    VAL  22           H        VAL  22  -0.479  11.939  -7.502
  175    HA   VAL  22           HA       VAL  22   1.811  12.660  -9.136
  176    HB   VAL  22           HB       VAL  22   1.668  10.845  -6.729
  177   HG11  VAL  22          HG11      VAL  22   4.083  11.161  -6.621
  178   HG12  VAL  22          HG12      VAL  22   4.023  12.099  -8.114
  179   HG13  VAL  22          HG13      VAL  22   3.586  10.391  -8.125
  180   HG21  VAL  22          HG21      VAL  22   1.018  13.127  -6.167
  181   HG22  VAL  22          HG22      VAL  22   2.503  13.737  -6.899
  182   HG23  VAL  22          HG23      VAL  22   2.581  12.717  -5.462
  183    H    SER  23           H        SER  23  -0.412  10.118  -8.591
  184    HA   SER  23           HA       SER  23   0.986   8.416 -10.542
  185    HB2  SER  23           HB2      SER  23   0.976   7.450  -8.251
  186    HB3  SER  23           HB3      SER  23  -0.783   7.522  -8.261
  187    HG   SER  23           HG       SER  23   0.468   6.182 -10.376
  188    H    THR  24           H        THR  24  -0.057   8.782 -12.376
  189    HA   THR  24           HA       THR  24  -2.982   8.808 -12.428
  190    HB   THR  24           HB       THR  24  -2.521   9.348 -14.927
  191    HG1  THR  24           HG1      THR  24  -0.059  10.307 -13.921
  192   HG21  THR  24          HG21      THR  24  -1.783  11.324 -12.764
  193   HG22  THR  24          HG22      THR  24  -3.414  10.974 -13.341
  194   HG23  THR  24          HG23      THR  24  -2.241  11.734 -14.417
  195    H    ASP  25           H        ASP  25  -1.953   6.420 -11.751
  196    HA   ASP  25           HA       ASP  25  -1.710   4.790 -14.160
  197    HB2  ASP  25           HB2      ASP  25  -1.120   4.146 -11.260
  198    HB3  ASP  25           HB3      ASP  25  -0.946   3.007 -12.590
  199    H    SER  26           H        SER  26  -3.089   4.351 -10.930
  200    HA   SER  26           HA       SER  26  -5.176   3.933 -10.187
  201    HB2  SER  26           HB2      SER  26  -6.125   5.594 -11.503
  202    HB3  SER  26           HB3      SER  26  -5.792   4.738 -13.004
  203    HG   SER  26           HG       SER  26  -7.547   3.645 -11.074
  204    H    LEU  27           H        LEU  27  -4.653   2.353 -13.344
  205    HA   LEU  27           HA       LEU  27  -6.132   0.020 -12.615
  206    HB2  LEU  27           HB2      LEU  27  -4.268   0.691 -14.860
  207    HB3  LEU  27           HB3      LEU  27  -4.809  -0.957 -14.618
  208    HG   LEU  27           HG       LEU  27  -7.192   0.047 -14.681
  209   HD11  LEU  27          HD11      LEU  27  -6.533   2.378 -14.529
  210   HD12  LEU  27          HD12      LEU  27  -7.410   2.056 -16.023
  211   HD13  LEU  27          HD13      LEU  27  -5.657   2.239 -16.052
  212   HD21  LEU  27          HD21      LEU  27  -5.497  -0.046 -17.165
  213   HD22  LEU  27          HD22      LEU  27  -7.256  -0.173 -17.095
  214   HD23  LEU  27          HD23      LEU  27  -6.249  -1.427 -16.368
  215    H    GLY  28           H        GLY  28  -5.492  -1.324 -11.074
  216    HA2  GLY  28           HA2      GLY  28  -2.684  -1.619 -10.408
  217    HA3  GLY  28           HA3      GLY  28  -4.036  -2.383  -9.586
  218    H    PHE  29           H        PHE  29  -2.894  -2.419 -12.941
  219    HA   PHE  29           HA       PHE  29  -2.703  -5.328 -12.805
  220    HB2  PHE  29           HB2      PHE  29  -3.929  -3.781 -15.100
  221    HB3  PHE  29           HB3      PHE  29  -3.768  -5.528 -14.974
  222    HD1  PHE  29           HD1      PHE  29  -5.144  -6.787 -13.386
  223    HD2  PHE  29           HD2      PHE  29  -5.719  -2.631 -14.060
  224    HE1  PHE  29           HE1      PHE  29  -7.370  -6.926 -12.355
  225    HE2  PHE  29           HE2      PHE  29  -7.937  -2.757 -13.032
  226    HZ   PHE  29           HZ       PHE  29  -8.771  -4.915 -12.171
  227    H    GLN  30           H        GLN  30  -1.182  -6.194 -14.173
  228    HA   GLN  30           HA       GLN  30   0.721  -4.238 -15.294
  229    HB2  GLN  30           HB2      GLN  30   2.572  -5.742 -14.655
  230    HB3  GLN  30           HB3      GLN  30   1.668  -5.171 -13.263
  231    HG2  GLN  30           HG2      GLN  30   0.540  -7.288 -13.067
  232    HG3  GLN  30           HG3      GLN  30   1.305  -7.876 -14.541
  233   HE21  GLN  30          HE21      GLN  30   2.269  -9.627 -13.477
  234   HE22  GLN  30          HE22      GLN  30   3.597  -9.419 -12.385
  235    H    HIS  31           H        HIS  31  -0.643  -7.457 -15.510
  236    HA   HIS  31           HA       HIS  31  -0.175  -7.409 -18.392
  237    HB2  HIS  31           HB2      HIS  31   1.680  -8.734 -17.341
  238    HB3  HIS  31           HB3      HIS  31   0.470  -9.829 -16.684
  239    HD1  HIS  31           HD1      HIS  31   2.451  -9.136 -19.683
  240    HD2  HIS  31           HD2      HIS  31  -0.935 -11.344 -18.717
  241    HE1  HIS  31           HE1      HIS  31   2.080 -10.688 -21.625
  242    HE2  HIS  31           HE2      HIS  31  -0.084 -11.865 -21.102
  243    H    LEU  32           H        LEU  32  -2.211  -7.400 -19.086
  244    HA   LEU  32           HA       LEU  32  -4.060  -9.420 -18.136
  245    HB2  LEU  32           HB2      LEU  32  -5.748  -7.911 -17.399
  246    HB3  LEU  32           HB3      LEU  32  -4.280  -7.476 -16.577
  247    HG   LEU  32           HG       LEU  32  -5.220  -6.000 -19.025
  248   HD11  LEU  32          HD11      LEU  32  -6.974  -5.957 -17.285
  249   HD12  LEU  32          HD12      LEU  32  -6.255  -4.375 -17.572
  250   HD13  LEU  32          HD13      LEU  32  -5.797  -5.308 -16.145
  251   HD21  LEU  32          HD21      LEU  32  -3.838  -4.203 -18.085
  252   HD22  LEU  32          HD22      LEU  32  -2.894  -5.651 -18.424
  253   HD23  LEU  32          HD23      LEU  32  -3.361  -5.269 -16.769
  254    H    THR  33           H        THR  33  -5.958  -9.596 -19.521
  255    HA   THR  33           HA       THR  33  -5.997  -8.095 -21.983
  256    HB   THR  33           HB       THR  33  -5.110 -10.974 -21.967
  257    HG1  THR  33           HG1      THR  33  -3.773  -8.787 -22.121
  258   HG21  THR  33          HG21      THR  33  -6.140  -9.410 -24.334
  259   HG22  THR  33          HG22      THR  33  -6.976 -10.747 -23.539
  260   HG23  THR  33          HG23      THR  33  -5.447 -11.034 -24.376
  261    H    ASN  34           H        ASN  34  -7.050 -11.436 -21.317
  262    HA   ASN  34           HA       ASN  34  -9.692 -10.915 -22.248
  263    HB2  ASN  34           HB2      ASN  34  -8.609 -13.235 -20.621
  264    HB3  ASN  34           HB3      ASN  34 -10.204 -13.187 -21.363
  265   HD21  ASN  34          HD21      ASN  34  -7.909 -14.986 -21.775
  266   HD22  ASN  34          HD22      ASN  34  -7.581 -14.923 -23.472
  267    H    GLU  35           H        GLU  35  -8.040 -10.841 -19.261
  268    HA   GLU  35           HA       GLU  35 -10.300 -10.573 -17.524
  269    HB2  GLU  35           HB2      GLU  35  -7.571  -9.420 -16.985
  270    HB3  GLU  35           HB3      GLU  35  -8.719 -10.099 -15.839
  271    HG2  GLU  35           HG2      GLU  35  -8.314 -12.316 -16.758
  272    HG3  GLU  35           HG3      GLU  35  -7.155 -11.639 -17.888
  273    H    GLU  36           H        GLU  36  -8.089  -8.467 -19.165
  274    HA   GLU  36           HA       GLU  36  -8.761  -5.970 -18.216
  275    HB2  GLU  36           HB2      GLU  36  -6.858  -6.443 -19.683
  276    HB3  GLU  36           HB3      GLU  36  -7.946  -6.753 -21.019
  277    HG2  GLU  36           HG2      GLU  36  -8.703  -4.411 -20.908
  278    HG3  GLU  36           HG3      GLU  36  -7.538  -4.119 -19.617
  279    H    ARG  37           H        ARG  37 -10.438  -7.935 -20.583
  280    HA   ARG  37           HA       ARG  37 -12.076  -5.934 -21.679
  281    HB2  ARG  37           HB2      ARG  37 -12.608  -8.894 -21.371
  282    HB3  ARG  37           HB3      ARG  37 -13.517  -7.805 -22.415
  283    HG2  ARG  37           HG2      ARG  37 -11.552  -7.362 -23.737
  284    HG3  ARG  37           HG3      ARG  37 -10.563  -8.329 -22.649
  285    HD2  ARG  37           HD2      ARG  37 -11.910 -10.311 -23.249
  286    HD3  ARG  37           HD3      ARG  37 -12.808  -9.320 -24.397
  287    HE   ARG  37           HE       ARG  37 -10.161  -8.985 -25.056
  288   HH11  ARG  37          HH11      ARG  37 -12.404 -11.661 -24.871
  289   HH12  ARG  37          HH12      ARG  37 -11.564 -12.613 -26.049
  290   HH21  ARG  37          HH21      ARG  37  -9.058 -10.233 -26.618
  291   HH22  ARG  37          HH22      ARG  37  -9.661 -11.803 -27.041
  292    H    ASN  38           H        ASN  38 -12.478  -7.969 -18.820
  293    HA   ASN  38           HA       ASN  38 -15.041  -6.803 -18.179
  294    HB2  ASN  38           HB2      ASN  38 -14.443  -9.133 -17.516
  295    HB3  ASN  38           HB3      ASN  38 -13.233  -8.473 -16.420
  296   HD21  ASN  38          HD21      ASN  38 -13.878  -7.552 -14.496
  297   HD22  ASN  38          HD22      ASN  38 -15.507  -7.623 -13.918
  298    H    ASP  39           H        ASP  39 -11.700  -6.490 -17.087
  299    HA   ASP  39           HA       ASP  39 -12.306  -4.780 -14.888
  300    HB2  ASP  39           HB2      ASP  39  -9.706  -5.494 -16.239
  301    HB3  ASP  39           HB3      ASP  39  -9.798  -4.431 -14.840
  302    H    MET  40           H        MET  40 -12.159  -4.136 -18.183
  303    HA   MET  40           HA       MET  40 -10.753  -1.705 -18.264
  304    HB2  MET  40           HB2      MET  40 -11.822  -1.320 -20.419
  305    HB3  MET  40           HB3      MET  40 -11.301  -2.993 -20.283
  306    HG2  MET  40           HG2      MET  40 -13.546  -3.719 -19.859
  307    HG3  MET  40           HG3      MET  40 -14.115  -2.053 -19.791
  308    HE1  MET  40           HE1      MET  40 -13.904  -0.875 -23.467
  309    HE2  MET  40           HE2      MET  40 -12.702  -0.620 -22.205
  310    HE3  MET  40           HE3      MET  40 -14.418  -0.496 -21.824
  311    H    ILE  41           H        ILE  41 -13.823  -2.384 -16.950
  312    HA   ILE  41           HA       ILE  41 -14.878   0.288 -17.357
  313    HB   ILE  41           HB       ILE  41 -16.031  -1.889 -15.604
  314   HG12  ILE  41          HG12      ILE  41 -16.518  -1.355 -18.545
  315   HG13  ILE  41          HG13      ILE  41 -15.678  -2.752 -17.881
  316   HG21  ILE  41          HG21      ILE  41 -16.964   0.333 -15.249
  317   HG22  ILE  41          HG22      ILE  41 -18.148  -0.726 -16.018
  318   HG23  ILE  41          HG23      ILE  41 -17.293   0.483 -16.975
  319   HD11  ILE  41          HD11      ILE  41 -17.948  -3.310 -18.527
  320   HD12  ILE  41          HD12      ILE  41 -18.575  -2.062 -17.449
  321   HD13  ILE  41          HD13      ILE  41 -17.737  -3.464 -16.783
  322    H    SER  42           H        SER  42 -12.431   0.311 -16.044
  323    HA   SER  42           HA       SER  42 -11.328   1.154 -14.251
  324    HB2  SER  42           HB2      SER  42 -14.033   2.419 -13.872
  325    HB3  SER  42           HB3      SER  42 -12.631   2.823 -12.890
  326    HG   SER  42           HG       SER  42 -13.192   3.426 -15.547
  327    H    TYR  43           H        TYR  43 -12.731  -1.407 -13.936
  328    HA   TYR  43           HA       TYR  43 -13.262  -1.410 -11.056
  329    HB2  TYR  43           HB2      TYR  43 -15.026  -2.374 -12.352
  330    HB3  TYR  43           HB3      TYR  43 -13.893  -3.348 -13.269
  331    HD1  TYR  43           HD1      TYR  43 -13.131  -5.476 -12.412
  332    HD2  TYR  43           HD2      TYR  43 -15.562  -2.944 -10.012
  333    HE1  TYR  43           HE1      TYR  43 -13.503  -7.330 -10.842
  334    HE2  TYR  43           HE2      TYR  43 -15.937  -4.790  -8.433
  335    HH   TYR  43           HH       TYR  43 -14.128  -7.682  -8.513
  336    H    LYS  44           H        LYS  44 -12.131  -2.755  -9.673
  337    HA   LYS  44           HA       LYS  44  -9.635  -3.839 -10.777
  338    HB2  LYS  44           HB2      LYS  44  -8.802  -3.604  -8.396
  339    HB3  LYS  44           HB3      LYS  44  -9.089  -2.106  -9.267
  340    HG2  LYS  44           HG2      LYS  44 -11.332  -2.012  -8.133
  341    HG3  LYS  44           HG3      LYS  44 -10.788  -3.350  -7.122
  342    HD2  LYS  44           HD2      LYS  44  -8.934  -2.012  -6.308
  343    HD3  LYS  44           HD3      LYS  44  -9.397  -0.685  -7.376
  344    HE2  LYS  44           HE2      LYS  44 -10.952  -1.783  -5.040
  345    HE3  LYS  44           HE3      LYS  44 -10.185  -0.201  -5.162
  346    HZ1  LYS  44           HZ1      LYS  44 -12.533  -1.177  -6.688
  347    HZ2  LYS  44           HZ2      LYS  44 -11.725   0.267  -7.040
  348    HZ3  LYS  44           HZ3      LYS  44 -12.496   0.072  -5.548
  349    H    GLU  45           H        GLU  45  -9.808  -5.948 -11.076
  350    HA   GLU  45           HA       GLU  45 -11.561  -7.731  -9.904
  351    HB2  GLU  45           HB2      GLU  45 -10.234  -8.228 -11.900
  352    HB3  GLU  45           HB3      GLU  45  -8.774  -8.289 -10.938
  353    HG2  GLU  45           HG2      GLU  45  -9.784 -10.166  -9.698
  354    HG3  GLU  45           HG3      GLU  45 -11.119 -10.157 -10.836
  355    H    ASN  46           H        ASN  46  -8.565  -6.496  -8.662
  356    HA   ASN  46           HA       ASN  46  -8.068  -8.525  -6.742
  357    HB2  ASN  46           HB2      ASN  46  -7.144  -5.644  -6.788
  358    HB3  ASN  46           HB3      ASN  46  -6.490  -6.905  -5.751
  359   HD21  ASN  46          HD21      ASN  46  -6.622  -8.958  -7.805
  360   HD22  ASN  46          HD22      ASN  46  -5.355  -8.604  -8.924
  361    H    GLY  47           H        GLY  47 -10.341  -5.997  -6.859
  362    HA2  GLY  47           HA2      GLY  47 -12.040  -5.525  -5.340
  363    HA3  GLY  47           HA3      GLY  47 -11.236  -6.567  -4.160
  364    H    ASP  48           H        ASP  48  -8.690  -5.298  -4.313
  365    HA   ASP  48           HA       ASP  48  -9.177  -2.524  -3.542
  366    HB2  ASP  48           HB2      ASP  48  -9.247  -3.781  -1.435
  367    HB3  ASP  48           HB3      ASP  48  -7.697  -4.522  -1.812
  368    H    VAL  49           H        VAL  49  -7.176  -1.286  -3.466
  369    HA   VAL  49           HA       VAL  49  -5.410  -2.228  -5.590
  370    HB   VAL  49           HB       VAL  49  -4.676   0.270  -5.523
  371   HG11  VAL  49          HG11      VAL  49  -5.871  -0.748  -7.377
  372   HG12  VAL  49          HG12      VAL  49  -6.506   0.863  -7.053
  373   HG13  VAL  49          HG13      VAL  49  -7.397  -0.560  -6.516
  374   HG21  VAL  49          HG21      VAL  49  -7.402   0.492  -4.237
  375   HG22  VAL  49          HG22      VAL  49  -6.389   1.825  -4.768
  376   HG23  VAL  49          HG23      VAL  49  -5.874   0.813  -3.418
  377    H    HIS  50           H        HIS  50  -3.860  -3.411  -4.650
  378    HA   HIS  50           HA       HIS  50  -2.283  -2.180  -2.489
  379    HB2  HIS  50           HB2      HIS  50  -3.624  -4.180  -1.792
  380    HB3  HIS  50           HB3      HIS  50  -2.736  -5.137  -2.968
  381    HD1  HIS  50           HD1      HIS  50  -2.674  -4.063   0.482
  382    HD2  HIS  50           HD2      HIS  50   0.142  -5.285  -2.320
  383    HE1  HIS  50           HE1      HIS  50  -0.636  -4.704   1.805
  384    HE2  HIS  50           HE2      HIS  50   0.953  -5.665   0.104
  385    H    VAL  51           H        VAL  51  -0.362  -1.564  -3.243
  386    HA   VAL  51           HA       VAL  51   1.040  -3.328  -5.130
  387    HB   VAL  51           HB       VAL  51   1.991  -1.206  -6.177
  388   HG11  VAL  51          HG11      VAL  51   0.412  -2.618  -7.364
  389   HG12  VAL  51          HG12      VAL  51   0.066  -0.913  -7.670
  390   HG13  VAL  51          HG13      VAL  51  -0.933  -1.827  -6.537
  391   HG21  VAL  51          HG21      VAL  51   1.287   0.395  -4.537
  392   HG22  VAL  51          HG22      VAL  51  -0.402  -0.026  -4.816
  393   HG23  VAL  51          HG23      VAL  51   0.533   0.755  -6.090
  394    H    LEU  52           H        LEU  52   3.241  -3.445  -4.905
  395    HA   LEU  52           HA       LEU  52   4.328  -2.265  -2.440
  396    HB2  LEU  52           HB2      LEU  52   5.328  -4.622  -4.041
  397    HB3  LEU  52           HB3      LEU  52   5.998  -4.052  -2.523
  398    HG   LEU  52           HG       LEU  52   3.233  -5.214  -2.888
  399   HD11  LEU  52          HD11      LEU  52   5.035  -6.853  -3.140
  400   HD12  LEU  52          HD12      LEU  52   4.104  -7.118  -1.667
  401   HD13  LEU  52          HD13      LEU  52   5.693  -6.358  -1.580
  402   HD21  LEU  52          HD21      LEU  52   3.156  -5.192  -0.437
  403   HD22  LEU  52          HD22      LEU  52   3.292  -3.564  -1.102
  404   HD23  LEU  52          HD23      LEU  52   4.705  -4.352  -0.402
  405    H    THR  53           H        THR  53   6.149  -1.008  -2.484
  406    HA   THR  53           HA       THR  53   7.612  -0.682  -4.979
  407    HB   THR  53           HB       THR  53   5.673   0.874  -5.131
  408    HG1  THR  53           HG1      THR  53   7.194   1.793  -6.290
  409   HG21  THR  53          HG21      THR  53   5.349   1.398  -2.797
  410   HG22  THR  53          HG22      THR  53   5.681   2.885  -3.687
  411   HG23  THR  53          HG23      THR  53   6.946   2.141  -2.708
  412    H    ILE  54           H        ILE  54   9.091   1.518  -4.427
  413    HA   ILE  54           HA       ILE  54  10.314   1.038  -1.803
  414    HB   ILE  54           HB       ILE  54  11.543   0.636  -4.459
  415   HG12  ILE  54          HG12      ILE  54  12.275  -0.357  -1.699
  416   HG13  ILE  54          HG13      ILE  54  11.156  -1.145  -2.785
  417   HG21  ILE  54          HG21      ILE  54  12.720   2.666  -3.805
  418   HG22  ILE  54          HG22      ILE  54  13.789   1.264  -3.761
  419   HG23  ILE  54          HG23      ILE  54  13.143   1.928  -2.260
  420   HD11  ILE  54          HD11      ILE  54  12.943  -1.523  -4.385
  421   HD12  ILE  54          HD12      ILE  54  13.341  -2.207  -2.808
  422   HD13  ILE  54          HD13      ILE  54  14.074  -0.685  -3.320
  423    H    CYS  55           H        CYS  55  10.126   2.869  -0.749
  424    HA   CYS  55           HA       CYS  55  10.039   5.451  -1.924
  425    HB2  CYS  55           HB2      CYS  55   9.971   6.306   0.334
  426    HB3  CYS  55           HB3      CYS  55   8.957   4.870   0.253
  427    H    GLU  56           H        GLU  56  11.558   7.145  -0.583
  428    HA   GLU  56           HA       GLU  56  14.003   7.031  -1.918
  429    HB2  GLU  56           HB2      GLU  56  13.168   8.687   0.464
  430    HB3  GLU  56           HB3      GLU  56  14.639   8.949  -0.452
  431    HG2  GLU  56           HG2      GLU  56  12.966  10.524  -1.138
  432    HG3  GLU  56           HG3      GLU  56  13.291   9.400  -2.455
  433    H    ASP  57           H        ASP  57  13.207   6.328   1.463
  434    HA   ASP  57           HA       ASP  57  15.813   6.165   2.448
  435    HB2  ASP  57           HB2      ASP  57  13.970   6.346   3.970
  436    HB3  ASP  57           HB3      ASP  57  13.280   4.828   3.400
  437    H    CYS  58           H        CYS  58  13.732   3.502   1.276
  438    HA   CYS  58           HA       CYS  58  15.780   1.552   1.757
  439    HB2  CYS  58           HB2      CYS  58  14.228   0.039   0.428
  440    HB3  CYS  58           HB3      CYS  58  13.560   0.738   1.898
  441    H    GLN  59           H        GLN  59  14.504   3.206  -1.095
  442    HA   GLN  59           HA       GLN  59  16.129   2.236  -3.079
  443    HB2  GLN  59           HB2      GLN  59  14.405   3.887  -3.520
  444    HB3  GLN  59           HB3      GLN  59  15.261   5.090  -2.573
  445    HG2  GLN  59           HG2      GLN  59  16.799   3.967  -4.797
  446    HG3  GLN  59           HG3      GLN  59  15.368   4.868  -5.272
  447   HE21  GLN  59          HE21      GLN  59  18.525   5.035  -3.895
  448   HE22  GLN  59          HE22      GLN  59  18.644   6.761  -3.871
  449    H    GLU  60           H        GLU  60  16.978   4.405  -0.456
  450    HA   GLU  60           HA       GLU  60  19.443   5.248  -1.523
  451    HB2  GLU  60           HB2      GLU  60  17.941   5.493   0.978
  452    HB3  GLU  60           HB3      GLU  60  19.668   5.518   1.174
  453    HG2  GLU  60           HG2      GLU  60  18.463   7.226  -0.881
  454    HG3  GLU  60           HG3      GLU  60  18.325   7.717   0.800
  455    H    ALA  61           H        ALA  61  18.564   2.724   0.790
  456    HA   ALA  61           HA       ALA  61  21.212   1.848   1.329
  457    HB1  ALA  61           HB1      ALA  61  18.628   0.290   1.519
  458    HB2  ALA  61           HB2      ALA  61  19.291   1.319   2.789
  459    HB3  ALA  61           HB3      ALA  61  20.162  -0.127   2.282
  460    H    LEU  62           H        LEU  62  18.828   1.243  -1.034
  461    HA   LEU  62           HA       LEU  62  19.881  -1.031  -2.299
  462    HB2  LEU  62           HB2      LEU  62  17.688   0.716  -2.467
  463    HB3  LEU  62           HB3      LEU  62  18.445   0.736  -4.047
  464    HG   LEU  62           HG       LEU  62  18.413  -1.834  -3.735
  465   HD11  LEU  62          HD11      LEU  62  16.208  -0.963  -1.894
  466   HD12  LEU  62          HD12      LEU  62  17.647  -1.887  -1.460
  467   HD13  LEU  62          HD13      LEU  62  16.418  -2.603  -2.505
  468   HD21  LEU  62          HD21      LEU  62  17.251  -0.702  -5.520
  469   HD22  LEU  62          HD22      LEU  62  15.963  -0.229  -4.413
  470   HD23  LEU  62          HD23      LEU  62  16.194  -1.929  -4.821
  471    H    ASP  63           H        ASP  63  19.846   2.337  -3.285
  472    HA   ASP  63           HA       ASP  63  21.447   2.120  -5.552
  473    HB2  ASP  63           HB2      ASP  63  19.950   4.012  -5.040
  474    HB3  ASP  63           HB3      ASP  63  21.049   4.531  -3.773
  475    H    ARG  64           H        ARG  64  22.354   2.728  -2.209
  476    HA   ARG  64           HA       ARG  64  24.299   2.371  -1.113
  477    HB2  ARG  64           HB2      ARG  64  24.416   0.300  -2.444
  478    HB3  ARG  64           HB3      ARG  64  25.260   1.175  -3.715
  479    HG2  ARG  64           HG2      ARG  64  26.968   1.757  -1.905
  480    HG3  ARG  64           HG3      ARG  64  26.221   0.459  -0.975
  481    HD2  ARG  64           HD2      ARG  64  28.104  -0.444  -2.156
  482    HD3  ARG  64           HD3      ARG  64  26.630  -1.072  -2.893
  483    HE   ARG  64           HE       ARG  64  27.630   1.311  -4.156
  484   HH11  ARG  64          HH11      ARG  64  27.875  -2.182  -4.046
  485   HH12  ARG  64          HH12      ARG  64  28.441  -2.320  -5.678
  486   HH21  ARG  64          HH21      ARG  64  28.384   1.140  -6.288
  487   HH22  ARG  64          HH22      ARG  64  28.747  -0.419  -6.956
  488    H    ASN  65           H        ASN  65  25.030   4.361  -0.686
  489    HA   ASN  65           HA       ASN  65  27.320   5.254  -2.150
  490    HB2  ASN  65           HB2      ASN  65  25.657   6.365  -3.495
  491    HB3  ASN  65           HB3      ASN  65  24.867   7.022  -2.072
  492   HD21  ASN  65          HD21      ASN  65  27.579   7.260  -4.217
  493   HD22  ASN  65          HD22      ASN  65  28.138   8.805  -3.671
  494    HA   PRO  66           HA       PRO  66  27.129   7.652   1.999
  495    HB2  PRO  66           HB2      PRO  66  24.925   7.503   3.554
  496    HB3  PRO  66           HB3      PRO  66  25.116   8.738   2.302
  497    HG2  PRO  66           HG2      PRO  66  23.626   6.136   2.177
  498    HG3  PRO  66           HG3      PRO  66  23.097   7.746   1.653
  499    HD2  PRO  66           HD2      PRO  66  24.036   5.932  -0.090
  500    HD3  PRO  66           HD3      PRO  66  24.352   7.667  -0.280
  501    H    HIS  67           H        HIS  67  25.395   4.603   1.794
  502    HA   HIS  67           HA       HIS  67  27.173   3.376   3.663
  503    HB2  HIS  67           HB2      HIS  67  25.440   2.603   5.217
  504    HB3  HIS  67           HB3      HIS  67  25.534   4.355   5.208
  505    HD1  HIS  67           HD1      HIS  67  23.236   1.531   4.494
  506    HD2  HIS  67           HD2      HIS  67  23.298   5.665   4.080
  507    HE1  HIS  67           HE1      HIS  67  20.861   2.201   4.023
  508    HE2  HIS  67           HE2      HIS  67  20.899   4.716   3.977
  509    H    TYR  68           H        TYR  68  25.767   1.107   4.164
  510    HA   TYR  68           HA       TYR  68  25.362  -0.955   3.345
  511    HB2  TYR  68           HB2      TYR  68  23.427   0.097   2.183
  512    HB3  TYR  68           HB3      TYR  68  24.465   0.402   0.793
  513    HD1  TYR  68           HD1      TYR  68  24.640  -1.214  -0.890
  514    HD2  TYR  68           HD2      TYR  68  23.226  -2.367   2.951
  515    HE1  TYR  68           HE1      TYR  68  24.124  -3.456  -1.760
  516    HE2  TYR  68           HE2      TYR  68  22.707  -4.610   2.094
  517    HH   TYR  68           HH       TYR  68  22.219  -5.698  -0.041
  518    H    HIS  69           H        HIS  69  27.070  -2.154   3.040
  519    HA   HIS  69           HA       HIS  69  29.105  -2.887   2.333
  520    HB2  HIS  69           HB2      HIS  69  27.527  -3.321   0.315
  521    HB3  HIS  69           HB3      HIS  69  28.351  -1.959  -0.434
  522    HD1  HIS  69           HD1      HIS  69  30.960  -2.287  -0.882
  523    HD2  HIS  69           HD2      HIS  69  28.879  -5.704   0.238
  524    HE1  HIS  69           HE1      HIS  69  32.445  -4.218  -1.502
  525    HE2  HIS  69           HE2      HIS  69  31.211  -6.267  -0.726
  526    H    GLU  70           H        GLU  70  29.564  -0.756   3.573
  527    HA   GLU  70           HA       GLU  70  30.110   1.632   2.209
  528    HB2  GLU  70           HB2      GLU  70  31.111   0.677   4.898
  529    HB3  GLU  70           HB3      GLU  70  31.211   2.332   4.314
  530    HG2  GLU  70           HG2      GLU  70  28.802   2.487   4.265
  531    HG3  GLU  70           HG3      GLU  70  28.660   0.798   4.750
  532    H    TYR  71           H        TYR  71  32.656  -0.003   4.028
  533    HA   TYR  71           HA       TYR  71  34.547   0.712   1.931
  534    HB2  TYR  71           HB2      TYR  71  36.257   0.032   3.678
  535    HB3  TYR  71           HB3      TYR  71  35.259   1.418   4.093
  536    HD1  TYR  71           HD1      TYR  71  36.320  -1.871   5.065
  537    HD2  TYR  71           HD2      TYR  71  33.313   1.068   5.683
  538    HE1  TYR  71           HE1      TYR  71  35.684  -2.966   7.172
  539    HE2  TYR  71           HE2      TYR  71  32.670  -0.023   7.787
  540    HH   TYR  71           HH       TYR  71  34.549  -2.261   9.353
  541    H    HIS  72           H        HIS  72  33.235  -2.033   3.627
  542    HA   HIS  72           HA       HIS  72  33.928  -3.792   1.445
  543    HB2  HIS  72           HB2      HIS  72  35.015  -4.213   4.235
  544    HB3  HIS  72           HB3      HIS  72  34.809  -5.542   3.104
  545    HD1  HIS  72           HD1      HIS  72  37.386  -3.575   4.333
  546    HD2  HIS  72           HD2      HIS  72  36.241  -4.624   0.479
  547    HE1  HIS  72           HE1      HIS  72  39.427  -3.244   2.908
  548    HE2  HIS  72           HE2      HIS  72  38.663  -3.733   0.558
  549    H    THR  73           H        THR  73  32.753  -3.648   4.778
  550    HA   THR  73           HA       THR  73  30.653  -5.550   4.189
  551    HB   THR  73           HB       THR  73  30.127  -4.988   6.697
  552    HG1  THR  73           HG1      THR  73  31.459  -3.512   7.437
  553   HG21  THR  73          HG21      THR  73  30.992  -7.132   5.895
  554   HG22  THR  73          HG22      THR  73  31.779  -6.662   7.399
  555   HG23  THR  73          HG23      THR  73  32.624  -6.470   5.862
  Start of MODEL   10
    1    H1   GLN  -1           H1       GLN  -1 -12.195  10.509  -4.170
    2    H2   GLN  -1           H2       GLN  -1 -11.372   9.148  -4.747
    3    H3   GLN  -1           H3       GLN  -1 -10.510  10.532  -4.302
    4    HA   GLN  -1           HA       GLN  -1 -11.192  10.267  -2.016
    5    HB2  GLN  -1           HB2      GLN  -1 -12.466   7.731  -3.062
    6    HB3  GLN  -1           HB3      GLN  -1 -12.277   8.129  -1.360
    7    HG2  GLN  -1           HG2      GLN  -1 -13.712  10.066  -1.631
    8    HG3  GLN  -1           HG3      GLN  -1 -13.866   9.728  -3.354
    9   HE21  GLN  -1          HE21      GLN  -1 -14.765   8.740  -0.149
   10   HE22  GLN  -1          HE22      GLN  -1 -16.054   7.687  -0.619
   11    H    SER   0           H        SER   0  -9.346   9.868  -1.058
   12    HA   SER   0           HA       SER   0  -7.310   9.041  -0.536
   13    HB2  SER   0           HB2      SER   0  -8.573   6.947  -0.120
   14    HB3  SER   0           HB3      SER   0  -8.325   6.478  -1.799
   15    HG   SER   0           HG       SER   0  -6.510   5.666  -1.168
   16    H    MET   1           H        MET   1  -5.381   7.667  -1.709
   17    HA   MET   1           HA       MET   1  -4.855   9.179  -4.111
   18    HB2  MET   1           HB2      MET   1  -3.206   7.115  -2.646
   19    HB3  MET   1           HB3      MET   1  -2.653   8.001  -4.060
   20    HG2  MET   1           HG2      MET   1  -3.396   9.160  -1.384
   21    HG3  MET   1           HG3      MET   1  -1.774   9.011  -2.060
   22    HE1  MET   1           HE1      MET   1  -2.892  11.708  -0.873
   23    HE2  MET   1           HE2      MET   1  -2.392  12.877  -2.096
   24    HE3  MET   1           HE3      MET   1  -1.293  11.589  -1.606
   25    H    ALA   2           H        ALA   2  -3.708   7.826  -5.946
   26    HA   ALA   2           HA       ALA   2  -5.681   6.375  -7.240
   27    HB1  ALA   2           HB1      ALA   2  -4.004   5.782  -8.873
   28    HB2  ALA   2           HB2      ALA   2  -2.720   6.190  -7.736
   29    HB3  ALA   2           HB3      ALA   2  -3.775   7.456  -8.366
   30    H    LEU   3           H        LEU   3  -2.696   5.077  -5.908
   31    HA   LEU   3           HA       LEU   3  -4.128   2.621  -5.150
   32    HB2  LEU   3           HB2      LEU   3  -1.443   2.782  -6.520
   33    HB3  LEU   3           HB3      LEU   3  -2.031   1.350  -5.726
   34    HG   LEU   3           HG       LEU   3  -4.045   1.565  -7.347
   35   HD11  LEU   3          HD11      LEU   3  -3.447   3.766  -8.135
   36   HD12  LEU   3          HD12      LEU   3  -3.461   2.598  -9.457
   37   HD13  LEU   3          HD13      LEU   3  -1.929   3.135  -8.764
   38   HD21  LEU   3          HD21      LEU   3  -1.302   0.717  -8.255
   39   HD22  LEU   3          HD22      LEU   3  -2.814   0.277  -9.047
   40   HD23  LEU   3          HD23      LEU   3  -2.484  -0.279  -7.406
   41    H    HIS   4           H        HIS   4  -3.175   1.499  -3.364
   42    HA   HIS   4           HA       HIS   4  -1.816   3.327  -1.544
   43    HB2  HIS   4           HB2      HIS   4  -2.967   0.575  -1.119
   44    HB3  HIS   4           HB3      HIS   4  -2.117   1.468   0.124
   45    HD1  HIS   4           HD1      HIS   4  -5.415   0.739  -0.898
   46    HD2  HIS   4           HD2      HIS   4  -3.499   4.147   0.502
   47    HE1  HIS   4           HE1      HIS   4  -7.245   2.238  -0.048
   48    HE2  HIS   4           HE2      HIS   4  -6.037   4.196   0.984
   49    H    TYR   5           H        TYR   5   0.249   3.295  -1.261
   50    HA   TYR   5           HA       TYR   5   1.834   1.130  -2.446
   51    HB2  TYR   5           HB2      TYR   5   2.528   3.950  -1.634
   52    HB3  TYR   5           HB3      TYR   5   3.760   2.750  -2.010
   53    HD1  TYR   5           HD1      TYR   5   0.952   2.226  -4.105
   54    HD2  TYR   5           HD2      TYR   5   4.343   4.716  -3.559
   55    HE1  TYR   5           HE1      TYR   5   0.859   2.853  -6.475
   56    HE2  TYR   5           HE2      TYR   5   4.276   5.351  -5.913
   57    HH   TYR   5           HH       TYR   5   3.408   4.494  -8.046
   58    H    TYR   6           H        TYR   6   2.711  -0.343  -1.176
   59    HA   TYR   6           HA       TYR   6   3.498   0.467   1.540
   60    HB2  TYR   6           HB2      TYR   6   2.387  -2.222   0.700
   61    HB3  TYR   6           HB3      TYR   6   3.008  -1.829   2.303
   62    HD1  TYR   6           HD1      TYR   6   1.834  -0.101   3.690
   63    HD2  TYR   6           HD2      TYR   6   0.180  -1.601   0.056
   64    HE1  TYR   6           HE1      TYR   6  -0.390   0.734   4.342
   65    HE2  TYR   6           HE2      TYR   6  -2.031  -0.761   0.708
   66    HH   TYR   6           HH       TYR   6  -2.468   1.368   3.379
   67    H    CYS   7           H        CYS   7   5.547  -0.147   2.170
   68    HA   CYS   7           HA       CYS   7   7.187  -0.435  -0.164
   69    HB2  CYS   7           HB2      CYS   7   7.652   1.312   1.481
   70    HB3  CYS   7           HB3      CYS   7   8.076   0.088   2.657
   71    H    ARG   8           H        ARG   8   8.651  -1.836  -0.646
   72    HA   ARG   8           HA       ARG   8   8.642  -4.458   0.385
   73    HB2  ARG   8           HB2      ARG   8   9.363  -3.797  -1.922
   74    HB3  ARG   8           HB3      ARG   8  10.795  -3.059  -1.223
   75    HG2  ARG   8           HG2      ARG   8  11.451  -5.274  -0.333
   76    HG3  ARG   8           HG3      ARG   8  10.064  -5.978  -1.175
   77    HD2  ARG   8           HD2      ARG   8  11.786  -6.326  -2.681
   78    HD3  ARG   8           HD3      ARG   8  11.069  -4.832  -3.268
   79    HE   ARG   8           HE       ARG   8  13.050  -4.003  -1.586
   80   HH11  ARG   8          HH11      ARG   8  12.883  -6.032  -4.422
   81   HH12  ARG   8          HH12      ARG   8  14.537  -5.777  -4.870
   82   HH21  ARG   8          HH21      ARG   8  15.246  -3.668  -2.160
   83   HH22  ARG   8          HH22      ARG   8  15.889  -4.438  -3.576
   84    H    HIS   9           H        HIS   9   9.352  -4.974   2.316
   85    HA   HIS   9           HA       HIS   9  11.120  -5.761   3.587
   86    HB2  HIS   9           HB2      HIS   9  12.786  -5.113   1.933
   87    HB3  HIS   9           HB3      HIS   9  12.698  -3.441   2.462
   88    HD1  HIS   9           HD1      HIS   9  14.154  -6.754   3.367
   89    HD2  HIS   9           HD2      HIS   9  14.105  -2.866   4.831
   90    HE1  HIS   9           HE1      HIS   9  16.003  -6.650   5.065
   91    HE2  HIS   9           HE2      HIS   9  16.086  -4.236   5.773
   92    H    CYS  10           H        CYS  10  10.626  -2.211   3.581
   93    HA   CYS  10           HA       CYS  10  10.987  -2.310   6.483
   94    HB2  CYS  10           HB2      CYS  10  11.383  -0.006   6.473
   95    HB3  CYS  10           HB3      CYS  10  12.118  -0.551   4.971
   96    H    GLY  11           H        GLY  11   8.536  -1.968   4.080
   97    HA2  GLY  11           HA2      GLY  11   6.278  -2.341   4.341
   98    HA3  GLY  11           HA3      GLY  11   6.534  -2.414   6.090
   99    H    VAL  12           H        VAL  12   7.700   0.438   4.527
  100    HA   VAL  12           HA       VAL  12   5.820   2.027   5.949
  101    HB   VAL  12           HB       VAL  12   8.038   2.915   5.695
  102   HG11  VAL  12          HG11      VAL  12   7.510   2.934   2.731
  103   HG12  VAL  12          HG12      VAL  12   8.644   1.872   3.567
  104   HG13  VAL  12          HG13      VAL  12   8.927   3.612   3.530
  105   HG21  VAL  12          HG21      VAL  12   7.560   5.109   4.851
  106   HG22  VAL  12          HG22      VAL  12   6.174   4.493   5.756
  107   HG23  VAL  12          HG23      VAL  12   6.157   4.481   3.991
  108    H    LYS  13           H        LYS  13   4.216   3.295   5.185
  109    HA   LYS  13           HA       LYS  13   2.999   2.421   2.700
  110    HB2  LYS  13           HB2      LYS  13   2.006   4.485   4.664
  111    HB3  LYS  13           HB3      LYS  13   1.064   3.678   3.424
  112    HG2  LYS  13           HG2      LYS  13   1.393   1.552   4.591
  113    HG3  LYS  13           HG3      LYS  13   2.298   2.392   5.847
  114    HD2  LYS  13           HD2      LYS  13   0.323   3.736   6.367
  115    HD3  LYS  13           HD3      LYS  13  -0.581   2.896   5.106
  116    HE2  LYS  13           HE2      LYS  13  -0.271   0.782   6.297
  117    HE3  LYS  13           HE3      LYS  13   0.630   1.623   7.555
  118    HZ1  LYS  13           HZ1      LYS  13  -1.346   2.914   8.060
  119    HZ2  LYS  13           HZ2      LYS  13  -1.664   1.261   8.200
  120    HZ3  LYS  13           HZ3      LYS  13  -2.212   2.112   6.844
  121    H    VAL  14           H        VAL  14   4.103   3.264   1.015
  122    HA   VAL  14           HA       VAL  14   5.291   5.879   1.110
  123    HB   VAL  14           HB       VAL  14   5.101   4.762  -1.572
  124   HG11  VAL  14          HG11      VAL  14   7.385   5.502   0.236
  125   HG12  VAL  14          HG12      VAL  14   6.679   6.467  -1.062
  126   HG13  VAL  14          HG13      VAL  14   7.568   4.992  -1.441
  127   HG21  VAL  14          HG21      VAL  14   6.374   3.032   0.540
  128   HG22  VAL  14          HG22      VAL  14   6.634   2.868  -1.198
  129   HG23  VAL  14          HG23      VAL  14   5.030   2.605  -0.523
  130    H    GLY  15           H        GLY  15   2.291   4.582   0.083
  131    HA2  GLY  15           HA2      GLY  15   1.586   7.177  -1.102
  132    HA3  GLY  15           HA3      GLY  15   1.274   5.703  -2.008
  133    H    SER  16           H        SER  16   0.363   7.675   0.668
  134    HA   SER  16           HA       SER  16  -1.609   7.969   1.733
  135    HB2  SER  16           HB2      SER  16  -2.725   7.512  -0.417
  136    HB3  SER  16           HB3      SER  16  -2.693   5.788  -0.061
  137    HG   SER  16           HG       SER  16  -4.038   7.793   1.438
  138    H    LEU  17           H        LEU  17  -2.167   7.350   3.703
  139    HA   LEU  17           HA       LEU  17  -1.390   4.639   4.532
  140    HB2  LEU  17           HB2      LEU  17  -1.105   5.586   6.768
  141    HB3  LEU  17           HB3      LEU  17  -0.108   6.406   5.584
  142    HG   LEU  17           HG       LEU  17  -2.349   7.974   5.594
  143   HD11  LEU  17          HD11      LEU  17  -3.311   6.746   7.467
  144   HD12  LEU  17          HD12      LEU  17  -2.922   8.404   7.918
  145   HD13  LEU  17          HD13      LEU  17  -1.874   7.082   8.433
  146   HD21  LEU  17          HD21      LEU  17  -0.986   9.533   6.924
  147   HD22  LEU  17          HD22      LEU  17  -0.084   8.782   5.610
  148   HD23  LEU  17          HD23      LEU  17   0.140   8.222   7.266
  149    H    GLU  18           H        GLU  18  -3.974   6.512   3.832
  150    HA   GLU  18           HA       GLU  18  -5.728   5.765   5.979
  151    HB2  GLU  18           HB2      GLU  18  -6.288   7.119   3.342
  152    HB3  GLU  18           HB3      GLU  18  -7.449   6.938   4.650
  153    HG2  GLU  18           HG2      GLU  18  -6.068   8.295   6.099
  154    HG3  GLU  18           HG3      GLU  18  -4.846   8.430   4.839
  155    H    SER  19           H        SER  19  -7.351   4.298   5.976
  156    HA   SER  19           HA       SER  19  -8.722   2.602   5.366
  157    HB2  SER  19           HB2      SER  19  -8.085   3.446   2.544
  158    HB3  SER  19           HB3      SER  19  -9.464   2.468   3.047
  159    HG   SER  19           HG       SER  19  -9.554   4.641   4.516
  160    H    SER  20           H        SER  20  -6.030   1.989   5.886
  161    HA   SER  20           HA       SER  20  -4.986   0.176   3.940
  162    HB2  SER  20           HB2      SER  20  -4.314   0.351   6.885
  163    HB3  SER  20           HB3      SER  20  -3.329  -0.391   5.624
  164    HG   SER  20           HG       SER  20  -4.060   2.241   5.174
  165    H    MET  21           H        MET  21  -6.303  -0.455   7.211
  166    HA   MET  21           HA       MET  21  -7.200  -3.089   6.229
  167    HB2  MET  21           HB2      MET  21  -6.767  -4.027   8.423
  168    HB3  MET  21           HB3      MET  21  -5.307  -3.282   7.797
  169    HG2  MET  21           HG2      MET  21  -5.524  -1.418   9.245
  170    HG3  MET  21           HG3      MET  21  -7.149  -1.904   9.724
  171    HE1  MET  21           HE1      MET  21  -3.343  -2.819   9.843
  172    HE2  MET  21           HE2      MET  21  -4.054  -4.342   9.309
  173    HE3  MET  21           HE3      MET  21  -3.333  -4.220  10.913
  174    H    VAL  22           H        VAL  22  -8.258  -0.237   6.825
  175    HA   VAL  22           HA       VAL  22 -10.196  -0.353   8.810
  176    HB   VAL  22           HB       VAL  22 -10.316   1.223   6.244
  177   HG11  VAL  22          HG11      VAL  22 -12.472   1.115   7.372
  178   HG12  VAL  22          HG12      VAL  22 -11.785   2.735   7.472
  179   HG13  VAL  22          HG13      VAL  22 -11.723   1.664   8.871
  180   HG21  VAL  22          HG21      VAL  22  -8.265   1.669   7.473
  181   HG22  VAL  22          HG22      VAL  22  -9.196   1.981   8.939
  182   HG23  VAL  22          HG23      VAL  22  -9.351   3.056   7.549
  183    H    SER  23           H        SER  23 -10.397  -1.153   5.434
  184    HA   SER  23           HA       SER  23 -13.141  -2.099   5.811
  185    HB2  SER  23           HB2      SER  23 -11.641  -1.454   3.269
  186    HB3  SER  23           HB3      SER  23 -13.310  -2.009   3.364
  187    HG   SER  23           HG       SER  23 -12.721   0.413   3.289
  188    H    THR  24           H        THR  24 -11.396  -3.762   6.899
  189    HA   THR  24           HA       THR  24 -10.537  -5.791   5.033
  190    HB   THR  24           HB       THR  24  -9.165  -5.285   7.018
  191    HG1  THR  24           HG1      THR  24 -10.267  -7.919   6.914
  192   HG21  THR  24          HG21      THR  24 -10.942  -4.773   8.611
  193   HG22  THR  24          HG22      THR  24  -9.889  -6.040   9.240
  194   HG23  THR  24          HG23      THR  24 -11.470  -6.455   8.581
  195    H    ASP  25           H        ASP  25 -13.287  -5.115   6.953
  196    HA   ASP  25           HA       ASP  25 -14.260  -7.877   6.817
  197    HB2  ASP  25           HB2      ASP  25 -14.508  -6.911   8.989
  198    HB3  ASP  25           HB3      ASP  25 -15.177  -5.428   8.329
  199    H    SER  26           H        SER  26 -14.786  -4.657   5.694
  200    HA   SER  26           HA       SER  26 -17.175  -5.387   4.204
  201    HB2  SER  26           HB2      SER  26 -17.010  -3.258   5.537
  202    HB3  SER  26           HB3      SER  26 -15.772  -2.713   4.411
  203    HG   SER  26           HG       SER  26 -18.102  -2.095   4.049
  204    H    LEU  27           H        LEU  27 -16.805  -3.566   2.079
  205    HA   LEU  27           HA       LEU  27 -14.921  -5.071   0.433
  206    HB2  LEU  27           HB2      LEU  27 -17.070  -3.076  -0.260
  207    HB3  LEU  27           HB3      LEU  27 -15.995  -3.791  -1.443
  208    HG   LEU  27           HG       LEU  27 -16.917  -6.050  -0.459
  209   HD11  LEU  27          HD11      LEU  27 -19.149  -4.128   0.171
  210   HD12  LEU  27          HD12      LEU  27 -18.208  -5.052   1.341
  211   HD13  LEU  27          HD13      LEU  27 -19.261  -5.887   0.199
  212   HD21  LEU  27          HD21      LEU  27 -18.548  -4.313  -2.298
  213   HD22  LEU  27          HD22      LEU  27 -18.600  -6.073  -2.196
  214   HD23  LEU  27          HD23      LEU  27 -17.139  -5.265  -2.766
  215    H    GLY  28           H        GLY  28 -13.956  -3.482  -1.390
  216    HA2  GLY  28           HA2      GLY  28 -12.033  -1.952   0.083
  217    HA3  GLY  28           HA3      GLY  28 -12.060  -2.194  -1.656
  218    H    PHE  29           H        PHE  29 -13.744  -0.435   0.922
  219    HA   PHE  29           HA       PHE  29 -13.660   1.965  -0.757
  220    HB2  PHE  29           HB2      PHE  29 -16.085   1.107   0.851
  221    HB3  PHE  29           HB3      PHE  29 -15.936   2.581  -0.094
  222    HD1  PHE  29           HD1      PHE  29 -15.876   2.484  -2.552
  223    HD2  PHE  29           HD2      PHE  29 -16.644  -0.948  -0.162
  224    HE1  PHE  29           HE1      PHE  29 -16.806   1.327  -4.514
  225    HE2  PHE  29           HE2      PHE  29 -17.580  -2.103  -2.108
  226    HZ   PHE  29           HZ       PHE  29 -17.654  -0.973  -4.298
  227    H    GLN  30           H        GLN  30 -15.008   3.589   1.231
  228    HA   GLN  30           HA       GLN  30 -13.094   3.351   3.467
  229    HB2  GLN  30           HB2      GLN  30 -14.151   5.970   2.384
  230    HB3  GLN  30           HB3      GLN  30 -12.879   5.733   3.568
  231    HG2  GLN  30           HG2      GLN  30 -11.591   4.587   1.749
  232    HG3  GLN  30           HG3      GLN  30 -12.792   5.204   0.626
  233   HE21  GLN  30          HE21      GLN  30 -10.180   6.011   2.760
  234   HE22  GLN  30          HE22      GLN  30  -9.974   7.646   2.221
  235    H    HIS  31           H        HIS  31 -15.850   5.291   2.572
  236    HA   HIS  31           HA       HIS  31 -17.463   4.198   4.734
  237    HB2  HIS  31           HB2      HIS  31 -16.253   6.168   5.701
  238    HB3  HIS  31           HB3      HIS  31 -16.981   7.180   4.460
  239    HD1  HIS  31           HD1      HIS  31 -17.771   5.356   7.626
  240    HD2  HIS  31           HD2      HIS  31 -19.671   7.836   4.885
  241    HE1  HIS  31           HE1      HIS  31 -19.941   6.028   8.707
  242    HE2  HIS  31           HE2      HIS  31 -21.001   7.642   7.091
  243    H    LEU  32           H        LEU  32 -18.471   3.314   2.813
  244    HA   LEU  32           HA       LEU  32 -19.564   5.158   0.901
  245    HB2  LEU  32           HB2      LEU  32 -20.714   2.960   0.093
  246    HB3  LEU  32           HB3      LEU  32 -19.051   3.285  -0.257
  247    HG   LEU  32           HG       LEU  32 -18.360   1.735   1.506
  248   HD11  LEU  32          HD11      LEU  32 -19.991   0.329   2.641
  249   HD12  LEU  32          HD12      LEU  32 -21.305   1.250   1.911
  250   HD13  LEU  32          HD13      LEU  32 -20.218   2.027   3.064
  251   HD21  LEU  32          HD21      LEU  32 -18.724   0.876  -0.730
  252   HD22  LEU  32          HD22      LEU  32 -20.429   0.608  -0.369
  253   HD23  LEU  32          HD23      LEU  32 -19.192  -0.326   0.473
  254    H    THR  33           H        THR  33 -21.805   5.037   0.249
  255    HA   THR  33           HA       THR  33 -23.607   4.917   2.569
  256    HB   THR  33           HB       THR  33 -24.157   6.523   0.077
  257    HG1  THR  33           HG1      THR  33 -22.035   7.070   1.002
  258   HG21  THR  33          HG21      THR  33 -25.283   8.003   1.798
  259   HG22  THR  33          HG22      THR  33 -25.008   6.708   2.963
  260   HG23  THR  33          HG23      THR  33 -26.020   6.425   1.546
  261    H    ASN  34           H        ASN  34 -25.947   4.438   1.826
  262    HA   ASN  34           HA       ASN  34 -26.179   1.946   0.757
  263    HB2  ASN  34           HB2      ASN  34 -28.559   2.398   0.407
  264    HB3  ASN  34           HB3      ASN  34 -28.008   3.061   1.938
  265   HD21  ASN  34          HD21      ASN  34 -30.333   3.749   0.348
  266   HD22  ASN  34          HD22      ASN  34 -30.200   5.438  -0.005
  267    H    GLU  35           H        GLU  35 -26.351   4.989  -1.057
  268    HA   GLU  35           HA       GLU  35 -27.057   3.863  -3.519
  269    HB2  GLU  35           HB2      GLU  35 -26.155   5.979  -4.506
  270    HB3  GLU  35           HB3      GLU  35 -27.352   6.193  -3.239
  271    HG2  GLU  35           HG2      GLU  35 -25.633   6.730  -1.649
  272    HG3  GLU  35           HG3      GLU  35 -24.380   6.407  -2.846
  273    H    GLU  36           H        GLU  36 -23.883   4.253  -2.019
  274    HA   GLU  36           HA       GLU  36 -22.497   3.641  -4.464
  275    HB2  GLU  36           HB2      GLU  36 -21.527   5.122  -2.750
  276    HB3  GLU  36           HB3      GLU  36 -21.472   3.778  -1.624
  277    HG2  GLU  36           HG2      GLU  36 -19.757   2.717  -2.782
  278    HG3  GLU  36           HG3      GLU  36 -20.056   3.639  -4.256
  279    H    ARG  37           H        ARG  37 -23.663   1.910  -1.659
  280    HA   ARG  37           HA       ARG  37 -22.334  -0.546  -2.179
  281    HB2  ARG  37           HB2      ARG  37 -25.001  -0.089  -0.822
  282    HB3  ARG  37           HB3      ARG  37 -24.056  -1.570  -0.751
  283    HG2  ARG  37           HG2      ARG  37 -22.231  -0.259   0.337
  284    HG3  ARG  37           HG3      ARG  37 -23.343   1.109   0.414
  285    HD2  ARG  37           HD2      ARG  37 -23.721  -1.594   1.697
  286    HD3  ARG  37           HD3      ARG  37 -23.330  -0.088   2.522
  287    HE   ARG  37           HE       ARG  37 -25.811  -0.146   0.997
  288   HH11  ARG  37          HH11      ARG  37 -24.253  -0.396   4.120
  289   HH12  ARG  37          HH12      ARG  37 -25.706  -0.086   5.009
  290   HH21  ARG  37          HH21      ARG  37 -27.728   0.231   2.162
  291   HH22  ARG  37          HH22      ARG  37 -27.689   0.256   3.895
  292    H    ASN  38           H        ASN  38 -25.487   0.757  -3.083
  293    HA   ASN  38           HA       ASN  38 -26.345  -1.423  -4.659
  294    HB2  ASN  38           HB2      ASN  38 -27.931   0.228  -3.876
  295    HB3  ASN  38           HB3      ASN  38 -27.077   1.514  -4.720
  296   HD21  ASN  38          HD21      ASN  38 -27.449   1.843  -6.874
  297   HD22  ASN  38          HD22      ASN  38 -28.652   0.986  -7.773
  298    H    ASP  39           H        ASP  39 -24.256   1.278  -5.276
  299    HA   ASP  39           HA       ASP  39 -24.368   1.209  -8.114
  300    HB2  ASP  39           HB2      ASP  39 -23.652   3.181  -6.767
  301    HB3  ASP  39           HB3      ASP  39 -22.179   2.315  -6.345
  302    H    MET  40           H        MET  40 -22.064  -0.078  -5.741
  303    HA   MET  40           HA       MET  40 -20.458  -1.309  -7.800
  304    HB2  MET  40           HB2      MET  40 -19.081  -2.136  -5.950
  305    HB3  MET  40           HB3      MET  40 -19.378  -0.411  -5.808
  306    HG2  MET  40           HG2      MET  40 -19.647  -1.135  -3.643
  307    HG3  MET  40           HG3      MET  40 -21.305  -1.112  -4.234
  308    HE1  MET  40           HE1      MET  40 -21.263  -4.178  -1.784
  309    HE2  MET  40           HE2      MET  40 -22.079  -2.673  -2.205
  310    HE3  MET  40           HE3      MET  40 -20.421  -2.638  -1.607
  311    H    ILE  41           H        ILE  41 -23.212  -2.124  -6.053
  312    HA   ILE  41           HA       ILE  41 -24.601  -3.903  -6.113
  313    HB   ILE  41           HB       ILE  41 -22.654  -5.241  -7.998
  314   HG12  ILE  41          HG12      ILE  41 -25.042  -3.506  -8.629
  315   HG13  ILE  41          HG13      ILE  41 -23.364  -3.026  -8.831
  316   HG21  ILE  41          HG21      ILE  41 -24.279  -6.751  -6.995
  317   HG22  ILE  41          HG22      ILE  41 -24.621  -6.514  -8.708
  318   HG23  ILE  41          HG23      ILE  41 -25.592  -5.685  -7.492
  319   HD11  ILE  41          HD11      ILE  41 -24.749  -5.264 -10.287
  320   HD12  ILE  41          HD12      ILE  41 -23.060  -4.797 -10.484
  321   HD13  ILE  41          HD13      ILE  41 -24.343  -3.682 -10.948
  322    H    SER  42           H        SER  42 -21.533  -5.657  -6.501
  323    HA   SER  42           HA       SER  42 -21.461  -6.440  -3.733
  324    HB2  SER  42           HB2      SER  42 -22.007  -8.522  -5.869
  325    HB3  SER  42           HB3      SER  42 -21.639  -8.860  -4.181
  326    HG   SER  42           HG       SER  42 -23.661  -7.103  -4.310
  327    H    TYR  43           H        TYR  43 -19.896  -5.228  -6.029
  328    HA   TYR  43           HA       TYR  43 -17.564  -7.027  -5.885
  329    HB2  TYR  43           HB2      TYR  43 -18.483  -7.045  -8.131
  330    HB3  TYR  43           HB3      TYR  43 -18.480  -5.288  -8.181
  331    HD1  TYR  43           HD1      TYR  43 -16.642  -4.162  -9.084
  332    HD2  TYR  43           HD2      TYR  43 -16.197  -8.206  -7.843
  333    HE1  TYR  43           HE1      TYR  43 -14.377  -4.199 -10.040
  334    HE2  TYR  43           HE2      TYR  43 -13.934  -8.255  -8.795
  335    HH   TYR  43           HH       TYR  43 -12.340  -5.385  -9.896
  336    H    LYS  44           H        LYS  44 -15.664  -6.162  -5.258
  337    HA   LYS  44           HA       LYS  44 -15.569  -3.508  -4.209
  338    HB2  LYS  44           HB2      LYS  44 -13.250  -5.359  -4.805
  339    HB3  LYS  44           HB3      LYS  44 -13.221  -3.961  -3.743
  340    HG2  LYS  44           HG2      LYS  44 -14.834  -5.100  -2.261
  341    HG3  LYS  44           HG3      LYS  44 -14.743  -6.520  -3.301
  342    HD2  LYS  44           HD2      LYS  44 -12.297  -6.605  -2.881
  343    HD3  LYS  44           HD3      LYS  44 -12.482  -5.273  -1.740
  344    HE2  LYS  44           HE2      LYS  44 -14.052  -6.663  -0.433
  345    HE3  LYS  44           HE3      LYS  44 -13.757  -7.998  -1.544
  346    HZ1  LYS  44           HZ1      LYS  44 -11.720  -6.693   0.180
  347    HZ2  LYS  44           HZ2      LYS  44 -11.423  -7.960  -0.899
  348    HZ3  LYS  44           HZ3      LYS  44 -12.421  -8.210   0.443
  349    H    GLU  45           H        GLU  45 -16.086  -2.153  -5.946
  350    HA   GLU  45           HA       GLU  45 -14.991  -2.292  -8.505
  351    HB2  GLU  45           HB2      GLU  45 -17.012  -1.026  -7.951
  352    HB3  GLU  45           HB3      GLU  45 -16.056   0.137  -7.059
  353    HG2  GLU  45           HG2      GLU  45 -15.012   0.878  -9.031
  354    HG3  GLU  45           HG3      GLU  45 -15.690  -0.432  -9.978
  355    H    ASN  46           H        ASN  46 -13.750  -0.747  -5.615
  356    HA   ASN  46           HA       ASN  46 -11.761   0.844  -6.823
  357    HB2  ASN  46           HB2      ASN  46 -12.450   1.079  -4.461
  358    HB3  ASN  46           HB3      ASN  46 -11.746  -0.492  -4.103
  359   HD21  ASN  46          HD21      ASN  46 -11.136   2.852  -4.701
  360   HD22  ASN  46          HD22      ASN  46  -9.451   2.831  -4.314
  361    H    GLY  47           H        GLY  47 -12.043  -2.541  -6.348
  362    HA2  GLY  47           HA2      GLY  47 -10.723  -4.269  -7.103
  363    HA3  GLY  47           HA3      GLY  47  -9.600  -3.071  -7.756
  364    H    ASP  48           H        ASP  48 -10.038  -2.168  -4.679
  365    HA   ASP  48           HA       ASP  48  -8.637  -2.036  -2.921
  366    HB2  ASP  48           HB2      ASP  48  -9.486  -4.192  -2.322
  367    HB3  ASP  48           HB3      ASP  48  -8.387  -5.001  -3.434
  368    H    VAL  49           H        VAL  49  -7.289  -0.710  -4.056
  369    HA   VAL  49           HA       VAL  49  -5.096  -1.688  -5.575
  370    HB   VAL  49           HB       VAL  49  -4.392   0.765  -5.486
  371   HG11  VAL  49          HG11      VAL  49  -7.128   0.063  -6.549
  372   HG12  VAL  49          HG12      VAL  49  -5.594  -0.249  -7.361
  373   HG13  VAL  49          HG13      VAL  49  -6.125   1.409  -7.088
  374   HG21  VAL  49          HG21      VAL  49  -6.021   2.386  -4.736
  375   HG22  VAL  49          HG22      VAL  49  -5.679   1.294  -3.394
  376   HG23  VAL  49          HG23      VAL  49  -7.165   1.121  -4.324
  377    H    HIS  50           H        HIS  50  -3.814  -2.953  -4.356
  378    HA   HIS  50           HA       HIS  50  -2.371  -1.690  -2.123
  379    HB2  HIS  50           HB2      HIS  50  -4.038  -3.414  -1.351
  380    HB3  HIS  50           HB3      HIS  50  -3.172  -4.609  -2.303
  381    HD1  HIS  50           HD1      HIS  50  -3.470  -3.550   1.040
  382    HD2  HIS  50           HD2      HIS  50  -0.248  -4.623  -1.353
  383    HE1  HIS  50           HE1      HIS  50  -1.633  -4.185   2.627
  384    HE2  HIS  50           HE2      HIS  50   0.193  -5.086   1.150
  385    H    VAL  51           H        VAL  51  -0.507  -1.220  -3.187
  386    HA   VAL  51           HA       VAL  51   0.775  -3.410  -4.692
  387    HB   VAL  51           HB       VAL  51   1.928  -1.600  -5.995
  388   HG11  VAL  51          HG11      VAL  51   0.028  -2.784  -6.950
  389   HG12  VAL  51          HG12      VAL  51   0.004  -1.083  -7.422
  390   HG13  VAL  51          HG13      VAL  51  -1.078  -1.662  -6.156
  391   HG21  VAL  51          HG21      VAL  51   1.660   0.223  -4.477
  392   HG22  VAL  51          HG22      VAL  51  -0.096   0.126  -4.621
  393   HG23  VAL  51          HG23      VAL  51   0.880   0.609  -6.010
  394    H    LEU  52           H        LEU  52   2.952  -3.759  -4.420
  395    HA   LEU  52           HA       LEU  52   4.141  -2.426  -2.084
  396    HB2  LEU  52           HB2      LEU  52   5.010  -5.016  -3.371
  397    HB3  LEU  52           HB3      LEU  52   5.554  -4.362  -1.836
  398    HG   LEU  52           HG       LEU  52   2.811  -5.453  -2.465
  399   HD11  LEU  52          HD11      LEU  52   4.953  -6.388  -0.564
  400   HD12  LEU  52          HD12      LEU  52   4.563  -7.125  -2.117
  401   HD13  LEU  52          HD13      LEU  52   3.375  -7.137  -0.813
  402   HD21  LEU  52          HD21      LEU  52   2.256  -4.996  -0.143
  403   HD22  LEU  52          HD22      LEU  52   2.652  -3.503  -0.993
  404   HD23  LEU  52          HD23      LEU  52   3.828  -4.235   0.099
  405    H    THR  53           H        THR  53   5.980  -1.258  -2.290
  406    HA   THR  53           HA       THR  53   7.640  -1.516  -4.653
  407    HB   THR  53           HB       THR  53   5.832   0.012  -5.399
  408    HG1  THR  53           HG1      THR  53   7.482   0.696  -6.528
  409   HG21  THR  53          HG21      THR  53   6.851   1.843  -3.228
  410   HG22  THR  53          HG22      THR  53   5.288   1.028  -3.239
  411   HG23  THR  53          HG23      THR  53   5.651   2.256  -4.452
  412    H    ILE  54           H        ILE  54   9.433   0.255  -4.517
  413    HA   ILE  54           HA       ILE  54  10.503   0.070  -1.814
  414    HB   ILE  54           HB       ILE  54  11.654   0.414  -4.530
  415   HG12  ILE  54          HG12      ILE  54  13.131  -0.947  -2.384
  416   HG13  ILE  54          HG13      ILE  54  11.551  -1.612  -2.740
  417   HG21  ILE  54          HG21      ILE  54  12.533   2.381  -3.415
  418   HG22  ILE  54          HG22      ILE  54  13.802   1.182  -3.670
  419   HG23  ILE  54          HG23      ILE  54  13.086   1.385  -2.071
  420   HD11  ILE  54          HD11      ILE  54  13.429  -2.657  -3.990
  421   HD12  ILE  54          HD12      ILE  54  13.660  -1.115  -4.816
  422   HD13  ILE  54          HD13      ILE  54  12.151  -2.005  -5.015
  423    H    CYS  55           H        CYS  55  10.626   1.729  -0.454
  424    HA   CYS  55           HA       CYS  55   9.666   4.324  -1.266
  425    HB2  CYS  55           HB2      CYS  55   9.612   4.898   1.030
  426    HB3  CYS  55           HB3      CYS  55   9.129   3.210   0.965
  427    H    GLU  56           H        GLU  56  10.949   6.275  -0.287
  428    HA   GLU  56           HA       GLU  56  13.217   6.569  -1.875
  429    HB2  GLU  56           HB2      GLU  56  11.723   8.367  -0.877
  430    HB3  GLU  56           HB3      GLU  56  12.639   8.176   0.608
  431    HG2  GLU  56           HG2      GLU  56  14.681   8.784  -0.589
  432    HG3  GLU  56           HG3      GLU  56  13.738   9.009  -2.060
  433    H    ASP  57           H        ASP  57  12.975   6.009   1.621
  434    HA   ASP  57           HA       ASP  57  15.688   6.043   2.245
  435    HB2  ASP  57           HB2      ASP  57  14.126   6.099   4.029
  436    HB3  ASP  57           HB3      ASP  57  13.360   4.604   3.504
  437    H    CYS  58           H        CYS  58  13.651   3.294   1.269
  438    HA   CYS  58           HA       CYS  58  15.765   1.402   1.500
  439    HB2  CYS  58           HB2      CYS  58  13.090   1.267   0.116
  440    HB3  CYS  58           HB3      CYS  58  14.219  -0.083   0.151
  441    H    GLN  59           H        GLN  59  14.371   3.170  -1.256
  442    HA   GLN  59           HA       GLN  59  15.976   2.174  -3.294
  443    HB2  GLN  59           HB2      GLN  59  14.054   3.821  -3.379
  444    HB3  GLN  59           HB3      GLN  59  15.221   5.077  -3.020
  445    HG2  GLN  59           HG2      GLN  59  15.098   3.344  -5.480
  446    HG3  GLN  59           HG3      GLN  59  14.753   5.055  -5.363
  447   HE21  GLN  59          HE21      GLN  59  16.479   6.513  -5.008
  448   HE22  GLN  59          HE22      GLN  59  18.074   6.098  -5.526
  449    H    GLU  60           H        GLU  60  16.787   4.624  -0.831
  450    HA   GLU  60           HA       GLU  60  19.267   5.139  -2.091
  451    HB2  GLU  60           HB2      GLU  60  17.974   5.863   0.499
  452    HB3  GLU  60           HB3      GLU  60  19.676   6.085   0.312
  453    HG2  GLU  60           HG2      GLU  60  19.229   7.476  -1.692
  454    HG3  GLU  60           HG3      GLU  60  17.529   7.338  -1.288
  455    H    ALA  61           H        ALA  61  18.201   3.176   0.628
  456    HA   ALA  61           HA       ALA  61  20.609   1.971   1.335
  457    HB1  ALA  61           HB1      ALA  61  17.960   0.550   1.115
  458    HB2  ALA  61           HB2      ALA  61  18.365   1.656   2.430
  459    HB3  ALA  61           HB3      ALA  61  19.297   0.180   2.205
  460    H    LEU  62           H        LEU  62  18.523   1.594  -1.343
  461    HA   LEU  62           HA       LEU  62  19.577  -0.763  -2.534
  462    HB2  LEU  62           HB2      LEU  62  17.984   1.588  -3.446
  463    HB3  LEU  62           HB3      LEU  62  18.548   0.424  -4.599
  464    HG   LEU  62           HG       LEU  62  16.281   0.329  -2.808
  465   HD11  LEU  62          HD11      LEU  62  16.081   0.059  -5.165
  466   HD12  LEU  62          HD12      LEU  62  15.619  -1.456  -4.384
  467   HD13  LEU  62          HD13      LEU  62  17.205  -1.298  -5.138
  468   HD21  LEU  62          HD21      LEU  62  17.767  -1.110  -1.475
  469   HD22  LEU  62          HD22      LEU  62  17.987  -2.149  -2.885
  470   HD23  LEU  62          HD23      LEU  62  16.392  -1.974  -2.155
  471    H    ASP  63           H        ASP  63  19.925   2.658  -3.315
  472    HA   ASP  63           HA       ASP  63  21.738   2.178  -5.431
  473    HB2  ASP  63           HB2      ASP  63  20.311   3.990  -5.734
  474    HB3  ASP  63           HB3      ASP  63  20.606   4.647  -4.136
  475    H    ARG  64           H        ARG  64  22.288   3.690  -2.180
  476    HA   ARG  64           HA       ARG  64  25.109   2.991  -2.542
  477    HB2  ARG  64           HB2      ARG  64  24.087   5.790  -2.318
  478    HB3  ARG  64           HB3      ARG  64  25.678   5.388  -1.684
  479    HG2  ARG  64           HG2      ARG  64  26.385   4.615  -3.865
  480    HG3  ARG  64           HG3      ARG  64  24.770   4.905  -4.513
  481    HD2  ARG  64           HD2      ARG  64  24.997   7.278  -4.103
  482    HD3  ARG  64           HD3      ARG  64  26.572   7.019  -3.351
  483    HE   ARG  64           HE       ARG  64  27.512   6.676  -5.448
  484   HH11  ARG  64          HH11      ARG  64  24.031   6.954  -5.727
  485   HH12  ARG  64          HH12      ARG  64  24.076   7.307  -7.424
  486   HH21  ARG  64          HH21      ARG  64  27.562   7.125  -7.684
  487   HH22  ARG  64          HH22      ARG  64  26.078   7.404  -8.537
  488    H    ASN  65           H        ASN  65  22.523   3.726  -0.357
  489    HA   ASN  65           HA       ASN  65  24.281   3.909   1.929
  490    HB2  ASN  65           HB2      ASN  65  21.303   4.044   1.591
  491    HB3  ASN  65           HB3      ASN  65  22.022   3.874   3.190
  492   HD21  ASN  65          HD21      ASN  65  20.499   6.086   2.082
  493   HD22  ASN  65          HD22      ASN  65  21.526   7.474   2.182
  494    HA   PRO  66           HA       PRO  66  24.262  -0.449   2.681
  495    HB2  PRO  66           HB2      PRO  66  25.727  -0.446   4.925
  496    HB3  PRO  66           HB3      PRO  66  26.438  -0.060   3.353
  497    HG2  PRO  66           HG2      PRO  66  25.566   1.779   5.544
  498    HG3  PRO  66           HG3      PRO  66  27.016   1.858   4.529
  499    HD2  PRO  66           HD2      PRO  66  24.743   3.348   4.102
  500    HD3  PRO  66           HD3      PRO  66  25.910   2.925   2.835
  501    H    HIS  67           H        HIS  67  24.120  -1.797   4.895
  502    HA   HIS  67           HA       HIS  67  22.797  -2.626   6.521
  503    HB2  HIS  67           HB2      HIS  67  22.245   0.299   6.994
  504    HB3  HIS  67           HB3      HIS  67  21.545  -0.969   7.991
  505    HD1  HIS  67           HD1      HIS  67  22.968  -1.879   9.845
  506    HD2  HIS  67           HD2      HIS  67  25.134   0.424   7.148
  507    HE1  HIS  67           HE1      HIS  67  25.247  -1.604  10.867
  508    HE2  HIS  67           HE2      HIS  67  26.472  -0.057   9.304
  509    H    TYR  68           H        TYR  68  21.791  -2.577   3.893
  510    HA   TYR  68           HA       TYR  68  18.918  -2.180   4.240
  511    HB2  TYR  68           HB2      TYR  68  19.962  -1.540   2.080
  512    HB3  TYR  68           HB3      TYR  68  20.455  -3.210   1.841
  513    HD1  TYR  68           HD1      TYR  68  19.114  -4.548   0.524
  514    HD2  TYR  68           HD2      TYR  68  17.349  -1.256   2.562
  515    HE1  TYR  68           HE1      TYR  68  16.951  -5.050  -0.538
  516    HE2  TYR  68           HE2      TYR  68  15.189  -1.749   1.502
  517    HH   TYR  68           HH       TYR  68  14.576  -4.664  -0.146
  518    H    HIS  69           H        HIS  69  21.298  -4.689   3.722
  519    HA   HIS  69           HA       HIS  69  19.459  -6.634   4.897
  520    HB2  HIS  69           HB2      HIS  69  20.100  -8.359   3.298
  521    HB3  HIS  69           HB3      HIS  69  19.413  -6.989   2.441
  522    HD1  HIS  69           HD1      HIS  69  22.241  -9.229   2.406
  523    HD2  HIS  69           HD2      HIS  69  21.548  -5.295   1.241
  524    HE1  HIS  69           HE1      HIS  69  24.101  -8.654   0.816
  525    HE2  HIS  69           HE2      HIS  69  23.638  -6.293   0.080
  526    H    GLU  70           H        GLU  70  20.431  -7.977   6.351
  527    HA   GLU  70           HA       GLU  70  23.001  -7.052   7.255
  528    HB2  GLU  70           HB2      GLU  70  21.200  -9.184   8.411
  529    HB3  GLU  70           HB3      GLU  70  22.582  -8.449   9.211
  530    HG2  GLU  70           HG2      GLU  70  21.424  -6.249   9.034
  531    HG3  GLU  70           HG3      GLU  70  20.009  -7.107   8.428
  532    H    TYR  71           H        TYR  71  24.177  -7.821   5.373
  533    HA   TYR  71           HA       TYR  71  24.686 -10.706   5.345
  534    HB2  TYR  71           HB2      TYR  71  24.274  -9.639   3.174
  535    HB3  TYR  71           HB3      TYR  71  25.604  -8.524   3.458
  536    HD1  TYR  71           HD1      TYR  71  25.058 -12.229   3.508
  537    HD2  TYR  71           HD2      TYR  71  27.550  -8.990   2.331
  538    HE1  TYR  71           HE1      TYR  71  26.599 -13.815   2.432
  539    HE2  TYR  71           HE2      TYR  71  29.101 -10.566   1.258
  540    HH   TYR  71           HH       TYR  71  28.316 -13.765   0.601
  541    H    HIS  72           H        HIS  72  26.637 -11.576   5.880
  542    HA   HIS  72           HA       HIS  72  28.361  -9.868   7.474
  543    HB2  HIS  72           HB2      HIS  72  27.525 -12.215   8.136
  544    HB3  HIS  72           HB3      HIS  72  28.745 -12.816   7.022
  545    HD1  HIS  72           HD1      HIS  72  31.169 -12.784   7.792
  546    HD2  HIS  72           HD2      HIS  72  28.583 -10.898  10.439
  547    HE1  HIS  72           HE1      HIS  72  32.517 -12.374   9.873
  548    HE2  HIS  72           HE2      HIS  72  30.970 -11.106  11.403
  549    H    THR  73           H        THR  73  29.269  -8.661   5.763
  550    HA   THR  73           HA       THR  73  31.232 -10.136   4.160
  551    HB   THR  73           HB       THR  73  29.712  -8.850   2.775
  552    HG1  THR  73           HG1      THR  73  31.388  -7.310   1.888
  553   HG21  THR  73          HG21      THR  73  29.019  -7.165   4.412
  554   HG22  THR  73          HG22      THR  73  29.548  -6.419   2.904
  555   HG23  THR  73          HG23      THR  73  30.611  -6.412   4.311
  Start of MODEL   11
    1    H1   GLN  -1           H1       GLN  -1  -2.046  12.969 -13.486
    2    H2   GLN  -1           H2       GLN  -1  -1.583  12.161 -12.075
    3    H3   GLN  -1           H3       GLN  -1  -2.596  13.514 -11.987
    4    HA   GLN  -1           HA       GLN  -1  -4.358  12.370 -13.089
    5    HB2  GLN  -1           HB2      GLN  -1  -2.388  10.077 -13.192
    6    HB3  GLN  -1           HB3      GLN  -1  -4.097   9.937 -13.579
    7    HG2  GLN  -1           HG2      GLN  -1  -2.193  11.762 -15.022
    8    HG3  GLN  -1           HG3      GLN  -1  -2.583  10.127 -15.545
    9   HE21  GLN  -1          HE21      GLN  -1  -3.461  10.820 -17.472
   10   HE22  GLN  -1          HE22      GLN  -1  -4.984  11.638 -17.566
   11    H    SER   0           H        SER   0  -2.841  12.650 -10.368
   12    HA   SER   0           HA       SER   0  -3.100  12.059  -8.197
   13    HB2  SER   0           HB2      SER   0  -5.539  12.396  -8.789
   14    HB3  SER   0           HB3      SER   0  -5.644  10.661  -9.070
   15    HG   SER   0           HG       SER   0  -6.200  11.637  -6.880
   16    H    MET   1           H        MET   1  -3.428   9.950  -6.755
   17    HA   MET   1           HA       MET   1  -2.050   7.782  -8.166
   18    HB2  MET   1           HB2      MET   1  -2.593   8.012  -5.206
   19    HB3  MET   1           HB3      MET   1  -1.562   6.832  -5.996
   20    HG2  MET   1           HG2      MET   1  -0.064   8.655  -6.705
   21    HG3  MET   1           HG3      MET   1  -1.073   9.794  -5.813
   22    HE1  MET   1           HE1      MET   1   2.186   9.519  -3.624
   23    HE2  MET   1           HE2      MET   1   1.143  10.594  -4.552
   24    HE3  MET   1           HE3      MET   1   2.121   9.386  -5.381
   25    H    ALA   2           H        ALA   2  -2.901   5.751  -8.281
   26    HA   ALA   2           HA       ALA   2  -5.727   5.484  -7.505
   27    HB1  ALA   2           HB1      ALA   2  -4.350   4.269  -9.899
   28    HB2  ALA   2           HB2      ALA   2  -5.465   5.634  -9.930
   29    HB3  ALA   2           HB3      ALA   2  -6.040   4.037  -9.453
   30    H    LEU   3           H        LEU   3  -2.650   4.448  -6.921
   31    HA   LEU   3           HA       LEU   3  -3.599   1.872  -5.874
   32    HB2  LEU   3           HB2      LEU   3  -0.724   2.365  -6.576
   33    HB3  LEU   3           HB3      LEU   3  -1.498   0.861  -6.255
   34    HG   LEU   3           HG       LEU   3  -2.748   1.158  -8.437
   35   HD11  LEU   3          HD11      LEU   3  -2.393   3.510  -8.719
   36   HD12  LEU   3          HD12      LEU   3  -1.628   2.639 -10.055
   37   HD13  LEU   3          HD13      LEU   3  -0.647   3.275  -8.729
   38   HD21  LEU   3          HD21      LEU   3   0.258   0.927  -8.541
   39   HD22  LEU   3          HD22      LEU   3  -0.879   0.328  -9.747
   40   HD23  LEU   3          HD23      LEU   3  -0.849  -0.383  -8.132
   41    H    HIS   4           H        HIS   4  -2.546   1.204  -3.912
   42    HA   HIS   4           HA       HIS   4  -1.693   3.504  -2.286
   43    HB2  HIS   4           HB2      HIS   4  -2.687   0.787  -1.404
   44    HB3  HIS   4           HB3      HIS   4  -2.192   2.078  -0.323
   45    HD1  HIS   4           HD1      HIS   4  -5.087   0.719  -0.521
   46    HD2  HIS   4           HD2      HIS   4  -3.977   4.439  -2.015
   47    HE1  HIS   4           HE1      HIS   4  -7.206   2.071  -0.614
   48    HE2  HIS   4           HE2      HIS   4  -6.493   4.354  -1.403
   49    H    TYR   5           H        TYR   5   0.345   3.648  -1.732
   50    HA   TYR   5           HA       TYR   5   2.162   1.527  -2.554
   51    HB2  TYR   5           HB2      TYR   5   2.403   4.439  -2.018
   52    HB3  TYR   5           HB3      TYR   5   3.837   3.446  -1.749
   53    HD1  TYR   5           HD1      TYR   5   1.550   2.400  -4.385
   54    HD2  TYR   5           HD2      TYR   5   4.970   4.776  -3.502
   55    HE1  TYR   5           HE1      TYR   5   2.072   2.532  -6.782
   56    HE2  TYR   5           HE2      TYR   5   5.506   4.901  -5.887
   57    HH   TYR   5           HH       TYR   5   3.325   3.959  -8.334
   58    H    TYR   6           H        TYR   6   2.906   0.104  -1.188
   59    HA   TYR   6           HA       TYR   6   3.584   0.955   1.545
   60    HB2  TYR   6           HB2      TYR   6   2.389  -1.729   0.781
   61    HB3  TYR   6           HB3      TYR   6   2.893  -1.239   2.398
   62    HD1  TYR   6           HD1      TYR   6   0.157  -1.462   0.178
   63    HD2  TYR   6           HD2      TYR   6   1.753   0.932   3.301
   64    HE1  TYR   6           HE1      TYR   6  -2.080  -0.518   0.587
   65    HE2  TYR   6           HE2      TYR   6  -0.475   1.877   3.715
   66    HH   TYR   6           HH       TYR   6  -3.315   0.583   2.456
   67    H    CYS   7           H        CYS   7   5.599   0.186   2.243
   68    HA   CYS   7           HA       CYS   7   7.293  -0.476   0.033
   69    HB2  CYS   7           HB2      CYS   7   8.026   1.110   1.821
   70    HB3  CYS   7           HB3      CYS   7   8.156  -0.251   2.903
   71    H    ARG   8           H        ARG   8   8.396  -2.195  -0.431
   72    HA   ARG   8           HA       ARG   8   7.786  -4.684   0.807
   73    HB2  ARG   8           HB2      ARG   8   9.406  -5.638  -0.703
   74    HB3  ARG   8           HB3      ARG   8   8.451  -4.457  -1.585
   75    HG2  ARG   8           HG2      ARG   8  10.240  -2.842  -1.414
   76    HG3  ARG   8           HG3      ARG   8  11.196  -3.982  -0.458
   77    HD2  ARG   8           HD2      ARG   8  11.035  -5.558  -2.423
   78    HD3  ARG   8           HD3      ARG   8  10.387  -4.200  -3.347
   79    HE   ARG   8           HE       ARG   8  12.774  -3.445  -2.056
   80   HH11  ARG   8          HH11      ARG   8  11.622  -5.383  -4.732
   81   HH12  ARG   8          HH12      ARG   8  13.094  -5.245  -5.640
   82   HH21  ARG   8          HH21      ARG   8  14.741  -3.293  -3.236
   83   HH22  ARG   8          HH22      ARG   8  14.871  -4.061  -4.787
   84    H    HIS   9           H        HIS   9   8.554  -5.385   2.547
   85    HA   HIS   9           HA       HIS   9  10.075  -6.223   4.060
   86    HB2  HIS   9           HB2      HIS   9  11.975  -5.910   2.536
   87    HB3  HIS   9           HB3      HIS   9  12.053  -4.207   2.969
   88    HD1  HIS   9           HD1      HIS   9  13.590  -3.634   4.858
   89    HD2  HIS   9           HD2      HIS   9  12.550  -7.662   4.862
   90    HE1  HIS   9           HE1      HIS   9  14.971  -4.686   6.668
   91    HE2  HIS   9           HE2      HIS   9  14.465  -7.146   6.525
   92    H    CYS  10           H        CYS  10   9.962  -2.699   3.635
   93    HA   CYS  10           HA       CYS  10  10.151  -2.229   6.470
   94    HB2  CYS  10           HB2      CYS  10   9.249  -0.377   4.279
   95    HB3  CYS  10           HB3      CYS  10   9.625   0.104   5.921
   96    H    GLY  11           H        GLY  11   7.585  -2.365   4.067
   97    HA2  GLY  11           HA2      GLY  11   5.302  -2.545   4.323
   98    HA3  GLY  11           HA3      GLY  11   5.543  -2.607   6.077
   99    H    VAL  12           H        VAL  12   7.133   0.031   4.681
  100    HA   VAL  12           HA       VAL  12   5.384   1.802   6.024
  101    HB   VAL  12           HB       VAL  12   7.654   2.367   6.218
  102   HG11  VAL  12          HG11      VAL  12   9.093   2.892   4.330
  103   HG12  VAL  12          HG12      VAL  12   7.781   2.511   3.220
  104   HG13  VAL  12          HG13      VAL  12   8.488   1.244   4.215
  105   HG21  VAL  12          HG21      VAL  12   6.114   4.255   5.963
  106   HG22  VAL  12          HG22      VAL  12   6.481   4.273   4.236
  107   HG23  VAL  12          HG23      VAL  12   7.750   4.619   5.413
  108    H    LYS  13           H        LYS  13   4.026   3.257   5.326
  109    HA   LYS  13           HA       LYS  13   2.814   2.840   2.771
  110    HB2  LYS  13           HB2      LYS  13   2.245   5.140   4.651
  111    HB3  LYS  13           HB3      LYS  13   1.150   4.380   3.497
  112    HG2  LYS  13           HG2      LYS  13   1.050   2.383   4.862
  113    HG3  LYS  13           HG3      LYS  13   2.221   3.059   5.984
  114    HD2  LYS  13           HD2      LYS  13   0.174   3.433   7.035
  115    HD3  LYS  13           HD3      LYS  13   0.531   4.980   6.272
  116    HE2  LYS  13           HE2      LYS  13  -1.699   4.652   5.741
  117    HE3  LYS  13           HE3      LYS  13  -0.865   4.071   4.303
  118    HZ1  LYS  13           HZ1      LYS  13  -2.516   2.483   4.837
  119    HZ2  LYS  13           HZ2      LYS  13  -2.075   2.452   6.466
  120    HZ3  LYS  13           HZ3      LYS  13  -1.043   1.797   5.306
  121    H    VAL  14           H        VAL  14   4.128   3.459   1.100
  122    HA   VAL  14           HA       VAL  14   5.667   5.907   1.248
  123    HB   VAL  14           HB       VAL  14   5.497   4.695  -1.406
  124   HG11  VAL  14          HG11      VAL  14   7.181   6.307  -0.850
  125   HG12  VAL  14          HG12      VAL  14   7.950   4.754  -1.202
  126   HG13  VAL  14          HG13      VAL  14   7.767   5.288   0.474
  127   HG21  VAL  14          HG21      VAL  14   6.455   2.987   0.879
  128   HG22  VAL  14          HG22      VAL  14   6.887   2.710  -0.813
  129   HG23  VAL  14          HG23      VAL  14   5.195   2.607  -0.304
  130    H    GLY  15           H        GLY  15   2.542   5.113   0.440
  131    HA2  GLY  15           HA2      GLY  15   2.004   7.688  -0.686
  132    HA3  GLY  15           HA3      GLY  15   1.914   6.408  -1.891
  133    H    SER  16           H        SER  16   0.666   7.505   1.187
  134    HA   SER  16           HA       SER  16  -1.883   6.243   0.543
  135    HB2  SER  16           HB2      SER  16  -0.518   5.948   3.228
  136    HB3  SER  16           HB3      SER  16  -2.095   5.300   2.780
  137    HG   SER  16           HG       SER  16  -0.514   4.383   0.963
  138    H    LEU  17           H        LEU  17  -2.703   8.290   0.149
  139    HA   LEU  17           HA       LEU  17  -2.919  10.032   2.499
  140    HB2  LEU  17           HB2      LEU  17  -3.504  11.843   0.912
  141    HB3  LEU  17           HB3      LEU  17  -1.883  11.222   0.679
  142    HG   LEU  17           HG       LEU  17  -4.066  10.101  -1.019
  143   HD11  LEU  17          HD11      LEU  17  -4.452  12.522  -1.075
  144   HD12  LEU  17          HD12      LEU  17  -3.839  11.920  -2.614
  145   HD13  LEU  17          HD13      LEU  17  -2.762  12.775  -1.511
  146   HD21  LEU  17          HD21      LEU  17  -1.781   9.216  -1.158
  147   HD22  LEU  17          HD22      LEU  17  -1.184  10.829  -1.549
  148   HD23  LEU  17          HD23      LEU  17  -2.269   9.995  -2.664
  149    H    GLU  18           H        GLU  18  -4.455   7.989   0.320
  150    HA   GLU  18           HA       GLU  18  -7.043   8.590   1.533
  151    HB2  GLU  18           HB2      GLU  18  -6.513   7.627  -1.280
  152    HB3  GLU  18           HB3      GLU  18  -8.099   7.840  -0.565
  153    HG2  GLU  18           HG2      GLU  18  -7.702  10.233  -0.364
  154    HG3  GLU  18           HG3      GLU  18  -6.093  10.026  -1.051
  155    H    SER  19           H        SER  19  -5.772   6.945   3.006
  156    HA   SER  19           HA       SER  19  -6.730   4.277   2.261
  157    HB2  SER  19           HB2      SER  19  -3.956   4.737   3.369
  158    HB3  SER  19           HB3      SER  19  -4.646   3.213   2.806
  159    HG   SER  19           HG       SER  19  -4.891   4.972   0.849
  160    H    SER  20           H        SER  20  -6.045   6.641   4.664
  161    HA   SER  20           HA       SER  20  -5.952   5.049   6.961
  162    HB2  SER  20           HB2      SER  20  -5.248   7.365   7.006
  163    HB3  SER  20           HB3      SER  20  -6.874   7.907   6.610
  164    HG   SER  20           HG       SER  20  -6.291   6.393   8.934
  165    H    MET  21           H        MET  21  -8.720   7.149   6.133
  166    HA   MET  21           HA       MET  21 -10.481   5.117   7.324
  167    HB2  MET  21           HB2      MET  21 -10.964   8.074   6.980
  168    HB3  MET  21           HB3      MET  21 -11.972   6.928   7.847
  169    HG2  MET  21           HG2      MET  21  -9.138   7.595   8.574
  170    HG3  MET  21           HG3      MET  21 -10.555   8.327   9.310
  171    HE1  MET  21           HE1      MET  21  -9.414   7.562  11.685
  172    HE2  MET  21           HE2      MET  21  -8.110   6.766  10.804
  173    HE3  MET  21           HE3      MET  21  -9.003   5.886  12.046
  174    H    VAL  22           H        VAL  22  -9.555   5.257   4.560
  175    HA   VAL  22           HA       VAL  22 -11.503   6.254   2.816
  176    HB   VAL  22           HB       VAL  22  -9.247   5.678   2.060
  177   HG11  VAL  22          HG11      VAL  22  -8.846   3.682   3.354
  178   HG12  VAL  22          HG12      VAL  22  -8.631   3.340   1.636
  179   HG13  VAL  22          HG13      VAL  22 -10.099   2.820   2.462
  180   HG21  VAL  22          HG21      VAL  22  -9.868   4.504  -0.036
  181   HG22  VAL  22          HG22      VAL  22 -10.930   5.852   0.373
  182   HG23  VAL  22          HG23      VAL  22 -11.458   4.193   0.663
  183    H    SER  23           H        SER  23 -13.327   5.466   2.012
  184    HA   SER  23           HA       SER  23 -14.658   3.386   3.427
  185    HB2  SER  23           HB2      SER  23 -15.534   4.726   0.871
  186    HB3  SER  23           HB3      SER  23 -16.558   3.893   2.037
  187    HG   SER  23           HG       SER  23 -15.616   5.559   3.563
  188    H    THR  24           H        THR  24 -13.794   1.435   3.137
  189    HA   THR  24           HA       THR  24 -14.451   0.071   0.709
  190    HB   THR  24           HB       THR  24 -12.272   0.866   0.026
  191    HG1  THR  24           HG1      THR  24 -11.316  -1.133  -0.437
  192   HG21  THR  24          HG21      THR  24 -10.220   0.336   1.217
  193   HG22  THR  24          HG22      THR  24 -11.146  -0.457   2.491
  194   HG23  THR  24          HG23      THR  24 -11.301   1.280   2.242
  195    H    ASP  25           H        ASP  25 -15.678  -1.387   1.691
  196    HA   ASP  25           HA       ASP  25 -14.835  -2.479   4.279
  197    HB2  ASP  25           HB2      ASP  25 -17.069  -1.497   4.191
  198    HB3  ASP  25           HB3      ASP  25 -17.505  -2.557   2.856
  199    H    SER  26           H        SER  26 -15.437  -3.322   1.002
  200    HA   SER  26           HA       SER  26 -15.456  -6.176   1.565
  201    HB2  SER  26           HB2      SER  26 -17.103  -5.152   0.004
  202    HB3  SER  26           HB3      SER  26 -15.770  -4.693  -1.049
  203    HG   SER  26           HG       SER  26 -15.305  -6.881  -1.343
  204    H    LEU  27           H        LEU  27 -13.803  -4.014  -0.726
  205    HA   LEU  27           HA       LEU  27 -11.729  -3.924  -1.569
  206    HB2  LEU  27           HB2      LEU  27 -11.324  -4.058   1.032
  207    HB3  LEU  27           HB3      LEU  27 -10.630  -5.616   0.628
  208    HG   LEU  27           HG       LEU  27  -9.746  -3.026  -0.633
  209   HD11  LEU  27          HD11      LEU  27  -7.805  -3.163   0.866
  210   HD12  LEU  27          HD12      LEU  27  -8.569  -4.515   1.706
  211   HD13  LEU  27          HD13      LEU  27  -9.316  -2.917   1.739
  212   HD21  LEU  27          HD21      LEU  27  -7.760  -4.320  -1.261
  213   HD22  LEU  27          HD22      LEU  27  -9.231  -5.005  -1.953
  214   HD23  LEU  27          HD23      LEU  27  -8.479  -5.765  -0.548
  215    H    GLY  28           H        GLY  28 -11.826  -5.017  -3.411
  216    HA2  GLY  28           HA2      GLY  28 -11.865  -7.833  -3.673
  217    HA3  GLY  28           HA3      GLY  28 -11.473  -6.683  -4.939
  218    H    PHE  29           H        PHE  29 -10.149  -8.436  -2.192
  219    HA   PHE  29           HA       PHE  29  -7.429  -7.846  -2.690
  220    HB2  PHE  29           HB2      PHE  29  -8.779 -10.077  -1.182
  221    HB3  PHE  29           HB3      PHE  29  -7.031  -9.982  -1.330
  222    HD1  PHE  29           HD1      PHE  29  -9.944  -8.787   0.403
  223    HD2  PHE  29           HD2      PHE  29  -5.840  -8.009  -0.408
  224    HE1  PHE  29           HE1      PHE  29  -9.833  -7.320   2.376
  225    HE2  PHE  29           HE2      PHE  29  -5.722  -6.540   1.558
  226    HZ   PHE  29           HZ       PHE  29  -7.722  -6.195   2.955
  227    H    GLN  30           H        GLN  30  -8.493 -11.206  -2.828
  228    HA   GLN  30           HA       GLN  30  -7.769 -11.545  -5.571
  229    HB2  GLN  30           HB2      GLN  30  -5.903 -13.131  -5.029
  230    HB3  GLN  30           HB3      GLN  30  -5.536 -11.437  -4.784
  231    HG2  GLN  30           HG2      GLN  30  -5.839 -11.705  -2.389
  232    HG3  GLN  30           HG3      GLN  30  -6.289 -13.393  -2.618
  233   HE21  GLN  30          HE21      GLN  30  -3.693 -11.095  -2.612
  234   HE22  GLN  30          HE22      GLN  30  -2.401 -12.247  -2.635
  235    H    HIS  31           H        HIS  31  -8.230 -13.143  -2.437
  236    HA   HIS  31           HA       HIS  31 -10.154 -14.955  -3.587
  237    HB2  HIS  31           HB2      HIS  31  -7.999 -16.077  -4.091
  238    HB3  HIS  31           HB3      HIS  31  -7.604 -16.059  -2.377
  239    HD1  HIS  31           HD1      HIS  31  -8.093 -18.195  -1.231
  240    HD2  HIS  31           HD2      HIS  31 -10.599 -17.583  -4.494
  241    HE1  HIS  31           HE1      HIS  31  -9.525 -20.258  -1.386
  242    HE2  HIS  31           HE2      HIS  31 -11.085 -19.834  -3.317
  243    H    LEU  32           H        LEU  32 -10.914 -13.201  -1.846
  244    HA   LEU  32           HA       LEU  32 -10.526 -14.119   0.863
  245    HB2  LEU  32           HB2      LEU  32 -10.528 -11.708   0.261
  246    HB3  LEU  32           HB3      LEU  32 -12.192 -11.858  -0.221
  247    HG   LEU  32           HG       LEU  32 -12.744 -12.522   2.092
  248   HD11  LEU  32          HD11      LEU  32 -10.570 -13.296   2.828
  249   HD12  LEU  32          HD12      LEU  32 -11.116 -11.974   3.860
  250   HD13  LEU  32          HD13      LEU  32  -9.901 -11.679   2.617
  251   HD21  LEU  32          HD21      LEU  32 -12.593 -10.236   2.991
  252   HD22  LEU  32          HD22      LEU  32 -13.123 -10.260   1.307
  253   HD23  LEU  32          HD23      LEU  32 -11.456  -9.827   1.702
  254    H    THR  33           H        THR  33 -13.474 -13.149  -0.887
  255    HA   THR  33           HA       THR  33 -14.859 -15.564  -0.186
  256    HB   THR  33           HB       THR  33 -16.694 -14.166   0.986
  257    HG1  THR  33           HG1      THR  33 -15.131 -12.498   2.251
  258   HG21  THR  33          HG21      THR  33 -15.639 -14.470   3.196
  259   HG22  THR  33          HG22      THR  33 -14.096 -14.776   2.397
  260   HG23  THR  33          HG23      THR  33 -15.450 -15.882   2.157
  261    H    ASN  34           H        ASN  34 -17.415 -14.954  -0.584
  262    HA   ASN  34           HA       ASN  34 -17.591 -14.162  -3.310
  263    HB2  ASN  34           HB2      ASN  34 -19.703 -14.571  -1.186
  264    HB3  ASN  34           HB3      ASN  34 -20.096 -14.101  -2.834
  265   HD21  ASN  34          HD21      ASN  34 -17.469 -16.274  -2.030
  266   HD22  ASN  34          HD22      ASN  34 -18.184 -17.692  -2.707
  267    H    GLU  35           H        GLU  35 -17.826 -12.521  -0.271
  268    HA   GLU  35           HA       GLU  35 -18.992 -10.090  -0.980
  269    HB2  GLU  35           HB2      GLU  35 -16.620 -10.409   0.866
  270    HB3  GLU  35           HB3      GLU  35 -17.864  -9.167   0.931
  271    HG2  GLU  35           HG2      GLU  35 -19.505 -10.867   1.508
  272    HG3  GLU  35           HG3      GLU  35 -18.252 -12.095   1.474
  273    H    GLU  36           H        GLU  36 -15.592 -10.989  -0.855
  274    HA   GLU  36           HA       GLU  36 -14.414  -8.708  -1.852
  275    HB2  GLU  36           HB2      GLU  36 -13.075 -10.421  -0.944
  276    HB3  GLU  36           HB3      GLU  36 -13.672 -11.611  -2.090
  277    HG2  GLU  36           HG2      GLU  36 -12.572 -10.144  -3.878
  278    HG3  GLU  36           HG3      GLU  36 -11.723  -9.386  -2.529
  279    H    ARG  37           H        ARG  37 -15.710 -11.445  -3.686
  280    HA   ARG  37           HA       ARG  37 -14.761 -10.768  -6.209
  281    HB2  ARG  37           HB2      ARG  37 -17.337 -12.173  -5.483
  282    HB3  ARG  37           HB3      ARG  37 -16.620 -12.150  -7.088
  283    HG2  ARG  37           HG2      ARG  37 -14.651 -13.312  -6.228
  284    HG3  ARG  37           HG3      ARG  37 -15.370 -13.334  -4.617
  285    HD2  ARG  37           HD2      ARG  37 -17.253 -14.645  -5.497
  286    HD3  ARG  37           HD3      ARG  37 -16.491 -14.653  -7.087
  287    HE   ARG  37           HE       ARG  37 -14.576 -15.694  -5.494
  288   HH11  ARG  37          HH11      ARG  37 -17.945 -16.468  -6.000
  289   HH12  ARG  37          HH12      ARG  37 -17.754 -18.147  -5.608
  290   HH21  ARG  37          HH21      ARG  37 -14.307 -17.898  -4.986
  291   HH22  ARG  37          HH22      ARG  37 -15.680 -18.962  -5.024
  292    H    ASN  38           H        ASN  38 -17.610  -9.606  -4.495
  293    HA   ASN  38           HA       ASN  38 -18.865  -8.363  -6.704
  294    HB2  ASN  38           HB2      ASN  38 -19.940  -8.902  -4.484
  295    HB3  ASN  38           HB3      ASN  38 -19.078  -7.531  -3.802
  296   HD21  ASN  38          HD21      ASN  38 -21.961  -8.097  -4.130
  297   HD22  ASN  38          HD22      ASN  38 -22.603  -6.730  -4.973
  298    H    ASP  39           H        ASP  39 -16.547  -7.210  -4.301
  299    HA   ASP  39           HA       ASP  39 -16.562  -4.512  -5.281
  300    HB2  ASP  39           HB2      ASP  39 -16.044  -5.026  -2.935
  301    HB3  ASP  39           HB3      ASP  39 -14.604  -5.903  -3.441
  302    H    MET  40           H        MET  40 -14.547  -7.353  -5.705
  303    HA   MET  40           HA       MET  40 -12.412  -6.121  -7.073
  304    HB2  MET  40           HB2      MET  40 -12.223  -8.363  -6.113
  305    HB3  MET  40           HB3      MET  40 -13.419  -8.967  -7.250
  306    HG2  MET  40           HG2      MET  40 -11.900  -8.408  -9.106
  307    HG3  MET  40           HG3      MET  40 -10.692  -7.890  -7.932
  308    HE1  MET  40           HE1      MET  40  -9.559  -9.508  -6.179
  309    HE2  MET  40           HE2      MET  40  -9.868 -11.242  -6.087
  310    HE3  MET  40           HE3      MET  40 -11.123 -10.096  -5.616
  311    H    ILE  41           H        ILE  41 -15.398  -7.623  -8.217
  312    HA   ILE  41           HA       ILE  41 -14.764  -7.229 -10.976
  313    HB   ILE  41           HB       ILE  41 -17.343  -7.948  -9.595
  314   HG12  ILE  41          HG12      ILE  41 -15.831  -9.737  -9.417
  315   HG13  ILE  41          HG13      ILE  41 -16.831 -10.114 -10.803
  316   HG21  ILE  41          HG21      ILE  41 -17.870  -6.808 -11.691
  317   HG22  ILE  41          HG22      ILE  41 -18.246  -8.528 -11.787
  318   HG23  ILE  41          HG23      ILE  41 -16.791  -7.899 -12.560
  319   HD11  ILE  41          HD11      ILE  41 -14.036  -9.042 -10.873
  320   HD12  ILE  41          HD12      ILE  41 -15.058  -9.284 -12.290
  321   HD13  ILE  41          HD13      ILE  41 -14.567 -10.665 -11.311
  322    H    SER  42           H        SER  42 -15.951  -5.871 -12.425
  323    HA   SER  42           HA       SER  42 -16.120  -3.779 -13.188
  324    HB2  SER  42           HB2      SER  42 -17.776  -2.273 -12.156
  325    HB3  SER  42           HB3      SER  42 -18.408  -3.903 -12.344
  326    HG   SER  42           HG       SER  42 -17.333  -3.836  -9.961
  327    H    TYR  43           H        TYR  43 -14.104  -4.603 -11.133
  328    HA   TYR  43           HA       TYR  43 -12.061  -3.667 -10.678
  329    HB2  TYR  43           HB2      TYR  43 -12.546  -2.162 -12.638
  330    HB3  TYR  43           HB3      TYR  43 -13.205  -0.995 -11.501
  331    HD1  TYR  43           HD1      TYR  43 -11.759   0.375 -10.161
  332    HD2  TYR  43           HD2      TYR  43 -10.137  -2.667 -12.650
  333    HE1  TYR  43           HE1      TYR  43  -9.517   1.334  -9.863
  334    HE2  TYR  43           HE2      TYR  43  -7.888  -1.718 -12.355
  335    HH   TYR  43           HH       TYR  43  -7.209   0.720 -10.023
  336    H    LYS  44           H        LYS  44 -11.062  -2.779  -8.868
  337    HA   LYS  44           HA       LYS  44 -12.775  -2.224  -6.633
  338    HB2  LYS  44           HB2      LYS  44  -9.768  -2.198  -6.896
  339    HB3  LYS  44           HB3      LYS  44 -10.608  -1.864  -5.394
  340    HG2  LYS  44           HG2      LYS  44 -10.035  -4.079  -5.168
  341    HG3  LYS  44           HG3      LYS  44 -11.690  -4.180  -5.762
  342    HD2  LYS  44           HD2      LYS  44 -10.369  -5.787  -6.946
  343    HD3  LYS  44           HD3      LYS  44 -10.770  -4.481  -8.062
  344    HE2  LYS  44           HE2      LYS  44  -8.443  -5.159  -8.312
  345    HE3  LYS  44           HE3      LYS  44  -8.552  -3.506  -7.716
  346    HZ1  LYS  44           HZ1      LYS  44  -7.993  -4.231  -5.534
  347    HZ2  LYS  44           HZ2      LYS  44  -6.858  -4.903  -6.592
  348    HZ3  LYS  44           HZ3      LYS  44  -8.104  -5.865  -5.969
  349    H    GLU  45           H        GLU  45 -13.856  -0.340  -7.190
  350    HA   GLU  45           HA       GLU  45 -12.592   1.963  -8.232
  351    HB2  GLU  45           HB2      GLU  45 -15.300   1.526  -6.985
  352    HB3  GLU  45           HB3      GLU  45 -14.790   3.065  -7.641
  353    HG2  GLU  45           HG2      GLU  45 -14.865   0.541  -9.208
  354    HG3  GLU  45           HG3      GLU  45 -16.172   1.712  -9.175
  355    H    ASN  46           H        ASN  46 -12.620   0.750  -5.083
  356    HA   ASN  46           HA       ASN  46 -12.648   3.294  -3.738
  357    HB2  ASN  46           HB2      ASN  46 -11.523   0.845  -2.439
  358    HB3  ASN  46           HB3      ASN  46 -12.499   2.131  -1.739
  359   HD21  ASN  46          HD21      ASN  46 -12.466  -0.899  -3.314
  360   HD22  ASN  46          HD22      ASN  46 -14.180  -1.208  -3.260
  361    H    GLY  47           H        GLY  47 -10.379   1.610  -5.547
  362    HA2  GLY  47           HA2      GLY  47  -8.258   2.468  -6.121
  363    HA3  GLY  47           HA3      GLY  47  -8.266   3.414  -4.628
  364    H    ASP  48           H        ASP  48  -9.048   0.019  -4.692
  365    HA   ASP  48           HA       ASP  48  -7.096  -0.414  -2.623
  366    HB2  ASP  48           HB2      ASP  48  -8.903  -2.476  -3.878
  367    HB3  ASP  48           HB3      ASP  48  -8.159  -2.523  -2.284
  368    H    VAL  49           H        VAL  49  -5.337   0.063  -4.339
  369    HA   VAL  49           HA       VAL  49  -4.462  -2.547  -5.382
  370    HB   VAL  49           HB       VAL  49  -3.248   0.025  -6.295
  371   HG11  VAL  49          HG11      VAL  49  -2.093  -2.110  -6.713
  372   HG12  VAL  49          HG12      VAL  49  -2.592  -1.310  -8.204
  373   HG13  VAL  49          HG13      VAL  49  -3.513  -2.683  -7.590
  374   HG21  VAL  49          HG21      VAL  49  -5.615  -1.351  -7.565
  375   HG22  VAL  49          HG22      VAL  49  -4.744   0.034  -8.221
  376   HG23  VAL  49          HG23      VAL  49  -5.663   0.201  -6.724
  377    H    HIS  50           H        HIS  50  -3.490  -3.333  -3.615
  378    HA   HIS  50           HA       HIS  50  -1.705  -1.746  -1.990
  379    HB2  HIS  50           HB2      HIS  50  -3.272  -3.457  -1.058
  380    HB3  HIS  50           HB3      HIS  50  -2.358  -4.703  -1.888
  381    HD1  HIS  50           HD1      HIS  50  -2.691  -3.174   1.303
  382    HD2  HIS  50           HD2      HIS  50   0.498  -4.694  -0.886
  383    HE1  HIS  50           HE1      HIS  50  -0.893  -3.671   2.985
  384    HE2  HIS  50           HE2      HIS  50   0.949  -4.763   1.659
  385    H    VAL  51           H        VAL  51   0.043  -1.240  -3.295
  386    HA   VAL  51           HA       VAL  51   1.495  -3.488  -4.502
  387    HB   VAL  51           HB       VAL  51   2.816  -1.598  -5.638
  388   HG11  VAL  51          HG11      VAL  51  -0.091  -2.019  -6.306
  389   HG12  VAL  51          HG12      VAL  51   1.253  -3.034  -6.820
  390   HG13  VAL  51          HG13      VAL  51   1.131  -1.375  -7.401
  391   HG21  VAL  51          HG21      VAL  51   1.679   0.510  -5.896
  392   HG22  VAL  51          HG22      VAL  51   2.006   0.202  -4.190
  393   HG23  VAL  51          HG23      VAL  51   0.380  -0.030  -4.835
  394    H    LEU  52           H        LEU  52   3.460  -4.057  -3.852
  395    HA   LEU  52           HA       LEU  52   4.625  -2.596  -1.605
  396    HB2  LEU  52           HB2      LEU  52   5.250  -5.342  -2.699
  397    HB3  LEU  52           HB3      LEU  52   6.008  -4.617  -1.290
  398    HG   LEU  52           HG       LEU  52   3.093  -5.357  -1.556
  399   HD11  LEU  52          HD11      LEU  52   5.269  -6.512   0.173
  400   HD12  LEU  52          HD12      LEU  52   4.602  -7.263  -1.276
  401   HD13  LEU  52          HD13      LEU  52   3.579  -7.014   0.137
  402   HD21  LEU  52          HD21      LEU  52   3.329  -3.358  -0.217
  403   HD22  LEU  52          HD22      LEU  52   4.602  -4.116   0.737
  404   HD23  LEU  52          HD23      LEU  52   2.955  -4.733   0.817
  405    H    THR  53           H        THR  53   6.018  -1.105  -2.146
  406    HA   THR  53           HA       THR  53   7.765  -1.569  -4.469
  407    HB   THR  53           HB       THR  53   5.918   0.013  -4.986
  408    HG1  THR  53           HG1      THR  53   7.273   1.076  -6.212
  409   HG21  THR  53          HG21      THR  53   7.194   1.726  -2.855
  410   HG22  THR  53          HG22      THR  53   5.595   0.985  -2.781
  411   HG23  THR  53          HG23      THR  53   5.927   2.248  -3.966
  412    H    ILE  54           H        ILE  54   9.419   0.462  -4.394
  413    HA   ILE  54           HA       ILE  54  10.950   0.021  -1.962
  414    HB   ILE  54           HB       ILE  54  11.555   1.237  -4.643
  415   HG12  ILE  54          HG12      ILE  54  13.046  -0.891  -3.129
  416   HG13  ILE  54          HG13      ILE  54  11.677  -1.241  -4.163
  417   HG21  ILE  54          HG21      ILE  54  13.329   1.360  -2.222
  418   HG22  ILE  54          HG22      ILE  54  12.589   2.729  -3.054
  419   HG23  ILE  54          HG23      ILE  54  13.817   1.759  -3.869
  420   HD11  ILE  54          HD11      ILE  54  14.183   0.133  -5.080
  421   HD12  ILE  54          HD12      ILE  54  12.840  -0.405  -6.091
  422   HD13  ILE  54          HD13      ILE  54  13.854  -1.590  -5.264
  423    H    CYS  55           H        CYS  55  10.973   1.431  -0.314
  424    HA   CYS  55           HA       CYS  55   9.720   4.012  -0.604
  425    HB2  CYS  55           HB2      CYS  55   9.940   4.256   1.764
  426    HB3  CYS  55           HB3      CYS  55   9.462   2.592   1.465
  427    H    GLU  56           H        GLU  56  10.901   5.972   0.347
  428    HA   GLU  56           HA       GLU  56  13.109   6.621  -1.223
  429    HB2  GLU  56           HB2      GLU  56  11.645   8.258  -0.100
  430    HB3  GLU  56           HB3      GLU  56  12.287   7.772   1.459
  431    HG2  GLU  56           HG2      GLU  56  14.479   8.595   0.826
  432    HG3  GLU  56           HG3      GLU  56  13.862   9.054  -0.760
  433    H    ASP  57           H        ASP  57  12.978   5.416   2.110
  434    HA   ASP  57           HA       ASP  57  15.752   5.644   2.607
  435    HB2  ASP  57           HB2      ASP  57  14.181   5.475   4.447
  436    HB3  ASP  57           HB3      ASP  57  13.677   3.874   3.913
  437    H    CYS  58           H        CYS  58  13.775   3.065   1.247
  438    HA   CYS  58           HA       CYS  58  15.871   1.138   1.204
  439    HB2  CYS  58           HB2      CYS  58  13.205   1.356  -0.112
  440    HB3  CYS  58           HB3      CYS  58  14.345   0.145  -0.685
  441    H    GLN  59           H        GLN  59  14.440   3.050  -1.462
  442    HA   GLN  59           HA       GLN  59  16.222   2.665  -3.440
  443    HB2  GLN  59           HB2      GLN  59  14.146   4.347  -3.076
  444    HB3  GLN  59           HB3      GLN  59  15.477   5.492  -3.057
  445    HG2  GLN  59           HG2      GLN  59  14.882   3.524  -5.262
  446    HG3  GLN  59           HG3      GLN  59  14.507   5.242  -5.282
  447   HE21  GLN  59          HE21      GLN  59  16.187   6.740  -5.415
  448   HE22  GLN  59          HE22      GLN  59  17.742   6.296  -6.007
  449    H    GLU  60           H        GLU  60  16.671   4.680  -0.579
  450    HA   GLU  60           HA       GLU  60  19.043   5.922  -1.300
  451    HB2  GLU  60           HB2      GLU  60  17.474   6.018   0.844
  452    HB3  GLU  60           HB3      GLU  60  18.756   5.034   1.498
  453    HG2  GLU  60           HG2      GLU  60  19.124   7.363   1.988
  454    HG3  GLU  60           HG3      GLU  60  20.348   6.727   0.910
  455    H    ALA  61           H        ALA  61  18.625   2.976   0.664
  456    HA   ALA  61           HA       ALA  61  21.333   2.171   0.595
  457    HB1  ALA  61           HB1      ALA  61  18.908   0.391   0.856
  458    HB2  ALA  61           HB2      ALA  61  19.621   1.299   2.186
  459    HB3  ALA  61           HB3      ALA  61  20.553   0.033   1.388
  460    H    LEU  62           H        LEU  62  18.677   1.848  -1.520
  461    HA   LEU  62           HA       LEU  62  19.308  -0.402  -3.065
  462    HB2  LEU  62           HB2      LEU  62  17.504   1.748  -2.909
  463    HB3  LEU  62           HB3      LEU  62  18.029   1.662  -4.568
  464    HG   LEU  62           HG       LEU  62  15.946   0.539  -4.245
  465   HD11  LEU  62          HD11      LEU  62  18.133  -1.446  -4.713
  466   HD12  LEU  62          HD12      LEU  62  17.491  -0.310  -5.897
  467   HD13  LEU  62          HD13      LEU  62  16.450  -1.580  -5.237
  468   HD21  LEU  62          HD21      LEU  62  17.331  -1.339  -2.352
  469   HD22  LEU  62          HD22      LEU  62  15.633  -1.373  -2.845
  470   HD23  LEU  62          HD23      LEU  62  16.246  -0.032  -1.866
  471    H    ASP  63           H        ASP  63  19.576   3.008  -4.023
  472    HA   ASP  63           HA       ASP  63  21.155   2.395  -6.326
  473    HB2  ASP  63           HB2      ASP  63  19.612   4.241  -6.419
  474    HB3  ASP  63           HB3      ASP  63  20.409   5.047  -5.076
  475    H    ARG  64           H        ARG  64  21.862   3.659  -3.139
  476    HA   ARG  64           HA       ARG  64  24.529   4.492  -3.750
  477    HB2  ARG  64           HB2      ARG  64  23.018   5.360  -1.893
  478    HB3  ARG  64           HB3      ARG  64  23.394   3.880  -1.026
  479    HG2  ARG  64           HG2      ARG  64  24.786   5.688  -0.244
  480    HG3  ARG  64           HG3      ARG  64  25.769   4.468  -1.058
  481    HD2  ARG  64           HD2      ARG  64  25.875   5.813  -3.050
  482    HD3  ARG  64           HD3      ARG  64  24.762   6.991  -2.360
  483    HE   ARG  64           HE       ARG  64  26.853   6.924  -0.613
  484   HH11  ARG  64          HH11      ARG  64  26.500   7.465  -4.043
  485   HH12  ARG  64          HH12      ARG  64  27.841   8.560  -4.145
  486   HH21  ARG  64          HH21      ARG  64  28.637   8.359  -0.738
  487   HH22  ARG  64          HH22      ARG  64  29.050   9.075  -2.265
  488    H    ASN  65           H        ASN  65  23.043   1.610  -2.418
  489    HA   ASN  65           HA       ASN  65  23.832  -0.405  -1.745
  490    HB2  ASN  65           HB2      ASN  65  25.920   0.198  -3.846
  491    HB3  ASN  65           HB3      ASN  65  25.684  -1.372  -3.087
  492   HD21  ASN  65          HD21      ASN  65  24.497   0.900  -5.389
  493   HD22  ASN  65          HD22      ASN  65  23.270  -0.108  -6.068
  494    HA   PRO  66           HA       PRO  66  27.239   1.284   0.908
  495    HB2  PRO  66           HB2      PRO  66  25.469   1.435   3.158
  496    HB3  PRO  66           HB3      PRO  66  26.249   2.766   2.304
  497    HG2  PRO  66           HG2      PRO  66  23.532   2.289   2.308
  498    HG3  PRO  66           HG3      PRO  66  24.387   3.221   1.070
  499    HD2  PRO  66           HD2      PRO  66  23.475   0.372   1.014
  500    HD3  PRO  66           HD3      PRO  66  23.447   1.592  -0.279
  501    H    HIS  67           H        HIS  67  24.738  -0.291   2.852
  502    HA   HIS  67           HA       HIS  67  26.366  -2.737   2.872
  503    HB2  HIS  67           HB2      HIS  67  25.038  -1.382   5.214
  504    HB3  HIS  67           HB3      HIS  67  25.523  -3.073   5.257
  505    HD1  HIS  67           HD1      HIS  67  27.867  -3.521   5.963
  506    HD2  HIS  67           HD2      HIS  67  27.330   0.408   4.711
  507    HE1  HIS  67           HE1      HIS  67  30.057  -2.359   6.396
  508    HE2  HIS  67           HE2      HIS  67  29.677   0.038   5.726
  509    H    TYR  68           H        TYR  68  23.199  -1.292   3.074
  510    HA   TYR  68           HA       TYR  68  21.151  -1.906   2.520
  511    HB2  TYR  68           HB2      TYR  68  20.899  -3.525   0.571
  512    HB3  TYR  68           HB3      TYR  68  21.781  -2.035   0.301
  513    HD1  TYR  68           HD1      TYR  68  22.071  -5.692   0.603
  514    HD2  TYR  68           HD2      TYR  68  24.116  -2.068  -0.277
  515    HE1  TYR  68           HE1      TYR  68  23.931  -6.981  -0.353
  516    HE2  TYR  68           HE2      TYR  68  25.985  -3.347  -1.230
  517    HH   TYR  68           HH       TYR  68  26.952  -5.611  -1.050
  518    H    HIS  69           H        HIS  69  22.824  -5.027   2.668
  519    HA   HIS  69           HA       HIS  69  20.616  -6.569   3.402
  520    HB2  HIS  69           HB2      HIS  69  22.622  -7.640   2.647
  521    HB3  HIS  69           HB3      HIS  69  23.574  -6.895   3.924
  522    HD1  HIS  69           HD1      HIS  69  24.170  -8.497   5.692
  523    HD2  HIS  69           HD2      HIS  69  20.502  -9.415   3.963
  524    HE1  HIS  69           HE1      HIS  69  23.378 -10.583   6.849
  525    HE2  HIS  69           HE2      HIS  69  21.154 -11.119   5.793
  526    H    GLU  70           H        GLU  70  22.916  -4.774   5.356
  527    HA   GLU  70           HA       GLU  70  21.087  -4.895   7.617
  528    HB2  GLU  70           HB2      GLU  70  23.050  -5.372   9.138
  529    HB3  GLU  70           HB3      GLU  70  22.534  -6.723   8.137
  530    HG2  GLU  70           HG2      GLU  70  24.346  -6.255   6.571
  531    HG3  GLU  70           HG3      GLU  70  24.867  -4.909   7.581
  532    H    TYR  71           H        TYR  71  21.335  -3.138   9.048
  533    HA   TYR  71           HA       TYR  71  22.441  -0.815   7.757
  534    HB2  TYR  71           HB2      TYR  71  20.278  -0.645   8.889
  535    HB3  TYR  71           HB3      TYR  71  21.027  -1.094  10.419
  536    HD1  TYR  71           HD1      TYR  71  21.164   1.496   7.743
  537    HD2  TYR  71           HD2      TYR  71  21.849   0.569  11.839
  538    HE1  TYR  71           HE1      TYR  71  21.654   3.863   8.191
  539    HE2  TYR  71           HE2      TYR  71  22.339   2.933  12.298
  540    HH   TYR  71           HH       TYR  71  23.099   4.919  11.091
  541    H    HIS  72           H        HIS  72  24.544  -0.594   7.827
  542    HA   HIS  72           HA       HIS  72  26.606  -0.106   8.597
  543    HB2  HIS  72           HB2      HIS  72  25.303   1.421  10.106
  544    HB3  HIS  72           HB3      HIS  72  25.357   0.161  11.333
  545    HD1  HIS  72           HD1      HIS  72  27.298   2.922   9.897
  546    HD2  HIS  72           HD2      HIS  72  28.017  -0.365  12.338
  547    HE1  HIS  72           HE1      HIS  72  29.548   3.331  10.938
  548    HE2  HIS  72           HE2      HIS  72  30.016   1.276  12.317
  549    H    THR  73           H        THR  73  27.723  -1.937   8.297
  550    HA   THR  73           HA       THR  73  27.709  -4.023  10.320
  551    HB   THR  73           HB       THR  73  29.454  -3.841   7.855
  552    HG1  THR  73           HG1      THR  73  26.971  -5.232   8.143
  553   HG21  THR  73          HG21      THR  73  29.601  -6.276   8.108
  554   HG22  THR  73          HG22      THR  73  28.596  -6.191   9.554
  555   HG23  THR  73          HG23      THR  73  30.197  -5.452   9.549
  Start of MODEL   12
    1    H1   GLN  -1           H1       GLN  -1  -1.079   9.525 -14.828
    2    H2   GLN  -1           H2       GLN  -1  -1.835   9.330 -13.331
    3    H3   GLN  -1           H3       GLN  -1  -0.180   9.022 -13.488
    4    HA   GLN  -1           HA       GLN  -1   0.257  11.324 -13.960
    5    HB2  GLN  -1           HB2      GLN  -1  -2.682  11.754 -13.378
    6    HB3  GLN  -1           HB3      GLN  -1  -1.501  12.994 -13.773
    7    HG2  GLN  -1           HG2      GLN  -1  -2.507  10.818 -15.590
    8    HG3  GLN  -1           HG3      GLN  -1  -2.878  12.537 -15.686
    9   HE21  GLN  -1          HE21      GLN  -1  -1.350  13.953 -16.508
   10   HE22  GLN  -1          HE22      GLN  -1   0.060  13.408 -17.351
   11    H    SER   0           H        SER   0  -2.452  11.235 -11.674
   12    HA   SER   0           HA       SER   0  -0.633  11.793  -9.479
   13    HB2  SER   0           HB2      SER   0  -2.901  11.832  -8.210
   14    HB3  SER   0           HB3      SER   0  -2.575  13.118  -9.370
   15    HG   SER   0           HG       SER   0  -4.668  11.654  -9.356
   16    H    MET   1           H        MET   1  -0.651  10.475  -7.521
   17    HA   MET   1           HA       MET   1  -0.448   7.716  -8.149
   18    HB2  MET   1           HB2      MET   1  -0.642   8.766  -5.351
   19    HB3  MET   1           HB3      MET   1   0.187   7.335  -5.910
   20    HG2  MET   1           HG2      MET   1   1.853   8.909  -5.364
   21    HG3  MET   1           HG3      MET   1   1.784   8.827  -7.122
   22    HE1  MET   1           HE1      MET   1   2.727  12.583  -6.281
   23    HE2  MET   1           HE2      MET   1   3.245  11.122  -7.120
   24    HE3  MET   1           HE3      MET   1   3.189  11.154  -5.358
   25    H    ALA   2           H        ALA   2  -1.840   6.162  -7.976
   26    HA   ALA   2           HA       ALA   2  -4.488   6.706  -6.817
   27    HB1  ALA   2           HB1      ALA   2  -5.507   5.409  -8.581
   28    HB2  ALA   2           HB2      ALA   2  -3.923   5.029  -9.254
   29    HB3  ALA   2           HB3      ALA   2  -4.519   6.686  -9.288
   30    H    LEU   3           H        LEU   3  -1.856   4.519  -7.172
   31    HA   LEU   3           HA       LEU   3  -3.309   2.344  -5.885
   32    HB2  LEU   3           HB2      LEU   3  -0.506   2.465  -7.011
   33    HB3  LEU   3           HB3      LEU   3  -1.234   1.049  -6.299
   34    HG   LEU   3           HG       LEU   3  -3.060   1.370  -8.110
   35   HD11  LEU   3          HD11      LEU   3  -2.196   2.379 -10.146
   36   HD12  LEU   3          HD12      LEU   3  -0.749   2.873  -9.264
   37   HD13  LEU   3          HD13      LEU   3  -2.319   3.533  -8.819
   38   HD21  LEU   3          HD21      LEU   3  -1.744   0.016  -9.685
   39   HD22  LEU   3          HD22      LEU   3  -1.563  -0.545  -8.023
   40   HD23  LEU   3          HD23      LEU   3  -0.281   0.402  -8.779
   41    H    HIS   4           H        HIS   4  -2.698   1.477  -3.957
   42    HA   HIS   4           HA       HIS   4  -1.592   3.426  -2.127
   43    HB2  HIS   4           HB2      HIS   4  -2.761   0.692  -1.722
   44    HB3  HIS   4           HB3      HIS   4  -2.044   1.601  -0.415
   45    HD1  HIS   4           HD1      HIS   4  -3.855   2.470   0.987
   46    HD2  HIS   4           HD2      HIS   4  -4.790   2.752  -3.056
   47    HE1  HIS   4           HE1      HIS   4  -6.113   3.569   0.891
   48    HE2  HIS   4           HE2      HIS   4  -6.627   3.824  -1.560
   49    H    TYR   5           H        TYR   5   0.389   3.497  -1.501
   50    HA   TYR   5           HA       TYR   5   2.264   1.472  -2.454
   51    HB2  TYR   5           HB2      TYR   5   2.421   4.377  -1.843
   52    HB3  TYR   5           HB3      TYR   5   3.876   3.422  -1.555
   53    HD1  TYR   5           HD1      TYR   5   4.990   4.860  -3.211
   54    HD2  TYR   5           HD2      TYR   5   1.729   2.351  -4.291
   55    HE1  TYR   5           HE1      TYR   5   5.630   5.055  -5.570
   56    HE2  TYR   5           HE2      TYR   5   2.357   2.549  -6.656
   57    HH   TYR   5           HH       TYR   5   3.592   4.065  -8.114
   58    H    TYR   6           H        TYR   6   2.935  -0.010  -1.079
   59    HA   TYR   6           HA       TYR   6   3.609   0.840   1.655
   60    HB2  TYR   6           HB2      TYR   6   2.380  -1.827   0.896
   61    HB3  TYR   6           HB3      TYR   6   2.906  -1.353   2.511
   62    HD1  TYR   6           HD1      TYR   6   1.700   0.511   3.699
   63    HD2  TYR   6           HD2      TYR   6   0.256  -1.170   0.064
   64    HE1  TYR   6           HE1      TYR   6  -0.513   1.492   4.127
   65    HE2  TYR   6           HE2      TYR   6  -1.955  -0.193   0.487
   66    HH   TYR   6           HH       TYR   6  -2.503   2.182   2.848
   67    H    CYS   7           H        CYS   7   5.611   0.096   2.376
   68    HA   CYS   7           HA       CYS   7   7.300  -0.394   0.131
   69    HB2  CYS   7           HB2      CYS   7   7.963   1.186   1.942
   70    HB3  CYS   7           HB3      CYS   7   8.207  -0.199   2.986
   71    H    ARG   8           H        ARG   8   8.421  -2.003  -0.471
   72    HA   ARG   8           HA       ARG   8   8.259  -4.632   0.442
   73    HB2  ARG   8           HB2      ARG   8   9.077  -3.933  -1.779
   74    HB3  ARG   8           HB3      ARG   8  10.484  -3.190  -1.039
   75    HG2  ARG   8           HG2      ARG   8   9.942  -6.117  -0.730
   76    HG3  ARG   8           HG3      ARG   8  10.721  -5.478  -2.180
   77    HD2  ARG   8           HD2      ARG   8  11.698  -5.236   0.663
   78    HD3  ARG   8           HD3      ARG   8  12.396  -6.228  -0.612
   79    HE   ARG   8           HE       ARG   8  12.422  -3.598  -1.519
   80   HH11  ARG   8          HH11      ARG   8  13.852  -5.476   1.069
   81   HH12  ARG   8          HH12      ARG   8  15.287  -4.500   1.155
   82   HH21  ARG   8          HH21      ARG   8  14.329  -2.324  -1.409
   83   HH22  ARG   8          HH22      ARG   8  15.553  -2.718  -0.246
   84    H    HIS   9           H        HIS   9   8.781  -5.271   2.408
   85    HA   HIS   9           HA       HIS   9  10.231  -6.076   3.990
   86    HB2  HIS   9           HB2      HIS   9  12.154  -5.672   2.477
   87    HB3  HIS   9           HB3      HIS   9  12.247  -4.020   3.072
   88    HD1  HIS   9           HD1      HIS   9  14.053  -3.767   4.743
   89    HD2  HIS   9           HD2      HIS   9  12.312  -7.540   4.898
   90    HE1  HIS   9           HE1      HIS   9  15.288  -5.009   6.546
   91    HE2  HIS   9           HE2      HIS   9  14.150  -7.253   6.696
   92    H    CYS  10           H        CYS  10  10.247  -2.528   3.646
   93    HA   CYS  10           HA       CYS  10  10.366  -2.070   6.459
   94    HB2  CYS  10           HB2      CYS  10   9.328  -0.286   4.272
   95    HB3  CYS  10           HB3      CYS  10   9.641   0.230   5.916
   96    H    GLY  11           H        GLY  11   7.771  -2.343   4.103
   97    HA2  GLY  11           HA2      GLY  11   5.509  -2.661   4.384
   98    HA3  GLY  11           HA3      GLY  11   5.781  -2.762   6.131
   99    H    VAL  12           H        VAL  12   7.190   0.002   4.771
  100    HA   VAL  12           HA       VAL  12   5.430   1.631   6.263
  101    HB   VAL  12           HB       VAL  12   7.651   2.334   6.386
  102   HG11  VAL  12          HG11      VAL  12   9.043   2.919   4.502
  103   HG12  VAL  12          HG12      VAL  12   7.720   2.568   3.390
  104   HG13  VAL  12          HG13      VAL  12   8.460   1.268   4.317
  105   HG21  VAL  12          HG21      VAL  12   7.624   4.595   5.557
  106   HG22  VAL  12          HG22      VAL  12   6.050   4.154   6.220
  107   HG23  VAL  12          HG23      VAL  12   6.299   4.183   4.475
  108    H    LYS  13           H        LYS  13   3.938   3.018   5.689
  109    HA   LYS  13           HA       LYS  13   2.629   2.683   3.188
  110    HB2  LYS  13           HB2      LYS  13   2.185   4.833   5.269
  111    HB3  LYS  13           HB3      LYS  13   1.069   4.379   3.996
  112    HG2  LYS  13           HG2      LYS  13   0.135   3.307   5.768
  113    HG3  LYS  13           HG3      LYS  13   1.196   2.031   5.181
  114    HD2  LYS  13           HD2      LYS  13   2.840   2.561   6.861
  115    HD3  LYS  13           HD3      LYS  13   1.920   3.976   7.373
  116    HE2  LYS  13           HE2      LYS  13   0.985   1.113   7.573
  117    HE3  LYS  13           HE3      LYS  13   1.651   2.061   8.900
  118    HZ1  LYS  13           HZ1      LYS  13  -0.823   2.730   7.396
  119    HZ2  LYS  13           HZ2      LYS  13  -0.201   3.588   8.714
  120    HZ3  LYS  13           HZ3      LYS  13  -0.777   2.015   8.926
  121    H    VAL  14           H        VAL  14   3.860   3.342   1.483
  122    HA   VAL  14           HA       VAL  14   5.119   5.971   1.571
  123    HB   VAL  14           HB       VAL  14   5.422   4.822  -1.011
  124   HG11  VAL  14          HG11      VAL  14   7.349   5.149   1.282
  125   HG12  VAL  14          HG12      VAL  14   6.973   6.352   0.052
  126   HG13  VAL  14          HG13      VAL  14   7.797   4.863  -0.396
  127   HG21  VAL  14          HG21      VAL  14   6.110   2.894   1.212
  128   HG22  VAL  14          HG22      VAL  14   6.602   2.739  -0.474
  129   HG23  VAL  14          HG23      VAL  14   4.897   2.643  -0.043
  130    H    GLY  15           H        GLY  15   2.134   4.894   0.957
  131    HA2  GLY  15           HA2      GLY  15   1.612   6.546  -1.393
  132    HA3  GLY  15           HA3      GLY  15   0.452   5.515  -0.565
  133    H    SER  16           H        SER  16   2.539   7.793   1.028
  134    HA   SER  16           HA       SER  16   2.204   9.648   2.251
  135    HB2  SER  16           HB2      SER  16   1.178  10.615   0.227
  136    HB3  SER  16           HB3      SER  16  -0.388   9.970   0.724
  137    HG   SER  16           HG       SER  16   0.612  12.277   1.387
  138    H    LEU  17           H        LEU  17   1.895   9.409   4.297
  139    HA   LEU  17           HA       LEU  17  -0.565   8.171   5.313
  140    HB2  LEU  17           HB2      LEU  17   0.673   8.013   7.445
  141    HB3  LEU  17           HB3      LEU  17   1.473   7.173   6.130
  142    HG   LEU  17           HG       LEU  17   2.380   9.942   6.501
  143   HD11  LEU  17          HD11      LEU  17   3.724   9.445   8.471
  144   HD12  LEU  17          HD12      LEU  17   2.937   7.875   8.619
  145   HD13  LEU  17          HD13      LEU  17   2.002   9.355   8.832
  146   HD21  LEU  17          HD21      LEU  17   3.447   8.402   4.957
  147   HD22  LEU  17          HD22      LEU  17   3.775   7.279   6.273
  148   HD23  LEU  17          HD23      LEU  17   4.565   8.855   6.242
  149    H    GLU  18           H        GLU  18   0.758  11.086   4.654
  150    HA   GLU  18           HA       GLU  18   0.215  12.674   6.885
  151    HB2  GLU  18           HB2      GLU  18   0.286  13.405   3.955
  152    HB3  GLU  18           HB3      GLU  18   0.282  14.565   5.277
  153    HG2  GLU  18           HG2      GLU  18   2.401  13.675   6.079
  154    HG3  GLU  18           HG3      GLU  18   2.403  12.488   4.775
  155    H    SER  19           H        SER  19  -1.502  13.895   7.498
  156    HA   SER  19           HA       SER  19  -4.100  12.987   6.864
  157    HB2  SER  19           HB2      SER  19  -3.307  15.569   8.229
  158    HB3  SER  19           HB3      SER  19  -4.868  14.758   8.338
  159    HG   SER  19           HG       SER  19  -3.818  13.009   9.358
  160    H    SER  20           H        SER  20  -5.798  14.113   5.831
  161    HA   SER  20           HA       SER  20  -6.797  15.390   4.246
  162    HB2  SER  20           HB2      SER  20  -5.607  17.326   5.262
  163    HB3  SER  20           HB3      SER  20  -4.255  17.031   4.174
  164    HG   SER  20           HG       SER  20  -6.017  17.219   2.473
  165    H    MET  21           H        MET  21  -3.916  13.713   3.841
  166    HA   MET  21           HA       MET  21  -4.233  13.676   0.920
  167    HB2  MET  21           HB2      MET  21  -1.945  12.715   2.652
  168    HB3  MET  21           HB3      MET  21  -2.010  12.559   0.902
  169    HG2  MET  21           HG2      MET  21  -2.103  15.008   0.711
  170    HG3  MET  21           HG3      MET  21  -1.967  15.129   2.464
  171    HE1  MET  21           HE1      MET  21   0.150  16.724   2.283
  172    HE2  MET  21           HE2      MET  21  -0.062  16.677   0.534
  173    HE3  MET  21           HE3      MET  21   1.526  16.380   1.237
  174    H    VAL  22           H        VAL  22  -3.971  11.680   3.810
  175    HA   VAL  22           HA       VAL  22  -4.935   9.296   2.594
  176    HB   VAL  22           HB       VAL  22  -4.992  10.215   5.481
  177   HG11  VAL  22          HG11      VAL  22  -5.464   7.905   6.071
  178   HG12  VAL  22          HG12      VAL  22  -5.567   7.480   4.363
  179   HG13  VAL  22          HG13      VAL  22  -6.750   8.579   5.071
  180   HG21  VAL  22          HG21      VAL  22  -3.141   8.640   5.761
  181   HG22  VAL  22          HG22      VAL  22  -2.754   9.901   4.591
  182   HG23  VAL  22          HG23      VAL  22  -3.187   8.284   4.035
  183    H    SER  23           H        SER  23  -6.890   9.141   1.676
  184    HA   SER  23           HA       SER  23  -8.956  11.054   2.432
  185    HB2  SER  23           HB2      SER  23  -8.896   9.064   0.154
  186    HB3  SER  23           HB3      SER  23 -10.071  10.359   0.378
  187    HG   SER  23           HG       SER  23  -8.036  11.736   0.408
  188    H    THR  24           H        THR  24  -8.066   8.170   3.530
  189    HA   THR  24           HA       THR  24  -9.020   6.401   4.583
  190    HB   THR  24           HB       THR  24 -11.567   8.009   4.787
  191    HG1  THR  24           HG1      THR  24 -10.338   9.470   5.729
  192   HG21  THR  24          HG21      THR  24 -11.736   6.873   6.962
  193   HG22  THR  24          HG22      THR  24 -10.214   6.041   6.641
  194   HG23  THR  24          HG23      THR  24 -11.626   5.710   5.639
  195    H    ASP  25           H        ASP  25  -8.951   6.239   1.913
  196    HA   ASP  25           HA       ASP  25 -11.583   5.464   0.897
  197    HB2  ASP  25           HB2      ASP  25 -10.541   5.434  -1.276
  198    HB3  ASP  25           HB3      ASP  25 -10.011   6.892  -0.449
  199    H    SER  26           H        SER  26  -9.069   4.200   2.525
  200    HA   SER  26           HA       SER  26  -8.587   1.744   1.202
  201    HB2  SER  26           HB2      SER  26  -6.939   2.796   2.654
  202    HB3  SER  26           HB3      SER  26  -8.012   2.616   4.035
  203    HG   SER  26           HG       SER  26  -7.750   0.217   2.966
  204    H    LEU  27           H        LEU  27 -11.222   1.660   1.193
  205    HA   LEU  27           HA       LEU  27 -11.813  -0.412   3.201
  206    HB2  LEU  27           HB2      LEU  27 -13.687   1.397   1.694
  207    HB3  LEU  27           HB3      LEU  27 -14.229  -0.063   2.499
  208    HG   LEU  27           HG       LEU  27 -13.032   2.373   3.781
  209   HD11  LEU  27          HD11      LEU  27 -15.383   2.554   3.138
  210   HD12  LEU  27          HD12      LEU  27 -15.174   2.554   4.889
  211   HD13  LEU  27          HD13      LEU  27 -15.736   1.098   4.069
  212   HD21  LEU  27          HD21      LEU  27 -12.159   0.464   4.947
  213   HD22  LEU  27          HD22      LEU  27 -13.760  -0.269   5.014
  214   HD23  LEU  27          HD23      LEU  27 -13.426   1.202   5.926
  215    H    GLY  28           H        GLY  28 -12.884  -2.262   2.506
  216    HA2  GLY  28           HA2      GLY  28 -13.474  -2.972  -0.118
  217    HA3  GLY  28           HA3      GLY  28 -11.788  -3.396   0.182
  218    H    PHE  29           H        PHE  29 -15.083  -4.132   0.888
  219    HA   PHE  29           HA       PHE  29 -14.603  -5.704   3.171
  220    HB2  PHE  29           HB2      PHE  29 -16.959  -5.301   1.358
  221    HB3  PHE  29           HB3      PHE  29 -16.984  -6.502   2.628
  222    HD1  PHE  29           HD1      PHE  29 -15.697  -2.953   2.584
  223    HD2  PHE  29           HD2      PHE  29 -18.367  -5.828   4.270
  224    HE1  PHE  29           HE1      PHE  29 -16.459  -1.298   4.227
  225    HE2  PHE  29           HE2      PHE  29 -19.118  -4.171   5.910
  226    HZ   PHE  29           HZ       PHE  29 -18.168  -1.899   5.893
  227    H    GLN  30           H        GLN  30 -15.704  -7.933   3.030
  228    HA   GLN  30           HA       GLN  30 -14.444  -9.550   0.949
  229    HB2  GLN  30           HB2      GLN  30 -13.878 -10.029   3.874
  230    HB3  GLN  30           HB3      GLN  30 -13.109 -10.774   2.491
  231    HG2  GLN  30           HG2      GLN  30 -12.281  -8.448   1.924
  232    HG3  GLN  30           HG3      GLN  30 -12.770  -8.002   3.544
  233   HE21  GLN  30          HE21      GLN  30 -11.659  -8.824   5.304
  234   HE22  GLN  30          HE22      GLN  30 -10.097  -9.550   5.149
  235    H    HIS  31           H        HIS  31 -15.921  -9.574   4.110
  236    HA   HIS  31           HA       HIS  31 -17.604 -11.851   3.282
  237    HB2  HIS  31           HB2      HIS  31 -16.510 -11.118   5.991
  238    HB3  HIS  31           HB3      HIS  31 -17.830 -12.258   5.787
  239    HD1  HIS  31           HD1      HIS  31 -17.259 -14.604   5.003
  240    HD2  HIS  31           HD2      HIS  31 -13.990 -12.039   5.021
  241    HE1  HIS  31           HE1      HIS  31 -15.250 -16.068   4.643
  242    HE2  HIS  31           HE2      HIS  31 -13.315 -14.471   4.460
  243    H    LEU  32           H        LEU  32 -19.389 -10.930   2.554
  244    HA   LEU  32           HA       LEU  32 -21.041  -9.447   4.400
  245    HB2  LEU  32           HB2      LEU  32 -21.517  -7.663   2.742
  246    HB3  LEU  32           HB3      LEU  32 -19.948  -7.566   3.446
  247    HG   LEU  32           HG       LEU  32 -20.564  -8.590   0.670
  248   HD11  LEU  32          HD11      LEU  32 -19.738  -6.497  -0.131
  249   HD12  LEU  32          HD12      LEU  32 -19.299  -5.991   1.501
  250   HD13  LEU  32          HD13      LEU  32 -20.996  -6.173   1.065
  251   HD21  LEU  32          HD21      LEU  32 -18.534  -9.601   1.361
  252   HD22  LEU  32          HD22      LEU  32 -17.971  -8.112   2.111
  253   HD23  LEU  32          HD23      LEU  32 -18.087  -8.222   0.355
  254    H    THR  33           H        THR  33 -23.202  -9.374   3.813
  255    HA   THR  33           HA       THR  33 -24.006 -11.543   2.072
  256    HB   THR  33           HB       THR  33 -26.332 -10.745   2.935
  257    HG1  THR  33           HG1      THR  33 -25.296  -9.846   5.244
  258   HG21  THR  33          HG21      THR  33 -26.090 -12.065   4.946
  259   HG22  THR  33          HG22      THR  33 -24.336 -11.910   4.871
  260   HG23  THR  33          HG23      THR  33 -25.196 -12.818   3.629
  261    H    ASN  34           H        ASN  34 -26.253 -10.922   0.907
  262    HA   ASN  34           HA       ASN  34 -25.636  -9.206  -1.210
  263    HB2  ASN  34           HB2      ASN  34 -28.374 -10.023  -0.202
  264    HB3  ASN  34           HB3      ASN  34 -28.068  -9.244  -1.748
  265   HD21  ASN  34          HD21      ASN  34 -28.003 -12.172   0.035
  266   HD22  ASN  34          HD22      ASN  34 -27.524 -13.208  -1.264
  267    H    GLU  35           H        GLU  35 -27.144  -8.602   1.889
  268    HA   GLU  35           HA       GLU  35 -28.061  -5.993   1.144
  269    HB2  GLU  35           HB2      GLU  35 -28.642  -5.766   3.553
  270    HB3  GLU  35           HB3      GLU  35 -29.380  -7.131   2.730
  271    HG2  GLU  35           HG2      GLU  35 -27.638  -8.591   3.672
  272    HG3  GLU  35           HG3      GLU  35 -27.015  -7.200   4.553
  273    H    GLU  36           H        GLU  36 -25.254  -7.208   3.006
  274    HA   GLU  36           HA       GLU  36 -24.412  -4.587   3.750
  275    HB2  GLU  36           HB2      GLU  36 -22.999  -7.246   3.646
  276    HB3  GLU  36           HB3      GLU  36 -22.223  -5.778   4.219
  277    HG2  GLU  36           HG2      GLU  36 -23.916  -5.602   5.983
  278    HG3  GLU  36           HG3      GLU  36 -24.653  -7.099   5.406
  279    H    ARG  37           H        ARG  37 -24.031  -6.663   1.017
  280    HA   ARG  37           HA       ARG  37 -21.940  -5.270  -0.269
  281    HB2  ARG  37           HB2      ARG  37 -22.546  -7.608  -0.728
  282    HB3  ARG  37           HB3      ARG  37 -24.099  -7.077  -1.353
  283    HG2  ARG  37           HG2      ARG  37 -22.952  -5.849  -3.115
  284    HG3  ARG  37           HG3      ARG  37 -21.408  -6.444  -2.505
  285    HD2  ARG  37           HD2      ARG  37 -23.681  -8.088  -3.602
  286    HD3  ARG  37           HD3      ARG  37 -22.108  -7.827  -4.355
  287    HE   ARG  37           HE       ARG  37 -21.187  -9.018  -2.338
  288   HH11  ARG  37          HH11      ARG  37 -24.429  -9.641  -3.519
  289   HH12  ARG  37          HH12      ARG  37 -24.487 -11.248  -2.868
  290   HH21  ARG  37          HH21      ARG  37 -21.280 -11.134  -1.473
  291   HH22  ARG  37          HH22      ARG  37 -22.704 -12.097  -1.720
  292    H    ASN  38           H        ASN  38 -25.429  -4.937  -0.138
  293    HA   ASN  38           HA       ASN  38 -25.700  -3.246  -2.394
  294    HB2  ASN  38           HB2      ASN  38 -27.598  -4.451  -1.319
  295    HB3  ASN  38           HB3      ASN  38 -27.472  -3.361   0.058
  296   HD21  ASN  38          HD21      ASN  38 -29.561  -2.599  -0.251
  297   HD22  ASN  38          HD22      ASN  38 -29.967  -1.524  -1.542
  298    H    ASP  39           H        ASP  39 -25.311  -2.591   1.071
  299    HA   ASP  39           HA       ASP  39 -25.340   0.220   0.917
  300    HB2  ASP  39           HB2      ASP  39 -23.966  -1.630   2.877
  301    HB3  ASP  39           HB3      ASP  39 -24.040   0.116   3.076
  302    H    MET  40           H        MET  40 -22.808  -2.135   0.421
  303    HA   MET  40           HA       MET  40 -20.755  -0.066   0.226
  304    HB2  MET  40           HB2      MET  40 -20.393  -2.182   1.528
  305    HB3  MET  40           HB3      MET  40 -20.480  -3.073   0.016
  306    HG2  MET  40           HG2      MET  40 -18.188  -2.770   0.664
  307    HG3  MET  40           HG3      MET  40 -18.519  -1.846  -0.800
  308    HE1  MET  40           HE1      MET  40 -16.258  -0.542  -0.432
  309    HE2  MET  40           HE2      MET  40 -15.940  -1.418   1.065
  310    HE3  MET  40           HE3      MET  40 -15.854   0.342   1.039
  311    H    ILE  41           H        ILE  41 -23.008  -1.034  -1.777
  312    HA   ILE  41           HA       ILE  41 -23.331  -1.065  -4.021
  313    HB   ILE  41           HB       ILE  41 -20.430  -0.233  -4.243
  314   HG12  ILE  41          HG12      ILE  41 -21.766   1.410  -3.009
  315   HG13  ILE  41          HG13      ILE  41 -21.322   2.035  -4.594
  316   HG21  ILE  41          HG21      ILE  41 -22.642  -0.175  -6.293
  317   HG22  ILE  41          HG22      ILE  41 -21.233  -1.235  -6.304
  318   HG23  ILE  41          HG23      ILE  41 -21.029   0.504  -6.506
  319   HD11  ILE  41          HD11      ILE  41 -23.569   1.466  -5.414
  320   HD12  ILE  41          HD12      ILE  41 -23.596   2.617  -4.079
  321   HD13  ILE  41          HD13      ILE  41 -24.000   0.926  -3.792
  322    H    SER  42           H        SER  42 -19.958  -2.138  -3.743
  323    HA   SER  42           HA       SER  42 -20.092  -4.825  -3.724
  324    HB2  SER  42           HB2      SER  42 -21.564  -4.728  -5.745
  325    HB3  SER  42           HB3      SER  42 -20.251  -3.959  -6.629
  326    HG   SER  42           HG       SER  42 -19.065  -5.812  -6.498
  327    H    TYR  43           H        TYR  43 -18.763  -2.001  -5.176
  328    HA   TYR  43           HA       TYR  43 -16.252  -3.211  -5.894
  329    HB2  TYR  43           HB2      TYR  43 -17.292  -1.473  -7.286
  330    HB3  TYR  43           HB3      TYR  43 -17.175  -0.333  -5.954
  331    HD1  TYR  43           HD1      TYR  43 -15.424   1.164  -6.009
  332    HD2  TYR  43           HD2      TYR  43 -14.948  -2.603  -7.927
  333    HE1  TYR  43           HE1      TYR  43 -13.215   1.864  -6.824
  334    HE2  TYR  43           HE2      TYR  43 -12.734  -1.913  -8.745
  335    HH   TYR  43           HH       TYR  43 -11.517   0.157  -9.226
  336    H    LYS  44           H        LYS  44 -14.302  -2.904  -4.922
  337    HA   LYS  44           HA       LYS  44 -14.271  -2.080  -2.160
  338    HB2  LYS  44           HB2      LYS  44 -11.973  -2.837  -3.985
  339    HB3  LYS  44           HB3      LYS  44 -11.911  -2.720  -2.231
  340    HG2  LYS  44           HG2      LYS  44 -13.452  -4.569  -2.014
  341    HG3  LYS  44           HG3      LYS  44 -13.638  -4.652  -3.764
  342    HD2  LYS  44           HD2      LYS  44 -12.133  -6.385  -3.098
  343    HD3  LYS  44           HD3      LYS  44 -11.193  -5.141  -3.922
  344    HE2  LYS  44           HE2      LYS  44 -10.457  -4.251  -1.795
  345    HE3  LYS  44           HE3      LYS  44 -11.465  -5.412  -0.934
  346    HZ1  LYS  44           HZ1      LYS  44 -10.135  -7.200  -1.882
  347    HZ2  LYS  44           HZ2      LYS  44  -9.171  -6.132  -0.990
  348    HZ3  LYS  44           HZ3      LYS  44  -9.156  -6.074  -2.686
  349    H    GLU  45           H        GLU  45 -14.214  -0.027  -1.614
  350    HA   GLU  45           HA       GLU  45 -14.114   2.101  -3.344
  351    HB2  GLU  45           HB2      GLU  45 -13.614   1.973  -0.382
  352    HB3  GLU  45           HB3      GLU  45 -13.725   3.481  -1.264
  353    HG2  GLU  45           HG2      GLU  45 -15.879   1.441  -1.302
  354    HG3  GLU  45           HG3      GLU  45 -15.809   2.727  -0.109
  355    H    ASN  46           H        ASN  46 -11.389   0.555  -1.784
  356    HA   ASN  46           HA       ASN  46  -9.631   2.786  -2.198
  357    HB2  ASN  46           HB2      ASN  46  -7.912   1.464  -1.245
  358    HB3  ASN  46           HB3      ASN  46  -9.380   1.053  -0.368
  359   HD21  ASN  46          HD21      ASN  46 -10.280  -0.983  -0.612
  360   HD22  ASN  46          HD22      ASN  46  -9.393  -2.290  -1.324
  361    H    GLY  47           H        GLY  47 -10.926   0.574  -4.293
  362    HA2  GLY  47           HA2      GLY  47 -10.504   0.453  -6.587
  363    HA3  GLY  47           HA3      GLY  47  -8.954   1.256  -6.320
  364    H    ASP  48           H        ASP  48  -9.120  -1.086  -4.083
  365    HA   ASP  48           HA       ASP  48  -7.923  -2.959  -3.707
  366    HB2  ASP  48           HB2      ASP  48  -9.821  -3.879  -5.033
  367    HB3  ASP  48           HB3      ASP  48  -8.843  -3.712  -6.482
  368    H    VAL  49           H        VAL  49  -6.380  -0.873  -4.429
  369    HA   VAL  49           HA       VAL  49  -4.362  -2.067  -6.190
  370    HB   VAL  49           HB       VAL  49  -3.552   0.386  -6.347
  371   HG11  VAL  49          HG11      VAL  49  -5.201   0.835  -8.182
  372   HG12  VAL  49          HG12      VAL  49  -6.089  -0.592  -7.651
  373   HG13  VAL  49          HG13      VAL  49  -4.443  -0.754  -8.258
  374   HG21  VAL  49          HG21      VAL  49  -6.413   0.828  -5.481
  375   HG22  VAL  49          HG22      VAL  49  -5.341   2.063  -6.130
  376   HG23  VAL  49          HG23      VAL  49  -4.975   1.305  -4.579
  377    H    HIS  50           H        HIS  50  -3.226  -3.176  -4.695
  378    HA   HIS  50           HA       HIS  50  -1.989  -1.659  -2.491
  379    HB2  HIS  50           HB2      HIS  50  -3.652  -3.395  -1.757
  380    HB3  HIS  50           HB3      HIS  50  -2.657  -4.616  -2.534
  381    HD1  HIS  50           HD1      HIS  50  -3.123  -2.850   0.610
  382    HD2  HIS  50           HD2      HIS  50  -0.028  -4.891  -1.266
  383    HE1  HIS  50           HE1      HIS  50  -1.471  -3.387   2.424
  384    HE2  HIS  50           HE2      HIS  50   0.293  -4.787   1.297
  385    H    VAL  51           H        VAL  51  -0.059  -1.172  -3.470
  386    HA   VAL  51           HA       VAL  51   1.384  -3.401  -4.733
  387    HB   VAL  51           HB       VAL  51   2.739  -1.583  -5.862
  388   HG11  VAL  51          HG11      VAL  51  -0.214  -1.617  -6.480
  389   HG12  VAL  51          HG12      VAL  51   0.937  -2.859  -6.980
  390   HG13  VAL  51          HG13      VAL  51   1.093  -1.212  -7.594
  391   HG21  VAL  51          HG21      VAL  51   2.192   0.254  -4.392
  392   HG22  VAL  51          HG22      VAL  51   0.490   0.132  -4.837
  393   HG23  VAL  51          HG23      VAL  51   1.683   0.618  -6.040
  394    H    LEU  52           H        LEU  52   3.358  -3.962  -4.095
  395    HA   LEU  52           HA       LEU  52   4.450  -2.658  -1.715
  396    HB2  LEU  52           HB2      LEU  52   5.117  -5.296  -3.040
  397    HB3  LEU  52           HB3      LEU  52   5.980  -4.652  -1.656
  398    HG   LEU  52           HG       LEU  52   4.481  -6.289  -0.830
  399   HD11  LEU  52          HD11      LEU  52   4.616  -4.259   0.514
  400   HD12  LEU  52          HD12      LEU  52   3.035  -5.027   0.655
  401   HD13  LEU  52          HD13      LEU  52   3.230  -3.593  -0.351
  402   HD21  LEU  52          HD21      LEU  52   2.993  -6.445  -2.754
  403   HD22  LEU  52          HD22      LEU  52   2.270  -4.894  -2.329
  404   HD23  LEU  52          HD23      LEU  52   2.080  -6.279  -1.254
  405    H    THR  53           H        THR  53   5.829  -1.073  -2.115
  406    HA   THR  53           HA       THR  53   7.587  -1.319  -4.469
  407    HB   THR  53           HB       THR  53   5.733   0.336  -4.770
  408    HG1  THR  53           HG1      THR  53   7.251   1.078  -6.043
  409   HG21  THR  53          HG21      THR  53   7.162   1.829  -2.570
  410   HG22  THR  53          HG22      THR  53   5.562   1.096  -2.450
  411   HG23  THR  53          HG23      THR  53   5.832   2.451  -3.547
  412    H    ILE  54           H        ILE  54   9.483   0.235  -4.304
  413    HA   ILE  54           HA       ILE  54  10.719  -0.067  -1.696
  414    HB   ILE  54           HB       ILE  54  11.653   0.374  -4.454
  415   HG12  ILE  54          HG12      ILE  54  13.032  -0.908  -2.099
  416   HG13  ILE  54          HG13      ILE  54  11.824  -1.716  -3.072
  417   HG21  ILE  54          HG21      ILE  54  13.802   1.342  -3.816
  418   HG22  ILE  54          HG22      ILE  54  13.210   1.565  -2.172
  419   HG23  ILE  54          HG23      ILE  54  12.465   2.449  -3.501
  420   HD11  ILE  54          HD11      ILE  54  14.094  -2.309  -3.735
  421   HD12  ILE  54          HD12      ILE  54  14.415  -0.616  -4.104
  422   HD13  ILE  54          HD13      ILE  54  13.215  -1.509  -5.035
  423    H    CYS  55           H        CYS  55  10.718   1.468  -0.220
  424    HA   CYS  55           HA       CYS  55   9.569   4.019  -0.724
  425    HB2  CYS  55           HB2      CYS  55   9.906   4.482   1.611
  426    HB3  CYS  55           HB3      CYS  55   9.393   2.807   1.467
  427    H    GLU  56           H        GLU  56  10.703   6.091  -0.092
  428    HA   GLU  56           HA       GLU  56  12.906   6.566  -1.717
  429    HB2  GLU  56           HB2      GLU  56  11.282   8.232  -0.686
  430    HB3  GLU  56           HB3      GLU  56  12.231   8.117   0.787
  431    HG2  GLU  56           HG2      GLU  56  12.906  10.059  -0.388
  432    HG3  GLU  56           HG3      GLU  56  14.209   8.879  -0.497
  433    H    ASP  57           H        ASP  57  12.700   5.753   1.698
  434    HA   ASP  57           HA       ASP  57  15.413   6.072   2.365
  435    HB2  ASP  57           HB2      ASP  57  13.624   5.915   4.041
  436    HB3  ASP  57           HB3      ASP  57  13.342   4.238   3.591
  437    H    CYS  58           H        CYS  58  13.608   3.286   1.094
  438    HA   CYS  58           HA       CYS  58  15.797   1.479   1.263
  439    HB2  CYS  58           HB2      CYS  58  13.200   1.435  -0.218
  440    HB3  CYS  58           HB3      CYS  58  14.455   0.289  -0.660
  441    H    GLN  59           H        GLN  59  14.418   3.189  -1.546
  442    HA   GLN  59           HA       GLN  59  16.156   2.449  -3.484
  443    HB2  GLN  59           HB2      GLN  59  14.156   3.961  -3.745
  444    HB3  GLN  59           HB3      GLN  59  15.195   5.288  -3.231
  445    HG2  GLN  59           HG2      GLN  59  16.751   4.351  -5.138
  446    HG3  GLN  59           HG3      GLN  59  15.222   3.723  -5.753
  447   HE21  GLN  59          HE21      GLN  59  17.069   6.531  -5.004
  448   HE22  GLN  59          HE22      GLN  59  16.091   7.651  -5.874
  449    H    GLU  60           H        GLU  60  16.724   4.761  -0.945
  450    HA   GLU  60           HA       GLU  60  19.030   5.952  -1.985
  451    HB2  GLU  60           HB2      GLU  60  17.555   6.623  -0.016
  452    HB3  GLU  60           HB3      GLU  60  18.473   5.498   0.932
  453    HG2  GLU  60           HG2      GLU  60  19.355   7.664   1.296
  454    HG3  GLU  60           HG3      GLU  60  20.489   6.741   0.330
  455    H    ALA  61           H        ALA  61  18.679   3.501   0.521
  456    HA   ALA  61           HA       ALA  61  21.337   2.669   0.679
  457    HB1  ALA  61           HB1      ALA  61  19.587   2.072   2.294
  458    HB2  ALA  61           HB2      ALA  61  20.433   0.644   1.698
  459    HB3  ALA  61           HB3      ALA  61  18.826   1.040   1.084
  460    H    LEU  62           H        LEU  62  18.809   2.059  -1.541
  461    HA   LEU  62           HA       LEU  62  19.625  -0.361  -2.751
  462    HB2  LEU  62           HB2      LEU  62  17.843   1.907  -3.305
  463    HB3  LEU  62           HB3      LEU  62  18.351   1.025  -4.711
  464    HG   LEU  62           HG       LEU  62  16.134   0.421  -3.559
  465   HD11  LEU  62          HD11      LEU  62  16.292  -1.853  -4.270
  466   HD12  LEU  62          HD12      LEU  62  18.052  -1.805  -4.180
  467   HD13  LEU  62          HD13      LEU  62  17.203  -0.839  -5.387
  468   HD21  LEU  62          HD21      LEU  62  16.979   0.217  -1.288
  469   HD22  LEU  62          HD22      LEU  62  18.036  -1.101  -1.792
  470   HD23  LEU  62          HD23      LEU  62  16.286  -1.307  -1.843
  471    H    ASP  63           H        ASP  63  19.799   2.913  -4.086
  472    HA   ASP  63           HA       ASP  63  21.465   2.294  -6.242
  473    HB2  ASP  63           HB2      ASP  63  20.190   4.398  -6.087
  474    HB3  ASP  63           HB3      ASP  63  21.259   4.948  -4.800
  475    H    ARG  64           H        ARG  64  22.235   3.067  -2.936
  476    HA   ARG  64           HA       ARG  64  25.015   3.463  -3.284
  477    HB2  ARG  64           HB2      ARG  64  23.786   4.183  -1.264
  478    HB3  ARG  64           HB3      ARG  64  23.516   2.499  -0.837
  479    HG2  ARG  64           HG2      ARG  64  25.937   2.171  -0.638
  480    HG3  ARG  64           HG3      ARG  64  26.188   3.872  -1.031
  481    HD2  ARG  64           HD2      ARG  64  26.308   3.589   1.354
  482    HD3  ARG  64           HD3      ARG  64  24.848   4.490   0.951
  483    HE   ARG  64           HE       ARG  64  24.611   1.602   1.347
  484   HH11  ARG  64          HH11      ARG  64  24.120   4.833   2.574
  485   HH12  ARG  64          HH12      ARG  64  22.972   4.343   3.776
  486   HH21  ARG  64          HH21      ARG  64  23.099   0.945   2.939
  487   HH22  ARG  64          HH22      ARG  64  22.394   2.132   3.991
  488    H    ASN  65           H        ASN  65  23.337   0.660  -1.818
  489    HA   ASN  65           HA       ASN  65  25.379  -1.095  -2.993
  490    HB2  ASN  65           HB2      ASN  65  24.626  -0.959  -0.070
  491    HB3  ASN  65           HB3      ASN  65  25.489  -2.316  -0.781
  492   HD21  ASN  65          HD21      ASN  65  26.271  -0.376   1.300
  493   HD22  ASN  65          HD22      ASN  65  27.754   0.321   0.744
  494    HA   PRO  66           HA       PRO  66  21.692  -3.348  -4.136
  495    HB2  PRO  66           HB2      PRO  66  23.653  -5.567  -4.384
  496    HB3  PRO  66           HB3      PRO  66  22.491  -4.952  -5.564
  497    HG2  PRO  66           HG2      PRO  66  25.105  -4.437  -5.797
  498    HG3  PRO  66           HG3      PRO  66  23.884  -3.228  -6.237
  499    HD2  PRO  66           HD2      PRO  66  25.622  -3.386  -3.818
  500    HD3  PRO  66           HD3      PRO  66  25.065  -1.965  -4.721
  501    H    HIS  67           H        HIS  67  24.171  -4.790  -2.053
  502    HA   HIS  67           HA       HIS  67  22.026  -6.090  -0.513
  503    HB2  HIS  67           HB2      HIS  67  24.968  -6.765  -0.721
  504    HB3  HIS  67           HB3      HIS  67  23.890  -7.485   0.465
  505    HD1  HIS  67           HD1      HIS  67  24.844  -9.676  -0.933
  506    HD2  HIS  67           HD2      HIS  67  22.031  -7.255  -2.802
  507    HE1  HIS  67           HE1      HIS  67  23.864 -11.076  -2.777
  508    HE2  HIS  67           HE2      HIS  67  22.033  -9.656  -3.767
  509    H    TYR  68           H        TYR  68  21.837  -3.725   0.144
  510    HA   TYR  68           HA       TYR  68  23.803  -2.560   1.827
  511    HB2  TYR  68           HB2      TYR  68  22.083  -0.901   2.352
  512    HB3  TYR  68           HB3      TYR  68  22.112  -1.228   0.622
  513    HD1  TYR  68           HD1      TYR  68  20.191  -1.555   3.716
  514    HD2  TYR  68           HD2      TYR  68  20.258  -2.407  -0.451
  515    HE1  TYR  68           HE1      TYR  68  17.785  -2.051   3.786
  516    HE2  TYR  68           HE2      TYR  68  17.850  -2.905  -0.390
  517    HH   TYR  68           HH       TYR  68  15.885  -2.164   2.333
  518    H    HIS  69           H        HIS  69  21.559  -5.037   2.355
  519    HA   HIS  69           HA       HIS  69  21.788  -4.692   5.267
  520    HB2  HIS  69           HB2      HIS  69  19.500  -4.132   4.313
  521    HB3  HIS  69           HB3      HIS  69  19.367  -5.824   3.852
  522    HD1  HIS  69           HD1      HIS  69  19.655  -3.657   6.938
  523    HD2  HIS  69           HD2      HIS  69  18.498  -7.494   5.838
  524    HE1  HIS  69           HE1      HIS  69  18.591  -4.655   8.985
  525    HE2  HIS  69           HE2      HIS  69  17.908  -6.981   8.306
  526    H    GLU  70           H        GLU  70  23.691  -6.116   4.118
  527    HA   GLU  70           HA       GLU  70  22.906  -8.880   3.787
  528    HB2  GLU  70           HB2      GLU  70  25.337  -9.275   3.395
  529    HB3  GLU  70           HB3      GLU  70  24.617  -8.097   2.309
  530    HG2  GLU  70           HG2      GLU  70  25.631  -6.290   3.468
  531    HG3  GLU  70           HG3      GLU  70  26.164  -7.349   4.774
  532    H    TYR  71           H        TYR  71  22.380  -7.813   6.356
  533    HA   TYR  71           HA       TYR  71  24.278  -8.674   8.275
  534    HB2  TYR  71           HB2      TYR  71  22.445  -7.100   8.793
  535    HB3  TYR  71           HB3      TYR  71  21.271  -8.380   8.520
  536    HD1  TYR  71           HD1      TYR  71  20.657  -9.829  10.267
  537    HD2  TYR  71           HD2      TYR  71  24.102  -7.371  10.695
  538    HE1  TYR  71           HE1      TYR  71  20.800 -10.452  12.642
  539    HE2  TYR  71           HE2      TYR  71  24.257  -7.988  13.067
  540    HH   TYR  71           HH       TYR  71  22.799  -8.803  14.851
  541    H    HIS  72           H        HIS  72  21.363 -10.149   6.927
  542    HA   HIS  72           HA       HIS  72  22.542 -12.788   7.351
  543    HB2  HIS  72           HB2      HIS  72  21.023 -12.408   9.262
  544    HB3  HIS  72           HB3      HIS  72  19.710 -12.055   8.146
  545    HD1  HIS  72           HD1      HIS  72  21.664 -14.876   9.614
  546    HD2  HIS  72           HD2      HIS  72  18.559 -14.308   6.906
  547    HE1  HIS  72           HE1      HIS  72  20.653 -17.149   9.252
  548    HE2  HIS  72           HE2      HIS  72  18.867 -16.803   7.514
  549    H    THR  73           H        THR  73  22.917 -12.918   5.159
  550    HA   THR  73           HA       THR  73  20.511 -13.160   3.507
  551    HB   THR  73           HB       THR  73  21.434 -11.059   2.856
  552    HG1  THR  73           HG1      THR  73  22.478 -12.790   0.875
  553   HG21  THR  73          HG21      THR  73  23.754 -10.784   2.084
  554   HG22  THR  73          HG22      THR  73  24.097 -12.447   2.559
  555   HG23  THR  73          HG23      THR  73  23.666 -11.252   3.782
  Start of MODEL   13
    1    H1   GLN  -1           H1       GLN  -1  -1.030  15.580  -6.438
    2    H2   GLN  -1           H2       GLN  -1  -1.916  14.345  -7.168
    3    H3   GLN  -1           H3       GLN  -1  -1.053  14.031  -5.747
    4    HA   GLN  -1           HA       GLN  -1  -2.465  15.594  -4.551
    5    HB2  GLN  -1           HB2      GLN  -1  -4.553  16.349  -5.648
    6    HB3  GLN  -1           HB3      GLN  -1  -3.114  17.016  -6.407
    7    HG2  GLN  -1           HG2      GLN  -1  -3.282  15.377  -8.196
    8    HG3  GLN  -1           HG3      GLN  -1  -4.699  14.668  -7.428
    9   HE21  GLN  -1          HE21      GLN  -1  -4.366  15.869 -10.067
   10   HE22  GLN  -1          HE22      GLN  -1  -5.533  17.141 -10.163
   11    H    SER   0           H        SER   0  -2.926  12.849  -6.639
   12    HA   SER   0           HA       SER   0  -4.609  11.629  -4.584
   13    HB2  SER   0           HB2      SER   0  -5.301  11.598  -7.534
   14    HB3  SER   0           HB3      SER   0  -6.181  10.762  -6.255
   15    HG   SER   0           HG       SER   0  -6.772  13.069  -7.098
   16    H    MET   1           H        MET   1  -4.431   9.403  -4.443
   17    HA   MET   1           HA       MET   1  -2.295   8.219  -6.075
   18    HB2  MET   1           HB2      MET   1  -2.281   6.430  -4.274
   19    HB3  MET   1           HB3      MET   1  -1.690   8.013  -3.809
   20    HG2  MET   1           HG2      MET   1  -3.807   8.501  -2.717
   21    HG3  MET   1           HG3      MET   1  -4.439   6.937  -3.227
   22    HE1  MET   1           HE1      MET   1  -3.950   6.656   0.690
   23    HE2  MET   1           HE2      MET   1  -5.117   6.574  -0.629
   24    HE3  MET   1           HE3      MET   1  -4.371   8.116  -0.207
   25    H    ALA   2           H        ALA   2  -2.591   6.359  -7.143
   26    HA   ALA   2           HA       ALA   2  -5.379   5.643  -7.677
   27    HB1  ALA   2           HB1      ALA   2  -4.508   4.583  -9.715
   28    HB2  ALA   2           HB2      ALA   2  -2.870   5.018  -9.228
   29    HB3  ALA   2           HB3      ALA   2  -4.041   6.280  -9.609
   30    H    LEU   3           H        LEU   3  -2.349   4.356  -6.595
   31    HA   LEU   3           HA       LEU   3  -3.766   1.993  -5.568
   32    HB2  LEU   3           HB2      LEU   3  -1.036   1.956  -6.867
   33    HB3  LEU   3           HB3      LEU   3  -1.735   0.624  -5.985
   34    HG   LEU   3           HG       LEU   3  -3.665   0.884  -7.759
   35   HD11  LEU   3          HD11      LEU   3  -2.746   2.866  -8.757
   36   HD12  LEU   3          HD12      LEU   3  -2.738   1.542  -9.924
   37   HD13  LEU   3          HD13      LEU   3  -1.247   2.018  -9.110
   38   HD21  LEU   3          HD21      LEU   3  -2.280  -1.110  -7.396
   39   HD22  LEU   3          HD22      LEU   3  -1.005  -0.392  -8.382
   40   HD23  LEU   3          HD23      LEU   3  -2.556  -0.804  -9.110
   41    H    HIS   4           H        HIS   4  -2.726   1.088  -3.712
   42    HA   HIS   4           HA       HIS   4  -1.564   3.245  -2.118
   43    HB2  HIS   4           HB2      HIS   4  -2.554   0.516  -1.316
   44    HB3  HIS   4           HB3      HIS   4  -1.881   1.683  -0.200
   45    HD1  HIS   4           HD1      HIS   4  -4.985   0.717  -1.878
   46    HD2  HIS   4           HD2      HIS   4  -3.514   4.031   0.151
   47    HE1  HIS   4           HE1      HIS   4  -7.000   2.103  -1.299
   48    HE2  HIS   4           HE2      HIS   4  -6.079   4.157  -0.168
   49    H    TYR   5           H        TYR   5   0.503   3.375  -1.776
   50    HA   TYR   5           HA       TYR   5   2.199   1.129  -2.497
   51    HB2  TYR   5           HB2      TYR   5   2.950   3.942  -1.684
   52    HB3  TYR   5           HB3      TYR   5   4.086   2.660  -2.097
   53    HD1  TYR   5           HD1      TYR   5   4.476   5.021  -3.460
   54    HD2  TYR   5           HD2      TYR   5   1.626   2.006  -4.319
   55    HE1  TYR   5           HE1      TYR   5   4.501   5.694  -5.809
   56    HE2  TYR   5           HE2      TYR   5   1.628   2.630  -6.687
   57    HH   TYR   5           HH       TYR   5   3.981   4.751  -8.008
   58    H    TYR   6           H        TYR   6   3.346  -0.014  -1.156
   59    HA   TYR   6           HA       TYR   6   3.675   0.789   1.629
   60    HB2  TYR   6           HB2      TYR   6   2.769  -1.992   0.815
   61    HB3  TYR   6           HB3      TYR   6   3.076  -1.427   2.452
   62    HD1  TYR   6           HD1      TYR   6   0.628  -1.820  -0.125
   63    HD2  TYR   6           HD2      TYR   6   1.565   0.432   3.369
   64    HE1  TYR   6           HE1      TYR   6  -1.731  -1.182   0.091
   65    HE2  TYR   6           HE2      TYR   6  -0.796   1.077   3.584
   66    HH   TYR   6           HH       TYR   6  -3.278  -0.436   1.956
   67    H    CYS   7           H        CYS   7   5.827   0.570   2.092
   68    HA   CYS   7           HA       CYS   7   7.442  -0.360  -0.040
   69    HB2  CYS   7           HB2      CYS   7   8.220   1.498   1.324
   70    HB3  CYS   7           HB3      CYS   7   8.336   0.420   2.725
   71    H    ARG   8           H        ARG   8   8.317  -2.121  -0.477
   72    HA   ARG   8           HA       ARG   8   7.836  -4.517   0.819
   73    HB2  ARG   8           HB2      ARG   8   9.619  -5.439  -0.566
   74    HB3  ARG   8           HB3      ARG   8   8.622  -4.341  -1.512
   75    HG2  ARG   8           HG2      ARG   8  10.290  -2.602  -1.316
   76    HG3  ARG   8           HG3      ARG   8  11.273  -3.637  -0.275
   77    HD2  ARG   8           HD2      ARG   8  11.304  -5.282  -2.214
   78    HD3  ARG   8           HD3      ARG   8  10.671  -3.962  -3.199
   79    HE   ARG   8           HE       ARG   8  12.966  -3.167  -1.721
   80   HH11  ARG   8          HH11      ARG   8  11.932  -4.854  -4.607
   81   HH12  ARG   8          HH12      ARG   8  13.439  -4.634  -5.436
   82   HH21  ARG   8          HH21      ARG   8  14.967  -2.901  -2.796
   83   HH22  ARG   8          HH22      ARG   8  15.179  -3.527  -4.411
   84    H    HIS   9           H        HIS   9   8.535  -5.294   2.574
   85    HA   HIS   9           HA       HIS   9   9.931  -6.068   4.206
   86    HB2  HIS   9           HB2      HIS   9  11.791  -6.054   2.631
   87    HB3  HIS   9           HB3      HIS   9  12.027  -4.331   2.885
   88    HD1  HIS   9           HD1      HIS   9  13.603  -3.676   4.678
   89    HD2  HIS   9           HD2      HIS   9  12.429  -7.643   5.003
   90    HE1  HIS   9           HE1      HIS   9  15.053  -4.656   6.474
   91    HE2  HIS   9           HE2      HIS   9  14.474  -7.105   6.495
   92    H    CYS  10           H        CYS  10   9.414  -2.703   3.613
   93    HA   CYS  10           HA       CYS  10  10.099  -2.018   6.369
   94    HB2  CYS  10           HB2      CYS  10   9.215  -0.334   4.044
   95    HB3  CYS  10           HB3      CYS  10   9.414   0.306   5.665
   96    H    GLY  11           H        GLY  11   7.305  -2.225   4.239
   97    HA2  GLY  11           HA2      GLY  11   5.081  -2.523   4.802
   98    HA3  GLY  11           HA3      GLY  11   5.531  -2.417   6.511
   99    H    VAL  12           H        VAL  12   6.916   0.183   5.030
  100    HA   VAL  12           HA       VAL  12   5.139   1.954   6.285
  101    HB   VAL  12           HB       VAL  12   7.360   2.675   6.292
  102   HG11  VAL  12          HG11      VAL  12   8.609   3.128   4.175
  103   HG12  VAL  12          HG12      VAL  12   7.326   2.266   3.323
  104   HG13  VAL  12          HG13      VAL  12   8.308   1.430   4.525
  105   HG21  VAL  12          HG21      VAL  12   5.799   4.496   5.954
  106   HG22  VAL  12          HG22      VAL  12   5.944   4.303   4.208
  107   HG23  VAL  12          HG23      VAL  12   7.335   4.828   5.155
  108    H    LYS  13           H        LYS  13   3.703   3.409   5.473
  109    HA   LYS  13           HA       LYS  13   2.464   2.636   2.970
  110    HB2  LYS  13           HB2      LYS  13   1.654   4.785   4.938
  111    HB3  LYS  13           HB3      LYS  13   0.705   4.246   3.568
  112    HG2  LYS  13           HG2      LYS  13   0.607   1.995   4.641
  113    HG3  LYS  13           HG3      LYS  13   1.380   2.707   6.056
  114    HD2  LYS  13           HD2      LYS  13  -0.449   4.277   6.307
  115    HD3  LYS  13           HD3      LYS  13  -1.211   3.660   4.842
  116    HE2  LYS  13           HE2      LYS  13  -2.290   2.749   6.816
  117    HE3  LYS  13           HE3      LYS  13  -1.482   1.474   5.909
  118    HZ1  LYS  13           HZ1      LYS  13   0.314   1.492   7.477
  119    HZ2  LYS  13           HZ2      LYS  13  -1.140   1.320   8.322
  120    HZ3  LYS  13           HZ3      LYS  13  -0.350   2.809   8.304
  121    H    VAL  14           H        VAL  14   3.715   3.302   1.386
  122    HA   VAL  14           HA       VAL  14   4.852   5.986   1.574
  123    HB   VAL  14           HB       VAL  14   6.393   4.059   1.500
  124   HG11  VAL  14          HG11      VAL  14   5.585   3.712  -1.346
  125   HG12  VAL  14          HG12      VAL  14   5.059   2.658  -0.028
  126   HG13  VAL  14          HG13      VAL  14   6.774   2.783  -0.434
  127   HG21  VAL  14          HG21      VAL  14   6.616   5.828  -0.896
  128   HG22  VAL  14          HG22      VAL  14   7.920   4.980  -0.055
  129   HG23  VAL  14          HG23      VAL  14   7.045   6.277   0.761
  130    H    GLY  15           H        GLY  15   2.236   4.710   0.411
  131    HA2  GLY  15           HA2      GLY  15   2.221   6.069  -2.187
  132    HA3  GLY  15           HA3      GLY  15   0.910   5.110  -1.505
  133    H    SER  16           H        SER  16   1.372   6.527   1.088
  134    HA   SER  16           HA       SER  16  -0.248   8.869   0.507
  135    HB2  SER  16           HB2      SER  16  -0.289   8.825   3.142
  136    HB3  SER  16           HB3      SER  16  -1.267   7.697   2.206
  137    HG   SER  16           HG       SER  16   0.448   7.053   4.028
  138    H    LEU  17           H        LEU  17   1.706   9.830  -0.466
  139    HA   LEU  17           HA       LEU  17   3.470  10.994   1.564
  140    HB2  LEU  17           HB2      LEU  17   5.210  11.217  -0.037
  141    HB3  LEU  17           HB3      LEU  17   4.617   9.575  -0.156
  142    HG   LEU  17           HG       LEU  17   3.692  11.727  -2.050
  143   HD11  LEU  17          HD11      LEU  17   6.063   9.889  -2.345
  144   HD12  LEU  17          HD12      LEU  17   6.116  11.643  -2.169
  145   HD13  LEU  17          HD13      LEU  17   5.398  10.923  -3.607
  146   HD21  LEU  17          HD21      LEU  17   2.337   9.719  -2.026
  147   HD22  LEU  17          HD22      LEU  17   3.773   8.712  -2.205
  148   HD23  LEU  17          HD23      LEU  17   3.277   9.784  -3.516
  149    H    GLU  18           H        GLU  18   1.303  11.509  -1.009
  150    HA   GLU  18           HA       GLU  18   1.550  14.387  -0.780
  151    HB2  GLU  18           HB2      GLU  18  -0.438  12.798  -2.407
  152    HB3  GLU  18           HB3      GLU  18  -0.124  14.523  -2.537
  153    HG2  GLU  18           HG2      GLU  18   2.223  13.942  -3.205
  154    HG3  GLU  18           HG3      GLU  18   1.703  12.261  -3.294
  155    H    SER  19           H        SER  19  -0.421  11.715   0.119
  156    HA   SER  19           HA       SER  19  -2.283  13.321   1.639
  157    HB2  SER  19           HB2      SER  19  -1.843  10.336   1.810
  158    HB3  SER  19           HB3      SER  19  -3.261  11.257   2.289
  159    HG   SER  19           HG       SER  19  -3.202  11.884  -0.100
  160    H    SER  20           H        SER  20  -0.418  14.376   2.697
  161    HA   SER  20           HA       SER  20   1.261  12.819   4.440
  162    HB2  SER  20           HB2      SER  20   1.019  15.828   4.216
  163    HB3  SER  20           HB3      SER  20   2.343  14.932   4.960
  164    HG   SER  20           HG       SER  20   2.807  14.044   2.904
  165    H    MET  21           H        MET  21  -1.141  15.400   4.939
  166    HA   MET  21           HA       MET  21  -1.593  14.287   7.629
  167    HB2  MET  21           HB2      MET  21  -2.249  16.486   8.388
  168    HB3  MET  21           HB3      MET  21  -0.650  16.575   7.668
  169    HG2  MET  21           HG2      MET  21  -1.573  17.524   5.649
  170    HG3  MET  21           HG3      MET  21  -3.207  17.357   6.290
  171    HE1  MET  21           HE1      MET  21  -3.684  19.924   5.780
  172    HE2  MET  21           HE2      MET  21  -2.056  20.070   5.121
  173    HE3  MET  21           HE3      MET  21  -2.630  21.233   6.315
  174    H    VAL  22           H        VAL  22  -2.691  14.160   4.711
  175    HA   VAL  22           HA       VAL  22  -5.438  14.825   4.906
  176    HB   VAL  22           HB       VAL  22  -4.065  12.866   3.058
  177   HG11  VAL  22          HG11      VAL  22  -6.453  12.445   3.174
  178   HG12  VAL  22          HG12      VAL  22  -6.021  13.152   1.617
  179   HG13  VAL  22          HG13      VAL  22  -6.782  14.148   2.856
  180   HG21  VAL  22          HG21      VAL  22  -3.176  15.111   2.829
  181   HG22  VAL  22          HG22      VAL  22  -4.805  15.760   2.657
  182   HG23  VAL  22          HG23      VAL  22  -4.146  14.688   1.420
  183    H    SER  23           H        SER  23  -6.833  13.881   6.211
  184    HA   SER  23           HA       SER  23  -6.439  11.374   7.455
  185    HB2  SER  23           HB2      SER  23  -8.928  11.694   8.035
  186    HB3  SER  23           HB3      SER  23  -7.804  12.924   8.609
  187    HG   SER  23           HG       SER  23  -9.687  13.055   6.508
  188    H    THR  24           H        THR  24  -7.502   9.391   7.083
  189    HA   THR  24           HA       THR  24  -7.924   8.837   4.309
  190    HB   THR  24           HB       THR  24  -8.502   6.509   5.205
  191    HG1  THR  24           HG1      THR  24  -8.941   7.394   7.388
  192   HG21  THR  24          HG21      THR  24  -6.318   7.052   4.280
  193   HG22  THR  24          HG22      THR  24  -6.140   6.000   5.683
  194   HG23  THR  24          HG23      THR  24  -5.809   7.726   5.827
  195    H    ASP  25           H        ASP  25  -9.735  10.255   3.946
  196    HA   ASP  25           HA       ASP  25 -12.297   9.381   5.061
  197    HB2  ASP  25           HB2      ASP  25 -11.535  11.671   3.237
  198    HB3  ASP  25           HB3      ASP  25 -13.202  11.280   3.643
  199    H    SER  26           H        SER  26 -10.410   9.405   2.174
  200    HA   SER  26           HA       SER  26 -12.420   8.289   0.473
  201    HB2  SER  26           HB2      SER  26 -10.546   9.733  -0.328
  202    HB3  SER  26           HB3      SER  26  -9.421   8.447   0.089
  203    HG   SER  26           HG       SER  26 -11.397   7.463  -1.446
  204    H    LEU  27           H        LEU  27 -12.922   6.577   2.069
  205    HA   LEU  27           HA       LEU  27 -11.328   4.178   1.464
  206    HB2  LEU  27           HB2      LEU  27 -12.682   4.850   4.082
  207    HB3  LEU  27           HB3      LEU  27 -11.967   3.297   3.701
  208    HG   LEU  27           HG       LEU  27 -10.463   5.907   3.930
  209   HD11  LEU  27          HD11      LEU  27  -9.517   4.910   5.957
  210   HD12  LEU  27          HD12      LEU  27 -10.588   3.522   5.768
  211   HD13  LEU  27          HD13      LEU  27 -11.262   5.121   6.082
  212   HD21  LEU  27          HD21      LEU  27  -9.492   3.089   3.465
  213   HD22  LEU  27          HD22      LEU  27  -8.459   4.472   3.826
  214   HD23  LEU  27          HD23      LEU  27  -9.395   4.437   2.332
  215    H    GLY  28           H        GLY  28 -12.729   2.152   1.829
  216    HA2  GLY  28           HA2      GLY  28 -15.104   2.544   0.237
  217    HA3  GLY  28           HA3      GLY  28 -14.432   1.004   0.751
  218    H    PHE  29           H        PHE  29 -15.658   3.850   2.487
  219    HA   PHE  29           HA       PHE  29 -17.609   2.116   3.825
  220    HB2  PHE  29           HB2      PHE  29 -15.961   4.291   5.149
  221    HB3  PHE  29           HB3      PHE  29 -17.187   3.311   5.941
  222    HD1  PHE  29           HD1      PHE  29 -16.764   0.660   5.465
  223    HD2  PHE  29           HD2      PHE  29 -13.815   3.714   5.624
  224    HE1  PHE  29           HE1      PHE  29 -15.053  -1.029   5.982
  225    HE2  PHE  29           HE2      PHE  29 -12.097   2.038   6.145
  226    HZ   PHE  29           HZ       PHE  29 -12.712  -0.342   6.322
  227    H    GLN  30           H        GLN  30 -18.789   4.221   5.342
  228    HA   GLN  30           HA       GLN  30 -20.011   5.649   3.070
  229    HB2  GLN  30           HB2      GLN  30 -22.040   5.853   4.500
  230    HB3  GLN  30           HB3      GLN  30 -21.600   4.196   4.125
  231    HG2  GLN  30           HG2      GLN  30 -20.686   3.888   6.330
  232    HG3  GLN  30           HG3      GLN  30 -20.943   5.588   6.710
  233   HE21  GLN  30          HE21      GLN  30 -23.258   3.603   4.962
  234   HE22  GLN  30          HE22      GLN  30 -24.453   3.587   6.207
  235    H    HIS  31           H        HIS  31 -19.142   6.009   6.453
  236    HA   HIS  31           HA       HIS  31 -17.992   8.548   6.251
  237    HB2  HIS  31           HB2      HIS  31 -20.348   9.290   5.842
  238    HB3  HIS  31           HB3      HIS  31 -20.824   8.555   7.368
  239    HD1  HIS  31           HD1      HIS  31 -20.840  10.082   9.313
  240    HD2  HIS  31           HD2      HIS  31 -18.372  11.475   6.275
  241    HE1  HIS  31           HE1      HIS  31 -20.040  12.336  10.079
  242    HE2  HIS  31           HE2      HIS  31 -18.460  13.111   8.278
  243    H    LEU  32           H        LEU  32 -16.779   6.752   7.328
  244    HA   LEU  32           HA       LEU  32 -17.779   5.476   9.582
  245    HB2  LEU  32           HB2      LEU  32 -15.302   4.911   9.981
  246    HB3  LEU  32           HB3      LEU  32 -16.141   4.256   8.609
  247    HG   LEU  32           HG       LEU  32 -15.009   5.761   7.107
  248   HD11  LEU  32          HD11      LEU  32 -13.736   6.980   9.548
  249   HD12  LEU  32          HD12      LEU  32 -14.916   7.757   8.488
  250   HD13  LEU  32          HD13      LEU  32 -13.316   7.339   7.873
  251   HD21  LEU  32          HD21      LEU  32 -12.707   5.040   7.439
  252   HD22  LEU  32          HD22      LEU  32 -13.840   3.727   7.753
  253   HD23  LEU  32          HD23      LEU  32 -13.085   4.579   9.097
  254    H    THR  33           H        THR  33 -17.114   5.484  11.694
  255    HA   THR  33           HA       THR  33 -16.073   7.991  12.768
  256    HB   THR  33           HB       THR  33 -18.539   8.156  12.832
  257    HG1  THR  33           HG1      THR  33 -18.701   8.573  15.086
  258   HG21  THR  33          HG21      THR  33 -19.853   6.636  14.222
  259   HG22  THR  33          HG22      THR  33 -18.410   5.678  14.551
  260   HG23  THR  33          HG23      THR  33 -19.058   5.764  12.914
  261    H    ASN  34           H        ASN  34 -16.139   7.430  15.434
  262    HA   ASN  34           HA       ASN  34 -13.938   5.806  15.794
  263    HB2  ASN  34           HB2      ASN  34 -14.570   5.756  18.217
  264    HB3  ASN  34           HB3      ASN  34 -14.572   7.365  17.504
  265   HD21  ASN  34          HD21      ASN  34 -16.474   4.860  18.924
  266   HD22  ASN  34          HD22      ASN  34 -17.952   5.755  19.022
  267    H    GLU  35           H        GLU  35 -17.325   4.888  15.856
  268    HA   GLU  35           HA       GLU  35 -16.911   2.204  16.704
  269    HB2  GLU  35           HB2      GLU  35 -19.181   3.451  15.169
  270    HB3  GLU  35           HB3      GLU  35 -19.207   1.852  15.901
  271    HG2  GLU  35           HG2      GLU  35 -18.787   4.402  17.422
  272    HG3  GLU  35           HG3      GLU  35 -20.332   3.595  17.210
  273    H    GLU  36           H        GLU  36 -17.651   3.637  13.536
  274    HA   GLU  36           HA       GLU  36 -17.532   1.181  12.140
  275    HB2  GLU  36           HB2      GLU  36 -18.676   3.364  11.442
  276    HB3  GLU  36           HB3      GLU  36 -17.095   3.880  10.885
  277    HG2  GLU  36           HG2      GLU  36 -17.008   2.190   9.240
  278    HG3  GLU  36           HG3      GLU  36 -18.391   1.348   9.934
  279    H    ARG  37           H        ARG  37 -15.090   3.549  12.959
  280    HA   ARG  37           HA       ARG  37 -13.070   2.541  11.212
  281    HB2  ARG  37           HB2      ARG  37 -12.804   4.108  13.781
  282    HB3  ARG  37           HB3      ARG  37 -11.500   3.808  12.646
  283    HG2  ARG  37           HG2      ARG  37 -12.775   5.060  10.931
  284    HG3  ARG  37           HG3      ARG  37 -13.977   5.443  12.164
  285    HD2  ARG  37           HD2      ARG  37 -11.098   6.297  12.029
  286    HD3  ARG  37           HD3      ARG  37 -12.538   7.310  12.059
  287    HE   ARG  37           HE       ARG  37 -11.735   5.673  14.380
  288   HH11  ARG  37          HH11      ARG  37 -12.744   8.735  13.010
  289   HH12  ARG  37          HH12      ARG  37 -12.741   9.555  14.536
  290   HH21  ARG  37          HH21      ARG  37 -11.744   6.743  16.378
  291   HH22  ARG  37          HH22      ARG  37 -12.181   8.422  16.460
  292    H    ASN  38           H        ASN  38 -14.157   1.787  14.445
  293    HA   ASN  38           HA       ASN  38 -11.912   0.104  15.057
  294    HB2  ASN  38           HB2      ASN  38 -13.189   1.297  16.815
  295    HB3  ASN  38           HB3      ASN  38 -14.602   0.319  16.431
  296   HD21  ASN  38          HD21      ASN  38 -14.728  -1.759  17.168
  297   HD22  ASN  38          HD22      ASN  38 -13.578  -2.445  18.264
  298    H    ASP  39           H        ASP  39 -15.310  -0.403  14.204
  299    HA   ASP  39           HA       ASP  39 -15.120  -3.250  14.213
  300    HB2  ASP  39           HB2      ASP  39 -17.250  -2.190  14.638
  301    HB3  ASP  39           HB3      ASP  39 -17.205  -1.385  13.073
  302    H    MET  40           H        MET  40 -15.490  -0.893  11.559
  303    HA   MET  40           HA       MET  40 -15.119  -2.983   9.598
  304    HB2  MET  40           HB2      MET  40 -15.475  -0.001   9.275
  305    HB3  MET  40           HB3      MET  40 -15.398  -1.149   7.947
  306    HG2  MET  40           HG2      MET  40 -17.473  -1.201  10.121
  307    HG3  MET  40           HG3      MET  40 -17.691  -0.443   8.545
  308    HE1  MET  40           HE1      MET  40 -19.948  -3.634   8.291
  309    HE2  MET  40           HE2      MET  40 -19.884  -1.881   8.121
  310    HE3  MET  40           HE3      MET  40 -19.688  -2.621   9.710
  311    H    ILE  41           H        ILE  41 -13.126  -0.960  11.366
  312    HA   ILE  41           HA       ILE  41 -10.873  -0.711  11.445
  313    HB   ILE  41           HB       ILE  41 -10.759  -2.445   8.969
  314   HG12  ILE  41          HG12      ILE  41 -10.359  -3.179  11.880
  315   HG13  ILE  41          HG13      ILE  41 -11.790  -3.565  10.931
  316   HG21  ILE  41          HG21      ILE  41  -8.751  -1.090   9.264
  317   HG22  ILE  41          HG22      ILE  41  -8.414  -2.793   9.579
  318   HG23  ILE  41          HG23      ILE  41  -8.596  -1.667  10.925
  319   HD11  ILE  41          HD11      ILE  41 -10.330  -5.483  11.116
  320   HD12  ILE  41          HD12      ILE  41  -8.999  -4.563  10.414
  321   HD13  ILE  41          HD13      ILE  41 -10.422  -4.939   9.441
  322    H    SER  42           H        SER  42  -9.643   0.993  10.861
  323    HA   SER  42           HA       SER  42 -10.545   2.669   8.707
  324    HB2  SER  42           HB2      SER  42  -8.143   3.001  10.521
  325    HB3  SER  42           HB3      SER  42  -8.887   4.253   9.527
  326    HG   SER  42           HG       SER  42  -9.496   3.609  11.997
  327    H    TYR  43           H        TYR  43  -9.812   0.394   7.509
  328    HA   TYR  43           HA       TYR  43  -7.566   1.129   5.860
  329    HB2  TYR  43           HB2      TYR  43  -6.489   0.030   7.833
  330    HB3  TYR  43           HB3      TYR  43  -7.428  -1.419   7.499
  331    HD1  TYR  43           HD1      TYR  43  -6.660  -3.015   5.947
  332    HD2  TYR  43           HD2      TYR  43  -4.822   0.819   6.096
  333    HE1  TYR  43           HE1      TYR  43  -4.885  -3.812   4.443
  334    HE2  TYR  43           HE2      TYR  43  -3.045   0.030   4.594
  335    HH   TYR  43           HH       TYR  43  -2.005  -2.168   3.970
  336    H    LYS  44           H        LYS  44  -7.426  -0.241   3.970
  337    HA   LYS  44           HA       LYS  44  -9.954  -1.176   3.066
  338    HB2  LYS  44           HB2      LYS  44  -7.189  -1.433   1.870
  339    HB3  LYS  44           HB3      LYS  44  -8.667  -1.912   1.050
  340    HG2  LYS  44           HG2      LYS  44  -7.915   0.873   1.919
  341    HG3  LYS  44           HG3      LYS  44  -7.958   0.255   0.267
  342    HD2  LYS  44           HD2      LYS  44 -10.403  -0.181   0.584
  343    HD3  LYS  44           HD3      LYS  44 -10.293   0.656   2.132
  344    HE2  LYS  44           HE2      LYS  44 -11.048   2.293   0.648
  345    HE3  LYS  44           HE3      LYS  44  -9.322   2.610   0.803
  346    HZ1  LYS  44           HZ1      LYS  44 -10.659   1.194  -1.440
  347    HZ2  LYS  44           HZ2      LYS  44  -8.986   1.386  -1.293
  348    HZ3  LYS  44           HZ3      LYS  44  -9.978   2.742  -1.491
  349    H    GLU  45           H        GLU  45 -10.808  -2.956   3.896
  350    HA   GLU  45           HA       GLU  45  -9.263  -4.991   5.141
  351    HB2  GLU  45           HB2      GLU  45 -11.589  -4.277   5.773
  352    HB3  GLU  45           HB3      GLU  45 -12.177  -5.133   4.364
  353    HG2  GLU  45           HG2      GLU  45 -11.173  -7.177   5.299
  354    HG3  GLU  45           HG3      GLU  45 -10.774  -6.284   6.755
  355    H    ASN  46           H        ASN  46 -10.609  -4.592   1.955
  356    HA   ASN  46           HA       ASN  46 -10.242  -7.397   1.268
  357    HB2  ASN  46           HB2      ASN  46 -11.058  -5.044  -0.452
  358    HB3  ASN  46           HB3      ASN  46 -11.028  -6.720  -0.978
  359   HD21  ASN  46          HD21      ASN  46 -13.231  -4.861  -0.895
  360   HD22  ASN  46          HD22      ASN  46 -14.440  -5.582   0.106
  361    H    GLY  47           H        GLY  47  -8.171  -5.028   1.782
  362    HA2  GLY  47           HA2      GLY  47  -5.909  -4.923   1.257
  363    HA3  GLY  47           HA3      GLY  47  -6.179  -6.108  -0.027
  364    H    ASP  48           H        ASP  48  -8.316  -4.695  -1.294
  365    HA   ASP  48           HA       ASP  48  -8.661  -3.225  -2.985
  366    HB2  ASP  48           HB2      ASP  48  -8.794  -1.823  -0.899
  367    HB3  ASP  48           HB3      ASP  48  -7.137  -1.336  -1.199
  368    H    VAL  49           H        VAL  49  -6.901  -0.974  -3.750
  369    HA   VAL  49           HA       VAL  49  -4.975  -2.459  -5.273
  370    HB   VAL  49           HB       VAL  49  -4.223  -0.094  -6.005
  371   HG11  VAL  49          HG11      VAL  49  -7.020  -1.062  -6.581
  372   HG12  VAL  49          HG12      VAL  49  -5.546  -1.604  -7.381
  373   HG13  VAL  49          HG13      VAL  49  -6.093   0.060  -7.574
  374   HG21  VAL  49          HG21      VAL  49  -5.324   1.106  -4.112
  375   HG22  VAL  49          HG22      VAL  49  -6.888   0.652  -4.787
  376   HG23  VAL  49          HG23      VAL  49  -5.815   1.699  -5.699
  377    H    HIS  50           H        HIS  50  -3.208  -3.173  -4.349
  378    HA   HIS  50           HA       HIS  50  -1.695  -1.374  -2.617
  379    HB2  HIS  50           HB2      HIS  50  -1.262  -3.205  -1.008
  380    HB3  HIS  50           HB3      HIS  50  -2.960  -2.764  -1.074
  381    HD1  HIS  50           HD1      HIS  50  -4.577  -4.492  -2.250
  382    HD2  HIS  50           HD2      HIS  50  -0.687  -5.828  -1.633
  383    HE1  HIS  50           HE1      HIS  50  -4.668  -6.992  -2.509
  384    HE2  HIS  50           HE2      HIS  50  -2.336  -7.787  -2.004
  385    H    VAL  51           H        VAL  51   0.318  -1.250  -3.222
  386    HA   VAL  51           HA       VAL  51   1.538  -3.528  -4.634
  387    HB   VAL  51           HB       VAL  51   2.815  -1.820  -6.000
  388   HG11  VAL  51          HG11      VAL  51   0.967  -3.057  -6.990
  389   HG12  VAL  51          HG12      VAL  51   0.989  -1.390  -7.576
  390   HG13  VAL  51          HG13      VAL  51  -0.177  -1.876  -6.344
  391   HG21  VAL  51          HG21      VAL  51   1.828   0.384  -6.238
  392   HG22  VAL  51          HG22      VAL  51   2.459   0.095  -4.614
  393   HG23  VAL  51          HG23      VAL  51   0.720   0.016  -4.913
  394    H    LEU  52           H        LEU  52   3.546  -4.060  -4.002
  395    HA   LEU  52           HA       LEU  52   4.687  -2.619  -1.747
  396    HB2  LEU  52           HB2      LEU  52   5.555  -5.197  -3.066
  397    HB3  LEU  52           HB3      LEU  52   6.208  -4.535  -1.576
  398    HG   LEU  52           HG       LEU  52   3.351  -5.444  -1.952
  399   HD11  LEU  52          HD11      LEU  52   5.638  -6.759  -0.499
  400   HD12  LEU  52          HD12      LEU  52   4.923  -7.313  -2.012
  401   HD13  LEU  52          HD13      LEU  52   3.968  -7.324  -0.529
  402   HD21  LEU  52          HD21      LEU  52   4.860  -4.531   0.491
  403   HD22  LEU  52          HD22      LEU  52   3.241  -5.226   0.493
  404   HD23  LEU  52          HD23      LEU  52   3.534  -3.683  -0.304
  405    H    THR  53           H        THR  53   6.126  -1.076  -2.078
  406    HA   THR  53           HA       THR  53   7.767  -1.179  -4.520
  407    HB   THR  53           HB       THR  53   5.826   0.396  -4.726
  408    HG1  THR  53           HG1      THR  53   7.204   1.276  -6.046
  409   HG21  THR  53          HG21      THR  53   5.923   2.520  -3.498
  410   HG22  THR  53          HG22      THR  53   7.283   1.906  -2.559
  411   HG23  THR  53          HG23      THR  53   5.698   1.145  -2.417
  412    H    ILE  54           H        ILE  54   9.279   1.044  -4.174
  413    HA   ILE  54           HA       ILE  54  10.858   0.353  -1.796
  414    HB   ILE  54           HB       ILE  54  11.532   1.358  -4.515
  415   HG12  ILE  54          HG12      ILE  54  13.487  -0.260  -3.130
  416   HG13  ILE  54          HG13      ILE  54  11.893  -0.996  -3.106
  417   HG21  ILE  54          HG21      ILE  54  12.476   3.103  -3.118
  418   HG22  ILE  54          HG22      ILE  54  13.750   2.103  -3.815
  419   HG23  ILE  54          HG23      ILE  54  13.286   1.889  -2.128
  420   HD11  ILE  54          HD11      ILE  54  11.776  -0.865  -5.522
  421   HD12  ILE  54          HD12      ILE  54  13.232  -1.724  -5.017
  422   HD13  ILE  54          HD13      ILE  54  13.338  -0.049  -5.564
  423    H    CYS  55           H        CYS  55  10.727   1.688  -0.124
  424    HA   CYS  55           HA       CYS  55   9.719   4.351  -0.335
  425    HB2  CYS  55           HB2      CYS  55  10.058   4.540   2.017
  426    HB3  CYS  55           HB3      CYS  55   9.529   2.891   1.730
  427    H    GLU  56           H        GLU  56  10.998   6.253   0.492
  428    HA   GLU  56           HA       GLU  56  13.191   6.758  -1.130
  429    HB2  GLU  56           HB2      GLU  56  12.535   8.023   1.537
  430    HB3  GLU  56           HB3      GLU  56  13.606   8.696   0.322
  431    HG2  GLU  56           HG2      GLU  56  10.666   8.194  -0.006
  432    HG3  GLU  56           HG3      GLU  56  11.430   9.760   0.254
  433    H    ASP  57           H        ASP  57  13.145   5.618   2.234
  434    HA   ASP  57           HA       ASP  57  15.882   5.656   2.755
  435    HB2  ASP  57           HB2      ASP  57  14.347   5.225   4.544
  436    HB3  ASP  57           HB3      ASP  57  13.724   3.788   3.739
  437    H    CYS  58           H        CYS  58  13.914   3.037   1.381
  438    HA   CYS  58           HA       CYS  58  16.098   1.271   1.023
  439    HB2  CYS  58           HB2      CYS  58  13.327   1.328  -0.159
  440    HB3  CYS  58           HB3      CYS  58  14.502   0.075  -0.550
  441    H    GLN  59           H        GLN  59  14.541   3.633  -1.077
  442    HA   GLN  59           HA       GLN  59  15.878   3.187  -3.444
  443    HB2  GLN  59           HB2      GLN  59  14.245   4.857  -3.521
  444    HB3  GLN  59           HB3      GLN  59  14.889   5.687  -2.115
  445    HG2  GLN  59           HG2      GLN  59  15.425   7.084  -3.885
  446    HG3  GLN  59           HG3      GLN  59  16.918   6.212  -3.576
  447   HE21  GLN  59          HE21      GLN  59  15.771   3.779  -4.897
  448   HE22  GLN  59          HE22      GLN  59  15.881   4.108  -6.579
  449    H    GLU  60           H        GLU  60  17.073   4.677  -0.512
  450    HA   GLU  60           HA       GLU  60  19.447   5.659  -1.686
  451    HB2  GLU  60           HB2      GLU  60  18.226   5.523   0.959
  452    HB3  GLU  60           HB3      GLU  60  19.958   5.361   0.981
  453    HG2  GLU  60           HG2      GLU  60  18.515   7.580  -0.352
  454    HG3  GLU  60           HG3      GLU  60  19.164   7.672   1.275
  455    H    ALA  61           H        ALA  61  18.688   2.742   0.205
  456    HA   ALA  61           HA       ALA  61  21.339   1.723   0.217
  457    HB1  ALA  61           HB1      ALA  61  19.653   0.895   1.776
  458    HB2  ALA  61           HB2      ALA  61  20.284  -0.428   0.794
  459    HB3  ALA  61           HB3      ALA  61  18.700   0.263   0.433
  460    H    LEU  62           H        LEU  62  18.643   1.622  -1.906
  461    HA   LEU  62           HA       LEU  62  19.460  -0.276  -3.785
  462    HB2  LEU  62           HB2      LEU  62  17.420   1.663  -3.393
  463    HB3  LEU  62           HB3      LEU  62  18.048   1.859  -5.018
  464    HG   LEU  62           HG       LEU  62  17.757  -0.663  -5.183
  465   HD11  LEU  62          HD11      LEU  62  15.958  -1.598  -3.810
  466   HD12  LEU  62          HD12      LEU  62  15.946  -0.112  -2.861
  467   HD13  LEU  62          HD13      LEU  62  17.374  -1.146  -2.860
  468   HD21  LEU  62          HD21      LEU  62  16.422   0.876  -6.467
  469   HD22  LEU  62          HD22      LEU  62  15.373   1.160  -5.079
  470   HD23  LEU  62          HD23      LEU  62  15.398  -0.422  -5.859
  471    H    ASP  63           H        ASP  63  19.544   3.226  -4.001
  472    HA   ASP  63           HA       ASP  63  21.117   3.504  -6.267
  473    HB2  ASP  63           HB2      ASP  63  19.818   5.314  -5.228
  474    HB3  ASP  63           HB3      ASP  63  20.935   5.341  -3.872
  475    H    ARG  64           H        ARG  64  22.042   2.938  -2.949
  476    HA   ARG  64           HA       ARG  64  24.835   3.418  -3.266
  477    HB2  ARG  64           HB2      ARG  64  23.719   3.494  -1.086
  478    HB3  ARG  64           HB3      ARG  64  23.320   1.790  -1.219
  479    HG2  ARG  64           HG2      ARG  64  25.681   1.215  -1.135
  480    HG3  ARG  64           HG3      ARG  64  26.100   2.928  -1.036
  481    HD2  ARG  64           HD2      ARG  64  24.859   3.119   1.050
  482    HD3  ARG  64           HD3      ARG  64  24.407   1.419   0.949
  483    HE   ARG  64           HE       ARG  64  27.206   1.640   0.870
  484   HH11  ARG  64          HH11      ARG  64  24.531   2.066   3.072
  485   HH12  ARG  64          HH12      ARG  64  25.462   1.688   4.485
  486   HH21  ARG  64          HH21      ARG  64  28.447   1.148   2.726
  487   HH22  ARG  64          HH22      ARG  64  27.697   1.169   4.288
  488    H    ASN  65           H        ASN  65  22.998   0.393  -2.858
  489    HA   ASN  65           HA       ASN  65  24.963  -0.942  -4.586
  490    HB2  ASN  65           HB2      ASN  65  24.432  -3.028  -3.113
  491    HB3  ASN  65           HB3      ASN  65  25.602  -1.845  -2.544
  492   HD21  ASN  65          HD21      ASN  65  22.489  -3.269  -2.041
  493   HD22  ASN  65          HD22      ASN  65  22.176  -2.532  -0.509
  494    HA   PRO  66           HA       PRO  66  20.984  -1.143  -6.713
  495    HB2  PRO  66           HB2      PRO  66  22.769  -2.426  -8.715
  496    HB3  PRO  66           HB3      PRO  66  21.597  -1.120  -8.922
  497    HG2  PRO  66           HG2      PRO  66  24.202  -0.598  -8.880
  498    HG3  PRO  66           HG3      PRO  66  23.048   0.488  -8.084
  499    HD2  PRO  66           HD2      PRO  66  24.884  -1.541  -6.879
  500    HD3  PRO  66           HD3      PRO  66  24.434   0.070  -6.284
  501    H    HIS  67           H        HIS  67  19.562  -2.725  -7.330
  502    HA   HIS  67           HA       HIS  67  18.498  -4.706  -7.300
  503    HB2  HIS  67           HB2      HIS  67  21.292  -5.675  -7.820
  504    HB3  HIS  67           HB3      HIS  67  19.974  -6.816  -7.575
  505    HD1  HIS  67           HD1      HIS  67  18.253  -7.066  -9.454
  506    HD2  HIS  67           HD2      HIS  67  21.156  -4.188 -10.214
  507    HE1  HIS  67           HE1      HIS  67  18.005  -6.476 -11.884
  508    HE2  HIS  67           HE2      HIS  67  19.635  -4.595 -12.264
  509    H    TYR  68           H        TYR  68  17.892  -4.209  -5.151
  510    HA   TYR  68           HA       TYR  68  19.362  -5.552  -3.019
  511    HB2  TYR  68           HB2      TYR  68  18.287  -3.206  -2.864
  512    HB3  TYR  68           HB3      TYR  68  16.758  -4.063  -2.718
  513    HD1  TYR  68           HD1      TYR  68  19.536  -2.746  -0.969
  514    HD2  TYR  68           HD2      TYR  68  16.628  -5.842  -0.812
  515    HE1  TYR  68           HE1      TYR  68  19.912  -2.971   1.448
  516    HE2  TYR  68           HE2      TYR  68  16.997  -6.076   1.605
  517    HH   TYR  68           HH       TYR  68  18.744  -5.608   3.251
  518    H    HIS  69           H        HIS  69  18.956  -7.660  -3.989
  519    HA   HIS  69           HA       HIS  69  17.883  -9.654  -4.217
  520    HB2  HIS  69           HB2      HIS  69  16.164  -8.554  -1.981
  521    HB3  HIS  69           HB3      HIS  69  16.166 -10.229  -2.516
  522    HD1  HIS  69           HD1      HIS  69  17.050  -8.941   0.349
  523    HD2  HIS  69           HD2      HIS  69  19.482 -10.556  -2.612
  524    HE1  HIS  69           HE1      HIS  69  19.174  -9.615   1.508
  525    HE2  HIS  69           HE2      HIS  69  20.685 -10.439  -0.324
  526    H    GLU  70           H        GLU  70  17.245  -8.213  -6.236
  527    HA   GLU  70           HA       GLU  70  14.364  -8.494  -6.589
  528    HB2  GLU  70           HB2      GLU  70  14.208  -6.222  -7.563
  529    HB3  GLU  70           HB3      GLU  70  14.597  -6.209  -5.848
  530    HG2  GLU  70           HG2      GLU  70  16.984  -5.908  -6.451
  531    HG3  GLU  70           HG3      GLU  70  16.494  -5.764  -8.138
  532    H    TYR  71           H        TYR  71  13.765  -9.015  -8.620
  533    HA   TYR  71           HA       TYR  71  15.901  -9.484 -10.558
  534    HB2  TYR  71           HB2      TYR  71  14.133 -11.242  -9.883
  535    HB3  TYR  71           HB3      TYR  71  13.008 -10.295 -10.850
  536    HD1  TYR  71           HD1      TYR  71  15.504 -12.835 -10.880
  537    HD2  TYR  71           HD2      TYR  71  13.613  -9.916 -13.329
  538    HE1  TYR  71           HE1      TYR  71  16.262 -14.035 -12.885
  539    HE2  TYR  71           HE2      TYR  71  14.365 -11.113 -15.342
  540    HH   TYR  71           HH       TYR  71  16.159 -12.685 -15.987
  541    H    HIS  72           H        HIS  72  16.050  -8.354 -12.451
  542    HA   HIS  72           HA       HIS  72  14.540  -5.943 -12.679
  543    HB2  HIS  72           HB2      HIS  72  15.791  -5.568 -14.780
  544    HB3  HIS  72           HB3      HIS  72  16.840  -5.925 -13.420
  545    HD1  HIS  72           HD1      HIS  72  18.242  -8.082 -13.542
  546    HD2  HIS  72           HD2      HIS  72  15.784  -7.484 -16.840
  547    HE1  HIS  72           HE1      HIS  72  19.029  -9.714 -15.274
  548    HE2  HIS  72           HE2      HIS  72  17.653  -9.203 -17.318
  549    H    THR  73           H        THR  73  12.552  -5.818 -13.374
  550    HA   THR  73           HA       THR  73  11.619  -7.773 -15.355
  551    HB   THR  73           HB       THR  73   9.316  -7.157 -14.539
  552    HG1  THR  73           HG1      THR  73  10.019  -5.145 -13.541
  553   HG21  THR  73          HG21      THR  73   9.460  -8.498 -12.498
  554   HG22  THR  73          HG22      THR  73  11.210  -8.280 -12.469
  555   HG23  THR  73          HG23      THR  73  10.457  -9.193 -13.777
  Start of MODEL   14
    1    H1   GLN  -1           H1       GLN  -1  -9.594  13.899  -6.417
    2    H2   GLN  -1           H2       GLN  -1  -8.704  15.209  -7.005
    3    H3   GLN  -1           H3       GLN  -1  -9.947  15.465  -5.890
    4    HA   GLN  -1           HA       GLN  -1  -7.798  15.635  -4.834
    5    HB2  GLN  -1           HB2      GLN  -1  -8.180  13.984  -3.029
    6    HB3  GLN  -1           HB3      GLN  -1  -9.656  14.824  -3.484
    7    HG2  GLN  -1           HG2      GLN  -1 -10.380  12.908  -4.776
    8    HG3  GLN  -1           HG3      GLN  -1  -8.876  12.068  -4.409
    9   HE21  GLN  -1          HE21      GLN  -1 -10.591  14.035  -2.077
   10   HE22  GLN  -1          HE22      GLN  -1 -11.094  12.728  -1.065
   11    H    SER   0           H        SER   0  -5.866  14.563  -4.133
   12    HA   SER   0           HA       SER   0  -4.626  13.105  -6.229
   13    HB2  SER   0           HB2      SER   0  -3.623  13.550  -3.407
   14    HB3  SER   0           HB3      SER   0  -2.651  13.178  -4.831
   15    HG   SER   0           HG       SER   0  -2.915  15.496  -4.067
   16    H    MET   1           H        MET   1  -5.294  11.084  -6.613
   17    HA   MET   1           HA       MET   1  -5.123   9.131  -4.435
   18    HB2  MET   1           HB2      MET   1  -7.207   8.037  -5.302
   19    HB3  MET   1           HB3      MET   1  -7.466   9.594  -4.532
   20    HG2  MET   1           HG2      MET   1  -7.497  10.633  -6.795
   21    HG3  MET   1           HG3      MET   1  -7.419   9.011  -7.481
   22    HE1  MET   1           HE1      MET   1  -9.309   7.186  -7.149
   23    HE2  MET   1           HE2      MET   1 -10.800   7.462  -6.251
   24    HE3  MET   1           HE3      MET   1  -9.258   7.391  -5.399
   25    H    ALA   2           H        ALA   2  -4.773   6.975  -5.126
   26    HA   ALA   2           HA       ALA   2  -4.400   6.200  -7.803
   27    HB1  ALA   2           HB1      ALA   2  -1.999   6.181  -7.977
   28    HB2  ALA   2           HB2      ALA   2  -1.824   6.772  -6.326
   29    HB3  ALA   2           HB3      ALA   2  -2.497   7.823  -7.571
   30    H    LEU   3           H        LEU   3  -2.141   4.473  -7.185
   31    HA   LEU   3           HA       LEU   3  -3.431   2.277  -5.921
   32    HB2  LEU   3           HB2      LEU   3  -0.464   2.613  -6.244
   33    HB3  LEU   3           HB3      LEU   3  -1.375   1.122  -6.200
   34    HG   LEU   3           HG       LEU   3  -1.383   3.118  -8.450
   35   HD11  LEU   3          HD11      LEU   3  -0.267   1.311  -9.692
   36   HD12  LEU   3          HD12      LEU   3  -0.178   0.383  -8.194
   37   HD13  LEU   3          HD13      LEU   3   0.700   1.906  -8.342
   38   HD21  LEU   3          HD21      LEU   3  -2.655   1.482  -9.665
   39   HD22  LEU   3          HD22      LEU   3  -3.515   2.039  -8.228
   40   HD23  LEU   3          HD23      LEU   3  -2.712   0.471  -8.225
   41    H    HIS   4           H        HIS   4  -2.874   1.308  -3.896
   42    HA   HIS   4           HA       HIS   4  -1.941   3.255  -1.937
   43    HB2  HIS   4           HB2      HIS   4  -2.846   0.404  -1.487
   44    HB3  HIS   4           HB3      HIS   4  -2.603   1.627  -0.251
   45    HD1  HIS   4           HD1      HIS   4  -5.293  -0.013  -1.446
   46    HD2  HIS   4           HD2      HIS   4  -4.388   4.045  -1.437
   47    HE1  HIS   4           HE1      HIS   4  -7.499   1.173  -1.687
   48    HE2  HIS   4           HE2      HIS   4  -6.921   3.625  -1.792
   49    H    TYR   5           H        TYR   5   0.098   3.337  -1.379
   50    HA   TYR   5           HA       TYR   5   1.879   1.276  -2.447
   51    HB2  TYR   5           HB2      TYR   5   2.226   4.179  -1.774
   52    HB3  TYR   5           HB3      TYR   5   3.631   3.120  -1.867
   53    HD1  TYR   5           HD1      TYR   5   1.129   2.167  -4.306
   54    HD2  TYR   5           HD2      TYR   5   4.286   4.924  -3.503
   55    HE1  TYR   5           HE1      TYR   5   1.349   2.644  -6.698
   56    HE2  TYR   5           HE2      TYR   5   4.499   5.386  -5.888
   57    HH   TYR   5           HH       TYR   5   2.153   4.401  -8.166
   58    H    TYR   6           H        TYR   6   2.588  -0.183  -1.063
   59    HA   TYR   6           HA       TYR   6   3.415   0.743   1.604
   60    HB2  TYR   6           HB2      TYR   6   2.196  -1.941   0.913
   61    HB3  TYR   6           HB3      TYR   6   2.847  -1.496   2.490
   62    HD1  TYR   6           HD1      TYR   6   1.728   0.318   3.820
   63    HD2  TYR   6           HD2      TYR   6   0.013  -1.279   0.251
   64    HE1  TYR   6           HE1      TYR   6  -0.478   1.229   4.452
   65    HE2  TYR   6           HE2      TYR   6  -2.171  -0.365   0.884
   66    HH   TYR   6           HH       TYR   6  -2.565   1.881   3.429
   67    H    CYS   7           H        CYS   7   5.477   0.193   2.164
   68    HA   CYS   7           HA       CYS   7   7.050  -0.370  -0.146
   69    HB2  CYS   7           HB2      CYS   7   7.640   1.362   1.553
   70    HB3  CYS   7           HB3      CYS   7   8.101   0.070   2.637
   71    H    ARG   8           H        ARG   8   8.373  -1.909  -0.606
   72    HA   ARG   8           HA       ARG   8   8.102  -4.484   0.514
   73    HB2  ARG   8           HB2      ARG   8   8.696  -4.307  -1.785
   74    HB3  ARG   8           HB3      ARG   8  10.043  -3.237  -1.433
   75    HG2  ARG   8           HG2      ARG   8  10.190  -5.909  -0.208
   76    HG3  ARG   8           HG3      ARG   8  10.293  -5.856  -1.972
   77    HD2  ARG   8           HD2      ARG   8  11.997  -4.185  -0.126
   78    HD3  ARG   8           HD3      ARG   8  12.499  -5.731  -0.800
   79    HE   ARG   8           HE       ARG   8  11.704  -3.593  -2.637
   80   HH11  ARG   8          HH11      ARG   8  14.264  -5.517  -1.209
   81   HH12  ARG   8          HH12      ARG   8  15.384  -5.200  -2.493
   82   HH21  ARG   8          HH21      ARG   8  13.175  -3.231  -4.344
   83   HH22  ARG   8          HH22      ARG   8  14.776  -3.902  -4.264
   84    H    HIS   9           H        HIS   9   8.796  -5.028   2.395
   85    HA   HIS   9           HA       HIS   9  10.412  -5.964   3.721
   86    HB2  HIS   9           HB2      HIS   9  12.096  -5.593   1.918
   87    HB3  HIS   9           HB3      HIS   9  12.408  -4.000   2.594
   88    HD1  HIS   9           HD1      HIS   9  13.072  -7.623   3.141
   89    HD2  HIS   9           HD2      HIS   9  13.856  -4.001   5.026
   90    HE1  HIS   9           HE1      HIS   9  14.824  -8.125   4.872
   91    HE2  HIS   9           HE2      HIS   9  15.240  -5.934   6.046
   92    H    CYS  10           H        CYS  10  10.479  -2.383   3.497
   93    HA   CYS  10           HA       CYS  10  11.165  -2.368   6.333
   94    HB2  CYS  10           HB2      CYS  10  11.897  -0.181   6.100
   95    HB3  CYS  10           HB3      CYS  10  12.250  -0.860   4.519
   96    H    GLY  11           H        GLY  11   8.444  -2.173   4.373
   97    HA2  GLY  11           HA2      GLY  11   6.229  -2.142   4.927
   98    HA3  GLY  11           HA3      GLY  11   6.734  -2.215   6.618
   99    H    VAL  12           H        VAL  12   7.646   0.440   4.482
  100    HA   VAL  12           HA       VAL  12   6.073   2.218   6.132
  101    HB   VAL  12           HB       VAL  12   8.284   3.018   5.763
  102   HG11  VAL  12          HG11      VAL  12   7.736   2.914   2.810
  103   HG12  VAL  12          HG12      VAL  12   8.744   1.763   3.686
  104   HG13  VAL  12          HG13      VAL  12   9.222   3.456   3.585
  105   HG21  VAL  12          HG21      VAL  12   6.515   4.694   5.734
  106   HG22  VAL  12          HG22      VAL  12   6.436   4.539   3.978
  107   HG23  VAL  12          HG23      VAL  12   7.897   5.164   4.744
  108    H    LYS  13           H        LYS  13   4.479   3.524   5.432
  109    HA   LYS  13           HA       LYS  13   3.051   2.629   3.071
  110    HB2  LYS  13           HB2      LYS  13   2.354   4.768   5.083
  111    HB3  LYS  13           HB3      LYS  13   1.279   4.133   3.853
  112    HG2  LYS  13           HG2      LYS  13   1.307   1.965   4.915
  113    HG3  LYS  13           HG3      LYS  13   2.462   2.542   6.114
  114    HD2  LYS  13           HD2      LYS  13  -0.244   3.795   5.711
  115    HD3  LYS  13           HD3      LYS  13   0.037   2.471   6.841
  116    HE2  LYS  13           HE2      LYS  13   1.400   5.164   6.891
  117    HE3  LYS  13           HE3      LYS  13   0.104   4.644   7.965
  118    HZ1  LYS  13           HZ1      LYS  13   1.575   2.864   8.761
  119    HZ2  LYS  13           HZ2      LYS  13   2.210   4.402   9.059
  120    HZ3  LYS  13           HZ3      LYS  13   2.825   3.470   7.793
  121    H    VAL  14           H        VAL  14   4.032   3.366   1.257
  122    HA   VAL  14           HA       VAL  14   5.211   6.003   1.164
  123    HB   VAL  14           HB       VAL  14   5.058   4.833  -1.454
  124   HG11  VAL  14          HG11      VAL  14   7.302   5.399   0.459
  125   HG12  VAL  14          HG12      VAL  14   6.754   6.386  -0.896
  126   HG13  VAL  14          HG13      VAL  14   7.544   4.839  -1.197
  127   HG21  VAL  14          HG21      VAL  14   6.362   2.806  -1.112
  128   HG22  VAL  14          HG22      VAL  14   4.783   2.676  -0.347
  129   HG23  VAL  14          HG23      VAL  14   6.215   2.991   0.635
  130    H    GLY  15           H        GLY  15   2.170   4.647   0.489
  131    HA2  GLY  15           HA2      GLY  15   1.410   7.090  -0.989
  132    HA3  GLY  15           HA3      GLY  15   0.804   5.509  -1.458
  133    H    SER  16           H        SER  16   1.074   7.437   1.519
  134    HA   SER  16           HA       SER  16  -1.714   7.648   1.902
  135    HB2  SER  16           HB2      SER  16  -1.422   5.206   2.435
  136    HB3  SER  16           HB3      SER  16  -0.343   5.672   3.748
  137    HG   SER  16           HG       SER  16  -2.151   6.906   4.596
  138    H    LEU  17           H        LEU  17  -1.279   9.767   2.361
  139    HA   LEU  17           HA       LEU  17  -0.114  10.241   4.982
  140    HB2  LEU  17           HB2      LEU  17   1.144  12.170   4.262
  141    HB3  LEU  17           HB3      LEU  17   1.669  10.752   3.381
  142    HG   LEU  17           HG       LEU  17  -0.343  12.605   2.148
  143   HD11  LEU  17          HD11      LEU  17   2.646  12.971   2.062
  144   HD12  LEU  17          HD12      LEU  17   1.518  14.005   2.935
  145   HD13  LEU  17          HD13      LEU  17   1.446  13.911   1.176
  146   HD21  LEU  17          HD21      LEU  17   0.677  11.809   0.078
  147   HD22  LEU  17          HD22      LEU  17   0.119  10.456   1.062
  148   HD23  LEU  17          HD23      LEU  17   1.836  10.855   1.005
  149    H    GLU  18           H        GLU  18  -1.938  11.497   2.316
  150    HA   GLU  18           HA       GLU  18  -3.237  13.426   4.081
  151    HB2  GLU  18           HB2      GLU  18  -4.118  14.421   1.962
  152    HB3  GLU  18           HB3      GLU  18  -2.368  14.448   2.105
  153    HG2  GLU  18           HG2      GLU  18  -2.297  12.411   0.665
  154    HG3  GLU  18           HG3      GLU  18  -4.033  12.595   0.420
  155    H    SER  19           H        SER  19  -3.752  10.518   3.987
  156    HA   SER  19           HA       SER  19  -6.219   9.967   2.750
  157    HB2  SER  19           HB2      SER  19  -5.065   8.641   5.207
  158    HB3  SER  19           HB3      SER  19  -6.173   7.938   4.031
  159    HG   SER  19           HG       SER  19  -4.130   7.230   3.520
  160    H    SER  20           H        SER  20  -5.438  11.749   5.519
  161    HA   SER  20           HA       SER  20  -7.603  11.347   7.207
  162    HB2  SER  20           HB2      SER  20  -6.175  13.965   6.718
  163    HB3  SER  20           HB3      SER  20  -7.053  13.496   8.173
  164    HG   SER  20           HG       SER  20  -4.567  13.232   7.906
  165    H    MET  21           H        MET  21  -7.276  13.470   4.393
  166    HA   MET  21           HA       MET  21 -10.147  14.070   4.621
  167    HB2  MET  21           HB2      MET  21  -9.688  16.124   3.330
  168    HB3  MET  21           HB3      MET  21  -8.856  16.090   4.876
  169    HG2  MET  21           HG2      MET  21  -7.567  15.376   2.255
  170    HG3  MET  21           HG3      MET  21  -7.526  16.979   2.973
  171    HE1  MET  21           HE1      MET  21  -5.460  16.371   6.244
  172    HE2  MET  21           HE2      MET  21  -7.214  16.334   6.079
  173    HE3  MET  21           HE3      MET  21  -6.276  17.567   5.239
  174    H    VAL  22           H        VAL  22  -7.583  12.854   2.680
  175    HA   VAL  22           HA       VAL  22  -9.302  12.559   0.351
  176    HB   VAL  22           HB       VAL  22  -6.411  11.765   0.764
  177   HG11  VAL  22          HG11      VAL  22  -7.497  10.436  -0.948
  178   HG12  VAL  22          HG12      VAL  22  -6.328  11.547  -1.659
  179   HG13  VAL  22          HG13      VAL  22  -8.053  11.902  -1.750
  180   HG21  VAL  22          HG21      VAL  22  -7.611  14.154  -0.626
  181   HG22  VAL  22          HG22      VAL  22  -5.902  13.721  -0.633
  182   HG23  VAL  22          HG23      VAL  22  -6.692  14.168   0.878
  183    H    SER  23           H        SER  23 -10.787  11.154   1.449
  184    HA   SER  23           HA       SER  23  -9.944   8.631   2.490
  185    HB2  SER  23           HB2      SER  23 -12.705   9.482   1.647
  186    HB3  SER  23           HB3      SER  23 -12.299   8.169   2.747
  187    HG   SER  23           HG       SER  23 -11.739   9.586   4.291
  188    H    THR  24           H        THR  24  -8.704   7.998   0.638
  189    HA   THR  24           HA       THR  24 -10.363   6.487  -1.263
  190    HB   THR  24           HB       THR  24  -9.267   8.486  -2.352
  191    HG1  THR  24           HG1      THR  24  -9.797   6.661  -3.602
  192   HG21  THR  24          HG21      THR  24  -6.866   8.402  -2.783
  193   HG22  THR  24          HG22      THR  24  -6.728   6.939  -1.810
  194   HG23  THR  24          HG23      THR  24  -7.179   8.462  -1.048
  195    H    ASP  25           H        ASP  25  -8.567   6.208   1.325
  196    HA   ASP  25           HA       ASP  25  -6.650   4.221   0.347
  197    HB2  ASP  25           HB2      ASP  25  -5.570   4.451   2.509
  198    HB3  ASP  25           HB3      ASP  25  -5.838   6.051   1.823
  199    H    SER  26           H        SER  26  -9.610   4.550   2.021
  200    HA   SER  26           HA       SER  26  -9.359   1.883   3.200
  201    HB2  SER  26           HB2      SER  26  -9.889   3.780   4.708
  202    HB3  SER  26           HB3      SER  26 -11.367   4.066   3.792
  203    HG   SER  26           HG       SER  26 -12.255   2.645   5.051
  204    H    LEU  27           H        LEU  27 -10.558   0.242   2.495
  205    HA   LEU  27           HA       LEU  27 -12.249   0.562   0.215
  206    HB2  LEU  27           HB2      LEU  27 -10.619  -1.374   0.909
  207    HB3  LEU  27           HB3      LEU  27 -12.002  -1.957   1.812
  208    HG   LEU  27           HG       LEU  27 -12.307  -1.302  -1.071
  209   HD11  LEU  27          HD11      LEU  27 -11.148  -3.856   0.027
  210   HD12  LEU  27          HD12      LEU  27 -10.329  -2.691  -1.014
  211   HD13  LEU  27          HD13      LEU  27 -11.693  -3.620  -1.634
  212   HD21  LEU  27          HD21      LEU  27 -14.300  -1.830   0.219
  213   HD22  LEU  27          HD22      LEU  27 -13.573  -3.346   0.749
  214   HD23  LEU  27          HD23      LEU  27 -13.974  -3.107  -0.952
  215    H    GLY  28           H        GLY  28 -14.437   0.485   0.130
  216    HA2  GLY  28           HA2      GLY  28 -15.927   0.913   2.544
  217    HA3  GLY  28           HA3      GLY  28 -16.584   0.776   0.919
  218    H    PHE  29           H        PHE  29 -15.303  -1.076   3.611
  219    HA   PHE  29           HA       PHE  29 -15.817  -3.650   2.808
  220    HB2  PHE  29           HB2      PHE  29 -16.155  -2.517   5.584
  221    HB3  PHE  29           HB3      PHE  29 -15.920  -4.211   5.203
  222    HD1  PHE  29           HD1      PHE  29 -14.337  -1.530   6.519
  223    HD2  PHE  29           HD2      PHE  29 -13.763  -4.433   3.461
  224    HE1  PHE  29           HE1      PHE  29 -11.909  -1.179   6.651
  225    HE2  PHE  29           HE2      PHE  29 -11.334  -4.094   3.592
  226    HZ   PHE  29           HZ       PHE  29 -10.400  -2.468   5.187
  227    H    GLN  30           H        GLN  30 -17.955  -1.965   5.083
  228    HA   GLN  30           HA       GLN  30 -20.281  -2.951   3.635
  229    HB2  GLN  30           HB2      GLN  30 -19.675  -3.505   6.540
  230    HB3  GLN  30           HB3      GLN  30 -21.308  -3.561   5.894
  231    HG2  GLN  30           HG2      GLN  30 -20.565  -5.254   4.294
  232    HG3  GLN  30           HG3      GLN  30 -18.980  -5.259   5.056
  233   HE21  GLN  30          HE21      GLN  30 -20.937  -7.412   4.787
  234   HE22  GLN  30          HE22      GLN  30 -21.283  -7.941   6.397
  235    H    HIS  31           H        HIS  31 -20.126  -1.728   6.869
  236    HA   HIS  31           HA       HIS  31 -21.038   0.924   6.023
  237    HB2  HIS  31           HB2      HIS  31 -23.019  -0.650   6.359
  238    HB3  HIS  31           HB3      HIS  31 -22.587  -0.678   8.063
  239    HD1  HIS  31           HD1      HIS  31 -23.954   0.877   9.381
  240    HD2  HIS  31           HD2      HIS  31 -23.340   2.276   5.518
  241    HE1  HIS  31           HE1      HIS  31 -25.221   3.043   9.238
  242    HE2  HIS  31           HE2      HIS  31 -25.011   3.746   6.828
  243    H    LEU  32           H        LEU  32 -18.696   1.012   6.880
  244    HA   LEU  32           HA       LEU  32 -18.513   0.946   9.781
  245    HB2  LEU  32           HB2      LEU  32 -16.460   1.379   7.630
  246    HB3  LEU  32           HB3      LEU  32 -16.094   1.604   9.318
  247    HG   LEU  32           HG       LEU  32 -15.288  -0.548   8.584
  248   HD11  LEU  32          HD11      LEU  32 -16.147  -0.400  10.864
  249   HD12  LEU  32          HD12      LEU  32 -16.361  -2.010  10.176
  250   HD13  LEU  32          HD13      LEU  32 -17.736  -0.913  10.295
  251   HD21  LEU  32          HD21      LEU  32 -18.130  -1.183   7.821
  252   HD22  LEU  32          HD22      LEU  32 -16.754  -2.284   7.748
  253   HD23  LEU  32          HD23      LEU  32 -16.808  -0.866   6.698
  254    H    THR  33           H        THR  33 -16.889   3.308   7.699
  255    HA   THR  33           HA       THR  33 -18.132   5.425   9.333
  256    HB   THR  33           HB       THR  33 -16.181   6.794   8.912
  257    HG1  THR  33           HG1      THR  33 -14.999   4.612   7.519
  258   HG21  THR  33          HG21      THR  33 -16.024   5.253  10.793
  259   HG22  THR  33          HG22      THR  33 -14.447   5.463  10.033
  260   HG23  THR  33          HG23      THR  33 -15.384   4.001   9.729
  261    H    ASN  34           H        ASN  34 -17.801   7.659   7.981
  262    HA   ASN  34           HA       ASN  34 -19.540   7.515   5.756
  263    HB2  ASN  34           HB2      ASN  34 -19.176   9.854   5.464
  264    HB3  ASN  34           HB3      ASN  34 -19.125   9.564   7.198
  265   HD21  ASN  34          HD21      ASN  34 -17.185   9.804   8.298
  266   HD22  ASN  34          HD22      ASN  34 -15.805  10.569   7.588
  267    H    GLU  35           H        GLU  35 -16.119   7.231   6.124
  268    HA   GLU  35           HA       GLU  35 -15.316   7.761   3.468
  269    HB2  GLU  35           HB2      GLU  35 -13.948   5.828   5.334
  270    HB3  GLU  35           HB3      GLU  35 -13.221   6.836   4.087
  271    HG2  GLU  35           HG2      GLU  35 -13.993   8.816   5.454
  272    HG3  GLU  35           HG3      GLU  35 -14.319   7.674   6.748
  273    H    GLU  36           H        GLU  36 -16.053   4.778   5.208
  274    HA   GLU  36           HA       GLU  36 -15.783   3.047   2.993
  275    HB2  GLU  36           HB2      GLU  36 -17.264   2.817   5.596
  276    HB3  GLU  36           HB3      GLU  36 -17.339   1.545   4.390
  277    HG2  GLU  36           HG2      GLU  36 -15.680   0.940   5.933
  278    HG3  GLU  36           HG3      GLU  36 -14.843   1.440   4.471
  279    H    ARG  37           H        ARG  37 -18.473   4.924   4.216
  280    HA   ARG  37           HA       ARG  37 -20.507   3.868   2.589
  281    HB2  ARG  37           HB2      ARG  37 -20.194   6.684   3.638
  282    HB3  ARG  37           HB3      ARG  37 -21.663   6.044   2.917
  283    HG2  ARG  37           HG2      ARG  37 -21.790   4.372   4.720
  284    HG3  ARG  37           HG3      ARG  37 -20.357   5.095   5.457
  285    HD2  ARG  37           HD2      ARG  37 -21.592   7.257   5.571
  286    HD3  ARG  37           HD3      ARG  37 -23.030   6.411   5.004
  287    HE   ARG  37           HE       ARG  37 -21.827   5.250   7.349
  288   HH11  ARG  37          HH11      ARG  37 -24.123   7.601   6.147
  289   HH12  ARG  37          HH12      ARG  37 -25.021   7.671   7.629
  290   HH21  ARG  37          HH21      ARG  37 -23.004   5.343   9.307
  291   HH22  ARG  37          HH22      ARG  37 -24.378   6.393   9.428
  292    H    ASN  38           H        ASN  38 -18.002   6.210   1.923
  293    HA   ASN  38           HA       ASN  38 -19.137   7.155  -0.520
  294    HB2  ASN  38           HB2      ASN  38 -17.580   8.525   0.777
  295    HB3  ASN  38           HB3      ASN  38 -16.310   7.333   0.544
  296   HD21  ASN  38          HD21      ASN  38 -18.586   8.367  -1.947
  297   HD22  ASN  38          HD22      ASN  38 -17.408   9.137  -2.944
  298    H    ASP  39           H        ASP  39 -16.715   4.734   0.327
  299    HA   ASP  39           HA       ASP  39 -16.147   4.070  -2.416
  300    HB2  ASP  39           HB2      ASP  39 -14.462   3.830  -0.593
  301    HB3  ASP  39           HB3      ASP  39 -15.427   2.523   0.082
  302    H    MET  40           H        MET  40 -18.689   3.408  -0.372
  303    HA   MET  40           HA       MET  40 -19.207   0.673  -0.747
  304    HB2  MET  40           HB2      MET  40 -20.276   2.037   0.995
  305    HB3  MET  40           HB3      MET  40 -21.148   2.938  -0.234
  306    HG2  MET  40           HG2      MET  40 -22.204   0.744  -0.909
  307    HG3  MET  40           HG3      MET  40 -21.509   0.067   0.561
  308    HE1  MET  40           HE1      MET  40 -21.727   2.380   2.649
  309    HE2  MET  40           HE2      MET  40 -22.249   0.736   3.008
  310    HE3  MET  40           HE3      MET  40 -23.312   2.096   3.363
  311    H    ILE  41           H        ILE  41 -19.394   3.212  -2.978
  312    HA   ILE  41           HA       ILE  41 -21.418   2.523  -4.725
  313    HB   ILE  41           HB       ILE  41 -19.972   4.491  -5.005
  314   HG12  ILE  41          HG12      ILE  41 -19.903   2.658  -7.413
  315   HG13  ILE  41          HG13      ILE  41 -21.260   3.674  -6.940
  316   HG21  ILE  41          HG21      ILE  41 -17.842   3.519  -4.404
  317   HG22  ILE  41          HG22      ILE  41 -17.738   4.265  -6.000
  318   HG23  ILE  41          HG23      ILE  41 -17.867   2.512  -5.853
  319   HD11  ILE  41          HD11      ILE  41 -19.889   5.663  -7.304
  320   HD12  ILE  41          HD12      ILE  41 -20.012   4.676  -8.759
  321   HD13  ILE  41          HD13      ILE  41 -18.538   4.638  -7.791
  322    H    SER  42           H        SER  42 -21.363   1.227  -6.718
  323    HA   SER  42           HA       SER  42 -20.422  -1.410  -6.069
  324    HB2  SER  42           HB2      SER  42 -22.656  -0.752  -7.154
  325    HB3  SER  42           HB3      SER  42 -21.748  -0.630  -8.654
  326    HG   SER  42           HG       SER  42 -21.030  -2.844  -8.175
  327    H    TYR  43           H        TYR  43 -18.341   0.422  -6.573
  328    HA   TYR  43           HA       TYR  43 -16.687  -1.183  -8.189
  329    HB2  TYR  43           HB2      TYR  43 -17.874   0.078  -9.996
  330    HB3  TYR  43           HB3      TYR  43 -17.275   1.577  -9.296
  331    HD1  TYR  43           HD1      TYR  43 -16.472  -1.339 -11.310
  332    HD2  TYR  43           HD2      TYR  43 -14.835   2.090  -9.397
  333    HE1  TYR  43           HE1      TYR  43 -14.425  -1.577 -12.649
  334    HE2  TYR  43           HE2      TYR  43 -12.784   1.866 -10.735
  335    HH   TYR  43           HH       TYR  43 -11.557   0.126 -11.952
  336    H    LYS  44           H        LYS  44 -15.062  -1.187  -6.823
  337    HA   LYS  44           HA       LYS  44 -14.654   0.486  -4.699
  338    HB2  LYS  44           HB2      LYS  44 -12.619  -1.141  -6.222
  339    HB3  LYS  44           HB3      LYS  44 -12.334  -0.427  -4.643
  340    HG2  LYS  44           HG2      LYS  44 -14.052  -1.799  -3.661
  341    HG3  LYS  44           HG3      LYS  44 -14.491  -2.441  -5.244
  342    HD2  LYS  44           HD2      LYS  44 -12.276  -3.423  -5.465
  343    HD3  LYS  44           HD3      LYS  44 -11.814  -2.765  -3.897
  344    HE2  LYS  44           HE2      LYS  44 -13.448  -4.144  -2.789
  345    HE3  LYS  44           HE3      LYS  44 -14.063  -4.723  -4.338
  346    HZ1  LYS  44           HZ1      LYS  44 -12.018  -5.839  -4.757
  347    HZ2  LYS  44           HZ2      LYS  44 -12.520  -6.281  -3.205
  348    HZ3  LYS  44           HZ3      LYS  44 -11.273  -5.153  -3.402
  349    H    GLU  45           H        GLU  45 -14.414   2.614  -4.754
  350    HA   GLU  45           HA       GLU  45 -13.155   3.975  -6.939
  351    HB2  GLU  45           HB2      GLU  45 -15.045   4.938  -5.629
  352    HB3  GLU  45           HB3      GLU  45 -13.982   5.082  -4.246
  353    HG2  GLU  45           HG2      GLU  45 -12.596   6.608  -5.481
  354    HG3  GLU  45           HG3      GLU  45 -13.614   6.442  -6.898
  355    H    ASN  46           H        ASN  46 -12.252   2.854  -3.787
  356    HA   ASN  46           HA       ASN  46  -9.834   4.250  -3.453
  357    HB2  ASN  46           HB2      ASN  46  -9.268   2.592  -1.811
  358    HB3  ASN  46           HB3      ASN  46 -11.003   2.869  -1.706
  359   HD21  ASN  46          HD21      ASN  46 -12.427   1.275  -2.445
  360   HD22  ASN  46          HD22      ASN  46 -11.902  -0.364  -2.663
  361    H    GLY  47           H        GLY  47 -10.691   1.798  -5.671
  362    HA2  GLY  47           HA2      GLY  47  -9.365   1.502  -7.623
  363    HA3  GLY  47           HA3      GLY  47  -7.928   1.838  -6.660
  364    H    ASP  48           H        ASP  48  -9.097  -0.040  -4.551
  365    HA   ASP  48           HA       ASP  48  -8.496  -2.112  -3.840
  366    HB2  ASP  48           HB2      ASP  48 -10.434  -2.675  -5.309
  367    HB3  ASP  48           HB3      ASP  48  -9.308  -2.936  -6.628
  368    H    VAL  49           H        VAL  49  -6.359  -0.875  -4.153
  369    HA   VAL  49           HA       VAL  49  -4.554  -2.519  -5.757
  370    HB   VAL  49           HB       VAL  49  -3.372  -0.075  -5.979
  371   HG11  VAL  49          HG11      VAL  49  -5.189  -1.610  -7.805
  372   HG12  VAL  49          HG12      VAL  49  -3.429  -1.448  -7.852
  373   HG13  VAL  49          HG13      VAL  49  -4.453  -0.087  -8.320
  374   HG21  VAL  49          HG21      VAL  49  -6.353   0.358  -6.204
  375   HG22  VAL  49          HG22      VAL  49  -5.136   1.474  -6.813
  376   HG23  VAL  49          HG23      VAL  49  -5.252   1.157  -5.080
  377    H    HIS  50           H        HIS  50  -3.259  -3.392  -4.372
  378    HA   HIS  50           HA       HIS  50  -2.085  -1.788  -2.200
  379    HB2  HIS  50           HB2      HIS  50  -3.744  -3.555  -1.437
  380    HB3  HIS  50           HB3      HIS  50  -2.663  -4.761  -2.116
  381    HD1  HIS  50           HD1      HIS  50  -3.499  -3.267   0.967
  382    HD2  HIS  50           HD2      HIS  50   0.073  -4.470  -0.791
  383    HE1  HIS  50           HE1      HIS  50  -1.882  -3.590   2.862
  384    HE2  HIS  50           HE2      HIS  50   0.230  -4.435   1.790
  385    H    VAL  51           H        VAL  51  -0.226  -1.301  -3.343
  386    HA   VAL  51           HA       VAL  51   1.212  -3.544  -4.589
  387    HB   VAL  51           HB       VAL  51   2.466  -1.724  -5.826
  388   HG11  VAL  51          HG11      VAL  51   0.764  -2.998  -6.958
  389   HG12  VAL  51          HG12      VAL  51   0.620  -1.300  -7.422
  390   HG13  VAL  51          HG13      VAL  51  -0.502  -1.993  -6.251
  391   HG21  VAL  51          HG21      VAL  51   1.949   0.121  -4.359
  392   HG22  VAL  51          HG22      VAL  51   0.236  -0.024  -4.757
  393   HG23  VAL  51          HG23      VAL  51   1.395   0.448  -6.000
  394    H    LEU  52           H        LEU  52   3.252  -4.025  -4.052
  395    HA   LEU  52           HA       LEU  52   4.424  -2.558  -1.806
  396    HB2  LEU  52           HB2      LEU  52   4.663  -5.354  -2.816
  397    HB3  LEU  52           HB3      LEU  52   6.039  -4.658  -1.976
  398    HG   LEU  52           HG       LEU  52   4.668  -4.276   0.008
  399   HD11  LEU  52          HD11      LEU  52   2.523  -3.871  -1.058
  400   HD12  LEU  52          HD12      LEU  52   2.387  -5.153   0.145
  401   HD13  LEU  52          HD13      LEU  52   2.442  -5.556  -1.571
  402   HD21  LEU  52          HD21      LEU  52   4.437  -7.087  -1.051
  403   HD22  LEU  52          HD22      LEU  52   4.287  -6.605   0.639
  404   HD23  LEU  52          HD23      LEU  52   5.823  -6.403  -0.202
  405    H    THR  53           H        THR  53   5.929  -1.139  -2.228
  406    HA   THR  53           HA       THR  53   7.536  -1.419  -4.670
  407    HB   THR  53           HB       THR  53   5.623   0.096  -5.117
  408    HG1  THR  53           HG1      THR  53   7.285   2.066  -5.391
  409   HG21  THR  53          HG21      THR  53   6.852   1.857  -2.996
  410   HG22  THR  53          HG22      THR  53   5.350   0.951  -2.821
  411   HG23  THR  53          HG23      THR  53   5.462   2.250  -4.009
  412    H    ILE  54           H        ILE  54   9.162   0.588  -4.617
  413    HA   ILE  54           HA       ILE  54  10.640   0.274  -2.115
  414    HB   ILE  54           HB       ILE  54  11.390   1.139  -4.891
  415   HG12  ILE  54          HG12      ILE  54  12.806  -0.826  -3.117
  416   HG13  ILE  54          HG13      ILE  54  11.391  -1.305  -4.039
  417   HG21  ILE  54          HG21      ILE  54  13.100   1.453  -2.438
  418   HG22  ILE  54          HG22      ILE  54  12.435   2.755  -3.424
  419   HG23  ILE  54          HG23      ILE  54  13.640   1.661  -4.103
  420   HD11  ILE  54          HD11      ILE  54  13.962  -0.206  -5.150
  421   HD12  ILE  54          HD12      ILE  54  12.540  -0.625  -6.103
  422   HD13  ILE  54          HD13      ILE  54  13.417  -1.880  -5.229
  423    H    CYS  55           H        CYS  55  10.647   1.828  -0.635
  424    HA   CYS  55           HA       CYS  55   9.592   4.450  -1.200
  425    HB2  CYS  55           HB2      CYS  55   9.811   4.890   1.140
  426    HB3  CYS  55           HB3      CYS  55   9.238   3.235   0.990
  427    H    GLU  56           H        GLU  56  10.925   6.352  -0.186
  428    HA   GLU  56           HA       GLU  56  13.191   6.797  -1.736
  429    HB2  GLU  56           HB2      GLU  56  11.841   8.564  -0.639
  430    HB3  GLU  56           HB3      GLU  56  12.486   8.069   0.918
  431    HG2  GLU  56           HG2      GLU  56  14.770   8.587   0.003
  432    HG3  GLU  56           HG3      GLU  56  13.955   9.322  -1.377
  433    H    ASP  57           H        ASP  57  12.885   5.763   1.621
  434    HA   ASP  57           HA       ASP  57  15.570   5.662   2.333
  435    HB2  ASP  57           HB2      ASP  57  14.044   5.474   4.094
  436    HB3  ASP  57           HB3      ASP  57  13.127   4.206   3.292
  437    H    CYS  58           H        CYS  58  13.554   3.061   0.932
  438    HA   CYS  58           HA       CYS  58  15.733   1.214   1.072
  439    HB2  CYS  58           HB2      CYS  58  13.061   0.961  -0.332
  440    HB3  CYS  58           HB3      CYS  58  14.269  -0.314  -0.248
  441    H    GLN  59           H        GLN  59  14.343   3.199  -1.523
  442    HA   GLN  59           HA       GLN  59  15.966   2.435  -3.626
  443    HB2  GLN  59           HB2      GLN  59  14.092   4.167  -3.504
  444    HB3  GLN  59           HB3      GLN  59  15.313   5.311  -2.991
  445    HG2  GLN  59           HG2      GLN  59  15.127   3.891  -5.646
  446    HG3  GLN  59           HG3      GLN  59  14.871   5.597  -5.327
  447   HE21  GLN  59          HE21      GLN  59  16.678   6.907  -4.795
  448   HE22  GLN  59          HE22      GLN  59  18.262   6.452  -5.321
  449    H    GLU  60           H        GLU  60  16.749   4.570  -0.864
  450    HA   GLU  60           HA       GLU  60  19.320   5.088  -1.921
  451    HB2  GLU  60           HB2      GLU  60  17.965   5.572   0.712
  452    HB3  GLU  60           HB3      GLU  60  19.640   5.916   0.470
  453    HG2  GLU  60           HG2      GLU  60  19.048   7.414  -1.396
  454    HG3  GLU  60           HG3      GLU  60  17.369   7.111  -0.992
  455    H    ALA  61           H        ALA  61  17.991   2.818   0.412
  456    HA   ALA  61           HA       ALA  61  20.331   1.503   1.171
  457    HB1  ALA  61           HB1      ALA  61  18.119   0.963   2.091
  458    HB2  ALA  61           HB2      ALA  61  18.923  -0.480   1.471
  459    HB3  ALA  61           HB3      ALA  61  17.638   0.285   0.535
  460    H    LEU  62           H        LEU  62  18.582   1.659  -1.747
  461    HA   LEU  62           HA       LEU  62  19.747  -0.579  -3.121
  462    HB2  LEU  62           HB2      LEU  62  18.033   1.765  -3.834
  463    HB3  LEU  62           HB3      LEU  62  18.711   0.794  -5.092
  464    HG   LEU  62           HG       LEU  62  16.303   0.436  -3.672
  465   HD11  LEU  62          HD11      LEU  62  16.561   0.003  -6.011
  466   HD12  LEU  62          HD12      LEU  62  16.001  -1.463  -5.207
  467   HD13  LEU  62          HD13      LEU  62  17.692  -1.310  -5.684
  468   HD21  LEU  62          HD21      LEU  62  18.183  -1.866  -3.201
  469   HD22  LEU  62          HD22      LEU  62  16.454  -1.840  -2.854
  470   HD23  LEU  62          HD23      LEU  62  17.546  -0.777  -1.968
  471    H    ASP  63           H        ASP  63  19.900   2.930  -3.584
  472    HA   ASP  63           HA       ASP  63  21.923   2.738  -5.570
  473    HB2  ASP  63           HB2      ASP  63  20.328   4.500  -5.747
  474    HB3  ASP  63           HB3      ASP  63  20.693   5.101  -4.136
  475    H    ARG  64           H        ARG  64  22.038   3.178  -2.109
  476    HA   ARG  64           HA       ARG  64  24.807   4.087  -2.259
  477    HB2  ARG  64           HB2      ARG  64  23.041   3.647   0.149
  478    HB3  ARG  64           HB3      ARG  64  24.659   4.333   0.187
  479    HG2  ARG  64           HG2      ARG  64  23.891   6.214  -1.175
  480    HG3  ARG  64           HG3      ARG  64  22.270   5.521  -1.209
  481    HD2  ARG  64           HD2      ARG  64  23.772   6.484   1.223
  482    HD3  ARG  64           HD3      ARG  64  22.382   7.259   0.466
  483    HE   ARG  64           HE       ARG  64  21.917   4.549   1.349
  484   HH11  ARG  64          HH11      ARG  64  21.773   7.941   2.200
  485   HH12  ARG  64          HH12      ARG  64  20.631   7.702   3.481
  486   HH21  ARG  64          HH21      ARG  64  20.423   4.230   3.042
  487   HH22  ARG  64          HH22      ARG  64  19.867   5.593   3.964
  488    H    ASN  65           H        ASN  65  23.041   1.178  -1.720
  489    HA   ASN  65           HA       ASN  65  25.580  -0.214  -1.212
  490    HB2  ASN  65           HB2      ASN  65  22.959  -0.740   0.206
  491    HB3  ASN  65           HB3      ASN  65  24.354  -1.809   0.278
  492   HD21  ASN  65          HD21      ASN  65  26.178  -1.171   1.437
  493   HD22  ASN  65          HD22      ASN  65  26.126   0.129   2.576
  494    HA   PRO  66           HA       PRO  66  24.372  -2.344  -4.917
  495    HB2  PRO  66           HB2      PRO  66  26.037  -4.513  -3.750
  496    HB3  PRO  66           HB3      PRO  66  26.122  -3.765  -5.347
  497    HG2  PRO  66           HG2      PRO  66  27.919  -3.187  -3.470
  498    HG3  PRO  66           HG3      PRO  66  27.318  -1.942  -4.579
  499    HD2  PRO  66           HD2      PRO  66  26.656  -2.406  -1.707
  500    HD3  PRO  66           HD3      PRO  66  26.792  -0.882  -2.607
  501    H    HIS  67           H        HIS  67  22.251  -2.855  -4.689
  502    HA   HIS  67           HA       HIS  67  20.393  -4.114  -4.393
  503    HB2  HIS  67           HB2      HIS  67  22.386  -6.340  -3.924
  504    HB3  HIS  67           HB3      HIS  67  20.652  -6.576  -4.105
  505    HD1  HIS  67           HD1      HIS  67  19.675  -6.409  -6.470
  506    HD2  HIS  67           HD2      HIS  67  23.768  -5.711  -6.289
  507    HE1  HIS  67           HE1      HIS  67  20.473  -6.461  -8.854
  508    HE2  HIS  67           HE2      HIS  67  22.900  -5.789  -8.724
  509    H    TYR  68           H        TYR  68  21.684  -2.724  -2.183
  510    HA   TYR  68           HA       TYR  68  21.639  -2.468   0.057
  511    HB2  TYR  68           HB2      TYR  68  19.231  -2.338  -0.366
  512    HB3  TYR  68           HB3      TYR  68  19.096  -4.086  -0.203
  513    HD1  TYR  68           HD1      TYR  68  17.749  -4.399   1.677
  514    HD2  TYR  68           HD2      TYR  68  21.004  -1.669   1.896
  515    HE1  TYR  68           HE1      TYR  68  17.387  -4.167   4.098
  516    HE2  TYR  68           HE2      TYR  68  20.649  -1.431   4.314
  517    HH   TYR  68           HH       TYR  68  18.594  -3.512   6.086
  518    H    HIS  69           H        HIS  69  23.552  -3.991  -0.165
  519    HA   HIS  69           HA       HIS  69  24.875  -5.497   0.893
  520    HB2  HIS  69           HB2      HIS  69  22.497  -5.729   2.746
  521    HB3  HIS  69           HB3      HIS  69  24.037  -6.522   3.032
  522    HD1  HIS  69           HD1      HIS  69  25.809  -5.174   4.203
  523    HD2  HIS  69           HD2      HIS  69  22.661  -2.832   2.824
  524    HE1  HIS  69           HE1      HIS  69  26.203  -2.878   5.149
  525    HE2  HIS  69           HE2      HIS  69  24.197  -1.530   4.447
  526    H    GLU  70           H        GLU  70  24.650  -7.965   1.836
  527    HA   GLU  70           HA       GLU  70  23.372  -9.410  -0.377
  528    HB2  GLU  70           HB2      GLU  70  25.735 -10.088   1.363
  529    HB3  GLU  70           HB3      GLU  70  24.974 -11.257   0.297
  530    HG2  GLU  70           HG2      GLU  70  26.165  -8.647  -0.597
  531    HG3  GLU  70           HG3      GLU  70  26.980 -10.207  -0.668
  532    H    TYR  71           H        TYR  71  23.127 -11.899   0.440
  533    HA   TYR  71           HA       TYR  71  20.984 -11.759   2.343
  534    HB2  TYR  71           HB2      TYR  71  20.851 -13.259   0.394
  535    HB3  TYR  71           HB3      TYR  71  22.236 -14.166   0.994
  536    HD1  TYR  71           HD1      TYR  71  18.708 -13.295   1.696
  537    HD2  TYR  71           HD2      TYR  71  21.969 -15.862   2.631
  538    HE1  TYR  71           HE1      TYR  71  17.196 -14.737   2.992
  539    HE2  TYR  71           HE2      TYR  71  20.465 -17.311   3.928
  540    HH   TYR  71           HH       TYR  71  17.117 -17.126   3.742
  541    H    HIS  72           H        HIS  72  23.978 -13.693   2.228
  542    HA   HIS  72           HA       HIS  72  24.406 -13.242   5.058
  543    HB2  HIS  72           HB2      HIS  72  22.838 -15.167   5.016
  544    HB3  HIS  72           HB3      HIS  72  23.977 -16.051   4.010
  545    HD1  HIS  72           HD1      HIS  72  23.189 -15.237   7.507
  546    HD2  HIS  72           HD2      HIS  72  26.397 -16.809   5.383
  547    HE1  HIS  72           HE1      HIS  72  24.671 -16.321   9.225
  548    HE2  HIS  72           HE2      HIS  72  26.516 -17.406   7.896
  549    H    THR  73           H        THR  73  25.390 -15.118   2.204
  550    HA   THR  73           HA       THR  73  28.149 -15.097   3.183
  551    HB   THR  73           HB       THR  73  27.106 -16.596   0.782
  552    HG1  THR  73           HG1      THR  73  25.944 -17.614   2.259
  553   HG21  THR  73          HG21      THR  73  29.012 -18.068   1.255
  554   HG22  THR  73          HG22      THR  73  29.460 -17.048   2.620
  555   HG23  THR  73          HG23      THR  73  29.538 -16.408   0.979
  Start of MODEL   15
    1    H1   GLN  -1           H1       GLN  -1  -8.851  14.283  -7.646
    2    H2   GLN  -1           H2       GLN  -1 -10.269  13.370  -7.581
    3    H3   GLN  -1           H3       GLN  -1  -9.171  13.139  -8.848
    4    HA   GLN  -1           HA       GLN  -1  -8.664  12.573  -5.993
    5    HB2  GLN  -1           HB2      GLN  -1  -9.105  10.706  -8.334
    6    HB3  GLN  -1           HB3      GLN  -1  -8.540  10.195  -6.755
    7    HG2  GLN  -1           HG2      GLN  -1 -10.841   9.692  -6.861
    8    HG3  GLN  -1           HG3      GLN  -1 -10.679  11.093  -5.806
    9   HE21  GLN  -1          HE21      GLN  -1 -12.798  11.717  -6.133
   10   HE22  GLN  -1          HE22      GLN  -1 -13.341  12.417  -7.617
   11    H    SER   0           H        SER   0  -6.590  12.759  -5.508
   12    HA   SER   0           HA       SER   0  -4.609  12.502  -7.667
   13    HB2  SER   0           HB2      SER   0  -4.311  13.775  -4.935
   14    HB3  SER   0           HB3      SER   0  -3.097  13.771  -6.215
   15    HG   SER   0           HG       SER   0  -5.699  14.877  -6.506
   16    H    MET   1           H        MET   1  -5.644  10.171  -6.835
   17    HA   MET   1           HA       MET   1  -3.389   8.862  -5.552
   18    HB2  MET   1           HB2      MET   1  -4.760   7.702  -3.911
   19    HB3  MET   1           HB3      MET   1  -4.936   9.437  -3.690
   20    HG2  MET   1           HG2      MET   1  -7.056   9.309  -5.002
   21    HG3  MET   1           HG3      MET   1  -6.892   7.555  -4.988
   22    HE1  MET   1           HE1      MET   1  -9.246   7.214  -3.902
   23    HE2  MET   1           HE2      MET   1  -9.518   8.956  -3.942
   24    HE3  MET   1           HE3      MET   1  -9.801   8.053  -2.452
   25    H    ALA   2           H        ALA   2  -3.495   6.503  -5.846
   26    HA   ALA   2           HA       ALA   2  -5.490   5.575  -7.755
   27    HB1  ALA   2           HB1      ALA   2  -3.868   4.673  -9.296
   28    HB2  ALA   2           HB2      ALA   2  -2.548   5.270  -8.294
   29    HB3  ALA   2           HB3      ALA   2  -3.613   6.409  -9.117
   30    H    LEU   3           H        LEU   3  -2.407   4.321  -6.615
   31    HA   LEU   3           HA       LEU   3  -3.873   2.116  -5.337
   32    HB2  LEU   3           HB2      LEU   3  -1.185   1.977  -6.694
   33    HB3  LEU   3           HB3      LEU   3  -1.882   0.694  -5.760
   34    HG   LEU   3           HG       LEU   3  -3.815   0.738  -7.430
   35   HD11  LEU   3          HD11      LEU   3  -1.728   2.209  -8.993
   36   HD12  LEU   3          HD12      LEU   3  -3.244   2.880  -8.405
   37   HD13  LEU   3          HD13      LEU   3  -3.261   1.600  -9.620
   38   HD21  LEU   3          HD21      LEU   3  -1.050  -0.131  -8.250
   39   HD22  LEU   3          HD22      LEU   3  -2.549  -0.677  -9.002
   40   HD23  LEU   3          HD23      LEU   3  -2.213  -1.070  -7.315
   41    H    HIS   4           H        HIS   4  -2.802   1.151  -3.486
   42    HA   HIS   4           HA       HIS   4  -1.646   3.301  -1.855
   43    HB2  HIS   4           HB2      HIS   4  -2.528   0.524  -1.053
   44    HB3  HIS   4           HB3      HIS   4  -1.978   1.762   0.051
   45    HD1  HIS   4           HD1      HIS   4  -4.047   2.148   1.395
   46    HD2  HIS   4           HD2      HIS   4  -4.782   2.291  -2.696
   47    HE1  HIS   4           HE1      HIS   4  -6.445   2.856   1.160
   48    HE2  HIS   4           HE2      HIS   4  -6.912   2.799  -1.313
   49    H    TYR   5           H        TYR   5   0.461   3.423  -1.537
   50    HA   TYR   5           HA       TYR   5   2.170   1.228  -2.403
   51    HB2  TYR   5           HB2      TYR   5   2.663   4.112  -1.720
   52    HB3  TYR   5           HB3      TYR   5   4.003   2.968  -1.829
   53    HD1  TYR   5           HD1      TYR   5   1.101   2.731  -4.106
   54    HD2  TYR   5           HD2      TYR   5   5.062   4.175  -3.590
   55    HE1  TYR   5           HE1      TYR   5   1.240   3.195  -6.508
   56    HE2  TYR   5           HE2      TYR   5   5.224   4.614  -5.986
   57    HH   TYR   5           HH       TYR   5   2.489   4.592  -8.038
   58    H    TYR   6           H        TYR   6   2.871  -0.214  -1.016
   59    HA   TYR   6           HA       TYR   6   3.538   0.661   1.714
   60    HB2  TYR   6           HB2      TYR   6   2.376  -2.025   0.923
   61    HB3  TYR   6           HB3      TYR   6   2.856  -1.547   2.549
   62    HD1  TYR   6           HD1      TYR   6   0.149  -1.864   0.361
   63    HD2  TYR   6           HD2      TYR   6   1.671   0.693   3.407
   64    HE1  TYR   6           HE1      TYR   6  -2.113  -0.993   0.752
   65    HE2  TYR   6           HE2      TYR   6  -0.596   1.566   3.800
   66    HH   TYR   6           HH       TYR   6  -3.359   0.099   2.662
   67    H    CYS   7           H        CYS   7   5.616   0.127   2.329
   68    HA   CYS   7           HA       CYS   7   7.253  -0.544   0.101
   69    HB2  CYS   7           HB2      CYS   7   7.948   1.126   1.839
   70    HB3  CYS   7           HB3      CYS   7   8.236  -0.217   2.919
   71    H    ARG   8           H        ARG   8   8.480  -2.181  -0.343
   72    HA   ARG   8           HA       ARG   8   8.185  -4.772   0.579
   73    HB2  ARG   8           HB2      ARG   8   9.313  -4.211  -1.499
   74    HB3  ARG   8           HB3      ARG   8  10.574  -3.361  -0.623
   75    HG2  ARG   8           HG2      ARG   8  11.079  -5.620   0.467
   76    HG3  ARG   8           HG3      ARG   8  10.091  -6.308  -0.828
   77    HD2  ARG   8           HD2      ARG   8  12.458  -6.307  -1.433
   78    HD3  ARG   8           HD3      ARG   8  11.532  -5.251  -2.494
   79    HE   ARG   8           HE       ARG   8  12.495  -3.382  -1.418
   80   HH11  ARG   8          HH11      ARG   8  13.786  -6.430  -0.277
   81   HH12  ARG   8          HH12      ARG   8  15.218  -5.715   0.393
   82   HH21  ARG   8          HH21      ARG   8  14.372  -2.438  -0.502
   83   HH22  ARG   8          HH22      ARG   8  15.553  -3.450   0.271
   84    H    HIS   9           H        HIS   9   8.383  -5.370   2.604
   85    HA   HIS   9           HA       HIS   9   9.490  -6.184   4.423
   86    HB2  HIS   9           HB2      HIS   9  11.618  -6.145   3.181
   87    HB3  HIS   9           HB3      HIS   9  11.829  -4.451   3.606
   88    HD1  HIS   9           HD1      HIS   9  12.936  -3.957   5.812
   89    HD2  HIS   9           HD2      HIS   9  11.798  -7.937   5.454
   90    HE1  HIS   9           HE1      HIS   9  13.924  -5.121   7.804
   91    HE2  HIS   9           HE2      HIS   9  13.134  -7.505   7.628
   92    H    CYS  10           H        CYS  10   9.935  -2.705   3.865
   93    HA   CYS  10           HA       CYS  10   9.967  -2.039   6.629
   94    HB2  CYS  10           HB2      CYS  10   9.226  -0.265   4.323
   95    HB3  CYS  10           HB3      CYS  10   9.744   0.264   5.910
   96    H    GLY  11           H        GLY  11   7.439  -2.350   4.230
   97    HA2  GLY  11           HA2      GLY  11   5.152  -2.422   4.466
   98    HA3  GLY  11           HA3      GLY  11   5.379  -2.318   6.220
   99    H    VAL  12           H        VAL  12   7.104   0.176   5.009
  100    HA   VAL  12           HA       VAL  12   5.335   2.084   5.998
  101    HB   VAL  12           HB       VAL  12   7.593   2.656   6.202
  102   HG11  VAL  12          HG11      VAL  12   7.921   2.618   3.213
  103   HG12  VAL  12          HG12      VAL  12   8.355   1.264   4.254
  104   HG13  VAL  12          HG13      VAL  12   9.176   2.808   4.440
  105   HG21  VAL  12          HG21      VAL  12   6.133   4.535   5.682
  106   HG22  VAL  12          HG22      VAL  12   6.507   4.320   3.971
  107   HG23  VAL  12          HG23      VAL  12   7.778   4.789   5.100
  108    H    LYS  13           H        LYS  13   3.968   3.416   5.169
  109    HA   LYS  13           HA       LYS  13   2.860   2.840   2.606
  110    HB2  LYS  13           HB2      LYS  13   2.236   5.174   4.420
  111    HB3  LYS  13           HB3      LYS  13   1.203   4.503   3.168
  112    HG2  LYS  13           HG2      LYS  13   1.041   2.418   4.467
  113    HG3  LYS  13           HG3      LYS  13   2.013   3.156   5.736
  114    HD2  LYS  13           HD2      LYS  13   0.316   4.882   6.048
  115    HD3  LYS  13           HD3      LYS  13  -0.654   4.172   4.756
  116    HE2  LYS  13           HE2      LYS  13  -1.525   3.484   6.904
  117    HE3  LYS  13           HE3      LYS  13  -0.834   2.093   6.072
  118    HZ1  LYS  13           HZ1      LYS  13   1.157   2.322   7.428
  119    HZ2  LYS  13           HZ2      LYS  13  -0.211   2.129   8.402
  120    HZ3  LYS  13           HZ3      LYS  13   0.486   3.658   8.225
  121    H    VAL  14           H        VAL  14   4.179   3.360   0.934
  122    HA   VAL  14           HA       VAL  14   5.710   5.819   0.933
  123    HB   VAL  14           HB       VAL  14   5.542   4.420  -1.633
  124   HG11  VAL  14          HG11      VAL  14   7.207   6.100  -1.177
  125   HG12  VAL  14          HG12      VAL  14   7.983   4.539  -1.457
  126   HG13  VAL  14          HG13      VAL  14   7.817   5.158   0.191
  127   HG21  VAL  14          HG21      VAL  14   6.551   2.920   0.768
  128   HG22  VAL  14          HG22      VAL  14   6.961   2.518  -0.899
  129   HG23  VAL  14          HG23      VAL  14   5.287   2.424  -0.358
  130    H    GLY  15           H        GLY  15   2.596   5.060   0.325
  131    HA2  GLY  15           HA2      GLY  15   2.227   7.473  -1.284
  132    HA3  GLY  15           HA3      GLY  15   1.526   5.971  -1.875
  133    H    SER  16           H        SER  16   1.340   8.495   0.469
  134    HA   SER  16           HA       SER  16  -0.767   7.276   1.995
  135    HB2  SER  16           HB2      SER  16   0.776   8.806   3.109
  136    HB3  SER  16           HB3      SER  16   0.313  10.106   2.011
  137    HG   SER  16           HG       SER  16  -1.484  10.408   3.092
  138    H    LEU  17           H        LEU  17  -2.889   7.524   1.780
  139    HA   LEU  17           HA       LEU  17  -3.956   9.698   0.215
  140    HB2  LEU  17           HB2      LEU  17  -5.363   8.326  -1.194
  141    HB3  LEU  17           HB3      LEU  17  -3.677   7.942  -1.462
  142    HG   LEU  17           HG       LEU  17  -5.448   6.270   0.316
  143   HD11  LEU  17          HD11      LEU  17  -5.668   4.754  -1.618
  144   HD12  LEU  17          HD12      LEU  17  -4.906   5.976  -2.636
  145   HD13  LEU  17          HD13      LEU  17  -6.463   6.306  -1.876
  146   HD21  LEU  17          HD21      LEU  17  -2.857   5.685  -1.120
  147   HD22  LEU  17          HD22      LEU  17  -3.772   4.546  -0.132
  148   HD23  LEU  17          HD23      LEU  17  -3.041   5.968   0.612
  149    H    GLU  18           H        GLU  18  -4.501   6.929   2.210
  150    HA   GLU  18           HA       GLU  18  -7.117   7.694   3.043
  151    HB2  GLU  18           HB2      GLU  18  -5.139   5.793   4.287
  152    HB3  GLU  18           HB3      GLU  18  -6.792   6.002   4.839
  153    HG2  GLU  18           HG2      GLU  18  -7.605   5.244   2.660
  154    HG3  GLU  18           HG3      GLU  18  -5.937   5.005   2.136
  155    H    SER  19           H        SER  19  -3.916   7.891   4.443
  156    HA   SER  19           HA       SER  19  -4.688   9.273   6.791
  157    HB2  SER  19           HB2      SER  19  -1.991   9.241   5.415
  158    HB3  SER  19           HB3      SER  19  -2.300   9.687   7.092
  159    HG   SER  19           HG       SER  19  -3.365   7.283   6.664
  160    H    SER  20           H        SER  20  -4.368  10.233   3.561
  161    HA   SER  20           HA       SER  20  -3.879  13.033   4.206
  162    HB2  SER  20           HB2      SER  20  -4.137  11.687   1.507
  163    HB3  SER  20           HB3      SER  20  -3.558  13.326   1.811
  164    HG   SER  20           HG       SER  20  -1.690  12.565   2.495
  165    H    MET  21           H        MET  21  -6.517  11.302   4.437
  166    HA   MET  21           HA       MET  21  -8.220  13.532   3.704
  167    HB2  MET  21           HB2      MET  21  -9.771  12.295   2.357
  168    HB3  MET  21           HB3      MET  21  -8.170  12.093   1.664
  169    HG2  MET  21           HG2      MET  21  -8.003   9.881   2.652
  170    HG3  MET  21           HG3      MET  21  -9.584  10.084   3.403
  171    HE1  MET  21           HE1      MET  21 -11.823  10.418   2.009
  172    HE2  MET  21           HE2      MET  21 -11.937  10.234   0.259
  173    HE3  MET  21           HE3      MET  21 -11.123  11.639   0.944
  174    H    VAL  22           H        VAL  22  -7.878  10.361   5.199
  175    HA   VAL  22           HA       VAL  22  -8.734   9.438   7.032
  176    HB   VAL  22           HB       VAL  22  -9.739  12.160   7.834
  177   HG11  VAL  22          HG11      VAL  22 -10.508  10.313   9.187
  178   HG12  VAL  22          HG12      VAL  22  -9.326  11.263  10.091
  179   HG13  VAL  22          HG13      VAL  22  -8.856   9.726   9.361
  180   HG21  VAL  22          HG21      VAL  22  -6.976  11.004   8.217
  181   HG22  VAL  22          HG22      VAL  22  -7.570  12.511   8.917
  182   HG23  VAL  22          HG23      VAL  22  -7.393  12.358   7.169
  183    H    SER  23           H        SER  23 -10.225   8.137   6.249
  184    HA   SER  23           HA       SER  23 -12.251   7.160   6.075
  185    HB2  SER  23           HB2      SER  23 -12.907   8.514   8.077
  186    HB3  SER  23           HB3      SER  23 -13.491   9.767   6.984
  187    HG   SER  23           HG       SER  23 -15.270   8.606   7.274
  188    H    THR  24           H        THR  24 -13.038   6.688   4.179
  189    HA   THR  24           HA       THR  24 -13.069   8.652   2.062
  190    HB   THR  24           HB       THR  24 -13.937   6.636   0.717
  191    HG1  THR  24           HG1      THR  24 -12.874   4.819   2.405
  192   HG21  THR  24          HG21      THR  24 -11.695   5.643   0.578
  193   HG22  THR  24          HG22      THR  24 -11.239   6.474   2.064
  194   HG23  THR  24          HG23      THR  24 -11.622   7.404   0.617
  195    H    ASP  25           H        ASP  25 -14.935   9.072   0.732
  196    HA   ASP  25           HA       ASP  25 -17.341   9.342   2.360
  197    HB2  ASP  25           HB2      ASP  25 -18.105  10.928   0.748
  198    HB3  ASP  25           HB3      ASP  25 -16.400  11.270   1.004
  199    H    SER  26           H        SER  26 -16.067   7.531  -0.218
  200    HA   SER  26           HA       SER  26 -18.348   6.601  -1.521
  201    HB2  SER  26           HB2      SER  26 -16.048   6.259  -2.317
  202    HB3  SER  26           HB3      SER  26 -15.723   5.198  -0.950
  203    HG   SER  26           HG       SER  26 -17.415   4.771  -3.176
  204    H    LEU  27           H        LEU  27 -20.043   5.592  -0.636
  205    HA   LEU  27           HA       LEU  27 -20.026   4.369   1.889
  206    HB2  LEU  27           HB2      LEU  27 -21.941   5.460   0.846
  207    HB3  LEU  27           HB3      LEU  27 -21.999   4.180  -0.353
  208    HG   LEU  27           HG       LEU  27 -22.424   2.571   1.380
  209   HD11  LEU  27          HD11      LEU  27 -22.401   4.950   3.233
  210   HD12  LEU  27          HD12      LEU  27 -21.273   3.595   3.252
  211   HD13  LEU  27          HD13      LEU  27 -22.964   3.339   3.675
  212   HD21  LEU  27          HD21      LEU  27 -24.227   4.956   1.426
  213   HD22  LEU  27          HD22      LEU  27 -24.685   3.338   1.958
  214   HD23  LEU  27          HD23      LEU  27 -24.272   3.632   0.267
  215    H    GLY  28           H        GLY  28 -20.562   2.977  -1.359
  216    HA2  GLY  28           HA2      GLY  28 -20.085   0.898  -2.210
  217    HA3  GLY  28           HA3      GLY  28 -18.791   0.818  -1.021
  218    H    PHE  29           H        PHE  29 -22.336   0.861  -0.886
  219    HA   PHE  29           HA       PHE  29 -22.428  -0.994   1.291
  220    HB2  PHE  29           HB2      PHE  29 -24.273   0.668  -0.209
  221    HB3  PHE  29           HB3      PHE  29 -24.943  -0.932   0.054
  222    HD1  PHE  29           HD1      PHE  29 -22.680   0.737   2.442
  223    HD2  PHE  29           HD2      PHE  29 -26.692  -0.255   1.438
  224    HE1  PHE  29           HE1      PHE  29 -23.410   1.406   4.696
  225    HE2  PHE  29           HE2      PHE  29 -27.430   0.419   3.672
  226    HZ   PHE  29           HZ       PHE  29 -25.790   1.247   5.314
  227    H    GLN  30           H        GLN  30 -24.222  -1.331  -1.711
  228    HA   GLN  30           HA       GLN  30 -23.182  -3.599  -2.809
  229    HB2  GLN  30           HB2      GLN  30 -24.891  -5.248  -1.931
  230    HB3  GLN  30           HB3      GLN  30 -23.546  -4.897  -0.867
  231    HG2  GLN  30           HG2      GLN  30 -25.061  -3.257   0.293
  232    HG3  GLN  30           HG3      GLN  30 -26.382  -3.914  -0.671
  233   HE21  GLN  30          HE21      GLN  30 -27.131  -5.984  -0.245
  234   HE22  GLN  30          HE22      GLN  30 -26.713  -6.840   1.197
  235    H    HIS  31           H        HIS  31 -26.134  -2.035  -1.736
  236    HA   HIS  31           HA       HIS  31 -27.138  -1.561  -4.330
  237    HB2  HIS  31           HB2      HIS  31 -27.545  -4.052  -4.112
  238    HB3  HIS  31           HB3      HIS  31 -28.619  -3.698  -2.768
  239    HD1  HIS  31           HD1      HIS  31 -28.338  -3.236  -6.502
  240    HD2  HIS  31           HD2      HIS  31 -31.181  -2.962  -3.484
  241    HE1  HIS  31           HE1      HIS  31 -30.544  -2.972  -7.674
  242    HE2  HIS  31           HE2      HIS  31 -32.228  -2.671  -5.831
  243    H    LEU  32           H        LEU  32 -26.708   0.211  -2.440
  244    HA   LEU  32           HA       LEU  32 -28.674   0.675  -0.515
  245    HB2  LEU  32           HB2      LEU  32 -26.568   1.891  -0.561
  246    HB3  LEU  32           HB3      LEU  32 -26.966   2.585  -2.103
  247    HG   LEU  32           HG       LEU  32 -28.888   3.723  -1.023
  248   HD11  LEU  32          HD11      LEU  32 -28.840   3.984   1.418
  249   HD12  LEU  32          HD12      LEU  32 -27.550   2.785   1.504
  250   HD13  LEU  32          HD13      LEU  32 -29.150   2.320   0.927
  251   HD21  LEU  32          HD21      LEU  32 -27.521   5.481  -0.002
  252   HD22  LEU  32          HD22      LEU  32 -26.824   4.902  -1.515
  253   HD23  LEU  32          HD23      LEU  32 -26.143   4.380   0.025
  254    H    THR  33           H        THR  33 -28.305   2.426  -3.556
  255    HA   THR  33           HA       THR  33 -31.014   2.026  -4.356
  256    HB   THR  33           HB       THR  33 -30.950   4.798  -4.497
  257    HG1  THR  33           HG1      THR  33 -30.112   5.572  -2.689
  258   HG21  THR  33          HG21      THR  33 -32.792   4.710  -2.883
  259   HG22  THR  33          HG22      THR  33 -32.344   3.057  -2.462
  260   HG23  THR  33          HG23      THR  33 -32.927   3.428  -4.084
  261    H    ASN  34           H        ASN  34 -31.325   3.817  -6.321
  262    HA   ASN  34           HA       ASN  34 -29.504   3.008  -8.278
  263    HB2  ASN  34           HB2      ASN  34 -31.542   5.211  -8.177
  264    HB3  ASN  34           HB3      ASN  34 -30.489   5.020  -9.578
  265   HD21  ASN  34          HD21      ASN  34 -33.424   4.644  -9.206
  266   HD22  ASN  34          HD22      ASN  34 -33.738   3.043  -9.781
  267    H    GLU  35           H        GLU  35 -29.492   5.752  -6.130
  268    HA   GLU  35           HA       GLU  35 -27.523   7.319  -7.286
  269    HB2  GLU  35           HB2      GLU  35 -27.085   8.189  -5.043
  270    HB3  GLU  35           HB3      GLU  35 -28.812   8.031  -5.335
  271    HG2  GLU  35           HG2      GLU  35 -28.821   5.938  -4.086
  272    HG3  GLU  35           HG3      GLU  35 -27.100   6.121  -3.768
  273    H    GLU  36           H        GLU  36 -27.128   4.518  -5.091
  274    HA   GLU  36           HA       GLU  36 -24.283   4.668  -5.157
  275    HB2  GLU  36           HB2      GLU  36 -25.334   3.593  -3.292
  276    HB3  GLU  36           HB3      GLU  36 -26.192   2.477  -4.347
  277    HG2  GLU  36           HG2      GLU  36 -24.227   1.290  -4.860
  278    HG3  GLU  36           HG3      GLU  36 -23.197   2.552  -4.182
  279    H    ARG  37           H        ARG  37 -26.725   2.912  -6.972
  280    HA   ARG  37           HA       ARG  37 -25.065   1.013  -8.148
  281    HB2  ARG  37           HB2      ARG  37 -27.645   2.177  -9.185
  282    HB3  ARG  37           HB3      ARG  37 -26.851   0.757  -9.855
  283    HG2  ARG  37           HG2      ARG  37 -26.976  -0.031  -7.325
  284    HG3  ARG  37           HG3      ARG  37 -28.345   1.079  -7.321
  285    HD2  ARG  37           HD2      ARG  37 -27.968  -1.144  -9.316
  286    HD3  ARG  37           HD3      ARG  37 -28.927  -1.290  -7.849
  287    HE   ARG  37           HE       ARG  37 -29.956   0.893  -9.151
  288   HH11  ARG  37          HH11      ARG  37 -29.429  -2.475  -9.957
  289   HH12  ARG  37          HH12      ARG  37 -30.809  -2.575 -11.005
  290   HH21  ARG  37          HH21      ARG  37 -31.787   0.766 -10.517
  291   HH22  ARG  37          HH22      ARG  37 -32.157  -0.732 -11.318
  292    H    ASN  38           H        ASN  38 -25.868   4.289  -9.256
  293    HA   ASN  38           HA       ASN  38 -24.525   3.863 -11.761
  294    HB2  ASN  38           HB2      ASN  38 -25.064   6.111 -12.326
  295    HB3  ASN  38           HB3      ASN  38 -26.457   5.448 -11.482
  296   HD21  ASN  38          HD21      ASN  38 -23.839   7.720 -11.367
  297   HD22  ASN  38          HD22      ASN  38 -24.400   8.604  -9.990
  298    H    ASP  39           H        ASP  39 -23.678   5.436  -8.702
  299    HA   ASP  39           HA       ASP  39 -21.265   6.553  -9.802
  300    HB2  ASP  39           HB2      ASP  39 -22.514   6.540  -7.087
  301    HB3  ASP  39           HB3      ASP  39 -20.820   6.984  -7.256
  302    H    MET  40           H        MET  40 -21.859   4.074  -7.282
  303    HA   MET  40           HA       MET  40 -19.050   3.261  -7.648
  304    HB2  MET  40           HB2      MET  40 -20.816   2.983  -5.214
  305    HB3  MET  40           HB3      MET  40 -19.201   2.310  -5.351
  306    HG2  MET  40           HG2      MET  40 -18.842   4.244  -4.165
  307    HG3  MET  40           HG3      MET  40 -18.469   4.736  -5.814
  308    HE1  MET  40           HE1      MET  40 -22.072   4.177  -4.235
  309    HE2  MET  40           HE2      MET  40 -22.385   5.793  -3.606
  310    HE3  MET  40           HE3      MET  40 -21.088   4.815  -2.920
  311    H    ILE  41           H        ILE  41 -22.187   2.281  -8.188
  312    HA   ILE  41           HA       ILE  41 -23.360   0.402  -8.377
  313    HB   ILE  41           HB       ILE  41 -22.230   0.164 -10.441
  314   HG12  ILE  41          HG12      ILE  41 -22.335  -2.472  -8.983
  315   HG13  ILE  41          HG13      ILE  41 -23.677  -1.667  -9.781
  316   HG21  ILE  41          HG21      ILE  41 -20.029  -1.391  -9.099
  317   HG22  ILE  41          HG22      ILE  41 -19.894   0.276  -9.654
  318   HG23  ILE  41          HG23      ILE  41 -20.176  -1.018 -10.816
  319   HD11  ILE  41          HD11      ILE  41 -22.808  -3.504 -11.115
  320   HD12  ILE  41          HD12      ILE  41 -21.220  -2.738 -11.143
  321   HD13  ILE  41          HD13      ILE  41 -22.589  -1.957 -11.934
  322    H    SER  42           H        SER  42 -20.265  -1.141  -7.485
  323    HA   SER  42           HA       SER  42 -21.285  -1.877  -4.897
  324    HB2  SER  42           HB2      SER  42 -20.668  -4.056  -6.915
  325    HB3  SER  42           HB3      SER  42 -21.059  -4.304  -5.215
  326    HG   SER  42           HG       SER  42 -22.979  -2.805  -6.272
  327    H    TYR  43           H        TYR  43 -19.130  -0.386  -6.134
  328    HA   TYR  43           HA       TYR  43 -16.775  -1.952  -5.324
  329    HB2  TYR  43           HB2      TYR  43 -16.793  -1.818  -7.712
  330    HB3  TYR  43           HB3      TYR  43 -17.189  -0.109  -7.676
  331    HD1  TYR  43           HD1      TYR  43 -15.495   1.405  -8.067
  332    HD2  TYR  43           HD2      TYR  43 -14.490  -2.439  -6.546
  333    HE1  TYR  43           HE1      TYR  43 -13.109   1.949  -8.288
  334    HE2  TYR  43           HE2      TYR  43 -12.101  -1.901  -6.762
  335    HH   TYR  43           HH       TYR  43 -10.657  -0.428  -7.992
  336    H    LYS  44           H        LYS  44 -15.501  -1.034  -3.869
  337    HA   LYS  44           HA       LYS  44 -16.130   1.485  -2.683
  338    HB2  LYS  44           HB2      LYS  44 -13.786  -0.397  -2.361
  339    HB3  LYS  44           HB3      LYS  44 -13.990   1.064  -1.411
  340    HG2  LYS  44           HG2      LYS  44 -16.106  -1.052  -1.485
  341    HG3  LYS  44           HG3      LYS  44 -14.723  -1.164  -0.394
  342    HD2  LYS  44           HD2      LYS  44 -15.322   1.084   0.491
  343    HD3  LYS  44           HD3      LYS  44 -16.779   1.040  -0.507
  344    HE2  LYS  44           HE2      LYS  44 -17.603  -0.873   0.671
  345    HE3  LYS  44           HE3      LYS  44 -16.083  -1.054   1.545
  346    HZ1  LYS  44           HZ1      LYS  44 -18.000   1.203   1.808
  347    HZ2  LYS  44           HZ2      LYS  44 -16.512   1.094   2.608
  348    HZ3  LYS  44           HZ3      LYS  44 -17.737  -0.025   2.941
  349    H    GLU  45           H        GLU  45 -15.285   3.452  -3.088
  350    HA   GLU  45           HA       GLU  45 -13.753   3.925  -5.425
  351    HB2  GLU  45           HB2      GLU  45 -15.377   5.496  -4.235
  352    HB3  GLU  45           HB3      GLU  45 -14.064   5.859  -3.135
  353    HG2  GLU  45           HG2      GLU  45 -14.093   7.559  -4.744
  354    HG3  GLU  45           HG3      GLU  45 -12.744   6.510  -5.145
  355    H    ASN  46           H        ASN  46 -12.859   2.928  -2.338
  356    HA   ASN  46           HA       ASN  46 -10.319   4.174  -2.096
  357    HB2  ASN  46           HB2      ASN  46 -11.549   3.143  -0.196
  358    HB3  ASN  46           HB3      ASN  46 -11.272   1.557  -0.908
  359   HD21  ASN  46          HD21      ASN  46 -10.105   0.800   0.811
  360   HD22  ASN  46          HD22      ASN  46  -8.518   1.366   1.192
  361    H    GLY  47           H        GLY  47 -11.523   1.490  -3.909
  362    HA2  GLY  47           HA2      GLY  47 -10.470   0.779  -5.875
  363    HA3  GLY  47           HA3      GLY  47  -8.941   1.397  -5.256
  364    H    ASP  48           H        ASP  48  -9.360  -0.075  -2.671
  365    HA   ASP  48           HA       ASP  48  -8.269  -1.877  -1.811
  366    HB2  ASP  48           HB2      ASP  48 -10.475  -2.882  -2.366
  367    HB3  ASP  48           HB3      ASP  48  -9.839  -3.358  -3.933
  368    H    VAL  49           H        VAL  49  -6.482  -0.683  -2.989
  369    HA   VAL  49           HA       VAL  49  -5.132  -2.470  -4.885
  370    HB   VAL  49           HB       VAL  49  -4.175  -0.148  -5.738
  371   HG11  VAL  49          HG11      VAL  49  -6.785  -1.413  -6.546
  372   HG12  VAL  49          HG12      VAL  49  -5.181  -1.758  -7.195
  373   HG13  VAL  49          HG13      VAL  49  -5.940  -0.197  -7.502
  374   HG21  VAL  49          HG21      VAL  49  -5.958   1.538  -5.850
  375   HG22  VAL  49          HG22      VAL  49  -5.484   1.211  -4.182
  376   HG23  VAL  49          HG23      VAL  49  -6.971   0.523  -4.825
  377    H    HIS  50           H        HIS  50  -3.301  -3.156  -4.017
  378    HA   HIS  50           HA       HIS  50  -1.729  -1.256  -2.420
  379    HB2  HIS  50           HB2      HIS  50  -1.047  -3.004  -0.897
  380    HB3  HIS  50           HB3      HIS  50  -2.804  -2.956  -0.942
  381    HD1  HIS  50           HD1      HIS  50  -4.020  -5.005  -1.902
  382    HD2  HIS  50           HD2      HIS  50   0.119  -5.340  -1.940
  383    HE1  HIS  50           HE1      HIS  50  -3.545  -7.409  -2.430
  384    HE2  HIS  50           HE2      HIS  50  -1.039  -7.625  -2.271
  385    H    VAL  51           H        VAL  51   0.405  -1.193  -2.856
  386    HA   VAL  51           HA       VAL  51   1.479  -3.163  -4.747
  387    HB   VAL  51           HB       VAL  51   2.779  -1.106  -5.720
  388   HG11  VAL  51          HG11      VAL  51   1.065  -0.797  -7.413
  389   HG12  VAL  51          HG12      VAL  51  -0.143  -1.518  -6.352
  390   HG13  VAL  51          HG13      VAL  51   1.185  -2.502  -6.978
  391   HG21  VAL  51          HG21      VAL  51   0.360   0.169  -4.495
  392   HG22  VAL  51          HG22      VAL  51   1.349   0.913  -5.752
  393   HG23  VAL  51          HG23      VAL  51   2.053   0.542  -4.178
  394    H    LEU  52           H        LEU  52   3.287  -4.025  -4.051
  395    HA   LEU  52           HA       LEU  52   4.713  -2.859  -1.811
  396    HB2  LEU  52           HB2      LEU  52   5.144  -5.418  -3.365
  397    HB3  LEU  52           HB3      LEU  52   6.163  -4.906  -2.031
  398    HG   LEU  52           HG       LEU  52   4.688  -6.528  -1.158
  399   HD11  LEU  52          HD11      LEU  52   4.999  -4.562   0.263
  400   HD12  LEU  52          HD12      LEU  52   3.432  -5.330   0.523
  401   HD13  LEU  52          HD13      LEU  52   3.541  -3.844  -0.421
  402   HD21  LEU  52          HD21      LEU  52   3.045  -6.551  -2.946
  403   HD22  LEU  52          HD22      LEU  52   2.410  -4.998  -2.401
  404   HD23  LEU  52          HD23      LEU  52   2.257  -6.424  -1.373
  405    H    THR  53           H        THR  53   6.091  -1.291  -2.231
  406    HA   THR  53           HA       THR  53   7.891  -1.602  -4.527
  407    HB   THR  53           HB       THR  53   6.049  -0.021  -5.093
  408    HG1  THR  53           HG1      THR  53   7.466   1.064  -6.230
  409   HG21  THR  53          HG21      THR  53   6.022   2.193  -4.039
  410   HG22  THR  53          HG22      THR  53   7.250   1.657  -2.892
  411   HG23  THR  53          HG23      THR  53   5.649   0.917  -2.880
  412    H    ILE  54           H        ILE  54   9.444   0.553  -4.252
  413    HA   ILE  54           HA       ILE  54  10.790  -0.036  -1.720
  414    HB   ILE  54           HB       ILE  54  11.677   0.526  -4.470
  415   HG12  ILE  54          HG12      ILE  54  13.246  -0.851  -2.326
  416   HG13  ILE  54          HG13      ILE  54  11.804  -1.599  -2.968
  417   HG21  ILE  54          HG21      ILE  54  13.847   1.420  -3.846
  418   HG22  ILE  54          HG22      ILE  54  13.332   1.529  -2.166
  419   HG23  ILE  54          HG23      ILE  54  12.556   2.530  -3.391
  420   HD11  ILE  54          HD11      ILE  54  12.768  -1.499  -5.219
  421   HD12  ILE  54          HD12      ILE  54  13.766  -2.424  -4.095
  422   HD13  ILE  54          HD13      ILE  54  14.227  -0.780  -4.535
  423    H    CYS  55           H        CYS  55  10.645   1.385  -0.150
  424    HA   CYS  55           HA       CYS  55   9.701   4.030  -0.478
  425    HB2  CYS  55           HB2      CYS  55  10.091   4.324   1.873
  426    HB3  CYS  55           HB3      CYS  55   9.493   2.690   1.636
  427    H    GLU  56           H        GLU  56  11.025   5.988   0.317
  428    HA   GLU  56           HA       GLU  56  13.176   6.352  -1.440
  429    HB2  GLU  56           HB2      GLU  56  12.571   7.894   1.100
  430    HB3  GLU  56           HB3      GLU  56  13.548   8.453  -0.246
  431    HG2  GLU  56           HG2      GLU  56  11.608   8.442  -1.698
  432    HG3  GLU  56           HG3      GLU  56  10.614   7.817  -0.384
  433    H    ASP  57           H        ASP  57  13.061   5.292   1.909
  434    HA   ASP  57           HA       ASP  57  15.832   5.482   2.457
  435    HB2  ASP  57           HB2      ASP  57  14.130   5.230   4.221
  436    HB3  ASP  57           HB3      ASP  57  13.789   3.600   3.657
  437    H    CYS  58           H        CYS  58  13.816   2.792   1.305
  438    HA   CYS  58           HA       CYS  58  15.926   0.944   0.955
  439    HB2  CYS  58           HB2      CYS  58  13.176   1.190  -0.238
  440    HB3  CYS  58           HB3      CYS  58  14.293  -0.052  -0.794
  441    H    GLN  59           H        GLN  59  14.379   3.248  -1.212
  442    HA   GLN  59           HA       GLN  59  15.791   2.952  -3.535
  443    HB2  GLN  59           HB2      GLN  59  13.956   4.518  -3.313
  444    HB3  GLN  59           HB3      GLN  59  14.863   5.471  -2.152
  445    HG2  GLN  59           HG2      GLN  59  14.854   6.603  -4.251
  446    HG3  GLN  59           HG3      GLN  59  16.485   6.021  -3.928
  447   HE21  GLN  59          HE21      GLN  59  17.301   4.322  -5.128
  448   HE22  GLN  59          HE22      GLN  59  16.596   3.855  -6.627
  449    H    GLU  60           H        GLU  60  16.827   4.529  -0.548
  450    HA   GLU  60           HA       GLU  60  19.215   5.566  -1.619
  451    HB2  GLU  60           HB2      GLU  60  18.121   5.115   1.132
  452    HB3  GLU  60           HB3      GLU  60  19.731   5.681   0.877
  453    HG2  GLU  60           HG2      GLU  60  17.240   7.029   0.037
  454    HG3  GLU  60           HG3      GLU  60  18.304   7.532   1.337
  455    H    ALA  61           H        ALA  61  18.374   2.719   0.278
  456    HA   ALA  61           HA       ALA  61  20.968   1.675   0.634
  457    HB1  ALA  61           HB1      ALA  61  18.332   0.208   0.441
  458    HB2  ALA  61           HB2      ALA  61  19.033   0.878   1.913
  459    HB3  ALA  61           HB3      ALA  61  19.836  -0.451   1.082
  460    H    LEU  62           H        LEU  62  18.708   1.738  -1.885
  461    HA   LEU  62           HA       LEU  62  19.782  -0.310  -3.516
  462    HB2  LEU  62           HB2      LEU  62  17.541   1.409  -3.388
  463    HB3  LEU  62           HB3      LEU  62  18.299   1.663  -4.951
  464    HG   LEU  62           HG       LEU  62  18.316  -0.864  -5.092
  465   HD11  LEU  62          HD11      LEU  62  17.754  -1.433  -2.847
  466   HD12  LEU  62          HD12      LEU  62  16.441  -1.964  -3.896
  467   HD13  LEU  62          HD13      LEU  62  16.266  -0.493  -2.937
  468   HD21  LEU  62          HD21      LEU  62  16.038  -0.890  -6.035
  469   HD22  LEU  62          HD22      LEU  62  16.959   0.530  -6.528
  470   HD23  LEU  62          HD23      LEU  62  15.737   0.669  -5.264
  471    H    ASP  63           H        ASP  63  19.646   3.187  -3.860
  472    HA   ASP  63           HA       ASP  63  21.210   3.300  -6.196
  473    HB2  ASP  63           HB2      ASP  63  19.529   5.001  -5.414
  474    HB3  ASP  63           HB3      ASP  63  20.731   5.562  -4.256
  475    H    ARG  64           H        ARG  64  22.075   3.807  -2.792
  476    HA   ARG  64           HA       ARG  64  24.886   3.870  -3.624
  477    HB2  ARG  64           HB2      ARG  64  25.283   5.625  -1.859
  478    HB3  ARG  64           HB3      ARG  64  24.402   6.165  -3.280
  479    HG2  ARG  64           HG2      ARG  64  22.287   5.872  -1.978
  480    HG3  ARG  64           HG3      ARG  64  23.284   5.554  -0.555
  481    HD2  ARG  64           HD2      ARG  64  23.252   8.076  -2.208
  482    HD3  ARG  64           HD3      ARG  64  22.607   7.875  -0.580
  483    HE   ARG  64           HE       ARG  64  25.203   7.194  -0.290
  484   HH11  ARG  64          HH11      ARG  64  23.586   9.971  -1.656
  485   HH12  ARG  64          HH12      ARG  64  24.883  11.066  -1.300
  486   HH21  ARG  64          HH21      ARG  64  26.919   8.627   0.190
  487   HH22  ARG  64          HH22      ARG  64  26.780  10.301  -0.247
  488    H    ASN  65           H        ASN  65  25.026   1.717  -2.979
  489    HA   ASN  65           HA       ASN  65  24.958   1.305  -0.060
  490    HB2  ASN  65           HB2      ASN  65  24.180  -0.938  -0.372
  491    HB3  ASN  65           HB3      ASN  65  23.113   0.125  -1.281
  492   HD21  ASN  65          HD21      ASN  65  23.322   0.189  -3.570
  493   HD22  ASN  65          HD22      ASN  65  24.026  -1.134  -4.432
  494    HA   PRO  66           HA       PRO  66  29.127  -0.141  -0.610
  495    HB2  PRO  66           HB2      PRO  66  29.451  -1.305   1.813
  496    HB3  PRO  66           HB3      PRO  66  29.475   0.444   1.577
  497    HG2  PRO  66           HG2      PRO  66  27.294  -1.301   2.619
  498    HG3  PRO  66           HG3      PRO  66  27.773   0.326   3.132
  499    HD2  PRO  66           HD2      PRO  66  25.631  -0.213   1.494
  500    HD3  PRO  66           HD3      PRO  66  26.497   1.333   1.529
  501    H    HIS  67           H        HIS  67  26.528  -2.295   0.491
  502    HA   HIS  67           HA       HIS  67  27.168  -4.280  -1.398
  503    HB2  HIS  67           HB2      HIS  67  27.950  -6.096   0.045
  504    HB3  HIS  67           HB3      HIS  67  29.078  -4.751   0.058
  505    HD1  HIS  67           HD1      HIS  67  27.362  -7.013   2.261
  506    HD2  HIS  67           HD2      HIS  67  28.730  -3.099   2.521
  507    HE1  HIS  67           HE1      HIS  67  27.505  -6.509   4.718
  508    HE2  HIS  67           HE2      HIS  67  28.441  -4.176   4.852
  509    H    TYR  68           H        TYR  68  24.831  -3.043  -0.836
  510    HA   TYR  68           HA       TYR  68  23.239  -4.704   0.928
  511    HB2  TYR  68           HB2      TYR  68  22.788  -2.305   0.881
  512    HB3  TYR  68           HB3      TYR  68  22.444  -2.385  -0.843
  513    HD1  TYR  68           HD1      TYR  68  21.291  -3.822   2.405
  514    HD2  TYR  68           HD2      TYR  68  20.247  -2.622  -1.541
  515    HE1  TYR  68           HE1      TYR  68  18.922  -4.249   2.906
  516    HE2  TYR  68           HE2      TYR  68  17.877  -3.046  -1.051
  517    HH   TYR  68           HH       TYR  68  16.729  -3.591   2.126
  518    H    HIS  69           H        HIS  69  23.549  -4.088  -2.523
  519    HA   HIS  69           HA       HIS  69  22.309  -6.667  -3.039
  520    HB2  HIS  69           HB2      HIS  69  20.718  -5.862  -4.652
  521    HB3  HIS  69           HB3      HIS  69  20.456  -4.974  -3.160
  522    HD1  HIS  69           HD1      HIS  69  20.987  -4.509  -6.725
  523    HD2  HIS  69           HD2      HIS  69  21.571  -2.254  -3.281
  524    HE1  HIS  69           HE1      HIS  69  21.229  -2.137  -7.507
  525    HE2  HIS  69           HE2      HIS  69  21.778  -0.820  -5.430
  526    H    GLU  70           H        GLU  70  22.996  -7.625  -4.931
  527    HA   GLU  70           HA       GLU  70  25.556  -6.773  -5.816
  528    HB2  GLU  70           HB2      GLU  70  23.740  -8.985  -6.768
  529    HB3  GLU  70           HB3      GLU  70  25.365  -8.724  -7.386
  530    HG2  GLU  70           HG2      GLU  70  26.287  -9.091  -5.170
  531    HG3  GLU  70           HG3      GLU  70  24.663  -9.304  -4.518
  532    H    TYR  71           H        TYR  71  25.372  -4.799  -6.799
  533    HA   TYR  71           HA       TYR  71  23.611  -4.315  -8.995
  534    HB2  TYR  71           HB2      TYR  71  25.234  -2.315  -9.336
  535    HB3  TYR  71           HB3      TYR  71  24.229  -2.359  -7.894
  536    HD1  TYR  71           HD1      TYR  71  27.662  -2.949  -9.157
  537    HD2  TYR  71           HD2      TYR  71  25.193  -2.422  -5.734
  538    HE1  TYR  71           HE1      TYR  71  29.668  -2.723  -7.751
  539    HE2  TYR  71           HE2      TYR  71  27.189  -2.196  -4.321
  540    HH   TYR  71           HH       TYR  71  30.345  -1.817  -5.632
  541    H    HIS  72           H        HIS  72  26.552  -5.927  -8.627
  542    HA   HIS  72           HA       HIS  72  27.449  -5.661 -11.352
  543    HB2  HIS  72           HB2      HIS  72  28.975  -6.071  -9.402
  544    HB3  HIS  72           HB3      HIS  72  28.277  -7.674  -9.249
  545    HD1  HIS  72           HD1      HIS  72  30.476  -5.624 -11.526
  546    HD2  HIS  72           HD2      HIS  72  29.300  -9.577 -10.970
  547    HE1  HIS  72           HE1      HIS  72  31.995  -6.998 -12.989
  548    HE2  HIS  72           HE2      HIS  72  31.293  -9.389 -12.610
  549    H    THR  73           H        THR  73  25.183  -7.562  -9.645
  550    HA   THR  73           HA       THR  73  24.783  -9.255 -11.997
  551    HB   THR  73           HB       THR  73  24.764 -10.372  -9.185
  552    HG1  THR  73           HG1      THR  73  26.763 -10.588 -11.219
  553   HG21  THR  73          HG21      THR  73  23.337 -11.572 -10.753
  554   HG22  THR  73          HG22      THR  73  24.754 -12.541 -10.350
  555   HG23  THR  73          HG23      THR  73  24.673 -11.699 -11.896
  Start of MODEL   16
    1    H1   GLN  -1           H1       GLN  -1  -7.384  14.507  -5.666
    2    H2   GLN  -1           H2       GLN  -1  -6.214  14.351  -6.878
    3    H3   GLN  -1           H3       GLN  -1  -5.911  15.325  -5.533
    4    HA   GLN  -1           HA       GLN  -1  -5.895  13.441  -4.083
    5    HB2  GLN  -1           HB2      GLN  -1  -6.398  11.866  -6.619
    6    HB3  GLN  -1           HB3      GLN  -1  -5.975  11.157  -5.069
    7    HG2  GLN  -1           HG2      GLN  -1  -8.475  12.688  -5.731
    8    HG3  GLN  -1           HG3      GLN  -1  -8.337  10.957  -5.438
    9   HE21  GLN  -1          HE21      GLN  -1  -9.972  12.931  -4.079
   10   HE22  GLN  -1          HE22      GLN  -1  -9.522  12.868  -2.408
   11    H    SER   0           H        SER   0  -3.927  12.415  -3.649
   12    HA   SER   0           HA       SER   0  -1.826  12.896  -5.652
   13    HB2  SER   0           HB2      SER   0  -1.537  12.503  -2.661
   14    HB3  SER   0           HB3      SER   0  -0.250  12.930  -3.790
   15    HG   SER   0           HG       SER   0  -2.469  14.485  -2.963
   16    H    MET   1           H        MET   1  -3.775  10.501  -4.882
   17    HA   MET   1           HA       MET   1  -1.707   8.444  -5.130
   18    HB2  MET   1           HB2      MET   1  -2.210   8.448  -2.802
   19    HB3  MET   1           HB3      MET   1  -3.935   8.453  -3.097
   20    HG2  MET   1           HG2      MET   1  -3.716   6.199  -4.083
   21    HG3  MET   1           HG3      MET   1  -2.003   6.219  -3.672
   22    HE1  MET   1           HE1      MET   1  -5.429   6.235  -0.574
   23    HE2  MET   1           HE2      MET   1  -5.659   6.249  -2.322
   24    HE3  MET   1           HE3      MET   1  -4.998   7.668  -1.509
   25    H    ALA   2           H        ALA   2  -2.214   6.704  -6.246
   26    HA   ALA   2           HA       ALA   2  -4.953   6.402  -7.278
   27    HB1  ALA   2           HB1      ALA   2  -2.387   5.870  -8.769
   28    HB2  ALA   2           HB2      ALA   2  -3.514   7.191  -9.081
   29    HB3  ALA   2           HB3      ALA   2  -4.008   5.523  -9.371
   30    H    LEU   3           H        LEU   3  -1.885   4.740  -6.898
   31    HA   LEU   3           HA       LEU   3  -3.294   2.303  -6.016
   32    HB2  LEU   3           HB2      LEU   3  -0.448   2.710  -6.967
   33    HB3  LEU   3           HB3      LEU   3  -1.056   1.211  -6.325
   34    HG   LEU   3           HG       LEU   3  -2.769   1.293  -8.230
   35   HD11  LEU   3          HD11      LEU   3  -2.431   3.586  -8.823
   36   HD12  LEU   3          HD12      LEU   3  -1.991   2.548 -10.182
   37   HD13  LEU   3          HD13      LEU   3  -0.736   3.274  -9.177
   38   HD21  LEU   3          HD21      LEU   3  -0.938  -0.307  -8.144
   39   HD22  LEU   3          HD22      LEU   3   0.169   0.899  -8.799
   40   HD23  LEU   3          HD23      LEU   3  -1.156   0.287  -9.790
   41    H    HIS   4           H        HIS   4  -2.544   1.260  -4.099
   42    HA   HIS   4           HA       HIS   4  -1.611   3.203  -2.129
   43    HB2  HIS   4           HB2      HIS   4  -2.624   0.384  -1.820
   44    HB3  HIS   4           HB3      HIS   4  -2.032   1.349  -0.485
   45    HD1  HIS   4           HD1      HIS   4  -4.948   0.980  -2.780
   46    HD2  HIS   4           HD2      HIS   4  -3.743   3.364   0.397
   47    HE1  HIS   4           HE1      HIS   4  -7.003   2.229  -2.060
   48    HE2  HIS   4           HE2      HIS   4  -6.308   3.427   0.045
   49    H    TYR   5           H        TYR   5   0.364   3.305  -1.444
   50    HA   TYR   5           HA       TYR   5   2.290   1.348  -2.473
   51    HB2  TYR   5           HB2      TYR   5   2.362   4.268  -1.958
   52    HB3  TYR   5           HB3      TYR   5   3.847   3.373  -1.621
   53    HD1  TYR   5           HD1      TYR   5   1.698   2.170  -4.342
   54    HD2  TYR   5           HD2      TYR   5   4.975   4.695  -3.332
   55    HE1  TYR   5           HE1      TYR   5   2.327   2.304  -6.712
   56    HE2  TYR   5           HE2      TYR   5   5.616   4.818  -5.693
   57    HH   TYR   5           HH       TYR   5   5.311   3.506  -7.774
   58    H    TYR   6           H        TYR   6   2.802  -0.154  -1.041
   59    HA   TYR   6           HA       TYR   6   3.539   0.742   1.669
   60    HB2  TYR   6           HB2      TYR   6   2.392  -1.958   0.907
   61    HB3  TYR   6           HB3      TYR   6   2.851  -1.444   2.529
   62    HD1  TYR   6           HD1      TYR   6   1.545   0.408   3.636
   63    HD2  TYR   6           HD2      TYR   6   0.272  -1.429   0.014
   64    HE1  TYR   6           HE1      TYR   6  -0.728   1.297   3.980
   65    HE2  TYR   6           HE2      TYR   6  -1.994  -0.544   0.355
   66    HH   TYR   6           HH       TYR   6  -3.406   0.235   2.258
   67    H    CYS   7           H        CYS   7   5.562   0.062   2.381
   68    HA   CYS   7           HA       CYS   7   7.255  -0.733   0.192
   69    HB2  CYS   7           HB2      CYS   7   7.881   1.066   1.900
   70    HB3  CYS   7           HB3      CYS   7   8.240  -0.258   2.977
   71    H    ARG   8           H        ARG   8   8.106  -2.569  -0.231
   72    HA   ARG   8           HA       ARG   8   7.681  -4.865   1.360
   73    HB2  ARG   8           HB2      ARG   8   9.297  -5.968  -0.158
   74    HB3  ARG   8           HB3      ARG   8   8.032  -5.116  -1.023
   75    HG2  ARG   8           HG2      ARG   8   9.807  -4.459  -2.262
   76    HG3  ARG   8           HG3      ARG   8   9.860  -3.190  -1.033
   77    HD2  ARG   8           HD2      ARG   8  11.502  -4.570   0.231
   78    HD3  ARG   8           HD3      ARG   8  11.517  -5.713  -1.111
   79    HE   ARG   8           HE       ARG   8  12.104  -2.984  -1.830
   80   HH11  ARG   8          HH11      ARG   8  13.452  -6.049  -0.804
   81   HH12  ARG   8          HH12      ARG   8  15.019  -5.721  -1.471
   82   HH21  ARG   8          HH21      ARG   8  14.167  -2.550  -2.678
   83   HH22  ARG   8          HH22      ARG   8  15.433  -3.728  -2.524
   84    H    HIS   9           H        HIS   9   8.593  -5.351   3.111
   85    HA   HIS   9           HA       HIS   9  10.322  -6.119   4.450
   86    HB2  HIS   9           HB2      HIS   9  11.956  -5.899   2.598
   87    HB3  HIS   9           HB3      HIS   9  12.131  -4.190   2.973
   88    HD1  HIS   9           HD1      HIS   9  13.128  -7.583   4.135
   89    HD2  HIS   9           HD2      HIS   9  13.665  -3.626   5.275
   90    HE1  HIS   9           HE1      HIS   9  14.954  -7.617   5.861
   91    HE2  HIS   9           HE2      HIS   9  15.362  -5.202   6.426
   92    H    CYS  10           H        CYS  10   9.279  -2.935   3.924
   93    HA   CYS  10           HA       CYS  10  10.163  -2.169   6.625
   94    HB2  CYS  10           HB2      CYS  10   9.235  -0.393   4.386
   95    HB3  CYS  10           HB3      CYS  10   9.792   0.153   5.955
   96    H    GLY  11           H        GLY  11   7.395  -2.356   4.459
   97    HA2  GLY  11           HA2      GLY  11   5.144  -2.477   4.976
   98    HA3  GLY  11           HA3      GLY  11   5.564  -2.332   6.691
   99    H    VAL  12           H        VAL  12   7.111   0.102   5.022
  100    HA   VAL  12           HA       VAL  12   5.421   2.043   6.185
  101    HB   VAL  12           HB       VAL  12   7.639   2.692   6.311
  102   HG11  VAL  12          HG11      VAL  12   9.220   2.738   4.546
  103   HG12  VAL  12          HG12      VAL  12   7.971   2.448   3.336
  104   HG13  VAL  12          HG13      VAL  12   8.420   1.174   4.467
  105   HG21  VAL  12          HG21      VAL  12   6.166   4.525   5.667
  106   HG22  VAL  12          HG22      VAL  12   6.538   4.203   3.973
  107   HG23  VAL  12          HG23      VAL  12   7.808   4.750   5.066
  108    H    LYS  13           H        LYS  13   3.940   3.265   5.431
  109    HA   LYS  13           HA       LYS  13   2.845   2.773   2.836
  110    HB2  LYS  13           HB2      LYS  13   2.134   4.820   4.941
  111    HB3  LYS  13           HB3      LYS  13   1.183   4.489   3.506
  112    HG2  LYS  13           HG2      LYS  13   0.109   3.351   5.231
  113    HG3  LYS  13           HG3      LYS  13   1.008   2.111   4.374
  114    HD2  LYS  13           HD2      LYS  13   2.741   2.169   6.084
  115    HD3  LYS  13           HD3      LYS  13   1.881   3.461   6.921
  116    HE2  LYS  13           HE2      LYS  13   0.741   0.720   6.408
  117    HE3  LYS  13           HE3      LYS  13   1.538   1.195   7.905
  118    HZ1  LYS  13           HZ1      LYS  13  -0.155   2.925   8.186
  119    HZ2  LYS  13           HZ2      LYS  13  -0.841   1.382   8.123
  120    HZ3  LYS  13           HZ3      LYS  13  -0.935   2.400   6.780
  121    H    VAL  14           H        VAL  14   4.171   3.465   1.243
  122    HA   VAL  14           HA       VAL  14   5.769   5.830   1.504
  123    HB   VAL  14           HB       VAL  14   5.487   4.663  -1.195
  124   HG11  VAL  14          HG11      VAL  14   7.188   6.323  -0.670
  125   HG12  VAL  14          HG12      VAL  14   7.917   4.788  -1.145
  126   HG13  VAL  14          HG13      VAL  14   7.862   5.245   0.560
  127   HG21  VAL  14          HG21      VAL  14   5.283   2.591  -0.058
  128   HG22  VAL  14          HG22      VAL  14   6.533   3.034   1.107
  129   HG23  VAL  14          HG23      VAL  14   6.963   2.724  -0.577
  130    H    GLY  15           H        GLY  15   2.728   5.037  -0.025
  131    HA2  GLY  15           HA2      GLY  15   2.434   7.846  -0.810
  132    HA3  GLY  15           HA3      GLY  15   2.268   6.625  -2.065
  133    H    SER  16           H        SER  16   1.165   6.846   1.291
  134    HA   SER  16           HA       SER  16  -1.596   6.934   0.418
  135    HB2  SER  16           HB2      SER  16  -0.579   4.706   2.206
  136    HB3  SER  16           HB3      SER  16  -2.263   4.996   1.772
  137    HG   SER  16           HG       SER  16  -1.311   4.836  -0.503
  138    H    LEU  17           H        LEU  17  -1.226   9.037   1.315
  139    HA   LEU  17           HA       LEU  17  -0.967   9.145   4.245
  140    HB2  LEU  17           HB2      LEU  17  -0.425  11.534   3.889
  141    HB3  LEU  17           HB3      LEU  17   0.703  10.453   3.090
  142    HG   LEU  17           HG       LEU  17  -1.557  11.386   1.425
  143   HD11  LEU  17          HD11      LEU  17  -0.517  13.548   0.979
  144   HD12  LEU  17          HD12      LEU  17   0.637  13.259   2.283
  145   HD13  LEU  17          HD13      LEU  17  -1.081  13.423   2.644
  146   HD21  LEU  17          HD21      LEU  17   0.175  11.536  -0.259
  147   HD22  LEU  17          HD22      LEU  17   0.271   9.981   0.566
  148   HD23  LEU  17          HD23      LEU  17   1.421  11.258   0.957
  149    H    GLU  18           H        GLU  18  -3.069   9.420   1.673
  150    HA   GLU  18           HA       GLU  18  -4.828  11.440   2.522
  151    HB2  GLU  18           HB2      GLU  18  -5.183   9.095   0.663
  152    HB3  GLU  18           HB3      GLU  18  -6.423  10.313   0.913
  153    HG2  GLU  18           HG2      GLU  18  -5.251  10.882  -1.064
  154    HG3  GLU  18           HG3      GLU  18  -4.792  12.036   0.176
  155    H    SER  19           H        SER  19  -4.341   8.278   3.629
  156    HA   SER  19           HA       SER  19  -6.841   7.470   4.529
  157    HB2  SER  19           HB2      SER  19  -5.427   6.243   6.286
  158    HB3  SER  19           HB3      SER  19  -5.061   5.921   4.592
  159    HG   SER  19           HG       SER  19  -3.239   6.430   6.086
  160    H    SER  20           H        SER  20  -4.640   9.843   5.814
  161    HA   SER  20           HA       SER  20  -5.651  10.033   8.427
  162    HB2  SER  20           HB2      SER  20  -3.504  11.025   7.738
  163    HB3  SER  20           HB3      SER  20  -4.363  12.185   6.728
  164    HG   SER  20           HG       SER  20  -4.995  12.011   9.464
  165    H    MET  21           H        MET  21  -6.917  11.139   5.397
  166    HA   MET  21           HA       MET  21  -8.877  12.842   6.796
  167    HB2  MET  21           HB2      MET  21  -8.183  12.789   3.852
  168    HB3  MET  21           HB3      MET  21  -9.272  13.917   4.646
  169    HG2  MET  21           HG2      MET  21  -7.427  14.850   5.907
  170    HG3  MET  21           HG3      MET  21  -6.322  13.688   5.177
  171    HE1  MET  21           HE1      MET  21  -7.409  13.602   2.154
  172    HE2  MET  21           HE2      MET  21  -5.704  13.646   2.603
  173    HE3  MET  21           HE3      MET  21  -6.334  14.790   1.418
  174    H    VAL  22           H        VAL  22  -8.346  10.124   4.781
  175    HA   VAL  22           HA       VAL  22 -11.216   9.703   4.381
  176    HB   VAL  22           HB       VAL  22  -8.858   8.467   2.948
  177   HG11  VAL  22          HG11      VAL  22 -11.805   8.304   2.398
  178   HG12  VAL  22          HG12      VAL  22 -10.776   7.009   3.004
  179   HG13  VAL  22          HG13      VAL  22 -10.528   7.642   1.378
  180   HG21  VAL  22          HG21      VAL  22  -9.060  10.835   2.443
  181   HG22  VAL  22          HG22      VAL  22 -10.768  10.625   2.059
  182   HG23  VAL  22          HG23      VAL  22  -9.537   9.865   1.050
  183    H    SER  23           H        SER  23 -11.800   8.670   6.264
  184    HA   SER  23           HA       SER  23 -10.261   6.536   7.381
  185    HB2  SER  23           HB2      SER  23 -13.151   7.257   7.903
  186    HB3  SER  23           HB3      SER  23 -12.114   6.263   8.928
  187    HG   SER  23           HG       SER  23 -12.354   8.951   8.823
  188    H    THR  24           H        THR  24 -12.848   6.795   5.076
  189    HA   THR  24           HA       THR  24 -13.342   3.933   5.115
  190    HB   THR  24           HB       THR  24 -14.537   5.901   3.172
  191    HG1  THR  24           HG1      THR  24 -15.155   6.786   5.067
  192   HG21  THR  24          HG21      THR  24 -15.498   3.272   4.316
  193   HG22  THR  24          HG22      THR  24 -14.893   3.539   2.681
  194   HG23  THR  24          HG23      THR  24 -16.403   4.290   3.195
  195    H    ASP  25           H        ASP  25 -11.207   3.347   4.488
  196    HA   ASP  25           HA       ASP  25 -10.461   3.894   1.705
  197    HB2  ASP  25           HB2      ASP  25  -8.711   4.151   3.420
  198    HB3  ASP  25           HB3      ASP  25  -8.967   2.492   3.942
  199    H    SER  26           H        SER  26 -11.866   1.626   3.772
  200    HA   SER  26           HA       SER  26 -11.764  -0.490   1.731
  201    HB2  SER  26           HB2      SER  26 -10.546  -0.966   3.884
  202    HB3  SER  26           HB3      SER  26 -12.086  -0.815   4.726
  203    HG   SER  26           HG       SER  26 -11.234  -3.002   3.907
  204    H    LEU  27           H        LEU  27 -13.703  -0.989   0.885
  205    HA   LEU  27           HA       LEU  27 -16.099   0.244   1.703
  206    HB2  LEU  27           HB2      LEU  27 -15.350  -0.760  -0.604
  207    HB3  LEU  27           HB3      LEU  27 -16.041  -2.235   0.018
  208    HG   LEU  27           HG       LEU  27 -17.655   0.266   0.038
  209   HD11  LEU  27          HD11      LEU  27 -18.488  -0.272  -2.194
  210   HD12  LEU  27          HD12      LEU  27 -17.303  -1.572  -2.325
  211   HD13  LEU  27          HD13      LEU  27 -16.767   0.105  -2.227
  212   HD21  LEU  27          HD21      LEU  27 -19.506  -1.290  -0.164
  213   HD22  LEU  27          HD22      LEU  27 -18.473  -1.754   1.190
  214   HD23  LEU  27          HD23      LEU  27 -18.381  -2.636  -0.335
  215    H    GLY  28           H        GLY  28 -15.467  -3.275   1.541
  216    HA2  GLY  28           HA2      GLY  28 -15.957  -4.950   3.041
  217    HA3  GLY  28           HA3      GLY  28 -16.127  -3.711   4.270
  218    H    PHE  29           H        PHE  29 -17.726  -6.163   2.955
  219    HA   PHE  29           HA       PHE  29 -20.308  -4.934   3.528
  220    HB2  PHE  29           HB2      PHE  29 -21.227  -6.282   1.517
  221    HB3  PHE  29           HB3      PHE  29 -20.419  -4.751   1.211
  222    HD1  PHE  29           HD1      PHE  29 -20.058  -8.416   1.031
  223    HD2  PHE  29           HD2      PHE  29 -18.408  -4.630  -0.023
  224    HE1  PHE  29           HE1      PHE  29 -18.504  -9.530  -0.519
  225    HE2  PHE  29           HE2      PHE  29 -16.866  -5.737  -1.574
  226    HZ   PHE  29           HZ       PHE  29 -16.904  -8.187  -1.825
  227    H    GLN  30           H        GLN  30 -21.539  -6.121   4.739
  228    HA   GLN  30           HA       GLN  30 -20.806  -8.858   5.373
  229    HB2  GLN  30           HB2      GLN  30 -20.939  -7.282   7.234
  230    HB3  GLN  30           HB3      GLN  30 -22.564  -6.810   6.750
  231    HG2  GLN  30           HG2      GLN  30 -23.374  -9.029   7.235
  232    HG3  GLN  30           HG3      GLN  30 -21.740  -9.525   7.639
  233   HE21  GLN  30          HE21      GLN  30 -22.444 -10.134   9.720
  234   HE22  GLN  30          HE22      GLN  30 -22.764  -8.953  10.942
  235    H    HIS  31           H        HIS  31 -23.786  -6.953   5.196
  236    HA   HIS  31           HA       HIS  31 -25.092  -9.120   3.713
  237    HB2  HIS  31           HB2      HIS  31 -26.376  -8.308   5.617
  238    HB3  HIS  31           HB3      HIS  31 -26.205  -6.647   5.068
  239    HD1  HIS  31           HD1      HIS  31 -27.761  -5.833   3.191
  240    HD2  HIS  31           HD2      HIS  31 -28.300  -9.833   4.233
  241    HE1  HIS  31           HE1      HIS  31 -29.905  -6.552   2.082
  242    HE2  HIS  31           HE2      HIS  31 -30.102  -9.016   2.570
  243    H    LEU  32           H        LEU  32 -24.923  -8.925   1.542
  244    HA   LEU  32           HA       LEU  32 -24.911  -6.196   0.473
  245    HB2  LEU  32           HB2      LEU  32 -23.064  -6.529  -0.848
  246    HB3  LEU  32           HB3      LEU  32 -22.635  -7.411   0.594
  247    HG   LEU  32           HG       LEU  32 -23.841  -8.827  -1.763
  248   HD11  LEU  32          HD11      LEU  32 -21.605  -9.296  -2.554
  249   HD12  LEU  32          HD12      LEU  32 -20.915  -8.315  -1.261
  250   HD13  LEU  32          HD13      LEU  32 -21.883  -7.555  -2.524
  251   HD21  LEU  32          HD21      LEU  32 -22.013  -9.725   0.463
  252   HD22  LEU  32          HD22      LEU  32 -22.688 -10.743  -0.809
  253   HD23  LEU  32          HD23      LEU  32 -23.752 -10.007   0.388
  254    H    THR  33           H        THR  33 -26.176  -5.835  -1.183
  255    HA   THR  33           HA       THR  33 -27.254  -7.912  -2.858
  256    HB   THR  33           HB       THR  33 -29.067  -6.469  -0.900
  257    HG1  THR  33           HG1      THR  33 -27.853  -8.932  -0.898
  258   HG21  THR  33          HG21      THR  33 -30.138  -6.686  -3.076
  259   HG22  THR  33          HG22      THR  33 -30.889  -7.765  -1.899
  260   HG23  THR  33          HG23      THR  33 -29.768  -8.410  -3.098
  261    H    ASN  34           H        ASN  34 -29.106  -5.061  -2.036
  262    HA   ASN  34           HA       ASN  34 -28.617  -3.817  -4.576
  263    HB2  ASN  34           HB2      ASN  34 -29.971  -1.948  -3.615
  264    HB3  ASN  34           HB3      ASN  34 -30.785  -3.503  -3.535
  265   HD21  ASN  34          HD21      ASN  34 -31.082  -1.011  -1.964
  266   HD22  ASN  34          HD22      ASN  34 -30.922  -1.495  -0.310
  267    H    GLU  35           H        GLU  35 -27.472  -3.646  -1.343
  268    HA   GLU  35           HA       GLU  35 -25.892  -1.330  -1.417
  269    HB2  GLU  35           HB2      GLU  35 -25.067  -3.843   0.015
  270    HB3  GLU  35           HB3      GLU  35 -24.894  -2.172   0.538
  271    HG2  GLU  35           HG2      GLU  35 -27.333  -2.035   0.785
  272    HG3  GLU  35           HG3      GLU  35 -27.454  -3.733   0.362
  273    H    GLU  36           H        GLU  36 -25.370  -4.612  -2.426
  274    HA   GLU  36           HA       GLU  36 -22.659  -4.423  -3.199
  275    HB2  GLU  36           HB2      GLU  36 -23.756  -6.586  -2.918
  276    HB3  GLU  36           HB3      GLU  36 -24.876  -6.212  -4.219
  277    HG2  GLU  36           HG2      GLU  36 -22.834  -6.031  -5.717
  278    HG3  GLU  36           HG3      GLU  36 -21.940  -6.788  -4.401
  279    H    ARG  37           H        ARG  37 -25.683  -4.124  -5.012
  280    HA   ARG  37           HA       ARG  37 -24.535  -3.716  -7.522
  281    HB2  ARG  37           HB2      ARG  37 -26.826  -4.484  -7.146
  282    HB3  ARG  37           HB3      ARG  37 -27.236  -2.933  -6.427
  283    HG2  ARG  37           HG2      ARG  37 -26.684  -1.869  -8.586
  284    HG3  ARG  37           HG3      ARG  37 -26.501  -3.480  -9.278
  285    HD2  ARG  37           HD2      ARG  37 -28.732  -2.607  -9.727
  286    HD3  ARG  37           HD3      ARG  37 -28.815  -4.002  -8.649
  287    HE   ARG  37           HE       ARG  37 -28.873  -1.262  -7.566
  288   HH11  ARG  37          HH11      ARG  37 -30.366  -4.415  -7.961
  289   HH12  ARG  37          HH12      ARG  37 -31.614  -4.105  -6.797
  290   HH21  ARG  37          HH21      ARG  37 -30.528  -0.846  -6.061
  291   HH22  ARG  37          HH22      ARG  37 -31.717  -2.066  -5.725
  292    H    ASN  38           H        ASN  38 -25.972  -1.386  -5.235
  293    HA   ASN  38           HA       ASN  38 -25.438   0.823  -6.971
  294    HB2  ASN  38           HB2      ASN  38 -26.450   0.676  -4.134
  295    HB3  ASN  38           HB3      ASN  38 -26.233   2.192  -4.998
  296   HD21  ASN  38          HD21      ASN  38 -28.390   2.709  -4.935
  297   HD22  ASN  38          HD22      ASN  38 -29.581   1.880  -5.875
  298    H    ASP  39           H        ASP  39 -24.202  -0.033  -3.736
  299    HA   ASP  39           HA       ASP  39 -22.369   2.157  -3.717
  300    HB2  ASP  39           HB2      ASP  39 -22.615  -0.248  -1.902
  301    HB3  ASP  39           HB3      ASP  39 -21.520   1.100  -1.616
  302    H    MET  40           H        MET  40 -21.884  -1.371  -3.831
  303    HA   MET  40           HA       MET  40 -19.046  -1.066  -4.150
  304    HB2  MET  40           HB2      MET  40 -19.878  -2.971  -2.931
  305    HB3  MET  40           HB3      MET  40 -20.847  -3.484  -4.306
  306    HG2  MET  40           HG2      MET  40 -18.701  -3.778  -5.575
  307    HG3  MET  40           HG3      MET  40 -17.854  -3.512  -4.052
  308    HE1  MET  40           HE1      MET  40 -17.470  -6.102  -5.860
  309    HE2  MET  40           HE2      MET  40 -17.461  -7.365  -4.628
  310    HE3  MET  40           HE3      MET  40 -16.620  -5.843  -4.336
  311    H    ILE  41           H        ILE  41 -21.732  -1.974  -6.226
  312    HA   ILE  41           HA       ILE  41 -21.988  -2.198  -8.454
  313    HB   ILE  41           HB       ILE  41 -19.369  -0.704  -8.728
  314   HG12  ILE  41          HG12      ILE  41 -22.228   0.280  -8.736
  315   HG13  ILE  41          HG13      ILE  41 -21.030   0.596  -7.487
  316   HG21  ILE  41          HG21      ILE  41 -20.157  -0.196 -10.992
  317   HG22  ILE  41          HG22      ILE  41 -21.581  -1.197 -10.721
  318   HG23  ILE  41          HG23      ILE  41 -19.981  -1.935 -10.747
  319   HD11  ILE  41          HD11      ILE  41 -19.696   1.859  -9.100
  320   HD12  ILE  41          HD12      ILE  41 -21.318   2.523  -8.920
  321   HD13  ILE  41          HD13      ILE  41 -20.915   1.555 -10.337
  322    H    SER  42           H        SER  42 -18.443  -2.367  -8.371
  323    HA   SER  42           HA       SER  42 -18.397  -5.234  -8.469
  324    HB2  SER  42           HB2      SER  42 -17.614  -3.645 -10.926
  325    HB3  SER  42           HB3      SER  42 -17.256  -5.351 -10.683
  326    HG   SER  42           HG       SER  42 -19.893  -4.809 -10.281
  327    H    TYR  43           H        TYR  43 -17.194  -2.607  -7.241
  328    HA   TYR  43           HA       TYR  43 -14.403  -3.498  -7.454
  329    HB2  TYR  43           HB2      TYR  43 -13.591  -1.281  -7.734
  330    HB3  TYR  43           HB3      TYR  43 -14.874  -1.494  -8.913
  331    HD1  TYR  43           HD1      TYR  43 -16.925  -0.211  -8.765
  332    HD2  TYR  43           HD2      TYR  43 -13.905   0.183  -5.796
  333    HE1  TYR  43           HE1      TYR  43 -18.024   1.820  -7.919
  334    HE2  TYR  43           HE2      TYR  43 -14.997   2.205  -4.937
  335    HH   TYR  43           HH       TYR  43 -16.532   3.968  -5.772
  336    H    LYS  44           H        LYS  44 -13.021  -2.721  -5.738
  337    HA   LYS  44           HA       LYS  44 -14.424  -2.464  -3.164
  338    HB2  LYS  44           HB2      LYS  44 -11.529  -3.091  -3.804
  339    HB3  LYS  44           HB3      LYS  44 -12.217  -3.023  -2.193
  340    HG2  LYS  44           HG2      LYS  44 -12.965  -4.975  -4.357
  341    HG3  LYS  44           HG3      LYS  44 -11.967  -5.314  -2.943
  342    HD2  LYS  44           HD2      LYS  44 -13.874  -4.793  -1.487
  343    HD3  LYS  44           HD3      LYS  44 -14.869  -4.484  -2.912
  344    HE2  LYS  44           HE2      LYS  44 -15.336  -6.699  -2.139
  345    HE3  LYS  44           HE3      LYS  44 -14.431  -6.818  -3.644
  346    HZ1  LYS  44           HZ1      LYS  44 -12.422  -7.208  -2.322
  347    HZ2  LYS  44           HZ2      LYS  44 -13.599  -8.387  -2.052
  348    HZ3  LYS  44           HZ3      LYS  44 -13.347  -7.170  -0.905
  349    H    GLU  45           H        GLU  45 -13.870  -0.797  -1.729
  350    HA   GLU  45           HA       GLU  45 -13.383   1.720  -2.914
  351    HB2  GLU  45           HB2      GLU  45 -14.736   1.414  -0.883
  352    HB3  GLU  45           HB3      GLU  45 -13.308   0.939   0.009
  353    HG2  GLU  45           HG2      GLU  45 -13.928   3.215   0.496
  354    HG3  GLU  45           HG3      GLU  45 -12.384   3.144  -0.335
  355    H    ASN  46           H        ASN  46 -11.285  -0.689  -1.689
  356    HA   ASN  46           HA       ASN  46  -9.031   0.990  -1.169
  357    HB2  ASN  46           HB2      ASN  46  -9.074  -1.964  -1.834
  358    HB3  ASN  46           HB3      ASN  46  -7.737  -1.083  -1.109
  359   HD21  ASN  46          HD21      ASN  46  -7.902  -0.417   1.050
  360   HD22  ASN  46          HD22      ASN  46  -9.045  -1.133   2.126
  361    H    GLY  47           H        GLY  47 -10.626   0.168  -3.967
  362    HA2  GLY  47           HA2      GLY  47 -10.115   0.513  -6.187
  363    HA3  GLY  47           HA3      GLY  47  -8.541   1.138  -5.680
  364    H    ASP  48           H        ASP  48  -8.834  -1.695  -4.166
  365    HA   ASP  48           HA       ASP  48  -7.742  -3.657  -4.286
  366    HB2  ASP  48           HB2      ASP  48  -9.607  -4.081  -5.871
  367    HB3  ASP  48           HB3      ASP  48  -8.564  -3.563  -7.186
  368    H    VAL  49           H        VAL  49  -6.364  -1.088  -4.972
  369    HA   VAL  49           HA       VAL  49  -4.116  -2.164  -6.505
  370    HB   VAL  49           HB       VAL  49  -3.413   0.336  -6.509
  371   HG11  VAL  49          HG11      VAL  49  -4.831   0.759  -8.496
  372   HG12  VAL  49          HG12      VAL  49  -5.786  -0.664  -8.080
  373   HG13  VAL  49          HG13      VAL  49  -4.084  -0.838  -8.510
  374   HG21  VAL  49          HG21      VAL  49  -6.369   0.627  -5.960
  375   HG22  VAL  49          HG22      VAL  49  -5.263   1.923  -6.392
  376   HG23  VAL  49          HG23      VAL  49  -5.076   1.084  -4.852
  377    H    HIS  50           H        HIS  50  -3.063  -3.273  -4.969
  378    HA   HIS  50           HA       HIS  50  -2.030  -1.774  -2.658
  379    HB2  HIS  50           HB2      HIS  50  -3.808  -3.493  -2.089
  380    HB3  HIS  50           HB3      HIS  50  -2.714  -4.727  -2.693
  381    HD1  HIS  50           HD1      HIS  50  -3.711  -3.151   0.342
  382    HD2  HIS  50           HD2      HIS  50  -0.118  -4.626  -1.142
  383    HE1  HIS  50           HE1      HIS  50  -2.254  -3.532   2.352
  384    HE2  HIS  50           HE2      HIS  50  -0.162  -4.594   1.444
  385    H    VAL  51           H        VAL  51  -0.049  -1.328  -3.560
  386    HA   VAL  51           HA       VAL  51   1.413  -3.592  -4.735
  387    HB   VAL  51           HB       VAL  51   2.793  -1.778  -5.863
  388   HG11  VAL  51          HG11      VAL  51   1.168  -1.471  -7.649
  389   HG12  VAL  51          HG12      VAL  51  -0.137  -1.950  -6.561
  390   HG13  VAL  51          HG13      VAL  51   1.097  -3.123  -7.031
  391   HG21  VAL  51          HG21      VAL  51   0.462  -0.082  -5.008
  392   HG22  VAL  51          HG22      VAL  51   1.713   0.383  -6.159
  393   HG23  VAL  51          HG23      VAL  51   2.134   0.090  -4.473
  394    H    LEU  52           H        LEU  52   3.281  -4.222  -3.927
  395    HA   LEU  52           HA       LEU  52   4.412  -2.787  -1.663
  396    HB2  LEU  52           HB2      LEU  52   5.215  -5.422  -2.910
  397    HB3  LEU  52           HB3      LEU  52   5.885  -4.743  -1.436
  398    HG   LEU  52           HG       LEU  52   3.025  -5.639  -1.824
  399   HD11  LEU  52          HD11      LEU  52   3.627  -7.382  -0.207
  400   HD12  LEU  52          HD12      LEU  52   5.299  -6.821  -0.239
  401   HD13  LEU  52          HD13      LEU  52   4.569  -7.502  -1.693
  402   HD21  LEU  52          HD21      LEU  52   2.767  -5.205   0.556
  403   HD22  LEU  52          HD22      LEU  52   3.204  -3.727  -0.301
  404   HD23  LEU  52          HD23      LEU  52   4.419  -4.594   0.639
  405    H    THR  53           H        THR  53   5.911  -1.318  -1.967
  406    HA   THR  53           HA       THR  53   7.577  -1.485  -4.385
  407    HB   THR  53           HB       THR  53   5.716   0.120  -4.712
  408    HG1  THR  53           HG1      THR  53   7.263   0.929  -5.918
  409   HG21  THR  53          HG21      THR  53   5.640   2.191  -3.443
  410   HG22  THR  53          HG22      THR  53   6.993   1.650  -2.450
  411   HG23  THR  53          HG23      THR  53   5.445   0.805  -2.371
  412    H    ILE  54           H        ILE  54   9.149   0.625  -4.093
  413    HA   ILE  54           HA       ILE  54  10.659   0.009  -1.662
  414    HB   ILE  54           HB       ILE  54  11.359   0.712  -4.441
  415   HG12  ILE  54          HG12      ILE  54  12.966  -0.707  -2.333
  416   HG13  ILE  54          HG13      ILE  54  11.688  -1.482  -3.241
  417   HG21  ILE  54          HG21      ILE  54  13.028   1.760  -2.170
  418   HG22  ILE  54          HG22      ILE  54  12.219   2.711  -3.417
  419   HG23  ILE  54          HG23      ILE  54  13.556   1.641  -3.848
  420   HD11  ILE  54          HD11      ILE  54  13.684  -2.059  -4.319
  421   HD12  ILE  54          HD12      ILE  54  14.284  -0.404  -4.245
  422   HD13  ILE  54          HD13      ILE  54  12.951  -0.811  -5.326
  423    H    CYS  55           H        CYS  55  10.570   1.417  -0.046
  424    HA   CYS  55           HA       CYS  55   9.594   4.074  -0.352
  425    HB2  CYS  55           HB2      CYS  55  10.010   4.357   1.993
  426    HB3  CYS  55           HB3      CYS  55   9.394   2.729   1.766
  427    H    GLU  56           H        GLU  56  10.980   5.993   0.467
  428    HA   GLU  56           HA       GLU  56  12.993   6.359  -1.418
  429    HB2  GLU  56           HB2      GLU  56  12.467   7.867   1.140
  430    HB3  GLU  56           HB3      GLU  56  13.534   8.415  -0.140
  431    HG2  GLU  56           HG2      GLU  56  11.613   8.386  -1.696
  432    HG3  GLU  56           HG3      GLU  56  10.570   7.976  -0.337
  433    H    ASP  57           H        ASP  57  13.228   5.508   2.013
  434    HA   ASP  57           HA       ASP  57  16.016   5.578   2.259
  435    HB2  ASP  57           HB2      ASP  57  14.610   5.399   4.221
  436    HB3  ASP  57           HB3      ASP  57  13.988   3.844   3.680
  437    H    CYS  58           H        CYS  58  13.852   3.001   1.190
  438    HA   CYS  58           HA       CYS  58  15.849   1.033   0.838
  439    HB2  CYS  58           HB2      CYS  58  13.058   1.385  -0.179
  440    HB3  CYS  58           HB3      CYS  58  14.083   0.132  -0.873
  441    H    GLN  59           H        GLN  59  14.349   3.308  -1.465
  442    HA   GLN  59           HA       GLN  59  15.967   2.699  -3.645
  443    HB2  GLN  59           HB2      GLN  59  13.988   4.193  -3.730
  444    HB3  GLN  59           HB3      GLN  59  14.975   5.468  -3.014
  445    HG2  GLN  59           HG2      GLN  59  16.598   4.886  -4.977
  446    HG3  GLN  59           HG3      GLN  59  15.149   4.218  -5.710
  447   HE21  GLN  59          HE21      GLN  59  16.798   6.417  -6.528
  448   HE22  GLN  59          HE22      GLN  59  15.774   7.794  -6.607
  449    H    GLU  60           H        GLU  60  16.731   4.695  -0.836
  450    HA   GLU  60           HA       GLU  60  19.146   5.623  -1.924
  451    HB2  GLU  60           HB2      GLU  60  18.029   5.345   0.846
  452    HB3  GLU  60           HB3      GLU  60  19.638   5.908   0.566
  453    HG2  GLU  60           HG2      GLU  60  18.762   7.749  -0.790
  454    HG3  GLU  60           HG3      GLU  60  17.151   7.171  -0.407
  455    H    ALA  61           H        ALA  61  18.321   2.893   0.174
  456    HA   ALA  61           HA       ALA  61  20.802   1.646   0.363
  457    HB1  ALA  61           HB1      ALA  61  18.812   0.835   1.532
  458    HB2  ALA  61           HB2      ALA  61  19.539  -0.456   0.574
  459    HB3  ALA  61           HB3      ALA  61  18.088   0.365  -0.009
  460    H    LEU  62           H        LEU  62  18.563   1.965  -2.179
  461    HA   LEU  62           HA       LEU  62  19.533   0.061  -4.061
  462    HB2  LEU  62           HB2      LEU  62  17.791   2.446  -4.033
  463    HB3  LEU  62           HB3      LEU  62  18.278   1.829  -5.579
  464    HG   LEU  62           HG       LEU  62  16.280   0.869  -3.696
  465   HD11  LEU  62          HD11      LEU  62  16.901   0.338  -6.571
  466   HD12  LEU  62          HD12      LEU  62  15.722   1.484  -5.926
  467   HD13  LEU  62          HD13      LEU  62  15.463  -0.253  -5.740
  468   HD21  LEU  62          HD21      LEU  62  17.910  -0.847  -3.171
  469   HD22  LEU  62          HD22      LEU  62  18.123  -1.186  -4.891
  470   HD23  LEU  62          HD23      LEU  62  16.576  -1.511  -4.114
  471    H    ASP  63           H        ASP  63  19.734   3.568  -3.951
  472    HA   ASP  63           HA       ASP  63  21.533   3.799  -6.115
  473    HB2  ASP  63           HB2      ASP  63  20.107   5.626  -5.691
  474    HB3  ASP  63           HB3      ASP  63  20.575   5.713  -3.999
  475    H    ARG  64           H        ARG  64  22.038   3.592  -2.629
  476    HA   ARG  64           HA       ARG  64  24.928   3.656  -3.148
  477    HB2  ARG  64           HB2      ARG  64  23.917   5.428  -1.605
  478    HB3  ARG  64           HB3      ARG  64  23.567   4.127  -0.481
  479    HG2  ARG  64           HG2      ARG  64  26.117   3.606  -0.729
  480    HG3  ARG  64           HG3      ARG  64  26.201   5.270  -1.308
  481    HD2  ARG  64           HD2      ARG  64  25.166   4.326   1.361
  482    HD3  ARG  64           HD3      ARG  64  26.656   5.216   1.061
  483    HE   ARG  64           HE       ARG  64  24.625   6.789   0.066
  484   HH11  ARG  64          HH11      ARG  64  25.518   5.424   3.163
  485   HH12  ARG  64          HH12      ARG  64  24.787   6.703   4.081
  486   HH21  ARG  64          HH21      ARG  64  23.654   8.476   1.274
  487   HH22  ARG  64          HH22      ARG  64  23.735   8.442   3.006
  488    H    ASN  65           H        ASN  65  24.632   2.597  -0.136
  489    HA   ASN  65           HA       ASN  65  23.619   0.065  -0.024
  490    HB2  ASN  65           HB2      ASN  65  25.212  -0.359  -1.972
  491    HB3  ASN  65           HB3      ASN  65  26.514  -0.125  -0.811
  492   HD21  ASN  65          HD21      ASN  65  25.761  -2.480  -2.367
  493   HD22  ASN  65          HD22      ASN  65  25.500  -3.740  -1.213
  494    HA   PRO  66           HA       PRO  66  25.700   1.487   3.860
  495    HB2  PRO  66           HB2      PRO  66  23.103   0.701   4.988
  496    HB3  PRO  66           HB3      PRO  66  23.975   2.227   5.157
  497    HG2  PRO  66           HG2      PRO  66  21.728   2.021   3.690
  498    HG3  PRO  66           HG3      PRO  66  23.036   3.127   3.252
  499    HD2  PRO  66           HD2      PRO  66  22.343   0.445   2.122
  500    HD3  PRO  66           HD3      PRO  66  22.861   1.923   1.283
  501    H    HIS  67           H        HIS  67  23.293  -1.102   3.507
  502    HA   HIS  67           HA       HIS  67  25.250  -3.157   3.848
  503    HB2  HIS  67           HB2      HIS  67  24.217  -4.207   5.847
  504    HB3  HIS  67           HB3      HIS  67  24.956  -2.657   6.212
  505    HD1  HIS  67           HD1      HIS  67  21.712  -4.446   6.221
  506    HD2  HIS  67           HD2      HIS  67  23.121  -0.593   6.860
  507    HE1  HIS  67           HE1      HIS  67  19.838  -3.224   7.362
  508    HE2  HIS  67           HE2      HIS  67  20.788  -0.958   7.913
  509    H    TYR  68           H        TYR  68  23.569  -2.449   1.817
  510    HA   TYR  68           HA       TYR  68  21.108  -3.988   2.021
  511    HB2  TYR  68           HB2      TYR  68  21.006  -1.710   1.121
  512    HB3  TYR  68           HB3      TYR  68  22.135  -2.150  -0.153
  513    HD1  TYR  68           HD1      TYR  68  21.382  -3.169  -2.145
  514    HD2  TYR  68           HD2      TYR  68  18.717  -2.762   1.144
  515    HE1  TYR  68           HE1      TYR  68  19.510  -3.829  -3.592
  516    HE2  TYR  68           HE2      TYR  68  16.836  -3.425  -0.293
  517    HH   TYR  68           HH       TYR  68  17.275  -4.796  -3.376
  518    H    HIS  69           H        HIS  69  21.740  -6.103   1.895
  519    HA   HIS  69           HA       HIS  69  22.308  -8.080   0.929
  520    HB2  HIS  69           HB2      HIS  69  21.447  -6.574  -1.549
  521    HB3  HIS  69           HB3      HIS  69  21.669  -8.318  -1.465
  522    HD1  HIS  69           HD1      HIS  69  19.729  -9.682  -0.609
  523    HD2  HIS  69           HD2      HIS  69  19.261  -5.606   0.079
  524    HE1  HIS  69           HE1      HIS  69  17.383  -9.401   0.251
  525    HE2  HIS  69           HE2      HIS  69  17.184  -6.954   0.812
  526    H    GLU  70           H        GLU  70  24.516  -6.825   1.536
  527    HA   GLU  70           HA       GLU  70  26.190  -6.403  -0.803
  528    HB2  GLU  70           HB2      GLU  70  27.859  -5.616   0.830
  529    HB3  GLU  70           HB3      GLU  70  26.320  -4.786   1.011
  530    HG2  GLU  70           HG2      GLU  70  25.767  -6.301   2.878
  531    HG3  GLU  70           HG3      GLU  70  27.366  -7.021   2.729
  532    H    TYR  71           H        TYR  71  25.197  -9.102   0.307
  533    HA   TYR  71           HA       TYR  71  27.651 -10.451   0.994
  534    HB2  TYR  71           HB2      TYR  71  26.146 -12.520   0.816
  535    HB3  TYR  71           HB3      TYR  71  25.781 -11.356   2.082
  536    HD1  TYR  71           HD1      TYR  71  24.823 -12.125  -1.460
  537    HD2  TYR  71           HD2      TYR  71  23.599 -10.691   2.355
  538    HE1  TYR  71           HE1      TYR  71  22.502 -11.985  -2.259
  539    HE2  TYR  71           HE2      TYR  71  21.281 -10.541   1.561
  540    HH   TYR  71           HH       TYR  71  20.231 -11.988  -1.307
  541    H    HIS  72           H        HIS  72  28.066  -9.240  -1.371
  542    HA   HIS  72           HA       HIS  72  28.337 -11.530  -3.166
  543    HB2  HIS  72           HB2      HIS  72  27.742 -10.139  -5.125
  544    HB3  HIS  72           HB3      HIS  72  26.397 -10.355  -4.022
  545    HD1  HIS  72           HD1      HIS  72  25.152  -8.290  -3.460
  546    HD2  HIS  72           HD2      HIS  72  29.030  -7.464  -4.719
  547    HE1  HIS  72           HE1      HIS  72  25.314  -5.783  -3.570
  548    HE2  HIS  72           HE2      HIS  72  27.626  -5.311  -4.449
  549    H    THR  73           H        THR  73  30.108 -10.161  -1.338
  550    HA   THR  73           HA       THR  73  31.895  -8.550  -2.915
  551    HB   THR  73           HB       THR  73  33.364  -8.722  -0.852
  552    HG1  THR  73           HG1      THR  73  32.154 -10.750  -0.211
  553   HG21  THR  73          HG21      THR  73  30.539  -7.715  -0.482
  554   HG22  THR  73          HG22      THR  73  31.870  -6.822  -1.220
  555   HG23  THR  73          HG23      THR  73  31.934  -7.246   0.491
  Start of MODEL   17
    1    H1   GLN  -1           H1       GLN  -1  -4.251  15.171  -3.399
    2    H2   GLN  -1           H2       GLN  -1  -4.932  14.290  -2.126
    3    H3   GLN  -1           H3       GLN  -1  -5.710  14.349  -3.623
    4    HA   GLN  -1           HA       GLN  -1  -3.953  13.158  -4.665
    5    HB2  GLN  -1           HB2      GLN  -1  -2.102  12.210  -3.376
    6    HB3  GLN  -1           HB3      GLN  -1  -2.089  13.961  -3.308
    7    HG2  GLN  -1           HG2      GLN  -1  -3.145  12.182  -1.121
    8    HG3  GLN  -1           HG3      GLN  -1  -1.514  12.843  -1.174
    9   HE21  GLN  -1          HE21      GLN  -1  -3.667  13.211   0.773
   10   HE22  GLN  -1          HE22      GLN  -1  -3.930  14.916   0.867
   11    H    SER   0           H        SER   0  -5.395  11.662  -5.143
   12    HA   SER   0           HA       SER   0  -5.687   9.445  -3.293
   13    HB2  SER   0           HB2      SER   0  -7.654  10.913  -2.840
   14    HB3  SER   0           HB3      SER   0  -8.116  10.769  -4.535
   15    HG   SER   0           HG       SER   0  -9.243   9.263  -3.264
   16    H    MET   1           H        MET   1  -5.051   7.766  -4.443
   17    HA   MET   1           HA       MET   1  -5.663   7.698  -7.322
   18    HB2  MET   1           HB2      MET   1  -3.360   6.400  -5.839
   19    HB3  MET   1           HB3      MET   1  -3.671   6.247  -7.561
   20    HG2  MET   1           HG2      MET   1  -1.959   7.838  -7.354
   21    HG3  MET   1           HG3      MET   1  -3.420   8.752  -7.710
   22    HE1  MET   1           HE1      MET   1  -0.876  10.247  -6.641
   23    HE2  MET   1           HE2      MET   1  -1.600  11.287  -5.415
   24    HE3  MET   1           HE3      MET   1  -2.430  11.020  -6.947
   25    H    ALA   2           H        ALA   2  -5.598   5.278  -8.116
   26    HA   ALA   2           HA       ALA   2  -7.605   3.889  -6.557
   27    HB1  ALA   2           HB1      ALA   2  -6.312   3.116  -9.172
   28    HB2  ALA   2           HB2      ALA   2  -7.816   4.020  -8.992
   29    HB3  ALA   2           HB3      ALA   2  -7.723   2.347  -8.442
   30    H    LEU   3           H        LEU   3  -4.291   3.973  -6.673
   31    HA   LEU   3           HA       LEU   3  -4.050   1.247  -5.617
   32    HB2  LEU   3           HB2      LEU   3  -1.721   2.675  -6.812
   33    HB3  LEU   3           HB3      LEU   3  -1.938   0.986  -6.571
   34    HG   LEU   3           HG       LEU   3  -3.714   1.133  -8.424
   35   HD11  LEU   3          HD11      LEU   3  -3.216   2.946 -10.038
   36   HD12  LEU   3          HD12      LEU   3  -2.203   3.692  -8.801
   37   HD13  LEU   3          HD13      LEU   3  -3.930   3.502  -8.527
   38   HD21  LEU   3          HD21      LEU   3  -1.503   0.037  -8.613
   39   HD22  LEU   3          HD22      LEU   3  -0.812   1.581  -9.112
   40   HD23  LEU   3          HD23      LEU   3  -2.026   0.793 -10.117
   41    H    HIS   4           H        HIS   4  -2.305   0.968  -4.083
   42    HA   HIS   4           HA       HIS   4  -1.779   3.403  -2.521
   43    HB2  HIS   4           HB2      HIS   4  -3.218   1.010  -1.643
   44    HB3  HIS   4           HB3      HIS   4  -1.959   1.524  -0.553
   45    HD1  HIS   4           HD1      HIS   4  -5.431   1.985  -1.206
   46    HD2  HIS   4           HD2      HIS   4  -2.354   4.445   0.133
   47    HE1  HIS   4           HE1      HIS   4  -6.556   3.899  -0.019
   48    HE2  HIS   4           HE2      HIS   4  -4.682   5.427   0.691
   49    H    TYR   5           H        TYR   5   0.193   3.587  -1.971
   50    HA   TYR   5           HA       TYR   5   2.075   1.508  -2.719
   51    HB2  TYR   5           HB2      TYR   5   2.284   4.430  -2.106
   52    HB3  TYR   5           HB3      TYR   5   3.729   3.418  -2.029
   53    HD1  TYR   5           HD1      TYR   5   4.976   4.192  -3.810
   54    HD2  TYR   5           HD2      TYR   5   0.907   3.169  -4.457
   55    HE1  TYR   5           HE1      TYR   5   5.318   4.409  -6.224
   56    HE2  TYR   5           HE2      TYR   5   1.232   3.386  -6.888
   57    HH   TYR   5           HH       TYR   5   4.351   3.663  -8.300
   58    H    TYR   6           H        TYR   6   2.603   0.042  -1.255
   59    HA   TYR   6           HA       TYR   6   3.342   0.993   1.439
   60    HB2  TYR   6           HB2      TYR   6   2.186  -1.708   0.687
   61    HB3  TYR   6           HB3      TYR   6   2.818  -1.294   2.276
   62    HD1  TYR   6           HD1      TYR   6   1.619   0.359   3.694
   63    HD2  TYR   6           HD2      TYR   6   0.010  -1.018   0.002
   64    HE1  TYR   6           HE1      TYR   6  -0.600   1.199   4.349
   65    HE2  TYR   6           HE2      TYR   6  -2.209  -0.184   0.649
   66    HH   TYR   6           HH       TYR   6  -2.687   1.909   3.277
   67    H    CYS   7           H        CYS   7   5.420   0.377   2.097
   68    HA   CYS   7           HA       CYS   7   6.997  -0.467  -0.157
   69    HB2  CYS   7           HB2      CYS   7   7.656   1.362   1.584
   70    HB3  CYS   7           HB3      CYS   7   8.276  -0.003   2.485
   71    H    ARG   8           H        ARG   8   7.882  -2.265  -0.570
   72    HA   ARG   8           HA       ARG   8   7.407  -4.595   0.912
   73    HB2  ARG   8           HB2      ARG   8   8.900  -5.701  -0.605
   74    HB3  ARG   8           HB3      ARG   8   8.012  -4.505  -1.537
   75    HG2  ARG   8           HG2      ARG   8   9.878  -3.063  -1.654
   76    HG3  ARG   8           HG3      ARG   8  10.752  -3.972  -0.417
   77    HD2  ARG   8           HD2      ARG   8  10.581  -5.938  -2.099
   78    HD3  ARG   8           HD3      ARG   8  10.243  -4.674  -3.284
   79    HE   ARG   8           HE       ARG   8  12.531  -3.934  -1.832
   80   HH11  ARG   8          HH11      ARG   8  11.513  -6.351  -4.173
   81   HH12  ARG   8          HH12      ARG   8  13.113  -6.596  -4.798
   82   HH21  ARG   8          HH21      ARG   8  14.634  -4.276  -2.668
   83   HH22  ARG   8          HH22      ARG   8  14.879  -5.405  -3.962
   84    H    HIS   9           H        HIS   9   8.217  -5.079   2.788
   85    HA   HIS   9           HA       HIS   9   9.857  -5.943   4.158
   86    HB2  HIS   9           HB2      HIS   9  11.359  -6.060   2.158
   87    HB3  HIS   9           HB3      HIS   9  11.891  -4.423   2.517
   88    HD1  HIS   9           HD1      HIS   9  13.986  -4.329   3.813
   89    HD2  HIS   9           HD2      HIS   9  11.888  -7.838   4.543
   90    HE1  HIS   9           HE1      HIS   9  15.449  -5.682   5.337
   91    HE2  HIS   9           HE2      HIS   9  14.101  -7.739   5.872
   92    H    CYS  10           H        CYS  10  10.201  -2.524   3.236
   93    HA   CYS  10           HA       CYS  10  11.069  -1.721   5.843
   94    HB2  CYS  10           HB2      CYS  10   9.670   0.015   3.816
   95    HB3  CYS  10           HB3      CYS  10  10.726   0.538   5.116
   96    H    GLY  11           H        GLY  11   7.988  -2.120   4.240
   97    HA2  GLY  11           HA2      GLY  11   5.886  -2.375   5.122
   98    HA3  GLY  11           HA3      GLY  11   6.590  -2.219   6.740
   99    H    VAL  12           H        VAL  12   7.436   0.302   4.656
  100    HA   VAL  12           HA       VAL  12   5.852   2.097   6.206
  101    HB   VAL  12           HB       VAL  12   7.942   3.020   5.984
  102   HG11  VAL  12          HG11      VAL  12   7.981   2.688   3.006
  103   HG12  VAL  12          HG12      VAL  12   8.616   1.455   4.086
  104   HG13  VAL  12          HG13      VAL  12   9.322   3.064   4.084
  105   HG21  VAL  12          HG21      VAL  12   7.736   4.993   4.586
  106   HG22  VAL  12          HG22      VAL  12   6.244   4.660   5.466
  107   HG23  VAL  12          HG23      VAL  12   6.371   4.253   3.754
  108    H    LYS  13           H        LYS  13   4.096   3.126   5.666
  109    HA   LYS  13           HA       LYS  13   2.852   2.414   3.155
  110    HB2  LYS  13           HB2      LYS  13   0.956   3.955   4.102
  111    HB3  LYS  13           HB3      LYS  13   1.202   2.351   4.752
  112    HG2  LYS  13           HG2      LYS  13   0.870   3.614   6.641
  113    HG3  LYS  13           HG3      LYS  13   2.620   3.541   6.552
  114    HD2  LYS  13           HD2      LYS  13   1.993   5.785   7.094
  115    HD3  LYS  13           HD3      LYS  13   2.590   5.771   5.436
  116    HE2  LYS  13           HE2      LYS  13   0.312   5.773   4.589
  117    HE3  LYS  13           HE3      LYS  13  -0.319   5.708   6.235
  118    HZ1  LYS  13           HZ1      LYS  13   1.320   7.923   5.122
  119    HZ2  LYS  13           HZ2      LYS  13   0.628   7.872   6.664
  120    HZ3  LYS  13           HZ3      LYS  13  -0.360   7.952   5.294
  121    H    VAL  14           H        VAL  14   3.774   3.365   1.522
  122    HA   VAL  14           HA       VAL  14   4.844   6.009   1.670
  123    HB   VAL  14           HB       VAL  14   4.507   5.071  -1.057
  124   HG11  VAL  14          HG11      VAL  14   6.955   5.535   0.637
  125   HG12  VAL  14          HG12      VAL  14   6.128   6.752  -0.340
  126   HG13  VAL  14          HG13      VAL  14   6.924   5.384  -1.119
  127   HG21  VAL  14          HG21      VAL  14   4.514   2.827  -0.243
  128   HG22  VAL  14          HG22      VAL  14   5.826   3.176   0.884
  129   HG23  VAL  14          HG23      VAL  14   6.135   3.167  -0.854
  130    H    GLY  15           H        GLY  15   1.956   4.517   0.366
  131    HA2  GLY  15           HA2      GLY  15  -0.089   5.465  -0.110
  132    HA3  GLY  15           HA3      GLY  15   0.579   7.032   0.337
  133    H    SER  16           H        SER  16   2.324   7.776  -1.175
  134    HA   SER  16           HA       SER  16   2.470   7.049  -3.854
  135    HB2  SER  16           HB2      SER  16   0.188   7.696  -4.136
  136    HB3  SER  16           HB3      SER  16   0.417   9.148  -3.170
  137    HG   SER  16           HG       SER  16   0.923  10.138  -4.952
  138    H    LEU  17           H        LEU  17   3.659   8.753  -5.087
  139    HA   LEU  17           HA       LEU  17   4.724  11.007  -3.761
  140    HB2  LEU  17           HB2      LEU  17   7.004  10.344  -3.418
  141    HB3  LEU  17           HB3      LEU  17   5.966   9.254  -2.528
  142    HG   LEU  17           HG       LEU  17   7.152   8.564  -5.215
  143   HD11  LEU  17          HD11      LEU  17   8.191   7.910  -2.465
  144   HD12  LEU  17          HD12      LEU  17   8.949   8.989  -3.636
  145   HD13  LEU  17          HD13      LEU  17   8.813   7.267  -3.985
  146   HD21  LEU  17          HD21      LEU  17   5.975   6.842  -3.034
  147   HD22  LEU  17          HD22      LEU  17   6.648   6.273  -4.562
  148   HD23  LEU  17          HD23      LEU  17   5.185   7.256  -4.555
  149    H    GLU  18           H        GLU  18   4.741   8.722  -6.287
  150    HA   GLU  18           HA       GLU  18   5.480  10.832  -8.164
  151    HB2  GLU  18           HB2      GLU  18   6.561   8.935  -9.535
  152    HB3  GLU  18           HB3      GLU  18   7.455   9.586  -8.172
  153    HG2  GLU  18           HG2      GLU  18   6.524   7.670  -6.816
  154    HG3  GLU  18           HG3      GLU  18   5.958   6.989  -8.339
  155    H    SER  19           H        SER  19   3.422  11.209  -8.793
  156    HA   SER  19           HA       SER  19   1.884   8.938  -9.850
  157    HB2  SER  19           HB2      SER  19  -0.033  10.667  -9.576
  158    HB3  SER  19           HB3      SER  19   0.563   9.817  -8.156
  159    HG   SER  19           HG       SER  19   1.745  12.256  -8.877
  160    H    SER  20           H        SER  20   3.909  10.826 -11.058
  161    HA   SER  20           HA       SER  20   2.775  12.589 -12.870
  162    HB2  SER  20           HB2      SER  20   5.252  10.964 -13.436
  163    HB3  SER  20           HB3      SER  20   4.884  12.608 -13.960
  164    HG   SER  20           HG       SER  20   4.966  13.225 -11.731
  165    H    MET  21           H        MET  21   3.446   9.118 -13.232
  166    HA   MET  21           HA       MET  21   1.991   9.206 -15.799
  167    HB2  MET  21           HB2      MET  21   3.157   7.202 -16.457
  168    HB3  MET  21           HB3      MET  21   4.333   8.412 -15.970
  169    HG2  MET  21           HG2      MET  21   4.661   7.307 -13.860
  170    HG3  MET  21           HG3      MET  21   3.378   6.156 -14.224
  171    HE1  MET  21           HE1      MET  21   4.966   4.122 -13.685
  172    HE2  MET  21           HE2      MET  21   6.251   5.257 -13.275
  173    HE3  MET  21           HE3      MET  21   6.573   3.925 -14.382
  174    H    VAL  22           H        VAL  22   1.571   8.562 -12.677
  175    HA   VAL  22           HA       VAL  22  -0.112   6.198 -13.068
  176    HB   VAL  22           HB       VAL  22   0.791   7.457 -10.473
  177   HG11  VAL  22          HG11      VAL  22   0.083   5.348  -9.476
  178   HG12  VAL  22          HG12      VAL  22  -0.481   4.796 -11.053
  179   HG13  VAL  22          HG13      VAL  22  -1.253   6.176 -10.271
  180   HG21  VAL  22          HG21      VAL  22   2.716   6.620 -11.700
  181   HG22  VAL  22          HG22      VAL  22   1.915   5.066 -11.924
  182   HG23  VAL  22          HG23      VAL  22   2.377   5.593 -10.305
  183    H    SER  23           H        SER  23  -1.844   7.302 -14.040
  184    HA   SER  23           HA       SER  23  -3.430   8.917 -12.166
  185    HB2  SER  23           HB2      SER  23  -3.304   9.503 -15.123
  186    HB3  SER  23           HB3      SER  23  -3.992  10.505 -13.847
  187    HG   SER  23           HG       SER  23  -2.018  11.126 -13.229
  188    H    THR  24           H        THR  24  -4.958   7.418 -11.709
  189    HA   THR  24           HA       THR  24  -6.152   5.816 -13.797
  190    HB   THR  24           HB       THR  24  -7.059   6.071 -10.921
  191    HG1  THR  24           HG1      THR  24  -5.161   4.250 -12.044
  192   HG21  THR  24          HG21      THR  24  -7.944   3.815 -11.287
  193   HG22  THR  24          HG22      THR  24  -7.359   3.849 -12.950
  194   HG23  THR  24          HG23      THR  24  -8.632   4.957 -12.442
  195    H    ASP  25           H        ASP  25  -7.634   6.700 -15.108
  196    HA   ASP  25           HA       ASP  25  -9.178   9.012 -14.237
  197    HB2  ASP  25           HB2      ASP  25  -9.059   7.543 -16.884
  198    HB3  ASP  25           HB3      ASP  25 -10.080   8.944 -16.582
  199    H    SER  26           H        SER  26  -9.439   5.645 -14.777
  200    HA   SER  26           HA       SER  26 -12.308   5.497 -14.580
  201    HB2  SER  26           HB2      SER  26 -10.932   3.906 -15.915
  202    HB3  SER  26           HB3      SER  26 -10.190   3.334 -14.425
  203    HG   SER  26           HG       SER  26 -11.860   2.130 -14.071
  204    H    LEU  27           H        LEU  27 -11.696   6.934 -12.472
  205    HA   LEU  27           HA       LEU  27 -11.815   5.143 -10.186
  206    HB2  LEU  27           HB2      LEU  27  -9.514   5.669 -10.437
  207    HB3  LEU  27           HB3      LEU  27  -9.874   7.377 -10.598
  208    HG   LEU  27           HG       LEU  27 -10.607   7.476  -8.330
  209   HD11  LEU  27          HD11      LEU  27 -11.562   5.241  -8.085
  210   HD12  LEU  27          HD12      LEU  27 -10.363   5.530  -6.825
  211   HD13  LEU  27          HD13      LEU  27  -9.957   4.526  -8.215
  212   HD21  LEU  27          HD21      LEU  27  -8.447   6.985  -7.250
  213   HD22  LEU  27          HD22      LEU  27  -8.267   7.812  -8.798
  214   HD23  LEU  27          HD23      LEU  27  -7.982   6.077  -8.686
  215    H    GLY  28           H        GLY  28 -13.950   5.710  -9.792
  216    HA2  GLY  28           HA2      GLY  28 -14.671   8.510  -9.461
  217    HA3  GLY  28           HA3      GLY  28 -15.730   7.121  -9.232
  218    H    PHE  29           H        PHE  29 -12.805   6.658  -7.774
  219    HA   PHE  29           HA       PHE  29 -12.022   6.527  -5.678
  220    HB2  PHE  29           HB2      PHE  29 -13.850   8.865  -5.087
  221    HB3  PHE  29           HB3      PHE  29 -12.535   8.300  -4.068
  222    HD1  PHE  29           HD1      PHE  29 -13.293  10.952  -5.772
  223    HD2  PHE  29           HD2      PHE  29 -10.373   7.876  -6.014
  224    HE1  PHE  29           HE1      PHE  29 -11.787  12.492  -6.954
  225    HE2  PHE  29           HE2      PHE  29  -8.851   9.410  -7.193
  226    HZ   PHE  29           HZ       PHE  29  -9.555  11.720  -7.665
  227    H    GLN  30           H        GLN  30 -15.286   7.610  -4.742
  228    HA   GLN  30           HA       GLN  30 -15.871   4.932  -3.750
  229    HB2  GLN  30           HB2      GLN  30 -15.629   7.376  -2.004
  230    HB3  GLN  30           HB3      GLN  30 -16.496   5.931  -1.517
  231    HG2  GLN  30           HG2      GLN  30 -14.473   4.642  -1.743
  232    HG3  GLN  30           HG3      GLN  30 -13.593   6.074  -2.248
  233   HE21  GLN  30          HE21      GLN  30 -12.165   6.038  -0.577
  234   HE22  GLN  30          HE22      GLN  30 -12.607   6.389   1.060
  235    H    HIS  31           H        HIS  31 -17.335   7.830  -2.546
  236    HA   HIS  31           HA       HIS  31 -19.570   7.527  -4.428
  237    HB2  HIS  31           HB2      HIS  31 -19.813   7.875  -1.433
  238    HB3  HIS  31           HB3      HIS  31 -21.152   8.038  -2.562
  239    HD1  HIS  31           HD1      HIS  31 -19.192   5.550  -0.703
  240    HD2  HIS  31           HD2      HIS  31 -21.878   5.571  -3.876
  241    HE1  HIS  31           HE1      HIS  31 -19.904   3.157  -1.002
  242    HE2  HIS  31           HE2      HIS  31 -21.456   3.180  -2.986
  243    H    LEU  32           H        LEU  32 -18.131   9.241  -5.324
  244    HA   LEU  32           HA       LEU  32 -18.006  11.809  -4.192
  245    HB2  LEU  32           HB2      LEU  32 -17.923  10.830  -7.034
  246    HB3  LEU  32           HB3      LEU  32 -17.754  12.518  -6.627
  247    HG   LEU  32           HG       LEU  32 -15.901  10.333  -5.714
  248   HD11  LEU  32          HD11      LEU  32 -15.651  10.669  -8.068
  249   HD12  LEU  32          HD12      LEU  32 -14.317  11.498  -7.270
  250   HD13  LEU  32          HD13      LEU  32 -15.687  12.419  -7.878
  251   HD21  LEU  32          HD21      LEU  32 -14.489  12.290  -5.035
  252   HD22  LEU  32          HD22      LEU  32 -15.957  12.090  -4.087
  253   HD23  LEU  32          HD23      LEU  32 -15.880  13.328  -5.339
  254    H    THR  33           H        THR  33 -19.858  11.102  -7.103
  255    HA   THR  33           HA       THR  33 -22.345  11.968  -5.927
  256    HB   THR  33           HB       THR  33 -21.289  13.602  -8.245
  257    HG1  THR  33           HG1      THR  33 -20.795  13.842  -5.530
  258   HG21  THR  33          HG21      THR  33 -23.573  14.039  -6.318
  259   HG22  THR  33          HG22      THR  33 -23.719  13.549  -8.005
  260   HG23  THR  33          HG23      THR  33 -23.088  15.145  -7.601
  261    H    ASN  34           H        ASN  34 -24.169  11.634  -7.431
  262    HA   ASN  34           HA       ASN  34 -24.087   9.286  -8.869
  263    HB2  ASN  34           HB2      ASN  34 -25.911  11.623  -9.467
  264    HB3  ASN  34           HB3      ASN  34 -26.212   9.935  -9.862
  265   HD21  ASN  34          HD21      ASN  34 -26.748   8.496  -8.205
  266   HD22  ASN  34          HD22      ASN  34 -27.317   9.057  -6.669
  267    H    GLU  35           H        GLU  35 -23.863  12.584 -10.172
  268    HA   GLU  35           HA       GLU  35 -23.614  12.018 -12.854
  269    HB2  GLU  35           HB2      GLU  35 -22.394  14.188 -13.004
  270    HB3  GLU  35           HB3      GLU  35 -23.916  14.263 -12.124
  271    HG2  GLU  35           HG2      GLU  35 -22.608  14.043 -10.013
  272    HG3  GLU  35           HG3      GLU  35 -21.153  14.196 -10.988
  273    H    GLU  36           H        GLU  36 -21.088  11.999 -10.396
  274    HA   GLU  36           HA       GLU  36 -18.910  11.579 -12.159
  275    HB2  GLU  36           HB2      GLU  36 -19.227  10.830  -9.244
  276    HB3  GLU  36           HB3      GLU  36 -17.706  10.830 -10.126
  277    HG2  GLU  36           HG2      GLU  36 -19.432  13.250  -9.659
  278    HG3  GLU  36           HG3      GLU  36 -18.010  12.816  -8.710
  279    H    ARG  37           H        ARG  37 -20.940   9.412 -10.257
  280    HA   ARG  37           HA       ARG  37 -19.662   6.993 -10.872
  281    HB2  ARG  37           HB2      ARG  37 -22.579   7.486 -10.242
  282    HB3  ARG  37           HB3      ARG  37 -21.767   5.929 -10.171
  283    HG2  ARG  37           HG2      ARG  37 -20.341   6.750  -8.364
  284    HG3  ARG  37           HG3      ARG  37 -21.133   8.321  -8.456
  285    HD2  ARG  37           HD2      ARG  37 -21.984   6.876  -6.629
  286    HD3  ARG  37           HD3      ARG  37 -23.224   7.377  -7.774
  287    HE   ARG  37           HE       ARG  37 -22.183   4.871  -8.553
  288   HH11  ARG  37          HH11      ARG  37 -24.120   6.294  -6.010
  289   HH12  ARG  37          HH12      ARG  37 -25.084   4.871  -5.771
  290   HH21  ARG  37          HH21      ARG  37 -23.450   3.000  -8.252
  291   HH22  ARG  37          HH22      ARG  37 -24.697   2.993  -7.045
  292    H    ASN  38           H        ASN  38 -22.327   8.690 -12.433
  293    HA   ASN  38           HA       ASN  38 -22.827   6.654 -14.363
  294    HB2  ASN  38           HB2      ASN  38 -24.600   8.171 -13.732
  295    HB3  ASN  38           HB3      ASN  38 -23.653   9.560 -14.248
  296   HD21  ASN  38          HD21      ASN  38 -23.656  10.146 -16.369
  297   HD22  ASN  38          HD22      ASN  38 -24.611   9.358 -17.578
  298    H    ASP  39           H        ASP  39 -20.624   9.321 -14.185
  299    HA   ASP  39           HA       ASP  39 -20.323   9.676 -16.996
  300    HB2  ASP  39           HB2      ASP  39 -19.788  11.456 -15.348
  301    HB3  ASP  39           HB3      ASP  39 -18.402  10.506 -14.816
  302    H    MET  40           H        MET  40 -18.125   8.233 -14.559
  303    HA   MET  40           HA       MET  40 -16.912   6.730 -16.795
  304    HB2  MET  40           HB2      MET  40 -15.308   8.328 -16.044
  305    HB3  MET  40           HB3      MET  40 -15.614   7.940 -14.359
  306    HG2  MET  40           HG2      MET  40 -13.504   7.017 -15.069
  307    HG3  MET  40           HG3      MET  40 -14.640   5.724 -14.690
  308    HE1  MET  40           HE1      MET  40 -14.321   7.984 -17.946
  309    HE2  MET  40           HE2      MET  40 -13.286   6.943 -18.923
  310    HE3  MET  40           HE3      MET  40 -12.673   7.636 -17.422
  311    H    ILE  41           H        ILE  41 -17.535   6.658 -13.294
  312    HA   ILE  41           HA       ILE  41 -18.557   4.078 -13.234
  313    HB   ILE  41           HB       ILE  41 -16.187   3.468 -13.880
  314   HG12  ILE  41          HG12      ILE  41 -17.135   2.429 -11.199
  315   HG13  ILE  41          HG13      ILE  41 -17.734   1.890 -12.762
  316   HG21  ILE  41          HG21      ILE  41 -15.574   4.427 -11.088
  317   HG22  ILE  41          HG22      ILE  41 -15.007   5.157 -12.590
  318   HG23  ILE  41          HG23      ILE  41 -14.466   3.542 -12.136
  319   HD11  ILE  41          HD11      ILE  41 -15.513   1.056 -13.323
  320   HD12  ILE  41          HD12      ILE  41 -16.136   0.322 -11.844
  321   HD13  ILE  41          HD13      ILE  41 -14.920   1.595 -11.752
  322    H    SER  42           H        SER  42 -18.844   3.311 -10.964
  323    HA   SER  42           HA       SER  42 -19.450   5.513  -9.314
  324    HB2  SER  42           HB2      SER  42 -19.451   2.558  -8.702
  325    HB3  SER  42           HB3      SER  42 -20.102   3.798  -7.630
  326    HG   SER  42           HG       SER  42 -21.248   2.641  -9.772
  327    H    TYR  43           H        TYR  43 -17.130   2.837  -8.698
  328    HA   TYR  43           HA       TYR  43 -15.430   4.678  -7.247
  329    HB2  TYR  43           HB2      TYR  43 -15.563   3.492  -5.118
  330    HB3  TYR  43           HB3      TYR  43 -17.150   4.073  -5.587
  331    HD1  TYR  43           HD1      TYR  43 -18.785   2.402  -6.606
  332    HD2  TYR  43           HD2      TYR  43 -15.199   1.228  -4.646
  333    HE1  TYR  43           HE1      TYR  43 -19.696   0.138  -6.310
  334    HE2  TYR  43           HE2      TYR  43 -16.097  -1.036  -4.348
  335    HH   TYR  43           HH       TYR  43 -18.854  -2.149  -5.972
  336    H    LYS  44           H        LYS  44 -13.910   2.885  -5.836
  337    HA   LYS  44           HA       LYS  44 -11.963   1.955  -7.454
  338    HB2  LYS  44           HB2      LYS  44 -12.951   0.633  -4.922
  339    HB3  LYS  44           HB3      LYS  44 -11.370   0.381  -5.642
  340    HG2  LYS  44           HG2      LYS  44 -12.335   3.071  -4.710
  341    HG3  LYS  44           HG3      LYS  44 -11.462   1.944  -3.674
  342    HD2  LYS  44           HD2      LYS  44  -9.594   1.961  -5.297
  343    HD3  LYS  44           HD3      LYS  44 -10.465   3.165  -6.247
  344    HE2  LYS  44           HE2      LYS  44  -8.834   4.280  -4.866
  345    HE3  LYS  44           HE3      LYS  44 -10.451   4.669  -4.286
  346    HZ1  LYS  44           HZ1      LYS  44  -9.019   4.200  -2.436
  347    HZ2  LYS  44           HZ2      LYS  44  -8.567   2.702  -3.086
  348    HZ3  LYS  44           HZ3      LYS  44 -10.157   2.955  -2.561
  349    H    GLU  45           H        GLU  45 -11.822   0.513  -9.027
  350    HA   GLU  45           HA       GLU  45 -13.952  -1.249  -9.691
  351    HB2  GLU  45           HB2      GLU  45 -11.144  -1.069 -10.762
  352    HB3  GLU  45           HB3      GLU  45 -12.398  -2.067 -11.460
  353    HG2  GLU  45           HG2      GLU  45 -13.704  -0.066 -11.876
  354    HG3  GLU  45           HG3      GLU  45 -12.408   0.923 -11.225
  355    H    ASN  46           H        ASN  46 -10.714  -1.768  -8.346
  356    HA   ASN  46           HA       ASN  46 -11.379  -4.606  -7.918
  357    HB2  ASN  46           HB2      ASN  46  -9.272  -4.049  -9.153
  358    HB3  ASN  46           HB3      ASN  46  -8.684  -3.231  -7.712
  359   HD21  ASN  46          HD21      ASN  46  -6.922  -4.582  -7.536
  360   HD22  ASN  46          HD22      ASN  46  -7.056  -6.229  -7.028
  361    H    GLY  47           H        GLY  47 -11.836  -1.880  -6.399
  362    HA2  GLY  47           HA2      GLY  47 -12.466  -1.590  -4.158
  363    HA3  GLY  47           HA3      GLY  47 -11.564  -3.055  -3.744
  364    H    ASP  48           H        ASP  48  -9.154  -2.367  -5.031
  365    HA   ASP  48           HA       ASP  48  -8.022   0.090  -4.757
  366    HB2  ASP  48           HB2      ASP  48  -8.722  -0.292  -2.266
  367    HB3  ASP  48           HB3      ASP  48  -7.343  -1.388  -2.227
  368    H    VAL  49           H        VAL  49  -5.680  -0.016  -5.037
  369    HA   VAL  49           HA       VAL  49  -4.813  -2.730  -5.728
  370    HB   VAL  49           HB       VAL  49  -3.458  -0.234  -6.655
  371   HG11  VAL  49          HG11      VAL  49  -2.171  -2.295  -6.804
  372   HG12  VAL  49          HG12      VAL  49  -2.587  -1.683  -8.405
  373   HG13  VAL  49          HG13      VAL  49  -3.473  -3.047  -7.725
  374   HG21  VAL  49          HG21      VAL  49  -5.663   0.010  -7.466
  375   HG22  VAL  49          HG22      VAL  49  -5.774  -1.697  -7.887
  376   HG23  VAL  49          HG23      VAL  49  -4.713  -0.631  -8.807
  377    H    HIS  50           H        HIS  50  -3.804  -3.630  -4.063
  378    HA   HIS  50           HA       HIS  50  -2.154  -2.161  -2.248
  379    HB2  HIS  50           HB2      HIS  50  -3.366  -4.226  -1.604
  380    HB3  HIS  50           HB3      HIS  50  -2.344  -5.149  -2.696
  381    HD1  HIS  50           HD1      HIS  50  -0.703  -6.423  -1.394
  382    HD2  HIS  50           HD2      HIS  50  -1.420  -2.692   0.287
  383    HE1  HIS  50           HE1      HIS  50   0.796  -6.290   0.621
  384    HE2  HIS  50           HE2      HIS  50   0.259  -4.073   1.690
  385    H    VAL  51           H        VAL  51  -0.357  -1.275  -2.973
  386    HA   VAL  51           HA       VAL  51   1.183  -2.641  -5.069
  387    HB   VAL  51           HB       VAL  51   0.914   0.275  -4.342
  388   HG11  VAL  51          HG11      VAL  51   3.218  -0.180  -4.979
  389   HG12  VAL  51          HG12      VAL  51   2.373   0.793  -6.182
  390   HG13  VAL  51          HG13      VAL  51   2.654  -0.923  -6.477
  391   HG21  VAL  51          HG21      VAL  51  -0.952  -0.538  -5.594
  392   HG22  VAL  51          HG22      VAL  51   0.110  -1.315  -6.766
  393   HG23  VAL  51          HG23      VAL  51   0.052   0.445  -6.663
  394    H    LEU  52           H        LEU  52   3.089  -3.468  -4.515
  395    HA   LEU  52           HA       LEU  52   4.446  -2.451  -2.114
  396    HB2  LEU  52           HB2      LEU  52   4.806  -5.029  -3.649
  397    HB3  LEU  52           HB3      LEU  52   5.855  -4.524  -2.338
  398    HG   LEU  52           HG       LEU  52   4.362  -6.130  -1.452
  399   HD11  LEU  52          HD11      LEU  52   3.348  -3.410  -0.652
  400   HD12  LEU  52          HD12      LEU  52   4.772  -4.221  -0.000
  401   HD13  LEU  52          HD13      LEU  52   3.168  -4.903   0.268
  402   HD21  LEU  52          HD21      LEU  52   1.916  -5.907  -1.567
  403   HD22  LEU  52          HD22      LEU  52   2.653  -6.127  -3.153
  404   HD23  LEU  52          HD23      LEU  52   2.109  -4.527  -2.648
  405    H    THR  53           H        THR  53   5.864  -0.914  -2.557
  406    HA   THR  53           HA       THR  53   7.596  -1.220  -4.928
  407    HB   THR  53           HB       THR  53   5.904   0.595  -5.216
  408    HG1  THR  53           HG1      THR  53   7.705   2.322  -5.443
  409   HG21  THR  53          HG21      THR  53   5.628   1.303  -2.931
  410   HG22  THR  53          HG22      THR  53   6.207   2.670  -3.884
  411   HG23  THR  53          HG23      THR  53   7.322   1.792  -2.838
  412    H    ILE  54           H        ILE  54   9.381   0.757  -4.496
  413    HA   ILE  54           HA       ILE  54  10.512   0.162  -1.850
  414    HB   ILE  54           HB       ILE  54  11.687   0.003  -4.503
  415   HG12  ILE  54          HG12      ILE  54  12.688  -0.782  -1.767
  416   HG13  ILE  54          HG13      ILE  54  11.687  -1.771  -2.813
  417   HG21  ILE  54          HG21      ILE  54  12.634   2.183  -4.020
  418   HG22  ILE  54          HG22      ILE  54  13.884   0.936  -3.976
  419   HG23  ILE  54          HG23      ILE  54  13.238   1.593  -2.470
  420   HD11  ILE  54          HD11      ILE  54  14.017  -2.458  -2.878
  421   HD12  ILE  54          HD12      ILE  54  14.481  -0.848  -3.427
  422   HD13  ILE  54          HD13      ILE  54  13.480  -1.878  -4.451
  423    H    CYS  55           H        CYS  55  10.281   1.800  -0.537
  424    HA   CYS  55           HA       CYS  55   9.865   4.489  -1.312
  425    HB2  CYS  55           HB2      CYS  55   9.893   5.032   1.037
  426    HB3  CYS  55           HB3      CYS  55   9.028   3.514   0.829
  427    H    GLU  56           H        GLU  56  11.333   6.176   0.107
  428    HA   GLU  56           HA       GLU  56  13.737   6.278  -1.390
  429    HB2  GLU  56           HB2      GLU  56  12.898   7.965   0.971
  430    HB3  GLU  56           HB3      GLU  56  14.130   8.367  -0.214
  431    HG2  GLU  56           HG2      GLU  56  12.476   8.476  -1.965
  432    HG3  GLU  56           HG3      GLU  56  11.222   7.965  -0.840
  433    H    ASP  57           H        ASP  57  12.964   5.278   1.881
  434    HA   ASP  57           HA       ASP  57  15.477   5.404   3.073
  435    HB2  ASP  57           HB2      ASP  57  13.441   4.927   4.339
  436    HB3  ASP  57           HB3      ASP  57  13.276   3.375   3.527
  437    H    CYS  58           H        CYS  58  14.000   2.685   1.333
  438    HA   CYS  58           HA       CYS  58  16.336   1.052   1.565
  439    HB2  CYS  58           HB2      CYS  58  15.022  -0.384  -0.144
  440    HB3  CYS  58           HB3      CYS  58  14.350  -0.206   1.471
  441    H    GLN  59           H        GLN  59  14.736   2.744  -1.136
  442    HA   GLN  59           HA       GLN  59  16.378   2.014  -3.224
  443    HB2  GLN  59           HB2      GLN  59  14.293   3.247  -3.511
  444    HB3  GLN  59           HB3      GLN  59  14.998   4.666  -2.761
  445    HG2  GLN  59           HG2      GLN  59  16.260   3.539  -5.216
  446    HG3  GLN  59           HG3      GLN  59  14.772   4.476  -5.354
  447   HE21  GLN  59          HE21      GLN  59  17.484   5.047  -6.300
  448   HE22  GLN  59          HE22      GLN  59  17.914   6.570  -5.606
  449    H    GLU  60           H        GLU  60  16.959   4.488  -0.804
  450    HA   GLU  60           HA       GLU  60  19.047   5.788  -2.162
  451    HB2  GLU  60           HB2      GLU  60  17.646   6.482  -0.119
  452    HB3  GLU  60           HB3      GLU  60  18.828   5.625   0.820
  453    HG2  GLU  60           HG2      GLU  60  19.262   8.022   0.716
  454    HG3  GLU  60           HG3      GLU  60  20.542   7.044   0.030
  455    H    ALA  61           H        ALA  61  19.085   3.515   0.545
  456    HA   ALA  61           HA       ALA  61  21.886   3.171   0.603
  457    HB1  ALA  61           HB1      ALA  61  20.487   2.584   2.513
  458    HB2  ALA  61           HB2      ALA  61  21.385   1.170   1.961
  459    HB3  ALA  61           HB3      ALA  61  19.677   1.342   1.559
  460    H    LEU  62           H        LEU  62  19.258   1.857  -1.142
  461    HA   LEU  62           HA       LEU  62  20.305  -0.538  -2.092
  462    HB2  LEU  62           HB2      LEU  62  17.992   0.940  -2.362
  463    HB3  LEU  62           HB3      LEU  62  18.645   0.920  -3.991
  464    HG   LEU  62           HG       LEU  62  18.923  -1.648  -3.307
  465   HD11  LEU  62          HD11      LEU  62  17.874  -1.446  -1.163
  466   HD12  LEU  62          HD12      LEU  62  16.833  -2.392  -2.227
  467   HD13  LEU  62          HD13      LEU  62  16.451  -0.703  -1.891
  468   HD21  LEU  62          HD21      LEU  62  16.869  -2.078  -4.614
  469   HD22  LEU  62          HD22      LEU  62  17.935  -0.893  -5.366
  470   HD23  LEU  62          HD23      LEU  62  16.488  -0.358  -4.511
  471    H    ASP  63           H        ASP  63  20.100   2.576  -3.752
  472    HA   ASP  63           HA       ASP  63  21.705   1.716  -5.944
  473    HB2  ASP  63           HB2      ASP  63  19.950   3.423  -6.174
  474    HB3  ASP  63           HB3      ASP  63  20.870   4.513  -5.143
  475    H    ARG  64           H        ARG  64  22.407   3.305  -2.914
  476    HA   ARG  64           HA       ARG  64  24.932   4.355  -3.749
  477    HB2  ARG  64           HB2      ARG  64  23.744   3.966  -1.002
  478    HB3  ARG  64           HB3      ARG  64  25.313   4.704  -1.284
  479    HG2  ARG  64           HG2      ARG  64  24.256   6.469  -2.598
  480    HG3  ARG  64           HG3      ARG  64  22.678   5.730  -2.320
  481    HD2  ARG  64           HD2      ARG  64  22.980   7.561  -0.784
  482    HD3  ARG  64           HD3      ARG  64  23.007   6.043   0.112
  483    HE   ARG  64           HE       ARG  64  25.620   6.974  -0.647
  484   HH11  ARG  64          HH11      ARG  64  23.084   7.229   1.760
  485   HH12  ARG  64          HH12      ARG  64  24.153   7.749   3.022
  486   HH21  ARG  64          HH21      ARG  64  27.032   7.669   1.017
  487   HH22  ARG  64          HH22      ARG  64  26.400   7.991   2.598
  488    H    ASN  65           H        ASN  65  23.950   1.456  -1.925
  489    HA   ASN  65           HA       ASN  65  26.542   0.258  -2.472
  490    HB2  ASN  65           HB2      ASN  65  26.948  -0.257  -0.066
  491    HB3  ASN  65           HB3      ASN  65  27.036   1.461  -0.432
  492   HD21  ASN  65          HD21      ASN  65  25.204  -1.050   1.147
  493   HD22  ASN  65          HD22      ASN  65  24.193   0.008   2.073
  494    HA   PRO  66           HA       PRO  66  24.123  -3.523  -2.107
  495    HB2  PRO  66           HB2      PRO  66  26.483  -4.957  -1.174
  496    HB3  PRO  66           HB3      PRO  66  25.629  -5.111  -2.710
  497    HG2  PRO  66           HG2      PRO  66  28.115  -4.046  -2.514
  498    HG3  PRO  66           HG3      PRO  66  26.949  -3.546  -3.752
  499    HD2  PRO  66           HD2      PRO  66  27.681  -2.193  -1.181
  500    HD3  PRO  66           HD3      PRO  66  27.388  -1.486  -2.785
  501    H    HIS  67           H        HIS  67  23.591  -5.214  -0.469
  502    HA   HIS  67           HA       HIS  67  22.896  -5.814   1.613
  503    HB2  HIS  67           HB2      HIS  67  25.450  -4.425   2.443
  504    HB3  HIS  67           HB3      HIS  67  24.414  -5.303   3.560
  505    HD1  HIS  67           HD1      HIS  67  24.428  -7.884   3.407
  506    HD2  HIS  67           HD2      HIS  67  27.027  -6.006   0.765
  507    HE1  HIS  67           HE1      HIS  67  25.959  -9.688   2.571
  508    HE2  HIS  67           HE2      HIS  67  27.652  -8.487   1.149
  509    H    TYR  68           H        TYR  68  21.461  -3.854   0.690
  510    HA   TYR  68           HA       TYR  68  21.500  -1.403   2.049
  511    HB2  TYR  68           HB2      TYR  68  19.131  -1.181   1.259
  512    HB3  TYR  68           HB3      TYR  68  20.291  -1.557  -0.006
  513    HD1  TYR  68           HD1      TYR  68  17.440  -2.809   1.934
  514    HD2  TYR  68           HD2      TYR  68  20.243  -3.705  -1.134
  515    HE1  TYR  68           HE1      TYR  68  16.052  -4.711   1.226
  516    HE2  TYR  68           HE2      TYR  68  18.866  -5.608  -1.848
  517    HH   TYR  68           HH       TYR  68  15.669  -6.120  -0.636
  518    H    HIS  69           H        HIS  69  20.711  -0.710   3.898
  519    HA   HIS  69           HA       HIS  69  19.633  -0.559   5.874
  520    HB2  HIS  69           HB2      HIS  69  17.649  -1.537   4.635
  521    HB3  HIS  69           HB3      HIS  69  18.138  -3.107   5.261
  522    HD1  HIS  69           HD1      HIS  69  16.912  -3.728   7.324
  523    HD2  HIS  69           HD2      HIS  69  17.377   0.387   6.979
  524    HE1  HIS  69           HE1      HIS  69  15.770  -2.747   9.337
  525    HE2  HIS  69           HE2      HIS  69  15.980  -0.254   9.057
  526    H    GLU  70           H        GLU  70  20.799  -3.778   5.009
  527    HA   GLU  70           HA       GLU  70  21.427  -4.443   7.749
  528    HB2  GLU  70           HB2      GLU  70  22.106  -5.782   5.128
  529    HB3  GLU  70           HB3      GLU  70  22.609  -6.404   6.693
  530    HG2  GLU  70           HG2      GLU  70  20.209  -6.526   7.337
  531    HG3  GLU  70           HG3      GLU  70  19.800  -6.081   5.681
  532    H    TYR  71           H        TYR  71  22.533  -2.088   7.375
  533    HA   TYR  71           HA       TYR  71  25.406  -2.653   7.192
  534    HB2  TYR  71           HB2      TYR  71  24.092  -1.277   5.235
  535    HB3  TYR  71           HB3      TYR  71  24.550   0.035   6.317
  536    HD1  TYR  71           HD1      TYR  71  25.526  -1.627   3.492
  537    HD2  TYR  71           HD2      TYR  71  27.136  -0.319   7.204
  538    HE1  TYR  71           HE1      TYR  71  27.778  -1.644   2.514
  539    HE2  TYR  71           HE2      TYR  71  29.395  -0.331   6.233
  540    HH   TYR  71           HH       TYR  71  30.583  -1.475   4.366
  541    H    HIS  72           H        HIS  72  26.535  -1.860   8.846
  542    HA   HIS  72           HA       HIS  72  25.293  -0.981  11.170
  543    HB2  HIS  72           HB2      HIS  72  27.565  -0.494  12.019
  544    HB3  HIS  72           HB3      HIS  72  27.453  -2.067  11.246
  545    HD1  HIS  72           HD1      HIS  72  29.030  -2.530   9.336
  546    HD2  HIS  72           HD2      HIS  72  29.028   1.466  10.489
  547    HE1  HIS  72           HE1      HIS  72  30.949  -1.466   8.106
  548    HE2  HIS  72           HE2      HIS  72  31.029   0.905   8.947
  549    H    THR  73           H        THR  73  26.387   0.851   8.464
  550    HA   THR  73           HA       THR  73  25.146   3.208   9.551
  551    HB   THR  73           HB       THR  73  28.046   3.377   8.696
  552    HG1  THR  73           HG1      THR  73  26.874   2.895  11.154
  553   HG21  THR  73          HG21      THR  73  26.209   5.436   9.929
  554   HG22  THR  73          HG22      THR  73  26.697   5.384   8.237
  555   HG23  THR  73          HG23      THR  73  27.899   5.681   9.490
  Start of MODEL   18
    1    H1   GLN  -1           H1       GLN  -1  -8.367   7.582  -7.314
    2    H2   GLN  -1           H2       GLN  -1  -6.881   8.043  -6.655
    3    H3   GLN  -1           H3       GLN  -1  -7.102   8.049  -8.328
    4    HA   GLN  -1           HA       GLN  -1  -8.665   9.813  -8.210
    5    HB2  GLN  -1           HB2      GLN  -1  -8.200   9.702  -5.224
    6    HB3  GLN  -1           HB3      GLN  -1  -9.143  10.921  -6.064
    7    HG2  GLN  -1           HG2      GLN  -1 -10.734   9.233  -6.774
    8    HG3  GLN  -1           HG3      GLN  -1  -9.774   7.982  -5.986
    9   HE21  GLN  -1          HE21      GLN  -1 -12.535   8.756  -5.506
   10   HE22  GLN  -1          HE22      GLN  -1 -12.625   9.198  -3.835
   11    H    SER   0           H        SER   0  -6.959  11.022  -5.480
   12    HA   SER   0           HA       SER   0  -5.305  12.668  -7.154
   13    HB2  SER   0           HB2      SER   0  -6.253  13.470  -4.986
   14    HB3  SER   0           HB3      SER   0  -5.214  12.323  -4.143
   15    HG   SER   0           HG       SER   0  -4.500  14.625  -5.608
   16    H    MET   1           H        MET   1  -4.899   9.853  -5.107
   17    HA   MET   1           HA       MET   1  -2.113   9.561  -5.923
   18    HB2  MET   1           HB2      MET   1  -3.854   7.792  -4.181
   19    HB3  MET   1           HB3      MET   1  -2.134   7.572  -4.461
   20    HG2  MET   1           HG2      MET   1  -1.662   9.679  -3.355
   21    HG3  MET   1           HG3      MET   1  -3.386   9.957  -3.119
   22    HE1  MET   1           HE1      MET   1  -2.983  10.374  -0.546
   23    HE2  MET   1           HE2      MET   1  -1.253  10.090  -0.741
   24    HE3  MET   1           HE3      MET   1  -2.150   9.243   0.520
   25    H    ALA   2           H        ALA   2  -1.455   7.473  -6.905
   26    HA   ALA   2           HA       ALA   2  -3.446   6.606  -8.854
   27    HB1  ALA   2           HB1      ALA   2  -1.274   7.345  -9.718
   28    HB2  ALA   2           HB2      ALA   2  -1.591   5.654 -10.099
   29    HB3  ALA   2           HB3      ALA   2  -0.485   6.069  -8.793
   30    H    LEU   3           H        LEU   3  -0.867   5.057  -7.033
   31    HA   LEU   3           HA       LEU   3  -2.725   2.888  -6.342
   32    HB2  LEU   3           HB2      LEU   3   0.151   2.603  -7.193
   33    HB3  LEU   3           HB3      LEU   3  -0.739   1.334  -6.409
   34    HG   LEU   3           HG       LEU   3  -2.390   1.537  -8.370
   35   HD11  LEU   3          HD11      LEU   3   0.026   2.882  -9.512
   36   HD12  LEU   3          HD12      LEU   3  -1.531   3.638  -9.186
   37   HD13  LEU   3          HD13      LEU   3  -1.402   2.379 -10.417
   38   HD21  LEU   3          HD21      LEU   3  -0.935  -0.382  -8.046
   39   HD22  LEU   3          HD22      LEU   3   0.405   0.490  -8.790
   40   HD23  LEU   3          HD23      LEU   3  -1.006   0.054  -9.754
   41    H    HIS   4           H        HIS   4  -2.271   1.822  -4.329
   42    HA   HIS   4           HA       HIS   4  -1.190   3.717  -2.399
   43    HB2  HIS   4           HB2      HIS   4  -2.520   1.037  -1.962
   44    HB3  HIS   4           HB3      HIS   4  -2.058   2.149  -0.692
   45    HD1  HIS   4           HD1      HIS   4  -4.994   1.061  -2.119
   46    HD2  HIS   4           HD2      HIS   4  -3.415   4.875  -1.554
   47    HE1  HIS   4           HE1      HIS   4  -6.956   2.629  -2.190
   48    HE2  HIS   4           HE2      HIS   4  -5.992   4.919  -1.771
   49    H    TYR   5           H        TYR   5   0.778   3.582  -1.668
   50    HA   TYR   5           HA       TYR   5   2.402   1.303  -2.505
   51    HB2  TYR   5           HB2      TYR   5   3.011   4.160  -1.838
   52    HB3  TYR   5           HB3      TYR   5   4.286   2.939  -1.781
   53    HD1  TYR   5           HD1      TYR   5   5.214   4.660  -3.452
   54    HD2  TYR   5           HD2      TYR   5   1.939   2.093  -4.302
   55    HE1  TYR   5           HE1      TYR   5   5.632   4.934  -5.841
   56    HE2  TYR   5           HE2      TYR   5   2.339   2.363  -6.708
   57    HH   TYR   5           HH       TYR   5   5.186   3.807  -7.939
   58    H    TYR   6           H        TYR   6   3.046  -0.138  -1.106
   59    HA   TYR   6           HA       TYR   6   3.607   0.703   1.653
   60    HB2  TYR   6           HB2      TYR   6   2.351  -1.928   0.817
   61    HB3  TYR   6           HB3      TYR   6   2.762  -1.452   2.465
   62    HD1  TYR   6           HD1      TYR   6   0.339  -1.156  -0.232
   63    HD2  TYR   6           HD2      TYR   6   1.495   0.373   3.571
   64    HE1  TYR   6           HE1      TYR   6  -1.869  -0.120   0.019
   65    HE2  TYR   6           HE2      TYR   6  -0.719   1.407   3.828
   66    HH   TYR   6           HH       TYR   6  -3.340   0.660   1.822
   67    H    CYS   7           H        CYS   7   5.605   0.022   2.380
   68    HA   CYS   7           HA       CYS   7   7.302  -0.830   0.234
   69    HB2  CYS   7           HB2      CYS   7   7.986   0.911   1.953
   70    HB3  CYS   7           HB3      CYS   7   8.245  -0.418   3.049
   71    H    ARG   8           H        ARG   8   8.242  -2.600  -0.163
   72    HA   ARG   8           HA       ARG   8   7.737  -4.985   1.253
   73    HB2  ARG   8           HB2      ARG   8   9.485  -5.963  -0.155
   74    HB3  ARG   8           HB3      ARG   8   8.407  -4.966  -1.124
   75    HG2  ARG   8           HG2      ARG   8  10.008  -3.187  -1.178
   76    HG3  ARG   8           HG3      ARG   8  11.060  -4.051  -0.052
   77    HD2  ARG   8           HD2      ARG   8  11.192  -5.882  -1.786
   78    HD3  ARG   8           HD3      ARG   8  10.410  -4.757  -2.900
   79    HE   ARG   8           HE       ARG   8  12.616  -3.522  -1.654
   80   HH11  ARG   8          HH11      ARG   8  11.864  -5.902  -4.099
   81   HH12  ARG   8          HH12      ARG   8  13.335  -5.651  -4.980
   82   HH21  ARG   8          HH21      ARG   8  14.565  -3.212  -2.790
   83   HH22  ARG   8          HH22      ARG   8  14.882  -4.136  -4.224
   84    H    HIS   9           H        HIS   9   8.533  -5.583   3.025
   85    HA   HIS   9           HA       HIS   9  10.109  -6.335   4.532
   86    HB2  HIS   9           HB2      HIS   9  11.921  -6.062   2.897
   87    HB3  HIS   9           HB3      HIS   9  11.998  -4.343   3.253
   88    HD1  HIS   9           HD1      HIS   9  13.279  -7.610   4.353
   89    HD2  HIS   9           HD2      HIS   9  13.044  -3.749   5.884
   90    HE1  HIS   9           HE1      HIS   9  14.909  -7.536   6.265
   91    HE2  HIS   9           HE2      HIS   9  14.743  -5.200   7.185
   92    H    CYS  10           H        CYS  10   9.970  -2.852   3.935
   93    HA   CYS  10           HA       CYS  10  10.339  -2.212   6.710
   94    HB2  CYS  10           HB2      CYS  10   9.331  -0.479   4.467
   95    HB3  CYS  10           HB3      CYS  10   9.884   0.087   6.034
   96    H    GLY  11           H        GLY  11   7.606  -2.445   4.501
   97    HA2  GLY  11           HA2      GLY  11   5.351  -2.627   4.977
   98    HA3  GLY  11           HA3      GLY  11   5.744  -2.531   6.701
   99    H    VAL  12           H        VAL  12   7.221  -0.039   4.982
  100    HA   VAL  12           HA       VAL  12   5.524   1.859   6.230
  101    HB   VAL  12           HB       VAL  12   7.773   2.492   6.320
  102   HG11  VAL  12          HG11      VAL  12   8.472   1.079   4.365
  103   HG12  VAL  12          HG12      VAL  12   9.273   2.637   4.497
  104   HG13  VAL  12          HG13      VAL  12   7.972   2.410   3.326
  105   HG21  VAL  12          HG21      VAL  12   7.849   4.618   5.169
  106   HG22  VAL  12          HG22      VAL  12   6.247   4.329   5.852
  107   HG23  VAL  12          HG23      VAL  12   6.527   4.100   4.126
  108    H    LYS  13           H        LYS  13   4.074   3.147   5.448
  109    HA   LYS  13           HA       LYS  13   2.934   2.507   2.887
  110    HB2  LYS  13           HB2      LYS  13   2.136   4.830   4.634
  111    HB3  LYS  13           HB3      LYS  13   1.138   3.913   3.517
  112    HG2  LYS  13           HG2      LYS  13   1.214   1.986   4.989
  113    HG3  LYS  13           HG3      LYS  13   2.267   2.861   6.101
  114    HD2  LYS  13           HD2      LYS  13   0.441   4.574   6.317
  115    HD3  LYS  13           HD3      LYS  13  -0.599   3.478   5.406
  116    HE2  LYS  13           HE2      LYS  13   0.729   2.927   8.060
  117    HE3  LYS  13           HE3      LYS  13  -0.988   3.205   7.779
  118    HZ1  LYS  13           HZ1      LYS  13  -0.996   1.177   6.392
  119    HZ2  LYS  13           HZ2      LYS  13  -0.600   0.873   8.003
  120    HZ3  LYS  13           HZ3      LYS  13   0.613   0.892   6.828
  121    H    VAL  14           H        VAL  14   4.297   3.147   1.284
  122    HA   VAL  14           HA       VAL  14   5.884   5.500   1.442
  123    HB   VAL  14           HB       VAL  14   5.432   4.381  -1.252
  124   HG11  VAL  14          HG11      VAL  14   7.904   4.921   0.369
  125   HG12  VAL  14          HG12      VAL  14   7.147   6.038  -0.773
  126   HG13  VAL  14          HG13      VAL  14   7.851   4.527  -1.351
  127   HG21  VAL  14          HG21      VAL  14   5.286   2.288  -0.119
  128   HG22  VAL  14          HG22      VAL  14   6.630   2.704   0.944
  129   HG23  VAL  14          HG23      VAL  14   6.916   2.424  -0.776
  130    H    GLY  15           H        GLY  15   2.764   4.762   0.065
  131    HA2  GLY  15           HA2      GLY  15   2.635   7.081  -1.625
  132    HA3  GLY  15           HA3      GLY  15   1.299   6.012  -1.221
  133    H    SER  16           H        SER  16   2.438   6.685   1.664
  134    HA   SER  16           HA       SER  16   0.770   9.083   1.984
  135    HB2  SER  16           HB2      SER  16  -0.255   7.068   2.971
  136    HB3  SER  16           HB3      SER  16   1.201   6.792   3.925
  137    HG   SER  16           HG       SER  16   0.328   8.030   5.358
  138    H    LEU  17           H        LEU  17   1.494  10.634   3.514
  139    HA   LEU  17           HA       LEU  17   4.276  10.289   4.394
  140    HB2  LEU  17           HB2      LEU  17   4.699  12.651   3.996
  141    HB3  LEU  17           HB3      LEU  17   4.223  11.847   2.515
  142    HG   LEU  17           HG       LEU  17   2.188  13.340   4.139
  143   HD11  LEU  17          HD11      LEU  17   2.657  15.325   2.813
  144   HD12  LEU  17          HD12      LEU  17   4.038  14.516   2.074
  145   HD13  LEU  17          HD13      LEU  17   4.046  14.876   3.800
  146   HD21  LEU  17          HD21      LEU  17   1.413  11.903   2.312
  147   HD22  LEU  17          HD22      LEU  17   2.462  12.768   1.188
  148   HD23  LEU  17          HD23      LEU  17   1.121  13.606   1.967
  149    H    GLU  18           H        GLU  18   1.095  11.194   5.087
  150    HA   GLU  18           HA       GLU  18   1.719  12.458   7.607
  151    HB2  GLU  18           HB2      GLU  18  -0.964  11.687   6.463
  152    HB3  GLU  18           HB3      GLU  18  -0.681  12.759   7.830
  153    HG2  GLU  18           HG2      GLU  18   0.451  14.345   6.359
  154    HG3  GLU  18           HG3      GLU  18   0.176  13.272   4.989
  155    H    SER  19           H        SER  19  -0.625   9.936   6.925
  156    HA   SER  19           HA       SER  19  -1.149   7.967   7.944
  157    HB2  SER  19           HB2      SER  19   1.807   7.900   8.511
  158    HB3  SER  19           HB3      SER  19   0.724   6.513   8.508
  159    HG   SER  19           HG       SER  19   2.079   7.219   6.510
  160    H    SER  20           H        SER  20  -1.538  10.203   9.554
  161    HA   SER  20           HA       SER  20  -0.633   9.381  12.200
  162    HB2  SER  20           HB2      SER  20  -2.183  11.850  11.380
  163    HB3  SER  20           HB3      SER  20  -1.498  11.533  12.973
  164    HG   SER  20           HG       SER  20   0.568  11.310  11.725
  165    H    MET  21           H        MET  21  -3.750  10.544  10.876
  166    HA   MET  21           HA       MET  21  -5.098   8.644  12.662
  167    HB2  MET  21           HB2      MET  21  -6.260  11.020  11.201
  168    HB3  MET  21           HB3      MET  21  -7.066  10.043  12.421
  169    HG2  MET  21           HG2      MET  21  -4.611  11.713  12.897
  170    HG3  MET  21           HG3      MET  21  -6.254  12.205  13.269
  171    HE1  MET  21           HE1      MET  21  -7.249   9.656  16.078
  172    HE2  MET  21           HE2      MET  21  -7.487   9.402  14.349
  173    HE3  MET  21           HE3      MET  21  -7.786  10.990  15.056
  174    H    VAL  22           H        VAL  22  -4.250   9.096   9.436
  175    HA   VAL  22           HA       VAL  22  -6.581   7.802   8.320
  176    HB   VAL  22           HB       VAL  22  -5.555   9.552   7.003
  177   HG11  VAL  22          HG11      VAL  22  -3.255   9.358   7.784
  178   HG12  VAL  22          HG12      VAL  22  -3.338   9.355   6.024
  179   HG13  VAL  22          HG13      VAL  22  -3.075   7.846   6.895
  180   HG21  VAL  22          HG21      VAL  22  -5.169   6.847   5.736
  181   HG22  VAL  22          HG22      VAL  22  -5.279   8.379   4.867
  182   HG23  VAL  22          HG23      VAL  22  -6.663   7.783   5.784
  183    H    SER  23           H        SER  23  -6.352   5.902   9.669
  184    HA   SER  23           HA       SER  23  -4.177   4.085   9.132
  185    HB2  SER  23           HB2      SER  23  -6.771   3.596  10.590
  186    HB3  SER  23           HB3      SER  23  -5.330   2.586  10.660
  187    HG   SER  23           HG       SER  23  -4.583   5.047  11.260
  188    H    THR  24           H        THR  24  -4.805   4.413   6.776
  189    HA   THR  24           HA       THR  24  -7.012   3.341   5.530
  190    HB   THR  24           HB       THR  24  -5.402   4.618   4.275
  191    HG1  THR  24           HG1      THR  24  -5.597   3.461   2.462
  192   HG21  THR  24          HG21      THR  24  -3.197   3.737   3.673
  193   HG22  THR  24          HG22      THR  24  -3.490   2.315   4.674
  194   HG23  THR  24          HG23      THR  24  -3.359   3.906   5.421
  195    H    ASP  25           H        ASP  25  -7.638   1.382   4.808
  196    HA   ASP  25           HA       ASP  25  -6.347  -0.914   6.079
  197    HB2  ASP  25           HB2      ASP  25  -9.132  -0.588   4.936
  198    HB3  ASP  25           HB3      ASP  25  -8.499  -2.097   5.584
  199    H    SER  26           H        SER  26  -8.034  -0.113   3.043
  200    HA   SER  26           HA       SER  26  -7.561  -0.601   0.883
  201    HB2  SER  26           HB2      SER  26  -5.611   0.715   1.227
  202    HB3  SER  26           HB3      SER  26  -4.812  -0.564   2.130
  203    HG   SER  26           HG       SER  26  -5.495  -0.713  -0.641
  204    H    LEU  27           H        LEU  27  -8.675  -2.644   2.045
  205    HA   LEU  27           HA       LEU  27  -7.220  -4.991   1.045
  206    HB2  LEU  27           HB2      LEU  27  -8.812  -4.796   3.603
  207    HB3  LEU  27           HB3      LEU  27  -8.235  -6.301   2.913
  208    HG   LEU  27           HG       LEU  27  -6.429  -4.044   3.796
  209   HD11  LEU  27          HD11      LEU  27  -5.906  -5.445   5.721
  210   HD12  LEU  27          HD12      LEU  27  -7.123  -6.614   5.209
  211   HD13  LEU  27          HD13      LEU  27  -7.610  -4.992   5.707
  212   HD21  LEU  27          HD21      LEU  27  -4.676  -5.764   3.632
  213   HD22  LEU  27          HD22      LEU  27  -5.446  -5.451   2.077
  214   HD23  LEU  27          HD23      LEU  27  -5.866  -6.897   2.993
  215    H    GLY  28           H        GLY  28  -8.682  -6.817   0.527
  216    HA2  GLY  28           HA2      GLY  28 -10.890  -5.708  -1.003
  217    HA3  GLY  28           HA3      GLY  28 -10.211  -7.318  -1.155
  218    H    PHE  29           H        PHE  29 -11.528  -5.676   1.702
  219    HA   PHE  29           HA       PHE  29 -13.970  -7.164   1.518
  220    HB2  PHE  29           HB2      PHE  29 -13.756  -8.219   3.763
  221    HB3  PHE  29           HB3      PHE  29 -12.684  -8.905   2.559
  222    HD1  PHE  29           HD1      PHE  29 -10.338  -8.840   2.824
  223    HD2  PHE  29           HD2      PHE  29 -12.864  -6.787   5.565
  224    HE1  PHE  29           HE1      PHE  29  -8.445  -8.585   4.373
  225    HE2  PHE  29           HE2      PHE  29 -10.975  -6.522   7.117
  226    HZ   PHE  29           HZ       PHE  29  -8.763  -7.423   6.523
  227    H    GLN  30           H        GLN  30 -15.605  -6.243   2.587
  228    HA   GLN  30           HA       GLN  30 -15.046  -3.769   4.096
  229    HB2  GLN  30           HB2      GLN  30 -17.737  -4.746   3.145
  230    HB3  GLN  30           HB3      GLN  30 -17.264  -3.110   3.557
  231    HG2  GLN  30           HG2      GLN  30 -15.913  -2.973   1.587
  232    HG3  GLN  30           HG3      GLN  30 -16.244  -4.651   1.192
  233   HE21  GLN  30          HE21      GLN  30 -18.278  -5.236   0.465
  234   HE22  GLN  30          HE22      GLN  30 -19.393  -4.072  -0.166
  235    H    HIS  31           H        HIS  31 -17.371  -6.356   3.979
  236    HA   HIS  31           HA       HIS  31 -17.378  -6.547   6.925
  237    HB2  HIS  31           HB2      HIS  31 -19.625  -7.576   6.683
  238    HB3  HIS  31           HB3      HIS  31 -19.573  -5.943   6.044
  239    HD1  HIS  31           HD1      HIS  31 -20.039  -9.500   5.013
  240    HD2  HIS  31           HD2      HIS  31 -19.918  -5.731   3.271
  241    HE1  HIS  31           HE1      HIS  31 -20.924  -9.801   2.681
  242    HE2  HIS  31           HE2      HIS  31 -20.870  -7.506   1.654
  243    H    LEU  32           H        LEU  32 -15.849  -7.722   4.514
  244    HA   LEU  32           HA       LEU  32 -14.938  -9.651   3.801
  245    HB2  LEU  32           HB2      LEU  32 -13.656 -10.810   5.484
  246    HB3  LEU  32           HB3      LEU  32 -13.570  -9.085   5.686
  247    HG   LEU  32           HG       LEU  32 -15.475 -10.658   7.385
  248   HD11  LEU  32          HD11      LEU  32 -13.666 -10.961   9.016
  249   HD12  LEU  32          HD12      LEU  32 -12.511 -10.318   7.849
  250   HD13  LEU  32          HD13      LEU  32 -13.341 -11.838   7.522
  251   HD21  LEU  32          HD21      LEU  32 -14.967  -8.883   8.986
  252   HD22  LEU  32          HD22      LEU  32 -15.525  -8.201   7.458
  253   HD23  LEU  32          HD23      LEU  32 -13.807  -8.182   7.857
  254    H    THR  33           H        THR  33 -15.112 -12.071   5.881
  255    HA   THR  33           HA       THR  33 -16.169 -14.068   5.838
  256    HB   THR  33           HB       THR  33 -18.529 -12.373   5.050
  257    HG1  THR  33           HG1      THR  33 -17.273 -12.879   7.379
  258   HG21  THR  33          HG21      THR  33 -18.468 -15.274   5.857
  259   HG22  THR  33          HG22      THR  33 -18.894 -14.632   4.268
  260   HG23  THR  33          HG23      THR  33 -19.925 -14.298   5.664
  261    H    ASN  34           H        ASN  34 -18.194 -12.883   3.189
  262    HA   ASN  34           HA       ASN  34 -17.220 -14.948   1.446
  263    HB2  ASN  34           HB2      ASN  34 -19.073 -12.598   0.984
  264    HB3  ASN  34           HB3      ASN  34 -18.656 -13.752  -0.276
  265   HD21  ASN  34          HD21      ASN  34 -21.240 -13.137   0.884
  266   HD22  ASN  34          HD22      ASN  34 -21.850 -14.621   1.530
  267    H    GLU  35           H        GLU  35 -16.764 -11.541   1.894
  268    HA   GLU  35           HA       GLU  35 -15.165 -11.126  -0.462
  269    HB2  GLU  35           HB2      GLU  35 -14.961  -9.344   1.934
  270    HB3  GLU  35           HB3      GLU  35 -14.990  -8.917   0.229
  271    HG2  GLU  35           HG2      GLU  35 -17.385  -9.559   0.178
  272    HG3  GLU  35           HG3      GLU  35 -17.317  -9.789   1.918
  273    H    GLU  36           H        GLU  36 -14.695 -12.162   2.749
  274    HA   GLU  36           HA       GLU  36 -11.979 -11.742   3.212
  275    HB2  GLU  36           HB2      GLU  36 -13.560 -12.560   4.904
  276    HB3  GLU  36           HB3      GLU  36 -13.718 -14.075   4.038
  277    HG2  GLU  36           HG2      GLU  36 -11.338 -14.529   4.456
  278    HG3  GLU  36           HG3      GLU  36 -11.245 -13.039   5.399
  279    H    ARG  37           H        ARG  37 -13.622 -14.451   1.635
  280    HA   ARG  37           HA       ARG  37 -11.282 -15.985   1.201
  281    HB2  ARG  37           HB2      ARG  37 -13.938 -16.081  -0.234
  282    HB3  ARG  37           HB3      ARG  37 -12.691 -17.316  -0.323
  283    HG2  ARG  37           HG2      ARG  37 -12.932 -17.676   2.112
  284    HG3  ARG  37           HG3      ARG  37 -14.258 -16.514   2.119
  285    HD2  ARG  37           HD2      ARG  37 -14.165 -19.088   0.552
  286    HD3  ARG  37           HD3      ARG  37 -15.082 -18.811   2.031
  287    HE   ARG  37           HE       ARG  37 -15.696 -16.996  -0.135
  288   HH11  ARG  37          HH11      ARG  37 -16.440 -20.060   1.373
  289   HH12  ARG  37          HH12      ARG  37 -18.064 -20.107   0.773
  290   HH21  ARG  37          HH21      ARG  37 -17.833 -17.060  -0.946
  291   HH22  ARG  37          HH22      ARG  37 -18.857 -18.401  -0.546
  292    H    ASN  38           H        ASN  38 -12.882 -13.474  -0.604
  293    HA   ASN  38           HA       ASN  38 -11.531 -13.967  -3.071
  294    HB2  ASN  38           HB2      ASN  38 -13.138 -11.643  -2.032
  295    HB3  ASN  38           HB3      ASN  38 -12.349 -11.602  -3.603
  296   HD21  ASN  38          HD21      ASN  38 -13.101 -12.925  -5.252
  297   HD22  ASN  38          HD22      ASN  38 -14.653 -13.685  -5.179
  298    H    ASP  39           H        ASP  39 -11.059 -11.678  -0.397
  299    HA   ASP  39           HA       ASP  39  -8.854 -10.349  -1.582
  300    HB2  ASP  39           HB2      ASP  39 -10.112  -9.338   0.265
  301    HB3  ASP  39           HB3      ASP  39  -9.559 -10.613   1.348
  302    H    MET  40           H        MET  40  -9.166 -13.228   0.378
  303    HA   MET  40           HA       MET  40  -6.445 -13.609   0.985
  304    HB2  MET  40           HB2      MET  40  -8.295 -14.870   2.053
  305    HB3  MET  40           HB3      MET  40  -8.569 -15.716   0.538
  306    HG2  MET  40           HG2      MET  40  -7.306 -17.091   2.079
  307    HG3  MET  40           HG3      MET  40  -6.334 -16.683   0.666
  308    HE1  MET  40           HE1      MET  40  -5.124 -17.864   3.352
  309    HE2  MET  40           HE2      MET  40  -3.699 -16.850   3.576
  310    HE3  MET  40           HE3      MET  40  -4.119 -17.439   1.966
  311    H    ILE  41           H        ILE  41  -8.344 -14.219  -1.864
  312    HA   ILE  41           HA       ILE  41  -6.291 -15.689  -3.239
  313    HB   ILE  41           HB       ILE  41  -8.723 -14.271  -4.354
  314   HG12  ILE  41          HG12      ILE  41  -8.312 -17.201  -3.717
  315   HG13  ILE  41          HG13      ILE  41  -9.257 -16.081  -2.742
  316   HG21  ILE  41          HG21      ILE  41  -7.015 -14.618  -6.053
  317   HG22  ILE  41          HG22      ILE  41  -8.391 -15.685  -6.331
  318   HG23  ILE  41          HG23      ILE  41  -6.909 -16.324  -5.620
  319   HD11  ILE  41          HD11      ILE  41 -10.787 -15.750  -4.619
  320   HD12  ILE  41          HD12      ILE  41 -10.692 -17.443  -4.138
  321   HD13  ILE  41          HD13      ILE  41  -9.844 -16.889  -5.581
  322    H    SER  42           H        SER  42  -7.761 -12.497  -3.845
  323    HA   SER  42           HA       SER  42  -5.435 -10.984  -3.933
  324    HB2  SER  42           HB2      SER  42  -5.138 -10.734  -6.414
  325    HB3  SER  42           HB3      SER  42  -4.686 -12.322  -5.800
  326    HG   SER  42           HG       SER  42  -6.087 -13.131  -7.114
  327    H    TYR  43           H        TYR  43  -8.483 -11.565  -5.595
  328    HA   TYR  43           HA       TYR  43  -8.983  -9.081  -6.650
  329    HB2  TYR  43           HB2      TYR  43 -10.345 -10.875  -7.336
  330    HB3  TYR  43           HB3      TYR  43 -10.828 -11.247  -5.687
  331    HD1  TYR  43           HD1      TYR  43 -10.943  -8.233  -7.926
  332    HD2  TYR  43           HD2      TYR  43 -13.041 -10.778  -5.239
  333    HE1  TYR  43           HE1      TYR  43 -12.972  -6.877  -8.228
  334    HE2  TYR  43           HE2      TYR  43 -15.069  -9.424  -5.527
  335    HH   TYR  43           HH       TYR  43 -15.414  -7.130  -7.997
  336    H    LYS  44           H        LYS  44  -9.160  -7.194  -5.809
  337    HA   LYS  44           HA       LYS  44 -10.149  -6.798  -3.090
  338    HB2  LYS  44           HB2      LYS  44  -9.076  -4.832  -5.131
  339    HB3  LYS  44           HB3      LYS  44  -9.448  -4.468  -3.455
  340    HG2  LYS  44           HG2      LYS  44  -7.441  -6.570  -4.167
  341    HG3  LYS  44           HG3      LYS  44  -7.001  -4.863  -4.111
  342    HD2  LYS  44           HD2      LYS  44  -7.623  -4.718  -1.799
  343    HD3  LYS  44           HD3      LYS  44  -8.295  -6.348  -1.830
  344    HE2  LYS  44           HE2      LYS  44  -5.409  -5.813  -2.455
  345    HE3  LYS  44           HE3      LYS  44  -5.972  -6.030  -0.799
  346    HZ1  LYS  44           HZ1      LYS  44  -5.131  -8.086  -1.842
  347    HZ2  LYS  44           HZ2      LYS  44  -6.393  -8.016  -2.969
  348    HZ3  LYS  44           HZ3      LYS  44  -6.738  -8.212  -1.318
  349    H    GLU  45           H        GLU  45 -12.247  -6.354  -2.760
  350    HA   GLU  45           HA       GLU  45 -14.115  -6.439  -4.772
  351    HB2  GLU  45           HB2      GLU  45 -15.691  -5.493  -3.041
  352    HB3  GLU  45           HB3      GLU  45 -14.950  -7.067  -2.797
  353    HG2  GLU  45           HG2      GLU  45 -14.743  -6.096  -0.811
  354    HG3  GLU  45           HG3      GLU  45 -13.175  -5.778  -1.492
  355    H    ASN  46           H        ASN  46 -12.485  -3.687  -3.481
  356    HA   ASN  46           HA       ASN  46 -14.264  -1.838  -4.869
  357    HB2  ASN  46           HB2      ASN  46 -13.593  -1.254  -2.594
  358    HB3  ASN  46           HB3      ASN  46 -11.897  -1.362  -3.040
  359   HD21  ASN  46          HD21      ASN  46 -14.851   0.460  -3.468
  360   HD22  ASN  46          HD22      ASN  46 -14.092   1.934  -3.963
  361    H    GLY  47           H        GLY  47 -11.662  -3.700  -5.636
  362    HA2  GLY  47           HA2      GLY  47 -10.153  -3.639  -7.382
  363    HA3  GLY  47           HA3      GLY  47 -10.898  -2.122  -7.906
  364    H    ASP  48           H        ASP  48  -9.721  -2.609  -4.678
  365    HA   ASP  48           HA       ASP  48  -8.413  -0.162  -4.569
  366    HB2  ASP  48           HB2      ASP  48  -9.192  -1.605  -2.623
  367    HB3  ASP  48           HB3      ASP  48  -7.700  -2.518  -2.826
  368    H    VAL  49           H        VAL  49  -6.428   0.507  -4.925
  369    HA   VAL  49           HA       VAL  49  -4.643  -1.235  -6.401
  370    HB   VAL  49           HB       VAL  49  -3.313   1.027  -6.552
  371   HG11  VAL  49          HG11      VAL  49  -5.922   0.550  -7.987
  372   HG12  VAL  49          HG12      VAL  49  -4.347  -0.107  -8.435
  373   HG13  VAL  49          HG13      VAL  49  -4.639   1.631  -8.531
  374   HG21  VAL  49          HG21      VAL  49  -4.689   3.010  -6.444
  375   HG22  VAL  49          HG22      VAL  49  -4.765   2.198  -4.881
  376   HG23  VAL  49          HG23      VAL  49  -6.103   2.062  -6.022
  377    H    HIS  50           H        HIS  50  -3.679  -2.546  -4.934
  378    HA   HIS  50           HA       HIS  50  -2.203  -1.274  -2.722
  379    HB2  HIS  50           HB2      HIS  50  -4.161  -2.802  -2.143
  380    HB3  HIS  50           HB3      HIS  50  -3.210  -4.123  -2.804
  381    HD1  HIS  50           HD1      HIS  50  -4.051  -2.704   0.293
  382    HD2  HIS  50           HD2      HIS  50  -0.496  -4.132  -1.332
  383    HE1  HIS  50           HE1      HIS  50  -2.582  -3.261   2.253
  384    HE2  HIS  50           HE2      HIS  50  -0.481  -4.218   1.256
  385    H    VAL  51           H        VAL  51  -0.105  -1.181  -3.296
  386    HA   VAL  51           HA       VAL  51   1.069  -3.554  -4.584
  387    HB   VAL  51           HB       VAL  51   2.626  -1.935  -5.772
  388   HG11  VAL  51          HG11      VAL  51   0.877  -3.121  -6.968
  389   HG12  VAL  51          HG12      VAL  51   1.013  -1.464  -7.566
  390   HG13  VAL  51          HG13      VAL  51  -0.303  -1.905  -6.476
  391   HG21  VAL  51          HG21      VAL  51   1.709   0.311  -6.176
  392   HG22  VAL  51          HG22      VAL  51   2.192   0.045  -4.500
  393   HG23  VAL  51          HG23      VAL  51   0.484   0.001  -4.944
  394    H    LEU  52           H        LEU  52   3.073  -4.159  -3.969
  395    HA   LEU  52           HA       LEU  52   4.239  -2.780  -1.659
  396    HB2  LEU  52           HB2      LEU  52   4.830  -5.500  -2.849
  397    HB3  LEU  52           HB3      LEU  52   5.658  -4.820  -1.462
  398    HG   LEU  52           HG       LEU  52   4.113  -6.340  -0.572
  399   HD11  LEU  52          HD11      LEU  52   2.576  -4.993   0.714
  400   HD12  LEU  52          HD12      LEU  52   2.779  -3.650  -0.410
  401   HD13  LEU  52          HD13      LEU  52   4.139  -4.187   0.576
  402   HD21  LEU  52          HD21      LEU  52   2.004  -5.137  -2.356
  403   HD22  LEU  52          HD22      LEU  52   1.734  -6.393  -1.147
  404   HD23  LEU  52          HD23      LEU  52   2.757  -6.720  -2.544
  405    H    THR  53           H        THR  53   6.004  -1.530  -1.933
  406    HA   THR  53           HA       THR  53   7.648  -1.927  -4.321
  407    HB   THR  53           HB       THR  53   5.801  -0.356  -4.925
  408    HG1  THR  53           HG1      THR  53   7.744  -0.142  -6.054
  409   HG21  THR  53          HG21      THR  53   5.841   1.917  -4.010
  410   HG22  THR  53          HG22      THR  53   7.118   1.441  -2.891
  411   HG23  THR  53          HG23      THR  53   5.514   0.722  -2.754
  412    H    ILE  54           H        ILE  54   9.221   0.219  -4.264
  413    HA   ILE  54           HA       ILE  54  10.781  -0.154  -1.839
  414    HB   ILE  54           HB       ILE  54  11.295   0.899  -4.580
  415   HG12  ILE  54          HG12      ILE  54  13.087  -0.724  -2.798
  416   HG13  ILE  54          HG13      ILE  54  11.777  -1.446  -3.709
  417   HG21  ILE  54          HG21      ILE  54  13.067   1.602  -2.251
  418   HG22  ILE  54          HG22      ILE  54  12.072   2.735  -3.165
  419   HG23  ILE  54          HG23      ILE  54  13.411   1.902  -3.954
  420   HD11  ILE  54          HD11      ILE  54  14.097   0.073  -4.856
  421   HD12  ILE  54          HD12      ILE  54  12.780  -0.643  -5.785
  422   HD13  ILE  54          HD13      ILE  54  13.883  -1.677  -4.877
  423    H    CYS  55           H        CYS  55  10.808   1.261  -0.198
  424    HA   CYS  55           HA       CYS  55   9.507   3.820  -0.465
  425    HB2  CYS  55           HB2      CYS  55   9.834   4.114   1.886
  426    HB3  CYS  55           HB3      CYS  55   9.356   2.440   1.636
  427    H    GLU  56           H        GLU  56  10.703   5.799   0.414
  428    HA   GLU  56           HA       GLU  56  12.747   6.428  -1.360
  429    HB2  GLU  56           HB2      GLU  56  12.118   7.720   1.301
  430    HB3  GLU  56           HB3      GLU  56  13.071   8.440   0.017
  431    HG2  GLU  56           HG2      GLU  56  10.983   9.431  -0.187
  432    HG3  GLU  56           HG3      GLU  56  11.002   8.198  -1.439
  433    H    ASP  57           H        ASP  57  12.943   5.502   2.060
  434    HA   ASP  57           HA       ASP  57  15.722   5.754   2.347
  435    HB2  ASP  57           HB2      ASP  57  14.308   5.544   4.292
  436    HB3  ASP  57           HB3      ASP  57  13.771   3.946   3.781
  437    H    CYS  58           H        CYS  58  13.739   2.991   1.336
  438    HA   CYS  58           HA       CYS  58  15.822   1.127   1.103
  439    HB2  CYS  58           HB2      CYS  58  13.105   1.381  -0.101
  440    HB3  CYS  58           HB3      CYS  58  14.223   0.213  -0.796
  441    H    GLN  59           H        GLN  59  14.338   3.167  -1.415
  442    HA   GLN  59           HA       GLN  59  16.014   2.606  -3.534
  443    HB2  GLN  59           HB2      GLN  59  13.925   4.259  -3.177
  444    HB3  GLN  59           HB3      GLN  59  15.216   5.449  -3.147
  445    HG2  GLN  59           HG2      GLN  59  14.721   3.488  -5.379
  446    HG3  GLN  59           HG3      GLN  59  14.200   5.167  -5.365
  447   HE21  GLN  59          HE21      GLN  59  15.720   6.799  -5.530
  448   HE22  GLN  59          HE22      GLN  59  17.307   6.506  -6.150
  449    H    GLU  60           H        GLU  60  16.525   4.800  -0.844
  450    HA   GLU  60           HA       GLU  60  18.754   6.190  -1.725
  451    HB2  GLU  60           HB2      GLU  60  17.456   6.656   0.292
  452    HB3  GLU  60           HB3      GLU  60  18.078   5.239   1.057
  453    HG2  GLU  60           HG2      GLU  60  19.239   7.062   1.966
  454    HG3  GLU  60           HG3      GLU  60  20.324   6.247   0.862
  455    H    ALA  61           H        ALA  61  18.628   3.365   0.342
  456    HA   ALA  61           HA       ALA  61  21.421   2.891   0.376
  457    HB1  ALA  61           HB1      ALA  61  20.808   0.764   1.420
  458    HB2  ALA  61           HB2      ALA  61  19.122   1.022   0.976
  459    HB3  ALA  61           HB3      ALA  61  19.901   2.096   2.136
  460    H    LEU  62           H        LEU  62  18.806   2.223  -1.695
  461    HA   LEU  62           HA       LEU  62  19.777  -0.155  -2.898
  462    HB2  LEU  62           HB2      LEU  62  17.404   1.034  -2.742
  463    HB3  LEU  62           HB3      LEU  62  17.905   1.665  -4.301
  464    HG   LEU  62           HG       LEU  62  18.494  -1.026  -4.367
  465   HD11  LEU  62          HD11      LEU  62  17.137  -1.397  -2.397
  466   HD12  LEU  62          HD12      LEU  62  16.404  -2.148  -3.815
  467   HD13  LEU  62          HD13      LEU  62  15.763  -0.628  -3.190
  468   HD21  LEU  62          HD21      LEU  62  16.623  -1.140  -6.004
  469   HD22  LEU  62          HD22      LEU  62  17.734   0.202  -6.280
  470   HD23  LEU  62          HD23      LEU  62  16.171   0.492  -5.516
  471    H    ASP  63           H        ASP  63  19.453   3.168  -4.136
  472    HA   ASP  63           HA       ASP  63  21.010   2.610  -6.466
  473    HB2  ASP  63           HB2      ASP  63  19.208   4.285  -6.444
  474    HB3  ASP  63           HB3      ASP  63  20.128   5.273  -5.319
  475    H    ARG  64           H        ARG  64  21.680   3.757  -3.276
  476    HA   ARG  64           HA       ARG  64  23.609   3.895  -2.107
  477    HB2  ARG  64           HB2      ARG  64  24.865   2.821  -4.629
  478    HB3  ARG  64           HB3      ARG  64  25.721   3.039  -3.108
  479    HG2  ARG  64           HG2      ARG  64  24.224   1.467  -2.018
  480    HG3  ARG  64           HG3      ARG  64  23.319   1.274  -3.519
  481    HD2  ARG  64           HD2      ARG  64  25.272   0.329  -4.603
  482    HD3  ARG  64           HD3      ARG  64  26.230   0.589  -3.146
  483    HE   ARG  64           HE       ARG  64  24.013  -0.952  -2.445
  484   HH11  ARG  64          HH11      ARG  64  26.886  -1.228  -4.411
  485   HH12  ARG  64          HH12      ARG  64  27.021  -2.943  -4.206
  486   HH21  ARG  64          HH21      ARG  64  24.184  -3.203  -2.160
  487   HH22  ARG  64          HH22      ARG  64  25.481  -4.071  -2.917
  488    H    ASN  65           H        ASN  65  22.862   5.815  -4.614
  489    HA   ASN  65           HA       ASN  65  25.153   7.590  -4.275
  490    HB2  ASN  65           HB2      ASN  65  22.724   7.653  -6.058
  491    HB3  ASN  65           HB3      ASN  65  23.743   9.072  -5.846
  492   HD21  ASN  65          HD21      ASN  65  23.184   7.386  -8.188
  493   HD22  ASN  65          HD22      ASN  65  24.735   6.890  -8.771
  494    HA   PRO  66           HA       PRO  66  23.272   9.298  -0.617
  495    HB2  PRO  66           HB2      PRO  66  24.933  11.621  -1.493
  496    HB3  PRO  66           HB3      PRO  66  24.797  10.874   0.104
  497    HG2  PRO  66           HG2      PRO  66  26.912  10.397  -1.435
  498    HG3  PRO  66           HG3      PRO  66  26.191   9.107  -0.457
  499    HD2  PRO  66           HD2      PRO  66  26.039   9.568  -3.393
  500    HD3  PRO  66           HD3      PRO  66  26.035   8.045  -2.484
  501    H    HIS  67           H        HIS  67  21.497  10.443  -0.273
  502    HA   HIS  67           HA       HIS  67  19.702  11.776  -0.572
  503    HB2  HIS  67           HB2      HIS  67  21.538  13.204  -2.490
  504    HB3  HIS  67           HB3      HIS  67  19.868  13.700  -2.242
  505    HD1  HIS  67           HD1      HIS  67  19.596  15.462  -0.539
  506    HD2  HIS  67           HD2      HIS  67  22.970  13.139   0.166
  507    HE1  HIS  67           HE1      HIS  67  20.716  16.483   1.467
  508    HE2  HIS  67           HE2      HIS  67  22.650  14.958   1.975
  509    H    TYR  68           H        TYR  68  18.727   9.866  -1.277
  510    HA   TYR  68           HA       TYR  68  18.441   8.897  -3.829
  511    HB2  TYR  68           HB2      TYR  68  16.290   7.975  -3.085
  512    HB3  TYR  68           HB3      TYR  68  17.489   7.843  -1.810
  513    HD1  TYR  68           HD1      TYR  68  17.100   8.780   0.320
  514    HD2  TYR  68           HD2      TYR  68  14.583   9.880  -2.925
  515    HE1  TYR  68           HE1      TYR  68  15.603   9.943   1.884
  516    HE2  TYR  68           HE2      TYR  68  13.081  11.050  -1.372
  517    HH   TYR  68           HH       TYR  68  12.497  11.072   0.967
  518    H    HIS  69           H        HIS  69  16.560   9.088  -5.312
  519    HA   HIS  69           HA       HIS  69  15.197  10.255  -6.707
  520    HB2  HIS  69           HB2      HIS  69  13.965  10.773  -4.595
  521    HB3  HIS  69           HB3      HIS  69  14.934  12.226  -4.419
  522    HD1  HIS  69           HD1      HIS  69  12.099  10.779  -6.379
  523    HD2  HIS  69           HD2      HIS  69  14.157  14.371  -6.024
  524    HE1  HIS  69           HE1      HIS  69  10.689  12.487  -7.564
  525    HE2  HIS  69           HE2      HIS  69  11.864  14.677  -7.173
  526    H    GLU  70           H        GLU  70  17.421  10.481  -7.658
  527    HA   GLU  70           HA       GLU  70  18.848  11.654  -8.955
  528    HB2  GLU  70           HB2      GLU  70  16.988  13.948  -8.337
  529    HB3  GLU  70           HB3      GLU  70  18.343  14.061  -9.453
  530    HG2  GLU  70           HG2      GLU  70  17.350  12.320 -10.841
  531    HG3  GLU  70           HG3      GLU  70  15.998  12.195  -9.718
  532    H    TYR  71           H        TYR  71  20.818  11.818  -8.215
  533    HA   TYR  71           HA       TYR  71  21.431  12.988  -5.676
  534    HB2  TYR  71           HB2      TYR  71  22.626  11.011  -6.691
  535    HB3  TYR  71           HB3      TYR  71  23.360  12.119  -7.841
  536    HD1  TYR  71           HD1      TYR  71  25.306  10.700  -6.584
  537    HD2  TYR  71           HD2      TYR  71  23.129  13.944  -4.905
  538    HE1  TYR  71           HE1      TYR  71  27.137  11.100  -4.993
  539    HE2  TYR  71           HE2      TYR  71  24.952  14.351  -3.312
  540    HH   TYR  71           HH       TYR  71  28.018  12.968  -3.636
  541    H    HIS  72           H        HIS  72  20.933  15.141  -5.737
  542    HA   HIS  72           HA       HIS  72  21.649  16.935  -7.786
  543    HB2  HIS  72           HB2      HIS  72  19.909  17.328  -6.003
  544    HB3  HIS  72           HB3      HIS  72  21.224  17.610  -4.870
  545    HD1  HIS  72           HD1      HIS  72  19.382  19.182  -7.703
  546    HD2  HIS  72           HD2      HIS  72  22.591  20.053  -5.209
  547    HE1  HIS  72           HE1      HIS  72  19.849  21.629  -8.031
  548    HE2  HIS  72           HE2      HIS  72  21.914  22.079  -6.666
  549    H    THR  73           H        THR  73  23.739  16.979  -8.390
  550    HA   THR  73           HA       THR  73  25.782  17.319  -6.307
  551    HB   THR  73           HB       THR  73  26.184  16.583  -9.213
  552    HG1  THR  73           HG1      THR  73  25.011  14.991  -7.924
  553   HG21  THR  73          HG21      THR  73  28.040  16.450  -6.831
  554   HG22  THR  73          HG22      THR  73  28.149  17.598  -8.166
  555   HG23  THR  73          HG23      THR  73  28.413  15.878  -8.457
  Start of MODEL   19
    1    H1   GLN  -1           H1       GLN  -1   1.333   7.500  -8.232
    2    H2   GLN  -1           H2       GLN  -1   2.752   6.970  -7.482
    3    H3   GLN  -1           H3       GLN  -1   2.808   7.595  -9.045
    4    HA   GLN  -1           HA       GLN  -1   3.618   9.168  -7.373
    5    HB2  GLN  -1           HB2      GLN  -1   1.095   9.926  -8.853
    6    HB3  GLN  -1           HB3      GLN  -1   2.217  11.077  -8.145
    7    HG2  GLN  -1           HG2      GLN  -1   3.983  10.277  -9.619
    8    HG3  GLN  -1           HG3      GLN  -1   2.871   9.106 -10.321
    9   HE21  GLN  -1          HE21      GLN  -1   4.350  11.309 -11.555
   10   HE22  GLN  -1          HE22      GLN  -1   3.159  12.304 -12.322
   11    H    SER   0           H        SER   0   2.701   7.634  -5.480
   12    HA   SER   0           HA       SER   0   1.870   7.606  -3.382
   13    HB2  SER   0           HB2      SER   0   1.129  10.501  -3.843
   14    HB3  SER   0           HB3      SER   0   1.283   9.690  -2.284
   15    HG   SER   0           HG       SER   0   3.534   9.300  -3.658
   16    H    MET   1           H        MET   1  -0.366   9.539  -5.377
   17    HA   MET   1           HA       MET   1  -2.645   8.294  -4.073
   18    HB2  MET   1           HB2      MET   1  -4.002   9.861  -5.355
   19    HB3  MET   1           HB3      MET   1  -2.696  10.708  -4.541
   20    HG2  MET   1           HG2      MET   1  -1.432  10.751  -6.640
   21    HG3  MET   1           HG3      MET   1  -2.769   9.936  -7.446
   22    HE1  MET   1           HE1      MET   1  -1.549  13.198  -5.669
   23    HE2  MET   1           HE2      MET   1  -2.944  12.762  -4.683
   24    HE3  MET   1           HE3      MET   1  -2.998  14.202  -5.697
   25    H    ALA   2           H        ALA   2  -4.512   7.812  -5.729
   26    HA   ALA   2           HA       ALA   2  -5.387   6.570  -7.401
   27    HB1  ALA   2           HB1      ALA   2  -2.637   6.437  -8.606
   28    HB2  ALA   2           HB2      ALA   2  -3.849   7.668  -8.960
   29    HB3  ALA   2           HB3      ALA   2  -4.148   5.983  -9.392
   30    H    LEU   3           H        LEU   3  -2.227   5.321  -6.493
   31    HA   LEU   3           HA       LEU   3  -3.529   2.733  -5.930
   32    HB2  LEU   3           HB2      LEU   3  -0.740   3.264  -6.933
   33    HB3  LEU   3           HB3      LEU   3  -1.219   1.741  -6.257
   34    HG   LEU   3           HG       LEU   3  -2.986   1.643  -8.084
   35   HD11  LEU   3          HD11      LEU   3  -1.208   3.771  -9.216
   36   HD12  LEU   3          HD12      LEU   3  -2.865   3.997  -8.666
   37   HD13  LEU   3          HD13      LEU   3  -2.530   2.965 -10.059
   38   HD21  LEU   3          HD21      LEU   3  -1.014   0.235  -8.109
   39   HD22  LEU   3          HD22      LEU   3  -0.058   1.548  -8.795
   40   HD23  LEU   3          HD23      LEU   3  -1.358   0.821  -9.737
   41    H    HIS   4           H        HIS   4  -2.721   1.570  -4.078
   42    HA   HIS   4           HA       HIS   4  -1.659   3.396  -2.062
   43    HB2  HIS   4           HB2      HIS   4  -2.800   0.613  -1.795
   44    HB3  HIS   4           HB3      HIS   4  -2.170   1.548  -0.454
   45    HD1  HIS   4           HD1      HIS   4  -5.266   0.672  -1.879
   46    HD2  HIS   4           HD2      HIS   4  -3.683   4.224  -0.401
   47    HE1  HIS   4           HE1      HIS   4  -7.246   2.131  -1.358
   48    HE2  HIS   4           HE2      HIS   4  -6.250   4.351  -0.704
   49    H    TYR   5           H        TYR   5   0.354   3.361  -1.557
   50    HA   TYR   5           HA       TYR   5   2.071   1.329  -2.769
   51    HB2  TYR   5           HB2      TYR   5   2.582   4.143  -1.823
   52    HB3  TYR   5           HB3      TYR   5   3.895   3.018  -2.180
   53    HD1  TYR   5           HD1      TYR   5   4.032   5.401  -3.564
   54    HD2  TYR   5           HD2      TYR   5   1.605   2.051  -4.481
   55    HE1  TYR   5           HE1      TYR   5   4.017   6.064  -5.909
   56    HE2  TYR   5           HE2      TYR   5   1.573   2.687  -6.845
   57    HH   TYR   5           HH       TYR   5   1.987   4.473  -8.277
   58    H    TYR   6           H        TYR   6   3.123  -0.084  -1.577
   59    HA   TYR   6           HA       TYR   6   3.546   0.565   1.248
   60    HB2  TYR   6           HB2      TYR   6   2.597  -2.038   0.069
   61    HB3  TYR   6           HB3      TYR   6   3.258  -1.908   1.699
   62    HD1  TYR   6           HD1      TYR   6   0.324  -1.521  -0.339
   63    HD2  TYR   6           HD2      TYR   6   2.173  -0.246   3.299
   64    HE1  TYR   6           HE1      TYR   6  -1.862  -0.800   0.512
   65    HE2  TYR   6           HE2      TYR   6  -0.030   0.471   4.148
   66    HH   TYR   6           HH       TYR   6  -2.201   1.165   3.260
   67    H    CYS   7           H        CYS   7   5.457   0.220   2.038
   68    HA   CYS   7           HA       CYS   7   7.621  -0.058   0.206
   69    HB2  CYS   7           HB2      CYS   7   8.088   1.532   1.809
   70    HB3  CYS   7           HB3      CYS   7   7.184   0.673   3.020
   71    H    ARG   8           H        ARG   8   8.299  -1.957  -0.447
   72    HA   ARG   8           HA       ARG   8   8.340  -4.274   1.149
   73    HB2  ARG   8           HB2      ARG   8   9.808  -5.210  -0.485
   74    HB3  ARG   8           HB3      ARG   8   8.640  -4.217  -1.340
   75    HG2  ARG   8           HG2      ARG   8  10.284  -2.445  -1.571
   76    HG3  ARG   8           HG3      ARG   8  11.460  -3.408  -0.668
   77    HD2  ARG   8           HD2      ARG   8  11.122  -5.196  -2.439
   78    HD3  ARG   8           HD3      ARG   8  10.272  -3.964  -3.370
   79    HE   ARG   8           HE       ARG   8  12.824  -3.047  -2.516
   80   HH11  ARG   8          HH11      ARG   8  11.223  -5.056  -4.886
   81   HH12  ARG   8          HH12      ARG   8  12.502  -4.932  -6.049
   82   HH21  ARG   8          HH21      ARG   8  14.525  -2.896  -4.029
   83   HH22  ARG   8          HH22      ARG   8  14.393  -3.696  -5.563
   84    H    HIS   9           H        HIS   9   9.564  -4.731   2.803
   85    HA   HIS   9           HA       HIS   9  11.563  -5.256   3.827
   86    HB2  HIS   9           HB2      HIS   9  12.819  -4.596   1.797
   87    HB3  HIS   9           HB3      HIS   9  12.813  -2.932   2.365
   88    HD1  HIS   9           HD1      HIS   9  14.736  -2.256   3.809
   89    HD2  HIS   9           HD2      HIS   9  14.289  -6.387   3.607
   90    HE1  HIS   9           HE1      HIS   9  16.735  -3.211   4.989
   91    HE2  HIS   9           HE2      HIS   9  16.505  -5.707   4.760
   92    H    CYS  10           H        CYS  10  11.082  -1.669   3.593
   93    HA   CYS  10           HA       CYS  10  12.124  -1.490   6.305
   94    HB2  CYS  10           HB2      CYS  10  10.982   0.945   5.055
   95    HB3  CYS  10           HB3      CYS  10  12.455   0.746   5.984
   96    H    GLY  11           H        GLY  11   9.039  -1.461   4.698
   97    HA2  GLY  11           HA2      GLY  11   7.009  -1.969   5.706
   98    HA3  GLY  11           HA3      GLY  11   7.770  -1.757   7.286
   99    H    VAL  12           H        VAL  12   7.866   0.686   4.764
  100    HA   VAL  12           HA       VAL  12   6.106   2.319   6.385
  101    HB   VAL  12           HB       VAL  12   8.148   3.434   6.217
  102   HG11  VAL  12          HG11      VAL  12   9.250   3.936   4.075
  103   HG12  VAL  12          HG12      VAL  12   8.038   2.954   3.249
  104   HG13  VAL  12          HG13      VAL  12   9.151   2.205   4.396
  105   HG21  VAL  12          HG21      VAL  12   6.251   4.586   4.202
  106   HG22  VAL  12          HG22      VAL  12   7.616   5.451   4.905
  107   HG23  VAL  12          HG23      VAL  12   6.291   4.911   5.933
  108    H    LYS  13           H        LYS  13   4.352   3.326   5.610
  109    HA   LYS  13           HA       LYS  13   3.290   2.195   3.142
  110    HB2  LYS  13           HB2      LYS  13   1.905   4.021   5.105
  111    HB3  LYS  13           HB3      LYS  13   1.155   3.011   3.880
  112    HG2  LYS  13           HG2      LYS  13   1.823   1.013   5.064
  113    HG3  LYS  13           HG3      LYS  13   2.683   1.981   6.261
  114    HD2  LYS  13           HD2      LYS  13  -0.275   2.210   5.729
  115    HD3  LYS  13           HD3      LYS  13   0.418   1.177   6.979
  116    HE2  LYS  13           HE2      LYS  13   0.872   4.154   6.804
  117    HE3  LYS  13           HE3      LYS  13  -0.381   3.403   7.790
  118    HZ1  LYS  13           HZ1      LYS  13   1.326   2.230   9.019
  119    HZ2  LYS  13           HZ2      LYS  13   1.605   3.897   9.077
  120    HZ3  LYS  13           HZ3      LYS  13   2.537   2.921   8.060
  121    H    VAL  14           H        VAL  14   4.270   3.293   1.479
  122    HA   VAL  14           HA       VAL  14   4.700   6.114   1.517
  123    HB   VAL  14           HB       VAL  14   4.722   5.310  -1.189
  124   HG11  VAL  14          HG11      VAL  14   6.974   5.696   0.774
  125   HG12  VAL  14          HG12      VAL  14   6.194   6.948  -0.193
  126   HG13  VAL  14          HG13      VAL  14   7.136   5.684  -0.982
  127   HG21  VAL  14          HG21      VAL  14   4.718   2.965  -0.386
  128   HG22  VAL  14          HG22      VAL  14   6.205   3.302   0.504
  129   HG23  VAL  14          HG23      VAL  14   6.183   3.410  -1.258
  130    H    GLY  15           H        GLY  15   2.050   4.116   0.620
  131    HA2  GLY  15           HA2      GLY  15   0.666   6.519  -0.386
  132    HA3  GLY  15           HA3      GLY  15   0.482   4.967  -1.188
  133    H    SER  16           H        SER  16   0.448   6.020   2.200
  134    HA   SER  16           HA       SER  16  -2.387   5.422   2.380
  135    HB2  SER  16           HB2      SER  16  -0.413   4.131   4.280
  136    HB3  SER  16           HB3      SER  16  -2.169   3.977   4.325
  137    HG   SER  16           HG       SER  16  -1.428   3.315   1.895
  138    H    LEU  17           H        LEU  17  -1.775   7.832   2.339
  139    HA   LEU  17           HA       LEU  17  -1.291   8.778   5.075
  140    HB2  LEU  17           HB2      LEU  17  -0.501  10.894   4.082
  141    HB3  LEU  17           HB3      LEU  17   0.500   9.526   3.644
  142    HG   LEU  17           HG       LEU  17  -1.650  10.454   1.766
  143   HD11  LEU  17          HD11      LEU  17   1.124  11.617   1.985
  144   HD12  LEU  17          HD12      LEU  17  -0.379  12.457   2.365
  145   HD13  LEU  17          HD13      LEU  17  -0.044  11.954   0.708
  146   HD21  LEU  17          HD21      LEU  17  -0.460   8.338   1.331
  147   HD22  LEU  17          HD22      LEU  17   1.068   9.217   1.328
  148   HD23  LEU  17          HD23      LEU  17  -0.144   9.551   0.092
  149    H    GLU  18           H        GLU  18  -3.335   8.675   2.387
  150    HA   GLU  18           HA       GLU  18  -5.320  10.215   3.878
  151    HB2  GLU  18           HB2      GLU  18  -6.316  10.811   1.629
  152    HB3  GLU  18           HB3      GLU  18  -4.809  11.616   2.032
  153    HG2  GLU  18           HG2      GLU  18  -3.579  10.157   0.584
  154    HG3  GLU  18           HG3      GLU  18  -5.012   9.172   0.289
  155    H    SER  19           H        SER  19  -5.020   7.599   4.322
  156    HA   SER  19           HA       SER  19  -7.012   6.199   2.683
  157    HB2  SER  19           HB2      SER  19  -4.959   5.196   4.656
  158    HB3  SER  19           HB3      SER  19  -6.152   4.189   3.852
  159    HG   SER  19           HG       SER  19  -5.171   5.285   1.858
  160    H    SER  20           H        SER  20  -7.318   8.164   4.981
  161    HA   SER  20           HA       SER  20  -8.540   6.702   7.097
  162    HB2  SER  20           HB2      SER  20  -8.672   9.649   6.438
  163    HB3  SER  20           HB3      SER  20  -9.231   8.916   7.943
  164    HG   SER  20           HG       SER  20  -6.660   8.229   7.261
  165    H    MET  21           H        MET  21  -9.723   8.318   4.206
  166    HA   MET  21           HA       MET  21 -12.480   7.676   4.965
  167    HB2  MET  21           HB2      MET  21 -11.480   9.312   2.629
  168    HB3  MET  21           HB3      MET  21 -13.145   9.179   3.176
  169    HG2  MET  21           HG2      MET  21 -10.885  10.379   4.754
  170    HG3  MET  21           HG3      MET  21 -12.093  11.280   3.847
  171    HE1  MET  21           HE1      MET  21 -11.417  11.701   7.001
  172    HE2  MET  21           HE2      MET  21 -13.062  11.979   7.577
  173    HE3  MET  21           HE3      MET  21 -12.533  12.675   6.046
  174    H    VAL  22           H        VAL  22  -9.956   6.335   3.279
  175    HA   VAL  22           HA       VAL  22 -11.774   4.625   1.774
  176    HB   VAL  22           HB       VAL  22 -11.123   6.296   0.141
  177   HG11  VAL  22          HG11      VAL  22  -8.275   5.556   0.804
  178   HG12  VAL  22          HG12      VAL  22  -9.068   7.095   1.146
  179   HG13  VAL  22          HG13      VAL  22  -8.779   6.603  -0.522
  180   HG21  VAL  22          HG21      VAL  22  -9.675   3.689  -0.308
  181   HG22  VAL  22          HG22      VAL  22 -10.131   4.842  -1.559
  182   HG23  VAL  22          HG23      VAL  22 -11.378   4.005  -0.638
  183    H    SER  23           H        SER  23 -11.242   2.557   1.940
  184    HA   SER  23           HA       SER  23  -8.499   1.781   2.525
  185    HB2  SER  23           HB2      SER  23  -9.211   0.414   4.457
  186    HB3  SER  23           HB3      SER  23  -9.521   2.127   4.730
  187    HG   SER  23           HG       SER  23 -11.367   1.100   5.317
  188    H    THR  24           H        THR  24  -9.092  -0.922   3.136
  189    HA   THR  24           HA       THR  24  -9.745  -1.871   0.511
  190    HB   THR  24           HB       THR  24  -9.235  -3.551   2.963
  191    HG1  THR  24           HG1      THR  24  -7.028  -3.403   1.590
  192   HG21  THR  24          HG21      THR  24 -10.086  -4.743   0.987
  193   HG22  THR  24          HG22      THR  24  -8.413  -5.182   1.327
  194   HG23  THR  24          HG23      THR  24  -8.781  -4.063   0.016
  195    H    ASP  25           H        ASP  25 -11.315  -1.625   3.594
  196    HA   ASP  25           HA       ASP  25 -13.463  -3.437   2.784
  197    HB2  ASP  25           HB2      ASP  25 -12.547  -3.507   5.120
  198    HB3  ASP  25           HB3      ASP  25 -13.175  -1.881   5.368
  199    H    SER  26           H        SER  26 -12.795  -0.087   3.464
  200    HA   SER  26           HA       SER  26 -15.401   0.928   3.109
  201    HB2  SER  26           HB2      SER  26 -13.504   2.151   4.172
  202    HB3  SER  26           HB3      SER  26 -12.750   2.286   2.587
  203    HG   SER  26           HG       SER  26 -14.083   4.129   3.351
  204    H    LEU  27           H        LEU  27 -16.509   1.430   1.296
  205    HA   LEU  27           HA       LEU  27 -15.441   0.469  -1.211
  206    HB2  LEU  27           HB2      LEU  27 -18.138   1.547  -0.429
  207    HB3  LEU  27           HB3      LEU  27 -17.724   1.118  -2.078
  208    HG   LEU  27           HG       LEU  27 -17.126  -1.200  -1.041
  209   HD11  LEU  27          HD11      LEU  27 -17.342  -0.565   1.289
  210   HD12  LEU  27          HD12      LEU  27 -18.536  -1.792   0.867
  211   HD13  LEU  27          HD13      LEU  27 -19.026  -0.105   1.028
  212   HD21  LEU  27          HD21      LEU  27 -19.986  -0.311  -1.325
  213   HD22  LEU  27          HD22      LEU  27 -19.370  -1.957  -1.485
  214   HD23  LEU  27          HD23      LEU  27 -18.906  -0.723  -2.655
  215    H    GLY  28           H        GLY  28 -14.524   1.700  -2.708
  216    HA2  GLY  28           HA2      GLY  28 -14.405   4.563  -2.376
  217    HA3  GLY  28           HA3      GLY  28 -13.612   3.618  -3.632
  218    H    PHE  29           H        PHE  29 -16.672   5.018  -2.626
  219    HA   PHE  29           HA       PHE  29 -17.439   5.170  -5.455
  220    HB2  PHE  29           HB2      PHE  29 -19.791   4.924  -4.795
  221    HB3  PHE  29           HB3      PHE  29 -18.855   3.531  -4.290
  222    HD1  PHE  29           HD1      PHE  29 -20.944   6.272  -3.231
  223    HD2  PHE  29           HD2      PHE  29 -18.267   3.255  -1.881
  224    HE1  PHE  29           HE1      PHE  29 -21.823   6.521  -0.952
  225    HE2  PHE  29           HE2      PHE  29 -19.137   3.505   0.406
  226    HZ   PHE  29           HZ       PHE  29 -20.919   5.138   0.874
  227    H    GLN  30           H        GLN  30 -19.715   6.851  -4.979
  228    HA   GLN  30           HA       GLN  30 -18.407   9.206  -3.802
  229    HB2  GLN  30           HB2      GLN  30 -19.547  10.629  -5.471
  230    HB3  GLN  30           HB3      GLN  30 -18.399   9.522  -6.194
  231    HG2  GLN  30           HG2      GLN  30 -21.375   9.074  -6.131
  232    HG3  GLN  30           HG3      GLN  30 -20.510   9.826  -7.463
  233   HE21  GLN  30          HE21      GLN  30 -18.208   8.136  -7.310
  234   HE22  GLN  30          HE22      GLN  30 -18.676   6.567  -7.888
  235    H    HIS  31           H        HIS  31 -21.554   7.872  -4.728
  236    HA   HIS  31           HA       HIS  31 -22.760   8.112  -2.236
  237    HB2  HIS  31           HB2      HIS  31 -22.573  10.582  -2.722
  238    HB3  HIS  31           HB3      HIS  31 -23.605  10.329  -4.124
  239    HD1  HIS  31           HD1      HIS  31 -23.690  10.673  -0.431
  240    HD2  HIS  31           HD2      HIS  31 -26.320   9.741  -3.513
  241    HE1  HIS  31           HE1      HIS  31 -25.991  10.823   0.572
  242    HE2  HIS  31           HE2      HIS  31 -27.567  10.401  -1.348
  243    H    LEU  32           H        LEU  32 -23.806   6.234  -2.626
  244    HA   LEU  32           HA       LEU  32 -25.792   6.133  -4.704
  245    HB2  LEU  32           HB2      LEU  32 -24.728   3.971  -5.609
  246    HB3  LEU  32           HB3      LEU  32 -24.134   5.503  -6.181
  247    HG   LEU  32           HG       LEU  32 -22.264   5.249  -4.472
  248   HD11  LEU  32          HD11      LEU  32 -21.761   2.979  -3.725
  249   HD12  LEU  32          HD12      LEU  32 -23.279   2.411  -4.420
  250   HD13  LEU  32          HD13      LEU  32 -23.296   3.544  -3.069
  251   HD21  LEU  32          HD21      LEU  32 -22.509   3.277  -6.735
  252   HD22  LEU  32          HD22      LEU  32 -21.006   3.697  -5.918
  253   HD23  LEU  32          HD23      LEU  32 -21.884   4.924  -6.830
  254    H    THR  33           H        THR  33 -26.929   4.019  -4.732
  255    HA   THR  33           HA       THR  33 -26.952   2.806  -2.070
  256    HB   THR  33           HB       THR  33 -29.135   1.753  -3.071
  257    HG1  THR  33           HG1      THR  33 -30.105   3.060  -4.640
  258   HG21  THR  33          HG21      THR  33 -30.431   3.710  -2.293
  259   HG22  THR  33          HG22      THR  33 -28.934   4.641  -2.226
  260   HG23  THR  33          HG23      THR  33 -29.150   3.240  -1.175
  261    H    ASN  34           H        ASN  34 -27.786   0.398  -2.260
  262    HA   ASN  34           HA       ASN  34 -25.744  -1.104  -3.496
  263    HB2  ASN  34           HB2      ASN  34 -28.440  -2.031  -2.482
  264    HB3  ASN  34           HB3      ASN  34 -27.069  -3.074  -2.842
  265   HD21  ASN  34          HD21      ASN  34 -28.580  -2.472  -0.339
  266   HD22  ASN  34          HD22      ASN  34 -27.380  -1.985   0.808
  267    H    GLU  35           H        GLU  35 -28.800   0.050  -4.564
  268    HA   GLU  35           HA       GLU  35 -29.329  -1.479  -6.815
  269    HB2  GLU  35           HB2      GLU  35 -29.496   1.530  -6.780
  270    HB3  GLU  35           HB3      GLU  35 -30.520   0.400  -7.651
  271    HG2  GLU  35           HG2      GLU  35 -31.468  -0.359  -5.562
  272    HG3  GLU  35           HG3      GLU  35 -30.431   0.742  -4.672
  273    H    GLU  36           H        GLU  36 -27.387   1.458  -6.540
  274    HA   GLU  36           HA       GLU  36 -26.468   1.404  -9.223
  275    HB2  GLU  36           HB2      GLU  36 -26.534   3.332  -7.418
  276    HB3  GLU  36           HB3      GLU  36 -24.904   2.766  -7.081
  277    HG2  GLU  36           HG2      GLU  36 -24.804   4.584  -8.636
  278    HG3  GLU  36           HG3      GLU  36 -24.328   3.095  -9.452
  279    H    ARG  37           H        ARG  37 -25.243   0.119  -6.215
  280    HA   ARG  37           HA       ARG  37 -22.612  -0.444  -6.916
  281    HB2  ARG  37           HB2      ARG  37 -24.502  -1.881  -5.064
  282    HB3  ARG  37           HB3      ARG  37 -22.819  -2.349  -5.245
  283    HG2  ARG  37           HG2      ARG  37 -22.135  -0.107  -4.514
  284    HG3  ARG  37           HG3      ARG  37 -23.834   0.319  -4.291
  285    HD2  ARG  37           HD2      ARG  37 -22.729  -0.334  -2.182
  286    HD3  ARG  37           HD3      ARG  37 -24.081  -1.386  -2.595
  287    HE   ARG  37           HE       ARG  37 -21.611  -2.424  -3.563
  288   HH11  ARG  37          HH11      ARG  37 -23.582  -2.122  -0.684
  289   HH12  ARG  37          HH12      ARG  37 -22.897  -3.521   0.083
  290   HH21  ARG  37          HH21      ARG  37 -20.715  -4.259  -2.562
  291   HH22  ARG  37          HH22      ARG  37 -21.267  -4.736  -0.989
  292    H    ASN  38           H        ASN  38 -25.481  -2.533  -7.280
  293    HA   ASN  38           HA       ASN  38 -23.935  -4.571  -8.595
  294    HB2  ASN  38           HB2      ASN  38 -26.916  -4.241  -8.225
  295    HB3  ASN  38           HB3      ASN  38 -26.177  -5.626  -9.021
  296   HD21  ASN  38          HD21      ASN  38 -24.958  -7.082  -7.803
  297   HD22  ASN  38          HD22      ASN  38 -25.099  -7.162  -6.081
  298    H    ASP  39           H        ASP  39 -26.045  -1.955  -9.594
  299    HA   ASP  39           HA       ASP  39 -26.382  -2.979 -12.251
  300    HB2  ASP  39           HB2      ASP  39 -28.121  -1.653 -11.124
  301    HB3  ASP  39           HB3      ASP  39 -27.055  -0.252 -11.150
  302    H    MET  40           H        MET  40 -24.767  -0.042 -11.000
  303    HA   MET  40           HA       MET  40 -23.598   0.326 -13.659
  304    HB2  MET  40           HB2      MET  40 -24.791   2.215 -12.577
  305    HB3  MET  40           HB3      MET  40 -23.596   2.201 -11.291
  306    HG2  MET  40           HG2      MET  40 -23.076   3.950 -12.842
  307    HG3  MET  40           HG3      MET  40 -21.845   2.693 -12.948
  308    HE1  MET  40           HE1      MET  40 -22.011   3.993 -16.628
  309    HE2  MET  40           HE2      MET  40 -20.965   3.640 -15.254
  310    HE3  MET  40           HE3      MET  40 -22.151   4.942 -15.149
  311    H    ILE  41           H        ILE  41 -22.677  -0.081 -10.290
  312    HA   ILE  41           HA       ILE  41 -19.892   0.364 -10.758
  313    HB   ILE  41           HB       ILE  41 -21.291  -0.895  -8.396
  314   HG12  ILE  41          HG12      ILE  41 -21.968   1.423  -8.753
  315   HG13  ILE  41          HG13      ILE  41 -20.939   1.307  -7.329
  316   HG21  ILE  41          HG21      ILE  41 -18.464   0.122  -8.617
  317   HG22  ILE  41          HG22      ILE  41 -18.948  -1.570  -8.514
  318   HG23  ILE  41          HG23      ILE  41 -19.239  -0.486  -7.153
  319   HD11  ILE  41          HD11      ILE  41 -20.118   2.281 -10.055
  320   HD12  ILE  41          HD12      ILE  41 -19.040   2.110  -8.670
  321   HD13  ILE  41          HD13      ILE  41 -20.373   3.263  -8.614
  322    H    SER  42           H        SER  42 -18.911  -0.992 -12.127
  323    HA   SER  42           HA       SER  42 -19.420  -3.812 -12.189
  324    HB2  SER  42           HB2      SER  42 -17.118  -2.246 -13.387
  325    HB3  SER  42           HB3      SER  42 -17.629  -3.873 -13.839
  326    HG   SER  42           HG       SER  42 -19.772  -2.653 -14.189
  327    H    TYR  43           H        TYR  43 -17.189  -1.658 -10.643
  328    HA   TYR  43           HA       TYR  43 -16.391  -3.668  -8.768
  329    HB2  TYR  43           HB2      TYR  43 -13.991  -3.563  -9.190
  330    HB3  TYR  43           HB3      TYR  43 -14.813  -4.119 -10.642
  331    HD1  TYR  43           HD1      TYR  43 -12.753  -1.524  -9.168
  332    HD2  TYR  43           HD2      TYR  43 -15.052  -2.584 -12.585
  333    HE1  TYR  43           HE1      TYR  43 -11.654   0.257 -10.451
  334    HE2  TYR  43           HE2      TYR  43 -13.956  -0.803 -13.878
  335    HH   TYR  43           HH       TYR  43 -12.806   1.343 -13.426
  336    H    LYS  44           H        LYS  44 -15.253  -2.725  -6.974
  337    HA   LYS  44           HA       LYS  44 -16.046  -0.193  -6.179
  338    HB2  LYS  44           HB2      LYS  44 -13.674  -1.864  -5.323
  339    HB3  LYS  44           HB3      LYS  44 -14.175  -0.395  -4.493
  340    HG2  LYS  44           HG2      LYS  44 -16.107  -1.349  -3.678
  341    HG3  LYS  44           HG3      LYS  44 -16.159  -2.576  -4.941
  342    HD2  LYS  44           HD2      LYS  44 -15.597  -3.611  -2.839
  343    HD3  LYS  44           HD3      LYS  44 -14.200  -3.672  -3.911
  344    HE2  LYS  44           HE2      LYS  44 -13.183  -1.813  -2.747
  345    HE3  LYS  44           HE3      LYS  44 -14.614  -1.629  -1.732
  346    HZ1  LYS  44           HZ1      LYS  44 -14.203  -3.816  -0.811
  347    HZ2  LYS  44           HZ2      LYS  44 -12.845  -2.832  -0.590
  348    HZ3  LYS  44           HZ3      LYS  44 -12.845  -4.014  -1.799
  349    H    GLU  45           H        GLU  45 -15.506   1.761  -6.893
  350    HA   GLU  45           HA       GLU  45 -13.861   2.049  -9.131
  351    HB2  GLU  45           HB2      GLU  45 -14.995   4.170  -7.317
  352    HB3  GLU  45           HB3      GLU  45 -14.281   4.467  -8.884
  353    HG2  GLU  45           HG2      GLU  45 -15.993   3.031  -9.908
  354    HG3  GLU  45           HG3      GLU  45 -16.735   2.892  -8.322
  355    H    ASN  46           H        ASN  46 -12.909   2.017  -5.876
  356    HA   ASN  46           HA       ASN  46 -10.623   3.686  -6.062
  357    HB2  ASN  46           HB2      ASN  46 -11.463   2.988  -3.886
  358    HB3  ASN  46           HB3      ASN  46 -11.180   1.297  -4.284
  359   HD21  ASN  46          HD21      ASN  46  -9.654   4.360  -3.558
  360   HD22  ASN  46          HD22      ASN  46  -8.124   3.705  -3.095
  361    H    GLY  47           H        GLY  47 -11.402   0.566  -7.263
  362    HA2  GLY  47           HA2      GLY  47 -10.266  -0.501  -9.000
  363    HA3  GLY  47           HA3      GLY  47  -8.851   0.504  -8.662
  364    H    ASP  48           H        ASP  48  -9.575  -0.468  -5.721
  365    HA   ASP  48           HA       ASP  48  -8.525  -1.839  -4.254
  366    HB2  ASP  48           HB2      ASP  48 -10.048  -3.511  -5.169
  367    HB3  ASP  48           HB3      ASP  48  -8.920  -3.856  -6.473
  368    H    VAL  49           H        VAL  49  -6.688  -0.495  -4.548
  369    HA   VAL  49           HA       VAL  49  -4.602  -1.527  -6.320
  370    HB   VAL  49           HB       VAL  49  -3.674   0.856  -5.978
  371   HG11  VAL  49          HG11      VAL  49  -5.076   1.686  -7.836
  372   HG12  VAL  49          HG12      VAL  49  -6.188   0.343  -7.569
  373   HG13  VAL  49          HG13      VAL  49  -4.535   0.027  -8.093
  374   HG21  VAL  49          HG21      VAL  49  -5.190   1.527  -4.160
  375   HG22  VAL  49          HG22      VAL  49  -6.576   1.301  -5.231
  376   HG23  VAL  49          HG23      VAL  49  -5.412   2.568  -5.566
  377    H    HIS  50           H        HIS  50  -3.300  -2.790  -5.190
  378    HA   HIS  50           HA       HIS  50  -2.137  -1.782  -2.690
  379    HB2  HIS  50           HB2      HIS  50  -3.926  -3.424  -2.155
  380    HB3  HIS  50           HB3      HIS  50  -3.116  -4.612  -3.163
  381    HD1  HIS  50           HD1      HIS  50  -3.106  -3.135   0.216
  382    HD2  HIS  50           HD2      HIS  50  -0.674  -5.624  -2.058
  383    HE1  HIS  50           HE1      HIS  50  -1.532  -4.220   1.848
  384    HE2  HIS  50           HE2      HIS  50  -0.155  -5.815   0.468
  385    H    VAL  51           H        VAL  51  -0.151  -1.327  -3.572
  386    HA   VAL  51           HA       VAL  51   1.220  -3.546  -4.953
  387    HB   VAL  51           HB       VAL  51   2.506  -1.805  -6.211
  388   HG11  VAL  51          HG11      VAL  51   0.603  -2.928  -7.251
  389   HG12  VAL  51          HG12      VAL  51   0.735  -1.253  -7.791
  390   HG13  VAL  51          HG13      VAL  51  -0.480  -1.700  -6.591
  391   HG21  VAL  51          HG21      VAL  51   1.632   0.451  -6.325
  392   HG22  VAL  51          HG22      VAL  51   2.172   0.046  -4.694
  393   HG23  VAL  51          HG23      VAL  51   0.448   0.059  -5.076
  394    H    LEU  52           H        LEU  52   3.308  -3.985  -4.387
  395    HA   LEU  52           HA       LEU  52   4.393  -2.467  -2.115
  396    HB2  LEU  52           HB2      LEU  52   5.452  -5.091  -3.180
  397    HB3  LEU  52           HB3      LEU  52   5.863  -4.316  -1.669
  398    HG   LEU  52           HG       LEU  52   4.500  -6.095  -1.045
  399   HD11  LEU  52          HD11      LEU  52   2.656  -3.726  -1.259
  400   HD12  LEU  52          HD12      LEU  52   3.820  -4.025   0.031
  401   HD13  LEU  52          HD13      LEU  52   2.444  -5.107  -0.182
  402   HD21  LEU  52          HD21      LEU  52   2.443  -6.747  -2.115
  403   HD22  LEU  52          HD22      LEU  52   3.725  -6.647  -3.322
  404   HD23  LEU  52          HD23      LEU  52   2.529  -5.358  -3.199
  405    H    THR  53           H        THR  53   6.071  -1.136  -2.452
  406    HA   THR  53           HA       THR  53   7.593  -1.407  -4.934
  407    HB   THR  53           HB       THR  53   5.594   0.036  -5.388
  408    HG1  THR  53           HG1      THR  53   7.739   0.289  -6.439
  409   HG21  THR  53          HG21      THR  53   5.376   1.109  -3.216
  410   HG22  THR  53          HG22      THR  53   5.580   2.322  -4.480
  411   HG23  THR  53          HG23      THR  53   6.935   1.904  -3.432
  412    H    ILE  54           H        ILE  54   9.139   0.652  -4.990
  413    HA   ILE  54           HA       ILE  54  10.764   0.373  -2.609
  414    HB   ILE  54           HB       ILE  54  11.197   1.325  -5.400
  415   HG12  ILE  54          HG12      ILE  54  12.959  -0.350  -3.629
  416   HG13  ILE  54          HG13      ILE  54  11.615  -1.016  -4.538
  417   HG21  ILE  54          HG21      ILE  54  13.386   2.252  -4.873
  418   HG22  ILE  54          HG22      ILE  54  13.062   2.053  -3.152
  419   HG23  ILE  54          HG23      ILE  54  12.095   3.178  -4.106
  420   HD11  ILE  54          HD11      ILE  54  13.970   0.424  -5.722
  421   HD12  ILE  54          HD12      ILE  54  12.642  -0.317  -6.616
  422   HD13  ILE  54          HD13      ILE  54  13.746  -1.324  -5.682
  423    H    CYS  55           H        CYS  55  10.434   1.695  -0.975
  424    HA   CYS  55           HA       CYS  55   9.306   4.319  -1.315
  425    HB2  CYS  55           HB2      CYS  55   9.233   4.444   1.033
  426    HB3  CYS  55           HB3      CYS  55   8.982   2.738   0.698
  427    H    GLU  56           H        GLU  56  10.625   6.109   0.105
  428    HA   GLU  56           HA       GLU  56  12.905   6.751  -1.369
  429    HB2  GLU  56           HB2      GLU  56  12.070   7.666   1.385
  430    HB3  GLU  56           HB3      GLU  56  13.335   8.414   0.424
  431    HG2  GLU  56           HG2      GLU  56  11.774   9.077  -1.253
  432    HG3  GLU  56           HG3      GLU  56  10.484   8.166  -0.474
  433    H    ASP  57           H        ASP  57  12.605   5.321   1.856
  434    HA   ASP  57           HA       ASP  57  15.365   5.063   2.367
  435    HB2  ASP  57           HB2      ASP  57  13.495   4.938   4.056
  436    HB3  ASP  57           HB3      ASP  57  13.163   3.311   3.470
  437    H    CYS  58           H        CYS  58  13.056   2.994   0.699
  438    HA   CYS  58           HA       CYS  58  14.640   0.664   0.475
  439    HB2  CYS  58           HB2      CYS  58  12.421   1.831  -1.176
  440    HB3  CYS  58           HB3      CYS  58  13.305   0.434  -1.767
  441    H    GLN  59           H        GLN  59  14.132   3.326  -1.815
  442    HA   GLN  59           HA       GLN  59  15.989   2.619  -3.745
  443    HB2  GLN  59           HB2      GLN  59  14.190   4.440  -3.767
  444    HB3  GLN  59           HB3      GLN  59  15.361   5.467  -2.976
  445    HG2  GLN  59           HG2      GLN  59  15.847   4.126  -5.625
  446    HG3  GLN  59           HG3      GLN  59  15.124   5.718  -5.474
  447   HE21  GLN  59          HE21      GLN  59  16.847   6.628  -3.322
  448   HE22  GLN  59          HE22      GLN  59  18.410   6.846  -3.999
  449    H    GLU  60           H        GLU  60  16.449   4.346  -0.710
  450    HA   GLU  60           HA       GLU  60  19.062   5.221  -1.178
  451    HB2  GLU  60           HB2      GLU  60  17.425   4.686   1.280
  452    HB3  GLU  60           HB3      GLU  60  19.034   5.307   1.334
  453    HG2  GLU  60           HG2      GLU  60  16.735   6.598   0.004
  454    HG3  GLU  60           HG3      GLU  60  17.419   7.080   1.544
  455    H    ALA  61           H        ALA  61  17.752   2.387   0.471
  456    HA   ALA  61           HA       ALA  61  20.215   1.257   1.258
  457    HB1  ALA  61           HB1      ALA  61  18.936  -0.808   1.563
  458    HB2  ALA  61           HB2      ALA  61  17.580  -0.103   0.681
  459    HB3  ALA  61           HB3      ALA  61  18.071   0.572   2.234
  460    H    LEU  62           H        LEU  62  18.369   1.374  -1.572
  461    HA   LEU  62           HA       LEU  62  19.420  -0.850  -2.948
  462    HB2  LEU  62           HB2      LEU  62  17.319   0.940  -3.154
  463    HB3  LEU  62           HB3      LEU  62  18.316   1.306  -4.551
  464    HG   LEU  62           HG       LEU  62  18.296  -1.271  -4.812
  465   HD11  LEU  62          HD11      LEU  62  16.171  -2.280  -4.158
  466   HD12  LEU  62          HD12      LEU  62  15.747  -0.796  -3.306
  467   HD13  LEU  62          HD13      LEU  62  17.120  -1.762  -2.766
  468   HD21  LEU  62          HD21      LEU  62  16.043   0.558  -5.581
  469   HD22  LEU  62          HD22      LEU  62  16.257  -1.058  -6.249
  470   HD23  LEU  62          HD23      LEU  62  17.483   0.178  -6.525
  471    H    ASP  63           H        ASP  63  19.747   2.643  -3.487
  472    HA   ASP  63           HA       ASP  63  21.686   2.310  -5.547
  473    HB2  ASP  63           HB2      ASP  63  20.069   4.213  -5.395
  474    HB3  ASP  63           HB3      ASP  63  20.999   4.835  -4.036
  475    H    ARG  64           H        ARG  64  21.867   3.271  -2.149
  476    HA   ARG  64           HA       ARG  64  24.795   3.258  -2.414
  477    HB2  ARG  64           HB2      ARG  64  23.070   4.787  -0.461
  478    HB3  ARG  64           HB3      ARG  64  24.828   4.739  -0.414
  479    HG2  ARG  64           HG2      ARG  64  24.852   5.683  -2.717
  480    HG3  ARG  64           HG3      ARG  64  23.104   5.868  -2.606
  481    HD2  ARG  64           HD2      ARG  64  25.043   7.100  -0.661
  482    HD3  ARG  64           HD3      ARG  64  24.447   7.927  -2.096
  483    HE   ARG  64           HE       ARG  64  22.237   7.033  -0.640
  484   HH11  ARG  64          HH11      ARG  64  24.899   9.268  -0.268
  485   HH12  ARG  64          HH12      ARG  64  23.992  10.395   0.690
  486   HH21  ARG  64          HH21      ARG  64  21.020   8.525   0.637
  487   HH22  ARG  64          HH22      ARG  64  21.809   9.962   1.221
  488    H    ASN  65           H        ASN  65  22.501   2.941   0.263
  489    HA   ASN  65           HA       ASN  65  21.991   1.067   1.510
  490    HB2  ASN  65           HB2      ASN  65  23.467  -0.363  -0.059
  491    HB3  ASN  65           HB3      ASN  65  24.691  -0.173   1.185
  492   HD21  ASN  65          HD21      ASN  65  22.684  -0.144   3.361
  493   HD22  ASN  65          HD22      ASN  65  22.156  -1.782   3.524
  494    HA   PRO  66           HA       PRO  66  25.260   1.957   4.889
  495    HB2  PRO  66           HB2      PRO  66  27.384   3.545   4.286
  496    HB3  PRO  66           HB3      PRO  66  27.442   1.781   4.187
  497    HG2  PRO  66           HG2      PRO  66  27.012   3.787   2.006
  498    HG3  PRO  66           HG3      PRO  66  28.048   2.346   2.014
  499    HD2  PRO  66           HD2      PRO  66  25.637   2.348   0.829
  500    HD3  PRO  66           HD3      PRO  66  26.272   0.915   1.658
  501    H    HIS  67           H        HIS  67  24.321   4.202   2.473
  502    HA   HIS  67           HA       HIS  67  23.841   6.240   4.541
  503    HB2  HIS  67           HB2      HIS  67  24.631   6.599   1.649
  504    HB3  HIS  67           HB3      HIS  67  23.926   7.897   2.604
  505    HD1  HIS  67           HD1      HIS  67  25.542   9.337   3.784
  506    HD2  HIS  67           HD2      HIS  67  27.148   5.606   2.898
  507    HE1  HIS  67           HE1      HIS  67  27.964   9.452   4.475
  508    HE2  HIS  67           HE2      HIS  67  28.945   7.236   3.782
  509    H    TYR  68           H        TYR  68  21.749   6.265   4.984
  510    HA   TYR  68           HA       TYR  68  19.859   6.442   2.788
  511    HB2  TYR  68           HB2      TYR  68  18.341   4.758   3.817
  512    HB3  TYR  68           HB3      TYR  68  19.832   4.075   3.189
  513    HD1  TYR  68           HD1      TYR  68  21.463   3.082   4.673
  514    HD2  TYR  68           HD2      TYR  68  17.920   4.850   6.225
  515    HE1  TYR  68           HE1      TYR  68  21.859   1.971   6.830
  516    HE2  TYR  68           HE2      TYR  68  18.312   3.749   8.388
  517    HH   TYR  68           HH       TYR  68  19.484   1.832   9.287
  518    H    HIS  69           H        HIS  69  20.780   7.127   6.017
  519    HA   HIS  69           HA       HIS  69  18.891   9.258   6.166
  520    HB2  HIS  69           HB2      HIS  69  17.562   7.182   6.862
  521    HB3  HIS  69           HB3      HIS  69  18.581   7.142   8.295
  522    HD1  HIS  69           HD1      HIS  69  17.814   8.529  10.226
  523    HD2  HIS  69           HD2      HIS  69  16.026   9.668   6.652
  524    HE1  HIS  69           HE1      HIS  69  16.093  10.250  10.850
  525    HE2  HIS  69           HE2      HIS  69  15.191  11.078   8.648
  526    H    GLU  70           H        GLU  70  21.079  10.181   6.278
  527    HA   GLU  70           HA       GLU  70  22.551   9.804   8.736
  528    HB2  GLU  70           HB2      GLU  70  22.944  11.737   6.447
  529    HB3  GLU  70           HB3      GLU  70  23.995  11.657   7.852
  530    HG2  GLU  70           HG2      GLU  70  25.164  10.389   6.366
  531    HG3  GLU  70           HG3      GLU  70  24.216   9.145   7.176
  532    H    TYR  71           H        TYR  71  22.576  11.123  10.487
  533    HA   TYR  71           HA       TYR  71  20.341  12.983  10.651
  534    HB2  TYR  71           HB2      TYR  71  20.967  12.926  13.148
  535    HB3  TYR  71           HB3      TYR  71  20.273  11.477  12.434
  536    HD1  TYR  71           HD1      TYR  71  21.416   9.429  12.526
  537    HD2  TYR  71           HD2      TYR  71  23.499  13.021  13.459
  538    HE1  TYR  71           HE1      TYR  71  23.327   8.107  13.334
  539    HE2  TYR  71           HE2      TYR  71  25.411  11.705  14.263
  540    HH   TYR  71           HH       TYR  71  25.728   8.371  13.688
  541    H    HIS  72           H        HIS  72  22.375  14.006   9.127
  542    HA   HIS  72           HA       HIS  72  23.044  16.347  10.695
  543    HB2  HIS  72           HB2      HIS  72  25.407  16.356  10.157
  544    HB3  HIS  72           HB3      HIS  72  25.017  14.862  10.995
  545    HD1  HIS  72           HD1      HIS  72  25.372  12.668   9.727
  546    HD2  HIS  72           HD2      HIS  72  26.115  16.056   7.430
  547    HE1  HIS  72           HE1      HIS  72  26.488  11.837   7.632
  548    HE2  HIS  72           HE2      HIS  72  26.865  13.893   6.226
  549    H    THR  73           H        THR  73  23.279  18.185   9.472
  550    HA   THR  73           HA       THR  73  22.957  19.593   7.731
  551    HB   THR  73           HB       THR  73  23.667  17.292   5.899
  552    HG1  THR  73           HG1      THR  73  25.173  18.600   7.764
  553   HG21  THR  73          HG21      THR  73  22.767  19.297   4.798
  554   HG22  THR  73          HG22      THR  73  24.475  19.071   4.424
  555   HG23  THR  73          HG23      THR  73  23.984  20.285   5.605
  Start of MODEL   20
    1    H1   GLN  -1           H1       GLN  -1  -1.900  15.415 -10.585
    2    H2   GLN  -1           H2       GLN  -1  -0.215  15.543 -10.515
    3    H3   GLN  -1           H3       GLN  -1  -1.106  15.326  -9.097
    4    HA   GLN  -1           HA       GLN  -1  -0.880  13.381 -11.313
    5    HB2  GLN  -1           HB2      GLN  -1   1.195  13.581 -10.004
    6    HB3  GLN  -1           HB3      GLN  -1   0.289  13.315  -8.522
    7    HG2  GLN  -1           HG2      GLN  -1  -0.378  11.082  -9.441
    8    HG3  GLN  -1           HG3      GLN  -1   0.758  11.363 -10.760
    9   HE21  GLN  -1          HE21      GLN  -1   2.969  11.350 -10.328
   10   HE22  GLN  -1          HE22      GLN  -1   3.615  10.690  -8.864
   11    H    SER   0           H        SER   0  -1.696  13.597  -7.843
   12    HA   SER   0           HA       SER   0  -3.331  12.666  -6.590
   13    HB2  SER   0           HB2      SER   0  -4.795  12.229  -9.203
   14    HB3  SER   0           HB3      SER   0  -5.500  12.156  -7.588
   15    HG   SER   0           HG       SER   0  -5.259  14.318  -7.367
   16    H    MET   1           H        MET   1  -2.806  10.813  -5.635
   17    HA   MET   1           HA       MET   1  -1.989   8.544  -7.235
   18    HB2  MET   1           HB2      MET   1  -2.245   8.690  -4.237
   19    HB3  MET   1           HB3      MET   1  -1.360   7.494  -5.165
   20    HG2  MET   1           HG2      MET   1   0.216   9.179  -5.895
   21    HG3  MET   1           HG3      MET   1  -0.689  10.424  -5.038
   22    HE1  MET   1           HE1      MET   1   1.566   7.263  -4.745
   23    HE2  MET   1           HE2      MET   1   0.150   6.729  -3.840
   24    HE3  MET   1           HE3      MET   1   1.675   7.023  -3.002
   25    H    ALA   2           H        ALA   2  -2.992   6.596  -7.345
   26    HA   ALA   2           HA       ALA   2  -5.704   6.425  -6.204
   27    HB1  ALA   2           HB1      ALA   2  -5.815   6.915  -8.595
   28    HB2  ALA   2           HB2      ALA   2  -6.461   5.316  -8.232
   29    HB3  ALA   2           HB3      ALA   2  -4.852   5.478  -8.935
   30    H    LEU   3           H        LEU   3  -2.671   4.967  -6.585
   31    HA   LEU   3           HA       LEU   3  -3.701   2.328  -5.789
   32    HB2  LEU   3           HB2      LEU   3  -1.069   3.096  -7.055
   33    HB3  LEU   3           HB3      LEU   3  -1.433   1.499  -6.464
   34    HG   LEU   3           HG       LEU   3  -3.443   1.625  -8.116
   35   HD11  LEU   3          HD11      LEU   3  -1.539   3.623  -9.274
   36   HD12  LEU   3          HD12      LEU   3  -3.130   3.979  -8.614
   37   HD13  LEU   3          HD13      LEU   3  -2.979   2.984 -10.064
   38   HD21  LEU   3          HD21      LEU   3  -0.587   1.283  -9.011
   39   HD22  LEU   3          HD22      LEU   3  -2.003   0.752  -9.918
   40   HD23  LEU   3          HD23      LEU   3  -1.642   0.034  -8.348
   41    H    HIS   4           H        HIS   4  -2.284   1.162  -4.227
   42    HA   HIS   4           HA       HIS   4  -1.633   3.103  -2.117
   43    HB2  HIS   4           HB2      HIS   4  -2.520   0.236  -1.939
   44    HB3  HIS   4           HB3      HIS   4  -1.919   1.140  -0.565
   45    HD1  HIS   4           HD1      HIS   4  -4.975   0.185  -2.027
   46    HD2  HIS   4           HD2      HIS   4  -3.550   3.685  -0.307
   47    HE1  HIS   4           HE1      HIS   4  -7.015   1.509  -1.395
   48    HE2  HIS   4           HE2      HIS   4  -6.103   3.432  -0.042
   49    H    TYR   5           H        TYR   5   0.332   3.289  -1.523
   50    HA   TYR   5           HA       TYR   5   2.308   1.414  -2.580
   51    HB2  TYR   5           HB2      TYR   5   2.463   4.256  -1.611
   52    HB3  TYR   5           HB3      TYR   5   3.910   3.276  -1.833
   53    HD1  TYR   5           HD1      TYR   5   4.942   4.526  -3.494
   54    HD2  TYR   5           HD2      TYR   5   0.941   3.221  -4.086
   55    HE1  TYR   5           HE1      TYR   5   5.079   5.204  -5.836
   56    HE2  TYR   5           HE2      TYR   5   1.066   3.896  -6.447
   57    HH   TYR   5           HH       TYR   5   2.424   5.588  -7.811
   58    H    TYR   6           H        TYR   6   2.768  -0.175  -1.206
   59    HA   TYR   6           HA       TYR   6   3.445   0.609   1.547
   60    HB2  TYR   6           HB2      TYR   6   2.359  -2.041   0.569
   61    HB3  TYR   6           HB3      TYR   6   2.909  -1.724   2.214
   62    HD1  TYR   6           HD1      TYR   6   0.120  -1.705   0.033
   63    HD2  TYR   6           HD2      TYR   6   1.755   0.280   3.437
   64    HE1  TYR   6           HE1      TYR   6  -2.115  -0.853   0.602
   65    HE2  TYR   6           HE2      TYR   6  -0.489   1.123   4.008
   66    HH   TYR   6           HH       TYR   6  -3.306  -0.058   2.709
   67    H    CYS   7           H        CYS   7   5.508   0.178   2.176
   68    HA   CYS   7           HA       CYS   7   7.229  -0.310  -0.048
   69    HB2  CYS   7           HB2      CYS   7   7.624   1.454   1.690
   70    HB3  CYS   7           HB3      CYS   7   8.128   0.164   2.759
   71    H    ARG   8           H        ARG   8   8.142  -2.070  -0.655
   72    HA   ARG   8           HA       ARG   8   8.294  -4.383   1.017
   73    HB2  ARG   8           HB2      ARG   8   9.348  -5.463  -0.810
   74    HB3  ARG   8           HB3      ARG   8   8.156  -4.397  -1.525
   75    HG2  ARG   8           HG2      ARG   8   9.835  -3.866  -2.902
   76    HG3  ARG   8           HG3      ARG   8  10.320  -2.793  -1.582
   77    HD2  ARG   8           HD2      ARG   8  11.818  -4.516  -0.720
   78    HD3  ARG   8           HD3      ARG   8  11.316  -5.610  -2.008
   79    HE   ARG   8           HE       ARG   8  12.446  -3.069  -2.833
   80   HH11  ARG   8          HH11      ARG   8  12.950  -6.485  -2.274
   81   HH12  ARG   8          HH12      ARG   8  14.399  -6.564  -3.225
   82   HH21  ARG   8          HH21      ARG   8  14.376  -3.173  -4.087
   83   HH22  ARG   8          HH22      ARG   8  15.200  -4.688  -4.262
   84    H    HIS   9           H        HIS   9   9.734  -4.663   2.538
   85    HA   HIS   9           HA       HIS   9  11.994  -5.193   3.092
   86    HB2  HIS   9           HB2      HIS   9  13.066  -4.185   1.170
   87    HB3  HIS   9           HB3      HIS   9  12.677  -2.572   1.743
   88    HD1  HIS   9           HD1      HIS   9  15.139  -5.327   2.126
   89    HD2  HIS   9           HD2      HIS   9  14.336  -1.633   3.859
   90    HE1  HIS   9           HE1      HIS   9  17.199  -4.727   3.432
   91    HE2  HIS   9           HE2      HIS   9  16.752  -2.422   4.338
   92    H    CYS  10           H        CYS  10  10.305  -2.142   3.554
   93    HA   CYS  10           HA       CYS  10  11.226  -2.285   6.344
   94    HB2  CYS  10           HB2      CYS  10  11.524   0.043   6.514
   95    HB3  CYS  10           HB3      CYS  10  12.274  -0.408   4.988
   96    H    GLY  11           H        GLY  11   8.583  -2.193   4.250
   97    HA2  GLY  11           HA2      GLY  11   6.351  -2.436   4.679
   98    HA3  GLY  11           HA3      GLY  11   6.777  -2.599   6.387
   99    H    VAL  12           H        VAL  12   7.582   0.300   4.571
  100    HA   VAL  12           HA       VAL  12   5.847   1.810   6.294
  101    HB   VAL  12           HB       VAL  12   8.037   2.747   6.000
  102   HG11  VAL  12          HG11      VAL  12   8.854   3.553   3.866
  103   HG12  VAL  12          HG12      VAL  12   7.393   2.968   3.070
  104   HG13  VAL  12          HG13      VAL  12   8.535   1.824   3.775
  105   HG21  VAL  12          HG21      VAL  12   7.494   4.967   5.314
  106   HG22  VAL  12          HG22      VAL  12   6.134   4.276   6.204
  107   HG23  VAL  12          HG23      VAL  12   6.086   4.369   4.442
  108    H    LYS  13           H        LYS  13   4.202   3.106   5.692
  109    HA   LYS  13           HA       LYS  13   2.839   2.467   3.219
  110    HB2  LYS  13           HB2      LYS  13   2.141   4.508   5.337
  111    HB3  LYS  13           HB3      LYS  13   1.079   3.943   4.063
  112    HG2  LYS  13           HG2      LYS  13   1.079   1.715   5.058
  113    HG3  LYS  13           HG3      LYS  13   2.159   2.282   6.329
  114    HD2  LYS  13           HD2      LYS  13   0.469   3.893   7.055
  115    HD3  LYS  13           HD3      LYS  13  -0.616   3.337   5.779
  116    HE2  LYS  13           HE2      LYS  13  -0.694   1.130   6.780
  117    HE3  LYS  13           HE3      LYS  13   0.452   1.631   8.021
  118    HZ1  LYS  13           HZ1      LYS  13  -2.272   2.740   7.624
  119    HZ2  LYS  13           HZ2      LYS  13  -1.173   3.251   8.802
  120    HZ3  LYS  13           HZ3      LYS  13  -1.802   1.684   8.857
  121    H    VAL  14           H        VAL  14   3.732   3.360   1.438
  122    HA   VAL  14           HA       VAL  14   4.786   6.090   1.593
  123    HB   VAL  14           HB       VAL  14   5.092   5.085  -1.039
  124   HG11  VAL  14          HG11      VAL  14   7.503   5.215  -0.452
  125   HG12  VAL  14          HG12      VAL  14   7.029   5.531   1.217
  126   HG13  VAL  14          HG13      VAL  14   6.581   6.664  -0.059
  127   HG21  VAL  14          HG21      VAL  14   6.097   3.116   1.011
  128   HG22  VAL  14          HG22      VAL  14   6.402   3.080  -0.728
  129   HG23  VAL  14          HG23      VAL  14   4.770   2.829  -0.113
  130    H    GLY  15           H        GLY  15   1.966   4.530   0.836
  131    HA2  GLY  15           HA2      GLY  15   0.899   6.899  -0.429
  132    HA3  GLY  15           HA3      GLY  15   0.914   5.473  -1.455
  133    H    SER  16           H        SER  16  -0.132   6.605   1.719
  134    HA   SER  16           HA       SER  16  -2.548   4.960   1.406
  135    HB2  SER  16           HB2      SER  16  -1.040   5.502   3.976
  136    HB3  SER  16           HB3      SER  16  -2.575   4.641   3.855
  137    HG   SER  16           HG       SER  16  -1.587   2.948   2.976
  138    H    LEU  17           H        LEU  17  -4.412   6.049   1.607
  139    HA   LEU  17           HA       LEU  17  -4.200   8.863   2.431
  140    HB2  LEU  17           HB2      LEU  17  -6.068   9.305   0.869
  141    HB3  LEU  17           HB3      LEU  17  -4.616   8.731   0.073
  142    HG   LEU  17           HG       LEU  17  -6.731   6.744   0.781
  143   HD11  LEU  17          HD11      LEU  17  -7.856   7.175  -1.342
  144   HD12  LEU  17          HD12      LEU  17  -6.831   8.588  -1.596
  145   HD13  LEU  17          HD13      LEU  17  -7.972   8.556  -0.251
  146   HD21  LEU  17          HD21      LEU  17  -5.932   5.659  -1.241
  147   HD22  LEU  17          HD22      LEU  17  -4.585   6.002  -0.155
  148   HD23  LEU  17          HD23      LEU  17  -4.858   7.019  -1.570
  149    H    GLU  18           H        GLU  18  -5.679   5.880   2.950
  150    HA   GLU  18           HA       GLU  18  -8.113   6.770   4.064
  151    HB2  GLU  18           HB2      GLU  18  -6.644   4.168   4.456
  152    HB3  GLU  18           HB3      GLU  18  -8.290   4.481   4.991
  153    HG2  GLU  18           HG2      GLU  18  -8.803   3.526   3.028
  154    HG3  GLU  18           HG3      GLU  18  -8.533   5.153   2.416
  155    H    SER  19           H        SER  19  -8.768   6.916   6.177
  156    HA   SER  19           HA       SER  19  -8.680   7.642   8.290
  157    HB2  SER  19           HB2      SER  19  -5.938   6.357   8.358
  158    HB3  SER  19           HB3      SER  19  -6.823   6.933   9.770
  159    HG   SER  19           HG       SER  19  -6.947   4.561   8.891
  160    H    SER  20           H        SER  20  -5.650   8.251   6.542
  161    HA   SER  20           HA       SER  20  -4.884  10.522   8.027
  162    HB2  SER  20           HB2      SER  20  -3.340   9.218   6.586
  163    HB3  SER  20           HB3      SER  20  -4.178   9.831   5.163
  164    HG   SER  20           HG       SER  20  -2.314  11.039   6.772
  165    H    MET  21           H        MET  21  -6.848  10.157   5.101
  166    HA   MET  21           HA       MET  21  -7.830  12.863   5.508
  167    HB2  MET  21           HB2      MET  21  -7.532  13.373   3.044
  168    HB3  MET  21           HB3      MET  21  -6.075  13.392   4.023
  169    HG2  MET  21           HG2      MET  21  -5.444  11.218   3.193
  170    HG3  MET  21           HG3      MET  21  -6.952  11.094   2.290
  171    HE1  MET  21           HE1      MET  21  -6.522  13.812  -0.458
  172    HE2  MET  21           HE2      MET  21  -7.288  14.030   1.114
  173    HE3  MET  21           HE3      MET  21  -7.552  12.543   0.204
  174    H    VAL  22           H        VAL  22  -8.042  10.004   3.364
  175    HA   VAL  22           HA       VAL  22  -9.760   9.189   2.126
  176    HB   VAL  22           HB       VAL  22 -11.437   9.856   4.550
  177   HG11  VAL  22          HG11      VAL  22 -11.564   7.728   2.438
  178   HG12  VAL  22          HG12      VAL  22 -12.721   9.033   2.710
  179   HG13  VAL  22          HG13      VAL  22 -12.554   7.735   3.896
  180   HG21  VAL  22          HG21      VAL  22  -9.235   8.710   5.080
  181   HG22  VAL  22          HG22      VAL  22  -9.853   7.341   4.155
  182   HG23  VAL  22          HG23      VAL  22 -10.703   7.882   5.598
  183    H    SER  23           H        SER  23  -9.447  11.318   0.883
  184    HA   SER  23           HA       SER  23 -12.077  12.403   0.402
  185    HB2  SER  23           HB2      SER  23  -9.788  14.256   1.110
  186    HB3  SER  23           HB3      SER  23 -11.393  14.748   0.572
  187    HG   SER  23           HG       SER  23 -11.583  13.055   2.661
  188    H    THR  24           H        THR  24 -11.279  10.899  -1.368
  189    HA   THR  24           HA       THR  24  -9.977  12.525  -3.448
  190    HB   THR  24           HB       THR  24  -9.215  10.289  -4.416
  191    HG1  THR  24           HG1      THR  24  -9.933   8.608  -3.348
  192   HG21  THR  24          HG21      THR  24  -8.036  11.158  -1.772
  193   HG22  THR  24          HG22      THR  24  -7.672  11.865  -3.345
  194   HG23  THR  24          HG23      THR  24  -7.217  10.196  -3.005
  195    H    ASP  25           H        ASP  25 -10.616  11.865  -5.655
  196    HA   ASP  25           HA       ASP  25 -13.470  11.214  -5.726
  197    HB2  ASP  25           HB2      ASP  25 -11.600  12.290  -7.848
  198    HB3  ASP  25           HB3      ASP  25 -13.288  11.887  -8.144
  199    H    SER  26           H        SER  26 -10.412   9.905  -6.274
  200    HA   SER  26           HA       SER  26 -11.395   7.707  -7.903
  201    HB2  SER  26           HB2      SER  26  -9.180   8.789  -8.362
  202    HB3  SER  26           HB3      SER  26  -8.622   8.212  -6.794
  203    HG   SER  26           HG       SER  26  -9.645   6.495  -8.812
  204    H    LEU  27           H        LEU  27 -11.151   5.518  -7.185
  205    HA   LEU  27           HA       LEU  27 -11.558   3.820  -5.780
  206    HB2  LEU  27           HB2      LEU  27 -10.281   5.631  -3.748
  207    HB3  LEU  27           HB3      LEU  27 -10.782   3.995  -3.418
  208    HG   LEU  27           HG       LEU  27  -8.691   4.798  -5.430
  209   HD11  LEU  27          HD11      LEU  27  -7.953   5.155  -3.126
  210   HD12  LEU  27          HD12      LEU  27  -7.106   3.800  -3.870
  211   HD13  LEU  27          HD13      LEU  27  -8.413   3.500  -2.722
  212   HD21  LEU  27          HD21      LEU  27  -8.243   2.367  -5.483
  213   HD22  LEU  27          HD22      LEU  27  -9.833   2.802  -6.107
  214   HD23  LEU  27          HD23      LEU  27  -9.678   2.123  -4.488
  215    H    GLY  28           H        GLY  28 -13.425   3.156  -5.020
  216    HA2  GLY  28           HA2      GLY  28 -15.370   5.137  -4.157
  217    HA3  GLY  28           HA3      GLY  28 -15.692   3.449  -4.525
  218    H    PHE  29           H        PHE  29 -13.194   2.978  -2.765
  219    HA   PHE  29           HA       PHE  29 -12.736   2.304  -0.658
  220    HB2  PHE  29           HB2      PHE  29 -14.651   4.499   0.148
  221    HB3  PHE  29           HB3      PHE  29 -13.506   3.692   1.210
  222    HD1  PHE  29           HD1      PHE  29 -14.044   6.631  -0.353
  223    HD2  PHE  29           HD2      PHE  29 -11.018   3.662  -0.041
  224    HE1  PHE  29           HE1      PHE  29 -12.348   8.315  -0.906
  225    HE2  PHE  29           HE2      PHE  29  -9.310   5.341  -0.601
  226    HZ   PHE  29           HZ       PHE  29  -9.976   7.674  -1.036
  227    H    GLN  30           H        GLN  30 -15.215   1.443  -2.151
  228    HA   GLN  30           HA       GLN  30 -16.842  -0.043  -2.072
  229    HB2  GLN  30           HB2      GLN  30 -16.705  -1.908  -0.587
  230    HB3  GLN  30           HB3      GLN  30 -15.101  -1.463  -1.114
  231    HG2  GLN  30           HG2      GLN  30 -14.558  -0.554   0.987
  232    HG3  GLN  30           HG3      GLN  30 -16.230  -0.638   1.523
  233   HE21  GLN  30          HE21      GLN  30 -16.658  -3.301   0.393
  234   HE22  GLN  30          HE22      GLN  30 -15.815  -4.401   1.427
  235    H    HIS  31           H        HIS  31 -16.562   1.493   1.112
  236    HA   HIS  31           HA       HIS  31 -19.446   1.942   1.039
  237    HB2  HIS  31           HB2      HIS  31 -19.022  -0.241   2.229
  238    HB3  HIS  31           HB3      HIS  31 -18.117   0.662   3.435
  239    HD1  HIS  31           HD1      HIS  31 -21.556  -0.199   2.366
  240    HD2  HIS  31           HD2      HIS  31 -19.713   2.296   5.137
  241    HE1  HIS  31           HE1      HIS  31 -23.372   0.507   3.957
  242    HE2  HIS  31           HE2      HIS  31 -22.264   2.133   5.528
  243    H    LEU  32           H        LEU  32 -18.831   4.180   0.776
  244    HA   LEU  32           HA       LEU  32 -17.988   5.360   3.301
  245    HB2  LEU  32           HB2      LEU  32 -16.096   5.431   1.791
  246    HB3  LEU  32           HB3      LEU  32 -17.075   6.196   0.551
  247    HG   LEU  32           HG       LEU  32 -17.394   8.124   2.050
  248   HD11  LEU  32          HD11      LEU  32 -15.911   8.360   4.007
  249   HD12  LEU  32          HD12      LEU  32 -15.389   6.690   3.783
  250   HD13  LEU  32          HD13      LEU  32 -17.069   7.044   4.192
  251   HD21  LEU  32          HD21      LEU  32 -15.633   8.156   0.355
  252   HD22  LEU  32          HD22      LEU  32 -14.509   7.443   1.513
  253   HD23  LEU  32          HD23      LEU  32 -15.158   9.058   1.794
  254    H    THR  33           H        THR  33 -18.864   7.028   0.249
  255    HA   THR  33           HA       THR  33 -21.498   7.636   1.327
  256    HB   THR  33           HB       THR  33 -19.521   9.847   0.749
  257    HG1  THR  33           HG1      THR  33 -20.088   8.461   2.987
  258   HG21  THR  33          HG21      THR  33 -21.748  10.503   0.062
  259   HG22  THR  33          HG22      THR  33 -21.313  11.348   1.550
  260   HG23  THR  33          HG23      THR  33 -22.412   9.970   1.607
  261    H    ASN  34           H        ASN  34 -20.009   9.769  -1.031
  262    HA   ASN  34           HA       ASN  34 -22.106   9.080  -2.910
  263    HB2  ASN  34           HB2      ASN  34 -19.851  11.093  -3.114
  264    HB3  ASN  34           HB3      ASN  34 -21.142  10.908  -4.295
  265   HD21  ASN  34          HD21      ASN  34 -20.399  13.211  -2.705
  266   HD22  ASN  34          HD22      ASN  34 -21.798  13.639  -1.782
  267    H    GLU  35           H        GLU  35 -18.683   8.749  -2.535
  268    HA   GLU  35           HA       GLU  35 -18.179   7.609  -5.075
  269    HB2  GLU  35           HB2      GLU  35 -16.052   6.884  -4.136
  270    HB3  GLU  35           HB3      GLU  35 -16.372   8.605  -4.025
  271    HG2  GLU  35           HG2      GLU  35 -16.916   6.726  -1.779
  272    HG3  GLU  35           HG3      GLU  35 -15.377   7.478  -2.090
  273    H    GLU  36           H        GLU  36 -19.342   6.437  -2.084
  274    HA   GLU  36           HA       GLU  36 -19.005   3.675  -2.387
  275    HB2  GLU  36           HB2      GLU  36 -19.883   4.956  -0.368
  276    HB3  GLU  36           HB3      GLU  36 -21.424   5.050  -1.200
  277    HG2  GLU  36           HG2      GLU  36 -20.164   2.389  -0.769
  278    HG3  GLU  36           HG3      GLU  36 -20.962   3.199   0.576
  279    H    ARG  37           H        ARG  37 -21.482   5.893  -3.576
  280    HA   ARG  37           HA       ARG  37 -23.113   4.004  -4.885
  281    HB2  ARG  37           HB2      ARG  37 -22.647   6.870  -5.708
  282    HB3  ARG  37           HB3      ARG  37 -24.042   5.880  -6.098
  283    HG2  ARG  37           HG2      ARG  37 -24.612   5.788  -3.705
  284    HG3  ARG  37           HG3      ARG  37 -23.252   6.858  -3.362
  285    HD2  ARG  37           HD2      ARG  37 -25.660   7.491  -5.067
  286    HD3  ARG  37           HD3      ARG  37 -25.325   8.118  -3.454
  287    HE   ARG  37           HE       ARG  37 -23.238   8.716  -5.326
  288   HH11  ARG  37          HH11      ARG  37 -26.370   9.728  -4.146
  289   HH12  ARG  37          HH12      ARG  37 -26.178  11.371  -4.675
  290   HH21  ARG  37          HH21      ARG  37 -22.989  10.867  -6.042
  291   HH22  ARG  37          HH22      ARG  37 -24.259  12.014  -5.767
  292    H    ASN  38           H        ASN  38 -20.181   5.668  -5.828
  293    HA   ASN  38           HA       ASN  38 -20.301   4.818  -8.573
  294    HB2  ASN  38           HB2      ASN  38 -17.989   5.958  -6.983
  295    HB3  ASN  38           HB3      ASN  38 -18.004   5.718  -8.727
  296   HD21  ASN  38          HD21      ASN  38 -17.610   8.170  -7.297
  297   HD22  ASN  38          HD22      ASN  38 -18.875   9.240  -7.789
  298    H    ASP  39           H        ASP  39 -19.218   3.494  -5.608
  299    HA   ASP  39           HA       ASP  39 -17.433   1.540  -6.738
  300    HB2  ASP  39           HB2      ASP  39 -17.416   2.458  -4.332
  301    HB3  ASP  39           HB3      ASP  39 -18.764   1.370  -4.034
  302    H    MET  40           H        MET  40 -20.794   1.906  -6.446
  303    HA   MET  40           HA       MET  40 -21.635  -0.776  -6.216
  304    HB2  MET  40           HB2      MET  40 -22.983   1.597  -7.511
  305    HB3  MET  40           HB3      MET  40 -23.764   0.048  -7.246
  306    HG2  MET  40           HG2      MET  40 -23.490   0.306  -4.843
  307    HG3  MET  40           HG3      MET  40 -22.674   1.846  -5.097
  308    HE1  MET  40           HE1      MET  40 -26.116   2.916  -3.561
  309    HE2  MET  40           HE2      MET  40 -24.361   2.982  -3.397
  310    HE3  MET  40           HE3      MET  40 -25.213   1.455  -3.168
  311    H    ILE  41           H        ILE  41 -20.361   1.051  -8.855
  312    HA   ILE  41           HA       ILE  41 -20.742  -1.292 -10.594
  313    HB   ILE  41           HB       ILE  41 -21.953   0.578 -11.539
  314   HG12  ILE  41          HG12      ILE  41 -19.356   0.094 -13.017
  315   HG13  ILE  41          HG13      ILE  41 -20.785  -0.932 -13.083
  316   HG21  ILE  41          HG21      ILE  41 -20.805   2.657 -12.202
  317   HG22  ILE  41          HG22      ILE  41 -19.354   2.098 -11.371
  318   HG23  ILE  41          HG23      ILE  41 -20.827   2.419 -10.455
  319   HD11  ILE  41          HD11      ILE  41 -22.041   0.910 -14.091
  320   HD12  ILE  41          HD12      ILE  41 -20.635   0.451 -15.051
  321   HD13  ILE  41          HD13      ILE  41 -20.585   1.904 -14.053
  322    H    SER  42           H        SER  42 -18.960  -2.272 -11.284
  323    HA   SER  42           HA       SER  42 -16.799  -2.750 -11.781
  324    HB2  SER  42           HB2      SER  42 -16.500   0.237 -11.613
  325    HB3  SER  42           HB3      SER  42 -15.145  -0.838 -11.934
  326    HG   SER  42           HG       SER  42 -17.263  -1.432 -13.514
  327    H    TYR  43           H        TYR  43 -17.607  -1.011  -8.956
  328    HA   TYR  43           HA       TYR  43 -16.624  -0.610  -6.976
  329    HB2  TYR  43           HB2      TYR  43 -15.786  -2.786  -5.867
  330    HB3  TYR  43           HB3      TYR  43 -17.465  -2.633  -6.332
  331    HD1  TYR  43           HD1      TYR  43 -18.316  -3.859  -8.326
  332    HD2  TYR  43           HD2      TYR  43 -14.414  -4.534  -6.763
  333    HE1  TYR  43           HE1      TYR  43 -18.202  -5.994  -9.535
  334    HE2  TYR  43           HE2      TYR  43 -14.290  -6.659  -7.981
  335    HH   TYR  43           HH       TYR  43 -16.465  -7.509 -10.425
  336    H    LYS  44           H        LYS  44 -14.214  -2.970  -7.013
  337    HA   LYS  44           HA       LYS  44 -12.156  -0.940  -7.090
  338    HB2  LYS  44           HB2      LYS  44 -11.975  -3.931  -6.652
  339    HB3  LYS  44           HB3      LYS  44 -10.665  -2.777  -6.423
  340    HG2  LYS  44           HG2      LYS  44 -11.775  -1.763  -4.580
  341    HG3  LYS  44           HG3      LYS  44 -13.253  -2.673  -4.898
  342    HD2  LYS  44           HD2      LYS  44 -12.108  -4.751  -4.359
  343    HD3  LYS  44           HD3      LYS  44 -10.606  -3.867  -4.099
  344    HE2  LYS  44           HE2      LYS  44 -13.141  -3.477  -2.523
  345    HE3  LYS  44           HE3      LYS  44 -11.761  -4.438  -1.998
  346    HZ1  LYS  44           HZ1      LYS  44 -10.399  -2.395  -2.183
  347    HZ2  LYS  44           HZ2      LYS  44 -11.608  -2.306  -1.000
  348    HZ3  LYS  44           HZ3      LYS  44 -11.819  -1.513  -2.479
  349    H    GLU  45           H        GLU  45 -11.751  -0.281  -9.117
  350    HA   GLU  45           HA       GLU  45 -12.204  -1.734 -11.440
  351    HB2  GLU  45           HB2      GLU  45 -10.403   0.640 -10.963
  352    HB3  GLU  45           HB3      GLU  45 -10.823   0.024 -12.546
  353    HG2  GLU  45           HG2      GLU  45 -13.143   0.489 -12.182
  354    HG3  GLU  45           HG3      GLU  45 -12.790   0.998 -10.542
  355    H    ASN  46           H        ASN  46  -9.357  -1.631  -9.415
  356    HA   ASN  46           HA       ASN  46  -7.903  -3.274 -11.380
  357    HB2  ASN  46           HB2      ASN  46  -6.969  -1.074 -10.249
  358    HB3  ASN  46           HB3      ASN  46  -6.625  -2.157  -8.907
  359   HD21  ASN  46          HD21      ASN  46  -6.076  -4.425 -10.751
  360   HD22  ASN  46          HD22      ASN  46  -4.516  -4.094 -11.421
  361    H    GLY  47           H        GLY  47 -10.065  -4.060  -9.398
  362    HA2  GLY  47           HA2      GLY  47 -10.509  -5.964  -8.152
  363    HA3  GLY  47           HA3      GLY  47  -8.813  -6.433  -8.330
  364    H    ASP  48           H        ASP  48  -7.638  -4.153  -7.327
  365    HA   ASP  48           HA       ASP  48  -8.464  -2.675  -5.279
  366    HB2  ASP  48           HB2      ASP  48  -9.010  -4.822  -4.037
  367    HB3  ASP  48           HB3      ASP  48  -7.284  -5.142  -3.987
  368    H    VAL  49           H        VAL  49  -6.869  -1.216  -5.338
  369    HA   VAL  49           HA       VAL  49  -4.366  -1.937  -6.467
  370    HB   VAL  49           HB       VAL  49  -3.810   0.471  -6.106
  371   HG11  VAL  49          HG11      VAL  49  -6.429  -0.146  -7.468
  372   HG12  VAL  49          HG12      VAL  49  -4.819  -0.262  -8.180
  373   HG13  VAL  49          HG13      VAL  49  -5.472   1.312  -7.726
  374   HG21  VAL  49          HG21      VAL  49  -6.636   0.632  -5.031
  375   HG22  VAL  49          HG22      VAL  49  -5.593   2.000  -5.381
  376   HG23  VAL  49          HG23      VAL  49  -5.164   0.873  -4.095
  377    H    HIS  50           H        HIS  50  -3.364  -3.348  -5.084
  378    HA   HIS  50           HA       HIS  50  -2.377  -2.185  -2.567
  379    HB2  HIS  50           HB2      HIS  50  -3.891  -4.227  -2.342
  380    HB3  HIS  50           HB3      HIS  50  -2.612  -5.147  -3.127
  381    HD1  HIS  50           HD1      HIS  50  -3.723  -3.979   0.127
  382    HD2  HIS  50           HD2      HIS  50  -0.112  -5.119  -1.591
  383    HE1  HIS  50           HE1      HIS  50  -2.168  -4.422   2.052
  384    HE2  HIS  50           HE2      HIS  50  -0.073  -5.328   0.987
  385    H    VAL  51           H        VAL  51  -0.488  -1.381  -3.182
  386    HA   VAL  51           HA       VAL  51   1.136  -2.909  -5.094
  387    HB   VAL  51           HB       VAL  51   0.659   0.034  -4.706
  388   HG11  VAL  51          HG11      VAL  51   2.313   0.515  -6.390
  389   HG12  VAL  51          HG12      VAL  51   2.778  -1.186  -6.449
  390   HG13  VAL  51          HG13      VAL  51   3.058  -0.242  -4.983
  391   HG21  VAL  51          HG21      VAL  51   0.396  -1.798  -7.077
  392   HG22  VAL  51          HG22      VAL  51   0.068  -0.065  -7.080
  393   HG23  VAL  51          HG23      VAL  51  -0.924  -1.148  -6.103
  394    H    LEU  52           H        LEU  52   2.987  -3.701  -4.293
  395    HA   LEU  52           HA       LEU  52   4.174  -2.407  -1.951
  396    HB2  LEU  52           HB2      LEU  52   5.143  -4.962  -3.224
  397    HB3  LEU  52           HB3      LEU  52   5.478  -4.356  -1.615
  398    HG   LEU  52           HG       LEU  52   2.784  -5.335  -2.559
  399   HD11  LEU  52          HD11      LEU  52   3.222  -7.240  -1.086
  400   HD12  LEU  52          HD12      LEU  52   4.843  -6.618  -0.775
  401   HD13  LEU  52          HD13      LEU  52   4.396  -7.141  -2.398
  402   HD21  LEU  52          HD21      LEU  52   3.745  -4.521   0.185
  403   HD22  LEU  52          HD22      LEU  52   2.158  -5.187  -0.206
  404   HD23  LEU  52          HD23      LEU  52   2.629  -3.609  -0.832
  405    H    THR  53           H        THR  53   5.771  -1.061  -2.192
  406    HA   THR  53           HA       THR  53   7.334  -1.095  -4.677
  407    HB   THR  53           HB       THR  53   5.458   0.485  -4.959
  408    HG1  THR  53           HG1      THR  53   7.121   1.291  -6.074
  409   HG21  THR  53          HG21      THR  53   6.629   1.907  -2.573
  410   HG22  THR  53          HG22      THR  53   5.104   1.021  -2.602
  411   HG23  THR  53          HG23      THR  53   5.296   2.480  -3.573
  412    H    ILE  54           H        ILE  54   8.979   0.942  -4.359
  413    HA   ILE  54           HA       ILE  54  10.347   0.364  -1.817
  414    HB   ILE  54           HB       ILE  54  11.333   1.027  -4.571
  415   HG12  ILE  54          HG12      ILE  54  12.462  -0.908  -2.572
  416   HG13  ILE  54          HG13      ILE  54  11.082  -1.312  -3.570
  417   HG21  ILE  54          HG21      ILE  54  13.544   1.489  -3.732
  418   HG22  ILE  54          HG22      ILE  54  12.976   1.313  -2.071
  419   HG23  ILE  54          HG23      ILE  54  12.392   2.647  -3.065
  420   HD11  ILE  54          HD11      ILE  54  12.423  -0.916  -5.578
  421   HD12  ILE  54          HD12      ILE  54  13.122  -2.161  -4.547
  422   HD13  ILE  54          HD13      ILE  54  13.807  -0.538  -4.557
  423    H    CYS  55           H        CYS  55  10.365   1.942  -0.347
  424    HA   CYS  55           HA       CYS  55   9.583   4.614  -1.007
  425    HB2  CYS  55           HB2      CYS  55   9.740   5.114   1.301
  426    HB3  CYS  55           HB3      CYS  55   9.163   3.455   1.231
  427    H    GLU  56           H        GLU  56  10.943   6.500  -0.398
  428    HA   GLU  56           HA       GLU  56  13.232   6.701  -1.881
  429    HB2  GLU  56           HB2      GLU  56  11.994   8.614  -1.000
  430    HB3  GLU  56           HB3      GLU  56  12.515   8.225   0.628
  431    HG2  GLU  56           HG2      GLU  56  14.824   8.671  -0.002
  432    HG3  GLU  56           HG3      GLU  56  14.305   9.053  -1.641
  433    H    ASP  57           H        ASP  57  12.995   6.008   1.581
  434    HA   ASP  57           HA       ASP  57  15.733   6.032   2.159
  435    HB2  ASP  57           HB2      ASP  57  14.112   6.189   3.924
  436    HB3  ASP  57           HB3      ASP  57  13.436   4.619   3.514
  437    H    CYS  58           H        CYS  58  13.627   3.331   1.176
  438    HA   CYS  58           HA       CYS  58  15.730   1.408   1.440
  439    HB2  CYS  58           HB2      CYS  58  13.053   1.245   0.057
  440    HB3  CYS  58           HB3      CYS  58  14.198  -0.091   0.107
  441    H    GLN  59           H        GLN  59  14.239   3.011  -1.393
  442    HA   GLN  59           HA       GLN  59  15.852   2.061  -3.400
  443    HB2  GLN  59           HB2      GLN  59  13.957   3.657  -3.698
  444    HB3  GLN  59           HB3      GLN  59  14.974   4.945  -3.082
  445    HG2  GLN  59           HG2      GLN  59  16.172   3.490  -5.305
  446    HG3  GLN  59           HG3      GLN  59  14.646   4.258  -5.710
  447   HE21  GLN  59          HE21      GLN  59  16.835   5.566  -3.321
  448   HE22  GLN  59          HE22      GLN  59  17.310   6.934  -4.248
  449    H    GLU  60           H        GLU  60  16.608   4.474  -0.969
  450    HA   GLU  60           HA       GLU  60  19.035   5.303  -2.151
  451    HB2  GLU  60           HB2      GLU  60  17.482   5.866   0.242
  452    HB3  GLU  60           HB3      GLU  60  19.199   5.879   0.531
  453    HG2  GLU  60           HG2      GLU  60  17.867   7.438  -1.610
  454    HG3  GLU  60           HG3      GLU  60  18.250   8.088  -0.027
  455    H    ALA  61           H        ALA  61  18.259   3.052   0.480
  456    HA   ALA  61           HA       ALA  61  20.932   2.364   1.108
  457    HB1  ALA  61           HB1      ALA  61  18.399   0.745   1.405
  458    HB2  ALA  61           HB2      ALA  61  19.076   1.844   2.606
  459    HB3  ALA  61           HB3      ALA  61  19.945   0.374   2.169
  460    H    LEU  62           H        LEU  62  18.587   1.325  -1.166
  461    HA   LEU  62           HA       LEU  62  19.806  -0.929  -2.260
  462    HB2  LEU  62           HB2      LEU  62  17.574   0.777  -2.679
  463    HB3  LEU  62           HB3      LEU  62  18.368   0.540  -4.220
  464    HG   LEU  62           HG       LEU  62  18.296  -1.943  -3.583
  465   HD11  LEU  62          HD11      LEU  62  16.407  -2.592  -2.170
  466   HD12  LEU  62          HD12      LEU  62  16.153  -0.894  -1.767
  467   HD13  LEU  62          HD13      LEU  62  17.641  -1.703  -1.276
  468   HD21  LEU  62          HD21      LEU  62  15.810  -0.432  -4.326
  469   HD22  LEU  62          HD22      LEU  62  16.027  -2.170  -4.536
  470   HD23  LEU  62          HD23      LEU  62  17.043  -1.038  -5.428
  471    H    ASP  63           H        ASP  63  19.600   2.310  -3.620
  472    HA   ASP  63           HA       ASP  63  21.413   1.970  -5.691
  473    HB2  ASP  63           HB2      ASP  63  19.918   3.850  -5.660
  474    HB3  ASP  63           HB3      ASP  63  20.635   4.457  -4.170
  475    H    ARG  64           H        ARG  64  21.989   2.795  -2.338
  476    HA   ARG  64           HA       ARG  64  24.700   3.582  -2.665
  477    HB2  ARG  64           HB2      ARG  64  23.094   4.066  -0.704
  478    HB3  ARG  64           HB3      ARG  64  23.517   2.462  -0.127
  479    HG2  ARG  64           HG2      ARG  64  25.585   4.567  -0.687
  480    HG3  ARG  64           HG3      ARG  64  24.777   4.418   0.873
  481    HD2  ARG  64           HD2      ARG  64  25.604   2.135   1.093
  482    HD3  ARG  64           HD3      ARG  64  26.379   2.254  -0.486
  483    HE   ARG  64           HE       ARG  64  27.358   4.350   1.031
  484   HH11  ARG  64          HH11      ARG  64  27.384   0.848   1.170
  485   HH12  ARG  64          HH12      ARG  64  28.909   0.772   1.994
  486   HH21  ARG  64          HH21      ARG  64  29.358   4.253   2.101
  487   HH22  ARG  64          HH22      ARG  64  30.031   2.714   2.536
  488    H    ASN  65           H        ASN  65  23.131   0.502  -1.824
  489    HA   ASN  65           HA       ASN  65  25.795  -0.761  -1.923
  490    HB2  ASN  65           HB2      ASN  65  23.410  -1.728  -0.342
  491    HB3  ASN  65           HB3      ASN  65  25.030  -2.407  -0.319
  492   HD21  ASN  65          HD21      ASN  65  22.972   0.132   0.791
  493   HD22  ASN  65          HD22      ASN  65  24.075   0.810   1.940
  494    HA   PRO  66           HA       PRO  66  23.842  -2.739  -5.456
  495    HB2  PRO  66           HB2      PRO  66  26.086  -3.903  -6.413
  496    HB3  PRO  66           HB3      PRO  66  25.743  -2.182  -6.617
  497    HG2  PRO  66           HG2      PRO  66  27.518  -3.535  -4.627
  498    HG3  PRO  66           HG3      PRO  66  27.807  -2.056  -5.559
  499    HD2  PRO  66           HD2      PRO  66  27.012  -2.042  -2.962
  500    HD3  PRO  66           HD3      PRO  66  26.597  -0.754  -4.109
  501    H    HIS  67           H        HIS  67  23.609  -3.981  -2.872
  502    HA   HIS  67           HA       HIS  67  23.994  -6.805  -3.627
  503    HB2  HIS  67           HB2      HIS  67  23.735  -5.518  -0.908
  504    HB3  HIS  67           HB3      HIS  67  23.578  -7.253  -1.156
  505    HD1  HIS  67           HD1      HIS  67  25.674  -8.479  -0.737
  506    HD2  HIS  67           HD2      HIS  67  26.395  -4.603  -2.062
  507    HE1  HIS  67           HE1      HIS  67  28.175  -8.208  -0.712
  508    HE2  HIS  67           HE2      HIS  67  28.571  -5.801  -1.337
  509    H    TYR  68           H        TYR  68  21.726  -4.478  -2.219
  510    HA   TYR  68           HA       TYR  68  19.490  -6.274  -2.776
  511    HB2  TYR  68           HB2      TYR  68  18.770  -3.564  -1.978
  512    HB3  TYR  68           HB3      TYR  68  18.346  -5.089  -1.221
  513    HD1  TYR  68           HD1      TYR  68  20.028  -6.136   0.397
  514    HD2  TYR  68           HD2      TYR  68  20.353  -2.149  -1.035
  515    HE1  TYR  68           HE1      TYR  68  21.539  -5.588   2.258
  516    HE2  TYR  68           HE2      TYR  68  21.852  -1.594   0.804
  517    HH   TYR  68           HH       TYR  68  23.265  -3.964   2.803
  518    H    HIS  69           H        HIS  69  21.370  -4.018  -4.307
  519    HA   HIS  69           HA       HIS  69  19.318  -3.517  -6.334
  520    HB2  HIS  69           HB2      HIS  69  19.667  -1.500  -4.854
  521    HB3  HIS  69           HB3      HIS  69  21.324  -1.452  -5.440
  522    HD1  HIS  69           HD1      HIS  69  21.671   0.093  -7.326
  523    HD2  HIS  69           HD2      HIS  69  17.801  -1.423  -7.257
  524    HE1  HIS  69           HE1      HIS  69  20.471   1.212  -9.232
  525    HE2  HIS  69           HE2      HIS  69  18.106   0.351  -9.109
  526    H    GLU  70           H        GLU  70  20.300  -5.184  -7.533
  527    HA   GLU  70           HA       GLU  70  22.515  -4.168  -9.100
  528    HB2  GLU  70           HB2      GLU  70  23.548  -6.525  -9.073
  529    HB3  GLU  70           HB3      GLU  70  23.847  -5.467  -7.706
  530    HG2  GLU  70           HG2      GLU  70  23.419  -7.689  -6.920
  531    HG3  GLU  70           HG3      GLU  70  22.088  -6.641  -6.443
  532    H    TYR  71           H        TYR  71  22.882  -5.595 -11.057
  533    HA   TYR  71           HA       TYR  71  20.410  -6.940 -11.852
  534    HB2  TYR  71           HB2      TYR  71  20.683  -5.923 -14.149
  535    HB3  TYR  71           HB3      TYR  71  20.164  -4.816 -12.889
  536    HD1  TYR  71           HD1      TYR  71  21.756  -3.124 -12.001
  537    HD2  TYR  71           HD2      TYR  71  22.753  -5.624 -15.292
  538    HE1  TYR  71           HE1      TYR  71  23.590  -1.598 -12.596
  539    HE2  TYR  71           HE2      TYR  71  24.588  -4.109 -15.894
  540    HH   TYR  71           HH       TYR  71  25.221  -1.761 -15.573
  541    H    HIS  72           H        HIS  72  20.657  -8.742 -13.019
  542    HA   HIS  72           HA       HIS  72  21.648 -10.614 -13.816
  543    HB2  HIS  72           HB2      HIS  72  22.518  -8.912 -15.512
  544    HB3  HIS  72           HB3      HIS  72  24.016  -8.906 -14.588
  545    HD1  HIS  72           HD1      HIS  72  25.542 -10.978 -14.786
  546    HD2  HIS  72           HD2      HIS  72  22.025 -11.242 -16.990
  547    HE1  HIS  72           HE1      HIS  72  25.832 -12.972 -16.291
  548    HE2  HIS  72           HE2      HIS  72  23.734 -13.055 -17.682
  549    H    THR  73           H        THR  73  21.751 -11.054 -11.465
  550    HA   THR  73           HA       THR  73  24.094 -10.744  -9.946
  551    HB   THR  73           HB       THR  73  22.166 -13.031  -9.587
  552    HG1  THR  73           HG1      THR  73  21.789 -10.250  -9.060
  553   HG21  THR  73          HG21      THR  73  23.691 -11.296  -7.637
  554   HG22  THR  73          HG22      THR  73  24.110 -12.946  -8.100
  555   HG23  THR  73          HG23      THR  73  22.620 -12.631  -7.209