*HEADER    ANTIMICROBIAL PROTEIN                   24-APR-12   2LS9              
*TITLE     PLEUROCIDIN-NH2                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PLEUROCIDIN;                                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: PSEUDOPLEURONECTES AMERICANUS;                  
*SOURCE   4 ORGANISM_COMMON: WINTER FLOUNDER;                                    
*SOURCE   5 ORGANISM_TAXID: 8265                                                 
*KEYWDS    ANTIMICROBIAL PEPTIDE, ANTIMICROBIAL PROTEIN                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    L.S.VERMEER, J.KOZLOWSKA, J.A.MASON                                   
*REVDAT   1   03-APR-13 2LS9    0                                                


assign (resid   20 and name  HB#) (resid   22 and name   HN) 2.934 1.076 1.076 weight 1.000 ! spec=NOESY, no=1, id=0, vol=7.110000e+05
assign (resid   24 and name  HB2) (resid   24 and name   HA) 2.779 0.966 0.966 weight 1.000 ! spec=NOESY, no=2, id=1, vol=9.840000e+05
assign (resid    3 and name  HA2) (resid    5 and name   HN) 2.399 0.719 0.719 weight 1.000 ! spec=NOESY, no=3, id=2, vol=2.380000e+06
assign (resid    8 and name   HA) (resid   12 and name   HN) 4.011 2.011 2.011 weight 1.000 ! spec=NOESY, no=5, id=4, vol=1.090000e+05
assign (resid   20 and name   HA) (resid   23 and name   HN) 2.782 0.967 0.967 weight 1.000 ! spec=NOESY, no=6, id=5, vol=9.790000e+05
assign (resid   15 and name   HA) (resid   15 and name   HN) 2.857 1.020 1.020 weight 1.000 ! spec=NOESY, no=7, id=6, vol=8.340000e+05
assign (resid    5 and name   HA) (resid    5 and name   HN) 2.491 0.775 0.775 weight 1.000 ! spec=NOESY, no=8, id=7, vol=1.900000e+06
assign (resid    5 and name   HA) (resid    6 and name   HN) 2.767 0.957 0.957 weight 1.000 ! spec=NOESY, no=9, id=8, vol=1.010000e+06
assign (resid    5 and name   HA) (resid    8 and name   HN) 3.216 1.293 1.293 weight 1.000 ! spec=NOESY, no=10, id=9, vol=4.100000e+05
assign (resid    5 and name  HB2) (resid    5 and name   HN) 2.212 0.612 0.612 weight 1.000 ! spec=NOESY, no=12, id=11, vol=3.870000e+06
assign (resid    5 and name  HB2) (resid    5 and name   HA) 2.560 0.819 0.819 weight 1.000 ! spec=NOESY, no=13, id=12, vol=1.610000e+06
assign (resid    6 and name   HA) (resid    6 and name   HN) 2.772 0.960 0.960 weight 1.000 ! spec=NOESY, no=16, id=14, vol=1.000000e+06
assign (resid    6 and name  HB2) (resid    6 and name   HN) 2.204 0.607 0.607 weight 1.000 ! spec=NOESY, no=17, id=15, vol=3.960000e+06
assign (resid    6 and name  HB2) (resid    6 and name   HA) 2.451 0.751 0.751 weight 1.000 ! spec=NOESY, no=18, id=16, vol=2.090000e+06
assign (resid    7 and name   HA) (resid    7 and name   HN) 2.577 0.830 0.830 weight 1.000 ! spec=NOESY, no=19, id=17, vol=1.550000e+06
assign (resid    7 and name   HA) (resid    8 and name   HN) 3.170 1.256 1.256 weight 1.000 ! spec=NOESY, no=20, id=18, vol=4.470000e+05
assign (resid    7 and name  HB2) (resid    7 and name   HN) 2.489 0.774 0.774 weight 1.000 ! spec=NOESY, no=21, id=19, vol=1.910000e+06
assign (resid    7 and name  HB2) (resid    7 and name   HA) 3.415 1.458 1.458 weight 1.000 ! spec=NOESY, no=22, id=20, vol=2.860000e+05
assign (resid    7 and name  HB2) (resid    7 and name  HE2) 2.031 0.515 0.515 weight 1.000 ! spec=NOESY, no=24, id=21, vol=6.470000e+06
assign (resid    7 and name  HD2) (resid    7 and name   HN) 3.425 1.466 1.466 weight 1.000 ! spec=NOESY, no=25, id=22, vol=2.810000e+05
assign (resid    7 and name  HD2) (resid    7 and name   HA) 2.111 0.557 0.557 weight 1.000 ! spec=NOESY, no=26, id=23, vol=5.120000e+06
assign (resid    7 and name  HE#) (resid    7 and name   HA) 3.483 1.517 1.517 weight 1.000 ! spec=NOESY, no=27, id=24, vol=2.540000e+05
assign (resid    7 and name  HG2) (resid    7 and name   HN) 3.076 1.183 1.183 weight 1.000 ! spec=NOESY, no=28, id=25, vol=5.350000e+05
assign (resid    7 and name  HG2) (resid    7 and name  HB2) 2.819 0.994 0.994 weight 1.000 ! spec=NOESY, no=29, id=26, vol=9.030000e+05
assign (resid    7 and name  HG2) (resid    7 and name  HD2) 2.486 0.773 0.773 weight 1.000 ! spec=NOESY, no=30, id=27, vol=1.920000e+06
assign (resid    7 and name  HG2) (resid    7 and name  HE2) 2.612 0.852 0.852 weight 1.000 ! spec=NOESY, no=31, id=28, vol=1.430000e+06
assign (resid    8 and name   HN) (resid    7 and name   HN) 2.984 1.113 1.113 weight 1.000 ! spec=NOESY, no=32, id=29, vol=6.430000e+05
assign (resid    8 and name   HN) (resid    9 and name   HN) 2.594 0.841 0.841 weight 1.000 ! spec=NOESY, no=33, id=30, vol=1.490000e+06
assign (resid    8 and name   HA) (resid    8 and name   HN) 2.819 0.993 0.993 weight 1.000 ! spec=NOESY, no=34, id=31, vol=9.040000e+05
assign (resid    8 and name   HA) (resid    9 and name   HN) 2.438 0.743 0.743 weight 1.000 ! spec=NOESY, no=35, id=32, vol=2.160000e+06
assign (resid    8 and name   HA) (resid   11 and name   HN) 3.307 1.367 1.367 weight 1.000 ! spec=NOESY, no=36, id=33, vol=3.470000e+05
assign (resid    8 and name  HB2) (resid    8 and name   HN) 2.225 0.619 0.619 weight 1.000 ! spec=NOESY, no=38, id=35, vol=3.740000e+06
assign (resid    8 and name  HB2) (resid    8 and name   HA) 2.602 0.847 0.847 weight 1.000 ! spec=NOESY, no=39, id=36, vol=1.460000e+06
assign (resid    8 and name  HB2) (resid    8 and name  HE2) 2.327 0.677 0.677 weight 1.000 ! spec=NOESY, no=42, id=38, vol=2.860000e+06
assign (resid    8 and name  HD2) (resid    8 and name   HN) 3.082 1.188 1.188 weight 1.000 ! spec=NOESY, no=43, id=39, vol=5.290000e+05
assign (resid    8 and name  HD2) (resid    8 and name   HA) 2.618 0.857 0.857 weight 1.000 ! spec=NOESY, no=44, id=40, vol=1.410000e+06
assign (resid    8 and name  HD2) (resid    8 and name  HE2) 2.423 0.734 0.734 weight 1.000 ! spec=NOESY, no=45, id=41, vol=2.240000e+06
assign (resid    8 and name  HG2) (resid    8 and name   HN) 2.938 1.079 1.079 weight 1.000 ! spec=NOESY, no=46, id=42, vol=7.050000e+05
assign (resid    8 and name  HG2) (resid    8 and name   HA) 3.129 1.224 1.224 weight 1.000 ! spec=NOESY, no=47, id=43, vol=4.830000e+05
assign (resid    8 and name  HG2) (resid    8 and name  HE2) 2.299 0.661 0.661 weight 1.000 ! spec=NOESY, no=48, id=44, vol=3.070000e+06
assign (resid    9 and name   HA) (resid    9 and name   HN) 2.434 0.741 0.741 weight 1.000 ! spec=NOESY, no=49, id=45, vol=2.180000e+06
assign (resid    9 and name  HB#) (resid    9 and name   HN) 2.278 0.648 0.648 weight 1.000 ! spec=NOESY, no=50, id=46, vol=3.250000e+06
assign (resid    9 and name  HB#) (resid    9 and name   HA) 2.037 0.519 0.519 weight 1.000 ! spec=NOESY, no=51, id=47, vol=6.350000e+06
assign (resid    9 and name  HB#) (resid   10 and name   HN) 2.696 0.909 0.909 weight 1.000 ! spec=NOESY, no=52, id=48, vol=1.180000e+06
assign (resid   10 and name   HA) (resid   10 and name   HN) 2.262 0.639 0.639 weight 1.000 ! spec=NOESY, no=53, id=49, vol=3.390000e+06
assign (resid   10 and name   HA) (resid   11 and name   HN) 3.153 1.242 1.242 weight 1.000 ! spec=NOESY, no=54, id=50, vol=4.620000e+05
assign (resid   10 and name  HB#) (resid   10 and name   HN) 2.386 0.711 0.711 weight 1.000 ! spec=NOESY, no=55, id=51, vol=2.460000e+06
assign (resid   10 and name  HB#) (resid   10 and name   HA) 2.406 0.723 0.723 weight 1.000 ! spec=NOESY, no=56, id=52, vol=2.340000e+06
assign (resid   10 and name  HB#) (resid   11 and name   HN) 3.050 1.162 1.162 weight 1.000 ! spec=NOESY, no=57, id=53, vol=5.640000e+05
assign (resid   11 and name   HN) (resid   10 and name   HN) 3.182 1.266 1.266 weight 1.000 ! spec=NOESY, no=58, id=54, vol=4.370000e+05
assign (resid   11 and name   HA) (resid   11 and name   HN) 3.032 1.149 1.149 weight 1.000 ! spec=NOESY, no=59, id=55, vol=5.840000e+05
assign (resid   11 and name   HA) (resid   11 and name  HE1) 3.598 1.618 1.618 weight 1.000 ! spec=NOESY, no=60, id=56, vol=2.090000e+05
assign (resid   11 and name   HA) (resid   12 and name   HN) 3.450 1.488 1.488 weight 1.000 ! spec=NOESY, no=61, id=57, vol=2.690000e+05
assign (resid   11 and name  HB2) (resid   11 and name   HN) 3.346 1.400 1.400 weight 1.000 ! spec=NOESY, no=62, id=58, vol=3.230000e+05
assign (resid   11 and name  HB2) (resid   11 and name   HA) 2.346 0.688 0.688 weight 1.000 ! spec=NOESY, no=64, id=60, vol=2.720000e+06
assign (resid   11 and name  HB2) (resid   12 and name   HN) 3.321 1.379 1.379 weight 1.000 ! spec=NOESY, no=68, id=62, vol=3.380000e+05
assign (resid   11 and name  HE1) (resid   11 and name  HD2) 3.353 1.406 1.406 weight 1.000 ! spec=NOESY, no=69, id=63, vol=3.190000e+05
assign (resid   12 and name   HN) (resid   13 and name   HN) 3.308 1.368 1.368 weight 1.000 ! spec=NOESY, no=70, id=64, vol=3.460000e+05
assign (resid   12 and name   HA) (resid   12 and name   HN) 3.276 1.341 1.341 weight 1.000 ! spec=NOESY, no=71, id=65, vol=3.670000e+05
assign (resid   12 and name   HA) (resid   13 and name   HN) 3.153 1.242 1.242 weight 1.000 ! spec=NOESY, no=72, id=66, vol=4.620000e+05
assign (resid   12 and name   HB) (resid   12 and name   HN) 2.838 1.007 1.007 weight 1.000 ! spec=NOESY, no=73, id=67, vol=8.680000e+05
assign (resid   12 and name   HB) (resid   12 and name   HA) 2.951 1.088 1.088 weight 1.000 ! spec=NOESY, no=74, id=68, vol=6.870000e+05
assign (resid   12 and name HG#2) (resid   12 and name   HN) 2.938 1.079 1.079 weight 1.000 ! spec=NOESY, no=75, id=69, vol=7.050000e+05
assign (resid   12 and name HG#2) (resid   12 and name   HA) 2.421 0.733 0.733 weight 1.000 ! spec=NOESY, no=77, id=71, vol=2.250000e+06
assign (resid   12 and name HG#2) (resid   12 and name   HB) 2.034 0.517 0.517 weight 1.000 ! spec=NOESY, no=79, id=73, vol=6.400000e+06
assign (resid   13 and name  HA2) (resid   13 and name   HN) 2.491 0.775 0.775 weight 1.000 ! spec=NOESY, no=81, id=75, vol=1.900000e+06
assign (resid   14 and name   HN) (resid   13 and name   HN) 3.164 1.251 1.251 weight 1.000 ! spec=NOESY, no=82, id=76, vol=4.520000e+05
assign (resid   14 and name   HA) (resid   14 and name   HN) 2.612 0.852 0.852 weight 1.000 ! spec=NOESY, no=83, id=77, vol=1.430000e+06
assign (resid   14 and name  HB2) (resid   14 and name   HN) 1.947 0.474 0.474 weight 1.000 ! spec=NOESY, no=84, id=78, vol=8.320000e+06
assign (resid   14 and name  HB2) (resid   14 and name   HA) 1.927 0.464 0.464 weight 1.000 ! spec=NOESY, no=85, id=79, vol=8.850000e+06
assign (resid   14 and name  HB2) (resid   14 and name  HE2) 3.000 1.125 1.125 weight 1.000 ! spec=NOESY, no=86, id=80, vol=6.220000e+05
assign (resid   14 and name  HG2) (resid   14 and name   HN) 1.812 0.411 0.411 weight 1.000 ! spec=NOESY, no=87, id=81, vol=1.280000e+07
assign (resid   16 and name   HA) (resid   16 and name   HN) 2.621 0.859 0.859 weight 1.000 ! spec=NOESY, no=88, id=82, vol=1.400000e+06
assign (resid   16 and name   HB) (resid   16 and name   HN) 2.682 0.899 0.899 weight 1.000 ! spec=NOESY, no=89, id=83, vol=1.220000e+06
assign (resid   16 and name   HB) (resid   16 and name   HA) 2.627 0.863 0.863 weight 1.000 ! spec=NOESY, no=90, id=84, vol=1.380000e+06
assign (resid   16 and name HG#2) (resid   16 and name   HN) 2.577 0.830 0.830 weight 1.000 ! spec=NOESY, no=92, id=86, vol=1.550000e+06
assign (resid   16 and name HG#2) (resid   16 and name   HA) 2.352 0.691 0.691 weight 1.000 ! spec=NOESY, no=94, id=88, vol=2.680000e+06
assign (resid   16 and name HG#2) (resid   16 and name   HB) 2.542 0.808 0.808 weight 1.000 ! spec=NOESY, no=95, id=89, vol=1.680000e+06
assign (resid   17 and name  HA2) (resid   17 and name   HN) 2.324 0.675 0.675 weight 1.000 ! spec=NOESY, no=97, id=91, vol=2.880000e+06
assign (resid   17 and name  HA2) (resid   18 and name   HN) 2.745 0.942 0.942 weight 1.000 ! spec=NOESY, no=98, id=92, vol=1.060000e+06
assign (resid   18 and name   HN) (resid   17 and name   HN) 2.948 1.086 1.086 weight 1.000 ! spec=NOESY, no=99, id=93, vol=6.910000e+05
assign (resid   18 and name   HA) (resid   18 and name   HN) 2.292 0.657 0.657 weight 1.000 ! spec=NOESY, no=100, id=94, vol=3.130000e+06
assign (resid   18 and name   HA) (resid   19 and name   HN) 3.371 1.421 1.421 weight 1.000 ! spec=NOESY, no=102, id=96, vol=3.090000e+05
assign (resid   18 and name  HB2) (resid   18 and name   HN) 2.962 1.097 1.097 weight 1.000 ! spec=NOESY, no=103, id=97, vol=6.720000e+05
assign (resid   18 and name  HD2) (resid   18 and name   HN) 2.353 0.692 0.692 weight 1.000 ! spec=NOESY, no=104, id=98, vol=2.670000e+06
assign (resid   18 and name  HG2) (resid   18 and name  HD2) 8.539 8.539 9.115 weight 1.000 ! spec=NOESY, no=105, id=99, vol=1.170000e+03
assign (resid   19 and name   HN) (resid   18 and name   HN) 2.925 1.069 1.069 weight 1.000 ! spec=NOESY, no=106, id=100, vol=7.250000e+05
assign (resid   19 and name   HN) (resid   20 and name   HN) 2.979 1.109 1.109 weight 1.000 ! spec=NOESY, no=107, id=101, vol=6.490000e+05
assign (resid   19 and name   HA) (resid   19 and name   HN) 2.927 1.071 1.071 weight 1.000 ! spec=NOESY, no=108, id=102, vol=7.220000e+05
assign (resid   19 and name   HA) (resid   20 and name   HN) 2.965 1.099 1.099 weight 1.000 ! spec=NOESY, no=109, id=103, vol=6.680000e+05
assign (resid   19 and name  HB#) (resid   19 and name   HN) 2.440 0.744 0.744 weight 1.000 ! spec=NOESY, no=110, id=104, vol=2.150000e+06
assign (resid   19 and name  HB#) (resid   19 and name   HA) 2.803 0.982 0.982 weight 1.000 ! spec=NOESY, no=111, id=105, vol=9.350000e+05
assign (resid   19 and name  HB#) (resid   20 and name   HN) 2.708 0.917 0.917 weight 1.000 ! spec=NOESY, no=112, id=106, vol=1.150000e+06
assign (resid   20 and name   HA) (resid   20 and name   HN) 2.793 0.975 0.975 weight 1.000 ! spec=NOESY, no=113, id=107, vol=9.560000e+05
assign (resid   20 and name  HB#) (resid   20 and name   HN) 2.423 0.734 0.734 weight 1.000 ! spec=NOESY, no=114, id=108, vol=2.240000e+06
assign (resid   20 and name  HB#) (resid   20 and name   HA) 2.298 0.660 0.660 weight 1.000 ! spec=NOESY, no=115, id=109, vol=3.080000e+06
assign (resid   20 and name  HB#) (resid   21 and name   HN) 2.790 0.973 0.973 weight 1.000 ! spec=NOESY, no=116, id=110, vol=9.620000e+05
assign (resid   21 and name   HN) (resid   20 and name   HN) 3.058 1.169 1.169 weight 1.000 ! spec=NOESY, no=117, id=111, vol=5.550000e+05
assign (resid   21 and name   HA) (resid   21 and name   HN) 2.712 0.919 0.919 weight 1.000 ! spec=NOESY, no=118, id=112, vol=1.140000e+06
assign (resid   21 and name  HB2) (resid   21 and name   HN) 2.381 0.709 0.709 weight 1.000 ! spec=NOESY, no=119, id=113, vol=2.490000e+06
assign (resid   21 and name   HG) (resid   21 and name   HN) 2.579 0.832 0.832 weight 1.000 ! spec=NOESY, no=120, id=114, vol=1.540000e+06
assign (resid   21 and name   HG) (resid   22 and name   HN) 2.442 0.745 0.745 weight 1.000 ! spec=NOESY, no=121, id=115, vol=2.140000e+06
assign (resid   22 and name   HN) (resid   21 and name   HN) 2.942 1.082 1.082 weight 1.000 ! spec=NOESY, no=122, id=116, vol=6.990000e+05
assign (resid   22 and name   HA) (resid   22 and name   HN) 2.482 0.770 0.770 weight 1.000 ! spec=NOESY, no=123, id=117, vol=1.940000e+06
assign (resid   22 and name   HB) (resid   22 and name   HN) 2.328 0.677 0.677 weight 1.000 ! spec=NOESY, no=125, id=118, vol=2.850000e+06
assign (resid   22 and name HG#1) (resid   22 and name   HN) 3.842 1.845 1.845 weight 1.000 ! spec=NOESY, no=126, id=119, vol=1.410000e+05
assign (resid   22 and name HG#1) (resid   22 and name   HA) 2.258 0.637 0.637 weight 1.000 ! spec=NOESY, no=127, id=120, vol=3.420000e+06
assign (resid   22 and name HG#1) (resid   22 and name   HB) 3.007 1.131 1.131 weight 1.000 ! spec=NOESY, no=128, id=121, vol=6.130000e+05
assign (resid   23 and name   HN) (resid   22 and name   HN) 2.401 0.720 0.720 weight 1.000 ! spec=NOESY, no=129, id=122, vol=2.370000e+06
assign (resid   23 and name   HA) (resid   23 and name   HN) 2.657 0.882 0.882 weight 1.000 ! spec=NOESY, no=130, id=123, vol=1.290000e+06
assign (resid   25 and name   HA) (resid   25 and name   HN) 3.117 1.214 1.214 weight 1.000 ! spec=NOESY, no=131, id=124, vol=4.950000e+05
assign (resid   25 and name  HB2) (resid   25 and name   HN) 2.696 0.909 0.909 weight 1.000 ! spec=NOESY, no=132, id=125, vol=1.180000e+06
assign (resid   25 and name  HB2) (resid   25 and name   HA) 2.763 0.954 0.954 weight 1.000 ! spec=NOESY, no=133, id=126, vol=1.020000e+06
assign (resid   25 and name HD#2) (resid   25 and name   HN) 2.621 0.859 0.859 weight 1.000 ! spec=NOESY, no=134, id=127, vol=1.400000e+06
assign (resid   25 and name HD#2) (resid   25 and name   HA) 2.461 0.757 0.757 weight 1.000 ! spec=NOESY, no=135, id=128, vol=2.040000e+06
assign (resid   25 and name HD#2) (resid   25 and name  HB#) 1.746 0.381 0.381 weight 1.000 ! spec=NOESY, no=136, id=129, vol=1.600000e+07
assign (resid   25 and name HD#2) (resid   25 and name   HG) 2.040 0.520 0.520 weight 1.000 ! spec=NOESY, no=137, id=130, vol=6.290000e+06
assign (resid   25 and name   HG) (resid   25 and name   HN) 3.133 1.227 1.227 weight 1.000 ! spec=NOESY, no=138, id=131, vol=4.800000e+05
assign (resid   25 and name   HG) (resid   25 and name   HA) 3.213 1.291 1.291 weight 1.000 ! spec=NOESY, no=139, id=132, vol=4.120000e+05
assign (resid   25 and name   HG) (resid   25 and name  HB2) 1.957 0.479 0.479 weight 1.000 ! spec=NOESY, no=140, id=133, vol=8.080000e+06
assign (resid   24 and name  HB2) (resid   24 and name   HN) 2.689 0.904 0.904 weight 1.000 ! spec=NOESY, no=142, id=135, vol=1.200000e+06
assign (resid   15 and name  HB2) (resid   15 and name   HN) 2.737 0.936 0.936 weight 1.000 ! spec=NOESY, no=144, id=137, vol=1.080000e+06
assign (resid   24 and name  HB2) (resid   25 and name   HN) 3.133 1.227 1.227 weight 1.000 ! spec=NOESY, no=146, id=139, vol=4.800000e+05
assign (resid   15 and name  HB2) (resid   16 and name   HA) 3.019 1.139 1.139 weight 1.000 ! spec=NOESY, no=147, id=140, vol=5.990000e+05
assign (resid   15 and name   HA) (resid   16 and name   HN) 3.118 1.215 1.215 weight 1.000 ! spec=NOESY, no=148, id=141, vol=4.940000e+05
assign (resid   11 and name   HA) (resid   14 and name   HN) 3.105 1.205 1.205 weight 1.000 ! spec=NOESY, no=149, id=142, vol=5.060000e+05
assign (resid   12 and name   HA) (resid   15 and name   HN) 3.178 1.263 1.263 weight 1.000 ! spec=NOESY, no=150, id=143, vol=4.400000e+05
assign (resid   15 and name   HN) (resid   16 and name   HN) 3.086 1.191 1.191 weight 1.000 ! spec=NOESY, no=151, id=144, vol=5.250000e+05
assign (resid   11 and name   HN) (resid   12 and name   HN) 3.905 1.906 1.906 weight 1.000 ! spec=NOESY, no=152, id=145, vol=1.280000e+05
assign (resid   21 and name   HA) (resid   24 and name  HD1) 2.741 0.939 0.939 weight 1.000 ! spec=NOESY, no=153, id=146, vol=1.070000e+06
assign (resid   24 and name  HB2) (resid   24 and name  HD1) 2.358 0.695 0.695 weight 1.000 ! spec=NOESY, no=154, id=147, vol=2.640000e+06
assign (resid   24 and name   HA) (resid   24 and name   HN) 2.537 0.805 0.805 weight 1.000 ! spec=NOESY, no=156, id=149, vol=1.700000e+06
assign (resid   24 and name  HE1) (resid   24 and name  HD1) 2.122 0.563 0.563 weight 1.000 ! spec=NOESY, no=159, id=151, vol=4.970000e+06
assign (resid   24 and name   HA) (resid   25 and name   HN) 2.804 0.983 0.983 weight 1.000 ! spec=NOESY, no=160, id=152, vol=9.330000e+05
assign (resid   10 and name   HA) (resid   13 and name   HN) 3.041 1.156 1.156 weight 1.000 ! spec=NOESY, no=161, id=153, vol=5.730000e+05
assign (resid   21 and name   HA) (resid   22 and name   HN) 2.558 0.818 0.818 weight 1.000 ! spec=NOESY, no=162, id=154, vol=1.620000e+06
assign (resid   23 and name   HA) (resid   24 and name   HN) 3.452 1.490 1.490 weight 1.000 ! spec=NOESY, no=163, id=155, vol=2.680000e+05
assign (resid   21 and name  HB2) (resid   20 and name   HN) 3.117 1.214 1.214 weight 1.000 ! spec=NOESY, no=164, id=156, vol=4.950000e+05
assign (resid   16 and name   HB) (resid   17 and name   HN) 2.911 1.059 1.059 weight 1.000 ! spec=NOESY, no=165, id=157, vol=7.460000e+05
assign (resid   12 and name   HB) (resid   13 and name   HN) 2.833 1.003 1.003 weight 1.000 ! spec=NOESY, no=166, id=158, vol=8.780000e+05
assign (resid   25 and name  HB2) (resid   24 and name  HD1) 2.724 0.928 0.928 weight 1.000 ! spec=NOESY, no=167, id=159, vol=1.110000e+06
assign (resid   20 and name  HB#) (resid   23 and name  HE#) 3.162 1.250 1.250 weight 1.000 ! spec=NOESY, no=168, id=160, vol=4.540000e+05
assign (resid   22 and name HG#1) (resid   23 and name   HN) 3.444 1.482 1.482 weight 1.000 ! spec=NOESY, no=169, id=161, vol=2.720000e+05
assign (resid    9 and name  HB#) (resid    8 and name   HN) 3.338 1.393 1.393 weight 1.000 ! spec=NOESY, no=170, id=162, vol=3.280000e+05
assign (resid   25 and name HD#2) (resid   24 and name  HD#) 2.463 0.759 0.759 weight 1.000 ! spec=NOESY, no=171, id=163, vol=2.030000e+06
assign (resid   25 and name HD#2) (resid   24 and name  HE#) 2.811 0.988 0.988 weight 1.000 ! spec=NOESY, no=172, id=164, vol=9.200000e+05
assign (resid   20 and name  HB#) (resid   24 and name  HE#) 3.689 1.701 1.701 weight 1.000 ! spec=NOESY, no=173, id=165, vol=1.800000e+05
assign (resid   16 and name   HA) (resid   19 and name   HN) 3.379 1.427 1.427 weight 1.000 ! spec=NOESY, no=174, id=166, vol=3.050000e+05
assign (resid    2 and name   HA) (resid    2 and name   HN) 3.019 1.139 1.139 weight 1.000 ! spec=NOESY, no=175, id=167, vol=5.990000e+05
assign (resid    3 and name   HN) (resid    4 and name   HN) 3.302 1.363 1.363 weight 1.000 ! spec=NOESY, no=176, id=168, vol=3.500000e+05
assign (resid    1 and name  HT#) (resid    2 and name   HN) 3.233 1.307 1.307 weight 1.000 ! spec=NOESY, no=177, id=169, vol=3.970000e+05
assign (resid    4 and name   HA) (resid    5 and name   HN) 3.320 1.377 1.377 weight 1.000 ! spec=NOESY, no=178, id=170, vol=3.390000e+05
assign (resid   19 and name   HN) (resid   21 and name   HN) 5.646 3.985 3.985 weight 1.000 ! spec=NOESY, no=179, id=171, vol=1.400000e+04
assign (resid   22 and name   HN) (resid   20 and name   HN) 2.992 1.119 1.119 weight 1.000 ! spec=NOESY, no=180, id=172, vol=6.320000e+05
assign (resid   16 and name   HN) (resid   17 and name   HN) 2.794 0.976 0.976 weight 1.000 ! spec=NOESY, no=181, id=173, vol=9.530000e+05
assign (resid   17 and name  HA2) (resid   20 and name   HN) 3.038 1.154 1.154 weight 1.000 ! spec=NOESY, no=182, id=174, vol=5.770000e+05
assign (resid   13 and name  HA2) (resid   16 and name   HN) 3.936 1.936 1.936 weight 1.000 ! spec=NOESY, no=183, id=175, vol=1.220000e+05
assign (resid   16 and name   HA) (resid   18 and name   HN) 2.504 0.784 0.784 weight 1.000 ! spec=NOESY, no=184, id=176, vol=1.840000e+06
assign (resid   16 and name   HB) (resid   15 and name   HN) 4.116 2.118 2.118 weight 1.000 ! spec=NOESY, no=185, id=177, vol=9.330000e+04
assign (resid    4 and name  HB2) (resid    4 and name   HN) 2.511 0.788 0.788 weight 1.000 ! spec=NOESY, no=186, id=178, vol=1.810000e+06
assign (resid   18 and name   HA) (resid   21 and name   HN) 3.507 1.537 1.537 weight 1.000 ! spec=NOESY, no=187, id=179, vol=2.440000e+05
assign (resid    4 and name   HA) (resid    4 and name   HN) 3.221 1.297 1.297 weight 1.000 ! spec=NOESY, no=188, id=180, vol=4.060000e+05
assign (resid    5 and name   HN) (resid    4 and name   HN) 3.613 1.632 1.632 weight 1.000 ! spec=NOESY, no=189, id=181, vol=2.040000e+05
assign (resid    2 and name   HA) (resid    4 and name   HN) 3.998 1.998 1.998 weight 1.000 ! spec=NOESY, no=190, id=182, vol=1.110000e+05
assign (resid   14 and name  HD2) (resid   17 and name   HN) 3.637 1.653 1.653 weight 1.000 ! spec=NOESY, no=191, id=183, vol=1.960000e+05
assign (resid   16 and name   HB) (resid   18 and name   HN) 2.952 1.089 1.089 weight 1.000 ! spec=NOESY, no=192, id=184, vol=6.860000e+05
assign (resid   14 and name   HA) (resid   17 and name   HN) 3.235 1.308 1.308 weight 1.000 ! spec=NOESY, no=193, id=185, vol=3.960000e+05
assign (resid    3 and name  HA2) (resid    3 and name   HN) 2.772 0.960 0.960 weight 1.000 ! spec=NOESY, no=194, id=186, vol=1.000000e+06
assign (resid   22 and name   HA) (resid   22 and name   HB) 3.180 1.264 1.264 weight 1.000 ! spec=NOESY, no=195, id=187, vol=4.390000e+05
assign (resid    3 and name   HN) (resid    2 and name   HN) 4.740 2.808 2.808 weight 1.000 ! spec=NOESY, no=197, id=189, vol=4.000000e+04
assign (resid   14 and name   HA) (resid   15 and name   HN) 2.967 1.100 1.100 weight 1.000 ! spec=NOESY, no=198, id=190, vol=6.650000e+05
assign (resid   13 and name  HA2) (resid   14 and name   HN) 2.566 0.823 0.823 weight 1.000 ! spec=NOESY, no=199, id=191, vol=1.590000e+06
assign (resid    2 and name   HA) (resid    5 and name   HN) 3.485 1.519 1.519 weight 1.000 ! spec=NOESY, no=200, id=192, vol=2.530000e+05

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1  19.747   1.403   4.465
    2    H2   GLY   1           HT2      GLY   1  20.833   0.196   4.947
    3    H3   GLY   1           HT3      GLY   1  19.162  -0.075   5.056
    4    HA2  GLY   1           HA2      GLY   1  20.707   0.281   2.548
    5    HA3  GLY   1           HA3      GLY   1  20.090  -1.244   3.164
    6    H    TRP   2           H        TRP   2  17.938  -1.760   2.912
    7    HA   TRP   2           HA       TRP   2  16.449   0.079   1.142
    8    HB2  TRP   2           HB3      TRP   2  16.166  -2.930   1.276
    9    HB3  TRP   2           HB2      TRP   2  15.446  -1.844   0.089
   10    HD1  TRP   2           HD1      TRP   2  18.517  -3.877   0.744
   11    HE1  TRP   2           HE1      TRP   2  20.227  -3.537  -1.149
   12    HE3  TRP   2           HE3      TRP   2  16.329   0.113  -1.602
   13    HZ2  TRP   2           HZ2      TRP   2  20.594  -1.800  -3.342
   14    HZ3  TRP   2           HZ3      TRP   2  17.432   1.055  -3.588
   15    HH2  TRP   2           HH2      TRP   2  19.519   0.120  -4.438
   16    H    GLY   3           H        GLY   3  16.519  -0.481   4.208
   17    HA2  GLY   3           HA3      GLY   3  13.900  -1.460   4.808
   18    HA3  GLY   3           HA2      GLY   3  15.008  -0.688   5.938
   19    H    SER   4           H        SER   4  15.102   1.572   3.820
   20    HA   SER   4           HA       SER   4  13.102   3.198   5.045
   21    HB2  SER   4           HB3      SER   4  14.833   3.769   2.628
   22    HB3  SER   4           HB2      SER   4  13.923   4.963   3.552
   23    HG   SER   4           HG       SER   4  15.965   3.295   4.623
   24    H    PHE   5           H        PHE   5  12.636   0.816   2.967
   25    HA   PHE   5           HA       PHE   5  10.573   2.227   1.412
   26    HB2  PHE   5           HB3      PHE   5  12.011  -0.380   0.882
   27    HB3  PHE   5           HB2      PHE   5  10.634   0.184  -0.059
   28    HD1  PHE   5           HD2      PHE   5  14.168   0.765   0.738
   29    HD2  PHE   5           HD1      PHE   5  10.861   1.952  -1.658
   30    HE1  PHE   5           HE2      PHE   5  15.690   2.035  -0.722
   31    HE2  PHE   5           HE1      PHE   5  12.376   3.225  -3.126
   32    HZ   PHE   5           HZ       PHE   5  14.792   3.266  -2.657
   33    H    PHE   6           H        PHE   6   9.835   1.878   3.904
   34    HA   PHE   6           HA       PHE   6   8.841  -0.577   4.774
   35    HB2  PHE   6           HB3      PHE   6   7.684   2.155   5.361
   36    HB3  PHE   6           HB2      PHE   6   7.459   0.702   6.323
   37    HD1  PHE   6           HD2      PHE   6   9.334  -0.210   7.638
   38    HD2  PHE   6           HD1      PHE   6   9.635   3.488   5.557
   39    HE1  PHE   6           HE2      PHE   6  11.294   0.392   8.999
   40    HE2  PHE   6           HE1      PHE   6  11.594   4.100   6.912
   41    HZ   PHE   6           HZ       PHE   6  12.424   2.548   8.637
   42    H    LYS   7           H        LYS   7   7.637  -1.776   3.367
   43    HA   LYS   7           HA       LYS   7   6.058  -2.345   1.837
   44    HB2  LYS   7           HB3      LYS   7   4.580  -1.045   4.082
   45    HB3  LYS   7           HB2      LYS   7   3.689  -1.598   2.673
   46    HG2  LYS   7           HG3      LYS   7   3.624  -3.322   4.305
   47    HG3  LYS   7           HG2      LYS   7   4.683  -3.856   3.007
   48    HD2  LYS   7           HD3      LYS   7   5.727  -4.450   5.062
   49    HD3  LYS   7           HD2      LYS   7   6.612  -3.069   4.408
   50    HE2  LYS   7           HE3      LYS   7   5.436  -1.567   5.905
   51    HE3  LYS   7           HE2      LYS   7   4.454  -2.901   6.511
   52    HZ1  LYS   7           HZ1      LYS   7   6.215  -2.427   8.047
   53    HZ2  LYS   7           HZ2      LYS   7   7.390  -2.573   6.834
   54    HZ3  LYS   7           HZ3      LYS   7   6.517  -3.939   7.336
   55    H    LYS   8           H        LYS   8   7.284  -0.564   0.534
   56    HA   LYS   8           HA       LYS   8   6.173   1.921   0.090
   57    HB2  LYS   8           HB3      LYS   8   7.600   2.177  -1.761
   58    HB3  LYS   8           HB2      LYS   8   8.456   1.112  -0.658
   59    HG2  LYS   8           HG3      LYS   8   6.898   0.209  -3.080
   60    HG3  LYS   8           HG2      LYS   8   8.647   0.422  -3.010
   61    HD2  LYS   8           HD3      LYS   8   7.167  -1.385  -1.129
   62    HD3  LYS   8           HD2      LYS   8   7.740  -1.950  -2.702
   63    HE2  LYS   8           HE3      LYS   8  10.038  -1.269  -2.046
   64    HE3  LYS   8           HE2      LYS   8   9.417  -0.833  -0.456
   65    HZ1  LYS   8           HZ1      LYS   8  10.413  -3.049  -0.474
   66    HZ2  LYS   8           HZ2      LYS   8   9.293  -3.555  -1.646
   67    HZ3  LYS   8           HZ3      LYS   8   8.759  -3.120  -0.099
   68    H    ALA   9           H        ALA   9   5.182  -1.098  -1.110
   69    HA   ALA   9           HA       ALA   9   3.638  -0.062  -3.314
   70    HB1  ALA   9           HB1      ALA   9   4.663  -2.284  -3.440
   71    HB2  ALA   9           HB2      ALA   9   2.912  -2.371  -3.626
   72    HB3  ALA   9           HB3      ALA   9   3.658  -2.824  -2.095
   73    H    ALA  10           H        ALA  10   3.054  -1.130  -0.019
   74    HA   ALA  10           HA       ALA  10   0.202  -1.100  -0.230
   75    HB1  ALA  10           HB1      ALA  10   1.399  -2.504   1.408
   76    HB2  ALA  10           HB2      ALA  10   0.201  -1.453   2.165
   77    HB3  ALA  10           HB3      ALA  10   1.915  -1.045   2.255
   78    H    HIS  11           H        HIS  11   2.681   1.151   0.779
   79    HA   HIS  11           HA       HIS  11   1.093   3.106   1.998
   80    HB2  HIS  11           HB3      HIS  11   3.628   2.961   1.951
   81    HB3  HIS  11           HB2      HIS  11   3.558   3.649   0.332
   82    HD1  HIS  11           HD1      HIS  11   3.878   4.573   3.776
   83    HD2  HIS  11           HD2      HIS  11   2.207   6.320   0.390
   84    HE1  HIS  11           HE1      HIS  11   3.654   7.025   4.313
   85    HE2  HIS  11           HE2      HIS  11   2.481   8.023   2.318
   86    H    VAL  12           H        VAL  12   1.842   2.502  -1.386
   87    HA   VAL  12           HA       VAL  12   0.478   4.887  -2.287
   88    HB   VAL  12           HB       VAL  12   1.475   2.546  -3.927
   89   HG11  VAL  12          HG11      VAL  12  -0.125   3.899  -5.134
   90   HG12  VAL  12          HG12      VAL  12   1.495   4.180  -5.773
   91   HG13  VAL  12          HG13      VAL  12   0.753   5.368  -4.702
   92   HG21  VAL  12          HG21      VAL  12   2.871   5.130  -3.227
   93   HG22  VAL  12          HG22      VAL  12   3.460   3.920  -4.367
   94   HG23  VAL  12          HG23      VAL  12   3.309   3.517  -2.658
   95    H    GLY  13           H        GLY  13  -0.188   1.468  -1.933
   96    HA2  GLY  13           HA3      GLY  13  -2.502   1.348  -3.557
   97    HA3  GLY  13           HA2      GLY  13  -2.073   0.212  -2.287
   98    H    LYS  14           H        LYS  14  -2.084   1.969  -0.081
   99    HA   LYS  14           HA       LYS  14  -4.837   1.914   0.527
  100    HB2  LYS  14           HB3      LYS  14  -4.199   2.832   2.681
  101    HB3  LYS  14           HB2      LYS  14  -3.086   1.571   2.182
  102    HG2  LYS  14           HG3      LYS  14  -1.675   3.171   3.069
  103    HG3  LYS  14           HG2      LYS  14  -1.602   3.498   1.339
  104    HD2  LYS  14           HD3      LYS  14  -1.786   5.564   2.646
  105    HD3  LYS  14           HD2      LYS  14  -3.191   5.335   1.606
  106    HE2  LYS  14           HE3      LYS  14  -4.452   4.454   3.514
  107    HE3  LYS  14           HE2      LYS  14  -3.048   4.701   4.553
  108    HZ1  LYS  14           HZ1      LYS  14  -4.489   6.851   3.094
  109    HZ2  LYS  14           HZ2      LYS  14  -3.188   7.063   4.158
  110    HZ3  LYS  14           HZ3      LYS  14  -4.677   6.497   4.743
  111    H    HIS  15           H        HIS  15  -3.127   4.189  -1.227
  112    HA   HIS  15           HA       HIS  15  -4.200   6.640  -0.377
  113    HB2  HIS  15           HB3      HIS  15  -2.369   6.119  -2.162
  114    HB3  HIS  15           HB2      HIS  15  -3.728   6.015  -3.277
  115    HD1  HIS  15           HD1      HIS  15  -4.236   8.128  -4.435
  116    HD2  HIS  15           HD2      HIS  15  -2.419   8.782  -0.751
  117    HE1  HIS  15           HE1      HIS  15  -3.901  10.615  -4.277
  118    HE2  HIS  15           HE2      HIS  15  -2.558  10.942  -2.172
  119    H    VAL  16           H        VAL  16  -5.420   4.159  -2.554
  120    HA   VAL  16           HA       VAL  16  -7.934   5.625  -2.835
  121    HB   VAL  16           HB       VAL  16  -8.495   3.739  -4.412
  122   HG11  VAL  16          HG11      VAL  16  -7.284   4.789  -6.278
  123   HG12  VAL  16          HG12      VAL  16  -6.231   5.599  -5.119
  124   HG13  VAL  16          HG13      VAL  16  -7.948   5.993  -5.171
  125   HG21  VAL  16          HG21      VAL  16  -5.523   3.287  -4.258
  126   HG22  VAL  16          HG22      VAL  16  -6.606   2.567  -5.449
  127   HG23  VAL  16          HG23      VAL  16  -6.775   2.159  -3.742
  128    H    GLY  17           H        GLY  17  -7.454   4.682  -0.376
  129    HA2  GLY  17           HA3      GLY  17  -8.304   2.071   0.220
  130    HA3  GLY  17           HA2      GLY  17  -8.249   3.406   1.356
  131    H    LYS  18           H        LYS  18 -10.113   4.720  -0.810
  132    HA   LYS  18           HA       LYS  18 -12.503   4.404   0.608
  133    HB2  LYS  18           HB3      LYS  18 -12.141   5.316  -2.251
  134    HB3  LYS  18           HB2      LYS  18 -13.580   5.558  -1.276
  135    HG2  LYS  18           HG3      LYS  18 -12.571   7.598  -1.091
  136    HG3  LYS  18           HG2      LYS  18 -11.936   6.781   0.338
  137    HD2  LYS  18           HD3      LYS  18  -9.871   6.268  -0.844
  138    HD3  LYS  18           HD2      LYS  18 -10.512   6.996  -2.319
  139    HE2  LYS  18           HE3      LYS  18 -10.714   9.152  -1.070
  140    HE3  LYS  18           HE2      LYS  18  -9.885   8.384   0.282
  141    HZ1  LYS  18           HZ1      LYS  18  -8.762   8.728  -2.451
  142    HZ2  LYS  18           HZ2      LYS  18  -7.959   8.035  -1.124
  143    HZ3  LYS  18           HZ3      LYS  18  -8.377   9.676  -1.102
  144    H    ALA  19           H        ALA  19 -11.167   2.692  -2.131
  145    HA   ALA  19           HA       ALA  19 -13.577   1.000  -2.216
  146    HB1  ALA  19           HB1      ALA  19 -12.923   0.389  -4.482
  147    HB2  ALA  19           HB2      ALA  19 -11.483   1.397  -4.349
  148    HB3  ALA  19           HB3      ALA  19 -13.083   2.139  -4.330
  149    H    ALA  20           H        ALA  20 -11.084   0.932  -0.463
  150    HA   ALA  20           HA       ALA  20 -10.087  -1.737  -1.209
  151    HB1  ALA  20           HB1      ALA  20  -8.903   0.299   0.669
  152    HB2  ALA  20           HB2      ALA  20  -8.339  -0.072  -0.960
  153    HB3  ALA  20           HB3      ALA  20  -8.218  -1.285   0.314
  154    H    LEU  21           H        LEU  21 -12.201  -0.179   0.849
  155    HA   LEU  21           HA       LEU  21 -11.860  -1.563   3.269
  156    HB2  LEU  21           HB3      LEU  21 -14.255  -0.916   3.687
  157    HB3  LEU  21           HB2      LEU  21 -13.159   0.398   3.318
  158    HG   LEU  21           HG       LEU  21 -14.050   0.193   0.903
  159   HD11  LEU  21          HD11      LEU  21 -15.223  -1.928   1.168
  160   HD12  LEU  21          HD12      LEU  21 -16.343  -0.637   0.732
  161   HD13  LEU  21          HD13      LEU  21 -16.263  -1.210   2.398
  162   HD21  LEU  21          HD21      LEU  21 -15.827   1.195   3.122
  163   HD22  LEU  21          HD22      LEU  21 -15.915   1.678   1.427
  164   HD23  LEU  21          HD23      LEU  21 -14.490   2.077   2.387
  165    H    THR  22           H        THR  22 -12.823  -2.707   0.290
  166    HA   THR  22           HA       THR  22 -14.695  -4.710   1.134
  167    HB   THR  22           HB       THR  22 -13.121  -4.966  -1.394
  168    HG1  THR  22           HG1      THR  22 -14.022  -3.214  -2.277
  169   HG21  THR  22          HG21      THR  22 -14.874  -6.593  -0.894
  170   HG22  THR  22          HG22      THR  22 -15.325  -5.609  -2.286
  171   HG23  THR  22          HG23      THR  22 -16.048  -5.290  -0.710
  172    H    HIS  23           H        HIS  23 -11.274  -4.410   1.110
  173    HA   HIS  23           HA       HIS  23 -10.988  -7.144   2.053
  174    HB2  HIS  23           HB3      HIS  23  -9.030  -7.535   0.508
  175    HB3  HIS  23           HB2      HIS  23 -10.606  -7.540  -0.271
  176    HD1  HIS  23           HD1      HIS  23 -10.890  -6.033  -2.235
  177    HD2  HIS  23           HD2      HIS  23  -7.533  -5.071   0.039
  178    HE1  HIS  23           HE1      HIS  23  -9.667  -4.249  -3.532
  179    HE2  HIS  23           HE2      HIS  23  -7.575  -3.773  -2.201
  180    H    TYR  24           H        TYR  24 -10.847  -5.011   3.623
  181    HA   TYR  24           HA       TYR  24  -8.122  -4.994   4.519
  182    HB2  TYR  24           HB3      TYR  24  -7.901  -3.304   2.815
  183    HB3  TYR  24           HB2      TYR  24  -9.342  -2.472   3.382
  184    HD1  TYR  24           HD2      TYR  24  -5.841  -3.314   4.278
  185    HD2  TYR  24           HD1      TYR  24  -9.212  -0.834   5.074
  186    HE1  TYR  24           HE2      TYR  24  -4.444  -1.873   5.699
  187    HE2  TYR  24           HE1      TYR  24  -7.817   0.613   6.487
  188    HH   TYR  24           HH       TYR  24  -4.425   0.431   6.528
  189    H    LEU  25           H        LEU  25 -11.044  -2.974   4.751
  190    HA   LEU  25           HA       LEU  25 -10.653  -2.686   7.595
  191    HB2  LEU  25           HB3      LEU  25 -11.213  -0.800   6.062
  192    HB3  LEU  25           HB2      LEU  25 -12.769  -1.544   5.776
  193    HG   LEU  25           HG       LEU  25 -13.280  -1.317   8.183
  194   HD11  LEU  25          HD11      LEU  25 -11.875   0.153   9.539
  195   HD12  LEU  25          HD12      LEU  25 -10.719   0.276   8.209
  196   HD13  LEU  25          HD13      LEU  25 -10.982  -1.274   9.008
  197   HD21  LEU  25          HD21      LEU  25 -13.733   1.057   8.069
  198   HD22  LEU  25          HD22      LEU  25 -14.006   0.306   6.493
  199   HD23  LEU  25          HD23      LEU  25 -12.540   1.240   6.782
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1  16.924   1.216  -7.400
    2    H2   GLY   1           HT2      GLY   1  18.168   2.036  -8.209
    3    H3   GLY   1           HT3      GLY   1  16.793   1.531  -9.059
    4    HA2  GLY   1           HA2      GLY   1  16.720   3.508  -6.849
    5    HA3  GLY   1           HA3      GLY   1  16.845   3.954  -8.544
    6    H    TRP   2           H        TRP   2  15.077   3.624  -9.924
    7    HA   TRP   2           HA       TRP   2  12.546   3.983  -8.704
    8    HB2  TRP   2           HB3      TRP   2  11.666   3.840 -11.041
    9    HB3  TRP   2           HB2      TRP   2  12.981   4.994 -10.856
   10    HD1  TRP   2           HD1      TRP   2  15.247   4.496 -12.149
   11    HE1  TRP   2           HE1      TRP   2  15.871   2.838 -14.022
   12    HE3  TRP   2           HE3      TRP   2  11.151   1.442 -11.927
   13    HZ2  TRP   2           HZ2      TRP   2  14.766   0.554 -15.243
   14    HZ3  TRP   2           HZ3      TRP   2  11.009  -0.455 -13.488
   15    HH2  TRP   2           HH2      TRP   2  12.781  -0.887 -15.112
   16    H    GLY   3           H        GLY   3  10.776   2.637  -8.567
   17    HA2  GLY   3           HA3      GLY   3   9.557   0.674  -8.644
   18    HA3  GLY   3           HA2      GLY   3  10.849  -0.066  -9.577
   19    H    SER   4           H        SER   4  12.634   0.996  -7.232
   20    HA   SER   4           HA       SER   4  12.476  -1.465  -5.724
   21    HB2  SER   4           HB3      SER   4  14.365   0.872  -5.370
   22    HB3  SER   4           HB2      SER   4  14.558  -0.755  -4.714
   23    HG   SER   4           HG       SER   4  15.771  -0.714  -6.540
   24    H    PHE   5           H        PHE   5  10.397   0.683  -5.550
   25    HA   PHE   5           HA       PHE   5  10.574   1.332  -2.681
   26    HB2  PHE   5           HB3      PHE   5   8.705   2.421  -4.804
   27    HB3  PHE   5           HB2      PHE   5   8.757   2.939  -3.124
   28    HD1  PHE   5           HD2      PHE   5  10.666   4.237  -2.284
   29    HD2  PHE   5           HD1      PHE   5  10.311   3.185  -6.393
   30    HE1  PHE   5           HE2      PHE   5  12.351   5.937  -2.862
   31    HE2  PHE   5           HE1      PHE   5  11.995   4.882  -6.979
   32    HZ   PHE   5           HZ       PHE   5  13.017   6.259  -5.209
   33    H    PHE   6           H        PHE   6   9.768  -1.229  -4.162
   34    HA   PHE   6           HA       PHE   6   6.982  -1.546  -3.964
   35    HB2  PHE   6           HB3      PHE   6   7.436  -3.960  -4.285
   36    HB3  PHE   6           HB2      PHE   6   8.257  -2.935  -5.456
   37    HD1  PHE   6           HD1      PHE   6  10.701  -2.527  -5.225
   38    HD2  PHE   6           HD2      PHE   6   8.637  -5.383  -2.835
   39    HE1  PHE   6           HE1      PHE   6  12.838  -3.607  -4.681
   40    HE2  PHE   6           HE2      PHE   6  10.776  -6.467  -2.283
   41    HZ   PHE   6           HZ       PHE   6  12.878  -5.579  -3.206
   42    H    LYS   7           H        LYS   7   9.406  -1.741  -1.496
   43    HA   LYS   7           HA       LYS   7   7.991  -3.499   0.222
   44    HB2  LYS   7           HB3      LYS   7  10.185  -1.494   0.724
   45    HB3  LYS   7           HB2      LYS   7   9.557  -2.577   1.939
   46    HG2  LYS   7           HG3      LYS   7  10.949  -3.370  -0.600
   47    HG3  LYS   7           HG2      LYS   7  11.606  -3.459   1.035
   48    HD2  LYS   7           HD3      LYS   7   9.187  -4.977   0.055
   49    HD3  LYS   7           HD2      LYS   7  10.814  -5.648   0.192
   50    HE2  LYS   7           HE3      LYS   7  10.790  -5.314   2.582
   51    HE3  LYS   7           HE2      LYS   7   9.236  -4.485   2.483
   52    HZ1  LYS   7           HZ1      LYS   7   8.998  -6.792   3.200
   53    HZ2  LYS   7           HZ2      LYS   7   9.706  -7.332   1.755
   54    HZ3  LYS   7           HZ3      LYS   7   8.216  -6.519   1.722
   55    H    LYS   8           H        LYS   8   8.019  -0.021  -0.287
   56    HA   LYS   8           HA       LYS   8   6.006   0.295   1.814
   57    HB2  LYS   8           HB3      LYS   8   7.761   2.268   0.356
   58    HB3  LYS   8           HB2      LYS   8   6.399   2.774   1.343
   59    HG2  LYS   8           HG3      LYS   8   8.331   2.970   2.663
   60    HG3  LYS   8           HG2      LYS   8   7.452   1.573   3.268
   61    HD2  LYS   8           HD3      LYS   8   9.721   0.935   3.220
   62    HD3  LYS   8           HD2      LYS   8   8.995   0.179   1.804
   63    HE2  LYS   8           HE3      LYS   8   9.874   1.926   0.377
   64    HE3  LYS   8           HE2      LYS   8  10.521   2.777   1.777
   65    HZ1  LYS   8           HZ1      LYS   8  11.868   0.712   2.203
   66    HZ2  LYS   8           HZ2      LYS   8  12.307   1.612   0.835
   67    HZ3  LYS   8           HZ3      LYS   8  11.412   0.187   0.656
   68    H    ALA   9           H        ALA   9   5.857  -0.711  -1.117
   69    HA   ALA   9           HA       ALA   9   4.480   1.185  -2.658
   70    HB1  ALA   9           HB1      ALA   9   5.579  -0.763  -3.626
   71    HB2  ALA   9           HB2      ALA   9   3.887  -0.668  -4.116
   72    HB3  ALA   9           HB3      ALA   9   4.381  -1.819  -2.874
   73    H    ALA  10           H        ALA  10   3.311  -1.315  -0.453
   74    HA   ALA  10           HA       ALA  10   0.596  -1.206  -1.118
   75    HB1  ALA  10           HB1      ALA  10   0.173  -2.212   1.057
   76    HB2  ALA  10           HB2      ALA  10   1.805  -1.801   1.579
   77    HB3  ALA  10           HB3      ALA  10   1.562  -2.967   0.277
   78    H    HIS  11           H        HIS  11   2.544   0.968   0.771
   79    HA   HIS  11           HA       HIS  11   0.475   2.274   2.192
   80    HB2  HIS  11           HB3      HIS  11   3.245   3.119   1.363
   81    HB3  HIS  11           HB2      HIS  11   2.170   4.209   2.229
   82    HD1  HIS  11           HD1      HIS  11   3.830   0.816   2.691
   83    HD2  HIS  11           HD2      HIS  11   2.196   3.914   4.933
   84    HE1  HIS  11           HE1      HIS  11   4.342   0.262   5.082
   85    HE2  HIS  11           HE2      HIS  11   3.193   2.049   6.428
   86    H    VAL  12           H        VAL  12   1.950   2.846  -0.957
   87    HA   VAL  12           HA       VAL  12   0.237   5.142  -1.468
   88    HB   VAL  12           HB       VAL  12   2.277   3.818  -3.273
   89   HG11  VAL  12          HG11      VAL  12   0.956   6.518  -3.455
   90   HG12  VAL  12          HG12      VAL  12   0.642   5.138  -4.503
   91   HG13  VAL  12          HG13      VAL  12   2.225   5.917  -4.523
   92   HG21  VAL  12          HG21      VAL  12   3.303   4.671  -1.222
   93   HG22  VAL  12          HG22      VAL  12   2.567   6.248  -1.510
   94   HG23  VAL  12          HG23      VAL  12   3.781   5.625  -2.627
   95    H    GLY  13           H        GLY  13   0.583   1.793  -2.392
   96    HA2  GLY  13           HA3      GLY  13  -1.118   1.713  -4.603
   97    HA3  GLY  13           HA2      GLY  13  -0.776   0.360  -3.542
   98    H    LYS  14           H        LYS  14  -1.849   1.552  -1.173
   99    HA   LYS  14           HA       LYS  14  -4.647   1.124  -1.637
  100    HB2  LYS  14           HB3      LYS  14  -4.887   1.248   0.755
  101    HB3  LYS  14           HB2      LYS  14  -3.488   0.267   0.347
  102    HG2  LYS  14           HG3      LYS  14  -1.997   2.076   0.900
  103    HG3  LYS  14           HG2      LYS  14  -3.372   3.133   1.234
  104    HD2  LYS  14           HD3      LYS  14  -4.058   1.749   3.068
  105    HD3  LYS  14           HD2      LYS  14  -2.821   0.548   2.686
  106    HE2  LYS  14           HE3      LYS  14  -2.016   1.841   4.519
  107    HE3  LYS  14           HE2      LYS  14  -1.099   2.303   3.086
  108    HZ1  LYS  14           HZ1      LYS  14  -3.190   3.824   4.508
  109    HZ2  LYS  14           HZ2      LYS  14  -2.823   4.167   2.891
  110    HZ3  LYS  14           HZ3      LYS  14  -1.619   4.315   4.078
  111    H    HIS  15           H        HIS  15  -3.610   3.363  -2.995
  112    HA   HIS  15           HA       HIS  15  -4.185   5.854  -1.910
  113    HB2  HIS  15           HB3      HIS  15  -3.156   5.404  -4.155
  114    HB3  HIS  15           HB2      HIS  15  -4.749   4.940  -4.743
  115    HD1  HIS  15           HD1      HIS  15  -4.356   6.900  -6.514
  116    HD2  HIS  15           HD2      HIS  15  -4.820   8.101  -2.559
  117    HE1  HIS  15           HE1      HIS  15  -4.870   9.362  -6.604
  118    HE2  HIS  15           HE2      HIS  15  -5.310  10.022  -4.216
  119    H    VAL  16           H        VAL  16  -6.273   3.280  -2.841
  120    HA   VAL  16           HA       VAL  16  -8.692   4.574  -3.293
  121    HB   VAL  16           HB       VAL  16  -8.339   1.928  -1.885
  122   HG11  VAL  16          HG11      VAL  16 -10.605   2.747  -1.788
  123   HG12  VAL  16          HG12      VAL  16 -10.509   1.388  -2.912
  124   HG13  VAL  16          HG13      VAL  16 -10.604   3.038  -3.529
  125   HG21  VAL  16          HG21      VAL  16  -7.028   2.000  -3.954
  126   HG22  VAL  16          HG22      VAL  16  -8.476   2.460  -4.849
  127   HG23  VAL  16          HG23      VAL  16  -8.385   0.880  -4.072
  128    H    GLY  17           H        GLY  17  -8.128   2.779  -0.258
  129    HA2  GLY  17           HA3      GLY  17  -8.776   3.265   1.898
  130    HA3  GLY  17           HA2      GLY  17  -8.842   4.959   1.432
  131    H    LYS  18           H        LYS  18 -10.746   4.793  -0.600
  132    HA   LYS  18           HA       LYS  18 -13.102   5.169   0.827
  133    HB2  LYS  18           HB3      LYS  18 -12.694   4.574  -2.108
  134    HB3  LYS  18           HB2      LYS  18 -14.188   5.187  -1.408
  135    HG2  LYS  18           HG3      LYS  18 -13.367   7.277  -1.125
  136    HG3  LYS  18           HG2      LYS  18 -11.724   6.715  -0.827
  137    HD2  LYS  18           HD3      LYS  18 -11.851   7.941  -2.925
  138    HD3  LYS  18           HD2      LYS  18 -11.447   6.248  -3.208
  139    HE2  LYS  18           HE3      LYS  18 -13.744   5.779  -3.835
  140    HE3  LYS  18           HE2      LYS  18 -14.203   7.445  -3.479
  141    HZ1  LYS  18           HZ1      LYS  18 -12.761   8.200  -5.241
  142    HZ2  LYS  18           HZ2      LYS  18 -13.850   7.056  -5.855
  143    HZ3  LYS  18           HZ3      LYS  18 -12.242   6.617  -5.551
  144    H    ALA  19           H        ALA  19 -12.077   2.340  -1.056
  145    HA   ALA  19           HA       ALA  19 -14.438   0.883  -0.115
  146    HB1  ALA  19           HB1      ALA  19 -13.813  -0.814  -1.774
  147    HB2  ALA  19           HB2      ALA  19 -12.383   0.129  -2.191
  148    HB3  ALA  19           HB3      ALA  19 -13.992   0.780  -2.506
  149    H    ALA  20           H        ALA  20 -11.868   1.606   1.389
  150    HA   ALA  20           HA       ALA  20 -11.210  -1.129   2.270
  151    HB1  ALA  20           HB1      ALA  20  -9.315   0.014   1.217
  152    HB2  ALA  20           HB2      ALA  20  -9.023  -0.305   2.928
  153    HB3  ALA  20           HB3      ALA  20  -9.460   1.320   2.396
  154    H    LEU  21           H        LEU  21 -12.031   2.141   3.185
  155    HA   LEU  21           HA       LEU  21 -11.832   1.825   5.991
  156    HB2  LEU  21           HB3      LEU  21 -13.257   3.852   6.097
  157    HB3  LEU  21           HB2      LEU  21 -11.865   4.027   5.050
  158    HG   LEU  21           HG       LEU  21 -13.509   3.473   3.128
  159   HD11  LEU  21          HD11      LEU  21 -15.814   4.193   3.543
  160   HD12  LEU  21          HD12      LEU  21 -15.451   4.336   5.265
  161   HD13  LEU  21          HD13      LEU  21 -15.391   2.760   4.479
  162   HD21  LEU  21          HD21      LEU  21 -14.083   5.827   2.921
  163   HD22  LEU  21          HD22      LEU  21 -12.422   5.628   3.479
  164   HD23  LEU  21          HD23      LEU  21 -13.688   6.084   4.620
  165    H    THR  22           H        THR  22 -13.869   0.446   3.775
  166    HA   THR  22           HA       THR  22 -16.183   0.154   5.475
  167    HB   THR  22           HB       THR  22 -15.602  -1.570   3.080
  168    HG1  THR  22           HG1      THR  22 -16.951   0.685   2.420
  169   HG21  THR  22          HG21      THR  22 -17.649  -2.002   4.355
  170   HG22  THR  22          HG22      THR  22 -18.031  -1.371   2.752
  171   HG23  THR  22          HG23      THR  22 -18.133  -0.316   4.163
  172    H    HIS  23           H        HIS  23 -13.125  -1.204   5.297
  173    HA   HIS  23           HA       HIS  23 -13.965  -3.767   6.467
  174    HB2  HIS  23           HB3      HIS  23 -11.248  -2.920   5.429
  175    HB3  HIS  23           HB2      HIS  23 -11.666  -4.522   6.022
  176    HD1  HIS  23           HD1      HIS  23 -10.771  -3.416   3.012
  177    HD2  HIS  23           HD2      HIS  23 -14.413  -4.971   4.287
  178    HE1  HIS  23           HE1      HIS  23 -11.930  -4.220   0.936
  179    HE2  HIS  23           HE2      HIS  23 -14.217  -4.955   1.710
  180    H    TYR  24           H        TYR  24 -11.388  -1.346   6.916
  181    HA   TYR  24           HA       TYR  24 -11.385  -1.906   9.770
  182    HB2  TYR  24           HB3      TYR  24  -9.438  -0.327   9.808
  183    HB3  TYR  24           HB2      TYR  24  -9.205  -1.734   8.794
  184    HD1  TYR  24           HD1      TYR  24 -10.095   1.884   8.640
  185    HD2  TYR  24           HD2      TYR  24  -8.542  -1.495   6.578
  186    HE1  TYR  24           HE1      TYR  24  -9.423   3.337   6.776
  187    HE2  TYR  24           HE2      TYR  24  -7.870  -0.052   4.705
  188    HH   TYR  24           HH       TYR  24  -7.804   3.340   4.930
  189    H    LEU  25           H        LEU  25 -10.623   0.869  10.469
  190    HA   LEU  25           HA       LEU  25 -11.503   2.798  11.136
  191    HB2  LEU  25           HB3      LEU  25 -11.956   2.890   8.597
  192    HB3  LEU  25           HB2      LEU  25 -13.614   2.543   9.040
  193    HG   LEU  25           HG       LEU  25 -13.446   4.526  10.593
  194   HD11  LEU  25          HD11      LEU  25 -11.803   6.213  10.053
  195   HD12  LEU  25          HD12      LEU  25 -11.101   5.161   8.824
  196   HD13  LEU  25          HD13      LEU  25 -11.009   4.711  10.526
  197   HD21  LEU  25          HD21      LEU  25 -13.989   6.100   8.797
  198   HD22  LEU  25          HD22      LEU  25 -14.757   4.533   8.540
  199   HD23  LEU  25          HD23      LEU  25 -13.320   4.972   7.617
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1   8.096  -1.120 -11.592
    2    H2   GLY   1           HT2      GLY   1   7.086  -0.503 -10.380
    3    H3   GLY   1           HT3      GLY   1   6.535  -1.754 -11.385
    4    HA2  GLY   1           HA2      GLY   1   8.264  -3.221 -10.488
    5    HA3  GLY   1           HA3      GLY   1   8.727  -1.925  -9.395
    6    H    TRP   2           H        TRP   2   7.884  -4.515  -8.630
    7    HA   TRP   2           HA       TRP   2   5.703  -3.769  -6.863
    8    HB2  TRP   2           HB3      TRP   2   4.615  -4.746  -8.908
    9    HB3  TRP   2           HB2      TRP   2   5.472  -6.248  -8.589
   10    HD1  TRP   2           HD1      TRP   2   4.394  -7.896  -6.874
   11    HE1  TRP   2           HE1      TRP   2   2.250  -7.856  -5.439
   12    HE3  TRP   2           HE3      TRP   2   3.066  -3.000  -7.542
   13    HZ2  TRP   2           HZ2      TRP   2   0.274  -5.987  -4.688
   14    HZ3  TRP   2           HZ3      TRP   2   1.041  -2.166  -6.425
   15    HH2  TRP   2           HH2      TRP   2  -0.326  -3.630  -5.028
   16    H    GLY   3           H        GLY   3   7.798  -6.416  -8.003
   17    HA2  GLY   3           HA3      GLY   3   7.946  -7.738  -5.487
   18    HA3  GLY   3           HA2      GLY   3   9.063  -7.944  -6.831
   19    H    SER   4           H        SER   4   9.098  -7.308  -3.740
   20    HA   SER   4           HA       SER   4  10.438  -6.273  -2.252
   21    HB2  SER   4           HB3      SER   4  12.047  -5.662  -4.722
   22    HB3  SER   4           HB2      SER   4  12.618  -5.372  -3.079
   23    HG   SER   4           HG       SER   4  12.866  -7.484  -2.777
   24    H    PHE   5           H        PHE   5   8.492  -4.817  -4.302
   25    HA   PHE   5           HA       PHE   5   9.112  -2.098  -3.338
   26    HB2  PHE   5           HB3      PHE   5   9.229  -2.367  -5.805
   27    HB3  PHE   5           HB2      PHE   5   7.559  -2.919  -5.810
   28    HD1  PHE   5           HD1      PHE   5   9.703  -0.013  -4.959
   29    HD2  PHE   5           HD2      PHE   5   5.810  -1.391  -5.986
   30    HE1  PHE   5           HE1      PHE   5   8.951   2.316  -5.213
   31    HE2  PHE   5           HE2      PHE   5   5.048   0.934  -6.241
   32    HZ   PHE   5           HZ       PHE   5   6.622   2.790  -5.858
   33    H    PHE   6           H        PHE   6   7.172  -4.703  -2.866
   34    HA   PHE   6           HA       PHE   6   4.561  -3.718  -2.808
   35    HB2  PHE   6           HB3      PHE   6   5.161  -6.122  -2.688
   36    HB3  PHE   6           HB2      PHE   6   5.758  -5.875  -1.052
   37    HD1  PHE   6           HD2      PHE   6   2.705  -5.593  -3.142
   38    HD2  PHE   6           HD1      PHE   6   4.323  -6.075   0.766
   39    HE1  PHE   6           HE2      PHE   6   0.448  -6.027  -2.268
   40    HE2  PHE   6           HE1      PHE   6   2.069  -6.514   1.649
   41    HZ   PHE   6           HZ       PHE   6   0.127  -6.489   0.131
   42    H    LYS   7           H        LYS   7   7.137  -3.563  -0.406
   43    HA   LYS   7           HA       LYS   7   5.675  -2.688   1.797
   44    HB2  LYS   7           HB3      LYS   7   8.114  -3.367   1.630
   45    HB3  LYS   7           HB2      LYS   7   8.429  -1.756   1.007
   46    HG2  LYS   7           HG3      LYS   7   8.961  -1.739   3.282
   47    HG3  LYS   7           HG2      LYS   7   7.446  -0.851   3.130
   48    HD2  LYS   7           HD3      LYS   7   7.336  -2.325   5.054
   49    HD3  LYS   7           HD2      LYS   7   6.231  -2.902   3.807
   50    HE2  LYS   7           HE3      LYS   7   7.867  -4.567   3.110
   51    HE3  LYS   7           HE2      LYS   7   9.004  -3.974   4.318
   52    HZ1  LYS   7           HZ1      LYS   7   6.334  -5.089   4.978
   53    HZ2  LYS   7           HZ2      LYS   7   7.583  -4.714   6.057
   54    HZ3  LYS   7           HZ3      LYS   7   7.762  -6.005   4.970
   55    H    LYS   8           H        LYS   8   6.991  -0.900  -0.963
   56    HA   LYS   8           HA       LYS   8   6.029   1.626   0.031
   57    HB2  LYS   8           HB3      LYS   8   7.446   0.792  -2.487
   58    HB3  LYS   8           HB2      LYS   8   6.776   2.406  -2.314
   59    HG2  LYS   8           HG3      LYS   8   9.040   2.584  -1.759
   60    HG3  LYS   8           HG2      LYS   8   8.181   2.630  -0.223
   61    HD2  LYS   8           HD3      LYS   8  10.069   1.225   0.088
   62    HD3  LYS   8           HD2      LYS   8   8.667   0.161  -0.027
   63    HE2  LYS   8           HE3      LYS   8   9.206  -0.435  -2.270
   64    HE3  LYS   8           HE2      LYS   8  10.449   0.812  -2.365
   65    HZ1  LYS   8           HZ1      LYS   8  11.780  -0.370  -0.782
   66    HZ2  LYS   8           HZ2      LYS   8  11.355  -1.449  -2.020
   67    HZ3  LYS   8           HZ3      LYS   8  10.563  -1.517  -0.523
   68    H    ALA   9           H        ALA   9   4.966  -0.894  -1.996
   69    HA   ALA   9           HA       ALA   9   3.016   0.540  -3.491
   70    HB1  ALA   9           HB1      ALA   9   2.158  -1.630  -4.146
   71    HB2  ALA   9           HB2      ALA   9   3.100  -2.410  -2.876
   72    HB3  ALA   9           HB3      ALA   9   3.920  -1.627  -4.226
   73    H    ALA  10           H        ALA  10   3.054  -1.003  -0.367
   74    HA   ALA  10           HA       ALA  10   0.305  -1.069   0.181
   75    HB1  ALA  10           HB1      ALA  10   1.966  -2.155   1.597
   76    HB2  ALA  10           HB2      ALA  10   0.957  -1.060   2.542
   77    HB3  ALA  10           HB3      ALA  10   2.594  -0.580   2.089
   78    H    HIS  11           H        HIS  11   2.595   1.549   0.172
   79    HA   HIS  11           HA       HIS  11   1.066   3.460   1.595
   80    HB2  HIS  11           HB3      HIS  11   3.300   3.697  -0.412
   81    HB3  HIS  11           HB2      HIS  11   2.507   5.120   0.253
   82    HD1  HIS  11           HD1      HIS  11   3.898   6.085   2.019
   83    HD2  HIS  11           HD2      HIS  11   4.059   1.931   2.051
   84    HE1  HIS  11           HE1      HIS  11   5.363   5.479   3.960
   85    HE2  HIS  11           HE2      HIS  11   5.310   2.968   4.071
   86    H    VAL  12           H        VAL  12   1.303   2.595  -1.808
   87    HA   VAL  12           HA       VAL  12  -0.519   4.604  -2.711
   88    HB   VAL  12           HB       VAL  12   0.257   2.046  -4.129
   89   HG11  VAL  12          HG11      VAL  12  -0.771   4.678  -5.168
   90   HG12  VAL  12          HG12      VAL  12  -1.668   3.161  -5.096
   91   HG13  VAL  12          HG13      VAL  12  -0.268   3.310  -6.161
   92   HG21  VAL  12          HG21      VAL  12   2.256   3.281  -3.463
   93   HG22  VAL  12          HG22      VAL  12   1.608   4.741  -4.209
   94   HG23  VAL  12          HG23      VAL  12   2.020   3.349  -5.209
   95    H    GLY  13           H        GLY  13  -0.722   1.281  -1.644
   96    HA2  GLY  13           HA3      GLY  13  -3.314   0.631  -2.463
   97    HA3  GLY  13           HA2      GLY  13  -2.498  -0.043  -1.061
   98    H    LYS  14           H        LYS  14  -2.260   1.991   0.676
   99    HA   LYS  14           HA       LYS  14  -4.928   2.374   1.559
  100    HB2  LYS  14           HB3      LYS  14  -3.952   3.536   3.451
  101    HB3  LYS  14           HB2      LYS  14  -3.069   2.062   3.100
  102    HG2  LYS  14           HG3      LYS  14  -1.401   3.583   3.595
  103    HG3  LYS  14           HG2      LYS  14  -1.427   3.573   1.834
  104    HD2  LYS  14           HD3      LYS  14  -1.243   5.852   2.712
  105    HD3  LYS  14           HD2      LYS  14  -2.752   5.621   1.828
  106    HE2  LYS  14           HE3      LYS  14  -3.939   5.314   3.953
  107    HE3  LYS  14           HE2      LYS  14  -2.425   5.565   4.830
  108    HZ1  LYS  14           HZ1      LYS  14  -2.314   7.797   4.008
  109    HZ2  LYS  14           HZ2      LYS  14  -3.846   7.570   4.698
  110    HZ3  LYS  14           HZ3      LYS  14  -3.666   7.567   3.012
  111    H    HIS  15           H        HIS  15  -2.859   4.169  -0.487
  112    HA   HIS  15           HA       HIS  15  -3.851   6.783  -0.068
  113    HB2  HIS  15           HB3      HIS  15  -1.786   5.983  -1.440
  114    HB3  HIS  15           HB2      HIS  15  -2.943   5.762  -2.748
  115    HD1  HIS  15           HD1      HIS  15  -0.498   7.976  -2.150
  116    HD2  HIS  15           HD2      HIS  15  -4.603   8.549  -2.526
  117    HE1  HIS  15           HE1      HIS  15  -0.795  10.389  -2.803
  118    HE2  HIS  15           HE2      HIS  15  -3.268  10.654  -3.200
  119    H    VAL  16           H        VAL  16  -4.642   4.313  -2.496
  120    HA   VAL  16           HA       VAL  16  -7.188   5.668  -2.983
  121    HB   VAL  16           HB       VAL  16  -7.433   3.939  -4.781
  122   HG11  VAL  16          HG11      VAL  16  -6.861   6.264  -5.255
  123   HG12  VAL  16          HG12      VAL  16  -6.012   5.184  -6.362
  124   HG13  VAL  16          HG13      VAL  16  -5.154   5.903  -4.998
  125   HG21  VAL  16          HG21      VAL  16  -5.791   2.326  -4.053
  126   HG22  VAL  16          HG22      VAL  16  -4.507   3.525  -4.203
  127   HG23  VAL  16          HG23      VAL  16  -5.337   2.938  -5.643
  128    H    GLY  17           H        GLY  17  -6.857   4.432  -0.568
  129    HA2  GLY  17           HA3      GLY  17  -7.710   1.720  -0.532
  130    HA3  GLY  17           HA2      GLY  17  -7.606   2.789   0.856
  131    H    LYS  18           H        LYS  18  -9.490   4.449  -1.226
  132    HA   LYS  18           HA       LYS  18 -11.767   3.950   0.407
  133    HB2  LYS  18           HB3      LYS  18 -12.938   5.614  -0.943
  134    HB3  LYS  18           HB2      LYS  18 -11.370   6.192  -0.415
  135    HG2  LYS  18           HG3      LYS  18 -11.803   5.039  -3.153
  136    HG3  LYS  18           HG2      LYS  18 -12.098   6.739  -2.787
  137    HD2  LYS  18           HD3      LYS  18  -9.697   6.723  -1.848
  138    HD3  LYS  18           HD2      LYS  18  -9.516   5.214  -2.743
  139    HE2  LYS  18           HE3      LYS  18 -10.233   7.916  -3.875
  140    HE3  LYS  18           HE2      LYS  18  -8.712   7.055  -4.084
  141    HZ1  LYS  18           HZ1      LYS  18 -10.007   5.278  -5.223
  142    HZ2  LYS  18           HZ2      LYS  18  -9.997   6.763  -6.041
  143    HZ3  LYS  18           HZ3      LYS  18 -11.371   6.290  -5.168
  144    H    ALA  19           H        ALA  19 -10.618   2.435  -2.381
  145    HA   ALA  19           HA       ALA  19 -13.193   1.014  -2.597
  146    HB1  ALA  19           HB1      ALA  19 -12.781   2.291  -4.642
  147    HB2  ALA  19           HB2      ALA  19 -12.688   0.556  -4.949
  148    HB3  ALA  19           HB3      ALA  19 -11.210   1.507  -4.819
  149    H    ALA  20           H        ALA  20 -10.711   0.658  -0.956
  150    HA   ALA  20           HA       ALA  20 -10.043  -2.071  -1.831
  151    HB1  ALA  20           HB1      ALA  20  -7.735  -1.733  -1.194
  152    HB2  ALA  20           HB2      ALA  20  -8.089  -0.072  -0.720
  153    HB3  ALA  20           HB3      ALA  20  -8.208  -0.551  -2.414
  154    H    LEU  21           H        LEU  21 -10.263   0.231   0.844
  155    HA   LEU  21           HA       LEU  21  -9.464  -1.483   2.898
  156    HB2  LEU  21           HB3      LEU  21 -10.629   0.068   4.416
  157    HB3  LEU  21           HB2      LEU  21  -9.616   0.890   3.252
  158    HG   LEU  21           HG       LEU  21 -11.837   1.205   1.917
  159   HD11  LEU  21          HD11      LEU  21 -13.805   1.435   3.351
  160   HD12  LEU  21          HD12      LEU  21 -12.894   0.771   4.707
  161   HD13  LEU  21          HD13      LEU  21 -13.236  -0.235   3.298
  162   HD21  LEU  21          HD21      LEU  21 -12.249   3.292   3.115
  163   HD22  LEU  21          HD22      LEU  21 -10.525   3.008   2.873
  164   HD23  LEU  21          HD23      LEU  21 -11.256   2.719   4.451
  165    H    THR  22           H        THR  22 -12.259  -1.553   1.018
  166    HA   THR  22           HA       THR  22 -14.028  -2.708   2.962
  167    HB   THR  22           HB       THR  22 -14.647  -3.170   0.134
  168    HG1  THR  22           HG1      THR  22 -14.848  -0.477   0.739
  169   HG21  THR  22          HG21      THR  22 -16.737  -2.074   0.767
  170   HG22  THR  22          HG22      THR  22 -16.034  -1.588   2.308
  171   HG23  THR  22          HG23      THR  22 -16.301  -3.298   1.964
  172    H    HIS  23           H        HIS  23 -11.425  -3.892   1.166
  173    HA   HIS  23           HA       HIS  23 -12.028  -6.643   1.756
  174    HB2  HIS  23           HB3      HIS  23 -12.011  -7.418  -0.594
  175    HB3  HIS  23           HB2      HIS  23 -13.387  -6.377  -0.255
  176    HD1  HIS  23           HD1      HIS  23 -10.451  -6.716  -2.459
  177    HD2  HIS  23           HD2      HIS  23 -13.152  -3.726  -1.408
  178    HE1  HIS  23           HE1      HIS  23 -10.174  -4.906  -4.185
  179    HE2  HIS  23           HE2      HIS  23 -11.712  -3.047  -3.446
  180    H    TYR  24           H        TYR  24  -9.887  -4.844   2.393
  181    HA   TYR  24           HA       TYR  24  -7.598  -6.307   1.597
  182    HB2  TYR  24           HB3      TYR  24  -7.812  -5.262  -0.541
  183    HB3  TYR  24           HB2      TYR  24  -8.143  -3.695   0.182
  184    HD1  TYR  24           HD2      TYR  24  -5.497  -6.163  -0.553
  185    HD2  TYR  24           HD1      TYR  24  -6.376  -2.250   0.879
  186    HE1  TYR  24           HE2      TYR  24  -3.119  -5.564  -0.746
  187    HE2  TYR  24           HE1      TYR  24  -3.999  -1.639   0.680
  188    HH   TYR  24           HH       TYR  24  -1.768  -3.485  -1.034
  189    H    LEU  25           H        LEU  25  -8.397  -2.899   2.307
  190    HA   LEU  25           HA       LEU  25  -6.230  -2.792   4.206
  191    HB2  LEU  25           HB3      LEU  25  -6.780  -1.013   2.484
  192    HB3  LEU  25           HB2      LEU  25  -8.186  -0.630   3.457
  193    HG   LEU  25           HG       LEU  25  -6.651  -0.154   5.359
  194   HD11  LEU  25          HD11      LEU  25  -4.753  -1.471   4.542
  195   HD12  LEU  25          HD12      LEU  25  -4.293   0.199   4.877
  196   HD13  LEU  25          HD13      LEU  25  -4.547  -0.332   3.214
  197   HD21  LEU  25          HD21      LEU  25  -6.030   2.039   4.530
  198   HD22  LEU  25          HD22      LEU  25  -7.630   1.590   3.932
  199   HD23  LEU  25          HD23      LEU  25  -6.228   1.486   2.867
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1   9.732  10.626 -12.682
    2    H2   GLY   1           HT2      GLY   1   9.319  10.029 -14.216
    3    H3   GLY   1           HT3      GLY   1   9.735   8.959 -12.971
    4    HA2  GLY   1           HA2      GLY   1   7.361  10.729 -12.955
    5    HA3  GLY   1           HA3      GLY   1   7.339   9.017 -13.360
    6    H    TRP   2           H        TRP   2   6.421   7.955 -11.725
    7    HA   TRP   2           HA       TRP   2   7.219   8.711  -8.992
    8    HB2  TRP   2           HB3      TRP   2   4.597   7.538  -9.931
    9    HB3  TRP   2           HB2      TRP   2   5.028   7.828  -8.249
   10    HD1  TRP   2           HD1      TRP   2   3.279   9.413 -11.052
   11    HE1  TRP   2           HE1      TRP   2   2.879  11.921 -10.599
   12    HE3  TRP   2           HE3      TRP   2   6.439  10.022  -7.074
   13    HZ2  TRP   2           HZ2      TRP   2   3.801  13.890  -8.789
   14    HZ3  TRP   2           HZ3      TRP   2   6.621  12.245  -6.040
   15    HH2  TRP   2           HH2      TRP   2   5.328  14.139  -6.881
   16    H    GLY   3           H        GLY   3   8.672   6.908 -10.648
   17    HA2  GLY   3           HA3      GLY   3   8.020   4.227  -9.714
   18    HA3  GLY   3           HA2      GLY   3   9.356   4.673 -10.770
   19    H    SER   4           H        SER   4   9.001   6.582  -7.994
   20    HA   SER   4           HA       SER   4  11.467   5.584  -6.884
   21    HB2  SER   4           HB3      SER   4   9.673   7.696  -5.682
   22    HB3  SER   4           HB2      SER   4  11.421   7.522  -5.516
   23    HG   SER   4           HG       SER   4  11.702   8.215  -7.593
   24    H    PHE   5           H        PHE   5   8.259   4.731  -6.600
   25    HA   PHE   5           HA       PHE   5   8.449   4.082  -3.744
   26    HB2  PHE   5           HB3      PHE   5   6.026   4.101  -5.551
   27    HB3  PHE   5           HB2      PHE   5   6.019   3.800  -3.817
   28    HD1  PHE   5           HD2      PHE   5   6.800   5.657  -2.280
   29    HD2  PHE   5           HD1      PHE   5   5.888   6.273  -6.391
   30    HE1  PHE   5           HE2      PHE   5   6.533   8.064  -1.857
   31    HE2  PHE   5           HE1      PHE   5   5.621   8.685  -5.974
   32    HZ   PHE   5           HZ       PHE   5   5.939   9.583  -3.706
   33    H    PHE   6           H        PHE   6   9.358   2.145  -3.463
   34    HA   PHE   6           HA       PHE   6   8.237  -0.119  -4.981
   35    HB2  PHE   6           HB3      PHE   6  10.874   0.050  -3.503
   36    HB3  PHE   6           HB2      PHE   6  10.273  -1.369  -4.353
   37    HD1  PHE   6           HD1      PHE   6   9.749  -1.048  -6.876
   38    HD2  PHE   6           HD2      PHE   6  12.236   1.550  -4.600
   39    HE1  PHE   6           HE1      PHE   6  10.824  -0.266  -8.946
   40    HE2  PHE   6           HE2      PHE   6  13.313   2.335  -6.667
   41    HZ   PHE   6           HZ       PHE   6  12.608   1.426  -8.844
   42    H    LYS   7           H        LYS   7   9.663   0.573  -1.788
   43    HA   LYS   7           HA       LYS   7   8.087  -1.420  -0.489
   44    HB2  LYS   7           HB3      LYS   7  10.014   0.701   0.386
   45    HB3  LYS   7           HB2      LYS   7   9.033  -0.144   1.563
   46    HG2  LYS   7           HG3      LYS   7  10.919  -1.447  -0.380
   47    HG3  LYS   7           HG2      LYS   7  11.256  -1.137   1.325
   48    HD2  LYS   7           HD3      LYS   7   9.030  -2.882   0.267
   49    HD3  LYS   7           HD2      LYS   7  10.559  -3.463   0.928
   50    HE2  LYS   7           HE3      LYS   7  10.032  -2.516   3.085
   51    HE3  LYS   7           HE2      LYS   7   8.563  -1.784   2.438
   52    HZ1  LYS   7           HZ1      LYS   7   9.084  -4.708   2.590
   53    HZ2  LYS   7           HZ2      LYS   7   7.660  -3.969   2.045
   54    HZ3  LYS   7           HZ3      LYS   7   8.112  -3.834   3.669
   55    H    LYS   8           H        LYS   8   8.044   2.109  -0.754
   56    HA   LYS   8           HA       LYS   8   5.839   2.499   0.952
   57    HB2  LYS   8           HB3      LYS   8   7.164   4.170  -1.144
   58    HB3  LYS   8           HB2      LYS   8   5.621   4.683  -0.478
   59    HG2  LYS   8           HG3      LYS   8   7.216   5.803   0.786
   60    HG3  LYS   8           HG2      LYS   8   6.717   4.458   1.805
   61    HD2  LYS   8           HD3      LYS   8   9.099   4.655   1.936
   62    HD3  LYS   8           HD2      LYS   8   8.723   3.204   1.005
   63    HE2  LYS   8           HE3      LYS   8   9.285   4.242  -1.036
   64    HE3  LYS   8           HE2      LYS   8   9.273   5.850  -0.309
   65    HZ1  LYS   8           HZ1      LYS   8  11.524   4.996  -0.718
   66    HZ2  LYS   8           HZ2      LYS   8  11.237   3.714   0.354
   67    HZ3  LYS   8           HZ3      LYS   8  11.244   5.313   0.921
   68    H    ALA   9           H        ALA   9   6.064   1.187  -2.119
   69    HA   ALA   9           HA       ALA   9   3.518   2.001  -3.135
   70    HB1  ALA   9           HB1      ALA   9   5.313   1.303  -4.632
   71    HB2  ALA   9           HB2      ALA   9   3.872   0.312  -4.857
   72    HB3  ALA   9           HB3      ALA   9   5.250  -0.326  -3.959
   73    H    ALA  10           H        ALA  10   4.581  -0.345  -0.884
   74    HA   ALA  10           HA       ALA  10   2.167  -1.944  -1.036
   75    HB1  ALA  10           HB1      ALA  10   3.102  -3.177   0.846
   76    HB2  ALA  10           HB2      ALA  10   4.384  -1.977   1.020
   77    HB3  ALA  10           HB3      ALA  10   4.310  -2.986  -0.425
   78    H    HIS  11           H        HIS  11   3.001   1.013   0.188
   79    HA   HIS  11           HA       HIS  11   1.048   0.869   2.377
   80    HB2  HIS  11           HB3      HIS  11   3.276   2.845   1.861
   81    HB3  HIS  11           HB2      HIS  11   2.076   3.032   3.137
   82    HD1  HIS  11           HD1      HIS  11   2.768   2.121   5.339
   83    HD2  HIS  11           HD2      HIS  11   4.728   0.240   2.187
   84    HE1  HIS  11           HE1      HIS  11   4.364   0.489   6.399
   85    HE2  HIS  11           HE2      HIS  11   5.365  -0.789   4.466
   86    H    VAL  12           H        VAL  12   2.006   2.707  -0.471
   87    HA   VAL  12           HA       VAL  12  -0.385   4.336  -0.406
   88    HB   VAL  12           HB       VAL  12   1.570   4.050  -2.699
   89   HG11  VAL  12          HG11      VAL  12  -0.264   6.311  -1.903
   90   HG12  VAL  12          HG12      VAL  12  -0.522   5.193  -3.242
   91   HG13  VAL  12          HG13      VAL  12   0.843   6.310  -3.277
   92   HG21  VAL  12          HG21      VAL  12   2.798   4.601  -0.655
   93   HG22  VAL  12          HG22      VAL  12   1.721   5.969  -0.376
   94   HG23  VAL  12          HG23      VAL  12   2.781   5.956  -1.785
   95    H    GLY  13           H        GLY  13   0.030   1.203  -0.958
   96    HA2  GLY  13           HA3      GLY  13  -1.339   0.690  -3.372
   97    HA3  GLY  13           HA2      GLY  13  -1.200  -0.420  -2.020
   98    H    LYS  14           H        LYS  14  -2.427   1.337  -0.124
   99    HA   LYS  14           HA       LYS  14  -5.193   0.818  -0.668
  100    HB2  LYS  14           HB3      LYS  14  -5.547   1.640   1.591
  101    HB3  LYS  14           HB2      LYS  14  -4.178   0.536   1.550
  102    HG2  LYS  14           HG3      LYS  14  -2.624   2.357   1.644
  103    HG3  LYS  14           HG2      LYS  14  -3.936   3.530   1.534
  104    HD2  LYS  14           HD3      LYS  14  -4.794   2.833   3.676
  105    HD3  LYS  14           HD2      LYS  14  -3.592   1.540   3.774
  106    HE2  LYS  14           HE3      LYS  14  -1.807   3.190   3.791
  107    HE3  LYS  14           HE2      LYS  14  -2.984   4.494   3.663
  108    HZ1  LYS  14           HZ1      LYS  14  -2.796   2.579   5.933
  109    HZ2  LYS  14           HZ2      LYS  14  -3.874   3.883   5.814
  110    HZ3  LYS  14           HZ3      LYS  14  -2.206   4.166   5.938
  111    H    HIS  15           H        HIS  15  -3.894   2.709  -2.445
  112    HA   HIS  15           HA       HIS  15  -4.351   5.399  -1.743
  113    HB2  HIS  15           HB3      HIS  15  -2.833   4.548  -3.578
  114    HB3  HIS  15           HB2      HIS  15  -4.288   4.277  -4.542
  115    HD1  HIS  15           HD1      HIS  15  -4.566   6.088  -6.169
  116    HD2  HIS  15           HD2      HIS  15  -3.017   7.488  -2.576
  117    HE1  HIS  15           HE1      HIS  15  -4.331   8.578  -6.456
  118    HE2  HIS  15           HE2      HIS  15  -3.571   9.423  -4.199
  119    H    VAL  16           H        VAL  16  -6.504   2.946  -2.663
  120    HA   VAL  16           HA       VAL  16  -8.535   4.380  -3.925
  121    HB   VAL  16           HB       VAL  16  -8.913   2.144  -1.932
  122   HG11  VAL  16          HG11      VAL  16 -10.674   3.129  -4.174
  123   HG12  VAL  16          HG12      VAL  16 -10.975   3.320  -2.446
  124   HG13  VAL  16          HG13      VAL  16 -10.989   1.712  -3.171
  125   HG21  VAL  16          HG21      VAL  16  -7.339   1.476  -3.681
  126   HG22  VAL  16          HG22      VAL  16  -8.482   1.990  -4.921
  127   HG23  VAL  16          HG23      VAL  16  -8.876   0.633  -3.868
  128    H    GLY  17           H        GLY  17  -7.987   3.823  -0.466
  129    HA2  GLY  17           HA3      GLY  17  -8.596   5.104   1.338
  130    HA3  GLY  17           HA2      GLY  17  -8.976   6.398   0.210
  131    H    LYS  18           H        LYS  18 -10.962   5.246  -1.314
  132    HA   LYS  18           HA       LYS  18 -13.165   5.727   0.470
  133    HB2  LYS  18           HB3      LYS  18 -13.036   4.990  -2.455
  134    HB3  LYS  18           HB2      LYS  18 -14.562   5.184  -1.606
  135    HG2  LYS  18           HG3      LYS  18 -14.114   7.215  -2.751
  136    HG3  LYS  18           HG2      LYS  18 -13.855   7.516  -1.034
  137    HD2  LYS  18           HD3      LYS  18 -11.436   7.246  -1.371
  138    HD3  LYS  18           HD2      LYS  18 -11.713   6.970  -3.088
  139    HE2  LYS  18           HE3      LYS  18 -12.426   9.488  -1.595
  140    HE3  LYS  18           HE2      LYS  18 -10.989   9.275  -2.592
  141    HZ1  LYS  18           HZ1      LYS  18 -12.626   8.708  -4.436
  142    HZ2  LYS  18           HZ2      LYS  18 -12.509  10.331  -3.972
  143    HZ3  LYS  18           HZ3      LYS  18 -13.819   9.397  -3.443
  144    H    ALA  19           H        ALA  19 -11.666   2.903  -0.885
  145    HA   ALA  19           HA       ALA  19 -13.668   1.224   0.462
  146    HB1  ALA  19           HB1      ALA  19 -12.909  -0.606  -0.946
  147    HB2  ALA  19           HB2      ALA  19 -11.672   0.429  -1.660
  148    HB3  ALA  19           HB3      ALA  19 -13.379   0.774  -1.938
  149    H    ALA  20           H        ALA  20 -10.878   2.653   1.148
  150    HA   ALA  20           HA       ALA  20  -9.522   0.324   2.295
  151    HB1  ALA  20           HB1      ALA  20  -8.178   1.895   0.983
  152    HB2  ALA  20           HB2      ALA  20  -7.648   1.813   2.663
  153    HB3  ALA  20           HB3      ALA  20  -8.607   3.184   2.107
  154    H    LEU  21           H        LEU  21 -11.420   3.052   3.108
  155    HA   LEU  21           HA       LEU  21 -10.709   3.437   5.784
  156    HB2  LEU  21           HB3      LEU  21 -12.937   4.473   6.022
  157    HB3  LEU  21           HB2      LEU  21 -12.048   5.050   4.626
  158    HG   LEU  21           HG       LEU  21 -13.460   3.266   3.330
  159   HD11  LEU  21          HD11      LEU  21 -15.709   2.975   4.255
  160   HD12  LEU  21          HD12      LEU  21 -15.185   3.749   5.752
  161   HD13  LEU  21          HD13      LEU  21 -14.478   2.211   5.258
  162   HD21  LEU  21          HD21      LEU  21 -14.670   5.834   4.339
  163   HD22  LEU  21          HD22      LEU  21 -15.156   4.955   2.888
  164   HD23  LEU  21          HD23      LEU  21 -13.551   5.683   2.987
  165    H    THR  22           H        THR  22 -12.276   0.837   4.291
  166    HA   THR  22           HA       THR  22 -13.941  -0.008   6.438
  167    HB   THR  22           HB       THR  22 -12.799  -1.731   4.231
  168    HG1  THR  22           HG1      THR  22 -15.291  -0.358   4.158
  169   HG21  THR  22          HG21      THR  22 -13.945  -2.949   6.035
  170   HG22  THR  22          HG22      THR  22 -14.843  -3.034   4.520
  171   HG23  THR  22          HG23      THR  22 -15.372  -1.942   5.801
  172    H    HIS  23           H        HIS  23 -10.569  -0.157   5.888
  173    HA   HIS  23           HA       HIS  23 -10.014  -2.518   7.406
  174    HB2  HIS  23           HB3      HIS  23  -8.353  -0.276   6.318
  175    HB3  HIS  23           HB2      HIS  23  -7.656  -1.371   7.507
  176    HD1  HIS  23           HD1      HIS  23  -8.585  -1.132   3.933
  177    HD2  HIS  23           HD2      HIS  23  -7.353  -4.064   6.607
  178    HE1  HIS  23           HE1      HIS  23  -7.886  -3.085   2.516
  179    HE2  HIS  23           HE2      HIS  23  -6.925  -4.742   4.149
  180    H    TYR  24           H        TYR  24 -10.960   0.607   8.304
  181    HA   TYR  24           HA       TYR  24 -10.286  -0.038  11.071
  182    HB2  TYR  24           HB3      TYR  24 -10.065   2.619  11.245
  183    HB3  TYR  24           HB2      TYR  24  -8.693   1.563  10.963
  184    HD1  TYR  24           HD1      TYR  24 -10.982   4.008   9.447
  185    HD2  TYR  24           HD2      TYR  24  -7.559   1.558   8.835
  186    HE1  TYR  24           HE1      TYR  24 -10.439   5.282   7.412
  187    HE2  TYR  24           HE2      TYR  24  -7.016   2.812   6.795
  188    HH   TYR  24           HH       TYR  24  -8.086   4.219   5.149
  189    H    LEU  25           H        LEU  25 -12.474   1.435   8.813
  190    HA   LEU  25           HA       LEU  25 -14.362   1.901  11.022
  191    HB2  LEU  25           HB3      LEU  25 -14.251   3.285   8.339
  192    HB3  LEU  25           HB2      LEU  25 -15.441   3.575   9.591
  193    HG   LEU  25           HG       LEU  25 -12.490   4.129   9.833
  194   HD11  LEU  25          HD11      LEU  25 -14.809   6.016   9.481
  195   HD12  LEU  25          HD12      LEU  25 -13.638   5.588   8.234
  196   HD13  LEU  25          HD13      LEU  25 -13.114   6.463   9.675
  197   HD21  LEU  25          HD21      LEU  25 -13.473   3.598  11.981
  198   HD22  LEU  25          HD22      LEU  25 -14.799   4.719  11.680
  199   HD23  LEU  25          HD23      LEU  25 -13.158   5.331  11.882
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1  12.882 -10.093  -3.628
    2    H2   GLY   1           HT2      GLY   1  12.659  -8.423  -3.421
    3    H3   GLY   1           HT3      GLY   1  11.733  -9.271  -4.563
    4    HA2  GLY   1           HA2      GLY   1  10.631 -10.515  -2.831
    5    HA3  GLY   1           HA3      GLY   1  11.628  -9.704  -1.628
    6    H    TRP   2           H        TRP   2   8.672  -9.685  -3.143
    7    HA   TRP   2           HA       TRP   2   8.201  -6.883  -3.325
    8    HB2  TRP   2           HB3      TRP   2   6.860  -8.647  -4.511
    9    HB3  TRP   2           HB2      TRP   2   6.148  -9.071  -2.957
   10    HD1  TRP   2           HD1      TRP   2   4.084  -7.701  -2.201
   11    HE1  TRP   2           HE1      TRP   2   2.823  -5.648  -3.121
   12    HE3  TRP   2           HE3      TRP   2   7.354  -6.335  -5.879
   13    HZ2  TRP   2           HZ2      TRP   2   3.186  -3.707  -5.138
   14    HZ3  TRP   2           HZ3      TRP   2   6.824  -4.370  -7.259
   15    HH2  TRP   2           HH2      TRP   2   4.782  -3.086  -6.894
   16    H    GLY   3           H        GLY   3   8.443  -5.656  -1.589
   17    HA2  GLY   3           HA3      GLY   3   6.970  -5.045   0.419
   18    HA3  GLY   3           HA2      GLY   3   7.443  -6.638   1.002
   19    H    SER   4           H        SER   4  10.128  -6.161  -0.348
   20    HA   SER   4           HA       SER   4  11.493  -5.075   1.909
   21    HB2  SER   4           HB3      SER   4  12.540  -5.701  -0.866
   22    HB3  SER   4           HB2      SER   4  13.521  -5.439   0.576
   23    HG   SER   4           HG       SER   4  13.332  -7.594   0.514
   24    H    PHE   5           H        PHE   5   9.673  -3.503  -0.189
   25    HA   PHE   5           HA       PHE   5  11.429  -1.157  -0.391
   26    HB2  PHE   5           HB3      PHE   5   8.828  -1.655  -1.858
   27    HB3  PHE   5           HB2      PHE   5   9.988  -0.367  -2.165
   28    HD1  PHE   5           HD1      PHE   5  12.300  -1.023  -2.993
   29    HD2  PHE   5           HD2      PHE   5   8.988  -3.693  -2.962
   30    HE1  PHE   5           HE1      PHE   5  13.428  -2.441  -4.653
   31    HE2  PHE   5           HE2      PHE   5  10.114  -5.116  -4.623
   32    HZ   PHE   5           HZ       PHE   5  12.337  -4.489  -5.469
   33    H    PHE   6           H        PHE   6   9.192  -2.506   1.522
   34    HA   PHE   6           HA       PHE   6   7.424  -1.876   2.795
   35    HB2  PHE   6           HB3      PHE   6   8.260  -0.162   4.519
   36    HB3  PHE   6           HB2      PHE   6   9.094  -1.697   4.345
   37    HD1  PHE   6           HD2      PHE   6  11.310  -1.798   3.305
   38    HD2  PHE   6           HD1      PHE   6   9.353   1.911   4.034
   39    HE1  PHE   6           HE2      PHE   6  13.448  -0.618   3.030
   40    HE2  PHE   6           HE1      PHE   6  11.490   3.094   3.765
   41    HZ   PHE   6           HZ       PHE   6  13.542   1.829   3.260
   42    H    LYS   7           H        LYS   7   8.688   1.414   2.400
   43    HA   LYS   7           HA       LYS   7   6.241   2.707   2.475
   44    HB2  LYS   7           HB3      LYS   7   8.845   3.450   2.375
   45    HB3  LYS   7           HB2      LYS   7   8.346   3.864   0.742
   46    HG2  LYS   7           HG3      LYS   7   6.858   4.806   3.176
   47    HG3  LYS   7           HG2      LYS   7   8.212   5.688   2.475
   48    HD2  LYS   7           HD3      LYS   7   5.728   4.910   0.964
   49    HD3  LYS   7           HD2      LYS   7   5.973   6.486   1.718
   50    HE2  LYS   7           HE3      LYS   7   7.550   5.255  -0.540
   51    HE3  LYS   7           HE2      LYS   7   6.531   6.695  -0.596
   52    HZ1  LYS   7           HZ1      LYS   7   9.181   6.360   0.678
   53    HZ2  LYS   7           HZ2      LYS   7   8.143   7.622   1.133
   54    HZ3  LYS   7           HZ3      LYS   7   8.697   7.516  -0.468
   55    H    LYS   8           H        LYS   8   8.065   1.460  -0.298
   56    HA   LYS   8           HA       LYS   8   5.923   2.248  -2.115
   57    HB2  LYS   8           HB3      LYS   8   8.684   1.119  -2.603
   58    HB3  LYS   8           HB2      LYS   8   7.508   1.366  -3.881
   59    HG2  LYS   8           HG3      LYS   8   8.966   3.207  -3.932
   60    HG3  LYS   8           HG2      LYS   8   7.453   3.786  -3.240
   61    HD2  LYS   8           HD3      LYS   8   9.260   4.717  -1.974
   62    HD3  LYS   8           HD2      LYS   8   8.471   3.496  -0.975
   63    HE2  LYS   8           HE3      LYS   8  10.879   3.301  -0.782
   64    HE3  LYS   8           HE2      LYS   8  10.216   1.881  -1.593
   65    HZ1  LYS   8           HZ1      LYS   8  11.298   4.181  -3.111
   66    HZ2  LYS   8           HZ2      LYS   8  11.026   2.595  -3.649
   67    HZ3  LYS   8           HZ3      LYS   8  12.294   2.916  -2.574
   68    H    ALA   9           H        ALA   9   4.743   0.539  -0.666
   69    HA   ALA   9           HA       ALA   9   4.602  -1.835  -2.375
   70    HB1  ALA   9           HB1      ALA   9   5.805  -2.517  -0.357
   71    HB2  ALA   9           HB2      ALA   9   4.228  -3.299  -0.458
   72    HB3  ALA   9           HB3      ALA   9   4.472  -1.938   0.638
   73    H    ALA  10           H        ALA  10   2.747  -1.372   0.570
   74    HA   ALA  10           HA       ALA  10   0.377  -0.884  -1.103
   75    HB1  ALA  10           HB1      ALA  10   0.530  -2.097   1.654
   76    HB2  ALA  10           HB2      ALA  10   0.309  -2.984   0.144
   77    HB3  ALA  10           HB3      ALA  10  -0.938  -1.869   0.702
   78    H    HIS  11           H        HIS  11   2.510   0.713   0.785
   79    HA   HIS  11           HA       HIS  11   0.810   2.235   2.473
   80    HB2  HIS  11           HB3      HIS  11   3.639   2.609   1.532
   81    HB3  HIS  11           HB2      HIS  11   2.826   3.843   2.494
   82    HD1  HIS  11           HD1      HIS  11   4.504   0.572   2.736
   83    HD2  HIS  11           HD2      HIS  11   2.126   2.991   5.138
   84    HE1  HIS  11           HE1      HIS  11   4.719  -0.351   5.049
   85    HE2  HIS  11           HE2      HIS  11   3.429   1.228   6.517
   86    H    VAL  12           H        VAL  12   1.811   2.519  -0.837
   87    HA   VAL  12           HA       VAL  12   0.558   5.142  -1.089
   88    HB   VAL  12           HB       VAL  12   1.311   5.010  -3.468
   89   HG11  VAL  12          HG11      VAL  12   3.407   4.699  -1.327
   90   HG12  VAL  12          HG12      VAL  12   2.644   6.201  -1.856
   91   HG13  VAL  12          HG13      VAL  12   3.713   5.318  -2.950
   92   HG21  VAL  12          HG21      VAL  12   3.004   3.307  -4.048
   93   HG22  VAL  12          HG22      VAL  12   1.405   2.617  -3.769
   94   HG23  VAL  12          HG23      VAL  12   2.653   2.478  -2.532
   95    H    GLY  13           H        GLY  13  -0.038   1.812  -1.723
   96    HA2  GLY  13           HA3      GLY  13  -2.054   2.087  -3.696
   97    HA3  GLY  13           HA2      GLY  13  -1.780   0.676  -2.687
   98    H    LYS  14           H        LYS  14  -2.078   2.333  -0.219
   99    HA   LYS  14           HA       LYS  14  -4.863   1.977   0.149
  100    HB2  LYS  14           HB3      LYS  14  -4.486   2.838   2.385
  101    HB3  LYS  14           HB2      LYS  14  -3.214   1.719   1.940
  102    HG2  LYS  14           HG3      LYS  14  -1.866   3.271   2.763
  103    HG3  LYS  14           HG2      LYS  14  -2.090   4.037   1.190
  104    HD2  LYS  14           HD3      LYS  14  -3.687   5.539   2.029
  105    HD3  LYS  14           HD2      LYS  14  -3.922   4.589   3.501
  106    HE2  LYS  14           HE3      LYS  14  -2.597   6.551   4.005
  107    HE3  LYS  14           HE2      LYS  14  -1.627   5.084   4.166
  108    HZ1  LYS  14           HZ1      LYS  14  -0.568   5.513   2.101
  109    HZ2  LYS  14           HZ2      LYS  14  -0.485   6.943   3.010
  110    HZ3  LYS  14           HZ3      LYS  14  -1.609   6.800   1.748
  111    H    HIS  15           H        HIS  15  -3.452   4.254  -1.637
  112    HA   HIS  15           HA       HIS  15  -4.648   6.672  -0.797
  113    HB2  HIS  15           HB3      HIS  15  -2.770   6.256  -2.556
  114    HB3  HIS  15           HB2      HIS  15  -4.107   6.029  -3.681
  115    HD1  HIS  15           HD1      HIS  15  -5.515   8.112  -4.300
  116    HD2  HIS  15           HD2      HIS  15  -2.349   8.896  -1.718
  117    HE1  HIS  15           HE1      HIS  15  -5.251  10.613  -4.286
  118    HE2  HIS  15           HE2      HIS  15  -3.203  11.043  -2.882
  119    H    VAL  16           H        VAL  16  -5.838   3.873  -2.373
  120    HA   VAL  16           HA       VAL  16  -8.129   4.832  -3.657
  121    HB   VAL  16           HB       VAL  16  -7.807   2.215  -2.192
  122   HG11  VAL  16          HG11      VAL  16  -9.710   3.013  -4.389
  123   HG12  VAL  16          HG12      VAL  16 -10.131   2.720  -2.701
  124   HG13  VAL  16          HG13      VAL  16  -9.547   1.397  -3.707
  125   HG21  VAL  16          HG21      VAL  16  -7.249   2.889  -5.079
  126   HG22  VAL  16          HG22      VAL  16  -7.175   1.279  -4.367
  127   HG23  VAL  16          HG23      VAL  16  -6.039   2.526  -3.847
  128    H    GLY  17           H        GLY  17  -7.921   3.436  -0.389
  129    HA2  GLY  17           HA3      GLY  17  -9.047   4.032   1.529
  130    HA3  GLY  17           HA2      GLY  17  -9.595   5.484   0.700
  131    H    LYS  18           H        LYS  18 -10.949   4.302  -1.465
  132    HA   LYS  18           HA       LYS  18 -13.401   3.695  -0.060
  133    HB2  LYS  18           HB3      LYS  18 -12.763   3.961  -2.995
  134    HB3  LYS  18           HB2      LYS  18 -14.356   3.500  -2.418
  135    HG2  LYS  18           HG3      LYS  18 -14.523   5.787  -2.790
  136    HG3  LYS  18           HG2      LYS  18 -14.286   5.657  -1.047
  137    HD2  LYS  18           HD3      LYS  18 -11.884   6.117  -1.374
  138    HD3  LYS  18           HD2      LYS  18 -12.177   6.306  -3.102
  139    HE2  LYS  18           HE3      LYS  18 -12.114   8.487  -2.154
  140    HE3  LYS  18           HE2      LYS  18 -13.793   8.129  -2.554
  141    HZ1  LYS  18           HZ1      LYS  18 -12.607   7.866   0.162
  142    HZ2  LYS  18           HZ2      LYS  18 -14.240   7.643  -0.248
  143    HZ3  LYS  18           HZ3      LYS  18 -13.534   9.182  -0.369
  144    H    ALA  19           H        ALA  19 -11.926   1.971  -2.816
  145    HA   ALA  19           HA       ALA  19 -13.191  -0.479  -1.951
  146    HB1  ALA  19           HB1      ALA  19 -11.342   0.073  -4.267
  147    HB2  ALA  19           HB2      ALA  19 -13.106   0.059  -4.313
  148    HB3  ALA  19           HB3      ALA  19 -12.219  -1.431  -3.991
  149    H    ALA  20           H        ALA  20 -10.991   0.770  -0.313
  150    HA   ALA  20           HA       ALA  20  -9.237  -1.593  -0.240
  151    HB1  ALA  20           HB1      ALA  20  -7.333  -0.211   0.269
  152    HB2  ALA  20           HB2      ALA  20  -8.332   1.240   0.218
  153    HB3  ALA  20           HB3      ALA  20  -8.055   0.307  -1.253
  154    H    LEU  21           H        LEU  21 -11.499   0.145   1.402
  155    HA   LEU  21           HA       LEU  21 -10.356   0.364   3.982
  156    HB2  LEU  21           HB3      LEU  21 -12.715   0.565   4.764
  157    HB3  LEU  21           HB2      LEU  21 -12.276   1.680   3.490
  158    HG   LEU  21           HG       LEU  21 -13.373  -0.041   1.901
  159   HD11  LEU  21          HD11      LEU  21 -13.613  -1.850   3.527
  160   HD12  LEU  21          HD12      LEU  21 -15.174  -1.344   2.882
  161   HD13  LEU  21          HD13      LEU  21 -14.684  -0.838   4.497
  162   HD21  LEU  21          HD21      LEU  21 -15.011   1.616   3.809
  163   HD22  LEU  21          HD22      LEU  21 -15.560   1.005   2.251
  164   HD23  LEU  21          HD23      LEU  21 -14.247   2.179   2.325
  165    H    THR  22           H        THR  22 -11.136  -2.333   2.215
  166    HA   THR  22           HA       THR  22 -12.000  -3.999   4.423
  167    HB   THR  22           HB       THR  22 -11.206  -5.374   1.976
  168    HG1  THR  22           HG1      THR  22 -12.069  -4.051   0.581
  169   HG21  THR  22          HG21      THR  22 -13.486  -6.243   2.125
  170   HG22  THR  22          HG22      THR  22 -13.861  -5.060   3.378
  171   HG23  THR  22          HG23      THR  22 -12.680  -6.332   3.693
  172    H    HIS  23           H        HIS  23  -9.061  -2.905   3.226
  173    HA   HIS  23           HA       HIS  23  -7.638  -5.394   3.832
  174    HB2  HIS  23           HB3      HIS  23  -6.784  -2.882   2.396
  175    HB3  HIS  23           HB2      HIS  23  -5.669  -4.177   2.815
  176    HD1  HIS  23           HD1      HIS  23  -6.929  -3.113  -0.109
  177    HD2  HIS  23           HD2      HIS  23  -7.412  -6.741   1.869
  178    HE1  HIS  23           HE1      HIS  23  -7.612  -4.766  -1.875
  179    HE2  HIS  23           HE2      HIS  23  -7.643  -6.995  -0.688
  180    H    TYR  24           H        TYR  24  -8.235  -2.279   5.141
  181    HA   TYR  24           HA       TYR  24  -6.431  -2.889   7.338
  182    HB2  TYR  24           HB3      TYR  24  -5.827  -0.398   7.341
  183    HB3  TYR  24           HB2      TYR  24  -5.028  -1.426   6.163
  184    HD1  TYR  24           HD1      TYR  24  -7.832   0.991   6.571
  185    HD2  TYR  24           HD2      TYR  24  -5.140  -0.915   3.888
  186    HE1  TYR  24           HE1      TYR  24  -8.567   2.499   4.777
  187    HE2  TYR  24           HE2      TYR  24  -5.867   0.585   2.085
  188    HH   TYR  24           HH       TYR  24  -7.728   3.367   2.642
  189    H    LEU  25           H        LEU  25  -6.930  -1.789   9.285
  190    HA   LEU  25           HA       LEU  25  -8.254  -0.912  10.891
  191    HB2  LEU  25           HB3      LEU  25  -9.608   0.538   8.613
  192    HB3  LEU  25           HB2      LEU  25  -9.753   0.925  10.319
  193    HG   LEU  25           HG       LEU  25  -7.216   1.099   8.700
  194   HD11  LEU  25          HD11      LEU  25  -8.977   3.297   9.757
  195   HD12  LEU  25          HD12      LEU  25  -8.943   2.748   8.084
  196   HD13  LEU  25          HD13      LEU  25  -7.506   3.483   8.800
  197   HD21  LEU  25          HD21      LEU  25  -6.812   0.599  11.059
  198   HD22  LEU  25          HD22      LEU  25  -7.820   1.971  11.525
  199   HD23  LEU  25          HD23      LEU  25  -6.307   2.241  10.657
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  -4.428  -9.796  -6.055
    2    H2   GLY   1           HT2      GLY   1  -3.854  -8.264  -5.619
    3    H3   GLY   1           HT3      GLY   1  -3.618  -9.583  -4.579
    4    HA2  GLY   1           HA2      GLY   1  -2.210 -10.643  -6.272
    5    HA3  GLY   1           HA3      GLY   1  -2.399  -9.198  -7.255
    6    H    TRP   2           H        TRP   2  -0.057 -10.532  -5.873
    7    HA   TRP   2           HA       TRP   2   1.001  -8.096  -4.644
    8    HB2  TRP   2           HB3      TRP   2   0.196  -9.636  -2.835
    9    HB3  TRP   2           HB2      TRP   2   1.328 -10.847  -3.422
   10    HD1  TRP   2           HD1      TRP   2   1.241  -7.465  -1.619
   11    HE1  TRP   2           HE1      TRP   2   3.487  -7.126  -0.404
   12    HE3  TRP   2           HE3      TRP   2   3.763 -11.521  -3.441
   13    HZ2  TRP   2           HZ2      TRP   2   5.997  -8.416  -0.245
   14    HZ3  TRP   2           HZ3      TRP   2   6.076 -11.900  -2.701
   15    HH2  TRP   2           HH2      TRP   2   7.170 -10.379  -1.136
   16    H    GLY   3           H        GLY   3   3.131  -7.728  -5.130
   17    HA2  GLY   3           HA3      GLY   3   4.726  -9.799  -6.383
   18    HA3  GLY   3           HA2      GLY   3   4.190  -8.515  -7.459
   19    H    SER   4           H        SER   4   5.973  -7.435  -7.904
   20    HA   SER   4           HA       SER   4   7.951  -6.850  -5.884
   21    HB2  SER   4           HB3      SER   4   7.850  -5.667  -8.655
   22    HB3  SER   4           HB2      SER   4   9.264  -5.997  -7.653
   23    HG   SER   4           HG       SER   4   7.583  -7.857  -8.985
   24    H    PHE   5           H        PHE   5   5.071  -5.748  -6.009
   25    HA   PHE   5           HA       PHE   5   5.604  -2.873  -5.907
   26    HB2  PHE   5           HB3      PHE   5   3.003  -4.327  -5.370
   27    HB3  PHE   5           HB2      PHE   5   3.210  -2.612  -5.700
   28    HD1  PHE   5           HD2      PHE   5   3.694  -1.834  -7.971
   29    HD2  PHE   5           HD1      PHE   5   2.963  -5.942  -7.138
   30    HE1  PHE   5           HE2      PHE   5   3.313  -2.251 -10.365
   31    HE2  PHE   5           HE1      PHE   5   2.577  -6.365  -9.531
   32    HZ   PHE   5           HZ       PHE   5   2.754  -4.517 -11.149
   33    H    PHE   6           H        PHE   6   6.437  -5.122  -3.953
   34    HA   PHE   6           HA       PHE   6   5.016  -5.266  -1.645
   35    HB2  PHE   6           HB3      PHE   6   6.894  -6.681  -2.006
   36    HB3  PHE   6           HB2      PHE   6   7.999  -5.315  -2.059
   37    HD1  PHE   6           HD1      PHE   6   5.426  -6.614   0.322
   38    HD2  PHE   6           HD2      PHE   6   9.380  -5.160  -0.258
   39    HE1  PHE   6           HE1      PHE   6   5.878  -6.892   2.720
   40    HE2  PHE   6           HE2      PHE   6   9.836  -5.434   2.142
   41    HZ   PHE   6           HZ       PHE   6   8.085  -6.301   3.635
   42    H    LYS   7           H        LYS   7   7.751  -2.954  -2.033
   43    HA   LYS   7           HA       LYS   7   7.308  -1.929   0.572
   44    HB2  LYS   7           HB3      LYS   7   9.128  -1.257  -1.693
   45    HB3  LYS   7           HB2      LYS   7   8.986  -0.159  -0.340
   46    HG2  LYS   7           HG3      LYS   7   9.797  -3.053  -0.185
   47    HG3  LYS   7           HG2      LYS   7  10.869  -1.659  -0.034
   48    HD2  LYS   7           HD3      LYS   7   8.543  -2.204   1.805
   49    HD3  LYS   7           HD2      LYS   7  10.202  -2.693   2.146
   50    HE2  LYS   7           HE3      LYS   7   9.517   0.162   1.526
   51    HE3  LYS   7           HE2      LYS   7   9.340  -0.486   3.155
   52    HZ1  LYS   7           HZ1      LYS   7  11.886  -0.936   1.785
   53    HZ2  LYS   7           HZ2      LYS   7  11.573  -0.657   3.431
   54    HZ3  LYS   7           HZ3      LYS   7  11.561   0.633   2.332
   55    H    LYS   8           H        LYS   8   5.833  -1.160  -2.412
   56    HA   LYS   8           HA       LYS   8   5.084   1.484  -1.396
   57    HB2  LYS   8           HB3      LYS   8   4.916   0.445  -4.223
   58    HB3  LYS   8           HB2      LYS   8   4.518   2.073  -3.699
   59    HG2  LYS   8           HG3      LYS   8   6.622   2.331  -4.575
   60    HG3  LYS   8           HG2      LYS   8   6.963   2.144  -2.860
   61    HD2  LYS   8           HD3      LYS   8   8.531   0.812  -4.085
   62    HD3  LYS   8           HD2      LYS   8   7.389  -0.282  -3.304
   63    HE2  LYS   8           HE3      LYS   8   7.806  -1.002  -5.576
   64    HE3  LYS   8           HE2      LYS   8   6.139  -0.451  -5.411
   65    HZ1  LYS   8           HZ1      LYS   8   6.905   1.725  -6.331
   66    HZ2  LYS   8           HZ2      LYS   8   6.985   0.434  -7.420
   67    HZ3  LYS   8           HZ3      LYS   8   8.402   0.999  -6.678
   68    H    ALA   9           H        ALA   9   3.904  -1.588  -1.672
   69    HA   ALA   9           HA       ALA   9   1.401  -1.388  -2.826
   70    HB1  ALA   9           HB1      ALA   9   0.811  -3.406  -1.613
   71    HB2  ALA   9           HB2      ALA   9   2.165  -3.159  -0.511
   72    HB3  ALA   9           HB3      ALA   9   2.468  -3.506  -2.214
   73    H    ALA  10           H        ALA  10   1.897  -1.478   0.712
   74    HA   ALA  10           HA       ALA  10  -0.706  -0.257   1.082
   75    HB1  ALA  10           HB1      ALA  10  -0.383  -0.719   3.440
   76    HB2  ALA  10           HB2      ALA  10   1.302  -1.145   3.150
   77    HB3  ALA  10           HB3      ALA  10   0.013  -2.152   2.491
   78    H    HIS  11           H        HIS  11   1.773   1.184   0.018
   79    HA   HIS  11           HA       HIS  11   1.869   3.342   2.022
   80    HB2  HIS  11           HB3      HIS  11   4.018   2.056   1.373
   81    HB3  HIS  11           HB2      HIS  11   3.941   3.006  -0.111
   82    HD1  HIS  11           HD1      HIS  11   5.088   5.202   0.003
   83    HD2  HIS  11           HD2      HIS  11   3.927   3.838   3.757
   84    HE1  HIS  11           HE1      HIS  11   5.865   6.940   1.640
   85    HE2  HIS  11           HE2      HIS  11   4.997   6.188   3.877
   86    H    VAL  12           H        VAL  12   1.779   2.700  -1.486
   87    HA   VAL  12           HA       VAL  12   0.761   5.433  -1.847
   88    HB   VAL  12           HB       VAL  12   1.120   5.143  -4.246
   89   HG11  VAL  12          HG11      VAL  12   3.576   5.062  -4.228
   90   HG12  VAL  12          HG12      VAL  12   3.524   4.456  -2.573
   91   HG13  VAL  12          HG13      VAL  12   2.920   6.072  -2.940
   92   HG21  VAL  12          HG21      VAL  12   2.351   3.195  -5.109
   93   HG22  VAL  12          HG22      VAL  12   0.759   2.761  -4.480
   94   HG23  VAL  12          HG23      VAL  12   2.209   2.426  -3.528
   95    H    GLY  13           H        GLY  13  -0.073   2.060  -2.246
   96    HA2  GLY  13           HA3      GLY  13  -2.474   2.433  -3.697
   97    HA3  GLY  13           HA2      GLY  13  -2.053   1.012  -2.752
   98    H    LYS  14           H        LYS  14  -1.694   2.747  -0.335
   99    HA   LYS  14           HA       LYS  14  -4.227   2.427   0.796
  100    HB2  LYS  14           HB3      LYS  14  -3.317   3.657   2.717
  101    HB3  LYS  14           HB2      LYS  14  -2.190   2.452   2.112
  102    HG2  LYS  14           HG3      LYS  14  -0.796   4.221   2.497
  103    HG3  LYS  14           HG2      LYS  14  -1.174   4.448   0.792
  104    HD2  LYS  14           HD3      LYS  14  -1.353   6.587   1.812
  105    HD3  LYS  14           HD2      LYS  14  -3.004   6.029   1.530
  106    HE2  LYS  14           HE3      LYS  14  -2.942   6.965   3.715
  107    HE3  LYS  14           HE2      LYS  14  -3.036   5.217   3.900
  108    HZ1  LYS  14           HZ1      LYS  14  -0.534   6.811   4.087
  109    HZ2  LYS  14           HZ2      LYS  14  -0.679   5.142   4.351
  110    HZ3  LYS  14           HZ3      LYS  14  -1.425   6.240   5.414
  111    H    HIS  15           H        HIS  15  -2.981   4.955  -1.171
  112    HA   HIS  15           HA       HIS  15  -4.553   7.117  -0.253
  113    HB2  HIS  15           HB3      HIS  15  -3.237   6.502  -2.878
  114    HB3  HIS  15           HB2      HIS  15  -4.286   7.905  -2.705
  115    HD1  HIS  15           HD1      HIS  15  -0.942   7.464  -2.963
  116    HD2  HIS  15           HD2      HIS  15  -3.226   9.088   0.120
  117    HE1  HIS  15           HE1      HIS  15   0.628   8.921  -1.637
  118    HE2  HIS  15           HE2      HIS  15  -0.751   9.817   0.276
  119    H    VAL  16           H        VAL  16  -5.141   4.570  -2.607
  120    HA   VAL  16           HA       VAL  16  -7.894   5.541  -2.835
  121    HB   VAL  16           HB       VAL  16  -7.990   3.926  -4.773
  122   HG11  VAL  16          HG11      VAL  16  -8.008   6.348  -5.055
  123   HG12  VAL  16          HG12      VAL  16  -7.064   5.590  -6.337
  124   HG13  VAL  16          HG13      VAL  16  -6.246   6.378  -4.989
  125   HG21  VAL  16          HG21      VAL  16  -5.945   2.697  -4.340
  126   HG22  VAL  16          HG22      VAL  16  -4.998   4.169  -4.555
  127   HG23  VAL  16          HG23      VAL  16  -5.865   3.472  -5.922
  128    H    GLY  17           H        GLY  17  -6.494   3.756  -0.841
  129    HA2  GLY  17           HA3      GLY  17  -7.322   1.106  -1.020
  130    HA3  GLY  17           HA2      GLY  17  -7.025   1.960   0.486
  131    H    LYS  18           H        LYS  18  -9.273   3.831  -0.756
  132    HA   LYS  18           HA       LYS  18 -11.330   2.647   0.874
  133    HB2  LYS  18           HB3      LYS  18 -12.653   4.692   0.022
  134    HB3  LYS  18           HB2      LYS  18 -11.293   4.957   1.098
  135    HG2  LYS  18           HG3      LYS  18 -11.146   6.609  -0.568
  136    HG3  LYS  18           HG2      LYS  18  -9.911   5.416  -0.964
  137    HD2  LYS  18           HD3      LYS  18 -11.241   4.509  -2.718
  138    HD3  LYS  18           HD2      LYS  18 -12.652   5.439  -2.211
  139    HE2  LYS  18           HE3      LYS  18 -10.082   6.590  -3.300
  140    HE3  LYS  18           HE2      LYS  18 -11.588   6.406  -4.197
  141    HZ1  LYS  18           HZ1      LYS  18 -11.419   8.649  -3.431
  142    HZ2  LYS  18           HZ2      LYS  18 -11.120   8.153  -1.838
  143    HZ3  LYS  18           HZ3      LYS  18 -12.644   7.889  -2.534
  144    H    ALA  19           H        ALA  19 -10.401   2.368  -2.346
  145    HA   ALA  19           HA       ALA  19 -12.934   0.983  -2.918
  146    HB1  ALA  19           HB1      ALA  19 -12.865   3.076  -4.206
  147    HB2  ALA  19           HB2      ALA  19 -12.796   1.660  -5.254
  148    HB3  ALA  19           HB3      ALA  19 -11.329   2.581  -4.917
  149    H    ALA  20           H        ALA  20  -9.828   0.602  -2.233
  150    HA   ALA  20           HA       ALA  20  -9.165  -1.318  -4.339
  151    HB1  ALA  20           HB1      ALA  20  -6.934  -1.323  -3.332
  152    HB2  ALA  20           HB2      ALA  20  -7.506  -0.228  -2.077
  153    HB3  ALA  20           HB3      ALA  20  -7.456   0.307  -3.756
  154    H    LEU  21           H        LEU  21 -10.159  -1.092  -1.070
  155    HA   LEU  21           HA       LEU  21  -9.338  -3.619  -0.130
  156    HB2  LEU  21           HB3      LEU  21 -11.037  -3.240   1.638
  157    HB3  LEU  21           HB2      LEU  21  -9.940  -1.894   1.411
  158    HG   LEU  21           HG       LEU  21 -11.823  -0.870  -0.043
  159   HD11  LEU  21          HD11      LEU  21 -13.253  -2.831  -0.189
  160   HD12  LEU  21          HD12      LEU  21 -14.084  -1.516   0.641
  161   HD13  LEU  21          HD13      LEU  21 -13.416  -2.860   1.566
  162   HD21  LEU  21          HD21      LEU  21 -12.132  -1.125   2.941
  163   HD22  LEU  21          HD22      LEU  21 -12.825   0.141   1.928
  164   HD23  LEU  21          HD23      LEU  21 -11.076   0.012   2.100
  165    H    THR  22           H        THR  22 -11.608  -2.741  -2.423
  166    HA   THR  22           HA       THR  22 -13.395  -4.995  -2.032
  167    HB   THR  22           HB       THR  22 -13.259  -3.126  -4.408
  168    HG1  THR  22           HG1      THR  22 -14.882  -2.866  -2.069
  169   HG21  THR  22          HG21      THR  22 -15.513  -4.804  -3.293
  170   HG22  THR  22          HG22      THR  22 -14.609  -5.134  -4.769
  171   HG23  THR  22          HG23      THR  22 -15.633  -3.703  -4.669
  172    H    HIS  23           H        HIS  23 -10.412  -4.391  -3.527
  173    HA   HIS  23           HA       HIS  23 -10.792  -6.445  -5.578
  174    HB2  HIS  23           HB3      HIS  23  -8.461  -4.569  -5.121
  175    HB3  HIS  23           HB2      HIS  23  -8.636  -5.678  -6.477
  176    HD1  HIS  23           HD1      HIS  23  -8.632  -2.331  -6.195
  177    HD2  HIS  23           HD2      HIS  23 -11.637  -4.920  -7.455
  178    HE1  HIS  23           HE1      HIS  23 -10.200  -0.932  -7.574
  179    HE2  HIS  23           HE2      HIS  23 -11.918  -2.550  -8.463
  180    H    TYR  24           H        TYR  24  -8.191  -5.574  -3.272
  181    HA   TYR  24           HA       TYR  24  -7.649  -8.443  -3.011
  182    HB2  TYR  24           HB3      TYR  24  -5.396  -7.674  -2.146
  183    HB3  TYR  24           HB2      TYR  24  -5.701  -7.408  -3.852
  184    HD1  TYR  24           HD1      TYR  24  -6.211  -5.533  -0.638
  185    HD2  TYR  24           HD2      TYR  24  -4.921  -5.424  -4.688
  186    HE1  TYR  24           HE1      TYR  24  -5.564  -3.178  -0.362
  187    HE2  TYR  24           HE2      TYR  24  -4.277  -3.068  -4.427
  188    HH   TYR  24           HH       TYR  24  -4.656  -1.190  -3.065
  189    H    LEU  25           H        LEU  25  -6.525  -8.932  -0.838
  190    HA   LEU  25           HA       LEU  25  -6.652  -9.186   1.401
  191    HB2  LEU  25           HB3      LEU  25  -7.854  -6.419   1.375
  192    HB3  LEU  25           HB2      LEU  25  -7.383  -7.292   2.819
  193    HG   LEU  25           HG       LEU  25  -5.507  -6.440   0.617
  194   HD11  LEU  25          HD11      LEU  25  -5.864  -5.300   3.379
  195   HD12  LEU  25          HD12      LEU  25  -6.470  -4.569   1.895
  196   HD13  LEU  25          HD13      LEU  25  -4.733  -4.750   2.143
  197   HD21  LEU  25          HD21      LEU  25  -3.738  -7.094   2.139
  198   HD22  LEU  25          HD22      LEU  25  -4.799  -8.467   1.817
  199   HD23  LEU  25          HD23      LEU  25  -4.928  -7.594   3.343
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1  14.509  -7.150  -7.775
    2    H2   GLY   1           HT2      GLY   1  14.257  -6.182  -9.140
    3    H3   GLY   1           HT3      GLY   1  12.945  -6.965  -8.407
    4    HA2  GLY   1           HA2      GLY   1  14.566  -4.757  -7.263
    5    HA3  GLY   1           HA3      GLY   1  12.897  -4.659  -7.802
    6    H    TRP   2           H        TRP   2  11.571  -4.495  -6.151
    7    HA   TRP   2           HA       TRP   2  10.447  -4.947  -4.239
    8    HB2  TRP   2           HB3      TRP   2  12.227  -7.370  -4.217
    9    HB3  TRP   2           HB2      TRP   2  11.107  -7.032  -2.902
   10    HD1  TRP   2           HD1      TRP   2  11.069  -7.796  -6.696
   11    HE1  TRP   2           HE1      TRP   2   8.789  -8.855  -7.276
   12    HE3  TRP   2           HE3      TRP   2   8.771  -7.338  -2.142
   13    HZ2  TRP   2           HZ2      TRP   2   6.355  -9.413  -5.977
   14    HZ3  TRP   2           HZ3      TRP   2   6.467  -8.164  -1.902
   15    HH2  TRP   2           HH2      TRP   2   5.286  -9.179  -3.779
   16    H    GLY   3           H        GLY   3  13.963  -5.075  -4.019
   17    HA2  GLY   3           HA3      GLY   3  14.137  -4.503  -1.256
   18    HA3  GLY   3           HA2      GLY   3  15.411  -4.231  -2.440
   19    H    SER   4           H        SER   4  13.874  -2.768  -0.145
   20    HA   SER   4           HA       SER   4  13.210  -0.721   0.470
   21    HB2  SER   4           HB3      SER   4  14.343   1.220  -0.453
   22    HB3  SER   4           HB2      SER   4  15.490  -0.101  -0.263
   23    HG   SER   4           HG       SER   4  14.718  -0.450  -2.645
   24    H    PHE   5           H        PHE   5  11.857  -2.228  -1.869
   25    HA   PHE   5           HA       PHE   5   9.927  -0.064  -2.371
   26    HB2  PHE   5           HB3      PHE   5  11.175  -1.877  -4.423
   27    HB3  PHE   5           HB2      PHE   5   9.592  -1.156  -4.691
   28    HD1  PHE   5           HD1      PHE   5   9.355   1.227  -5.052
   29    HD2  PHE   5           HD2      PHE   5  13.184  -0.525  -4.425
   30    HE1  PHE   5           HE1      PHE   5  10.428   3.281  -5.877
   31    HE2  PHE   5           HE2      PHE   5  14.262   1.527  -5.248
   32    HZ   PHE   5           HZ       PHE   5  12.882   3.432  -5.975
   33    H    PHE   6           H        PHE   6  10.135  -2.364  -0.544
   34    HA   PHE   6           HA       PHE   6   7.754  -3.876  -1.364
   35    HB2  PHE   6           HB3      PHE   6   9.527  -5.361  -0.774
   36    HB3  PHE   6           HB2      PHE   6   9.915  -4.437   0.673
   37    HD1  PHE   6           HD1      PHE   6   7.141  -6.413  -0.844
   38    HD2  PHE   6           HD2      PHE   6   9.108  -5.152   2.712
   39    HE1  PHE   6           HE1      PHE   6   5.686  -7.891   0.481
   40    HE2  PHE   6           HE2      PHE   6   7.659  -6.627   4.042
   41    HZ   PHE   6           HZ       PHE   6   5.944  -8.001   2.928
   42    H    LYS   7           H        LYS   7   9.171  -2.146   1.395
   43    HA   LYS   7           HA       LYS   7   6.862  -2.275   3.007
   44    HB2  LYS   7           HB3      LYS   7   9.176  -1.900   3.831
   45    HB3  LYS   7           HB2      LYS   7   9.144  -0.298   3.109
   46    HG2  LYS   7           HG3      LYS   7   8.716  -0.114   5.456
   47    HG3  LYS   7           HG2      LYS   7   7.256   0.274   4.558
   48    HD2  LYS   7           HD3      LYS   7   6.878  -1.154   6.579
   49    HD3  LYS   7           HD2      LYS   7   6.273  -1.836   5.067
   50    HE2  LYS   7           HE3      LYS   7   7.389  -3.565   6.311
   51    HE3  LYS   7           HE2      LYS   7   8.340  -3.158   4.885
   52    HZ1  LYS   7           HZ1      LYS   7   8.900  -2.306   7.676
   53    HZ2  LYS   7           HZ2      LYS   7   9.755  -1.762   6.320
   54    HZ3  LYS   7           HZ3      LYS   7   9.795  -3.400   6.743
   55    H    LYS   8           H        LYS   8   8.019   0.055   0.639
   56    HA   LYS   8           HA       LYS   8   5.763   1.811   1.163
   57    HB2  LYS   8           HB3      LYS   8   8.143   2.039  -0.676
   58    HB3  LYS   8           HB2      LYS   8   6.825   3.200  -0.672
   59    HG2  LYS   8           HG3      LYS   8   8.398   4.194   0.677
   60    HG3  LYS   8           HG2      LYS   8   7.325   3.433   1.842
   61    HD2  LYS   8           HD3      LYS   8   9.502   2.963   2.591
   62    HD3  LYS   8           HD2      LYS   8   8.956   1.478   1.810
   63    HE2  LYS   8           HE3      LYS   8  11.254   2.016   1.190
   64    HE3  LYS   8           HE2      LYS   8  10.181   2.074  -0.207
   65    HZ1  LYS   8           HZ1      LYS   8  10.948   4.493   1.330
   66    HZ2  LYS   8           HZ2      LYS   8  10.212   4.421  -0.197
   67    HZ3  LYS   8           HZ3      LYS   8  11.824   3.941  -0.009
   68    H    ALA   9           H        ALA   9   5.947  -0.991  -0.369
   69    HA   ALA   9           HA       ALA   9   4.993  -0.350  -2.985
   70    HB1  ALA   9           HB1      ALA   9   4.851  -2.968  -1.492
   71    HB2  ALA   9           HB2      ALA   9   6.166  -2.445  -2.545
   72    HB3  ALA   9           HB3      ALA   9   4.563  -2.741  -3.218
   73    H    ALA  10           H        ALA  10   3.499  -0.987   0.104
   74    HA   ALA  10           HA       ALA  10   0.847  -1.162  -1.093
   75    HB1  ALA  10           HB1      ALA  10   1.691  -1.410   1.791
   76    HB2  ALA  10           HB2      ALA  10   1.442  -2.748   0.670
   77    HB3  ALA  10           HB3      ALA  10   0.081  -1.731   1.149
   78    H    HIS  11           H        HIS  11   2.568   1.340  -0.898
   79    HA   HIS  11           HA       HIS  11   1.234   3.100   0.934
   80    HB2  HIS  11           HB3      HIS  11   3.612   3.235  -0.268
   81    HB3  HIS  11           HB2      HIS  11   2.678   4.201  -1.411
   82    HD1  HIS  11           HD1      HIS  11   4.858   5.510   0.288
   83    HD2  HIS  11           HD2      HIS  11   0.847   5.341   1.370
   84    HE1  HIS  11           HE1      HIS  11   4.526   7.316   1.999
   85    HE2  HIS  11           HE2      HIS  11   2.061   7.324   2.500
   86    H    VAL  12           H        VAL  12   1.030   2.418  -2.518
   87    HA   VAL  12           HA       VAL  12  -0.732   4.570  -3.122
   88    HB   VAL  12           HB       VAL  12  -0.189   2.072  -4.737
   89   HG11  VAL  12          HG11      VAL  12  -0.929   3.392  -6.650
   90   HG12  VAL  12          HG12      VAL  12  -1.289   4.750  -5.585
   91   HG13  VAL  12          HG13      VAL  12  -2.207   3.251  -5.445
   92   HG21  VAL  12          HG21      VAL  12   1.157   4.771  -4.841
   93   HG22  VAL  12          HG22      VAL  12   1.453   3.426  -5.943
   94   HG23  VAL  12          HG23      VAL  12   1.870   3.275  -4.235
   95    H    GLY  13           H        GLY  13  -1.175   1.114  -2.510
   96    HA2  GLY  13           HA3      GLY  13  -3.868   0.867  -3.150
   97    HA3  GLY  13           HA2      GLY  13  -3.033  -0.097  -1.943
   98    H    LYS  14           H        LYS  14  -2.446   1.763  -0.002
   99    HA   LYS  14           HA       LYS  14  -4.996   2.060   1.218
  100    HB2  LYS  14           HB3      LYS  14  -3.790   2.845   3.152
  101    HB3  LYS  14           HB2      LYS  14  -2.980   1.450   2.460
  102    HG2  LYS  14           HG3      LYS  14  -1.225   2.849   3.013
  103    HG3  LYS  14           HG2      LYS  14  -1.459   3.173   1.295
  104    HD2  LYS  14           HD3      LYS  14  -1.120   5.238   2.597
  105    HD3  LYS  14           HD2      LYS  14  -2.702   5.193   1.819
  106    HE2  LYS  14           HE3      LYS  14  -2.886   6.035   4.095
  107    HE3  LYS  14           HE2      LYS  14  -3.722   4.491   3.929
  108    HZ1  LYS  14           HZ1      LYS  14  -2.434   4.609   5.973
  109    HZ2  LYS  14           HZ2      LYS  14  -1.011   4.863   5.084
  110    HZ3  LYS  14           HZ3      LYS  14  -1.841   3.391   4.953
  111    H    HIS  15           H        HIS  15  -3.021   4.106  -0.714
  112    HA   HIS  15           HA       HIS  15  -3.985   6.620   0.189
  113    HB2  HIS  15           HB3      HIS  15  -1.942   6.285  -1.247
  114    HB3  HIS  15           HB2      HIS  15  -3.029   5.928  -2.589
  115    HD1  HIS  15           HD1      HIS  15  -2.395   7.943  -4.004
  116    HD2  HIS  15           HD2      HIS  15  -3.688   8.952  -0.181
  117    HE1  HIS  15           HE1      HIS  15  -2.714  10.439  -4.032
  118    HE2  HIS  15           HE2      HIS  15  -3.645  11.005  -1.758
  119    H    VAL  16           H        VAL  16  -5.168   4.194  -2.005
  120    HA   VAL  16           HA       VAL  16  -7.243   5.689  -3.199
  121    HB   VAL  16           HB       VAL  16  -7.239   2.731  -2.590
  122   HG11  VAL  16          HG11      VAL  16  -9.442   3.583  -3.189
  123   HG12  VAL  16          HG12      VAL  16  -8.793   2.577  -4.483
  124   HG13  VAL  16          HG13      VAL  16  -8.773   4.334  -4.638
  125   HG21  VAL  16          HG21      VAL  16  -6.356   2.426  -4.850
  126   HG22  VAL  16          HG22      VAL  16  -5.244   3.366  -3.850
  127   HG23  VAL  16          HG23      VAL  16  -6.254   4.177  -5.048
  128    H    GLY  17           H        GLY  17  -7.243   3.520  -0.396
  129    HA2  GLY  17           HA3      GLY  17  -8.568   3.513   1.484
  130    HA3  GLY  17           HA2      GLY  17  -9.097   5.129   1.041
  131    H    LYS  18           H        LYS  18 -10.175   4.511  -1.489
  132    HA   LYS  18           HA       LYS  18 -12.804   3.817  -0.693
  133    HB2  LYS  18           HB3      LYS  18 -11.708   3.849  -3.510
  134    HB3  LYS  18           HB2      LYS  18 -13.386   4.046  -3.026
  135    HG2  LYS  18           HG3      LYS  18 -11.128   5.966  -2.502
  136    HG3  LYS  18           HG2      LYS  18 -12.446   6.173  -3.654
  137    HD2  LYS  18           HD3      LYS  18 -14.051   6.172  -1.795
  138    HD3  LYS  18           HD2      LYS  18 -12.715   6.000  -0.655
  139    HE2  LYS  18           HE3      LYS  18 -13.386   8.313  -0.755
  140    HE3  LYS  18           HE2      LYS  18 -11.786   8.139  -1.479
  141    HZ1  LYS  18           HZ1      LYS  18 -14.368   8.407  -2.922
  142    HZ2  LYS  18           HZ2      LYS  18 -12.879   8.110  -3.676
  143    HZ3  LYS  18           HZ3      LYS  18 -13.129   9.564  -2.836
  144    H    ALA  19           H        ALA  19 -10.225   1.999  -2.246
  145    HA   ALA  19           HA       ALA  19 -11.976  -0.296  -2.643
  146    HB1  ALA  19           HB1      ALA  19  -9.074   0.087  -3.377
  147    HB2  ALA  19           HB2      ALA  19 -10.460   0.322  -4.447
  148    HB3  ALA  19           HB3      ALA  19 -10.086  -1.288  -3.829
  149    H    ALA  20           H        ALA  20 -11.242   0.575   0.070
  150    HA   ALA  20           HA       ALA  20  -9.910  -1.908   0.951
  151    HB1  ALA  20           HB1      ALA  20  -8.627   0.159   1.432
  152    HB2  ALA  20           HB2      ALA  20  -9.072  -0.756   2.872
  153    HB3  ALA  20           HB3      ALA  20  -9.966   0.703   2.444
  154    H    LEU  21           H        LEU  21 -12.681   0.134   1.199
  155    HA   LEU  21           HA       LEU  21 -13.678  -0.721   3.683
  156    HB2  LEU  21           HB3      LEU  21 -15.863   0.117   2.879
  157    HB3  LEU  21           HB2      LEU  21 -14.556   1.266   2.688
  158    HG   LEU  21           HG       LEU  21 -14.465   0.364   0.239
  159   HD11  LEU  21          HD11      LEU  21 -16.003  -1.497   0.534
  160   HD12  LEU  21          HD12      LEU  21 -16.645  -0.334  -0.627
  161   HD13  LEU  21          HD13      LEU  21 -17.283  -0.383   1.017
  162   HD21  LEU  21          HD21      LEU  21 -16.130   2.046  -0.429
  163   HD22  LEU  21          HD22      LEU  21 -15.050   2.635   0.832
  164   HD23  LEU  21          HD23      LEU  21 -16.690   2.136   1.242
  165    H    THR  22           H        THR  22 -13.275  -2.388   0.840
  166    HA   THR  22           HA       THR  22 -15.484  -4.120   0.770
  167    HB   THR  22           HB       THR  22 -12.684  -4.885  -0.047
  168    HG1  THR  22           HG1      THR  22 -14.534  -3.287  -1.540
  169   HG21  THR  22          HG21      THR  22 -14.438  -6.591  -0.274
  170   HG22  THR  22          HG22      THR  22 -13.861  -6.053  -1.852
  171   HG23  THR  22          HG23      THR  22 -15.404  -5.468  -1.230
  172    H    HIS  23           H        HIS  23 -12.494  -4.149   2.627
  173    HA   HIS  23           HA       HIS  23 -13.644  -6.315   4.252
  174    HB2  HIS  23           HB3      HIS  23 -11.418  -7.276   4.632
  175    HB3  HIS  23           HB2      HIS  23 -11.831  -7.306   2.924
  176    HD1  HIS  23           HD1      HIS  23  -9.286  -6.124   5.297
  177    HD2  HIS  23           HD2      HIS  23 -10.349  -5.377   1.345
  178    HE1  HIS  23           HE1      HIS  23  -7.330  -4.907   4.280
  179    HE2  HIS  23           HE2      HIS  23  -7.908  -4.665   1.839
  180    H    TYR  24           H        TYR  24 -14.109  -3.735   4.784
  181    HA   TYR  24           HA       TYR  24 -12.502  -3.194   7.166
  182    HB2  TYR  24           HB3      TYR  24 -11.494  -1.965   5.238
  183    HB3  TYR  24           HB2      TYR  24 -13.022  -1.127   5.017
  184    HD1  TYR  24           HD2      TYR  24 -10.460  -1.747   7.667
  185    HD2  TYR  24           HD1      TYR  24 -13.266   0.960   5.961
  186    HE1  TYR  24           HE2      TYR  24  -9.690   0.011   9.207
  187    HE2  TYR  24           HE1      TYR  24 -12.500   2.725   7.486
  188    HH   TYR  24           HH       TYR  24  -9.657   2.567   9.202
  189    H    LEU  25           H        LEU  25 -15.170  -1.989   5.130
  190    HA   LEU  25           HA       LEU  25 -16.623  -1.075   7.464
  191    HB2  LEU  25           HB3      LEU  25 -16.368  -0.067   4.997
  192    HB3  LEU  25           HB2      LEU  25 -17.791  -1.053   4.733
  193    HG   LEU  25           HG       LEU  25 -18.363   1.241   5.226
  194   HD11  LEU  25          HD11      LEU  25 -19.935   0.875   7.068
  195   HD12  LEU  25          HD12      LEU  25 -19.110  -0.633   7.460
  196   HD13  LEU  25          HD13      LEU  25 -19.942  -0.458   5.913
  197   HD21  LEU  25          HD21      LEU  25 -17.878   2.263   7.355
  198   HD22  LEU  25          HD22      LEU  25 -16.382   1.753   6.567
  199   HD23  LEU  25          HD23      LEU  25 -17.049   0.802   7.891
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1  19.184  -5.774  -2.386
    2    H2   GLY   1           HT2      GLY   1  20.305  -5.237  -1.230
    3    H3   GLY   1           HT3      GLY   1  19.174  -4.157  -1.884
    4    HA2  GLY   1           HA2      GLY   1  18.547  -6.499  -0.179
    5    HA3  GLY   1           HA3      GLY   1  18.540  -4.822   0.347
    6    H    TRP   2           H        TRP   2  16.816  -7.325  -1.237
    7    HA   TRP   2           HA       TRP   2  14.746  -5.513  -2.197
    8    HB2  TRP   2           HB3      TRP   2  15.463  -7.498  -3.547
    9    HB3  TRP   2           HB2      TRP   2  14.808  -8.536  -2.286
   10    HD1  TRP   2           HD1      TRP   2  13.638  -5.971  -4.920
   11    HE1  TRP   2           HE1      TRP   2  11.172  -6.452  -5.482
   12    HE3  TRP   2           HE3      TRP   2  12.734  -9.656  -1.490
   13    HZ2  TRP   2           HZ2      TRP   2   9.120  -8.183  -4.596
   14    HZ3  TRP   2           HZ3      TRP   2  10.500 -10.676  -1.418
   15    HH2  TRP   2           HH2      TRP   2   8.731  -9.953  -2.939
   16    H    GLY   3           H        GLY   3  12.818  -5.204  -1.222
   17    HA2  GLY   3           HA3      GLY   3  11.060  -6.048   0.252
   18    HA3  GLY   3           HA2      GLY   3  12.335  -6.671   1.296
   19    H    SER   4           H        SER   4  13.655  -3.945   0.384
   20    HA   SER   4           HA       SER   4  12.867  -2.492   2.726
   21    HB2  SER   4           HB3      SER   4  14.556  -1.440   0.461
   22    HB3  SER   4           HB2      SER   4  14.606  -0.983   2.162
   23    HG   SER   4           HG       SER   4  16.249  -2.544   1.202
   24    H    PHE   5           H        PHE   5  11.420  -2.868  -0.208
   25    HA   PHE   5           HA       PHE   5  10.688  -0.045  -0.547
   26    HB2  PHE   5           HB3      PHE   5  10.253  -2.398  -2.403
   27    HB3  PHE   5           HB2      PHE   5   9.897  -0.714  -2.772
   28    HD1  PHE   5           HD1      PHE   5  11.760   0.913  -3.007
   29    HD2  PHE   5           HD2      PHE   5  12.443  -3.272  -2.604
   30    HE1  PHE   5           HE1      PHE   5  14.045   1.202  -3.871
   31    HE2  PHE   5           HE2      PHE   5  14.728  -2.985  -3.467
   32    HZ   PHE   5           HZ       PHE   5  15.531  -0.746  -4.102
   33    H    PHE   6           H        PHE   6   9.595  -1.547   1.611
   34    HA   PHE   6           HA       PHE   6   6.983  -2.490   0.950
   35    HB2  PHE   6           HB3      PHE   6   8.209  -3.306   2.917
   36    HB3  PHE   6           HB2      PHE   6   8.150  -1.699   3.627
   37    HD1  PHE   6           HD2      PHE   6   6.016  -4.510   2.495
   38    HD2  PHE   6           HD1      PHE   6   6.338  -1.050   4.948
   39    HE1  PHE   6           HE2      PHE   6   3.877  -5.073   3.565
   40    HE2  PHE   6           HE1      PHE   6   4.195  -1.609   6.024
   41    HZ   PHE   6           HZ       PHE   6   2.960  -3.623   5.332
   42    H    LYS   7           H        LYS   7   8.309   0.592   1.975
   43    HA   LYS   7           HA       LYS   7   5.905   1.785   2.810
   44    HB2  LYS   7           HB3      LYS   7   8.527   2.919   1.887
   45    HB3  LYS   7           HB2      LYS   7   7.159   3.974   2.213
   46    HG2  LYS   7           HG3      LYS   7   8.511   3.922   4.160
   47    HG3  LYS   7           HG2      LYS   7   7.050   2.999   4.507
   48    HD2  LYS   7           HD3      LYS   7   8.926   1.801   5.393
   49    HD3  LYS   7           HD2      LYS   7   8.310   0.928   3.984
   50    HE2  LYS   7           HE3      LYS   7  10.104   1.655   2.630
   51    HE3  LYS   7           HE2      LYS   7  10.589   2.887   3.792
   52    HZ1  LYS   7           HZ1      LYS   7  10.761  -0.044   4.258
   53    HZ2  LYS   7           HZ2      LYS   7  11.303   1.178   5.302
   54    HZ3  LYS   7           HZ3      LYS   7  12.062   0.947   3.803
   55    H    LYS   8           H        LYS   8   7.626   1.869  -0.289
   56    HA   LYS   8           HA       LYS   8   5.468   3.321  -1.558
   57    HB2  LYS   8           HB3      LYS   8   8.089   2.237  -2.577
   58    HB3  LYS   8           HB2      LYS   8   6.910   3.007  -3.616
   59    HG2  LYS   8           HG3      LYS   8   7.980   4.384  -1.180
   60    HG3  LYS   8           HG2      LYS   8   8.823   4.432  -2.731
   61    HD2  LYS   8           HD3      LYS   8   5.994   5.339  -2.205
   62    HD3  LYS   8           HD2      LYS   8   7.392   6.379  -2.517
   63    HE2  LYS   8           HE3      LYS   8   6.461   4.260  -4.431
   64    HE3  LYS   8           HE2      LYS   8   5.865   5.926  -4.498
   65    HZ1  LYS   8           HZ1      LYS   8   7.784   5.349  -6.002
   66    HZ2  LYS   8           HZ2      LYS   8   8.753   5.241  -4.610
   67    HZ3  LYS   8           HZ3      LYS   8   8.014   6.708  -5.017
   68    H    ALA   9           H        ALA   9   5.166   0.498  -0.496
   69    HA   ALA   9           HA       ALA   9   4.025  -0.601  -2.981
   70    HB1  ALA   9           HB1      ALA   9   4.266  -2.841  -2.012
   71    HB2  ALA   9           HB2      ALA   9   5.035  -2.139  -0.589
   72    HB3  ALA   9           HB3      ALA   9   5.825  -2.030  -2.162
   73    H    ALA  10           H        ALA  10   3.661  -0.761   0.558
   74    HA   ALA  10           HA       ALA  10   0.907  -1.522   0.355
   75    HB1  ALA  10           HB1      ALA  10   2.526  -0.675   2.751
   76    HB2  ALA  10           HB2      ALA  10   2.310  -2.325   2.169
   77    HB3  ALA  10           HB3      ALA  10   0.930  -1.426   2.797
   78    H    HIS  11           H        HIS  11   2.578   1.425   1.467
   79    HA   HIS  11           HA       HIS  11   0.249   2.756   2.317
   80    HB2  HIS  11           HB3      HIS  11   2.591   3.308   3.023
   81    HB3  HIS  11           HB2      HIS  11   2.849   4.033   1.441
   82    HD1  HIS  11           HD1      HIS  11   1.431   4.696   4.779
   83    HD2  HIS  11           HD2      HIS  11   1.355   6.451   1.005
   84    HE1  HIS  11           HE1      HIS  11   0.567   7.034   5.130
   85    HE2  HIS  11           HE2      HIS  11   0.780   8.142   2.880
   86    H    VAL  12           H        VAL  12   1.826   2.578  -0.813
   87    HA   VAL  12           HA       VAL  12   0.284   4.746  -1.925
   88    HB   VAL  12           HB       VAL  12   1.268   4.088  -4.092
   89   HG11  VAL  12          HG11      VAL  12   2.428   5.670  -2.653
   90   HG12  VAL  12          HG12      VAL  12   3.580   4.671  -3.542
   91   HG13  VAL  12          HG13      VAL  12   3.257   4.342  -1.839
   92   HG21  VAL  12          HG21      VAL  12   2.656   1.934  -2.501
   93   HG22  VAL  12          HG22      VAL  12   2.984   2.351  -4.183
   94   HG23  VAL  12          HG23      VAL  12   1.418   1.681  -3.727
   95    H    GLY  13           H        GLY  13  -0.012   1.301  -1.668
   96    HA2  GLY  13           HA3      GLY  13  -1.976   0.988  -3.725
   97    HA3  GLY  13           HA2      GLY  13  -1.585  -0.182  -2.472
   98    H    LYS  14           H        LYS  14  -2.117   1.196  -0.184
   99    HA   LYS  14           HA       LYS  14  -4.971   1.121  -0.106
  100    HB2  LYS  14           HB3      LYS  14  -4.692   1.486   2.281
  101    HB3  LYS  14           HB2      LYS  14  -3.580   0.260   1.694
  102    HG2  LYS  14           HG3      LYS  14  -2.116   1.397   2.951
  103    HG3  LYS  14           HG2      LYS  14  -1.989   2.395   1.502
  104    HD2  LYS  14           HD3      LYS  14  -2.240   3.840   3.400
  105    HD3  LYS  14           HD2      LYS  14  -3.739   3.886   2.461
  106    HE2  LYS  14           HE3      LYS  14  -4.836   2.442   4.012
  107    HE3  LYS  14           HE2      LYS  14  -3.327   2.108   4.858
  108    HZ1  LYS  14           HZ1      LYS  14  -4.772   3.711   6.013
  109    HZ2  LYS  14           HZ2      LYS  14  -4.602   4.783   4.709
  110    HZ3  LYS  14           HZ3      LYS  14  -3.245   4.349   5.631
  111    H    HIS  15           H        HIS  15  -3.137   3.414  -1.329
  112    HA   HIS  15           HA       HIS  15  -3.903   5.848  -0.173
  113    HB2  HIS  15           HB3      HIS  15  -2.134   5.611  -1.894
  114    HB3  HIS  15           HB2      HIS  15  -3.368   5.224  -3.087
  115    HD1  HIS  15           HD1      HIS  15  -1.923   8.102  -1.157
  116    HD2  HIS  15           HD2      HIS  15  -4.732   7.405  -4.151
  117    HE1  HIS  15           HE1      HIS  15  -2.474  10.361  -2.117
  118    HE2  HIS  15           HE2      HIS  15  -3.978   9.879  -4.081
  119    H    VAL  16           H        VAL  16  -5.575   3.637  -2.258
  120    HA   VAL  16           HA       VAL  16  -7.603   5.398  -3.166
  121    HB   VAL  16           HB       VAL  16  -7.735   2.395  -2.906
  122   HG11  VAL  16          HG11      VAL  16  -9.296   4.316  -4.625
  123   HG12  VAL  16          HG12      VAL  16  -9.912   3.398  -3.252
  124   HG13  VAL  16          HG13      VAL  16  -9.393   2.558  -4.714
  125   HG21  VAL  16          HG21      VAL  16  -5.783   3.050  -4.199
  126   HG22  VAL  16          HG22      VAL  16  -6.785   4.083  -5.219
  127   HG23  VAL  16          HG23      VAL  16  -7.007   2.333  -5.246
  128    H    GLY  17           H        GLY  17  -7.799   2.728  -0.833
  129    HA2  GLY  17           HA3      GLY  17  -8.992   2.505   1.108
  130    HA3  GLY  17           HA2      GLY  17  -9.093   4.257   1.163
  131    H    LYS  18           H        LYS  18 -10.361   3.696  -1.719
  132    HA   LYS  18           HA       LYS  18 -12.468   3.729  -2.580
  133    HB2  LYS  18           HB3      LYS  18 -12.850   1.822  -0.303
  134    HB3  LYS  18           HB2      LYS  18 -14.253   2.402  -1.183
  135    HG2  LYS  18           HG3      LYS  18 -13.674   0.343  -2.145
  136    HG3  LYS  18           HG2      LYS  18 -13.135   1.578  -3.280
  137    HD2  LYS  18           HD3      LYS  18 -10.864   1.306  -2.607
  138    HD3  LYS  18           HD2      LYS  18 -11.328   0.275  -1.250
  139    HE2  LYS  18           HE3      LYS  18 -12.177  -1.400  -2.820
  140    HE3  LYS  18           HE2      LYS  18 -11.697  -0.375  -4.172
  141    HZ1  LYS  18           HZ1      LYS  18 -10.112  -2.197  -3.589
  142    HZ2  LYS  18           HZ2      LYS  18  -9.779  -1.378  -2.144
  143    HZ3  LYS  18           HZ3      LYS  18  -9.432  -0.648  -3.636
  144    H    ALA  19           H        ALA  19 -11.545   5.651  -0.461
  145    HA   ALA  19           HA       ALA  19 -14.203   6.719   0.233
  146    HB1  ALA  19           HB1      ALA  19 -13.273   7.612   2.302
  147    HB2  ALA  19           HB2      ALA  19 -11.702   6.916   1.907
  148    HB3  ALA  19           HB3      ALA  19 -13.076   5.862   2.232
  149    H    ALA  20           H        ALA  20 -10.989   7.338  -0.967
  150    HA   ALA  20           HA       ALA  20 -11.378  10.217  -0.969
  151    HB1  ALA  20           HB1      ALA  20  -9.155   9.218  -0.539
  152    HB2  ALA  20           HB2      ALA  20  -9.162  10.338  -1.902
  153    HB3  ALA  20           HB3      ALA  20  -9.155   8.597  -2.191
  154    H    LEU  21           H        LEU  21 -11.360   7.524  -3.192
  155    HA   LEU  21           HA       LEU  21 -11.359   8.945  -5.604
  156    HB2  LEU  21           HB3      LEU  21 -11.956   6.892  -6.644
  157    HB3  LEU  21           HB2      LEU  21 -10.906   6.501  -5.295
  158    HG   LEU  21           HG       LEU  21 -13.188   6.100  -4.032
  159   HD11  LEU  21          HD11      LEU  21 -13.957   5.650  -6.913
  160   HD12  LEU  21          HD12      LEU  21 -14.645   6.854  -5.822
  161   HD13  LEU  21          HD13      LEU  21 -14.892   5.135  -5.508
  162   HD21  LEU  21          HD21      LEU  21 -12.032   4.175  -6.044
  163   HD22  LEU  21          HD22      LEU  21 -13.070   3.747  -4.683
  164   HD23  LEU  21          HD23      LEU  21 -11.468   4.423  -4.391
  165    H    THR  22           H        THR  22 -13.736   8.488  -3.239
  166    HA   THR  22           HA       THR  22 -16.102   8.599  -4.753
  167    HB   THR  22           HB       THR  22 -15.944   9.763  -1.998
  168    HG1  THR  22           HG1      THR  22 -16.158   7.218  -1.611
  169   HG21  THR  22          HG21      THR  22 -18.121   9.574  -3.069
  170   HG22  THR  22          HG22      THR  22 -18.013   8.439  -1.725
  171   HG23  THR  22          HG23      THR  22 -17.842   7.863  -3.382
  172    H    HIS  23           H        HIS  23 -13.842  11.029  -3.742
  173    HA   HIS  23           HA       HIS  23 -15.372  13.007  -5.280
  174    HB2  HIS  23           HB3      HIS  23 -14.627  14.776  -3.651
  175    HB3  HIS  23           HB2      HIS  23 -15.824  13.653  -3.018
  176    HD1  HIS  23           HD1      HIS  23 -15.143  12.184  -1.048
  177    HD2  HIS  23           HD2      HIS  23 -12.061  14.581  -2.482
  178    HE1  HIS  23           HE1      HIS  23 -13.286  11.992   0.643
  179    HE2  HIS  23           HE2      HIS  23 -11.542  13.652  -0.123
  180    H    TYR  24           H        TYR  24 -13.497  11.527  -6.395
  181    HA   TYR  24           HA       TYR  24 -11.192  13.300  -6.689
  182    HB2  TYR  24           HB3      TYR  24 -10.485  11.696  -5.030
  183    HB3  TYR  24           HB2      TYR  24 -11.069  10.360  -6.007
  184    HD1  TYR  24           HD2      TYR  24  -8.734  13.257  -6.466
  185    HD2  TYR  24           HD1      TYR  24  -9.451   9.097  -6.964
  186    HE1  TYR  24           HE2      TYR  24  -6.492  12.993  -7.441
  187    HE2  TYR  24           HE1      TYR  24  -7.214   8.816  -7.929
  188    HH   TYR  24           HH       TYR  24  -5.541  10.259  -9.134
  189    H    LEU  25           H        LEU  25 -13.084  10.572  -7.879
  190    HA   LEU  25           HA       LEU  25 -12.218  11.288 -10.581
  191    HB2  LEU  25           HB3      LEU  25 -12.401   8.862 -11.197
  192    HB3  LEU  25           HB2      LEU  25 -11.047   9.291 -10.175
  193    HG   LEU  25           HG       LEU  25 -12.481   8.492  -8.226
  194   HD11  LEU  25          HD11      LEU  25 -13.938   7.090 -10.456
  195   HD12  LEU  25          HD12      LEU  25 -14.604   8.390  -9.468
  196   HD13  LEU  25          HD13      LEU  25 -14.178   6.845  -8.726
  197   HD21  LEU  25          HD21      LEU  25 -11.498   6.523 -10.275
  198   HD22  LEU  25          HD22      LEU  25 -11.754   6.198  -8.559
  199   HD23  LEU  25          HD23      LEU  25 -10.507   7.340  -9.063
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1  21.718  -4.831   3.158
    2    H2   GLY   1           HT2      GLY   1  22.000  -5.994   1.958
    3    H3   GLY   1           HT3      GLY   1  22.519  -6.275   3.551
    4    HA2  GLY   1           HA2      GLY   1  20.556  -7.559   3.157
    5    HA3  GLY   1           HA3      GLY   1  20.195  -6.267   4.296
    6    H    TRP   2           H        TRP   2  18.049  -7.245   3.197
    7    HA   TRP   2           HA       TRP   2  17.450  -5.939   0.668
    8    HB2  TRP   2           HB3      TRP   2  15.871  -7.827   2.420
    9    HB3  TRP   2           HB2      TRP   2  15.239  -7.125   0.932
   10    HD1  TRP   2           HD1      TRP   2  16.410  -7.917  -1.382
   11    HE1  TRP   2           HE1      TRP   2  17.639 -10.097  -1.983
   12    HE3  TRP   2           HE3      TRP   2  17.370  -9.638   3.339
   13    HZ2  TRP   2           HZ2      TRP   2  18.839 -12.264  -0.635
   14    HZ3  TRP   2           HZ3      TRP   2  18.554 -11.778   3.595
   15    HH2  TRP   2           HH2      TRP   2  19.273 -13.064   1.647
   16    H    GLY   3           H        GLY   3  17.864  -3.853   1.999
   17    HA2  GLY   3           HA3      GLY   3  15.621  -3.006   3.633
   18    HA3  GLY   3           HA2      GLY   3  17.040  -2.047   3.232
   19    H    SER   4           H        SER   4  15.992  -3.319   0.414
   20    HA   SER   4           HA       SER   4  14.742  -0.905  -0.467
   21    HB2  SER   4           HB3      SER   4  14.978  -3.594  -1.841
   22    HB3  SER   4           HB2      SER   4  14.501  -2.083  -2.615
   23    HG   SER   4           HG       SER   4  17.021  -2.862  -1.610
   24    H    PHE   5           H        PHE   5  13.649  -3.628   1.185
   25    HA   PHE   5           HA       PHE   5  10.940  -3.497   0.125
   26    HB2  PHE   5           HB3      PHE   5  12.223  -5.219   2.253
   27    HB3  PHE   5           HB2      PHE   5  10.504  -5.276   1.880
   28    HD1  PHE   5           HD2      PHE   5   9.746  -6.086  -0.316
   29    HD2  PHE   5           HD1      PHE   5  13.837  -6.243   0.849
   30    HE1  PHE   5           HE2      PHE   5  10.189  -7.710  -2.106
   31    HE2  PHE   5           HE1      PHE   5  14.287  -7.867  -0.943
   32    HZ   PHE   5           HZ       PHE   5  12.467  -8.605  -2.419
   33    H    PHE   6           H        PHE   6  11.084  -1.137   0.850
   34    HA   PHE   6           HA       PHE   6  10.486  -0.740   3.672
   35    HB2  PHE   6           HB3      PHE   6  11.901   0.875   2.394
   36    HB3  PHE   6           HB2      PHE   6  10.515   1.251   1.382
   37    HD1  PHE   6           HD2      PHE   6  11.634   1.275   4.926
   38    HD2  PHE   6           HD1      PHE   6   9.102   2.991   1.963
   39    HE1  PHE   6           HE2      PHE   6  10.970   3.032   6.514
   40    HE2  PHE   6           HE1      PHE   6   8.438   4.751   3.545
   41    HZ   PHE   6           HZ       PHE   6   9.368   4.772   5.826
   42    H    LYS   7           H        LYS   7   8.858  -1.967   1.229
   43    HA   LYS   7           HA       LYS   7   6.722  -2.238   0.583
   44    HB2  LYS   7           HB3      LYS   7   6.381  -1.225   3.368
   45    HB3  LYS   7           HB2      LYS   7   4.959  -1.385   2.346
   46    HG2  LYS   7           HG3      LYS   7   5.154  -3.380   3.628
   47    HG3  LYS   7           HG2      LYS   7   5.603  -3.766   1.976
   48    HD2  LYS   7           HD3      LYS   7   7.164  -4.850   3.406
   49    HD3  LYS   7           HD2      LYS   7   7.996  -3.487   2.644
   50    HE2  LYS   7           HE3      LYS   7   7.482  -2.142   4.656
   51    HE3  LYS   7           HE2      LYS   7   6.835  -3.588   5.423
   52    HZ1  LYS   7           HZ1      LYS   7   9.053  -4.624   5.077
   53    HZ2  LYS   7           HZ2      LYS   7   9.064  -3.316   6.152
   54    HZ3  LYS   7           HZ3      LYS   7   9.637  -3.115   4.569
   55    H    LYS   8           H        LYS   8   7.719  -0.399  -0.834
   56    HA   LYS   8           HA       LYS   8   6.843   2.251  -0.516
   57    HB2  LYS   8           HB3      LYS   8   7.770   0.720  -2.927
   58    HB3  LYS   8           HB2      LYS   8   7.272   2.401  -3.037
   59    HG2  LYS   8           HG3      LYS   8   9.587   2.499  -2.850
   60    HG3  LYS   8           HG2      LYS   8   9.016   2.849  -1.222
   61    HD2  LYS   8           HD3      LYS   8  10.854   1.333  -1.053
   62    HD3  LYS   8           HD2      LYS   8   9.383   0.446  -0.657
   63    HE2  LYS   8           HE3      LYS   8  10.771  -0.917  -2.070
   64    HE3  LYS   8           HE2      LYS   8   9.340  -0.429  -2.973
   65    HZ1  LYS   8           HZ1      LYS   8  11.903   1.047  -3.167
   66    HZ2  LYS   8           HZ2      LYS   8  10.575   1.103  -4.224
   67    HZ3  LYS   8           HZ3      LYS   8  11.553  -0.282  -4.160
   68    H    ALA   9           H        ALA   9   5.802   0.162  -3.106
   69    HA   ALA   9           HA       ALA   9   3.466   1.587  -3.688
   70    HB1  ALA   9           HB1      ALA   9   4.528   0.058  -5.274
   71    HB2  ALA   9           HB2      ALA   9   2.818  -0.312  -5.059
   72    HB3  ALA   9           HB3      ALA   9   4.040  -1.315  -4.279
   73    H    ALA  10           H        ALA  10   4.044  -1.124  -1.533
   74    HA   ALA  10           HA       ALA  10   1.392  -1.857  -1.019
   75    HB1  ALA  10           HB1      ALA  10   3.300  -3.222  -0.372
   76    HB2  ALA  10           HB2      ALA  10   2.257  -2.897   1.014
   77    HB3  ALA  10           HB3      ALA  10   3.771  -2.012   0.822
   78    H    HIS  11           H        HIS  11   3.417   0.633   0.495
   79    HA   HIS  11           HA       HIS  11   1.425   1.249   2.489
   80    HB2  HIS  11           HB3      HIS  11   4.053   1.590   2.538
   81    HB3  HIS  11           HB2      HIS  11   3.637   3.145   1.822
   82    HD1  HIS  11           HD1      HIS  11   2.498   4.888   3.337
   83    HD2  HIS  11           HD2      HIS  11   3.199   1.227   5.190
   84    HE1  HIS  11           HE1      HIS  11   2.062   5.267   5.786
   85    HE2  HIS  11           HE2      HIS  11   2.309   2.992   6.854
   86    H    VAL  12           H        VAL  12   2.326   2.421  -0.668
   87    HA   VAL  12           HA       VAL  12   0.587   4.714  -0.579
   88    HB   VAL  12           HB       VAL  12   1.767   3.356  -3.019
   89   HG11  VAL  12          HG11      VAL  12   1.526   5.552  -4.078
   90   HG12  VAL  12          HG12      VAL  12   0.768   6.175  -2.613
   91   HG13  VAL  12          HG13      VAL  12  -0.033   4.917  -3.554
   92   HG21  VAL  12          HG21      VAL  12   2.898   5.605  -1.362
   93   HG22  VAL  12          HG22      VAL  12   3.579   4.988  -2.867
   94   HG23  VAL  12          HG23      VAL  12   3.525   3.960  -1.435
   95    H    GLY  13           H        GLY  13  -0.003   1.513  -0.539
   96    HA2  GLY  13           HA3      GLY  13  -2.116   1.147  -2.368
   97    HA3  GLY  13           HA2      GLY  13  -1.864   0.221  -0.895
   98    H    LYS  14           H        LYS  14  -1.940   3.124   0.370
   99    HA   LYS  14           HA       LYS  14  -4.623   3.114   1.208
  100    HB2  LYS  14           HB3      LYS  14  -4.110   5.302   2.196
  101    HB3  LYS  14           HB2      LYS  14  -2.848   4.126   2.514
  102    HG2  LYS  14           HG3      LYS  14  -1.704   6.101   2.030
  103    HG3  LYS  14           HG2      LYS  14  -1.595   5.148   0.550
  104    HD2  LYS  14           HD3      LYS  14  -2.098   7.408  -0.065
  105    HD3  LYS  14           HD2      LYS  14  -3.551   6.435  -0.328
  106    HE2  LYS  14           HE3      LYS  14  -4.434   7.212   1.829
  107    HE3  LYS  14           HE2      LYS  14  -3.006   8.221   2.045
  108    HZ1  LYS  14           HZ1      LYS  14  -5.005   8.464  -0.141
  109    HZ2  LYS  14           HZ2      LYS  14  -3.615   9.421   0.021
  110    HZ3  LYS  14           HZ3      LYS  14  -4.844   9.511   1.184
  111    H    HIS  15           H        HIS  15  -3.319   3.984  -1.745
  112    HA   HIS  15           HA       HIS  15  -4.728   6.211  -2.606
  113    HB2  HIS  15           HB3      HIS  15  -2.971   5.056  -3.920
  114    HB3  HIS  15           HB2      HIS  15  -4.083   3.721  -4.201
  115    HD1  HIS  15           HD1      HIS  15  -3.252   7.164  -5.375
  116    HD2  HIS  15           HD2      HIS  15  -6.124   4.234  -6.081
  117    HE1  HIS  15           HE1      HIS  15  -4.435   7.856  -7.485
  118    HE2  HIS  15           HE2      HIS  15  -5.984   5.944  -8.011
  119    H    VAL  16           H        VAL  16  -5.806   2.950  -2.081
  120    HA   VAL  16           HA       VAL  16  -8.213   2.989  -3.502
  121    HB   VAL  16           HB       VAL  16  -7.677   1.556  -0.897
  122   HG11  VAL  16          HG11      VAL  16  -9.345  -0.044  -1.708
  123   HG12  VAL  16          HG12      VAL  16  -9.609   0.956  -3.136
  124   HG13  VAL  16          HG13      VAL  16 -10.034   1.572  -1.539
  125   HG21  VAL  16          HG21      VAL  16  -5.928   1.046  -2.495
  126   HG22  VAL  16          HG22      VAL  16  -7.133   0.683  -3.730
  127   HG23  VAL  16          HG23      VAL  16  -6.995  -0.344  -2.301
  128    H    GLY  17           H        GLY  17  -7.919   3.285   0.044
  129    HA2  GLY  17           HA3      GLY  17  -9.249   4.372   1.572
  130    HA3  GLY  17           HA2      GLY  17  -9.441   5.611   0.343
  131    H    LYS  18           H        LYS  18 -10.527   2.784  -0.962
  132    HA   LYS  18           HA       LYS  18 -12.554   1.965  -1.526
  133    HB2  LYS  18           HB3      LYS  18 -13.310   2.831   1.268
  134    HB3  LYS  18           HB2      LYS  18 -14.304   1.819   0.226
  135    HG2  LYS  18           HG3      LYS  18 -11.619   1.161   1.410
  136    HG3  LYS  18           HG2      LYS  18 -13.170   0.389   1.746
  137    HD2  LYS  18           HD3      LYS  18 -11.713   0.338  -0.898
  138    HD3  LYS  18           HD2      LYS  18 -11.761  -0.979   0.273
  139    HE2  LYS  18           HE3      LYS  18 -14.089  -1.306  -0.061
  140    HE3  LYS  18           HE2      LYS  18 -14.235   0.199  -0.972
  141    HZ1  LYS  18           HZ1      LYS  18 -12.949  -0.729  -2.741
  142    HZ2  LYS  18           HZ2      LYS  18 -14.205  -1.808  -2.387
  143    HZ3  LYS  18           HZ3      LYS  18 -12.629  -2.138  -1.852
  144    H    ALA  19           H        ALA  19 -12.487   3.783  -3.039
  145    HA   ALA  19           HA       ALA  19 -13.561   5.360  -4.260
  146    HB1  ALA  19           HB1      ALA  19 -15.870   4.855  -2.385
  147    HB2  ALA  19           HB2      ALA  19 -15.542   3.989  -3.887
  148    HB3  ALA  19           HB3      ALA  19 -15.952   5.704  -3.929
  149    H    ALA  20           H        ALA  20 -12.591   5.827  -1.221
  150    HA   ALA  20           HA       ALA  20 -11.985   7.639   0.011
  151    HB1  ALA  20           HB1      ALA  20 -12.965   9.283  -2.323
  152    HB2  ALA  20           HB2      ALA  20 -11.318   8.680  -2.115
  153    HB3  ALA  20           HB3      ALA  20 -11.978   9.858  -0.978
  154    H    LEU  21           H        LEU  21 -14.668   6.412  -0.148
  155    HA   LEU  21           HA       LEU  21 -16.659   8.382   0.160
  156    HB2  LEU  21           HB3      LEU  21 -18.086   6.564   0.828
  157    HB3  LEU  21           HB2      LEU  21 -17.055   6.052  -0.496
  158    HG   LEU  21           HG       LEU  21 -15.573   4.993   1.350
  159   HD11  LEU  21          HD11      LEU  21 -16.806   4.241   3.320
  160   HD12  LEU  21          HD12      LEU  21 -18.194   5.213   2.826
  161   HD13  LEU  21          HD13      LEU  21 -16.681   6.000   3.276
  162   HD21  LEU  21          HD21      LEU  21 -16.911   2.946   1.254
  163   HD22  LEU  21          HD22      LEU  21 -16.812   3.738  -0.319
  164   HD23  LEU  21          HD23      LEU  21 -18.282   3.874   0.646
  165    H    THR  22           H        THR  22 -14.184   7.360   2.187
  166    HA   THR  22           HA       THR  22 -15.331   7.715   4.733
  167    HB   THR  22           HB       THR  22 -12.507   8.492   4.436
  168    HG1  THR  22           HG1      THR  22 -12.912   5.768   4.003
  169   HG21  THR  22          HG21      THR  22 -13.906   6.305   5.987
  170   HG22  THR  22          HG22      THR  22 -13.524   7.916   6.595
  171   HG23  THR  22          HG23      THR  22 -12.224   6.798   6.184
  172    H    HIS  23           H        HIS  23 -14.068   9.915   2.327
  173    HA   HIS  23           HA       HIS  23 -15.046  12.145   3.984
  174    HB2  HIS  23           HB3      HIS  23 -13.212  13.592   3.141
  175    HB3  HIS  23           HB2      HIS  23 -12.631  12.276   4.147
  176    HD1  HIS  23           HD1      HIS  23 -10.804  10.862   3.189
  177    HD2  HIS  23           HD2      HIS  23 -12.721  13.144   0.281
  178    HE1  HIS  23           HE1      HIS  23  -9.447  10.575   1.087
  179    HE2  HIS  23           HE2      HIS  23 -10.668  11.891  -0.679
  180    H    TYR  24           H        TYR  24 -16.564  10.847   2.127
  181    HA   TYR  24           HA       TYR  24 -16.886  12.865   0.047
  182    HB2  TYR  24           HB3      TYR  24 -15.395  11.174  -0.917
  183    HB3  TYR  24           HB2      TYR  24 -16.550   9.913  -0.522
  184    HD1  TYR  24           HD2      TYR  24 -17.072  13.251  -2.123
  185    HD2  TYR  24           HD1      TYR  24 -17.235   9.023  -2.520
  186    HE1  TYR  24           HE2      TYR  24 -18.095  13.504  -4.349
  187    HE2  TYR  24           HE1      TYR  24 -18.243   9.259  -4.743
  188    HH   TYR  24           HH       TYR  24 -18.297  12.177  -6.446
  189    H    LEU  25           H        LEU  25 -18.176   9.587   0.614
  190    HA   LEU  25           HA       LEU  25 -20.831  10.798   0.967
  191    HB2  LEU  25           HB3      LEU  25 -20.140   8.217  -0.442
  192    HB3  LEU  25           HB2      LEU  25 -21.770   8.747  -0.076
  193    HG   LEU  25           HG       LEU  25 -19.834  10.182  -1.888
  194   HD11  LEU  25          HD11      LEU  25 -20.599   8.032  -2.773
  195   HD12  LEU  25          HD12      LEU  25 -21.233   9.396  -3.695
  196   HD13  LEU  25          HD13      LEU  25 -22.271   8.544  -2.551
  197   HD21  LEU  25          HD21      LEU  25 -22.746  10.697  -1.290
  198   HD22  LEU  25          HD22      LEU  25 -21.791  11.519  -2.523
  199   HD23  LEU  25          HD23      LEU  25 -21.385  11.715  -0.819
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1  10.950   2.517 -12.337
    2    H2   GLY   1           HT2      GLY   1  12.033   2.015 -11.136
    3    H3   GLY   1           HT3      GLY   1  12.547   3.092 -12.339
    4    HA2  GLY   1           HA2      GLY   1  12.221   4.368 -10.401
    5    HA3  GLY   1           HA3      GLY   1  10.911   4.732 -11.510
    6    H    TRP   2           H        TRP   2   9.811   1.918 -10.787
    7    HA   TRP   2           HA       TRP   2   8.716   2.657  -8.158
    8    HB2  TRP   2           HB3      TRP   2   7.177   1.568 -10.529
    9    HB3  TRP   2           HB2      TRP   2   6.511   1.802  -8.914
   10    HD1  TRP   2           HD1      TRP   2   6.403   4.429  -8.057
   11    HE1  TRP   2           HE1      TRP   2   5.970   6.577  -9.414
   12    HE3  TRP   2           HE3      TRP   2   7.478   2.652 -12.737
   13    HZ2  TRP   2           HZ2      TRP   2   6.055   7.391 -12.120
   14    HZ3  TRP   2           HZ3      TRP   2   7.278   4.182 -14.653
   15    HH2  TRP   2           HH2      TRP   2   6.581   6.502 -14.347
   16    H    GLY   3           H        GLY   3   8.156   0.952  -6.808
   17    HA2  GLY   3           HA3      GLY   3   7.996  -1.306  -6.186
   18    HA3  GLY   3           HA2      GLY   3   8.795  -1.773  -7.682
   19    H    SER   4           H        SER   4  10.774   0.480  -7.016
   20    HA   SER   4           HA       SER   4  12.677  -1.054  -5.553
   21    HB2  SER   4           HB3      SER   4  12.714   1.910  -6.195
   22    HB3  SER   4           HB2      SER   4  14.102   0.912  -5.764
   23    HG   SER   4           HG       SER   4  13.422  -0.383  -7.701
   24    H    PHE   5           H        PHE   5  10.003   0.732  -4.678
   25    HA   PHE   5           HA       PHE   5  11.036   1.374  -2.005
   26    HB2  PHE   5           HB3      PHE   5   8.385   2.122  -3.272
   27    HB3  PHE   5           HB2      PHE   5   8.999   2.698  -1.727
   28    HD1  PHE   5           HD1      PHE   5  11.054   4.136  -1.704
   29    HD2  PHE   5           HD2      PHE   5   8.951   3.193  -5.276
   30    HE1  PHE   5           HE1      PHE   5  12.128   6.043  -2.831
   31    HE2  PHE   5           HE2      PHE   5  10.018   5.097  -6.416
   32    HZ   PHE   5           HZ       PHE   5  11.607   6.522  -5.191
   33    H    PHE   6           H        PHE   6  11.138  -0.798  -1.358
   34    HA   PHE   6           HA       PHE   6   9.211  -2.745  -1.865
   35    HB2  PHE   6           HB3      PHE   6  11.167  -2.674   0.439
   36    HB3  PHE   6           HB2      PHE   6  10.409  -4.105  -0.254
   37    HD1  PHE   6           HD1      PHE   6  10.939  -4.699  -2.653
   38    HD2  PHE   6           HD2      PHE   6  13.164  -1.826  -0.428
   39    HE1  PHE   6           HE1      PHE   6  12.803  -4.914  -4.242
   40    HE2  PHE   6           HE2      PHE   6  15.030  -2.039  -2.018
   41    HZ   PHE   6           HZ       PHE   6  14.850  -3.581  -3.926
   42    H    LYS   7           H        LYS   7   9.578  -0.590   0.917
   43    HA   LYS   7           HA       LYS   7   7.363  -1.888   2.277
   44    HB2  LYS   7           HB3      LYS   7   9.262  -1.250   3.631
   45    HB3  LYS   7           HB2      LYS   7   9.170   0.408   3.055
   46    HG2  LYS   7           HG3      LYS   7   8.303   0.176   5.325
   47    HG3  LYS   7           HG2      LYS   7   7.069   0.712   4.198
   48    HD2  LYS   7           HD3      LYS   7   6.131  -0.936   5.681
   49    HD3  LYS   7           HD2      LYS   7   6.230  -1.601   4.050
   50    HE2  LYS   7           HE3      LYS   7   8.389  -2.644   4.709
   51    HE3  LYS   7           HE2      LYS   7   8.067  -2.140   6.365
   52    HZ1  LYS   7           HZ1      LYS   7   5.931  -3.395   6.193
   53    HZ2  LYS   7           HZ2      LYS   7   7.321  -4.363   6.155
   54    HZ3  LYS   7           HZ3      LYS   7   6.478  -4.032   4.719
   55    H    LYS   8           H        LYS   8   7.811   0.632   0.064
   56    HA   LYS   8           HA       LYS   8   5.410   2.050   0.977
   57    HB2  LYS   8           HB3      LYS   8   7.403   2.897  -1.130
   58    HB3  LYS   8           HB2      LYS   8   6.107   3.868  -0.479
   59    HG2  LYS   8           HG3      LYS   8   8.305   2.784   1.247
   60    HG3  LYS   8           HG2      LYS   8   8.437   4.329   0.400
   61    HD2  LYS   8           HD3      LYS   8   6.289   3.563   2.374
   62    HD3  LYS   8           HD2      LYS   8   7.645   4.652   2.688
   63    HE2  LYS   8           HE3      LYS   8   5.703   5.106   0.455
   64    HE3  LYS   8           HE2      LYS   8   5.405   5.719   2.090
   65    HZ1  LYS   8           HZ1      LYS   8   7.469   6.972   1.957
   66    HZ2  LYS   8           HZ2      LYS   8   6.448   7.381   0.665
   67    HZ3  LYS   8           HZ3      LYS   8   7.773   6.364   0.401
   68    H    ALA   9           H        ALA   9   6.113  -0.444  -0.953
   69    HA   ALA   9           HA       ALA   9   4.776   0.195  -3.371
   70    HB1  ALA   9           HB1      ALA   9   6.431  -1.603  -3.206
   71    HB2  ALA   9           HB2      ALA   9   4.894  -2.185  -3.848
   72    HB3  ALA   9           HB3      ALA   9   5.331  -2.513  -2.171
   73    H    ALA  10           H        ALA  10   3.783  -1.633  -0.480
   74    HA   ALA  10           HA       ALA  10   1.073  -1.874  -1.450
   75    HB1  ALA  10           HB1      ALA  10   2.211  -2.505   1.273
   76    HB2  ALA  10           HB2      ALA  10   2.075  -3.638  -0.074
   77    HB3  ALA  10           HB3      ALA  10   0.619  -2.976   0.674
   78    H    HIS  11           H        HIS  11   2.897   0.382   0.369
   79    HA   HIS  11           HA       HIS  11   0.680   1.448   1.850
   80    HB2  HIS  11           HB3      HIS  11   3.570   2.125   1.604
   81    HB3  HIS  11           HB2      HIS  11   2.468   3.358   2.217
   82    HD1  HIS  11           HD1      HIS  11   4.283   0.326   3.210
   83    HD2  HIS  11           HD2      HIS  11   1.056   2.554   4.604
   84    HE1  HIS  11           HE1      HIS  11   3.870  -0.466   5.562
   85    HE2  HIS  11           HE2      HIS  11   1.885   0.862   6.374
   86    H    VAL  12           H        VAL  12   2.017   1.988  -1.283
   87    HA   VAL  12           HA       VAL  12   0.939   4.603  -1.666
   88    HB   VAL  12           HB       VAL  12   2.705   3.426  -3.104
   89   HG11  VAL  12          HG11      VAL  12   1.542   1.365  -3.557
   90   HG12  VAL  12          HG12      VAL  12   1.864   2.212  -5.068
   91   HG13  VAL  12          HG13      VAL  12   0.245   2.239  -4.369
   92   HG21  VAL  12          HG21      VAL  12   1.992   4.618  -5.154
   93   HG22  VAL  12          HG22      VAL  12   1.859   5.599  -3.697
   94   HG23  VAL  12          HG23      VAL  12   0.415   4.884  -4.413
   95    H    GLY  13           H        GLY  13  -0.324   1.457  -1.539
   96    HA2  GLY  13           HA3      GLY  13  -2.645   1.801  -3.146
   97    HA3  GLY  13           HA2      GLY  13  -2.377   0.526  -1.970
   98    H    LYS  14           H        LYS  14  -1.872   3.198  -0.187
   99    HA   LYS  14           HA       LYS  14  -4.357   3.106   1.126
  100    HB2  LYS  14           HB3      LYS  14  -3.577   4.992   2.434
  101    HB3  LYS  14           HB2      LYS  14  -2.275   3.835   2.209
  102    HG2  LYS  14           HG3      LYS  14  -1.277   5.940   1.970
  103    HG3  LYS  14           HG2      LYS  14  -1.456   5.329   0.327
  104    HD2  LYS  14           HD3      LYS  14  -2.076   7.670   0.409
  105    HD3  LYS  14           HD2      LYS  14  -3.502   6.678   0.072
  106    HE2  LYS  14           HE3      LYS  14  -4.109   6.812   2.464
  107    HE3  LYS  14           HE2      LYS  14  -2.731   7.880   2.735
  108    HZ1  LYS  14           HZ1      LYS  14  -3.710   9.452   1.155
  109    HZ2  LYS  14           HZ2      LYS  14  -4.744   9.155   2.464
  110    HZ3  LYS  14           HZ3      LYS  14  -5.056   8.433   0.965
  111    H    HIS  15           H        HIS  15  -3.344   4.690  -1.702
  112    HA   HIS  15           HA       HIS  15  -4.912   6.987  -1.771
  113    HB2  HIS  15           HB3      HIS  15  -3.944   5.147  -3.942
  114    HB3  HIS  15           HB2      HIS  15  -4.934   6.552  -4.312
  115    HD1  HIS  15           HD1      HIS  15  -1.706   5.832  -4.819
  116    HD2  HIS  15           HD2      HIS  15  -3.444   8.762  -2.431
  117    HE1  HIS  15           HE1      HIS  15   0.056   7.602  -4.520
  118    HE2  HIS  15           HE2      HIS  15  -1.108   9.471  -3.297
  119    H    VAL  16           H        VAL  16  -5.718   3.651  -2.482
  120    HA   VAL  16           HA       VAL  16  -8.250   4.004  -3.588
  121    HB   VAL  16           HB       VAL  16  -7.393   1.743  -1.782
  122   HG11  VAL  16          HG11      VAL  16  -9.490   1.898  -3.942
  123   HG12  VAL  16          HG12      VAL  16  -9.778   1.759  -2.206
  124   HG13  VAL  16          HG13      VAL  16  -9.018   0.431  -3.084
  125   HG21  VAL  16          HG21      VAL  16  -5.768   2.072  -3.569
  126   HG22  VAL  16          HG22      VAL  16  -7.062   2.028  -4.765
  127   HG23  VAL  16          HG23      VAL  16  -6.687   0.588  -3.819
  128    H    GLY  17           H        GLY  17  -7.544   3.130  -0.197
  129    HA2  GLY  17           HA3      GLY  17  -8.818   3.390   1.700
  130    HA3  GLY  17           HA2      GLY  17  -9.178   4.979   1.044
  131    H    LYS  18           H        LYS  18 -10.188   2.534  -1.021
  132    HA   LYS  18           HA       LYS  18 -12.185   1.664  -1.630
  133    HB2  LYS  18           HB3      LYS  18 -13.099   2.174   1.208
  134    HB3  LYS  18           HB2      LYS  18 -13.872   1.121   0.036
  135    HG2  LYS  18           HG3      LYS  18 -11.185   0.721   1.326
  136    HG3  LYS  18           HG2      LYS  18 -12.659  -0.197   1.630
  137    HD2  LYS  18           HD3      LYS  18 -12.625  -0.973  -0.711
  138    HD3  LYS  18           HD2      LYS  18 -11.106  -0.110  -0.955
  139    HE2  LYS  18           HE3      LYS  18 -11.617  -2.402   0.931
  140    HE3  LYS  18           HE2      LYS  18 -10.630  -2.431  -0.530
  141    HZ1  LYS  18           HZ1      LYS  18  -9.122  -0.849   0.512
  142    HZ2  LYS  18           HZ2      LYS  18  -9.260  -2.251   1.453
  143    HZ3  LYS  18           HZ3      LYS  18 -10.069  -0.838   1.916
  144    H    ALA  19           H        ALA  19 -12.636   3.258  -3.053
  145    HA   ALA  19           HA       ALA  19 -13.760   4.953  -4.041
  146    HB1  ALA  19           HB1      ALA  19 -15.919   5.635  -3.164
  147    HB2  ALA  19           HB2      ALA  19 -15.557   4.869  -1.618
  148    HB3  ALA  19           HB3      ALA  19 -15.742   3.882  -3.067
  149    H    ALA  20           H        ALA  20 -11.740   5.394  -1.664
  150    HA   ALA  20           HA       ALA  20 -12.345   8.184  -1.080
  151    HB1  ALA  20           HB1      ALA  20 -10.020   6.474  -0.230
  152    HB2  ALA  20           HB2      ALA  20 -11.473   6.788   0.718
  153    HB3  ALA  20           HB3      ALA  20 -10.362   8.107   0.340
  154    H    LEU  21           H        LEU  21 -10.355   6.215  -3.110
  155    HA   LEU  21           HA       LEU  21  -8.592   8.226  -4.048
  156    HB2  LEU  21           HB3      LEU  21  -8.052   6.739  -5.823
  157    HB3  LEU  21           HB2      LEU  21  -8.328   5.752  -4.403
  158    HG   LEU  21           HG       LEU  21 -10.437   6.159  -6.525
  159   HD11  LEU  21          HD11      LEU  21  -9.760   4.011  -7.448
  160   HD12  LEU  21          HD12      LEU  21  -8.414   3.932  -6.312
  161   HD13  LEU  21          HD13      LEU  21  -8.447   5.182  -7.555
  162   HD21  LEU  21          HD21      LEU  21 -11.243   5.362  -4.360
  163   HD22  LEU  21          HD22      LEU  21 -10.062   4.055  -4.392
  164   HD23  LEU  21          HD23      LEU  21 -11.363   4.095  -5.580
  165    H    THR  22           H        THR  22 -11.901   7.755  -4.407
  166    HA   THR  22           HA       THR  22 -12.162   9.129  -6.940
  167    HB   THR  22           HB       THR  22 -14.445   8.673  -5.046
  168    HG1  THR  22           HG1      THR  22 -14.161   6.523  -6.616
  169   HG21  THR  22          HG21      THR  22 -14.858   9.791  -7.189
  170   HG22  THR  22          HG22      THR  22 -15.655   8.219  -7.126
  171   HG23  THR  22          HG23      THR  22 -14.161   8.415  -8.044
  172    H    HIS  23           H        HIS  23 -11.538  10.008  -3.800
  173    HA   HIS  23           HA       HIS  23 -13.098  12.475  -3.869
  174    HB2  HIS  23           HB3      HIS  23 -11.534  11.094  -1.699
  175    HB3  HIS  23           HB2      HIS  23 -12.108  12.747  -1.520
  176    HD1  HIS  23           HD1      HIS  23 -13.350   9.206  -1.751
  177    HD2  HIS  23           HD2      HIS  23 -14.819  13.019  -1.018
  178    HE1  HIS  23           HE1      HIS  23 -15.656   8.868  -0.839
  179    HE2  HIS  23           HE2      HIS  23 -16.602  11.192  -0.602
  180    H    TYR  24           H        TYR  24  -9.779  11.810  -2.713
  181    HA   TYR  24           HA       TYR  24  -9.115  14.533  -3.417
  182    HB2  TYR  24           HB3      TYR  24  -6.919  13.968  -2.273
  183    HB3  TYR  24           HB2      TYR  24  -8.365  13.981  -1.279
  184    HD1  TYR  24           HD1      TYR  24  -6.665  11.379  -3.413
  185    HD2  TYR  24           HD2      TYR  24  -8.269  12.421   0.391
  186    HE1  TYR  24           HE1      TYR  24  -6.059   9.157  -2.551
  187    HE2  TYR  24           HE2      TYR  24  -7.682  10.200   1.256
  188    HH   TYR  24           HH       TYR  24  -7.262   7.890   0.309
  189    H    LEU  25           H        LEU  25  -8.999  11.718  -5.117
  190    HA   LEU  25           HA       LEU  25  -6.599  12.564  -6.587
  191    HB2  LEU  25           HB3      LEU  25  -7.977   9.882  -6.500
  192    HB3  LEU  25           HB2      LEU  25  -6.678  10.277  -7.607
  193    HG   LEU  25           HG       LEU  25  -6.470  10.246  -4.599
  194   HD11  LEU  25          HD11      LEU  25  -6.767   8.032  -5.642
  195   HD12  LEU  25          HD12      LEU  25  -5.185   8.235  -4.888
  196   HD13  LEU  25          HD13      LEU  25  -5.348   8.343  -6.641
  197   HD21  LEU  25          HD21      LEU  25  -4.077  10.502  -4.977
  198   HD22  LEU  25          HD22      LEU  25  -4.966  11.874  -5.636
  199   HD23  LEU  25          HD23      LEU  25  -4.352  10.620  -6.714