*HEADER    ANTIMICROBIAL PROTEIN                   24-APR-12   2LSA              
*TITLE     MAGAININ                                                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MAGAININ-2;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: MAGAININ II;                                                
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: XENOPUS LAEVIS;                                 
*SOURCE   4 ORGANISM_COMMON: CLAWED FROG,COMMON PLATANNA,PLATANNA;               
*SOURCE   5 ORGANISM_TAXID: 8355                                                 
*KEYWDS    ANTIMICROBIAL PEPTIDE, ANTIMICROBIAL PROTEIN                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    L.S.VERMEER, J.A.MASON                                                
*REVDAT   1   03-APR-13 2LSA    0                                                


assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    9 and name   HN) 2.490 0.775 0.775 weight 1.000 ! spec=NOESY, no=1, id=0, vol=1.510000e+07
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name   HN) 2.540 0.806 0.806 weight 1.000 ! spec=NOESY, no=2, id=1, vol=1.340000e+07
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   19 and name   HN) 2.662 0.886 0.886 weight 1.000 ! spec=NOESY, no=3, id=2, vol=1.010000e+07
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name   HN) 2.675 0.894 0.894 weight 1.000 ! spec=NOESY, no=4, id=3, vol=9.820000e+06
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name   HN) 2.856 1.020 1.020 weight 1.000 ! spec=NOESY, no=5, id=4, vol=6.620000e+06
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name   HN) 2.653 0.880 0.880 weight 1.000 ! spec=NOESY, no=6, id=5, vol=1.030000e+07
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name   HN) 2.378 0.707 0.707 weight 1.000 ! spec=NOESY, no=7, id=6, vol=1.990000e+07
assign (segid "   A" and resid   13 and name  HA2) (segid "   A" and resid   13 and name   HN) 2.170 0.589 0.589 weight 1.000 ! spec=NOESY, no=8, id=7, vol=3.440000e+07
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name   HN) 2.641 0.872 0.872 weight 1.000 ! spec=NOESY, no=9, id=8, vol=1.060000e+07
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   17 and name   HN) 2.701 0.912 0.912 weight 1.000 ! spec=NOESY, no=10, id=9, vol=9.260000e+06
assign (segid "   A" and resid   18 and name  HA2) (segid "   A" and resid   18 and name   HN) 2.257 0.637 0.637 weight 1.000 ! spec=NOESY, no=11, id=10, vol=2.720000e+07
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name   HN) 2.605 0.848 0.848 weight 1.000 ! spec=NOESY, no=13, id=12, vol=1.150000e+07
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name   HN) 2.845 1.012 1.012 weight 1.000 ! spec=NOESY, no=14, id=13, vol=6.780000e+06
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    4 and name   HN) 2.763 0.954 0.954 weight 1.000 ! spec=NOESY, no=15, id=14, vol=8.080000e+06
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   11 and name   HN) 2.601 0.846 0.846 weight 1.000 ! spec=NOESY, no=16, id=15, vol=1.160000e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name   HN) 2.699 0.911 0.911 weight 1.000 ! spec=NOESY, no=17, id=16, vol=9.300000e+06
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name   HN) 2.878 1.035 1.035 weight 1.000 ! spec=NOESY, no=18, id=17, vol=6.330000e+06
assign (segid "   A" and resid    3 and name  HA2) (segid "   A" and resid    3 and name   HN) 2.521 0.795 0.795 weight 1.000 ! spec=NOESY, no=20, id=19, vol=1.400000e+07
assign (segid "   A" and resid    1 and name  HA2) (segid "   A" and resid    1 and name  HT3) 2.710 0.918 0.918 weight 1.000 ! spec=NOESY, no=22, id=21, vol=9.070000e+06
    or (segid "   A" and resid    1 and name  HA2) (segid "   A" and resid    1 and name  HT2)
    or (segid "   A" and resid    1 and name  HA2) (segid "   A" and resid    1 and name  HT1)
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name   HN) 2.686 0.902 0.902 weight 1.000 ! spec=NOESY, no=23, id=22, vol=9.570000e+06
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   22 and name   HN) 2.518 0.793 0.793 weight 1.000 ! spec=NOESY, no=24, id=23, vol=1.410000e+07
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name   HN) 3.228 1.302 1.302 weight 1.000 ! spec=NOESY, no=25, id=24, vol=3.180000e+06
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   23 and name   HN) 3.095 1.197 1.197 weight 1.000 ! spec=NOESY, no=27, id=26, vol=4.090000e+06
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name   HN) 2.726 0.929 0.929 weight 1.000 ! spec=NOESY, no=28, id=27, vol=8.770000e+06
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    6 and name   HN) 3.254 1.323 1.323 weight 1.000 ! spec=NOESY, no=30, id=29, vol=3.030000e+06
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    8 and name   HN) 3.216 1.293 1.293 weight 1.000 ! spec=NOESY, no=31, id=30, vol=3.250000e+06
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    8 and name   HN) 3.266 1.334 1.334 weight 1.000 ! spec=NOESY, no=32, id=31, vol=2.960000e+06
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid   10 and name   HN) 3.226 1.301 1.301 weight 1.000 ! spec=NOESY, no=33, id=32, vol=3.190000e+06
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    9 and name   HN) 3.043 1.157 1.157 weight 1.000 ! spec=NOESY, no=34, id=33, vol=4.530000e+06
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   17 and name   HN) 2.963 1.098 1.098 weight 1.000 ! spec=NOESY, no=35, id=34, vol=5.310000e+06
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   13 and name   HN) 2.968 1.101 1.101 weight 1.000 ! spec=NOESY, no=36, id=35, vol=5.260000e+06
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   13 and name   HN) 3.124 1.220 1.220 weight 1.000 ! spec=NOESY, no=37, id=36, vol=3.870000e+06
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   14 and name   HN) 2.463 0.758 0.758 weight 1.000 ! spec=NOESY, no=38, id=37, vol=1.610000e+07
assign (segid "   A" and resid   13 and name  HA2) (segid "   A" and resid   14 and name   HN) 2.569 0.825 0.825 weight 1.000 ! spec=NOESY, no=39, id=38, vol=1.250000e+07
assign (segid "   A" and resid   13 and name  HA2) (segid "   A" and resid   16 and name   HN) 3.108 1.207 1.207 weight 1.000 ! spec=NOESY, no=40, id=39, vol=3.990000e+06
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   21 and name   HN) 2.924 1.069 1.069 weight 1.000 ! spec=NOESY, no=41, id=40, vol=5.750000e+06
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name   HN) 2.760 0.952 0.952 weight 1.000 ! spec=NOESY, no=42, id=41, vol=8.140000e+06
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   17 and name   HN) 3.349 1.402 1.402 weight 1.000 ! spec=NOESY, no=43, id=42, vol=2.550000e+06
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid   12 and name   HN) 3.189 1.271 1.271 weight 1.000 ! spec=NOESY, no=44, id=43, vol=3.420000e+06
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   16 and name   HN) 3.150 1.240 1.240 weight 1.000 ! spec=NOESY, no=45, id=44, vol=3.680000e+06
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   18 and name   HN) 3.293 1.355 1.355 weight 1.000 ! spec=NOESY, no=46, id=45, vol=2.820000e+06
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name   HN) 3.565 1.589 1.589 weight 1.000 ! spec=NOESY, no=47, id=46, vol=1.750000e+06
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   22 and name   HN) 2.906 1.056 1.056 weight 1.000 ! spec=NOESY, no=48, id=47, vol=5.970000e+06
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   19 and name   HN) 3.170 1.256 1.256 weight 1.000 ! spec=NOESY, no=49, id=48, vol=3.540000e+06
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   11 and name   HN) 3.122 1.219 1.219 weight 1.000 ! spec=NOESY, no=50, id=49, vol=3.880000e+06
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   20 and name   HN) 2.983 1.112 1.112 weight 1.000 ! spec=NOESY, no=51, id=50, vol=5.100000e+06
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   22 and name   HN) 3.159 1.247 1.247 weight 1.000 ! spec=NOESY, no=52, id=51, vol=3.620000e+06
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    5 and name   HN) 3.233 1.306 1.306 weight 1.000 ! spec=NOESY, no=53, id=52, vol=3.150000e+06
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid   10 and name   HN) 2.971 1.103 1.103 weight 1.000 ! spec=NOESY, no=54, id=53, vol=5.230000e+06
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid   10 and name   HN) 2.916 1.063 1.063 weight 1.000 ! spec=NOESY, no=55, id=54, vol=5.850000e+06
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   18 and name   HN) 3.961 1.961 1.961 weight 1.000 ! spec=NOESY, no=56, id=55, vol=9.310000e+05
assign (segid "   A" and resid    3 and name  HA2) (segid "   A" and resid    4 and name   HN) 3.011 1.134 1.134 weight 1.000 ! spec=NOESY, no=57, id=56, vol=4.820000e+06
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   15 and name   HN) 3.028 1.146 1.146 weight 1.000 ! spec=NOESY, no=59, id=58, vol=4.660000e+06
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   11 and name   HN) 2.991 1.118 1.118 weight 1.000 ! spec=NOESY, no=61, id=60, vol=5.020000e+06
assign (segid "   A" and resid   18 and name  HA2) (segid "   A" and resid   19 and name   HN) 2.718 0.924 0.924 weight 1.000 ! spec=NOESY, no=62, id=61, vol=8.910000e+06
assign (segid "   A" and resid    1 and name  HA2) (segid "   A" and resid    4 and name   HN) 3.427 1.468 1.468 weight 1.000 ! spec=NOESY, no=63, id=62, vol=2.220000e+06
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name   HN) 3.059 1.169 1.169 weight 1.000 ! spec=NOESY, no=65, id=64, vol=4.390000e+06
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   20 and name   HN) 3.098 1.199 1.199 weight 1.000 ! spec=NOESY, no=66, id=65, vol=4.070000e+06
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name   HN) 2.719 0.924 0.924 weight 1.000 ! spec=NOESY, no=67, id=66, vol=8.890000e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   13 and name   HN) 2.617 0.856 0.856 weight 1.000 ! spec=NOESY, no=68, id=67, vol=1.120000e+07
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name   HN) 2.734 0.935 0.935 weight 1.000 ! spec=NOESY, no=69, id=68, vol=8.600000e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    9 and name   HN) 2.681 0.899 0.899 weight 1.000 ! spec=NOESY, no=70, id=69, vol=9.680000e+06
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HN) 2.670 0.891 0.891 weight 1.000 ! spec=NOESY, no=71, id=70, vol=9.930000e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    6 and name   HN) 2.720 0.925 0.925 weight 1.000 ! spec=NOESY, no=72, id=71, vol=8.870000e+06
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name   HN) 2.825 0.998 0.998 weight 1.000 ! spec=NOESY, no=73, id=72, vol=7.070000e+06
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name   HN) 2.948 1.086 1.086 weight 1.000 ! spec=NOESY, no=74, id=73, vol=5.480000e+06
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name   HN) 2.676 0.895 0.895 weight 1.000 ! spec=NOESY, no=75, id=74, vol=9.790000e+06
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name   HN) 2.766 0.956 0.956 weight 1.000 ! spec=NOESY, no=76, id=75, vol=8.030000e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   21 and name   HN) 2.670 0.891 0.891 weight 1.000 ! spec=NOESY, no=77, id=76, vol=9.920000e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name   HN) 2.641 0.872 0.872 weight 1.000 ! spec=NOESY, no=78, id=77, vol=1.060000e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name   HN) 2.649 0.877 0.877 weight 1.000 ! spec=NOESY, no=79, id=78, vol=1.040000e+07
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    7 and name   HN) 2.436 0.742 0.742 weight 1.000 ! spec=NOESY, no=80, id=79, vol=1.720000e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   16 and name   HN) 2.734 0.935 0.935 weight 1.000 ! spec=NOESY, no=81, id=80, vol=8.600000e+06
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   13 and name   HN) 4.073 2.074 2.074 weight 1.000 ! spec=NOESY, no=82, id=81, vol=7.870000e+05
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   13 and name   HN) 2.601 0.846 0.846 weight 1.000 ! spec=NOESY, no=83, id=82, vol=1.160000e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name   HN) 3.998 1.998 1.998 weight 1.000 ! spec=NOESY, no=84, id=83, vol=8.800000e+05
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   17 and name   HN) 3.151 1.241 1.241 weight 1.000 ! spec=NOESY, no=85, id=84, vol=3.670000e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   17 and name   HN) 3.319 1.377 1.377 weight 1.000 ! spec=NOESY, no=86, id=85, vol=2.690000e+06
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   14 and name   HN) 3.342 1.396 1.396 weight 1.000 ! spec=NOESY, no=87, id=86, vol=2.580000e+06
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   14 and name   HN) 2.669 0.891 0.891 weight 1.000 ! spec=NOESY, no=88, id=87, vol=9.940000e+06
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   19 and name   HN) 2.629 0.864 0.864 weight 1.000 ! spec=NOESY, no=89, id=88, vol=1.090000e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   23 and name   HN) 3.533 1.560 1.560 weight 1.000 ! spec=NOESY, no=90, id=89, vol=1.850000e+06
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   16 and name   HN) 3.344 1.398 1.398 weight 1.000 ! spec=NOESY, no=91, id=90, vol=2.570000e+06
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   21 and name   HN) 3.631 1.648 1.648 weight 1.000 ! spec=NOESY, no=92, id=91, vol=1.570000e+06
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    7 and name   HN) 3.705 1.716 1.716 weight 1.000 ! spec=NOESY, no=93, id=92, vol=1.390000e+06
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   23 and name   HN) 2.989 1.117 1.117 weight 1.000 ! spec=NOESY, no=94, id=93, vol=5.040000e+06
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   12 and name   HN) 3.183 1.266 1.266 weight 1.000 ! spec=NOESY, no=95, id=94, vol=3.460000e+06
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   10 and name   HN) 2.495 0.778 0.778 weight 1.000 ! spec=NOESY, no=96, id=95, vol=1.490000e+07
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   20 and name   HN) 3.445 1.484 1.484 weight 1.000 ! spec=NOESY, no=97, id=96, vol=2.150000e+06
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   17 and name   HN) 4.329 2.343 2.343 weight 1.000 ! spec=NOESY, no=98, id=97, vol=5.460000e+05
assign (segid "   A" and resid    2 and name   HA) (segid "   A" and resid    2 and name   HN) 2.888 1.042 1.042 weight 1.000 ! spec=NOESY, no=99, id=98, vol=6.200000e+06
assign (segid "   A" and resid    2 and name   HA) (segid "   A" and resid    5 and name   HN) 3.864 1.866 1.866 weight 1.000 ! spec=NOESY, no=100, id=99, vol=1.080000e+06
assign (segid "   A" and resid    2 and name   HA) (segid "   A" and resid    4 and name   HN) 3.608 1.627 1.627 weight 1.000 ! spec=NOESY, no=101, id=100, vol=1.630000e+06
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   16 and name   HN) 2.979 1.110 1.110 weight 1.000 ! spec=NOESY, no=102, id=101, vol=5.140000e+06
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    2 and name   HN) 2.976 1.107 1.107 weight 1.000 ! spec=NOESY, no=103, id=102, vol=5.170000e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   22 and name   HN) 3.597 1.617 1.617 weight 1.000 ! spec=NOESY, no=104, id=103, vol=1.660000e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name   HN) 3.307 1.367 1.367 weight 1.000 ! spec=NOESY, no=105, id=104, vol=2.750000e+06
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   21 and name   HN) 3.107 1.206 1.206 weight 1.000 ! spec=NOESY, no=106, id=105, vol=4.000000e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   18 and name   HN) 3.241 1.313 1.313 weight 1.000 ! spec=NOESY, no=107, id=106, vol=3.100000e+06
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid   11 and name   HN) 3.079 1.185 1.185 weight 1.000 ! spec=NOESY, no=108, id=107, vol=4.220000e+06
assign (segid "   A" and resid   13 and name  HA2) (segid "   A" and resid   12 and name   HN) 3.224 1.299 1.299 weight 1.000 ! spec=NOESY, no=109, id=108, vol=3.200000e+06
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    6 and name   HN) 2.418 0.731 0.731 weight 1.000 ! spec=NOESY, no=110, id=109, vol=1.800000e+07
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    6 and name   HN) 2.645 0.874 0.874 weight 1.000 ! spec=NOESY, no=111, id=110, vol=1.050000e+07
assign (segid "   A" and resid   18 and name  HA2) (segid "   A" and resid   17 and name   HN) 3.309 1.368 1.368 weight 1.000 ! spec=NOESY, no=112, id=111, vol=2.740000e+06

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1  -5.468   5.131  -1.290
    2    H2   GLY   1           HT2      GLY   1  -4.840   3.968  -0.228
    3    H3   GLY   1           HT3      GLY   1  -4.936   5.589   0.254
    4    HA2  GLY   1           HA1      GLY   1  -7.339   5.522   0.179
    5    HA3  GLY   1           HA2      GLY   1  -7.263   3.845  -0.343
    6    H    ILE   2           HN       ILE   2  -8.360   5.258   2.102
    7    HA   ILE   2           HA       ILE   2  -7.040   3.524   4.079
    8    HB   ILE   2           HB       ILE   2  -6.289   5.815   4.461
    9   HG12  ILE   2          HG12      ILE   2  -8.289   4.942   6.558
   10   HG13  ILE   2          HG11      ILE   2  -6.641   4.344   6.409
   11   HG21  ILE   2          HG21      ILE   2  -7.857   7.590   5.076
   12   HG22  ILE   2          HG22      ILE   2  -9.208   6.508   4.744
   13   HG23  ILE   2          HG23      ILE   2  -8.136   7.006   3.436
   14   HD11  ILE   2          HD11      ILE   2  -5.796   6.596   6.851
   15   HD12  ILE   2          HD12      ILE   2  -6.798   5.989   8.168
   16   HD13  ILE   2          HD13      ILE   2  -7.451   7.173   7.034
   17    H    GLY   3           HN       GLY   3  -9.930   4.788   2.706
   18    HA2  GLY   3           HA2      GLY   3 -11.755   4.092   4.758
   19    HA3  GLY   3           HA1      GLY   3 -12.147   4.297   3.057
   20    H    LYS   4           HN       LYS   4 -11.583   2.456   1.620
   21    HA   LYS   4           HA       LYS   4 -11.390  -0.103   3.030
   22    HB2  LYS   4           HB2      LYS   4 -13.798   0.447   2.400
   23    HB3  LYS   4           HB1      LYS   4 -13.298   0.272   0.723
   24    HG2  LYS   4           HG2      LYS   4 -12.785  -2.019   1.016
   25    HG3  LYS   4           HG1      LYS   4 -12.909  -1.893   2.772
   26    HD2  LYS   4           HD2      LYS   4 -15.330  -1.333   2.476
   27    HD3  LYS   4           HD1      LYS   4 -15.145  -1.699   0.758
   28    HE2  LYS   4           HE2      LYS   4 -14.457  -3.967   1.296
   29    HE3  LYS   4           HE1      LYS   4 -14.560  -3.608   3.018
   30    HZ1  LYS   4           HZ1      LYS   4 -16.951  -3.205   2.717
   31    HZ2  LYS   4           HZ2      LYS   4 -16.507  -4.789   2.312
   32    HZ3  LYS   4           HZ3      LYS   4 -16.822  -3.660   1.088
   33    H    PHE   5           HN       PHE   5 -10.295   1.944   0.653
   34    HA   PHE   5           HA       PHE   5  -9.328   0.050  -1.242
   35    HB2  PHE   5           HB2      PHE   5  -8.346   2.838  -0.583
   36    HB3  PHE   5           HB1      PHE   5  -7.820   1.888  -1.966
   37    HD1  PHE   5           HD1      PHE   5 -10.549   3.850  -0.524
   38    HD2  PHE   5           HD2      PHE   5  -9.258   1.575  -3.881
   39    HE1  PHE   5           HE1      PHE   5 -12.399   4.771  -1.859
   40    HE2  PHE   5           HE2      PHE   5 -11.107   2.493  -5.220
   41    HZ   PHE   5           HZ       PHE   5 -12.682   4.094  -4.208
   42    H    LEU   6           HN       LEU   6  -8.550   0.762   1.926
   43    HA   LEU   6           HA       LEU   6  -5.727   0.373   1.889
   44    HB2  LEU   6           HB2      LEU   6  -6.993   1.596   3.649
   45    HB3  LEU   6           HB1      LEU   6  -7.690   0.073   4.164
   46    HG   LEU   6           HG       LEU   6  -5.431  -0.737   4.761
   47   HD11  LEU   6          HD11      LEU   6  -4.587   2.067   4.050
   48   HD12  LEU   6          HD12      LEU   6  -4.121   0.593   3.202
   49   HD13  LEU   6          HD13      LEU   6  -3.581   0.867   4.859
   50   HD21  LEU   6          HD21      LEU   6  -6.849   0.302   6.450
   51   HD22  LEU   6          HD22      LEU   6  -6.208   1.889   6.020
   52   HD23  LEU   6          HD23      LEU   6  -5.149   0.674   6.737
   53    H    HIS   7           HN       HIS   7  -8.363  -1.686   1.553
   54    HA   HIS   7           HA       HIS   7  -7.580  -3.981   2.948
   55    HB2  HIS   7           HB2      HIS   7  -9.828  -3.518   1.877
   56    HB3  HIS   7           HB1      HIS   7  -9.096  -3.932   0.333
   57    HD1  HIS   7           HD1      HIS   7  -9.790  -6.213  -0.322
   58    HD2  HIS   7           HD2      HIS   7  -9.169  -5.893   3.782
   59    HE1  HIS   7           HE1      HIS   7 -10.252  -8.500   0.618
   60    HE2  HIS   7           HE2      HIS   7  -9.787  -8.307   3.091
   61    H    SER   8           HN       SER   8  -6.837  -2.903  -0.362
   62    HA   SER   8           HA       SER   8  -4.882  -5.076  -0.520
   63    HB2  SER   8           HB2      SER   8  -4.816  -4.458  -2.964
   64    HB3  SER   8           HB1      SER   8  -6.357  -5.099  -2.399
   65    HG   SER   8           HG       SER   8  -5.749  -2.627  -3.407
   66    H    ALA   9           HN       ALA   9  -5.147  -1.699  -0.132
   67    HA   ALA   9           HA       ALA   9  -2.739  -0.791  -1.196
   68    HB1  ALA   9           HB1      ALA   9  -2.895   1.040   0.412
   69    HB2  ALA   9           HB2      ALA   9  -4.118   0.148   1.317
   70    HB3  ALA   9           HB3      ALA   9  -4.463   0.706  -0.321
   71    H    LYS  10           HN       LYS  10  -3.390  -2.756   1.584
   72    HA   LYS  10           HA       LYS  10  -0.507  -2.730   2.188
   73    HB2  LYS  10           HB2      LYS  10  -2.785  -2.757   4.169
   74    HB3  LYS  10           HB1      LYS  10  -1.143  -3.214   4.596
   75    HG2  LYS  10           HG2      LYS  10  -2.047  -0.525   3.586
   76    HG3  LYS  10           HG1      LYS  10  -1.561  -0.925   5.233
   77    HD2  LYS  10           HD2      LYS  10   0.212  -1.064   2.792
   78    HD3  LYS  10           HD1      LYS  10   0.229   0.223   3.997
   79    HE2  LYS  10           HE2      LYS  10   0.770  -2.678   4.614
   80    HE3  LYS  10           HE1      LYS  10   2.028  -1.491   4.277
   81    HZ1  LYS  10           HZ1      LYS  10   1.604  -1.862   6.678
   82    HZ2  LYS  10           HZ2      LYS  10   0.047  -1.228   6.476
   83    HZ3  LYS  10           HZ3      LYS  10   1.400  -0.249   6.199
   84    H    LYS  11           HN       LYS  11  -2.256  -4.444   0.532
   85    HA   LYS  11           HA       LYS  11  -1.422  -6.973   1.783
   86    HB2  LYS  11           HB2      LYS  11  -3.899  -6.729   1.797
   87    HB3  LYS  11           HB1      LYS  11  -3.866  -6.597   0.043
   88    HG2  LYS  11           HG2      LYS  11  -2.958  -8.843  -0.131
   89    HG3  LYS  11           HG1      LYS  11  -2.924  -8.979   1.628
   90    HD2  LYS  11           HD2      LYS  11  -5.356  -8.729   1.689
   91    HD3  LYS  11           HD1      LYS  11  -5.386  -8.606  -0.073
   92    HE2  LYS  11           HE2      LYS  11  -4.441 -10.975   1.538
   93    HE3  LYS  11           HE1      LYS  11  -5.963 -10.856   0.657
   94    HZ1  LYS  11           HZ1      LYS  11  -3.223 -10.929  -0.478
   95    HZ2  LYS  11           HZ2      LYS  11  -4.600 -10.535  -1.389
   96    HZ3  LYS  11           HZ3      LYS  11  -4.462 -12.067  -0.684
   97    H    PHE  12           HN       PHE  12  -1.953  -5.117  -1.145
   98    HA   PHE  12           HA       PHE  12  -0.098  -6.909  -2.558
   99    HB2  PHE  12           HB2      PHE  12  -2.300  -6.608  -3.651
  100    HB3  PHE  12           HB1      PHE  12  -2.031  -4.869  -3.698
  101    HD1  PHE  12           HD1      PHE  12  -0.745  -8.113  -4.949
  102    HD2  PHE  12           HD2      PHE  12  -0.846  -3.889  -5.459
  103    HE1  PHE  12           HE1      PHE  12   0.360  -8.357  -7.133
  104    HE2  PHE  12           HE2      PHE  12   0.264  -4.125  -7.643
  105    HZ   PHE  12           HZ       PHE  12   0.867  -6.361  -8.483
  106    H    GLY  13           HN       GLY  13  -0.908  -3.494  -1.990
  107    HA2  GLY  13           HA2      GLY  13   1.516  -2.524  -3.170
  108    HA3  GLY  13           HA1      GLY  13   0.347  -1.579  -2.260
  109    H    LYS  14           HN       LYS  14   1.044  -4.101  -0.326
  110    HA   LYS  14           HA       LYS  14   2.423  -2.654   1.611
  111    HB2  LYS  14           HB2      LYS  14   2.830  -4.846   2.693
  112    HB3  LYS  14           HB1      LYS  14   1.163  -4.654   2.164
  113    HG2  LYS  14           HG2      LYS  14   1.575  -6.055   0.235
  114    HG3  LYS  14           HG1      LYS  14   3.283  -6.179   0.660
  115    HD2  LYS  14           HD2      LYS  14   0.989  -7.180   2.347
  116    HD3  LYS  14           HD1      LYS  14   2.005  -8.181   1.311
  117    HE2  LYS  14           HE2      LYS  14   3.975  -7.437   2.637
  118    HE3  LYS  14           HE1      LYS  14   2.873  -6.603   3.732
  119    HZ1  LYS  14           HZ1      LYS  14   3.019  -9.518   3.206
  120    HZ2  LYS  14           HZ2      LYS  14   1.781  -8.788   4.100
  121    HZ3  LYS  14           HZ3      LYS  14   3.379  -8.719   4.655
  122    H    ALA  15           HN       ALA  15   3.636  -4.675  -0.999
  123    HA   ALA  15           HA       ALA  15   6.375  -4.440  -0.025
  124    HB1  ALA  15           HB1      ALA  15   5.304  -5.924  -2.420
  125    HB2  ALA  15           HB2      ALA  15   5.585  -6.619  -0.822
  126    HB3  ALA  15           HB3      ALA  15   6.945  -6.022  -1.776
  127    H    PHE  16           HN       PHE  16   4.445  -2.431  -1.570
  128    HA   PHE  16           HA       PHE  16   6.544  -1.505  -3.417
  129    HB2  PHE  16           HB2      PHE  16   3.548  -1.127  -3.641
  130    HB3  PHE  16           HB1      PHE  16   4.736  -0.386  -4.707
  131    HD1  PHE  16           HD1      PHE  16   6.139  -1.835  -6.164
  132    HD2  PHE  16           HD2      PHE  16   2.827  -3.344  -3.965
  133    HE1  PHE  16           HE1      PHE  16   6.083  -3.817  -7.618
  134    HE2  PHE  16           HE2      PHE  16   2.766  -5.333  -5.413
  135    HZ   PHE  16           HZ       PHE  16   4.396  -5.569  -7.245
  136    H    VAL  17           HN       VAL  17   3.800  -0.330  -1.463
  137    HA   VAL  17           HA       VAL  17   4.774   2.367  -1.499
  138    HB   VAL  17           HB       VAL  17   2.667   1.163   0.309
  139   HG11  VAL  17          HG11      VAL  17   3.458   3.327   1.080
  140   HG12  VAL  17          HG12      VAL  17   1.812   3.458   0.457
  141   HG13  VAL  17          HG13      VAL  17   3.173   4.019  -0.516
  142   HG21  VAL  17          HG21      VAL  17   2.322   2.489  -2.380
  143   HG22  VAL  17          HG22      VAL  17   1.026   1.923  -1.326
  144   HG23  VAL  17          HG23      VAL  17   2.141   0.765  -2.050
  145    H    GLY  18           HN       GLY  18   5.157  -0.401   0.524
  146    HA2  GLY  18           HA2      GLY  18   6.381   1.173   2.657
  147    HA3  GLY  18           HA1      GLY  18   6.061  -0.558   2.689
  148    H    GLU  19           HN       GLU  19   7.441   0.397  -0.227
  149    HA   GLU  19           HA       GLU  19  10.123  -0.364   0.725
  150    HB2  GLU  19           HB2      GLU  19   9.026  -2.309  -0.313
  151    HB3  GLU  19           HB1      GLU  19   8.757  -1.372  -1.777
  152    HG2  GLU  19           HG2      GLU  19  11.294  -1.083  -1.838
  153    HG3  GLU  19           HG1      GLU  19  11.343  -2.392  -0.659
  154    H    ILE  20           HN       ILE  20   8.590   0.580  -2.362
  155    HA   ILE  20           HA       ILE  20  11.020   1.871  -3.191
  156    HB   ILE  20           HB       ILE  20   9.439   0.579  -4.697
  157   HG12  ILE  20          HG12      ILE  20   9.790   2.113  -6.631
  158   HG13  ILE  20          HG11      ILE  20  10.290   3.368  -5.500
  159   HG21  ILE  20          HG21      ILE  20   7.573   1.780  -5.694
  160   HG22  ILE  20          HG22      ILE  20   7.866   3.147  -4.618
  161   HG23  ILE  20          HG23      ILE  20   7.348   1.595  -3.954
  162   HD11  ILE  20          HD11      ILE  20  12.148   1.961  -4.775
  163   HD12  ILE  20          HD12      ILE  20  12.205   2.286  -6.507
  164   HD13  ILE  20          HD13      ILE  20  11.649   0.719  -5.921
  165    H    MET  21           HN       MET  21   8.250   2.847  -1.496
  166    HA   MET  21           HA       MET  21   8.288   5.611  -2.231
  167    HB2  MET  21           HB2      MET  21   6.270   4.690  -1.284
  168    HB3  MET  21           HB1      MET  21   7.126   4.179   0.163
  169    HG2  MET  21           HG2      MET  21   7.585   6.576   0.655
  170    HG3  MET  21           HG1      MET  21   6.549   6.997  -0.708
  171    HE1  MET  21           HE1      MET  21   6.208   7.974   2.360
  172    HE2  MET  21           HE2      MET  21   4.456   7.893   2.524
  173    HE3  MET  21           HE3      MET  21   5.173   8.532   1.046
  174    H    ASN  22           HN       ASN  22   9.713   3.677   0.347
  175    HA   ASN  22           HA       ASN  22  10.849   5.905   1.731
  176    HB2  ASN  22           HB2      ASN  22  10.316   3.661   2.767
  177    HB3  ASN  22           HB1      ASN  22  11.696   3.001   1.897
  178   HD21  ASN  22          HD21      ASN  22  11.136   3.256   4.776
  179   HD22  ASN  22          HD22      ASN  22  12.493   4.115   5.430
  180    H    SER  23           HN       SER  23  12.191   3.349  -0.349
  181    HA   SER  23           HA       SER  23  14.621   4.918  -0.706
  182    HB2  SER  23           HB2      SER  23  13.859   2.133  -1.613
  183    HB3  SER  23           HB1      SER  23  15.398   2.910  -1.993
  184    HG   SER  23           HG       SER  23  14.406   2.007   0.488
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1  -9.851   4.976  -3.589
    2    H2   GLY   1           HT2      GLY   1 -11.256   5.404  -4.437
    3    H3   GLY   1           HT3      GLY   1 -10.205   4.234  -5.072
    4    HA2  GLY   1           HA1      GLY   1 -12.176   3.214  -4.119
    5    HA3  GLY   1           HA2      GLY   1 -10.707   2.725  -3.285
    6    H    ILE   2           HN       ILE   2 -10.110   4.255  -1.418
    7    HA   ILE   2           HA       ILE   2 -10.559   4.987   0.676
    8    HB   ILE   2           HB       ILE   2 -13.286   5.683  -0.431
    9   HG12  ILE   2          HG12      ILE   2 -10.834   7.385   0.075
   10   HG13  ILE   2          HG11      ILE   2 -11.419   6.874  -1.504
   11   HG21  ILE   2          HG21      ILE   2 -11.999   6.525   2.167
   12   HG22  ILE   2          HG22      ILE   2 -13.363   5.422   1.996
   13   HG23  ILE   2          HG23      ILE   2 -13.538   7.116   1.538
   14   HD11  ILE   2          HD11      ILE   2 -13.471   8.158  -1.146
   15   HD12  ILE   2          HD12      ILE   2 -12.027   9.167  -1.062
   16   HD13  ILE   2          HD13      ILE   2 -12.854   8.688   0.420
   17    H    GLY   3           HN       GLY   3 -10.925   3.883   2.479
   18    HA2  GLY   3           HA2      GLY   3 -11.910   2.445   3.986
   19    HA3  GLY   3           HA1      GLY   3 -13.292   2.323   2.908
   20    H    LYS   4           HN       LYS   4 -12.789   1.013   0.851
   21    HA   LYS   4           HA       LYS   4 -11.789  -1.538   1.856
   22    HB2  LYS   4           HB2      LYS   4 -12.964  -2.413  -0.267
   23    HB3  LYS   4           HB1      LYS   4 -13.963  -1.847   1.063
   24    HG2  LYS   4           HG2      LYS   4 -14.245   0.308  -0.094
   25    HG3  LYS   4           HG1      LYS   4 -13.294  -0.317  -1.444
   26    HD2  LYS   4           HD2      LYS   4 -14.929  -1.959  -1.951
   27    HD3  LYS   4           HD1      LYS   4 -15.787  -1.671  -0.438
   28    HE2  LYS   4           HE2      LYS   4 -16.417   0.553  -1.200
   29    HE3  LYS   4           HE1      LYS   4 -15.512   0.313  -2.695
   30    HZ1  LYS   4           HZ1      LYS   4 -17.012  -1.381  -3.367
   31    HZ2  LYS   4           HZ2      LYS   4 -17.954  -0.056  -2.886
   32    HZ3  LYS   4           HZ3      LYS   4 -17.790  -1.401  -1.863
   33    H    PHE   5           HN       PHE   5 -10.951   0.971  -0.233
   34    HA   PHE   5           HA       PHE   5  -9.140  -0.401  -1.920
   35    HB2  PHE   5           HB2      PHE   5  -9.815   1.922  -2.341
   36    HB3  PHE   5           HB1      PHE   5  -9.054   2.430  -0.840
   37    HD1  PHE   5           HD2      PHE   5  -8.310   0.928  -4.157
   38    HD2  PHE   5           HD1      PHE   5  -6.830   3.089  -0.802
   39    HE1  PHE   5           HE2      PHE   5  -6.204   1.343  -5.359
   40    HE2  PHE   5           HE1      PHE   5  -4.721   3.515  -2.000
   41    HZ   PHE   5           HZ       PHE   5  -4.406   2.638  -4.280
   42    H    LEU   6           HN       LEU   6  -9.208   0.335   1.404
   43    HA   LEU   6           HA       LEU   6  -6.356   0.373   1.821
   44    HB2  LEU   6           HB2      LEU   6  -8.619   0.153   3.805
   45    HB3  LEU   6           HB1      LEU   6  -6.935   0.440   4.207
   46    HG   LEU   6           HG       LEU   6  -8.683   2.307   2.599
   47   HD11  LEU   6          HD11      LEU   6  -9.336   2.199   4.951
   48   HD12  LEU   6          HD12      LEU   6  -8.584   3.745   4.560
   49   HD13  LEU   6          HD13      LEU   6  -7.667   2.515   5.428
   50   HD21  LEU   6          HD21      LEU   6  -5.885   2.668   3.667
   51   HD22  LEU   6          HD22      LEU   6  -6.835   3.869   2.791
   52   HD23  LEU   6          HD23      LEU   6  -6.309   2.396   1.977
   53    H    HIS   7           HN       HIS   7  -8.780  -2.029   1.590
   54    HA   HIS   7           HA       HIS   7  -7.613  -4.082   3.099
   55    HB2  HIS   7           HB2      HIS   7  -9.859  -4.303   2.198
   56    HB3  HIS   7           HB1      HIS   7  -9.242  -4.222   0.553
   57    HD1  HIS   7           HD1      HIS   7  -9.123  -6.414  -0.536
   58    HD2  HIS   7           HD2      HIS   7  -8.650  -6.727   3.586
   59    HE1  HIS   7           HE1      HIS   7  -8.856  -8.873  -0.067
   60    HE2  HIS   7           HE2      HIS   7  -8.782  -9.049   2.445
   61    H    SER   8           HN       SER   8  -7.228  -3.272  -0.355
   62    HA   SER   8           HA       SER   8  -5.013  -5.090  -0.595
   63    HB2  SER   8           HB2      SER   8  -6.042  -3.061  -2.583
   64    HB3  SER   8           HB1      SER   8  -4.921  -4.382  -2.905
   65    HG   SER   8           HG       SER   8  -7.443  -4.538  -3.196
   66    H    ALA   9           HN       ALA   9  -5.473  -1.761   0.160
   67    HA   ALA   9           HA       ALA   9  -2.846  -0.853  -0.378
   68    HB1  ALA   9           HB1      ALA   9  -4.691   0.686   0.116
   69    HB2  ALA   9           HB2      ALA   9  -3.322   0.946   1.195
   70    HB3  ALA   9           HB3      ALA   9  -4.749   0.083   1.772
   71    H    LYS  10           HN       LYS  10  -4.134  -3.025   1.905
   72    HA   LYS  10           HA       LYS  10  -1.693  -2.942   3.514
   73    HB2  LYS  10           HB2      LYS  10  -4.231  -4.554   3.785
   74    HB3  LYS  10           HB1      LYS  10  -2.824  -4.792   4.809
   75    HG2  LYS  10           HG2      LYS  10  -3.025  -2.456   5.571
   76    HG3  LYS  10           HG1      LYS  10  -4.496  -2.300   4.605
   77    HD2  LYS  10           HD2      LYS  10  -5.547  -4.085   5.891
   78    HD3  LYS  10           HD1      LYS  10  -4.069  -4.301   6.829
   79    HE2  LYS  10           HE2      LYS  10  -4.293  -1.976   7.638
   80    HE3  LYS  10           HE1      LYS  10  -5.829  -1.856   6.774
   81    HZ1  LYS  10           HZ1      LYS  10  -6.719  -3.623   8.129
   82    HZ2  LYS  10           HZ2      LYS  10  -6.111  -2.403   9.136
   83    HZ3  LYS  10           HZ3      LYS  10  -5.229  -3.836   8.908
   84    H    LYS  11           HN       LYS  11  -3.370  -4.935   1.154
   85    HA   LYS  11           HA       LYS  11  -1.724  -7.236   1.577
   86    HB2  LYS  11           HB2      LYS  11  -3.993  -7.491   0.757
   87    HB3  LYS  11           HB1      LYS  11  -3.627  -6.521  -0.662
   88    HG2  LYS  11           HG2      LYS  11  -3.690  -8.872  -1.226
   89    HG3  LYS  11           HG1      LYS  11  -2.054  -8.238  -1.423
   90    HD2  LYS  11           HD2      LYS  11  -1.486  -9.148   0.809
   91    HD3  LYS  11           HD1      LYS  11  -3.097  -9.863   0.893
   92    HE2  LYS  11           HE2      LYS  11  -1.024 -10.450  -1.215
   93    HE3  LYS  11           HE1      LYS  11  -1.388 -11.477   0.170
   94    HZ1  LYS  11           HZ1      LYS  11  -3.327 -10.751  -1.966
   95    HZ2  LYS  11           HZ2      LYS  11  -3.604 -11.814  -0.672
   96    HZ3  LYS  11           HZ3      LYS  11  -2.479 -12.218  -1.877
   97    H    PHE  12           HN       PHE  12  -1.820  -4.661  -0.843
   98    HA   PHE  12           HA       PHE  12   0.823  -5.552  -1.778
   99    HB2  PHE  12           HB2      PHE  12  -0.954  -6.175  -3.402
  100    HB3  PHE  12           HB1      PHE  12  -1.405  -4.480  -3.527
  101    HD1  PHE  12           HD2      PHE  12   1.418  -6.833  -4.082
  102    HD2  PHE  12           HD1      PHE  12  -0.345  -3.086  -5.073
  103    HE1  PHE  12           HE2      PHE  12   3.074  -6.533  -5.880
  104    HE2  PHE  12           HE1      PHE  12   1.304  -2.782  -6.871
  105    HZ   PHE  12           HZ       PHE  12   3.018  -4.504  -7.277
  106    H    GLY  13           HN       GLY  13  -1.317  -2.996  -0.876
  107    HA2  GLY  13           HA2      GLY  13   0.076  -0.807  -1.935
  108    HA3  GLY  13           HA1      GLY  13  -0.960  -0.757  -0.518
  109    H    LYS  14           HN       LYS  14   0.417  -2.523   1.105
  110    HA   LYS  14           HA       LYS  14   2.495  -0.803   2.081
  111    HB2  LYS  14           HB2      LYS  14   1.545  -3.513   3.016
  112    HB3  LYS  14           HB1      LYS  14   2.754  -2.548   3.852
  113    HG2  LYS  14           HG2      LYS  14  -0.089  -1.707   3.334
  114    HG3  LYS  14           HG1      LYS  14   0.536  -2.330   4.861
  115    HD2  LYS  14           HD2      LYS  14   2.038  -0.431   5.056
  116    HD3  LYS  14           HD1      LYS  14   1.527   0.163   3.476
  117    HE2  LYS  14           HE2      LYS  14  -0.304  -0.170   5.851
  118    HE3  LYS  14           HE1      LYS  14   0.467   1.349   5.388
  119    HZ1  LYS  14           HZ1      LYS  14  -1.327  -0.202   3.605
  120    HZ2  LYS  14           HZ2      LYS  14  -0.722   1.362   3.344
  121    HZ3  LYS  14           HZ3      LYS  14  -1.849   1.081   4.580
  122    H    ALA  15           HN       ALA  15   2.360  -3.494  -0.019
  123    HA   ALA  15           HA       ALA  15   5.106  -4.296   0.319
  124    HB1  ALA  15           HB1      ALA  15   3.432  -5.913  -0.427
  125    HB2  ALA  15           HB2      ALA  15   4.698  -5.720  -1.640
  126    HB3  ALA  15           HB3      ALA  15   3.128  -4.949  -1.870
  127    H    PHE  16           HN       PHE  16   3.223  -2.453  -2.055
  128    HA   PHE  16           HA       PHE  16   5.431  -1.826  -3.720
  129    HB2  PHE  16           HB2      PHE  16   3.087  -1.766  -4.492
  130    HB3  PHE  16           HB1      PHE  16   2.781  -0.390  -3.436
  131    HD1  PHE  16           HD2      PHE  16   5.010  -1.460  -6.228
  132    HD2  PHE  16           HD1      PHE  16   3.016   1.754  -4.271
  133    HE1  PHE  16           HE2      PHE  16   5.720   0.069  -8.020
  134    HE2  PHE  16           HE1      PHE  16   3.723   3.282  -6.062
  135    HZ   PHE  16           HZ       PHE  16   5.074   2.442  -7.938
  136    H    VAL  17           HN       VAL  17   3.770  -0.029  -1.124
  137    HA   VAL  17           HA       VAL  17   5.477   2.255  -1.393
  138    HB   VAL  17           HB       VAL  17   3.114   2.216  -0.387
  139   HG11  VAL  17          HG11      VAL  17   3.411   0.421   1.203
  140   HG12  VAL  17          HG12      VAL  17   2.985   1.913   2.041
  141   HG13  VAL  17          HG13      VAL  17   4.653   1.342   2.051
  142   HG21  VAL  17          HG21      VAL  17   5.324   3.667   1.068
  143   HG22  VAL  17          HG22      VAL  17   3.614   4.093   1.119
  144   HG23  VAL  17          HG23      VAL  17   4.506   4.204  -0.398
  145    H    GLY  18           HN       GLY  18   5.875  -0.800  -0.094
  146    HA2  GLY  18           HA2      GLY  18   7.660  -0.139   2.052
  147    HA3  GLY  18           HA1      GLY  18   7.385  -1.736   1.371
  148    H    GLU  19           HN       GLU  19   7.979  -0.193  -1.312
  149    HA   GLU  19           HA       GLU  19  10.901  -0.349  -1.024
  150    HB2  GLU  19           HB2      GLU  19  10.984  -0.980  -3.432
  151    HB3  GLU  19           HB1      GLU  19  10.184  -2.169  -2.415
  152    HG2  GLU  19           HG2      GLU  19   8.023  -1.413  -3.179
  153    HG3  GLU  19           HG1      GLU  19   8.783  -0.132  -4.127
  154    H    ILE  20           HN       ILE  20   8.253   1.289  -2.757
  155    HA   ILE  20           HA       ILE  20  10.043   3.269  -3.845
  156    HB   ILE  20           HB       ILE  20   8.034   2.498  -5.066
  157   HG12  ILE  20          HG12      ILE  20   7.262   4.740  -5.814
  158   HG13  ILE  20          HG11      ILE  20   8.097   5.455  -4.438
  159   HG21  ILE  20          HG21      ILE  20   6.464   2.247  -3.278
  160   HG22  ILE  20          HG22      ILE  20   5.819   3.399  -4.449
  161   HG23  ILE  20          HG23      ILE  20   6.513   3.974  -2.931
  162   HD11  ILE  20          HD11      ILE  20   9.405   3.895  -6.652
  163   HD12  ILE  20          HD12      ILE  20  10.225   4.676  -5.300
  164   HD13  ILE  20          HD13      ILE  20   9.384   5.651  -6.508
  165    H    MET  21           HN       MET  21  10.510   3.328  -1.258
  166    HA   MET  21           HA       MET  21   9.454   5.921  -0.403
  167    HB2  MET  21           HB2      MET  21   8.130   4.261   0.802
  168    HB3  MET  21           HB1      MET  21   9.596   3.467   1.361
  169    HG2  MET  21           HG2      MET  21   8.661   4.800   3.132
  170    HG3  MET  21           HG1      MET  21  10.195   5.496   2.615
  171    HE1  MET  21           HE1      MET  21   6.656   5.710   0.891
  172    HE2  MET  21           HE2      MET  21   6.053   7.231   1.551
  173    HE3  MET  21           HE3      MET  21   6.297   5.843   2.612
  174    H    ASN  22           HN       ASN  22  11.724   3.329   0.532
  175    HA   ASN  22           HA       ASN  22  13.704   5.421   1.155
  176    HB2  ASN  22           HB2      ASN  22  13.483   2.608   2.266
  177    HB3  ASN  22           HB1      ASN  22  14.745   3.766   2.674
  178   HD21  ASN  22          HD21      ASN  22  12.999   6.052   2.740
  179   HD22  ASN  22          HD22      ASN  22  12.035   5.904   4.173
  180    H    SER  23           HN       SER  23  12.984   3.845  -1.375
  181    HA   SER  23           HA       SER  23  15.739   3.033  -2.006
  182    HB2  SER  23           HB2      SER  23  13.203   1.761  -3.072
  183    HB3  SER  23           HB1      SER  23  14.849   1.320  -3.520
  184    HG   SER  23           HG       SER  23  14.609   1.272  -0.850
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  -9.404   5.928  -4.685
    2    H2   GLY   1           HT2      GLY   1  -8.208   6.799  -3.861
    3    H3   GLY   1           HT3      GLY   1  -9.839   7.000  -3.444
    4    HA2  GLY   1           HA1      GLY   1  -9.944   4.672  -2.721
    5    HA3  GLY   1           HA2      GLY   1  -8.228   4.531  -3.089
    6    H    ILE   2           HN       ILE   2  -7.312   4.272  -1.138
    7    HA   ILE   2           HA       ILE   2  -6.607   4.709   0.973
    8    HB   ILE   2           HB       ILE   2  -7.698   7.407   0.242
    9   HG12  ILE   2          HG12      ILE   2  -5.333   8.074   0.765
   10   HG13  ILE   2          HG11      ILE   2  -4.970   6.378   1.061
   11   HG21  ILE   2          HG21      ILE   2  -7.056   8.320   2.410
   12   HG22  ILE   2          HG22      ILE   2  -6.702   6.695   2.995
   13   HG23  ILE   2          HG23      ILE   2  -8.355   7.137   2.567
   14   HD11  ILE   2          HD11      ILE   2  -4.253   7.042  -1.149
   15   HD12  ILE   2          HD12      ILE   2  -5.890   7.573  -1.541
   16   HD13  ILE   2          HD13      ILE   2  -5.561   5.863  -1.259
   17    H    GLY   3           HN       GLY   3  -7.389   4.477   3.092
   18    HA2  GLY   3           HA2      GLY   3  -8.993   4.229   4.756
   19    HA3  GLY   3           HA1      GLY   3 -10.230   4.720   3.605
   20    H    LYS   4           HN       LYS   4 -10.903   3.140   1.984
   21    HA   LYS   4           HA       LYS   4 -10.829   0.452   3.180
   22    HB2  LYS   4           HB2      LYS   4 -12.928   0.128   1.693
   23    HB3  LYS   4           HB1      LYS   4 -13.068   1.098   3.153
   24    HG2  LYS   4           HG2      LYS   4 -12.841   3.133   1.799
   25    HG3  LYS   4           HG1      LYS   4 -12.752   2.134   0.347
   26    HD2  LYS   4           HD2      LYS   4 -14.981   1.294   0.741
   27    HD3  LYS   4           HD1      LYS   4 -15.075   2.175   2.269
   28    HE2  LYS   4           HE2      LYS   4 -16.275   3.342   0.491
   29    HE3  LYS   4           HE1      LYS   4 -14.911   4.292   1.073
   30    HZ1  LYS   4           HZ1      LYS   4 -15.030   4.347  -1.332
   31    HZ2  LYS   4           HZ2      LYS   4 -14.956   2.650  -1.406
   32    HZ3  LYS   4           HZ3      LYS   4 -13.626   3.530  -0.843
   33    H    PHE   5           HN       PHE   5  -9.865   2.247   0.461
   34    HA   PHE   5           HA       PHE   5  -9.427  -0.014  -1.256
   35    HB2  PHE   5           HB2      PHE   5  -9.663   2.276  -2.156
   36    HB3  PHE   5           HB1      PHE   5  -8.202   2.760  -1.306
   37    HD1  PHE   5           HD1      PHE   5  -9.404   0.312  -3.837
   38    HD2  PHE   5           HD2      PHE   5  -6.183   2.680  -2.392
   39    HE1  PHE   5           HE1      PHE   5  -8.061  -0.331  -5.797
   40    HE2  PHE   5           HE2      PHE   5  -4.829   2.045  -4.345
   41    HZ   PHE   5           HZ       PHE   5  -5.769   0.536  -6.050
   42    H    LEU   6           HN       LEU   6  -8.061   1.092   1.583
   43    HA   LEU   6           HA       LEU   6  -5.310   0.481   0.968
   44    HB2  LEU   6           HB2      LEU   6  -6.677   1.146   3.569
   45    HB3  LEU   6           HB1      LEU   6  -4.955   0.855   3.418
   46    HG   LEU   6           HG       LEU   6  -6.518   3.110   2.158
   47   HD11  LEU   6          HD11      LEU   6  -5.079   4.513   3.576
   48   HD12  LEU   6          HD12      LEU   6  -4.400   3.055   4.300
   49   HD13  LEU   6          HD13      LEU   6  -6.108   3.431   4.516
   50   HD21  LEU   6          HD21      LEU   6  -3.580   2.461   1.927
   51   HD22  LEU   6          HD22      LEU   6  -4.375   3.910   1.305
   52   HD23  LEU   6          HD23      LEU   6  -4.775   2.328   0.637
   53    H    HIS   7           HN       HIS   7  -8.014  -1.332   1.759
   54    HA   HIS   7           HA       HIS   7  -6.793  -3.422   3.229
   55    HB2  HIS   7           HB2      HIS   7  -9.233  -3.191   3.098
   56    HB3  HIS   7           HB1      HIS   7  -9.184  -3.510   1.368
   57    HD1  HIS   7           HD1      HIS   7  -8.388  -5.259   4.648
   58    HD2  HIS   7           HD2      HIS   7  -9.393  -6.136   0.704
   59    HE1  HIS   7           HE1      HIS   7  -8.748  -7.751   4.574
   60    HE2  HIS   7           HE2      HIS   7  -9.319  -8.270   2.168
   61    H    SER   8           HN       SER   8  -7.303  -2.843  -0.232
   62    HA   SER   8           HA       SER   8  -5.800  -5.197  -0.936
   63    HB2  SER   8           HB2      SER   8  -6.801  -2.968  -2.710
   64    HB3  SER   8           HB1      SER   8  -6.213  -4.545  -3.222
   65    HG   SER   8           HG       SER   8  -8.616  -4.131  -2.969
   66    H    ALA   9           HN       ALA   9  -5.251  -1.767  -0.615
   67    HA   ALA   9           HA       ALA   9  -2.738  -1.688  -1.910
   68    HB1  ALA   9           HB1      ALA   9  -2.367   0.383  -0.658
   69    HB2  ALA   9           HB2      ALA   9  -3.767   0.021   0.353
   70    HB3  ALA   9           HB3      ALA   9  -3.982   0.340  -1.368
   71    H    LYS  10           HN       LYS  10  -3.770  -3.215   0.900
   72    HA   LYS  10           HA       LYS  10  -0.985  -3.535   1.798
   73    HB2  LYS  10           HB2      LYS  10  -2.679  -2.462   3.408
   74    HB3  LYS  10           HB1      LYS  10  -3.427  -4.051   3.499
   75    HG2  LYS  10           HG2      LYS  10  -1.322  -4.986   4.335
   76    HG3  LYS  10           HG1      LYS  10  -0.594  -3.379   4.266
   77    HD2  LYS  10           HD2      LYS  10  -2.250  -2.561   5.871
   78    HD3  LYS  10           HD1      LYS  10  -2.990  -4.159   5.931
   79    HE2  LYS  10           HE2      LYS  10  -1.583  -3.923   7.846
   80    HE3  LYS  10           HE1      LYS  10  -0.816  -5.062   6.739
   81    HZ1  LYS  10           HZ1      LYS  10   0.806  -3.534   7.610
   82    HZ2  LYS  10           HZ2      LYS  10  -0.099  -2.197   7.094
   83    HZ3  LYS  10           HZ3      LYS  10   0.605  -3.234   5.957
   84    H    LYS  11           HN       LYS  11  -3.113  -4.911  -0.109
   85    HA   LYS  11           HA       LYS  11  -3.048  -7.639   0.842
   86    HB2  LYS  11           HB2      LYS  11  -4.946  -6.873  -0.489
   87    HB3  LYS  11           HB1      LYS  11  -3.872  -6.440  -1.812
   88    HG2  LYS  11           HG2      LYS  11  -3.253  -8.843  -2.009
   89    HG3  LYS  11           HG1      LYS  11  -4.487  -9.205  -0.798
   90    HD2  LYS  11           HD2      LYS  11  -6.188  -8.201  -2.245
   91    HD3  LYS  11           HD1      LYS  11  -4.954  -7.869  -3.462
   92    HE2  LYS  11           HE2      LYS  11  -6.182  -9.881  -4.039
   93    HE3  LYS  11           HE1      LYS  11  -4.511 -10.279  -3.643
   94    HZ1  LYS  11           HZ1      LYS  11  -6.187 -11.800  -2.664
   95    HZ2  LYS  11           HZ2      LYS  11  -6.762 -10.507  -1.724
   96    HZ3  LYS  11           HZ3      LYS  11  -5.176 -11.068  -1.513
   97    H    PHE  12           HN       PHE  12  -1.827  -6.082  -2.127
   98    HA   PHE  12           HA       PHE  12   0.473  -7.927  -2.006
   99    HB2  PHE  12           HB2      PHE  12  -1.051  -8.262  -3.952
  100    HB3  PHE  12           HB1      PHE  12  -0.721  -6.611  -4.461
  101    HD1  PHE  12           HD1      PHE  12   0.894  -9.878  -3.801
  102    HD2  PHE  12           HD2      PHE  12   1.111  -6.140  -5.828
  103    HE1  PHE  12           HE1      PHE  12   2.829 -10.689  -5.080
  104    HE2  PHE  12           HE2      PHE  12   3.050  -6.948  -7.108
  105    HZ   PHE  12           HZ       PHE  12   3.908  -9.224  -6.736
  106    H    GLY  13           HN       GLY  13  -0.636  -4.657  -2.433
  107    HA2  GLY  13           HA2      GLY  13   1.947  -3.573  -3.062
  108    HA3  GLY  13           HA1      GLY  13   0.486  -2.667  -2.713
  109    H    LYS  14           HN       LYS  14   0.988  -4.886  -0.275
  110    HA   LYS  14           HA       LYS  14   1.585  -2.935   1.662
  111    HB2  LYS  14           HB2      LYS  14   1.884  -4.796   3.227
  112    HB3  LYS  14           HB1      LYS  14   0.438  -5.007   2.254
  113    HG2  LYS  14           HG2      LYS  14   1.544  -6.662   0.891
  114    HG3  LYS  14           HG1      LYS  14   3.069  -6.376   1.730
  115    HD2  LYS  14           HD2      LYS  14   2.080  -7.162   3.817
  116    HD3  LYS  14           HD1      LYS  14   0.541  -7.429   2.999
  117    HE2  LYS  14           HE2      LYS  14   3.129  -8.801   2.285
  118    HE3  LYS  14           HE1      LYS  14   1.882  -9.497   3.317
  119    HZ1  LYS  14           HZ1      LYS  14   0.327  -9.324   1.439
  120    HZ2  LYS  14           HZ2      LYS  14   1.657 -10.317   1.083
  121    HZ3  LYS  14           HZ3      LYS  14   1.586  -8.747   0.457
  122    H    ALA  15           HN       ALA  15   3.592  -4.961  -0.312
  123    HA   ALA  15           HA       ALA  15   6.014  -4.282   1.130
  124    HB1  ALA  15           HB1      ALA  15   7.158  -5.544  -0.620
  125    HB2  ALA  15           HB2      ALA  15   5.644  -5.690  -1.512
  126    HB3  ALA  15           HB3      ALA  15   5.819  -6.472   0.058
  127    H    PHE  16           HN       PHE  16   4.136  -3.151  -1.533
  128    HA   PHE  16           HA       PHE  16   6.224  -1.657  -2.794
  129    HB2  PHE  16           HB2      PHE  16   4.387  -2.472  -4.145
  130    HB3  PHE  16           HB1      PHE  16   3.223  -1.604  -3.150
  131    HD1  PHE  16           HD2      PHE  16   6.119  -1.076  -5.418
  132    HD2  PHE  16           HD1      PHE  16   2.575   0.559  -3.713
  133    HE1  PHE  16           HE2      PHE  16   6.311   0.884  -6.893
  134    HE2  PHE  16           HE1      PHE  16   2.767   2.518  -5.184
  135    HZ   PHE  16           HZ       PHE  16   4.637   2.685  -6.774
  136    H    VAL  17           HN       VAL  17   3.797  -0.993  -0.343
  137    HA   VAL  17           HA       VAL  17   3.978   1.837  -0.563
  138    HB   VAL  17           HB       VAL  17   2.047   0.753   0.529
  139   HG11  VAL  17          HG11      VAL  17   3.174  -1.045   1.699
  140   HG12  VAL  17          HG12      VAL  17   2.226  -0.074   2.827
  141   HG13  VAL  17          HG13      VAL  17   3.979   0.119   2.751
  142   HG21  VAL  17          HG21      VAL  17   2.499   3.092   0.979
  143   HG22  VAL  17          HG22      VAL  17   3.565   2.652   2.313
  144   HG23  VAL  17          HG23      VAL  17   1.839   2.307   2.413
  145    H    GLY  18           HN       GLY  18   5.682  -0.596   1.263
  146    HA2  GLY  18           HA2      GLY  18   7.322   1.295   2.670
  147    HA3  GLY  18           HA1      GLY  18   7.552  -0.446   2.585
  148    H    GLU  19           HN       GLU  19   7.189   0.227  -0.479
  149    HA   GLU  19           HA       GLU  19  10.078   0.248  -0.937
  150    HB2  GLU  19           HB2      GLU  19   8.719  -1.556  -1.917
  151    HB3  GLU  19           HB1      GLU  19   7.775  -0.366  -2.796
  152    HG2  GLU  19           HG2      GLU  19   9.714   0.257  -4.096
  153    HG3  GLU  19           HG1      GLU  19  10.718  -0.861  -3.172
  154    H    ILE  20           HN       ILE  20   7.128   1.915  -1.959
  155    HA   ILE  20           HA       ILE  20   8.475   3.775  -3.641
  156    HB   ILE  20           HB       ILE  20   6.095   3.218  -3.952
  157   HG12  ILE  20          HG12      ILE  20   6.501   6.147  -3.312
  158   HG13  ILE  20          HG11      ILE  20   7.031   5.364  -4.797
  159   HG21  ILE  20          HG21      ILE  20   4.386   4.135  -2.469
  160   HG22  ILE  20          HG22      ILE  20   5.642   4.762  -1.400
  161   HG23  ILE  20          HG23      ILE  20   5.448   3.021  -1.607
  162   HD11  ILE  20          HD11      ILE  20   4.741   4.879  -5.390
  163   HD12  ILE  20          HD12      ILE  20   4.941   6.604  -5.076
  164   HD13  ILE  20          HD13      ILE  20   4.181   5.568  -3.868
  165    H    MET  21           HN       MET  21   7.773   3.673  -0.215
  166    HA   MET  21           HA       MET  21   8.052   6.520   0.114
  167    HB2  MET  21           HB2      MET  21   7.645   6.184   2.436
  168    HB3  MET  21           HB1      MET  21   6.552   5.136   1.549
  169    HG2  MET  21           HG2      MET  21   7.942   3.216   2.033
  170    HG3  MET  21           HG1      MET  21   9.120   4.249   2.841
  171    HE1  MET  21           HE1      MET  21   7.933   1.671   4.234
  172    HE2  MET  21           HE2      MET  21   7.561   2.279   5.847
  173    HE3  MET  21           HE3      MET  21   9.056   2.764   5.047
  174    H    ASN  22           HN       ASN  22  10.286   3.987  -0.177
  175    HA   ASN  22           HA       ASN  22  12.299   5.581   1.252
  176    HB2  ASN  22           HB2      ASN  22  13.765   3.700   1.268
  177    HB3  ASN  22           HB1      ASN  22  12.186   3.127   1.778
  178   HD21  ASN  22          HD21      ASN  22  11.205   1.540   0.648
  179   HD22  ASN  22          HD22      ASN  22  11.893   0.790  -0.758
  180    H    SER  23           HN       SER  23  10.973   5.804  -1.532
  181    HA   SER  23           HA       SER  23  13.416   6.018  -3.130
  182    HB2  SER  23           HB2      SER  23  10.521   6.347  -3.971
  183    HB3  SER  23           HB1      SER  23  11.919   6.326  -5.047
  184    HG   SER  23           HG       SER  23  11.258   4.177  -3.319
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1 -16.262   2.756  -3.018
    2    H2   GLY   1           HT2      GLY   1 -15.421   4.007  -2.234
    3    H3   GLY   1           HT3      GLY   1 -16.627   3.147  -1.411
    4    HA2  GLY   1           HA1      GLY   1 -15.309   1.124  -1.543
    5    HA3  GLY   1           HA2      GLY   1 -14.051   2.031  -2.369
    6    H    ILE   2           HN       ILE   2 -15.410   1.154   0.642
    7    HA   ILE   2           HA       ILE   2 -13.364   2.760   2.021
    8    HB   ILE   2           HB       ILE   2 -14.963   3.009   3.948
    9   HG12  ILE   2          HG12      ILE   2 -17.051   2.357   1.860
   10   HG13  ILE   2          HG11      ILE   2 -16.562   1.263   3.151
   11   HG21  ILE   2          HG21      ILE   2 -15.582   4.395   1.350
   12   HG22  ILE   2          HG22      ILE   2 -14.431   4.898   2.590
   13   HG23  ILE   2          HG23      ILE   2 -16.161   4.927   2.930
   14   HD11  ILE   2          HD11      ILE   2 -17.343   2.864   4.808
   15   HD12  ILE   2          HD12      ILE   2 -18.631   2.415   3.689
   16   HD13  ILE   2          HD13      ILE   2 -17.818   3.971   3.521
   17    H    GLY   3           HN       GLY   3 -15.483  -0.077   2.084
   18    HA2  GLY   3           HA2      GLY   3 -14.174  -1.111   4.467
   19    HA3  GLY   3           HA1      GLY   3 -15.523  -1.844   3.613
   20    H    LYS   4           HN       LYS   4 -13.272  -1.029   1.361
   21    HA   LYS   4           HA       LYS   4 -11.577  -3.367   1.728
   22    HB2  LYS   4           HB2      LYS   4 -11.987  -4.110  -0.613
   23    HB3  LYS   4           HB1      LYS   4 -13.411  -4.251   0.412
   24    HG2  LYS   4           HG2      LYS   4 -14.179  -2.050  -0.513
   25    HG3  LYS   4           HG1      LYS   4 -12.849  -2.148  -1.666
   26    HD2  LYS   4           HD2      LYS   4 -13.745  -4.223  -2.561
   27    HD3  LYS   4           HD1      LYS   4 -15.042  -4.202  -1.363
   28    HE2  LYS   4           HE2      LYS   4 -15.865  -2.095  -2.306
   29    HE3  LYS   4           HE1      LYS   4 -14.579  -2.135  -3.512
   30    HZ1  LYS   4           HZ1      LYS   4 -16.647  -2.953  -4.425
   31    HZ2  LYS   4           HZ2      LYS   4 -16.756  -4.136  -3.217
   32    HZ3  LYS   4           HZ3      LYS   4 -15.506  -4.208  -4.362
   33    H    PHE   5           HN       PHE   5 -11.903  -0.206   1.058
   34    HA   PHE   5           HA       PHE   5  -9.909   0.162  -0.948
   35    HB2  PHE   5           HB2      PHE   5 -11.665   1.848  -0.436
   36    HB3  PHE   5           HB1      PHE   5 -10.934   2.105   1.143
   37    HD1  PHE   5           HD2      PHE   5 -10.212   2.309  -2.493
   38    HD2  PHE   5           HD1      PHE   5  -9.279   3.712   1.415
   39    HE1  PHE   5           HE2      PHE   5  -8.765   4.044  -3.467
   40    HE2  PHE   5           HE1      PHE   5  -7.822   5.445   0.450
   41    HZ   PHE   5           HZ       PHE   5  -7.566   5.615  -1.995
   42    H    LEU   6           HN       LEU   6  -9.904  -0.573   2.381
   43    HA   LEU   6           HA       LEU   6  -7.128   0.380   2.694
   44    HB2  LEU   6           HB2      LEU   6  -9.243  -0.286   4.741
   45    HB3  LEU   6           HB1      LEU   6  -7.561  -0.032   5.164
   46    HG   LEU   6           HG       LEU   6  -8.637   1.999   5.648
   47   HD11  LEU   6          HD11      LEU   6  -7.408   2.324   2.918
   48   HD12  LEU   6          HD12      LEU   6  -6.538   2.293   4.450
   49   HD13  LEU   6          HD13      LEU   6  -7.662   3.606   4.103
   50   HD21  LEU   6          HD21      LEU   6  -9.923   1.913   2.923
   51   HD22  LEU   6          HD22      LEU   6 -10.118   3.182   4.133
   52   HD23  LEU   6          HD23      LEU   6 -10.727   1.557   4.452
   53    H    HIS   7           HN       HIS   7  -8.577  -2.220   1.646
   54    HA   HIS   7           HA       HIS   7  -7.124  -4.191   3.204
   55    HB2  HIS   7           HB2      HIS   7  -9.422  -4.657   2.365
   56    HB3  HIS   7           HB1      HIS   7  -8.812  -4.562   0.718
   57    HD1  HIS   7           HD1      HIS   7  -8.889  -6.786   3.717
   58    HD2  HIS   7           HD2      HIS   7  -7.344  -6.792  -0.143
   59    HE1  HIS   7           HE1      HIS   7  -8.181  -9.161   3.277
   60    HE2  HIS   7           HE2      HIS   7  -7.375  -9.165   0.886
   61    H    SER   8           HN       SER   8  -7.271  -3.162  -0.205
   62    HA   SER   8           HA       SER   8  -4.811  -4.562  -0.746
   63    HB2  SER   8           HB2      SER   8  -5.237  -3.560  -3.078
   64    HB3  SER   8           HB1      SER   8  -6.360  -4.789  -2.492
   65    HG   SER   8           HG       SER   8  -7.137  -2.590  -3.409
   66    H    ALA   9           HN       ALA   9  -5.853  -1.232  -0.338
   67    HA   ALA   9           HA       ALA   9  -3.542   0.020  -1.317
   68    HB1  ALA   9           HB1      ALA   9  -5.257   0.927   0.994
   69    HB2  ALA   9           HB2      ALA   9  -5.586   1.245  -0.710
   70    HB3  ALA   9           HB3      ALA   9  -4.150   1.928   0.055
   71    H    LYS  10           HN       LYS  10  -4.048  -1.941   1.425
   72    HA   LYS  10           HA       LYS  10  -1.541  -0.998   2.632
   73    HB2  LYS  10           HB2      LYS  10  -3.700  -2.754   3.809
   74    HB3  LYS  10           HB1      LYS  10  -2.253  -2.207   4.649
   75    HG2  LYS  10           HG2      LYS  10  -3.013   0.141   4.290
   76    HG3  LYS  10           HG1      LYS  10  -4.521  -0.503   3.638
   77    HD2  LYS  10           HD2      LYS  10  -4.898  -1.674   5.783
   78    HD3  LYS  10           HD1      LYS  10  -3.436  -0.916   6.423
   79    HE2  LYS  10           HE2      LYS  10  -5.927   0.490   5.461
   80    HE3  LYS  10           HE1      LYS  10  -5.404   0.316   7.134
   81    HZ1  LYS  10           HZ1      LYS  10  -3.981   1.831   5.006
   82    HZ2  LYS  10           HZ2      LYS  10  -3.427   1.625   6.593
   83    HZ3  LYS  10           HZ3      LYS  10  -4.849   2.500   6.300
   84    H    LYS  11           HN       LYS  11  -2.707  -3.382   0.580
   85    HA   LYS  11           HA       LYS  11  -0.683  -5.314   1.470
   86    HB2  LYS  11           HB2      LYS  11  -2.825  -6.333   1.128
   87    HB3  LYS  11           HB1      LYS  11  -2.996  -5.577  -0.451
   88    HG2  LYS  11           HG2      LYS  11  -1.188  -6.931  -1.328
   89    HG3  LYS  11           HG1      LYS  11  -0.925  -7.646   0.263
   90    HD2  LYS  11           HD2      LYS  11  -3.536  -7.851  -1.226
   91    HD3  LYS  11           HD1      LYS  11  -2.244  -9.045  -1.364
   92    HE2  LYS  11           HE2      LYS  11  -3.679  -8.256   1.167
   93    HE3  LYS  11           HE1      LYS  11  -3.917  -9.749   0.261
   94    HZ1  LYS  11           HZ1      LYS  11  -1.523  -8.901   1.789
   95    HZ2  LYS  11           HZ2      LYS  11  -1.468 -10.158   0.659
   96    HZ3  LYS  11           HZ3      LYS  11  -2.478 -10.286   2.017
   97    H    PHE  12           HN       PHE  12  -1.575  -3.230  -1.195
   98    HA   PHE  12           HA       PHE  12   0.919  -3.997  -2.562
   99    HB2  PHE  12           HB2      PHE  12  -1.328  -4.838  -3.605
  100    HB3  PHE  12           HB1      PHE  12  -1.526  -3.161  -4.107
  101    HD1  PHE  12           HD1      PHE  12   0.852  -6.011  -4.277
  102    HD2  PHE  12           HD2      PHE  12  -0.532  -2.415  -6.090
  103    HE1  PHE  12           HE1      PHE  12   2.289  -6.443  -6.224
  104    HE2  PHE  12           HE2      PHE  12   0.912  -2.841  -8.037
  105    HZ   PHE  12           HZ       PHE  12   2.323  -4.856  -8.104
  106    H    GLY  13           HN       GLY  13  -0.036  -1.855  -0.721
  107    HA2  GLY  13           HA2      GLY  13   1.165   0.341  -2.266
  108    HA3  GLY  13           HA1      GLY  13  -0.255   0.635  -1.267
  109    H    LYS  14           HN       LYS  14   0.101  -0.645   0.965
  110    HA   LYS  14           HA       LYS  14   2.075   0.848   2.350
  111    HB2  LYS  14           HB2      LYS  14   0.002   0.101   3.426
  112    HB3  LYS  14           HB1      LYS  14   0.489  -1.576   3.238
  113    HG2  LYS  14           HG2      LYS  14   0.793  -0.769   5.523
  114    HG3  LYS  14           HG1      LYS  14   2.324  -1.248   4.788
  115    HD2  LYS  14           HD2      LYS  14   2.939   1.038   4.426
  116    HD3  LYS  14           HD1      LYS  14   1.330   1.597   4.880
  117    HE2  LYS  14           HE2      LYS  14   3.100   1.896   6.640
  118    HE3  LYS  14           HE1      LYS  14   1.667   1.008   7.154
  119    HZ1  LYS  14           HZ1      LYS  14   3.922   0.082   7.807
  120    HZ2  LYS  14           HZ2      LYS  14   4.084  -0.397   6.186
  121    HZ3  LYS  14           HZ3      LYS  14   2.808  -0.998   7.131
  122    H    ALA  15           HN       ALA  15   1.924  -2.511   1.263
  123    HA   ALA  15           HA       ALA  15   4.565  -3.070   2.324
  124    HB1  ALA  15           HB1      ALA  15   2.740  -4.805   0.665
  125    HB2  ALA  15           HB2      ALA  15   2.810  -4.786   2.426
  126    HB3  ALA  15           HB3      ALA  15   4.205  -5.331   1.494
  127    H    PHE  16           HN       PHE  16   3.117  -2.090  -0.667
  128    HA   PHE  16           HA       PHE  16   5.281  -3.059  -2.316
  129    HB2  PHE  16           HB2      PHE  16   2.976  -2.990  -3.186
  130    HB3  PHE  16           HB1      PHE  16   2.967  -1.239  -3.016
  131    HD1  PHE  16           HD1      PHE  16   4.780  -4.001  -4.715
  132    HD2  PHE  16           HD2      PHE  16   3.621   0.091  -4.784
  133    HE1  PHE  16           HE1      PHE  16   5.672  -3.791  -6.997
  134    HE2  PHE  16           HE2      PHE  16   4.520   0.311  -7.064
  135    HZ   PHE  16           HZ       PHE  16   5.543  -1.633  -8.175
  136    H    VAL  17           HN       VAL  17   3.986   0.183  -1.550
  137    HA   VAL  17           HA       VAL  17   6.175   1.538  -2.768
  138    HB   VAL  17           HB       VAL  17   4.161   2.586  -0.762
  139   HG11  VAL  17          HG11      VAL  17   5.943   4.094  -2.674
  140   HG12  VAL  17          HG12      VAL  17   6.149   4.010  -0.924
  141   HG13  VAL  17          HG13      VAL  17   4.728   4.801  -1.611
  142   HG21  VAL  17          HG21      VAL  17   2.963   3.449  -2.712
  143   HG22  VAL  17          HG22      VAL  17   3.097   1.691  -2.765
  144   HG23  VAL  17          HG23      VAL  17   4.145   2.685  -3.776
  145    H    GLY  18           HN       GLY  18   5.531   0.221   0.349
  146    HA2  GLY  18           HA2      GLY  18   7.366   1.674   1.907
  147    HA3  GLY  18           HA1      GLY  18   6.741   0.077   2.277
  148    H    GLU  19           HN       GLU  19   7.996  -0.526  -0.589
  149    HA   GLU  19           HA       GLU  19  10.682  -1.059   0.491
  150    HB2  GLU  19           HB2      GLU  19   9.163  -2.453  -1.721
  151    HB3  GLU  19           HB1      GLU  19  10.835  -2.797  -1.304
  152    HG2  GLU  19           HG2      GLU  19  10.116  -3.468   0.944
  153    HG3  GLU  19           HG1      GLU  19   8.442  -3.168   0.481
  154    H    ILE  20           HN       ILE  20   8.962  -0.054  -2.442
  155    HA   ILE  20           HA       ILE  20  11.253   0.189  -4.042
  156    HB   ILE  20           HB       ILE  20   9.839   1.413  -5.629
  157   HG12  ILE  20          HG12      ILE  20   7.722   1.241  -3.467
  158   HG13  ILE  20          HG11      ILE  20   8.536   2.718  -3.970
  159   HG21  ILE  20          HG21      ILE  20   8.208  -0.375  -5.996
  160   HG22  ILE  20          HG22      ILE  20   8.506  -0.981  -4.367
  161   HG23  ILE  20          HG23      ILE  20   9.793  -1.019  -5.572
  162   HD11  ILE  20          HD11      ILE  20   6.324   2.563  -4.946
  163   HD12  ILE  20          HD12      ILE  20   6.736   1.015  -5.682
  164   HD13  ILE  20          HD13      ILE  20   7.558   2.485  -6.205
  165    H    MET  21           HN       MET  21   9.781   2.477  -1.823
  166    HA   MET  21           HA       MET  21  11.146   4.723  -3.027
  167    HB2  MET  21           HB2      MET  21  10.140   6.082  -1.302
  168    HB3  MET  21           HB1      MET  21   8.926   5.019  -1.996
  169    HG2  MET  21           HG2      MET  21   9.112   3.539  -0.074
  170    HG3  MET  21           HG1      MET  21  10.346   4.588   0.622
  171    HE1  MET  21           HE1      MET  21   7.145   5.125   2.878
  172    HE2  MET  21           HE2      MET  21   8.832   4.612   2.863
  173    HE3  MET  21           HE3      MET  21   7.606   3.635   2.056
  174    H    ASN  22           HN       ASN  22  12.082   2.282  -0.940
  175    HA   ASN  22           HA       ASN  22  13.966   3.959   0.542
  176    HB2  ASN  22           HB2      ASN  22  13.545   0.963   0.680
  177    HB3  ASN  22           HB1      ASN  22  14.592   1.904   1.734
  178   HD21  ASN  22          HD21      ASN  22  12.390   0.195   2.410
  179   HD22  ASN  22          HD22      ASN  22  11.240   1.174   3.251
  180    H    SER  23           HN       SER  23  13.808   2.002  -2.243
  181    HA   SER  23           HA       SER  23  16.632   1.357  -2.264
  182    HB2  SER  23           HB2      SER  23  14.500   0.851  -4.362
  183    HB3  SER  23           HB1      SER  23  16.113   0.138  -4.319
  184    HG   SER  23           HG       SER  23  15.263  -0.517  -2.040
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1 -12.167   7.554  -1.738
    2    H2   GLY   1           HT2      GLY   1 -13.618   6.686  -1.843
    3    H3   GLY   1           HT3      GLY   1 -12.600   6.792  -3.189
    4    HA2  GLY   1           HA1      GLY   1 -12.390   4.627  -2.173
    5    HA3  GLY   1           HA2      GLY   1 -10.891   5.537  -2.038
    6    H    ILE   2           HN       ILE   2 -10.120   4.513  -0.253
    7    HA   ILE   2           HA       ILE   2  -9.834   3.973   1.937
    8    HB   ILE   2           HB       ILE   2 -12.060   5.937   2.562
    9   HG12  ILE   2          HG12      ILE   2  -9.087   6.450   2.298
   10   HG13  ILE   2          HG11      ILE   2 -10.319   6.979   1.160
   11   HG21  ILE   2          HG21      ILE   2 -10.927   6.173   4.720
   12   HG22  ILE   2          HG22      ILE   2  -9.735   4.968   4.230
   13   HG23  ILE   2          HG23      ILE   2 -11.424   4.505   4.439
   14   HD11  ILE   2          HD11      ILE   2 -11.319   8.375   2.897
   15   HD12  ILE   2          HD12      ILE   2  -9.634   8.799   2.594
   16   HD13  ILE   2          HD13      ILE   2 -10.063   7.860   4.024
   17    H    GLY   3           HN       GLY   3 -11.018   2.909   3.838
   18    HA2  GLY   3           HA2      GLY   3 -12.643   1.512   4.701
   19    HA3  GLY   3           HA1      GLY   3 -13.700   2.001   3.382
   20    H    LYS   4           HN       LYS   4 -13.184   1.035   1.215
   21    HA   LYS   4           HA       LYS   4 -12.707  -1.823   1.686
   22    HB2  LYS   4           HB2      LYS   4 -14.089  -0.464  -0.636
   23    HB3  LYS   4           HB1      LYS   4 -13.908  -2.200  -0.436
   24    HG2  LYS   4           HG2      LYS   4 -15.165  -1.940   1.739
   25    HG3  LYS   4           HG1      LYS   4 -15.546  -0.304   1.209
   26    HD2  LYS   4           HD2      LYS   4 -16.223  -2.829  -0.298
   27    HD3  LYS   4           HD1      LYS   4 -17.346  -1.914   0.706
   28    HE2  LYS   4           HE2      LYS   4 -17.870  -1.080  -1.358
   29    HE3  LYS   4           HE1      LYS   4 -16.627   0.066  -0.868
   30    HZ1  LYS   4           HZ1      LYS   4 -16.374  -0.768  -3.167
   31    HZ2  LYS   4           HZ2      LYS   4 -16.120  -2.328  -2.552
   32    HZ3  LYS   4           HZ3      LYS   4 -15.021  -1.089  -2.197
   33    H    PHE   5           HN       PHE   5 -11.455   0.931   0.090
   34    HA   PHE   5           HA       PHE   5  -9.747  -0.517  -1.703
   35    HB2  PHE   5           HB2      PHE   5  -9.781   2.358  -0.776
   36    HB3  PHE   5           HB1      PHE   5  -8.580   1.730  -1.901
   37    HD1  PHE   5           HD1      PHE   5 -12.218   2.264  -1.428
   38    HD2  PHE   5           HD2      PHE   5  -9.054   1.510  -4.172
   39    HE1  PHE   5           HE1      PHE   5 -13.755   2.660  -3.308
   40    HE2  PHE   5           HE2      PHE   5 -10.583   1.905  -6.054
   41    HZ   PHE   5           HZ       PHE   5 -12.938   2.482  -5.620
   42    H    LEU   6           HN       LEU   6  -9.858  -0.348   1.527
   43    HA   LEU   6           HA       LEU   6  -6.996  -0.224   2.059
   44    HB2  LEU   6           HB2      LEU   6  -8.675   0.655   3.673
   45    HB3  LEU   6           HB1      LEU   6  -9.302  -0.968   3.873
   46    HG   LEU   6           HG       LEU   6  -7.098  -1.666   4.785
   47   HD11  LEU   6          HD11      LEU   6  -5.499   0.047   5.452
   48   HD12  LEU   6          HD12      LEU   6  -6.493   1.286   4.688
   49   HD13  LEU   6          HD13      LEU   6  -5.725   0.043   3.702
   50   HD21  LEU   6          HD21      LEU   6  -8.445   0.635   6.185
   51   HD22  LEU   6          HD22      LEU   6  -7.371  -0.541   6.942
   52   HD23  LEU   6          HD23      LEU   6  -8.918  -1.062   6.273
   53    H    HIS   7           HN       HIS   7  -9.163  -2.418   0.878
   54    HA   HIS   7           HA       HIS   7  -8.481  -4.840   2.092
   55    HB2  HIS   7           HB2      HIS   7 -10.413  -4.536   0.588
   56    HB3  HIS   7           HB1      HIS   7  -9.320  -4.314  -0.771
   57    HD1  HIS   7           HD1      HIS   7 -11.061  -6.885   1.198
   58    HD2  HIS   7           HD2      HIS   7  -7.938  -6.733  -1.548
   59    HE1  HIS   7           HE1      HIS   7 -10.743  -9.245   0.398
   60    HE2  HIS   7           HE2      HIS   7  -9.027  -9.080  -1.436
   61    H    SER   8           HN       SER   8  -7.221  -3.444  -0.957
   62    HA   SER   8           HA       SER   8  -4.933  -5.237  -0.716
   63    HB2  SER   8           HB2      SER   8  -5.724  -3.425  -3.007
   64    HB3  SER   8           HB1      SER   8  -4.476  -4.665  -3.032
   65    HG   SER   8           HG       SER   8  -6.041  -6.239  -2.846
   66    H    ALA   9           HN       ALA   9  -5.770  -2.130   0.166
   67    HA   ALA   9           HA       ALA   9  -3.392  -0.718  -0.325
   68    HB1  ALA   9           HB1      ALA   9  -4.059   0.770   1.465
   69    HB2  ALA   9           HB2      ALA   9  -5.224  -0.417   2.054
   70    HB3  ALA   9           HB3      ALA   9  -5.462   0.349   0.484
   71    H    LYS  10           HN       LYS  10  -4.213  -3.205   1.953
   72    HA   LYS  10           HA       LYS  10  -1.778  -2.725   3.489
   73    HB2  LYS  10           HB2      LYS  10  -3.833  -3.358   4.694
   74    HB3  LYS  10           HB1      LYS  10  -3.863  -4.889   3.827
   75    HG2  LYS  10           HG2      LYS  10  -1.706  -5.485   4.824
   76    HG3  LYS  10           HG1      LYS  10  -1.708  -3.965   5.712
   77    HD2  LYS  10           HD2      LYS  10  -3.729  -4.655   6.899
   78    HD3  LYS  10           HD1      LYS  10  -3.750  -6.170   5.989
   79    HE2  LYS  10           HE2      LYS  10  -1.588  -6.782   6.936
   80    HE3  LYS  10           HE1      LYS  10  -1.530  -5.258   7.817
   81    HZ1  LYS  10           HZ1      LYS  10  -3.523  -5.939   9.025
   82    HZ2  LYS  10           HZ2      LYS  10  -2.241  -7.028   9.257
   83    HZ3  LYS  10           HZ3      LYS  10  -3.513  -7.430   8.209
   84    H    LYS  11           HN       LYS  11  -2.913  -4.825   0.957
   85    HA   LYS  11           HA       LYS  11  -0.565  -6.558   1.359
   86    HB2  LYS  11           HB2      LYS  11  -3.252  -7.193   0.150
   87    HB3  LYS  11           HB1      LYS  11  -1.861  -8.260   0.013
   88    HG2  LYS  11           HG2      LYS  11  -1.754  -8.282   2.515
   89    HG3  LYS  11           HG1      LYS  11  -3.298  -7.429   2.517
   90    HD2  LYS  11           HD2      LYS  11  -4.365  -9.254   1.376
   91    HD3  LYS  11           HD1      LYS  11  -2.820 -10.083   1.174
   92    HE2  LYS  11           HE2      LYS  11  -2.618 -10.223   3.632
   93    HE3  LYS  11           HE1      LYS  11  -4.211  -9.483   3.778
   94    HZ1  LYS  11           HZ1      LYS  11  -4.355 -11.869   3.975
   95    HZ2  LYS  11           HZ2      LYS  11  -3.612 -12.076   2.462
   96    HZ3  LYS  11           HZ3      LYS  11  -5.145 -11.361   2.563
   97    H    PHE  12           HN       PHE  12  -0.911  -4.012  -0.089
   98    HA   PHE  12           HA       PHE  12   0.754  -4.706  -2.305
   99    HB2  PHE  12           HB2      PHE  12  -1.408  -5.059  -3.383
  100    HB3  PHE  12           HB1      PHE  12  -1.977  -3.492  -2.820
  101    HD1  PHE  12           HD2      PHE  12   0.531  -5.114  -5.020
  102    HD2  PHE  12           HD1      PHE  12  -1.634  -1.566  -4.099
  103    HE1  PHE  12           HE2      PHE  12   1.358  -4.073  -7.091
  104    HE2  PHE  12           HE1      PHE  12  -0.809  -0.521  -6.166
  105    HZ   PHE  12           HZ       PHE  12   0.690  -1.774  -7.663
  106    H    GLY  13           HN       GLY  13  -1.288  -2.216  -0.824
  107    HA2  GLY  13           HA2      GLY  13   0.231  -0.007  -1.676
  108    HA3  GLY  13           HA1      GLY  13  -0.868  -0.015  -0.312
  109    H    LYS  14           HN       LYS  14   0.103  -1.401   1.553
  110    HA   LYS  14           HA       LYS  14   2.207   0.024   2.671
  111    HB2  LYS  14           HB2      LYS  14   1.296  -2.769   3.385
  112    HB3  LYS  14           HB1      LYS  14   2.250  -1.710   4.411
  113    HG2  LYS  14           HG2      LYS  14  -0.547  -1.126   3.462
  114    HG3  LYS  14           HG1      LYS  14  -0.126  -1.801   5.034
  115    HD2  LYS  14           HD2      LYS  14   1.115   0.199   5.608
  116    HD3  LYS  14           HD1      LYS  14   0.824   0.871   4.002
  117    HE2  LYS  14           HE2      LYS  14  -1.566   0.932   4.436
  118    HE3  LYS  14           HE1      LYS  14  -1.320   0.187   6.012
  119    HZ1  LYS  14           HZ1      LYS  14  -1.642   2.627   6.066
  120    HZ2  LYS  14           HZ2      LYS  14  -0.179   2.817   5.231
  121    HZ3  LYS  14           HZ3      LYS  14  -0.187   2.122   6.778
  122    H    ALA  15           HN       ALA  15   2.231  -2.952   0.822
  123    HA   ALA  15           HA       ALA  15   4.955  -3.595   1.369
  124    HB1  ALA  15           HB1      ALA  15   4.700  -5.277  -0.371
  125    HB2  ALA  15           HB2      ALA  15   3.162  -4.560  -0.852
  126    HB3  ALA  15           HB3      ALA  15   3.328  -5.307   0.737
  127    H    PHE  16           HN       PHE  16   3.228  -1.996  -1.263
  128    HA   PHE  16           HA       PHE  16   5.430  -1.755  -3.019
  129    HB2  PHE  16           HB2      PHE  16   2.852  -1.486  -3.421
  130    HB3  PHE  16           HB1      PHE  16   3.149   0.195  -3.001
  131    HD1  PHE  16           HD1      PHE  16   3.871  -2.470  -5.409
  132    HD2  PHE  16           HD2      PHE  16   4.256   1.668  -4.509
  133    HE1  PHE  16           HE1      PHE  16   4.544  -2.036  -7.734
  134    HE2  PHE  16           HE2      PHE  16   4.933   2.116  -6.831
  135    HZ   PHE  16           HZ       PHE  16   5.074   0.260  -8.447
  136    H    VAL  17           HN       VAL  17   4.078   0.368  -0.511
  137    HA   VAL  17           HA       VAL  17   5.823   2.540  -1.163
  138    HB   VAL  17           HB       VAL  17   5.104   3.583   0.920
  139   HG11  VAL  17          HG11      VAL  17   2.813   2.285  -0.548
  140   HG12  VAL  17          HG12      VAL  17   3.649   3.763  -1.027
  141   HG13  VAL  17          HG13      VAL  17   2.711   3.724   0.466
  142   HG21  VAL  17          HG21      VAL  17   3.523   2.471   2.417
  143   HG22  VAL  17          HG22      VAL  17   5.068   1.624   2.357
  144   HG23  VAL  17          HG23      VAL  17   3.678   0.988   1.476
  145    H    GLY  18           HN       GLY  18   6.130  -0.332   0.655
  146    HA2  GLY  18           HA2      GLY  18   8.348   0.453   2.261
  147    HA3  GLY  18           HA1      GLY  18   7.857  -1.194   1.887
  148    H    GLU  19           HN       GLU  19   7.965  -0.302  -1.051
  149    HA   GLU  19           HA       GLU  19  10.785  -0.962  -1.418
  150    HB2  GLU  19           HB2      GLU  19   8.553  -0.734  -3.439
  151    HB3  GLU  19           HB1      GLU  19  10.177  -1.313  -3.770
  152    HG2  GLU  19           HG2      GLU  19   9.793  -3.193  -2.235
  153    HG3  GLU  19           HG1      GLU  19   8.142  -2.624  -1.983
  154    H    ILE  20           HN       ILE  20   8.405   1.436  -2.506
  155    HA   ILE  20           HA       ILE  20  10.302   3.002  -3.928
  156    HB   ILE  20           HB       ILE  20   8.527   4.731  -4.019
  157   HG12  ILE  20          HG12      ILE  20   6.994   2.733  -2.341
  158   HG13  ILE  20          HG11      ILE  20   7.471   4.358  -1.856
  159   HG21  ILE  20          HG21      ILE  20   7.673   1.926  -4.705
  160   HG22  ILE  20          HG22      ILE  20   8.659   2.994  -5.703
  161   HG23  ILE  20          HG23      ILE  20   6.976   3.401  -5.374
  162   HD11  ILE  20          HD11      ILE  20   5.119   4.267  -2.439
  163   HD12  ILE  20          HD12      ILE  20   5.523   3.664  -4.046
  164   HD13  ILE  20          HD13      ILE  20   6.001   5.293  -3.569
  165    H    MET  21           HN       MET  21   9.670   2.706  -0.619
  166    HA   MET  21           HA       MET  21  10.388   5.279   0.284
  167    HB2  MET  21           HB2      MET  21   9.433   3.604   1.796
  168    HB3  MET  21           HB1      MET  21  10.847   2.583   1.581
  169    HG2  MET  21           HG2      MET  21  12.243   4.215   2.682
  170    HG3  MET  21           HG1      MET  21  10.886   5.331   2.815
  171    HE1  MET  21           HE1      MET  21   8.545   3.519   5.350
  172    HE2  MET  21           HE2      MET  21   8.483   3.383   3.594
  173    HE3  MET  21           HE3      MET  21   8.793   4.948   4.347
  174    H    ASN  22           HN       ASN  22  12.274   2.442  -0.612
  175    HA   ASN  22           HA       ASN  22  14.741   4.017  -0.350
  176    HB2  ASN  22           HB2      ASN  22  15.896   1.796  -0.562
  177    HB3  ASN  22           HB1      ASN  22  14.885   1.953   0.870
  178   HD21  ASN  22          HD21      ASN  22  15.309   0.377  -2.190
  179   HD22  ASN  22          HD22      ASN  22  14.066  -0.817  -1.979
  180    H    SER  23           HN       SER  23  12.676   4.058  -2.547
  181    HA   SER  23           HA       SER  23  14.594   3.763  -4.741
  182    HB2  SER  23           HB2      SER  23  11.691   2.913  -4.913
  183    HB3  SER  23           HB1      SER  23  12.889   2.810  -6.203
  184    HG   SER  23           HG       SER  23  12.770   1.336  -3.779
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  -5.085   7.566   0.196
    2    H2   GLY   1           HT2      GLY   1  -5.119   6.469  -1.089
    3    H3   GLY   1           HT3      GLY   1  -4.638   5.950   0.449
    4    HA2  GLY   1           HA1      GLY   1  -7.354   6.907  -0.272
    5    HA3  GLY   1           HA2      GLY   1  -6.899   5.222  -0.041
    6    H    ILE   2           HN       ILE   2  -8.829   5.677   1.508
    7    HA   ILE   2           HA       ILE   2  -7.844   6.751   4.060
    8    HB   ILE   2           HB       ILE   2 -10.681   6.021   3.309
    9   HG12  ILE   2          HG12      ILE   2  -9.367   8.746   3.449
   10   HG13  ILE   2          HG11      ILE   2  -9.797   7.902   1.964
   11   HG21  ILE   2          HG21      ILE   2  -9.569   7.536   5.673
   12   HG22  ILE   2          HG22      ILE   2 -10.276   5.920   5.706
   13   HG23  ILE   2          HG23      ILE   2 -11.281   7.317   5.315
   14   HD11  ILE   2          HD11      ILE   2 -11.717   8.842   4.081
   15   HD12  ILE   2          HD12      ILE   2 -12.152   8.002   2.592
   16   HD13  ILE   2          HD13      ILE   2 -11.430   9.608   2.519
   17    H    GLY   3           HN       GLY   3 -10.135   4.160   3.198
   18    HA2  GLY   3           HA2      GLY   3  -8.559   2.333   4.894
   19    HA3  GLY   3           HA1      GLY   3 -10.305   2.434   5.043
   20    H    LYS   4           HN       LYS   4 -10.629   2.753   2.110
   21    HA   LYS   4           HA       LYS   4 -10.692  -0.073   1.548
   22    HB2  LYS   4           HB2      LYS   4 -11.630   2.284  -0.095
   23    HB3  LYS   4           HB1      LYS   4 -11.869   0.600  -0.540
   24    HG2  LYS   4           HG2      LYS   4 -13.165   0.275   1.544
   25    HG3  LYS   4           HG1      LYS   4 -13.004   2.002   1.872
   26    HD2  LYS   4           HD2      LYS   4 -14.185   2.517  -0.195
   27    HD3  LYS   4           HD1      LYS   4 -14.314   0.796  -0.565
   28    HE2  LYS   4           HE2      LYS   4 -15.604   0.491   1.529
   29    HE3  LYS   4           HE1      LYS   4 -15.549   2.234   1.781
   30    HZ1  LYS   4           HZ1      LYS   4 -16.718   2.520  -0.330
   31    HZ2  LYS   4           HZ2      LYS   4 -17.628   1.594   0.764
   32    HZ3  LYS   4           HZ3      LYS   4 -16.811   0.835  -0.512
   33    H    PHE   5           HN       PHE   5  -9.109   2.797   0.220
   34    HA   PHE   5           HA       PHE   5  -7.416   1.182  -1.472
   35    HB2  PHE   5           HB2      PHE   5  -7.400   4.110  -0.746
   36    HB3  PHE   5           HB1      PHE   5  -6.153   3.379  -1.748
   37    HD1  PHE   5           HD1      PHE   5  -9.691   4.337  -1.565
   38    HD2  PHE   5           HD2      PHE   5  -6.595   2.737  -4.009
   39    HE1  PHE   5           HE1      PHE   5 -11.099   4.656  -3.557
   40    HE2  PHE   5           HE2      PHE   5  -8.000   3.051  -6.002
   41    HZ   PHE   5           HZ       PHE   5 -10.255   4.010  -5.777
   42    H    LEU   6           HN       LEU   6  -7.615   0.961   1.552
   43    HA   LEU   6           HA       LEU   6  -4.703   0.867   2.036
   44    HB2  LEU   6           HB2      LEU   6  -5.871   2.471   3.516
   45    HB3  LEU   6           HB1      LEU   6  -6.939   1.187   4.049
   46    HG   LEU   6           HG       LEU   6  -4.855  -0.000   4.895
   47   HD11  LEU   6          HD11      LEU   6  -3.196   1.258   3.662
   48   HD12  LEU   6          HD12      LEU   6  -2.936   1.445   5.397
   49   HD13  LEU   6          HD13      LEU   6  -3.686   2.746   4.473
   50   HD21  LEU   6          HD21      LEU   6  -6.494   1.104   6.343
   51   HD22  LEU   6          HD22      LEU   6  -5.618   2.625   6.169
   52   HD23  LEU   6          HD23      LEU   6  -4.855   1.253   6.973
   53    H    HIS   7           HN       HIS   7  -7.487  -0.815   1.448
   54    HA   HIS   7           HA       HIS   7  -7.239  -2.981   3.284
   55    HB2  HIS   7           HB2      HIS   7  -9.351  -2.148   2.121
   56    HB3  HIS   7           HB1      HIS   7  -8.774  -2.984   0.687
   57    HD1  HIS   7           HD1      HIS   7 -11.157  -4.233   1.102
   58    HD2  HIS   7           HD2      HIS   7  -8.081  -5.103   3.767
   59    HE1  HIS   7           HE1      HIS   7 -11.811  -6.385   2.224
   60    HE2  HIS   7           HE2      HIS   7 -10.079  -6.728   4.017
   61    H    SER   8           HN       SER   8  -7.160  -3.164  -0.281
   62    HA   SER   8           HA       SER   8  -5.364  -5.432  -0.070
   63    HB2  SER   8           HB2      SER   8  -5.710  -5.413  -2.617
   64    HB3  SER   8           HB1      SER   8  -7.111  -5.799  -1.611
   65    HG   SER   8           HG       SER   8  -7.047  -3.969  -3.419
   66    H    ALA   9           HN       ALA   9  -5.262  -2.083  -0.856
   67    HA   ALA   9           HA       ALA   9  -2.864  -2.033  -2.338
   68    HB1  ALA   9           HB1      ALA   9  -4.388  -0.123  -2.238
   69    HB2  ALA   9           HB2      ALA   9  -2.756   0.332  -1.747
   70    HB3  ALA   9           HB3      ALA   9  -4.008   0.093  -0.527
   71    H    LYS  10           HN       LYS  10  -3.509  -2.762   0.905
   72    HA   LYS  10           HA       LYS  10  -0.623  -2.626   1.461
   73    HB2  LYS  10           HB2      LYS  10  -2.941  -2.136   3.313
   74    HB3  LYS  10           HB1      LYS  10  -1.363  -2.611   3.928
   75    HG2  LYS  10           HG2      LYS  10  -1.978  -0.161   2.290
   76    HG3  LYS  10           HG1      LYS  10  -1.593  -0.212   4.013
   77    HD2  LYS  10           HD2      LYS  10   0.617  -1.116   3.493
   78    HD3  LYS  10           HD1      LYS  10   0.234  -1.075   1.773
   79    HE2  LYS  10           HE2      LYS  10   1.596   0.834   2.372
   80    HE3  LYS  10           HE1      LYS  10  -0.017   1.368   1.904
   81    HZ1  LYS  10           HZ1      LYS  10   0.995   2.412   3.959
   82    HZ2  LYS  10           HZ2      LYS  10   0.725   0.932   4.740
   83    HZ3  LYS  10           HZ3      LYS  10  -0.580   1.812   4.114
   84    H    LYS  11           HN       LYS  11  -2.553  -4.680   0.311
   85    HA   LYS  11           HA       LYS  11  -1.632  -6.878   2.042
   86    HB2  LYS  11           HB2      LYS  11  -4.089  -6.792   1.514
   87    HB3  LYS  11           HB1      LYS  11  -3.682  -7.007  -0.182
   88    HG2  LYS  11           HG2      LYS  11  -4.353  -9.112   0.765
   89    HG3  LYS  11           HG1      LYS  11  -2.632  -9.169   0.373
   90    HD2  LYS  11           HD2      LYS  11  -2.114  -8.666   2.739
   91    HD3  LYS  11           HD1      LYS  11  -3.840  -8.705   3.100
   92    HE2  LYS  11           HE2      LYS  11  -2.846 -10.815   3.699
   93    HE3  LYS  11           HE1      LYS  11  -3.917 -11.042   2.317
   94    HZ1  LYS  11           HZ1      LYS  11  -2.017 -11.087   0.855
   95    HZ2  LYS  11           HZ2      LYS  11  -1.801 -12.230   2.089
   96    HZ3  LYS  11           HZ3      LYS  11  -0.961 -10.757   2.144
   97    H    PHE  12           HN       PHE  12  -2.207  -6.232  -1.409
   98    HA   PHE  12           HA       PHE  12   0.115  -7.809  -2.154
   99    HB2  PHE  12           HB2      PHE  12  -1.868  -6.226  -3.819
  100    HB3  PHE  12           HB1      PHE  12  -0.552  -7.185  -4.488
  101    HD1  PHE  12           HD2      PHE  12  -0.624  -9.611  -4.427
  102    HD2  PHE  12           HD1      PHE  12  -3.832  -7.261  -2.907
  103    HE1  PHE  12           HE2      PHE  12  -2.077 -11.597  -4.431
  104    HE2  PHE  12           HE1      PHE  12  -5.290  -9.241  -2.909
  105    HZ   PHE  12           HZ       PHE  12  -4.413 -11.415  -3.671
  106    H    GLY  13           HN       GLY  13  -0.912  -4.488  -1.872
  107    HA2  GLY  13           HA2      GLY  13   1.498  -3.414  -3.043
  108    HA3  GLY  13           HA1      GLY  13   0.222  -2.501  -2.252
  109    H    LYS  14           HN       LYS  14   0.913  -4.921  -0.199
  110    HA   LYS  14           HA       LYS  14   2.197  -3.326   1.718
  111    HB2  LYS  14           HB2      LYS  14   0.893  -5.304   2.326
  112    HB3  LYS  14           HB1      LYS  14   2.040  -6.340   1.492
  113    HG2  LYS  14           HG2      LYS  14   3.760  -5.801   3.092
  114    HG3  LYS  14           HG1      LYS  14   2.693  -4.646   3.892
  115    HD2  LYS  14           HD2      LYS  14   1.203  -6.406   4.571
  116    HD3  LYS  14           HD1      LYS  14   2.108  -7.591   3.627
  117    HE2  LYS  14           HE2      LYS  14   3.214  -6.029   5.957
  118    HE3  LYS  14           HE1      LYS  14   2.615  -7.684   6.048
  119    HZ1  LYS  14           HZ1      LYS  14   4.322  -8.382   4.518
  120    HZ2  LYS  14           HZ2      LYS  14   5.042  -7.561   5.821
  121    HZ3  LYS  14           HZ3      LYS  14   4.865  -6.786   4.326
  122    H    ALA  15           HN       ALA  15   3.420  -5.478  -0.758
  123    HA   ALA  15           HA       ALA  15   6.172  -5.001   0.127
  124    HB1  ALA  15           HB1      ALA  15   6.795  -6.798  -1.407
  125    HB2  ALA  15           HB2      ALA  15   5.122  -6.925  -1.948
  126    HB3  ALA  15           HB3      ALA  15   5.542  -7.327  -0.285
  127    H    PHE  16           HN       PHE  16   4.424  -3.000  -1.200
  128    HA   PHE  16           HA       PHE  16   6.296  -2.314  -3.342
  129    HB2  PHE  16           HB2      PHE  16   4.330  -3.362  -4.418
  130    HB3  PHE  16           HB1      PHE  16   3.287  -2.169  -3.651
  131    HD1  PHE  16           HD1      PHE  16   6.119  -2.532  -6.018
  132    HD2  PHE  16           HD2      PHE  16   2.887  -0.117  -4.667
  133    HE1  PHE  16           HE1      PHE  16   6.450  -1.028  -7.934
  134    HE2  PHE  16           HE2      PHE  16   3.210   1.394  -6.581
  135    HZ   PHE  16           HZ       PHE  16   4.994   0.939  -8.222
  136    H    VAL  17           HN       VAL  17   3.398  -1.119  -1.622
  137    HA   VAL  17           HA       VAL  17   4.115   1.614  -2.062
  138    HB   VAL  17           HB       VAL  17   2.096   0.500  -0.100
  139   HG11  VAL  17          HG11      VAL  17   1.035   2.715  -0.320
  140   HG12  VAL  17          HG12      VAL  17   2.398   3.250  -1.305
  141   HG13  VAL  17          HG13      VAL  17   2.648   2.802   0.384
  142   HG21  VAL  17          HG21      VAL  17   1.604  -0.292  -2.332
  143   HG22  VAL  17          HG22      VAL  17   1.742   1.346  -2.972
  144   HG23  VAL  17          HG23      VAL  17   0.432   0.940  -1.863
  145    H    GLY  18           HN       GLY  18   4.473  -0.677   0.554
  146    HA2  GLY  18           HA2      GLY  18   5.363   1.161   2.522
  147    HA3  GLY  18           HA1      GLY  18   5.589  -0.580   2.546
  148    H    GLU  19           HN       GLU  19   6.857   0.233  -0.314
  149    HA   GLU  19           HA       GLU  19   9.513   0.745   0.847
  150    HB2  GLU  19           HB2      GLU  19   8.912  -0.897  -1.617
  151    HB3  GLU  19           HB1      GLU  19  10.498  -0.634  -0.900
  152    HG2  GLU  19           HG2      GLU  19   9.606  -1.740   1.181
  153    HG3  GLU  19           HG1      GLU  19   8.195  -2.190   0.226
  154    H    ILE  20           HN       ILE  20   7.263   1.452  -1.741
  155    HA   ILE  20           HA       ILE  20   9.036   3.057  -3.271
  156    HB   ILE  20           HB       ILE  20   6.903   2.086  -4.154
  157   HG12  ILE  20          HG12      ILE  20   6.291   4.065  -5.521
  158   HG13  ILE  20          HG11      ILE  20   7.234   5.078  -4.430
  159   HG21  ILE  20          HG21      ILE  20   5.629   4.299  -2.555
  160   HG22  ILE  20          HG22      ILE  20   5.428   2.565  -2.304
  161   HG23  ILE  20          HG23      ILE  20   4.811   3.322  -3.773
  162   HD11  ILE  20          HD11      ILE  20   8.333   2.826  -6.095
  163   HD12  ILE  20          HD12      ILE  20   9.258   3.912  -5.058
  164   HD13  ILE  20          HD13      ILE  20   8.443   4.541  -6.492
  165    H    MET  21           HN       MET  21   7.177   3.612  -0.402
  166    HA   MET  21           HA       MET  21   7.505   6.499  -0.557
  167    HB2  MET  21           HB2      MET  21   5.452   5.355   0.402
  168    HB3  MET  21           HB1      MET  21   6.449   4.899   1.776
  169    HG2  MET  21           HG2      MET  21   5.143   6.884   2.265
  170    HG3  MET  21           HG1      MET  21   6.865   7.252   2.266
  171    HE1  MET  21           HE1      MET  21   6.347   9.883   2.105
  172    HE2  MET  21           HE2      MET  21   4.636   9.470   2.185
  173    HE3  MET  21           HE3      MET  21   5.220  10.564   0.931
  174    H    ASN  22           HN       ASN  22   9.842   4.919  -0.598
  175    HA   ASN  22           HA       ASN  22  11.221   6.141   1.668
  176    HB2  ASN  22           HB2      ASN  22  10.892   3.770   2.290
  177    HB3  ASN  22           HB1      ASN  22  11.668   3.271   0.791
  178   HD21  ASN  22          HD21      ASN  22  13.905   3.507   0.575
  179   HD22  ASN  22          HD22      ASN  22  14.933   3.784   1.935
  180    H    SER  23           HN       SER  23  11.866   4.067  -1.146
  181    HA   SER  23           HA       SER  23  13.230   6.201  -2.523
  182    HB2  SER  23           HB2      SER  23  14.743   3.699  -1.707
  183    HB3  SER  23           HB1      SER  23  15.333   4.917  -2.837
  184    HG   SER  23           HG       SER  23  14.524   6.093  -0.555
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1  -7.988   4.299  -3.856
    2    H2   GLY   1           HT2      GLY   1  -8.112   2.730  -4.495
    3    H3   GLY   1           HT3      GLY   1  -7.003   3.055  -3.251
    4    HA2  GLY   1           HA1      GLY   1  -9.961   3.209  -3.012
    5    HA3  GLY   1           HA2      GLY   1  -8.961   1.894  -2.410
    6    H    ILE   2           HN       ILE   2 -10.745   3.903  -1.059
    7    HA   ILE   2           HA       ILE   2  -8.765   4.749   0.931
    8    HB   ILE   2           HB       ILE   2  -9.294   6.688  -0.509
    9   HG12  ILE   2          HG12      ILE   2  -9.875   8.261   1.314
   10   HG13  ILE   2          HG11      ILE   2 -10.322   6.893   2.329
   11   HG21  ILE   2          HG21      ILE   2 -11.516   7.721  -0.397
   12   HG22  ILE   2          HG22      ILE   2 -12.105   6.335   0.521
   13   HG23  ILE   2          HG23      ILE   2 -11.562   6.125  -1.144
   14   HD11  ILE   2          HD11      ILE   2  -8.111   7.717   2.883
   15   HD12  ILE   2          HD12      ILE   2  -7.580   7.449   1.222
   16   HD13  ILE   2          HD13      ILE   2  -8.025   6.076   2.237
   17    H    GLY   3           HN       GLY   3 -11.913   3.578   0.179
   18    HA2  GLY   3           HA2      GLY   3 -12.909   3.930   2.882
   19    HA3  GLY   3           HA1      GLY   3 -13.769   3.198   1.538
   20    H    LYS   4           HN       LYS   4 -12.625   1.105   0.754
   21    HA   LYS   4           HA       LYS   4 -12.026  -0.472   3.160
   22    HB2  LYS   4           HB2      LYS   4 -13.327  -2.345   2.198
   23    HB3  LYS   4           HB1      LYS   4 -14.316  -0.933   2.533
   24    HG2  LYS   4           HG2      LYS   4 -14.324  -0.338   0.187
   25    HG3  LYS   4           HG1      LYS   4 -13.251  -1.693  -0.178
   26    HD2  LYS   4           HD2      LYS   4 -14.953  -3.263   0.578
   27    HD3  LYS   4           HD1      LYS   4 -16.022  -1.922   0.997
   28    HE2  LYS   4           HE2      LYS   4 -16.652  -2.889  -1.143
   29    HE3  LYS   4           HE1      LYS   4 -16.085  -1.234  -1.348
   30    HZ1  LYS   4           HZ1      LYS   4 -14.436  -3.664  -1.834
   31    HZ2  LYS   4           HZ2      LYS   4 -13.976  -2.057  -2.128
   32    HZ3  LYS   4           HZ3      LYS   4 -15.214  -2.766  -3.042
   33    H    PHE   5           HN       PHE   5 -11.264   0.228  -0.114
   34    HA   PHE   5           HA       PHE   5  -9.710  -2.101  -0.624
   35    HB2  PHE   5           HB2      PHE   5 -10.574  -0.567  -2.403
   36    HB3  PHE   5           HB1      PHE   5  -9.419   0.649  -1.866
   37    HD1  PHE   5           HD1      PHE   5  -9.659  -2.801  -3.201
   38    HD2  PHE   5           HD2      PHE   5  -7.251   0.672  -2.715
   39    HE1  PHE   5           HE1      PHE   5  -7.965  -3.770  -4.700
   40    HE2  PHE   5           HE2      PHE   5  -5.554  -0.287  -4.213
   41    HZ   PHE   5           HZ       PHE   5  -5.911  -2.513  -5.211
   42    H    LEU   6           HN       LEU   6  -9.304   0.436   1.517
   43    HA   LEU   6           HA       LEU   6  -6.465   0.818   1.319
   44    HB2  LEU   6           HB2      LEU   6  -8.024   2.476   2.321
   45    HB3  LEU   6           HB1      LEU   6  -8.318   1.369   3.647
   46    HG   LEU   6           HG       LEU   6  -5.914   1.530   4.262
   47   HD11  LEU   6          HD11      LEU   6  -5.854   3.691   2.161
   48   HD12  LEU   6          HD12      LEU   6  -5.022   2.139   2.077
   49   HD13  LEU   6          HD13      LEU   6  -4.560   3.322   3.303
   50   HD21  LEU   6          HD21      LEU   6  -7.585   2.891   5.385
   51   HD22  LEU   6          HD22      LEU   6  -7.425   4.135   4.144
   52   HD23  LEU   6          HD23      LEU   6  -6.071   3.779   5.215
   53    H    HIS   7           HN       HIS   7  -8.457  -1.601   2.609
   54    HA   HIS   7           HA       HIS   7  -6.641  -2.624   4.565
   55    HB2  HIS   7           HB2      HIS   7  -9.020  -3.833   3.145
   56    HB3  HIS   7           HB1      HIS   7  -8.053  -4.738   4.302
   57    HD1  HIS   7           HD1      HIS   7  -8.940  -4.700   6.599
   58    HD2  HIS   7           HD2      HIS   7 -10.100  -1.335   4.444
   59    HE1  HIS   7           HE1      HIS   7 -10.424  -3.385   8.141
   60    HE2  HIS   7           HE2      HIS   7 -11.283  -1.474   6.747
   61    H    SER   8           HN       SER   8  -6.882  -2.765   1.137
   62    HA   SER   8           HA       SER   8  -4.870  -4.885   1.063
   63    HB2  SER   8           HB2      SER   8  -6.854  -4.094  -1.075
   64    HB3  SER   8           HB1      SER   8  -5.718  -5.436  -1.149
   65    HG   SER   8           HG       SER   8  -6.857  -6.531   0.349
   66    H    ALA   9           HN       ALA   9  -5.591  -1.631   0.235
   67    HA   ALA   9           HA       ALA   9  -3.729  -1.087  -1.745
   68    HB1  ALA   9           HB1      ALA   9  -5.385   0.532  -0.875
   69    HB2  ALA   9           HB2      ALA   9  -3.757   1.199  -0.969
   70    HB3  ALA   9           HB3      ALA   9  -4.415   0.699   0.588
   71    H    LYS  10           HN       LYS  10  -3.302  -1.805   1.618
   72    HA   LYS  10           HA       LYS  10  -0.399  -1.654   1.158
   73    HB2  LYS  10           HB2      LYS  10  -0.110  -1.300   3.617
   74    HB3  LYS  10           HB1      LYS  10  -0.814   0.051   2.746
   75    HG2  LYS  10           HG2      LYS  10  -2.990  -0.451   3.609
   76    HG3  LYS  10           HG1      LYS  10  -2.403  -1.948   4.343
   77    HD2  LYS  10           HD2      LYS  10  -2.632  -0.059   5.959
   78    HD3  LYS  10           HD1      LYS  10  -1.000  -0.722   5.865
   79    HE2  LYS  10           HE2      LYS  10  -0.411   1.117   4.292
   80    HE3  LYS  10           HE1      LYS  10  -2.008   1.811   4.564
   81    HZ1  LYS  10           HZ1      LYS  10  -1.480   2.095   6.885
   82    HZ2  LYS  10           HZ2      LYS  10  -0.283   2.843   5.942
   83    HZ3  LYS  10           HZ3      LYS  10   0.028   1.348   6.684
   84    H    LYS  11           HN       LYS  11  -2.156  -3.807   0.605
   85    HA   LYS  11           HA       LYS  11  -0.786  -5.793   2.297
   86    HB2  LYS  11           HB2      LYS  11  -3.260  -5.839   2.607
   87    HB3  LYS  11           HB1      LYS  11  -3.443  -6.161   0.887
   88    HG2  LYS  11           HG2      LYS  11  -3.657  -8.201   2.182
   89    HG3  LYS  11           HG1      LYS  11  -2.227  -8.264   1.150
   90    HD2  LYS  11           HD2      LYS  11  -1.632  -9.129   3.300
   91    HD3  LYS  11           HD1      LYS  11  -0.866  -7.552   3.111
   92    HE2  LYS  11           HE2      LYS  11  -1.742  -7.634   5.316
   93    HE3  LYS  11           HE1      LYS  11  -2.803  -6.574   4.388
   94    HZ1  LYS  11           HZ1      LYS  11  -4.331  -8.466   4.117
   95    HZ2  LYS  11           HZ2      LYS  11  -4.103  -8.052   5.742
   96    HZ3  LYS  11           HZ3      LYS  11  -3.324  -9.413   5.099
   97    H    PHE  12           HN       PHE  12  -2.050  -4.969  -0.904
   98    HA   PHE  12           HA       PHE  12  -0.290  -6.926  -2.155
   99    HB2  PHE  12           HB2      PHE  12  -2.271  -4.969  -3.341
  100    HB3  PHE  12           HB1      PHE  12  -1.322  -6.115  -4.275
  101    HD1  PHE  12           HD1      PHE  12  -1.625  -8.603  -3.723
  102    HD2  PHE  12           HD2      PHE  12  -4.340  -5.566  -2.500
  103    HE1  PHE  12           HE1      PHE  12  -3.377 -10.300  -3.412
  104    HE2  PHE  12           HE2      PHE  12  -6.098  -7.257  -2.185
  105    HZ   PHE  12           HZ       PHE  12  -5.619  -9.631  -2.645
  106    H    GLY  13           HN       GLY  13  -0.939  -3.434  -2.333
  107    HA2  GLY  13           HA2      GLY  13   1.522  -2.878  -3.698
  108    HA3  GLY  13           HA1      GLY  13   0.384  -1.702  -3.059
  109    H    LYS  14           HN       LYS  14   1.047  -3.754  -0.590
  110    HA   LYS  14           HA       LYS  14   2.428  -1.883   0.959
  111    HB2  LYS  14           HB2      LYS  14   1.127  -3.731   1.911
  112    HB3  LYS  14           HB1      LYS  14   2.294  -4.887   1.285
  113    HG2  LYS  14           HG2      LYS  14   4.002  -4.018   2.752
  114    HG3  LYS  14           HG1      LYS  14   2.908  -2.754   3.322
  115    HD2  LYS  14           HD2      LYS  14   1.428  -4.425   4.272
  116    HD3  LYS  14           HD1      LYS  14   2.441  -5.718   3.629
  117    HE2  LYS  14           HE2      LYS  14   3.352  -3.656   5.626
  118    HE3  LYS  14           HE1      LYS  14   2.799  -5.276   6.042
  119    HZ1  LYS  14           HZ1      LYS  14   4.614  -6.166   4.663
  120    HZ2  LYS  14           HZ2      LYS  14   5.183  -5.233   5.957
  121    HZ3  LYS  14           HZ3      LYS  14   5.170  -4.589   4.389
  122    H    ALA  15           HN       ALA  15   3.587  -4.574  -0.993
  123    HA   ALA  15           HA       ALA  15   6.328  -4.248  -0.135
  124    HB1  ALA  15           HB1      ALA  15   6.817  -6.061  -1.691
  125    HB2  ALA  15           HB2      ALA  15   5.175  -5.971  -2.330
  126    HB3  ALA  15           HB3      ALA  15   5.445  -6.476  -0.660
  127    H    PHE  16           HN       PHE  16   4.502  -2.362  -1.939
  128    HA   PHE  16           HA       PHE  16   6.673  -1.699  -3.810
  129    HB2  PHE  16           HB2      PHE  16   3.702  -1.201  -4.088
  130    HB3  PHE  16           HB1      PHE  16   4.922  -0.584  -5.195
  131    HD1  PHE  16           HD1      PHE  16   6.108  -2.083  -6.703
  132    HD2  PHE  16           HD2      PHE  16   3.045  -3.508  -4.111
  133    HE1  PHE  16           HE1      PHE  16   5.965  -4.156  -8.022
  134    HE2  PHE  16           HE2      PHE  16   2.898  -5.584  -5.423
  135    HZ   PHE  16           HZ       PHE  16   4.358  -5.910  -7.379
  136    H    VAL  17           HN       VAL  17   4.011  -0.259  -1.910
  137    HA   VAL  17           HA       VAL  17   5.063   2.389  -2.232
  138    HB   VAL  17           HB       VAL  17   2.642   1.993  -1.939
  139   HG11  VAL  17          HG11      VAL  17   2.696   0.177  -0.336
  140   HG12  VAL  17          HG12      VAL  17   1.727   1.513   0.286
  141   HG13  VAL  17          HG13      VAL  17   3.361   1.252   0.892
  142   HG21  VAL  17          HG21      VAL  17   3.881   3.706   0.210
  143   HG22  VAL  17          HG22      VAL  17   2.216   3.822  -0.359
  144   HG23  VAL  17          HG23      VAL  17   3.550   4.189  -1.453
  145    H    GLY  18           HN       GLY  18   5.268  -0.115   0.182
  146    HA2  GLY  18           HA2      GLY  18   6.701   1.603   2.039
  147    HA3  GLY  18           HA1      GLY  18   6.292  -0.093   2.270
  148    H    GLU  19           HN       GLU  19   7.547   0.386  -0.767
  149    HA   GLU  19           HA       GLU  19  10.134  -0.686   0.124
  150    HB2  GLU  19           HB2      GLU  19   8.594  -2.163  -1.234
  151    HB3  GLU  19           HB1      GLU  19   8.823  -1.045  -2.570
  152    HG2  GLU  19           HG2      GLU  19  10.259  -2.940  -2.839
  153    HG3  GLU  19           HG1      GLU  19  11.229  -1.503  -2.518
  154    H    ILE  20           HN       ILE  20   8.684   1.166  -2.566
  155    HA   ILE  20           HA       ILE  20  11.246   2.169  -3.364
  156    HB   ILE  20           HB       ILE  20   9.506   1.764  -5.035
  157   HG12  ILE  20          HG12      ILE  20  10.278   4.681  -4.800
  158   HG13  ILE  20          HG11      ILE  20  11.249   3.407  -5.531
  159   HG21  ILE  20          HG21      ILE  20   7.540   2.340  -3.738
  160   HG22  ILE  20          HG22      ILE  20   7.579   3.271  -5.235
  161   HG23  ILE  20          HG23      ILE  20   8.030   4.035  -3.711
  162   HD11  ILE  20          HD11      ILE  20  10.173   4.761  -7.224
  163   HD12  ILE  20          HD12      ILE  20   8.591   4.410  -6.527
  164   HD13  ILE  20          HD13      ILE  20   9.539   3.114  -7.258
  165    H    MET  21           HN       MET  21   8.652   3.348  -1.336
  166    HA   MET  21           HA       MET  21   9.619   6.069  -1.383
  167    HB2  MET  21           HB2      MET  21   7.567   4.763   0.410
  168    HB3  MET  21           HB1      MET  21   7.901   6.487   0.339
  169    HG2  MET  21           HG2      MET  21   6.746   4.765  -1.836
  170    HG3  MET  21           HG1      MET  21   5.932   6.038  -0.926
  171    HE1  MET  21           HE1      MET  21   5.872   5.865  -4.084
  172    HE2  MET  21           HE2      MET  21   6.166   7.546  -4.535
  173    HE3  MET  21           HE3      MET  21   5.092   7.168  -3.188
  174    H    ASN  22           HN       ASN  22  10.139   3.214   0.474
  175    HA   ASN  22           HA       ASN  22  11.957   4.719   2.219
  176    HB2  ASN  22           HB2      ASN  22  10.103   2.492   3.105
  177    HB3  ASN  22           HB1      ASN  22  11.351   3.223   4.108
  178   HD21  ASN  22          HD21      ASN  22  11.079   5.369   4.816
  179   HD22  ASN  22          HD22      ASN  22   9.527   6.128   4.820
  180    H    SER  23           HN       SER  23  13.520   4.017   0.618
  181    HA   SER  23           HA       SER  23  14.161   1.161   0.694
  182    HB2  SER  23           HB2      SER  23  15.307   3.409  -0.982
  183    HB3  SER  23           HB1      SER  23  15.792   1.718  -1.096
  184    HG   SER  23           HG       SER  23  13.067   2.223  -1.282
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1 -11.008   5.736  -4.730
    2    H2   GLY   1           HT2      GLY   1 -10.708   4.417  -5.748
    3    H3   GLY   1           HT3      GLY   1  -9.516   5.600  -5.525
    4    HA2  GLY   1           HA1      GLY   1 -10.534   3.732  -3.454
    5    HA3  GLY   1           HA2      GLY   1  -8.986   3.611  -4.278
    6    H    ILE   2           HN       ILE   2 -10.755   5.052  -1.739
    7    HA   ILE   2           HA       ILE   2  -8.459   6.705  -0.963
    8    HB   ILE   2           HB       ILE   2 -10.805   7.643  -0.917
    9   HG12  ILE   2          HG12      ILE   2 -10.548   8.772   1.266
   10   HG13  ILE   2          HG11      ILE   2  -9.320   7.592   1.715
   11   HG21  ILE   2          HG21      ILE   2 -11.154   5.749   1.400
   12   HG22  ILE   2          HG22      ILE   2 -12.021   5.715  -0.135
   13   HG23  ILE   2          HG23      ILE   2 -12.255   7.060   0.981
   14   HD11  ILE   2          HD11      ILE   2  -7.917   8.362  -0.135
   15   HD12  ILE   2          HD12      ILE   2  -8.297   9.659   0.998
   16   HD13  ILE   2          HD13      ILE   2  -9.139   9.565  -0.550
   17    H    GLY   3           HN       GLY   3  -9.227   6.351   1.950
   18    HA2  GLY   3           HA2      GLY   3  -7.320   4.418   2.582
   19    HA3  GLY   3           HA1      GLY   3  -8.482   5.097   3.703
   20    H    LYS   4           HN       LYS   4 -10.503   3.785   1.539
   21    HA   LYS   4           HA       LYS   4 -10.711   1.377   3.159
   22    HB2  LYS   4           HB2      LYS   4 -12.914   1.098   2.315
   23    HB3  LYS   4           HB1      LYS   4 -12.730   2.807   2.670
   24    HG2  LYS   4           HG2      LYS   4 -12.362   3.252   0.289
   25    HG3  LYS   4           HG1      LYS   4 -12.579   1.533  -0.051
   26    HD2  LYS   4           HD2      LYS   4 -14.841   1.713   1.030
   27    HD3  LYS   4           HD1      LYS   4 -14.611   3.461   1.051
   28    HE2  LYS   4           HE2      LYS   4 -15.906   2.883  -0.878
   29    HE3  LYS   4           HE1      LYS   4 -14.307   3.397  -1.411
   30    HZ1  LYS   4           HZ1      LYS   4 -15.207   1.368  -2.529
   31    HZ2  LYS   4           HZ2      LYS   4 -15.066   0.551  -1.047
   32    HZ3  LYS   4           HZ3      LYS   4 -13.680   1.158  -1.817
   33    H    PHE   5           HN       PHE   5  -9.649   2.376   0.096
   34    HA   PHE   5           HA       PHE   5  -9.612  -0.275  -1.068
   35    HB2  PHE   5           HB2      PHE   5  -9.873   1.705  -2.501
   36    HB3  PHE   5           HB1      PHE   5  -8.343   2.347  -1.920
   37    HD1  PHE   5           HD1      PHE   5  -9.833  -0.483  -3.809
   38    HD2  PHE   5           HD2      PHE   5  -6.352   1.832  -3.014
   39    HE1  PHE   5           HE1      PHE   5  -8.672  -1.597  -5.671
   40    HE2  PHE   5           HE2      PHE   5  -5.184   0.719  -4.872
   41    HZ   PHE   5           HZ       PHE   5  -6.345  -0.995  -6.205
   42    H    LEU   6           HN       LEU   6  -7.967   1.316   1.305
   43    HA   LEU   6           HA       LEU   6  -5.270   0.591   0.540
   44    HB2  LEU   6           HB2      LEU   6  -5.849   2.714   1.721
   45    HB3  LEU   6           HB1      LEU   6  -6.264   1.770   3.136
   46    HG   LEU   6           HG       LEU   6  -3.941   0.985   3.300
   47   HD11  LEU   6          HD11      LEU   6  -3.334   1.106   0.945
   48   HD12  LEU   6          HD12      LEU   6  -2.201   2.020   1.941
   49   HD13  LEU   6          HD13      LEU   6  -3.433   2.865   1.000
   50   HD21  LEU   6          HD21      LEU   6  -4.646   2.968   4.532
   51   HD22  LEU   6          HD22      LEU   6  -4.221   3.985   3.154
   52   HD23  LEU   6          HD23      LEU   6  -2.965   3.100   4.020
   53    H    HIS   7           HN       HIS   7  -7.815  -1.022   2.001
   54    HA   HIS   7           HA       HIS   7  -6.450  -2.511   3.989
   55    HB2  HIS   7           HB2      HIS   7  -8.940  -3.128   2.392
   56    HB3  HIS   7           HB1      HIS   7  -8.331  -4.171   3.676
   57    HD1  HIS   7           HD1      HIS   7 -11.004  -2.179   3.366
   58    HD2  HIS   7           HD2      HIS   7  -7.797  -1.999   6.008
   59    HE1  HIS   7           HE1      HIS   7 -11.835  -0.885   5.358
   60    HE2  HIS   7           HE2      HIS   7  -9.961  -1.024   7.032
   61    H    SER   8           HN       SER   8  -7.454  -3.492   0.695
   62    HA   SER   8           HA       SER   8  -5.643  -5.738   0.855
   63    HB2  SER   8           HB2      SER   8  -7.550  -4.868  -1.320
   64    HB3  SER   8           HB1      SER   8  -6.601  -6.352  -1.339
   65    HG   SER   8           HG       SER   8  -8.449  -7.027  -0.450
   66    H    ALA   9           HN       ALA   9  -5.601  -2.539  -0.415
   67    HA   ALA   9           HA       ALA   9  -3.507  -2.891  -2.306
   68    HB1  ALA   9           HB1      ALA   9  -3.107  -0.486  -2.037
   69    HB2  ALA   9           HB2      ALA   9  -4.164  -0.466  -0.627
   70    HB3  ALA   9           HB3      ALA   9  -4.826  -0.832  -2.221
   71    H    LYS  10           HN       LYS  10  -3.692  -3.013   1.075
   72    HA   LYS  10           HA       LYS  10  -0.787  -2.783   1.413
   73    HB2  LYS  10           HB2      LYS  10  -2.299  -1.505   2.925
   74    HB3  LYS  10           HB1      LYS  10  -2.994  -3.021   3.475
   75    HG2  LYS  10           HG2      LYS  10  -0.781  -3.675   4.353
   76    HG3  LYS  10           HG1      LYS  10  -0.160  -2.091   3.880
   77    HD2  LYS  10           HD2      LYS  10  -0.801  -2.158   6.259
   78    HD3  LYS  10           HD1      LYS  10  -1.764  -0.996   5.344
   79    HE2  LYS  10           HE2      LYS  10  -3.507  -2.802   5.111
   80    HE3  LYS  10           HE1      LYS  10  -2.572  -3.746   6.268
   81    HZ1  LYS  10           HZ1      LYS  10  -3.700  -1.049   6.792
   82    HZ2  LYS  10           HZ2      LYS  10  -2.881  -2.024   7.912
   83    HZ3  LYS  10           HZ3      LYS  10  -4.392  -2.507   7.311
   84    H    LYS  11           HN       LYS  11  -2.909  -5.064   0.522
   85    HA   LYS  11           HA       LYS  11  -1.846  -7.215   2.181
   86    HB2  LYS  11           HB2      LYS  11  -4.268  -7.173   1.631
   87    HB3  LYS  11           HB1      LYS  11  -3.862  -7.323  -0.074
   88    HG2  LYS  11           HG2      LYS  11  -2.863  -9.499   0.341
   89    HG3  LYS  11           HG1      LYS  11  -3.217  -9.343   2.063
   90    HD2  LYS  11           HD2      LYS  11  -5.611  -9.233   1.544
   91    HD3  LYS  11           HD1      LYS  11  -5.239  -9.430  -0.170
   92    HE2  LYS  11           HE2      LYS  11  -4.239 -11.609   0.296
   93    HE3  LYS  11           HE1      LYS  11  -4.592 -11.410   2.012
   94    HZ1  LYS  11           HZ1      LYS  11  -6.244 -12.787   0.965
   95    HZ2  LYS  11           HZ2      LYS  11  -6.589 -11.587  -0.181
   96    HZ3  LYS  11           HZ3      LYS  11  -6.960 -11.330   1.456
   97    H    PHE  12           HN       PHE  12  -2.032  -6.281  -1.245
   98    HA   PHE  12           HA       PHE  12   0.182  -8.134  -1.798
   99    HB2  PHE  12           HB2      PHE  12  -1.919  -8.297  -3.179
  100    HB3  PHE  12           HB1      PHE  12  -1.576  -6.684  -3.792
  101    HD1  PHE  12           HD1      PHE  12   0.316  -6.301  -5.299
  102    HD2  PHE  12           HD2      PHE  12  -0.680 -10.207  -3.931
  103    HE1  PHE  12           HE1      PHE  12   1.715  -7.276  -7.074
  104    HE2  PHE  12           HE2      PHE  12   0.719 -11.187  -5.701
  105    HZ   PHE  12           HZ       PHE  12   1.920  -9.722  -7.274
  106    H    GLY  13           HN       GLY  13  -0.887  -4.791  -2.296
  107    HA2  GLY  13           HA2      GLY  13   1.532  -4.020  -3.621
  108    HA3  GLY  13           HA1      GLY  13   0.240  -2.952  -3.099
  109    H    LYS  14           HN       LYS  14   1.071  -4.708  -0.440
  110    HA   LYS  14           HA       LYS  14   2.221  -2.539   0.907
  111    HB2  LYS  14           HB2      LYS  14   2.626  -4.061   2.748
  112    HB3  LYS  14           HB1      LYS  14   1.048  -4.379   2.052
  113    HG2  LYS  14           HG2      LYS  14   1.914  -6.331   0.909
  114    HG3  LYS  14           HG1      LYS  14   3.534  -5.997   1.531
  115    HD2  LYS  14           HD2      LYS  14   2.632  -6.212   3.838
  116    HD3  LYS  14           HD1      LYS  14   1.077  -6.671   3.146
  117    HE2  LYS  14           HE2      LYS  14   3.674  -8.155   2.767
  118    HE3  LYS  14           HE1      LYS  14   2.379  -8.621   3.869
  119    HZ1  LYS  14           HZ1      LYS  14   0.927  -8.643   1.793
  120    HZ2  LYS  14           HZ2      LYS  14   2.032  -9.911   1.995
  121    HZ3  LYS  14           HZ3      LYS  14   2.380  -8.648   0.913
  122    H    ALA  15           HN       ALA  15   3.648  -5.132  -0.927
  123    HA   ALA  15           HA       ALA  15   6.326  -4.747  -0.029
  124    HB1  ALA  15           HB1      ALA  15   5.582  -6.847  -1.066
  125    HB2  ALA  15           HB2      ALA  15   6.961  -6.154  -1.916
  126    HB3  ALA  15           HB3      ALA  15   5.341  -6.002  -2.594
  127    H    PHE  16           HN       PHE  16   4.301  -3.300  -2.450
  128    HA   PHE  16           HA       PHE  16   6.495  -2.011  -3.816
  129    HB2  PHE  16           HB2      PHE  16   3.507  -1.671  -4.132
  130    HB3  PHE  16           HB1      PHE  16   4.729  -0.965  -5.185
  131    HD1  PHE  16           HD2      PHE  16   6.252  -2.538  -6.471
  132    HD2  PHE  16           HD1      PHE  16   2.711  -3.829  -4.496
  133    HE1  PHE  16           HE2      PHE  16   6.229  -4.583  -7.845
  134    HE2  PHE  16           HE1      PHE  16   2.685  -5.871  -5.861
  135    HZ   PHE  16           HZ       PHE  16   4.442  -6.250  -7.540
  136    H    VAL  17           HN       VAL  17   3.748  -0.980  -1.776
  137    HA   VAL  17           HA       VAL  17   4.513   1.766  -1.850
  138    HB   VAL  17           HB       VAL  17   2.869   2.118  -0.065
  139   HG11  VAL  17          HG11      VAL  17   1.901   0.242  -2.220
  140   HG12  VAL  17          HG12      VAL  17   2.079   1.994  -2.361
  141   HG13  VAL  17          HG13      VAL  17   0.884   1.313  -1.257
  142   HG21  VAL  17          HG21      VAL  17   3.293   0.082   1.238
  143   HG22  VAL  17          HG22      VAL  17   2.569  -0.888  -0.047
  144   HG23  VAL  17          HG23      VAL  17   1.578   0.260   0.855
  145    H    GLY  18           HN       GLY  18   5.407  -0.950   0.067
  146    HA2  GLY  18           HA2      GLY  18   6.491   0.418   2.291
  147    HA3  GLY  18           HA1      GLY  18   6.913  -1.207   1.769
  148    H    GLU  19           HN       GLU  19   7.545   0.142  -0.945
  149    HA   GLU  19           HA       GLU  19  10.266   0.941  -0.189
  150    HB2  GLU  19           HB2      GLU  19  10.056  -0.944  -1.784
  151    HB3  GLU  19           HB1      GLU  19   9.232   0.126  -2.911
  152    HG2  GLU  19           HG2      GLU  19  11.273   1.572  -2.899
  153    HG3  GLU  19           HG1      GLU  19  12.076   0.318  -1.954
  154    H    ILE  20           HN       ILE  20   7.410   1.945  -1.948
  155    HA   ILE  20           HA       ILE  20   8.413   4.258  -3.151
  156    HB   ILE  20           HB       ILE  20   5.607   3.778  -2.130
  157   HG12  ILE  20          HG12      ILE  20   6.791   3.351  -4.884
  158   HG13  ILE  20          HG11      ILE  20   6.427   2.067  -3.738
  159   HG21  ILE  20          HG21      ILE  20   6.644   5.758  -4.161
  160   HG22  ILE  20          HG22      ILE  20   6.024   6.139  -2.554
  161   HG23  ILE  20          HG23      ILE  20   4.945   5.475  -3.780
  162   HD11  ILE  20          HD11      ILE  20   4.053   2.671  -3.844
  163   HD12  ILE  20          HD12      ILE  20   4.700   2.231  -5.424
  164   HD13  ILE  20          HD13      ILE  20   4.436   3.926  -5.022
  165    H    MET  21           HN       MET  21   6.936   3.798   0.059
  166    HA   MET  21           HA       MET  21   7.423   6.574   0.738
  167    HB2  MET  21           HB2      MET  21   6.380   6.099   2.854
  168    HB3  MET  21           HB1      MET  21   5.414   5.367   1.582
  169    HG2  MET  21           HG2      MET  21   6.419   3.193   2.082
  170    HG3  MET  21           HG1      MET  21   7.357   3.934   3.379
  171    HE1  MET  21           HE1      MET  21   5.271   6.030   4.508
  172    HE2  MET  21           HE2      MET  21   6.227   5.017   5.588
  173    HE3  MET  21           HE3      MET  21   4.478   5.128   5.797
  174    H    ASN  22           HN       ASN  22   9.461   4.192   0.320
  175    HA   ASN  22           HA       ASN  22  11.133   4.807   2.660
  176    HB2  ASN  22           HB2      ASN  22  10.846   2.440   2.384
  177    HB3  ASN  22           HB1      ASN  22  11.203   2.534   0.664
  178   HD21  ASN  22          HD21      ASN  22  13.313   2.610  -0.016
  179   HD22  ASN  22          HD22      ASN  22  14.659   2.374   1.044
  180    H    SER  23           HN       SER  23  10.766   5.272  -0.714
  181    HA   SER  23           HA       SER  23  13.551   6.154  -0.992
  182    HB2  SER  23           HB2      SER  23  11.603   5.598  -3.237
  183    HB3  SER  23           HB1      SER  23  13.362   5.729  -3.332
  184    HG   SER  23           HG       SER  23  11.847   3.684  -2.060
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1 -11.779   7.145  -4.357
    2    H2   GLY   1           HT2      GLY   1 -12.397   7.332  -2.783
    3    H3   GLY   1           HT3      GLY   1 -13.066   6.176  -3.822
    4    HA2  GLY   1           HA1      GLY   1 -11.660   5.102  -2.202
    5    HA3  GLY   1           HA2      GLY   1 -11.016   4.920  -3.828
    6    H    ILE   2           HN       ILE   2 -10.429   6.035  -0.666
    7    HA   ILE   2           HA       ILE   2  -7.861   7.188  -1.552
    8    HB   ILE   2           HB       ILE   2  -9.548   8.121   0.781
    9   HG12  ILE   2          HG12      ILE   2 -10.381   8.889  -1.407
   10   HG13  ILE   2          HG11      ILE   2  -9.746  10.225  -0.453
   11   HG21  ILE   2          HG21      ILE   2  -7.835   9.833   1.114
   12   HG22  ILE   2          HG22      ILE   2  -6.865   9.113  -0.173
   13   HG23  ILE   2          HG23      ILE   2  -7.175   8.208   1.308
   14   HD11  ILE   2          HD11      ILE   2  -7.671  10.140  -1.762
   15   HD12  ILE   2          HD12      ILE   2  -9.091  10.442  -2.763
   16   HD13  ILE   2          HD13      ILE   2  -8.360   8.839  -2.731
   17    H    GLY   3           HN       GLY   3  -9.614   5.552   1.076
   18    HA2  GLY   3           HA2      GLY   3  -7.068   4.269   1.819
   19    HA3  GLY   3           HA1      GLY   3  -8.033   5.057   3.056
   20    H    LYS   4           HN       LYS   4 -10.096   3.705   0.791
   21    HA   LYS   4           HA       LYS   4 -10.568   1.475   2.603
   22    HB2  LYS   4           HB2      LYS   4 -12.263   2.659   0.414
   23    HB3  LYS   4           HB1      LYS   4 -12.688   1.172   1.254
   24    HG2  LYS   4           HG2      LYS   4 -12.443   3.935   2.413
   25    HG3  LYS   4           HG1      LYS   4 -13.885   2.921   2.306
   26    HD2  LYS   4           HD2      LYS   4 -12.862   1.312   3.840
   27    HD3  LYS   4           HD1      LYS   4 -11.426   2.327   3.950
   28    HE2  LYS   4           HE2      LYS   4 -12.716   2.778   5.881
   29    HE3  LYS   4           HE1      LYS   4 -12.928   4.158   4.805
   30    HZ1  LYS   4           HZ1      LYS   4 -15.052   3.260   4.109
   31    HZ2  LYS   4           HZ2      LYS   4 -15.017   3.440   5.793
   32    HZ3  LYS   4           HZ3      LYS   4 -14.835   1.904   5.104
   33    H    PHE   5           HN       PHE   5  -9.213   2.092  -0.468
   34    HA   PHE   5           HA       PHE   5  -9.239  -0.737  -1.142
   35    HB2  PHE   5           HB2      PHE   5  -8.039  -0.141  -3.144
   36    HB3  PHE   5           HB1      PHE   5  -9.349   1.013  -2.933
   37    HD1  PHE   5           HD1      PHE   5  -8.848   3.329  -2.195
   38    HD2  PHE   5           HD2      PHE   5  -5.770   0.537  -3.118
   39    HE1  PHE   5           HE1      PHE   5  -7.236   5.176  -2.400
   40    HE2  PHE   5           HE2      PHE   5  -4.154   2.381  -3.324
   41    HZ   PHE   5           HZ       PHE   5  -4.887   4.701  -2.965
   42    H    LEU   6           HN       LEU   6  -7.782   1.018   1.102
   43    HA   LEU   6           HA       LEU   6  -5.026   0.334   0.790
   44    HB2  LEU   6           HB2      LEU   6  -5.867   2.281   2.093
   45    HB3  LEU   6           HB1      LEU   6  -6.507   1.166   3.284
   46    HG   LEU   6           HG       LEU   6  -4.189   0.369   3.718
   47   HD11  LEU   6          HD11      LEU   6  -3.432   2.656   1.911
   48   HD12  LEU   6          HD12      LEU   6  -3.185   0.941   1.585
   49   HD13  LEU   6          HD13      LEU   6  -2.315   1.720   2.909
   50   HD21  LEU   6          HD21      LEU   6  -5.213   2.040   5.155
   51   HD22  LEU   6          HD22      LEU   6  -4.658   3.324   4.079
   52   HD23  LEU   6          HD23      LEU   6  -3.488   2.352   4.970
   53    H    HIS   7           HN       HIS   7  -7.739  -1.426   1.710
   54    HA   HIS   7           HA       HIS   7  -6.649  -3.171   3.635
   55    HB2  HIS   7           HB2      HIS   7  -8.843  -3.574   1.595
   56    HB3  HIS   7           HB1      HIS   7  -8.417  -4.785   2.800
   57    HD1  HIS   7           HD1      HIS   7  -9.941  -4.732   4.722
   58    HD2  HIS   7           HD2      HIS   7  -9.391  -0.938   3.106
   59    HE1  HIS   7           HE1      HIS   7 -11.349  -3.184   6.121
   60    HE2  HIS   7           HE2      HIS   7 -10.856  -0.876   5.239
   61    H    SER   8           HN       SER   8  -6.968  -3.533   0.094
   62    HA   SER   8           HA       SER   8  -5.160  -5.777   0.108
   63    HB2  SER   8           HB2      SER   8  -6.230  -4.258  -2.272
   64    HB3  SER   8           HB1      SER   8  -5.558  -5.886  -2.248
   65    HG   SER   8           HG       SER   8  -7.731  -6.171  -2.219
   66    H    ALA   9           HN       ALA   9  -4.988  -2.355  -0.305
   67    HA   ALA   9           HA       ALA   9  -2.474  -2.237  -1.606
   68    HB1  ALA   9           HB1      ALA   9  -2.393   0.080  -0.886
   69    HB2  ALA   9           HB2      ALA   9  -3.708  -0.206   0.251
   70    HB3  ALA   9           HB3      ALA   9  -4.005  -0.313  -1.482
   71    H    LYS  10           HN       LYS  10  -3.362  -3.282   1.461
   72    HA   LYS  10           HA       LYS  10  -0.569  -3.062   2.373
   73    HB2  LYS  10           HB2      LYS  10  -3.111  -3.521   3.941
   74    HB3  LYS  10           HB1      LYS  10  -1.500  -3.659   4.633
   75    HG2  LYS  10           HG2      LYS  10  -1.065  -1.327   4.205
   76    HG3  LYS  10           HG1      LYS  10  -2.612  -1.160   3.371
   77    HD2  LYS  10           HD2      LYS  10  -2.747  -0.285   5.642
   78    HD3  LYS  10           HD1      LYS  10  -3.786  -1.698   5.452
   79    HE2  LYS  10           HE2      LYS  10  -2.100  -3.097   6.511
   80    HE3  LYS  10           HE1      LYS  10  -1.022  -1.712   6.658
   81    HZ1  LYS  10           HZ1      LYS  10  -3.696  -1.913   7.937
   82    HZ2  LYS  10           HZ2      LYS  10  -2.568  -0.662   8.141
   83    HZ3  LYS  10           HZ3      LYS  10  -2.221  -2.223   8.720
   84    H    LYS  11           HN       LYS  11  -2.922  -5.198   1.156
   85    HA   LYS  11           HA       LYS  11  -1.759  -7.568   2.351
   86    HB2  LYS  11           HB2      LYS  11  -4.220  -7.334   1.767
   87    HB3  LYS  11           HB1      LYS  11  -3.744  -7.440   0.078
   88    HG2  LYS  11           HG2      LYS  11  -4.451  -9.601   0.745
   89    HG3  LYS  11           HG1      LYS  11  -2.693  -9.651   0.602
   90    HD2  LYS  11           HD2      LYS  11  -2.495  -9.354   3.030
   91    HD3  LYS  11           HD1      LYS  11  -4.252  -9.329   3.167
   92    HE2  LYS  11           HE2      LYS  11  -3.556 -11.518   3.747
   93    HE3  LYS  11           HE1      LYS  11  -4.258 -11.625   2.135
   94    HZ1  LYS  11           HZ1      LYS  11  -1.347 -11.442   2.695
   95    HZ2  LYS  11           HZ2      LYS  11  -2.071 -11.691   1.181
   96    HZ3  LYS  11           HZ3      LYS  11  -2.179 -12.884   2.380
   97    H    PHE  12           HN       PHE  12  -2.152  -6.277  -0.932
   98    HA   PHE  12           HA       PHE  12   0.192  -7.839  -1.791
   99    HB2  PHE  12           HB2      PHE  12  -1.946  -6.490  -3.459
  100    HB3  PHE  12           HB1      PHE  12  -0.599  -7.425  -4.091
  101    HD1  PHE  12           HD2      PHE  12  -0.563  -9.860  -3.860
  102    HD2  PHE  12           HD1      PHE  12  -3.872  -7.541  -2.514
  103    HE1  PHE  12           HE2      PHE  12  -1.946 -11.893  -3.750
  104    HE2  PHE  12           HE1      PHE  12  -5.255  -9.571  -2.405
  105    HZ   PHE  12           HZ       PHE  12  -4.294 -11.752  -3.025
  106    H    GLY  13           HN       GLY  13  -1.254  -4.665  -1.612
  107    HA2  GLY  13           HA2      GLY  13   0.743  -3.330  -3.150
  108    HA3  GLY  13           HA1      GLY  13  -0.484  -2.571  -2.152
  109    H    LYS  14           HN       LYS  14   0.917  -4.622  -0.069
  110    HA   LYS  14           HA       LYS  14   2.288  -2.642   1.356
  111    HB2  LYS  14           HB2      LYS  14   1.441  -4.765   2.358
  112    HB3  LYS  14           HB1      LYS  14   2.746  -5.627   1.551
  113    HG2  LYS  14           HG2      LYS  14   4.391  -4.330   2.805
  114    HG3  LYS  14           HG1      LYS  14   3.091  -3.452   3.610
  115    HD2  LYS  14           HD2      LYS  14   2.287  -5.560   4.581
  116    HD3  LYS  14           HD1      LYS  14   3.607  -6.420   3.786
  117    HE2  LYS  14           HE2      LYS  14   3.943  -4.207   5.809
  118    HE3  LYS  14           HE1      LYS  14   4.077  -5.930   6.160
  119    HZ1  LYS  14           HZ1      LYS  14   6.228  -4.741   5.781
  120    HZ2  LYS  14           HZ2      LYS  14   5.778  -4.557   4.156
  121    HZ3  LYS  14           HZ3      LYS  14   5.984  -6.106   4.805
  122    H    ALA  15           HN       ALA  15   3.349  -4.831  -1.146
  123    HA   ALA  15           HA       ALA  15   6.151  -4.366  -0.775
  124    HB1  ALA  15           HB1      ALA  15   6.434  -5.565  -2.863
  125    HB2  ALA  15           HB2      ALA  15   4.708  -5.444  -3.196
  126    HB3  ALA  15           HB3      ALA  15   5.277  -6.409  -1.835
  127    H    PHE  16           HN       PHE  16   3.646  -2.512  -2.021
  128    HA   PHE  16           HA       PHE  16   5.439  -0.983  -3.774
  129    HB2  PHE  16           HB2      PHE  16   2.424  -0.905  -3.535
  130    HB3  PHE  16           HB1      PHE  16   3.381   0.060  -4.654
  131    HD1  PHE  16           HD2      PHE  16   4.798  -1.178  -6.372
  132    HD2  PHE  16           HD1      PHE  16   1.709  -3.040  -4.113
  133    HE1  PHE  16           HE2      PHE  16   4.687  -2.993  -8.027
  134    HE2  PHE  16           HE1      PHE  16   1.594  -4.860  -5.762
  135    HZ   PHE  16           HZ       PHE  16   3.084  -4.839  -7.729
  136    H    VAL  17           HN       VAL  17   3.056  -0.552  -1.151
  137    HA   VAL  17           HA       VAL  17   3.670   2.207  -0.776
  138    HB   VAL  17           HB       VAL  17   1.525   1.240  -0.008
  139   HG11  VAL  17          HG11      VAL  17   2.255  -0.913   0.791
  140   HG12  VAL  17          HG12      VAL  17   1.449  -0.046   2.096
  141   HG13  VAL  17          HG13      VAL  17   3.208  -0.153   2.064
  142   HG21  VAL  17          HG21      VAL  17   3.191   2.453   2.191
  143   HG22  VAL  17          HG22      VAL  17   1.431   2.378   2.166
  144   HG23  VAL  17          HG23      VAL  17   2.289   3.330   0.956
  145    H    GLY  18           HN       GLY  18   4.878  -0.814   0.482
  146    HA2  GLY  18           HA2      GLY  18   6.685   0.453   2.354
  147    HA3  GLY  18           HA1      GLY  18   6.586  -1.263   1.976
  148    H    GLU  19           HN       GLU  19   6.698   0.724  -0.746
  149    HA   GLU  19           HA       GLU  19   9.613   0.411  -1.008
  150    HB2  GLU  19           HB2      GLU  19   8.218  -1.074  -2.512
  151    HB3  GLU  19           HB1      GLU  19   7.622   0.390  -3.281
  152    HG2  GLU  19           HG2      GLU  19   9.387  -0.551  -4.602
  153    HG3  GLU  19           HG1      GLU  19   9.926   0.975  -3.903
  154    H    ILE  20           HN       ILE  20   6.752   2.282  -1.947
  155    HA   ILE  20           HA       ILE  20   8.103   4.528  -2.965
  156    HB   ILE  20           HB       ILE  20   5.382   4.387  -1.648
  157   HG12  ILE  20          HG12      ILE  20   6.177   4.259  -4.566
  158   HG13  ILE  20          HG11      ILE  20   5.619   2.899  -3.594
  159   HG21  ILE  20          HG21      ILE  20   6.228   6.675  -1.719
  160   HG22  ILE  20          HG22      ILE  20   4.881   6.459  -2.835
  161   HG23  ILE  20          HG23      ILE  20   6.533   6.514  -3.449
  162   HD11  ILE  20          HD11      ILE  20   4.013   5.343  -4.314
  163   HD12  ILE  20          HD12      ILE  20   3.453   4.000  -3.318
  164   HD13  ILE  20          HD13      ILE  20   3.844   3.733  -5.013
  165    H    MET  21           HN       MET  21   7.178   3.611   0.303
  166    HA   MET  21           HA       MET  21   7.814   6.121   1.498
  167    HB2  MET  21           HB2      MET  21   7.464   3.358   2.653
  168    HB3  MET  21           HB1      MET  21   7.802   4.773   3.638
  169    HG2  MET  21           HG2      MET  21   5.739   5.818   2.862
  170    HG3  MET  21           HG1      MET  21   5.403   4.407   1.859
  171    HE1  MET  21           HE1      MET  21   5.571   4.245   6.471
  172    HE2  MET  21           HE2      MET  21   5.875   5.711   5.539
  173    HE3  MET  21           HE3      MET  21   7.003   4.358   5.447
  174    H    ASN  22           HN       ASN  22   9.758   3.718   0.203
  175    HA   ASN  22           HA       ASN  22  12.005   4.091   1.987
  176    HB2  ASN  22           HB2      ASN  22  11.874   2.764  -0.736
  177    HB3  ASN  22           HB1      ASN  22  13.260   2.732   0.346
  178   HD21  ASN  22          HD21      ASN  22  11.753   0.522  -0.734
  179   HD22  ASN  22          HD22      ASN  22  11.140  -0.357   0.627
  180    H    SER  23           HN       SER  23  10.582   5.793  -0.518
  181    HA   SER  23           HA       SER  23  13.096   7.112  -1.275
  182    HB2  SER  23           HB2      SER  23  11.622   6.122  -3.076
  183    HB3  SER  23           HB1      SER  23  10.406   7.323  -2.651
  184    HG   SER  23           HG       SER  23  13.048   7.825  -3.586
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1 -11.640   4.447  -3.630
    2    H2   GLY   1           HT2      GLY   1 -10.602   4.272  -4.958
    3    H3   GLY   1           HT3      GLY   1 -10.926   5.815  -4.334
    4    HA2  GLY   1           HA1      GLY   1  -9.447   3.635  -2.973
    5    HA3  GLY   1           HA2      GLY   1  -8.751   5.112  -3.634
    6    H    ILE   2           HN       ILE   2  -7.910   5.404  -1.462
    7    HA   ILE   2           HA       ILE   2  -7.877   6.465   0.542
    8    HB   ILE   2           HB       ILE   2 -10.647   7.414  -0.228
    9   HG12  ILE   2          HG12      ILE   2  -7.962   8.798  -0.421
   10   HG13  ILE   2          HG11      ILE   2  -8.839   8.100  -1.778
   11   HG21  ILE   2          HG21      ILE   2  -8.796   8.415   1.933
   12   HG22  ILE   2          HG22      ILE   2 -10.318   7.560   2.178
   13   HG23  ILE   2          HG23      ILE   2 -10.318   9.166   1.452
   14   HD11  ILE   2          HD11      ILE   2 -10.663   9.694  -1.400
   15   HD12  ILE   2          HD12      ILE   2  -9.125  10.498  -1.713
   16   HD13  ILE   2          HD13      ILE   2  -9.750  10.403  -0.068
   17    H    GLY   3           HN       GLY   3  -8.220   5.865   2.628
   18    HA2  GLY   3           HA2      GLY   3  -9.280   4.937   4.457
   19    HA3  GLY   3           HA1      GLY   3 -10.681   4.619   3.452
   20    H    LYS   4           HN       LYS   4 -10.387   2.775   1.845
   21    HA   LYS   4           HA       LYS   4  -9.110   0.610   3.375
   22    HB2  LYS   4           HB2      LYS   4 -10.946  -0.868   2.543
   23    HB3  LYS   4           HB1      LYS   4 -11.464   0.397   3.644
   24    HG2  LYS   4           HG2      LYS   4 -12.133   1.731   1.611
   25    HG3  LYS   4           HG1      LYS   4 -11.862   0.261   0.668
   26    HD2  LYS   4           HD2      LYS   4 -13.494  -0.931   2.037
   27    HD3  LYS   4           HD1      LYS   4 -13.739   0.513   3.019
   28    HE2  LYS   4           HE2      LYS   4 -15.545   0.387   1.481
   29    HE3  LYS   4           HE1      LYS   4 -14.491   1.693   0.945
   30    HZ1  LYS   4           HZ1      LYS   4 -13.581   0.279  -0.738
   31    HZ2  LYS   4           HZ2      LYS   4 -15.272   0.232  -0.866
   32    HZ3  LYS   4           HZ3      LYS   4 -14.442  -1.064  -0.161
   33    H    PHE   5           HN       PHE   5  -9.145   2.220   0.449
   34    HA   PHE   5           HA       PHE   5  -8.223   0.126  -1.235
   35    HB2  PHE   5           HB2      PHE   5  -8.990   2.295  -2.132
   36    HB3  PHE   5           HB1      PHE   5  -7.632   3.098  -1.355
   37    HD1  PHE   5           HD1      PHE   5  -8.496   0.562  -3.915
   38    HD2  PHE   5           HD2      PHE   5  -5.575   3.288  -2.451
   39    HE1  PHE   5           HE1      PHE   5  -7.141   0.183  -5.934
   40    HE2  PHE   5           HE2      PHE   5  -4.210   2.912  -4.465
   41    HZ   PHE   5           HZ       PHE   5  -4.993   1.360  -6.211
   42    H    LEU   6           HN       LEU   6  -6.905   1.846   1.391
   43    HA   LEU   6           HA       LEU   6  -4.137   1.332   0.682
   44    HB2  LEU   6           HB2      LEU   6  -5.415   2.481   3.160
   45    HB3  LEU   6           HB1      LEU   6  -3.693   2.207   3.015
   46    HG   LEU   6           HG       LEU   6  -4.047   4.506   2.602
   47   HD11  LEU   6          HD11      LEU   6  -3.765   3.163  -0.077
   48   HD12  LEU   6          HD12      LEU   6  -2.467   3.410   1.091
   49   HD13  LEU   6          HD13      LEU   6  -3.249   4.800   0.337
   50   HD21  LEU   6          HD21      LEU   6  -6.163   3.725   0.601
   51   HD22  LEU   6          HD22      LEU   6  -5.597   5.366   0.918
   52   HD23  LEU   6          HD23      LEU   6  -6.439   4.465   2.178
   53    H    HIS   7           HN       HIS   7  -6.688  -0.305   2.206
   54    HA   HIS   7           HA       HIS   7  -5.046  -2.038   3.804
   55    HB2  HIS   7           HB2      HIS   7  -7.429  -1.624   4.367
   56    HB3  HIS   7           HB1      HIS   7  -7.905  -2.438   2.881
   57    HD1  HIS   7           HD1      HIS   7  -8.866  -4.621   3.533
   58    HD2  HIS   7           HD2      HIS   7  -5.454  -3.701   5.736
   59    HE1  HIS   7           HE1      HIS   7  -8.433  -6.626   4.995
   60    HE2  HIS   7           HE2      HIS   7  -6.242  -6.130   6.135
   61    H    SER   8           HN       SER   8  -6.421  -2.034   0.577
   62    HA   SER   8           HA       SER   8  -5.381  -4.660   0.002
   63    HB2  SER   8           HB2      SER   8  -6.089  -3.914  -2.394
   64    HB3  SER   8           HB1      SER   8  -7.334  -4.278  -1.198
   65    HG   SER   8           HG       SER   8  -7.469  -2.211  -2.472
   66    H    ALA   9           HN       ALA   9  -4.483  -1.315  -0.523
   67    HA   ALA   9           HA       ALA   9  -2.182  -1.779  -2.079
   68    HB1  ALA   9           HB1      ALA   9  -3.072   0.464  -1.719
   69    HB2  ALA   9           HB2      ALA   9  -1.384   0.373  -1.217
   70    HB3  ALA   9           HB3      ALA   9  -2.666   0.362  -0.006
   71    H    LYS  10           HN       LYS  10  -2.982  -2.545   1.140
   72    HA   LYS  10           HA       LYS  10  -0.197  -3.362   1.632
   73    HB2  LYS  10           HB2      LYS  10  -2.389  -2.559   3.513
   74    HB3  LYS  10           HB1      LYS  10  -1.104  -3.628   4.062
   75    HG2  LYS  10           HG2      LYS  10   0.542  -1.905   3.312
   76    HG3  LYS  10           HG1      LYS  10  -0.821  -0.827   3.001
   77    HD2  LYS  10           HD2      LYS  10  -1.433  -0.803   5.296
   78    HD3  LYS  10           HD1      LYS  10  -0.331  -2.130   5.669
   79    HE2  LYS  10           HE2      LYS  10   0.608  -0.029   6.426
   80    HE3  LYS  10           HE1      LYS  10   1.572  -0.689   5.106
   81    HZ1  LYS  10           HZ1      LYS  10   1.302   1.617   4.724
   82    HZ2  LYS  10           HZ2      LYS  10  -0.370   1.546   4.979
   83    HZ3  LYS  10           HZ3      LYS  10   0.303   0.825   3.607
   84    H    LYS  11           HN       LYS  11  -2.644  -4.642   0.194
   85    HA   LYS  11           HA       LYS  11  -2.596  -7.188   1.656
   86    HB2  LYS  11           HB2      LYS  11  -4.819  -6.296   0.977
   87    HB3  LYS  11           HB1      LYS  11  -4.314  -6.399  -0.706
   88    HG2  LYS  11           HG2      LYS  11  -4.010  -8.839  -0.417
   89    HG3  LYS  11           HG1      LYS  11  -4.653  -8.691   1.220
   90    HD2  LYS  11           HD2      LYS  11  -6.424  -9.411  -0.221
   91    HD3  LYS  11           HD1      LYS  11  -6.738  -7.733   0.225
   92    HE2  LYS  11           HE2      LYS  11  -5.816  -6.994  -1.916
   93    HE3  LYS  11           HE1      LYS  11  -5.477  -8.669  -2.351
   94    HZ1  LYS  11           HZ1      LYS  11  -7.838  -9.140  -2.265
   95    HZ2  LYS  11           HZ2      LYS  11  -7.519  -7.892  -3.370
   96    HZ3  LYS  11           HZ3      LYS  11  -8.172  -7.527  -1.847
   97    H    PHE  12           HN       PHE  12  -2.167  -5.886  -1.616
   98    HA   PHE  12           HA       PHE  12  -0.453  -8.208  -2.209
   99    HB2  PHE  12           HB2      PHE  12  -1.246  -8.097  -4.550
  100    HB3  PHE  12           HB1      PHE  12  -2.552  -8.443  -3.423
  101    HD1  PHE  12           HD2      PHE  12  -4.297  -6.806  -3.000
  102    HD2  PHE  12           HD1      PHE  12  -1.157  -6.007  -5.760
  103    HE1  PHE  12           HE2      PHE  12  -5.590  -4.926  -3.920
  104    HE2  PHE  12           HE1      PHE  12  -2.447  -4.124  -6.684
  105    HZ   PHE  12           HZ       PHE  12  -4.664  -3.584  -5.765
  106    H    GLY  13           HN       GLY  13  -0.530  -4.954  -1.787
  107    HA2  GLY  13           HA2      GLY  13   1.822  -4.595  -3.528
  108    HA3  GLY  13           HA1      GLY  13   0.616  -3.333  -3.313
  109    H    LYS  14           HN       LYS  14   1.204  -5.165  -0.516
  110    HA   LYS  14           HA       LYS  14   2.063  -2.889   0.919
  111    HB2  LYS  14           HB2      LYS  14   2.255  -4.329   2.834
  112    HB3  LYS  14           HB1      LYS  14   0.826  -4.799   1.930
  113    HG2  LYS  14           HG2      LYS  14   2.183  -6.638   0.909
  114    HG3  LYS  14           HG1      LYS  14   3.470  -6.223   2.043
  115    HD2  LYS  14           HD2      LYS  14   0.682  -7.170   2.712
  116    HD3  LYS  14           HD1      LYS  14   2.189  -8.055   2.947
  117    HE2  LYS  14           HE2      LYS  14   1.432  -5.483   4.331
  118    HE3  LYS  14           HE1      LYS  14   1.316  -7.092   5.040
  119    HZ1  LYS  14           HZ1      LYS  14   3.312  -5.999   5.766
  120    HZ2  LYS  14           HZ2      LYS  14   3.814  -5.732   4.165
  121    HZ3  LYS  14           HZ3      LYS  14   3.727  -7.311   4.778
  122    H    ALA  15           HN       ALA  15   3.741  -5.495  -0.667
  123    HA   ALA  15           HA       ALA  15   6.316  -4.932   0.444
  124    HB1  ALA  15           HB1      ALA  15   5.573  -6.391  -2.094
  125    HB2  ALA  15           HB2      ALA  15   5.813  -7.117  -0.504
  126    HB3  ALA  15           HB3      ALA  15   7.171  -6.375  -1.348
  127    H    PHE  16           HN       PHE  16   4.397  -3.517  -2.023
  128    HA   PHE  16           HA       PHE  16   6.669  -2.249  -3.331
  129    HB2  PHE  16           HB2      PHE  16   3.698  -2.082  -3.892
  130    HB3  PHE  16           HB1      PHE  16   4.934  -1.235  -4.818
  131    HD1  PHE  16           HD2      PHE  16   6.561  -2.515  -6.162
  132    HD2  PHE  16           HD1      PHE  16   3.258  -4.380  -4.240
  133    HE1  PHE  16           HE2      PHE  16   6.841  -4.487  -7.604
  134    HE2  PHE  16           HE1      PHE  16   3.532  -6.355  -5.675
  135    HZ   PHE  16           HZ       PHE  16   5.326  -6.411  -7.360
  136    H    VAL  17           HN       VAL  17   3.834  -1.336  -1.398
  137    HA   VAL  17           HA       VAL  17   4.425   1.453  -1.493
  138    HB   VAL  17           HB       VAL  17   2.727   1.733   0.239
  139   HG11  VAL  17          HG11      VAL  17   1.896  -0.258  -1.871
  140   HG12  VAL  17          HG12      VAL  17   1.993   1.493  -2.070
  141   HG13  VAL  17          HG13      VAL  17   0.814   0.796  -0.960
  142   HG21  VAL  17          HG21      VAL  17   1.522  -0.203   1.156
  143   HG22  VAL  17          HG22      VAL  17   3.219  -0.196   1.633
  144   HG23  VAL  17          HG23      VAL  17   2.665  -1.284   0.360
  145    H    GLY  18           HN       GLY  18   5.496  -1.186   0.425
  146    HA2  GLY  18           HA2      GLY  18   6.441   0.336   2.648
  147    HA3  GLY  18           HA1      GLY  18   6.872  -1.321   2.252
  148    H    GLU  19           HN       GLU  19   7.492   0.168  -0.509
  149    HA   GLU  19           HA       GLU  19  10.193   1.020   0.291
  150    HB2  GLU  19           HB2      GLU  19   9.421  -0.459  -2.230
  151    HB3  GLU  19           HB1      GLU  19  11.041   0.077  -1.801
  152    HG2  GLU  19           HG2      GLU  19  10.931  -1.397   0.197
  153    HG3  GLU  19           HG1      GLU  19   9.387  -2.007  -0.394
  154    H    ILE  20           HN       ILE  20   7.995   1.138  -2.512
  155    HA   ILE  20           HA       ILE  20   9.109   3.436  -3.674
  156    HB   ILE  20           HB       ILE  20   6.270   2.428  -3.956
  157   HG12  ILE  20          HG12      ILE  20   8.701   1.750  -5.630
  158   HG13  ILE  20          HG11      ILE  20   8.022   0.695  -4.395
  159   HG21  ILE  20          HG21      ILE  20   6.564   4.674  -4.837
  160   HG22  ILE  20          HG22      ILE  20   6.351   3.518  -6.152
  161   HG23  ILE  20          HG23      ILE  20   7.958   4.138  -5.777
  162   HD11  ILE  20          HD11      ILE  20   7.318   0.023  -6.609
  163   HD12  ILE  20          HD12      ILE  20   6.630   1.621  -6.894
  164   HD13  ILE  20          HD13      ILE  20   5.936   0.572  -5.657
  165    H    MET  21           HN       MET  21   6.330   3.048  -1.501
  166    HA   MET  21           HA       MET  21   6.104   5.976  -1.330
  167    HB2  MET  21           HB2      MET  21   4.135   3.776  -0.705
  168    HB3  MET  21           HB1      MET  21   3.862   5.458  -0.270
  169    HG2  MET  21           HG2      MET  21   4.272   4.421  -3.066
  170    HG3  MET  21           HG1      MET  21   2.718   4.821  -2.336
  171    HE1  MET  21           HE1      MET  21   3.291   7.706  -4.952
  172    HE2  MET  21           HE2      MET  21   2.209   6.413  -4.433
  173    HE3  MET  21           HE3      MET  21   3.786   6.022  -5.118
  174    H    ASN  22           HN       ASN  22   8.215   4.863   0.024
  175    HA   ASN  22           HA       ASN  22   7.503   5.449   2.776
  176    HB2  ASN  22           HB2      ASN  22   7.150   3.007   2.605
  177    HB3  ASN  22           HB1      ASN  22   8.801   2.820   2.024
  178   HD21  ASN  22          HD21      ASN  22   9.373   1.493   3.711
  179   HD22  ASN  22          HD22      ASN  22   9.611   2.082   5.324
  180    H    SER  23           HN       SER  23  10.116   4.238   0.677
  181    HA   SER  23           HA       SER  23  12.021   5.839   2.210
  182    HB2  SER  23           HB2      SER  23  12.523   3.774   0.047
  183    HB3  SER  23           HB1      SER  23  13.741   4.522   1.082
  184    HG   SER  23           HG       SER  23  12.255   3.611   2.847