*HEADER    CELL CYCLE                              12-FEB-18   6CEJ              
*TITLE     SOLUTION STRUCTURE OF A 14MER FRAGMENT OF THE P21 PROTEIN             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYCLIN-DEPENDENT KINASE INHIBITOR 1;                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 139-152;                                      
*COMPND   5 SYNONYM: CDK-INTERACTING PROTEIN 1, MELANOMA DIFFERENTIATION-        
*COMPND   6 ASSOCIATED PROTEIN 6, MDA-6, P21;                                    
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606                                                 
*KEYWDS    PIP-BOX MOTIF, P21, PCNA, CELL CYCLE                                  
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.L.WEGENER                                                           
*REVDAT   1   04-JUL-18 6CEJ    0                                                
# Restraints file 1: p21-14mer_unambig.tbl


assign (segid "   A" and resid  152 and name   HA) (segid "   A" and resid  152 and name   HN) 3.706 1.716 1.716 weight 1.000 ! spec=Expt_33, no=2, id=0, vol=4.224001e-03
assign (segid "   A" and resid  152 and name  HB1) (segid "   A" and resid  152 and name   HN) 3.799 1.804 1.804 weight 1.000 ! spec=Expt_33, no=3, id=1, vol=2.793601e-03
assign (segid "   A" and resid  150 and name  HB1) (segid "   A" and resid  150 and name   HN) 3.181 1.265 1.265 weight 1.000 ! spec=Expt_33, no=4, id=2, vol=9.063032e-03
assign (segid "   A" and resid  150 and name  HB2) (segid "   A" and resid  150 and name   HN) 2.906 1.056 1.056 weight 1.000 ! spec=Expt_33, no=5, id=3, vol=1.600101e-02
assign (segid "   A" and resid  151 and name  HB1) (segid "   A" and resid  151 and name   HN) 3.413 1.456 1.456 weight 1.000 ! spec=Expt_33, no=6, id=4, vol=5.968912e-03
assign (segid "   A" and resid  151 and name  HB2) (segid "   A" and resid  151 and name   HN) 2.997 1.123 1.123 weight 1.000 ! spec=Expt_33, no=7, id=5, vol=1.340770e-02
assign (segid "   A" and resid  149 and name  HB2) (segid "   A" and resid  149 and name   HN) 3.290 1.353 1.353 weight 1.000 ! spec=Expt_33, no=8, id=6, vol=6.832777e-03
assign (segid "   A" and resid  149 and name  HB1) (segid "   A" and resid  149 and name   HN) 3.086 1.191 1.191 weight 1.000 ! spec=Expt_33, no=9, id=7, vol=9.866051e-03
assign (segid "   A" and resid  149 and name   HA) (segid "   A" and resid  149 and name   HN) 3.842 1.845 1.845 weight 1.000 ! spec=Expt_33, no=10, id=8, vol=5.335678e-03
assign (segid "   A" and resid  150 and name   HA) (segid "   A" and resid  150 and name   HN) 3.115 1.213 1.213 weight 1.000 ! spec=Expt_33, no=11, id=9, vol=1.244569e-02
assign (segid "   A" and resid  148 and name HG21) (segid "   A" and resid  148 and name   HN) 3.299 1.360 1.360 weight 1.000 ! spec=Expt_33, no=14, id=11, vol=7.652871e-03
    or (segid "   A" and resid  148 and name HG22) (segid "   A" and resid  148 and name   HN)
    or (segid "   A" and resid  148 and name HG23) (segid "   A" and resid  148 and name   HN)
assign (segid "   A" and resid  148 and name   HB) (segid "   A" and resid  148 and name   HN) 3.106 1.206 1.206 weight 1.000 ! spec=Expt_33, no=16, id=13, vol=1.083534e-02
assign (segid "   A" and resid  148 and name   HA) (segid "   A" and resid  148 and name   HN) 2.929 1.072 1.072 weight 1.000 ! spec=Expt_33, no=17, id=14, vol=1.503361e-02
assign (segid "   A" and resid  145 and name   HB) (segid "   A" and resid  145 and name   HN) 3.066 1.175 1.175 weight 1.000 ! spec=Expt_33, no=19, id=16, vol=1.108716e-02
assign (segid "   A" and resid  145 and name   HA) (segid "   A" and resid  145 and name   HN) 3.060 1.171 1.171 weight 1.000 ! spec=Expt_33, no=20, id=17, vol=1.757277e-02
assign (segid "   A" and resid  146 and name   HA) (segid "   A" and resid  146 and name   HN) 3.636 1.652 1.652 weight 1.000 ! spec=Expt_33, no=21, id=18, vol=6.979654e-03
assign (segid "   A" and resid  146 and name  HB2) (segid "   A" and resid  146 and name   HN) 3.212 1.290 1.290 weight 1.000 ! spec=Expt_33, no=22, id=19, vol=9.223948e-03
assign (segid "   A" and resid  146 and name  HB1) (segid "   A" and resid  146 and name   HN) 3.152 1.242 1.242 weight 1.000 ! spec=Expt_33, no=23, id=20, vol=1.011275e-02
assign (segid "   A" and resid  147 and name   HA) (segid "   A" and resid  147 and name   HN) 2.462 0.758 0.758 weight 1.000 ! spec=Expt_33, no=24, id=21, vol=4.151095e-02
assign (segid "   A" and resid  144 and name   HA) (segid "   A" and resid  144 and name   HN) 3.137 1.230 1.230 weight 1.000 ! spec=Expt_33, no=29, id=26, vol=1.046360e-02
assign (segid "   A" and resid  144 and name  HB1) (segid "   A" and resid  144 and name   HN) 2.922 1.067 1.067 weight 1.000 ! spec=Expt_33, no=30, id=27, vol=1.533282e-02
assign (segid "   A" and resid  147 and name  HG1) (segid "   A" and resid  147 and name   HN) 3.880 1.882 1.882 weight 1.000 ! spec=Expt_33, no=31, id=28, vol=2.698452e-03
assign (segid "   A" and resid  144 and name HE21) (segid "   A" and resid  144 and name HE22) 1.516 0.287 0.287 weight 1.000 ! spec=Expt_33, no=32, id=29, vol=6.026743e-01
assign (segid "   A" and resid  150 and name  HD1) (segid "   A" and resid  150 and name  HE1) 1.917 0.460 0.460 weight 1.000 ! spec=Expt_33, no=34, id=31, vol=1.351878e-01
    or (segid "   A" and resid  150 and name  HD1) (segid "   A" and resid  150 and name  HE2)
    or (segid "   A" and resid  150 and name  HD2) (segid "   A" and resid  150 and name  HE1)
    or (segid "   A" and resid  150 and name  HD2) (segid "   A" and resid  150 and name  HE2)
assign (segid "   A" and resid  147 and name  HB2) (segid "   A" and resid  147 and name   HN) 3.593 1.614 1.614 weight 1.000 ! spec=Expt_33, no=36, id=32, vol=4.472776e-03
assign (segid "   A" and resid  147 and name  HB1) (segid "   A" and resid  147 and name   HN) 2.869 1.029 1.029 weight 1.000 ! spec=Expt_33, no=37, id=33, vol=1.703177e-02
assign (segid "   A" and resid  144 and name  HB2) (segid "   A" and resid  144 and name   HN) 3.215 1.292 1.292 weight 1.000 ! spec=Expt_33, no=46, id=42, vol=8.560977e-03
assign (segid "   A" and resid  151 and name  HD1) (segid "   A" and resid  151 and name   HN) 3.667 1.681 1.681 weight 1.000 ! spec=Expt_33, no=59, id=54, vol=4.216714e-03
    or (segid "   A" and resid  151 and name  HD2) (segid "   A" and resid  151 and name   HN)
assign (segid "   A" and resid  151 and name  HD1) (segid "   A" and resid  151 and name  HE1) 1.835 0.421 0.421 weight 1.000 ! spec=Expt_33, no=64, id=59, vol=1.566125e-01
    or (segid "   A" and resid  151 and name  HD1) (segid "   A" and resid  151 and name  HE2)
    or (segid "   A" and resid  151 and name  HD2) (segid "   A" and resid  151 and name  HE1)
    or (segid "   A" and resid  151 and name  HD2) (segid "   A" and resid  151 and name  HE2)
assign (segid "   A" and resid  150 and name   HA) (segid "   A" and resid  150 and name  HD1) 3.334 1.389 1.389 weight 1.000 ! spec=Expt_33, no=65, id=60, vol=7.389379e-03
    or (segid "   A" and resid  150 and name   HA) (segid "   A" and resid  150 and name  HD2)
assign (segid "   A" and resid  150 and name  HB1) (segid "   A" and resid  150 and name  HD1) 3.432 1.472 1.472 weight 1.000 ! spec=Expt_33, no=66, id=61, vol=4.691794e-03
    or (segid "   A" and resid  150 and name  HB1) (segid "   A" and resid  150 and name  HD2)
assign (segid "   A" and resid  150 and name  HB2) (segid "   A" and resid  150 and name  HD1) 3.365 1.415 1.415 weight 1.000 ! spec=Expt_33, no=67, id=62, vol=8.841049e-03
    or (segid "   A" and resid  150 and name  HB2) (segid "   A" and resid  150 and name  HD2)
assign (segid "   A" and resid  151 and name  HB1) (segid "   A" and resid  151 and name  HD1) 3.200 1.280 1.280 weight 1.000 ! spec=Expt_33, no=68, id=63, vol=9.537158e-03
    or (segid "   A" and resid  151 and name  HB1) (segid "   A" and resid  151 and name  HD2)
assign (segid "   A" and resid  151 and name  HB2) (segid "   A" and resid  151 and name  HD1) 3.229 1.304 1.304 weight 1.000 ! spec=Expt_33, no=69, id=64, vol=9.993601e-03
    or (segid "   A" and resid  151 and name  HB2) (segid "   A" and resid  151 and name  HD2)
assign (segid "   A" and resid  148 and name HG21) (segid "   A" and resid  148 and name   HB) 2.657 0.882 0.882 weight 1.000 ! spec=Expt_33, no=72, id=67, vol=2.299763e-02
    or (segid "   A" and resid  148 and name HG22) (segid "   A" and resid  148 and name   HB)
    or (segid "   A" and resid  148 and name HG23) (segid "   A" and resid  148 and name   HB)
assign (segid "   A" and resid  145 and name HG21) (segid "   A" and resid  145 and name   HB) 2.448 0.749 0.749 weight 1.000 ! spec=Expt_33, no=73, id=68, vol=3.638450e-02
    or (segid "   A" and resid  145 and name HG22) (segid "   A" and resid  145 and name   HB)
    or (segid "   A" and resid  145 and name HG23) (segid "   A" and resid  145 and name   HB)
assign (segid "   A" and resid  143 and name   HA) (segid "   A" and resid  143 and name  HB1) 2.939 1.080 1.080 weight 1.000 ! spec=Expt_33, no=74, id=69, vol=1.609736e-02
assign (segid "   A" and resid  143 and name   HA) (segid "   A" and resid  143 and name  HB2) 2.711 0.919 0.919 weight 1.000 ! spec=Expt_33, no=76, id=71, vol=2.451894e-02
assign (segid "   A" and resid  144 and name   HA) (segid "   A" and resid  144 and name  HB1) 3.756 1.764 1.764 weight 1.000 ! spec=Expt_33, no=77, id=72, vol=3.219028e-03
assign (segid "   A" and resid  147 and name   HA) (segid "   A" and resid  147 and name  HB1) 3.710 1.721 1.721 weight 1.000 ! spec=Expt_33, no=78, id=73, vol=3.397255e-03
assign (segid "   A" and resid  147 and name   HA) (segid "   A" and resid  147 and name  HB2) 3.512 1.542 1.542 weight 1.000 ! spec=Expt_33, no=79, id=74, vol=5.061228e-03
assign (segid "   A" and resid  144 and name   HA) (segid "   A" and resid  144 and name  HB2) 3.367 1.417 1.417 weight 1.000 ! spec=Expt_33, no=80, id=75, vol=5.872729e-03
assign (segid "   A" and resid  151 and name   HA) (segid "   A" and resid  151 and name  HB2) 3.853 1.855 1.855 weight 1.000 ! spec=Expt_33, no=81, id=76, vol=4.208786e-05
assign (segid "   A" and resid  149 and name   HA) (segid "   A" and resid  149 and name  HB2) 3.518 1.547 1.547 weight 1.000 ! spec=Expt_33, no=82, id=77, vol=3.465980e-03
assign (segid "   A" and resid  148 and name   HA) (segid "   A" and resid  148 and name HG21) 2.824 0.997 0.997 weight 1.000 ! spec=Expt_33, no=83, id=78, vol=1.766636e-02
    or (segid "   A" and resid  148 and name   HA) (segid "   A" and resid  148 and name HG22)
    or (segid "   A" and resid  148 and name   HA) (segid "   A" and resid  148 and name HG23)
assign (segid "   A" and resid  145 and name   HA) (segid "   A" and resid  145 and name HG21) 2.770 0.959 0.959 weight 1.000 ! spec=Expt_33, no=84, id=79, vol=1.877853e-02
    or (segid "   A" and resid  145 and name   HA) (segid "   A" and resid  145 and name HG22)
    or (segid "   A" and resid  145 and name   HA) (segid "   A" and resid  145 and name HG23)
assign (segid "   A" and resid  151 and name   HA) (segid "   A" and resid  151 and name  HB1) 3.678 1.691 1.691 weight 1.000 ! spec=Expt_33, no=88, id=83, vol=3.664945e-03
assign (segid "   A" and resid  143 and name  HB1) (segid "   A" and resid  143 and name   HN) 3.108 1.207 1.207 weight 1.000 ! spec=Expt_33, no=107, id=102, vol=1.095995e-02
assign (segid "   A" and resid  143 and name  HB2) (segid "   A" and resid  143 and name   HN) 3.284 1.348 1.348 weight 1.000 ! spec=Expt_33, no=108, id=103, vol=7.897934e-03
assign (segid "   A" and resid  141 and name   HA) (segid "   A" and resid  141 and name   HN) 2.709 0.917 0.917 weight 1.000 ! spec=Expt_33, no=113, id=108, vol=2.148811e-02

sequential
assign (segid "   A" and resid  143 and name   HA) (segid "   A" and resid  144 and name   HN) 2.300 0.661 0.661 weight 1.000 ! spec=Expt_33, no=38, id=34, vol=6.316051e-02
assign (segid "   A" and resid  145 and name   HA) (segid "   A" and resid  146 and name   HN) 2.441 0.745 0.745 weight 1.000 ! spec=Expt_33, no=39, id=35, vol=4.482389e-02
assign (segid "   A" and resid  145 and name   HB) (segid "   A" and resid  146 and name   HN) 3.102 1.203 1.203 weight 1.000 ! spec=Expt_33, no=40, id=36, vol=1.073677e-02
assign (segid "   A" and resid  144 and name   HA) (segid "   A" and resid  145 and name   HN) 2.413 0.728 0.728 weight 1.000 ! spec=Expt_33, no=41, id=37, vol=4.637956e-02
assign (segid "   A" and resid  148 and name   HA) (segid "   A" and resid  149 and name   HN) 2.649 0.877 0.877 weight 1.000 ! spec=Expt_33, no=42, id=38, vol=2.482476e-02
assign (segid "   A" and resid  148 and name   HB) (segid "   A" and resid  149 and name   HN) 4.088 2.089 2.089 weight 1.000 ! spec=Expt_33, no=43, id=39, vol=3.674723e-03
assign (segid "   A" and resid  149 and name   HA) (segid "   A" and resid  150 and name   HN) 2.710 0.918 0.918 weight 1.000 ! spec=Expt_33, no=44, id=40, vol=2.317280e-02
assign (segid "   A" and resid  151 and name   HA) (segid "   A" and resid  152 and name   HN) 3.028 1.146 1.146 weight 1.000 ! spec=Expt_33, no=45, id=41, vol=1.115177e-02

assign (segid "   A" and resid  146 and name  HB2) (segid "   A" and resid  147 and name   HN) 3.475 1.510 1.510 weight 1.000 ! spec=Expt_33, no=47, id=43, vol=5.007914e-03
assign (segid "   A" and resid  146 and name  HB1) (segid "   A" and resid  147 and name   HN) 3.745 1.753 1.753 weight 1.000 ! spec=Expt_33, no=48, id=44, vol=3.573892e-03
assign (segid "   A" and resid  150 and name  HB1) (segid "   A" and resid  151 and name   HN) 3.783 1.789 1.789 weight 1.000 ! spec=Expt_33, no=50, id=45, vol=3.048007e-03
assign (segid "   A" and resid  149 and name  HB2) (segid "   A" and resid  150 and name   HN) 3.759 1.767 1.767 weight 1.000 ! spec=Expt_33, no=51, id=46, vol=3.719627e-03
assign (segid "   A" and resid  149 and name  HB1) (segid "   A" and resid  150 and name   HN) 3.589 1.610 1.610 weight 1.000 ! spec=Expt_33, no=52, id=47, vol=4.517741e-03
assign (segid "   A" and resid  147 and name  HB2) (segid "   A" and resid  148 and name   HN) 3.722 1.732 1.732 weight 1.000 ! spec=Expt_33, no=53, id=48, vol=3.147718e-03
assign (segid "   A" and resid  147 and name  HB1) (segid "   A" and resid  148 and name   HN) 3.773 1.780 1.780 weight 1.000 ! spec=Expt_33, no=54, id=49, vol=3.301975e-03
assign (segid "   A" and resid  148 and name HG21) (segid "   A" and resid  149 and name   HN) 5.353 3.582 3.582 weight 1.000 ! spec=Expt_33, no=55, id=50, vol=1.182262e-03
    or (segid "   A" and resid  148 and name HG22) (segid "   A" and resid  149 and name   HN)
    or (segid "   A" and resid  148 and name HG23) (segid "   A" and resid  149 and name   HN)

assign (segid "   A" and resid  144 and name  HB2) (segid "   A" and resid  145 and name   HN) 3.538 1.564 1.564 weight 1.000 ! spec=Expt_33, no=58, id=53, vol=4.666699e-03
assign (segid "   A" and resid  152 and name   HN) (segid "   A" and resid  151 and name   HN) 3.223 1.299 1.299 weight 1.000 ! spec=Expt_33, no=60, id=55, vol=6.807033e-03
assign (segid "   A" and resid  148 and name   HN) (segid "   A" and resid  147 and name   HN) 3.016 1.137 1.137 weight 1.000 ! spec=Expt_33, no=61, id=56, vol=1.112291e-02

assign (segid "   A" and resid  151 and name  HB2) (segid "   A" and resid  152 and name   HN) 4.368 2.385 2.385 weight 1.000 ! spec=Expt_33, no=86, id=81, vol=1.189806e-03
assign (segid "   A" and resid  147 and name   HA) (segid "   A" and resid  148 and name   HN) 2.493 0.777 0.777 weight 1.000 ! spec=Expt_33, no=87, id=82, vol=4.328755e-02
assign (segid "   A" and resid  151 and name   HN) (segid "   A" and resid  150 and name  HB2) 3.282 1.346 1.346 weight 1.000 ! spec=Expt_33, no=102, id=97, vol=6.250109e-03

assign (segid "   A" and resid  140 and name   HA) (segid "   A" and resid  141 and name   HN) 2.791 0.974 0.974 weight 1.000 ! spec=Expt_33, no=110, id=105, vol=1.979773e-02
assign (segid "   A" and resid  146 and name  HB2) (segid "   A" and resid  149 and name   HN) 4.282 2.292 2.292 weight 1.000 ! spec=Expt_33, no=114, id=109, vol=1.452355e-03
assign (segid "   A" and resid  146 and name  HB1) (segid "   A" and resid  149 and name   HN) 4.224 2.230 2.230 weight 1.000 ! spec=Expt_33, no=115, id=110, vol=1.636010e-03
assign (segid "   A" and resid  150 and name   HA) (segid "   A" and resid  150 and name  HB1) 3.562 1.586 1.586 weight 1.000 ! spec=Expt_33, no=120, id=111, vol=5.244144e-03
assign (segid "   A" and resid  144 and name  HB1) (segid "   A" and resid  145 and name   HN) 3.895 1.897 1.897 weight 1.000 ! spec=Expt_33, no=123, id=113, vol=2.643631e-03
assign (segid "   A" and resid  143 and name  HB2) (segid "   A" and resid  144 and name   HN) 3.417 1.460 1.460 weight 1.000 ! spec=Expt_33, no=124, id=114, vol=5.974452e-03
assign (segid "   A" and resid  141 and name  HB1) (segid "   A" and resid  141 and name   HN) 3.242 1.314 1.314 weight 1.000 ! spec=Expt_33, no=125, id=115, vol=7.561243e-03
assign (segid "   A" and resid  143 and name  HB1) (segid "   A" and resid  144 and name   HN) 3.583 1.605 1.605 weight 1.000 ! spec=Expt_33, no=126, id=116, vol=4.587026e-03
assign (segid "   A" and resid  141 and name  HB2) (segid "   A" and resid  141 and name   HN) 3.578 1.600 1.600 weight 1.000 ! spec=Expt_33, no=127, id=117, vol=4.982143e-03
assign (segid "   A" and resid  145 and name HG21) (segid "   A" and resid  146 and name   HN) 3.706 1.717 1.717 weight 1.000 ! spec=Expt_33, no=128, id=118, vol=3.236208e-03
    or (segid "   A" and resid  145 and name HG22) (segid "   A" and resid  146 and name   HN)
    or (segid "   A" and resid  145 and name HG23) (segid "   A" and resid  146 and name   HN)
assign (segid "   A" and resid  145 and name HG21) (segid "   A" and resid  145 and name   HN) 3.333 1.389 1.389 weight 1.000 ! spec=Expt_33, no=129, id=119, vol=6.455404e-03
    or (segid "   A" and resid  145 and name HG22) (segid "   A" and resid  145 and name   HN)
    or (segid "   A" and resid  145 and name HG23) (segid "   A" and resid  145 and name   HN)

assign (segid "   A" and resid  146 and name  HB1) (segid "   A" and resid  148 and name   HN) 4.140 2.142 2.142 weight 1.000 ! spec=Expt_33, no=56, id=51, vol=2.038311e-03
assign (segid "   A" and resid  146 and name  HB2) (segid "   A" and resid  148 and name   HN) 4.312 2.324 2.324 weight 1.000 ! spec=Expt_33, no=57, id=52, vol=1.615631e-03

# Restraints file 2: p21-14mer_ambig.tbl
assign (segid "   A" and resid  151 and name   HA) (segid "   A" and resid  151 and name   HN) 2.516 0.792 0.792 weight 1.000 ! spec=Expt_33, no=12, id=10, vol=3.097919e-02
    or (segid "   A" and resid  150 and name   HA) (segid "   A" and resid  151 and name   HN)
assign (segid "   A" and resid  142 and name   HA) (segid "   A" and resid  143 and name   HN) 2.133 0.569 0.569 weight 1.000 ! spec=Expt_33, no=25, id=22, vol=9.848044e-02
    or (segid "   A" and resid  143 and name   HA) (segid "   A" and resid  143 and name   HN)
assign (segid "   A" and resid  143 and name  HB2) (segid "   A" and resid  143 and name   HN) 2.787 0.971 0.971 weight 1.000 ! spec=Expt_33, no=26, id=23, vol=2.058375e-02
    or (segid "   A" and resid  142 and name  HB2) (segid "   A" and resid  142 and name   HN)
assign (segid "   A" and resid  142 and name  HB1) (segid "   A" and resid  142 and name   HN) 2.709 0.917 0.917 weight 1.000 ! spec=Expt_33, no=27, id=24, vol=2.432543e-02
    or (segid "   A" and resid  143 and name  HB1) (segid "   A" and resid  143 and name   HN)
assign (segid "   A" and resid  143 and name  HG2) (segid "   A" and resid  143 and name   HN) 3.340 1.395 1.395 weight 1.000 ! spec=Expt_33, no=28, id=25, vol=7.716443e-03
    or (segid "   A" and resid  143 and name  HG1) (segid "   A" and resid  143 and name   HN)
    or (segid "   A" and resid  142 and name  HG2) (segid "   A" and resid  142 and name   HN)
    or (segid "   A" and resid  142 and name  HG1) (segid "   A" and resid  143 and name   HN)
    or (segid "   A" and resid  142 and name  HG1) (segid "   A" and resid  142 and name   HN)
assign (segid "   A" and resid  143 and name   HA) (segid "   A" and resid  143 and name  HG1) 3.225 1.300 1.300 weight 1.000 ! spec=Expt_33, no=85, id=80, vol=9.217933e-03
    or (segid "   A" and resid  143 and name   HA) (segid "   A" and resid  143 and name  HG2)
assign (segid "   A" and resid  144 and name  HG2) (segid "   A" and resid  144 and name  HB1) 2.604 0.847 0.847 weight 1.000 ! spec=Expt_33, no=89, id=84, vol=2.708579e-02
    or (segid "   A" and resid  144 and name  HG1) (segid "   A" and resid  144 and name  HB1)
assign (segid "   A" and resid  144 and name  HG1) (segid "   A" and resid  144 and name  HB2) 2.487 0.773 0.773 weight 1.000 ! spec=Expt_33, no=90, id=85, vol=4.411641e-02
    or (segid "   A" and resid  144 and name  HG2) (segid "   A" and resid  144 and name  HB2)
assign (segid "   A" and resid  144 and name  HG1) (segid "   A" and resid  144 and name   HN) 3.671 1.684 1.684 weight 1.000 ! spec=Expt_33, no=122, id=112, vol=3.735956e-03
    or (segid "   A" and resid  144 and name  HG2) (segid "   A" and resid  144 and name   HN)
assign (segid "   A" and resid  143 and name  HG2) (segid "   A" and resid  144 and name   HN) 3.911 1.912 1.912 weight 1.000 ! spec=Expt_33, no=130, id=120, vol=2.537530e-03
    or (segid "   A" and resid  143 and name  HG1) (segid "   A" and resid  144 and name   HN)
# Restraints file 3: p21-14mer_scalar_restraints.tbl
assign (resid 141 and name C ) (resid 142 and name N ) 
    (resid 142 and name CA) (resid 142 and name C )  6.498   2
    
assign (resid 142 and name C ) (resid 143 and name N ) 
    (resid 143 and name CA) (resid 143 and name C )  6.618   2
    
assign (resid 143 and name C ) (resid 144 and name N ) 
    (resid 144 and name CA) (resid 144 and name C )  7.080   2
    
assign (resid 144 and name C ) (resid 145 and name N ) 
    (resid 145 and name CA) (resid 145 and name C )  7.650   2
    
assign (resid 145 and name C ) (resid 146 and name N ) 
    (resid 146 and name CA) (resid 146 and name C )  7.032   2
    
assign (resid 147 and name C ) (resid 148 and name N ) 
    (resid 148 and name CA) (resid 148 and name C )  7.482   2
    
assign (resid 148 and name C ) (resid 149 and name N ) 
    (resid 149 and name CA) (resid 149 and name C )  7.176   2
    
assign (resid 149 and name C ) (resid 150 and name N ) 
    (resid 150 and name CA) (resid 150 and name C )  7.296   2
    
assign (resid 150 and name C ) (resid 151 and name N ) 
    (resid 151 and name CA) (resid 151 and name C )  7.008   2
    
assign (resid 151 and name C ) (resid 152 and name N ) 
    (resid 152 and name CA) (resid 152 and name C )  7.680   2
    
# Restraints file 4: p21-14mer_Hbond.tbl
assign (segid "   A" and resid  148 and name  HN) 
((segid "   A" and resid  146 and name   O) or (segid "   A" and resid 146 and name   OG) or (segid "   A" and resid  148 and name   OG1)) 1.80 0.00 0.50
assign (segid "   A" and resid  148 and name  N) 
((segid "   A" and resid  146 and name   O) or (segid "   A" and resid 146 and name   OG) or (segid "   A" and resid  148 and name   OG1)) 2.80 0.00 0.50







  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY 139           HT1      GLY 139   9.178   7.065  -3.215
    2    H2   GLY 139           HT2      GLY 139  10.002   5.836  -4.028
    3    H3   GLY 139           HT3      GLY 139  10.861   6.955  -3.103
    4    HA2  GLY 139           HA1      GLY 139   9.830   6.137  -1.086
    5    HA3  GLY 139           HA2      GLY 139   8.917   4.983  -2.047
    6    H    ARG 140           HN       ARG 140  10.967   4.649   0.124
    7    HA   ARG 140           HA       ARG 140  12.943   3.088  -1.411
    8    HB2  ARG 140           HB2      ARG 140  13.268   4.356   1.312
    9    HB3  ARG 140           HB1      ARG 140  14.482   3.393   0.484
   10    HG2  ARG 140           HG2      ARG 140  14.569   5.055  -1.310
   11    HG3  ARG 140           HG1      ARG 140  13.370   6.028  -0.454
   12    HD2  ARG 140           HD2      ARG 140  14.920   6.186   1.461
   13    HD3  ARG 140           HD1      ARG 140  16.123   5.290   0.533
   14    HE   ARG 140           HE       ARG 140  15.320   7.496  -0.981
   15   HH11  ARG 140          HH11      ARG 140  17.036   6.818   1.993
   16   HH12  ARG 140          HH12      ARG 140  18.011   8.250   1.908
   17   HH21  ARG 140          HH21      ARG 140  16.592   9.376  -1.101
   18   HH22  ARG 140          HH22      ARG 140  17.751   9.718   0.144
   19    H    LYS 141           HN       LYS 141  10.201   2.570   0.109
   20    HA   LYS 141           HA       LYS 141  11.062  -0.077   0.973
   21    HB2  LYS 141           HB2      LYS 141   9.693   0.045   3.034
   22    HB3  LYS 141           HB1      LYS 141  11.068   1.136   3.054
   23    HG2  LYS 141           HG2      LYS 141   9.561   2.997   2.466
   24    HG3  LYS 141           HG1      LYS 141   8.194   1.880   2.548
   25    HD2  LYS 141           HD2      LYS 141   8.683   1.427   4.889
   26    HD3  LYS 141           HD1      LYS 141  10.090   2.489   4.819
   27    HE2  LYS 141           HE2      LYS 141   7.212   3.309   4.434
   28    HE3  LYS 141           HE1      LYS 141   8.200   3.617   5.860
   29    HZ1  LYS 141           HZ1      LYS 141   8.596   4.729   3.139
   30    HZ2  LYS 141           HZ2      LYS 141   9.708   4.912   4.398
   31    HZ3  LYS 141           HZ3      LYS 141   8.158   5.576   4.534
   32    H    ARG 142           HN       ARG 142   9.721   0.838  -1.349
   33    HA   ARG 142           HA       ARG 142   6.930   0.160  -1.074
   34    HB2  ARG 142           HB2      ARG 142   8.593   0.522  -3.575
   35    HB3  ARG 142           HB1      ARG 142   6.840   0.399  -3.514
   36    HG2  ARG 142           HG2      ARG 142   6.795   2.458  -2.135
   37    HG3  ARG 142           HG1      ARG 142   8.538   2.600  -2.362
   38    HD2  ARG 142           HD2      ARG 142   7.444   4.017  -3.952
   39    HD3  ARG 142           HD1      ARG 142   8.156   2.654  -4.814
   40    HE   ARG 142           HE       ARG 142   5.436   2.174  -4.106
   41   HH11  ARG 142          HH11      ARG 142   7.490   3.780  -6.439
   42   HH12  ARG 142          HH12      ARG 142   6.291   3.767  -7.692
   43   HH21  ARG 142          HH21      ARG 142   3.851   2.166  -5.749
   44   HH22  ARG 142          HH22      ARG 142   4.225   2.839  -7.302
   45    H    ARG 143           HN       ARG 143   6.446  -1.876  -0.624
   46    HA   ARG 143           HA       ARG 143   7.300  -4.028  -2.337
   47    HB2  ARG 143           HB2      ARG 143   9.209  -3.844  -0.779
   48    HB3  ARG 143           HB1      ARG 143   8.111  -4.004   0.582
   49    HG2  ARG 143           HG2      ARG 143   9.081  -6.114   0.315
   50    HG3  ARG 143           HG1      ARG 143   7.470  -6.257  -0.389
   51    HD2  ARG 143           HD2      ARG 143   8.402  -5.983  -2.620
   52    HD3  ARG 143           HD1      ARG 143  10.014  -5.771  -1.936
   53    HE   ARG 143           HE       ARG 143   8.634  -8.258  -1.307
   54   HH11  ARG 143          HH11      ARG 143  11.012  -6.618  -3.282
   55   HH12  ARG 143          HH12      ARG 143  11.822  -8.080  -3.741
   56   HH21  ARG 143          HH21      ARG 143   9.710 -10.180  -1.891
   57   HH22  ARG 143          HH22      ARG 143  11.085 -10.108  -2.948
   58    H    GLN 144           HN       GLN 144   5.573  -5.296  -2.563
   59    HA   GLN 144           HA       GLN 144   3.516  -6.194  -2.282
   60    HB2  GLN 144           HB2      GLN 144   4.559  -6.388   0.542
   61    HB3  GLN 144           HB1      GLN 144   3.063  -7.143   0.011
   62    HG2  GLN 144           HG2      GLN 144   4.319  -8.440  -1.644
   63    HG3  GLN 144           HG1      GLN 144   5.812  -7.697  -1.083
   64   HE21  GLN 144          HE21      GLN 144   3.290  -9.966  -0.363
   65   HE22  GLN 144          HE22      GLN 144   4.079 -10.731   0.972
   66    H    THR 145           HN       THR 145   2.885  -3.881  -2.758
   67    HA   THR 145           HA       THR 145   1.695  -2.445  -0.543
   68    HB   THR 145           HB       THR 145   1.529  -1.784  -3.481
   69    HG1  THR 145           HG1      THR 145   3.669  -1.641  -3.148
   70   HG21  THR 145          HG21      THR 145   1.246  -0.085  -1.003
   71   HG22  THR 145          HG22      THR 145  -0.066  -0.599  -2.064
   72   HG23  THR 145          HG23      THR 145   1.174   0.500  -2.666
   73    H    SER 146           HN       SER 146   0.102  -3.867   0.119
   74    HA   SER 146           HA       SER 146  -1.917  -4.837  -1.676
   75    HB2  SER 146           HB2      SER 146  -1.942  -4.826   1.352
   76    HB3  SER 146           HB1      SER 146  -2.877  -5.870   0.281
   77    HG   SER 146           HG       SER 146  -0.439  -6.277   1.263
   78    H    MET 147           HN       MET 147  -4.145  -4.276  -1.611
   79    HA   MET 147           HA       MET 147  -4.591  -1.464  -1.079
   80    HB2  MET 147           HB2      MET 147  -6.380  -3.583  -2.285
   81    HB3  MET 147           HB1      MET 147  -6.833  -1.894  -2.105
   82    HG2  MET 147           HG2      MET 147  -4.947  -1.260  -3.553
   83    HG3  MET 147           HG1      MET 147  -4.568  -2.966  -3.772
   84    HE1  MET 147           HE1      MET 147  -7.738  -4.267  -5.680
   85    HE2  MET 147           HE2      MET 147  -7.527  -4.240  -3.931
   86    HE3  MET 147           HE3      MET 147  -6.180  -4.695  -4.973
   87    H    THR 148           HN       THR 148  -4.359  -1.655   1.236
   88    HA   THR 148           HA       THR 148  -6.383  -3.086   2.714
   89    HB   THR 148           HB       THR 148  -5.293  -1.709   4.659
   90    HG1  THR 148           HG1      THR 148  -4.033  -0.263   3.569
   91   HG21  THR 148          HG21      THR 148  -3.512  -3.385   4.840
   92   HG22  THR 148          HG22      THR 148  -3.767  -3.837   3.155
   93   HG23  THR 148          HG23      THR 148  -5.037  -4.120   4.345
   94    H    ASP 149           HN       ASP 149  -6.563  -0.447   0.927
   95    HA   ASP 149           HA       ASP 149  -8.942   0.458   2.293
   96    HB2  ASP 149           HB2      ASP 149  -7.318   1.961   3.288
   97    HB3  ASP 149           HB1      ASP 149  -6.643   2.338   1.705
   98    H    PHE 150           HN       PHE 150 -10.467   0.705   0.805
   99    HA   PHE 150           HA       PHE 150  -9.702   0.463  -1.980
  100    HB2  PHE 150           HB2      PHE 150 -12.413   0.414  -0.646
  101    HB3  PHE 150           HB1      PHE 150 -12.136   0.147  -2.363
  102    HD1  PHE 150           HD1      PHE 150 -10.599  -1.788  -3.018
  103    HD2  PHE 150           HD2      PHE 150 -12.305  -1.358   0.855
  104    HE1  PHE 150           HE1      PHE 150 -10.226  -4.183  -2.594
  105    HE2  PHE 150           HE2      PHE 150 -11.935  -3.751   1.286
  106    HZ   PHE 150           HZ       PHE 150 -10.894  -5.166  -0.438
  107    H    TYR 151           HN       TYR 151  -8.952   2.897  -0.971
  108    HA   TYR 151           HA       TYR 151 -10.346   4.614  -2.842
  109    HB2  TYR 151           HB2      TYR 151 -11.393   4.768  -0.432
  110    HB3  TYR 151           HB1      TYR 151  -9.952   5.714  -0.076
  111    HD1  TYR 151           HD1      TYR 151  -9.656   7.932  -1.031
  112    HD2  TYR 151           HD2      TYR 151 -13.095   5.607  -1.952
  113    HE1  TYR 151           HE1      TYR 151 -10.753   9.929  -1.948
  114    HE2  TYR 151           HE2      TYR 151 -14.201   7.599  -2.877
  115    HH   TYR 151           HH       TYR 151 -14.029  10.106  -2.577
  116    H    HIS 152           HN       HIS 152  -7.699   3.314  -2.323
  117    HA   HIS 152           HA       HIS 152  -6.039   5.612  -2.897
  118    HB2  HIS 152           HB2      HIS 152  -5.676   3.926  -0.431
  119    HB3  HIS 152           HB1      HIS 152  -4.302   4.714  -1.196
  120    HD1  HIS 152           HD1      HIS 152  -7.236   5.349   0.974
  121    HD2  HIS 152           HD2      HIS 152  -4.352   7.561  -1.062
  122    HE1  HIS 152           HE1      HIS 152  -7.348   7.676   1.935
  123    HE2  HIS 152           HE2      HIS 152  -5.548   8.975   0.745
  Start of MODEL    2
    1    H1   GLY 139           HT1      GLY 139  16.564   0.780  -3.736
    2    H2   GLY 139           HT2      GLY 139  18.083   0.135  -3.361
    3    H3   GLY 139           HT3      GLY 139  17.017   0.561  -2.122
    4    HA2  GLY 139           HA1      GLY 139  16.608  -1.608  -4.103
    5    HA3  GLY 139           HA2      GLY 139  17.048  -1.827  -2.416
    6    H    ARG 140           HN       ARG 140  15.196  -3.072  -2.033
    7    HA   ARG 140           HA       ARG 140  12.566  -2.039  -2.547
    8    HB2  ARG 140           HB2      ARG 140  13.386  -4.355  -0.788
    9    HB3  ARG 140           HB1      ARG 140  11.778  -4.045  -1.424
   10    HG2  ARG 140           HG2      ARG 140  12.557  -4.446  -3.680
   11    HG3  ARG 140           HG1      ARG 140  14.208  -4.664  -3.093
   12    HD2  ARG 140           HD2      ARG 140  11.815  -6.401  -2.515
   13    HD3  ARG 140           HD1      ARG 140  13.242  -6.828  -3.455
   14    HE   ARG 140           HE       ARG 140  13.316  -6.284  -0.556
   15   HH11  ARG 140          HH11      ARG 140  14.335  -8.139  -3.350
   16   HH12  ARG 140          HH12      ARG 140  15.354  -9.193  -2.425
   17   HH21  ARG 140          HH21      ARG 140  14.665  -7.664   0.647
   18   HH22  ARG 140          HH22      ARG 140  15.562  -8.911  -0.160
   19    H    LYS 141           HN       LYS 141  12.538  -0.045  -1.443
   20    HA   LYS 141           HA       LYS 141  12.730  -0.223   1.492
   21    HB2  LYS 141           HB2      LYS 141  13.403   2.100   1.511
   22    HB3  LYS 141           HB1      LYS 141  14.453   1.193   0.432
   23    HG2  LYS 141           HG2      LYS 141  13.150   2.018  -1.487
   24    HG3  LYS 141           HG1      LYS 141  12.167   2.979  -0.380
   25    HD2  LYS 141           HD2      LYS 141  14.281   4.096   0.376
   26    HD3  LYS 141           HD1      LYS 141  15.117   3.251  -0.929
   27    HE2  LYS 141           HE2      LYS 141  12.848   5.216  -1.212
   28    HE3  LYS 141           HE1      LYS 141  14.536   5.491  -1.633
   29    HZ1  LYS 141           HZ1      LYS 141  13.163   4.983  -3.570
   30    HZ2  LYS 141           HZ2      LYS 141  12.774   3.477  -2.912
   31    HZ3  LYS 141           HZ3      LYS 141  14.368   3.821  -3.343
   32    H    ARG 142           HN       ARG 142  10.454  -0.138  -0.825
   33    HA   ARG 142           HA       ARG 142   8.472   0.946   0.959
   34    HB2  ARG 142           HB2      ARG 142   7.615   2.657  -0.574
   35    HB3  ARG 142           HB1      ARG 142   9.265   3.014  -0.087
   36    HG2  ARG 142           HG2      ARG 142  10.085   2.152  -2.215
   37    HG3  ARG 142           HG1      ARG 142   8.432   1.782  -2.706
   38    HD2  ARG 142           HD2      ARG 142   9.489   4.531  -2.041
   39    HD3  ARG 142           HD1      ARG 142   9.259   3.895  -3.667
   40    HE   ARG 142           HE       ARG 142   6.869   3.805  -2.083
   41   HH11  ARG 142          HH11      ARG 142   8.840   5.831  -4.148
   42   HH12  ARG 142          HH12      ARG 142   7.537   6.895  -4.567
   43   HH21  ARG 142          HH21      ARG 142   5.144   5.202  -2.651
   44   HH22  ARG 142          HH22      ARG 142   5.435   6.532  -3.727
   45    H    ARG 143           HN       ARG 143   6.300   0.634   0.192
   46    HA   ARG 143           HA       ARG 143   5.835  -0.936  -2.177
   47    HB2  ARG 143           HB2      ARG 143   4.804  -2.836  -0.915
   48    HB3  ARG 143           HB1      ARG 143   6.551  -2.740  -0.755
   49    HG2  ARG 143           HG2      ARG 143   6.331  -1.769   1.453
   50    HG3  ARG 143           HG1      ARG 143   4.574  -1.742   1.292
   51    HD2  ARG 143           HD2      ARG 143   5.412  -3.646   2.645
   52    HD3  ARG 143           HD1      ARG 143   4.492  -4.147   1.228
   53    HE   ARG 143           HE       ARG 143   7.204  -4.068   0.538
   54   HH11  ARG 143          HH11      ARG 143   5.070  -5.900   2.619
   55   HH12  ARG 143          HH12      ARG 143   5.985  -7.366   2.484
   56   HH21  ARG 143          HH21      ARG 143   8.409  -5.994   0.353
   57   HH22  ARG 143          HH22      ARG 143   7.888  -7.421   1.195
   58    H    GLN 144           HN       GLN 144   3.355  -1.768  -1.915
   59    HA   GLN 144           HA       GLN 144   1.757   0.217  -0.528
   60    HB2  GLN 144           HB2      GLN 144   2.363   1.278  -2.700
   61    HB3  GLN 144           HB1      GLN 144   1.593  -0.064  -3.535
   62    HG2  GLN 144           HG2      GLN 144  -0.548   0.524  -2.514
   63    HG3  GLN 144           HG1      GLN 144   0.225   1.867  -1.676
   64   HE21  GLN 144          HE21      GLN 144   1.937   2.439  -4.017
   65   HE22  GLN 144          HE22      GLN 144   0.906   3.259  -5.135
   66    H    THR 145           HN       THR 145   0.221  -0.873   0.394
   67    HA   THR 145           HA       THR 145  -0.498  -3.522  -0.504
   68    HB   THR 145           HB       THR 145  -1.626  -1.962   1.827
   69    HG1  THR 145           HG1      THR 145   0.372  -3.841   2.276
   70   HG21  THR 145          HG21      THR 145  -2.874  -3.981   1.236
   71   HG22  THR 145          HG22      THR 145  -2.033  -4.193   2.772
   72   HG23  THR 145          HG23      THR 145  -1.389  -4.929   1.305
   73    H    SER 146           HN       SER 146  -2.346  -4.089  -1.501
   74    HA   SER 146           HA       SER 146  -3.819  -2.001  -2.791
   75    HB2  SER 146           HB2      SER 146  -4.388  -4.971  -2.848
   76    HB3  SER 146           HB1      SER 146  -4.876  -3.766  -4.038
   77    HG   SER 146           HG       SER 146  -2.809  -3.594  -4.739
   78    H    MET 147           HN       MET 147  -4.457  -4.307  -0.205
   79    HA   MET 147           HA       MET 147  -7.201  -3.362   0.046
   80    HB2  MET 147           HB2      MET 147  -7.422  -5.040   1.817
   81    HB3  MET 147           HB1      MET 147  -6.776  -5.751   0.348
   82    HG2  MET 147           HG2      MET 147  -4.528  -5.682   1.311
   83    HG3  MET 147           HG1      MET 147  -5.190  -4.995   2.790
   84    HE1  MET 147           HE1      MET 147  -3.357  -7.572   2.741
   85    HE2  MET 147           HE2      MET 147  -4.211  -8.645   3.849
   86    HE3  MET 147           HE3      MET 147  -4.047  -6.931   4.232
   87    H    THR 148           HN       THR 148  -5.354  -1.353   0.386
   88    HA   THR 148           HA       THR 148  -5.965  -0.482   3.071
   89    HB   THR 148           HB       THR 148  -3.077  -0.656   2.184
   90    HG1  THR 148           HG1      THR 148  -4.708  -2.348   3.586
   91   HG21  THR 148          HG21      THR 148  -3.558   1.347   3.526
   92   HG22  THR 148          HG22      THR 148  -2.552   0.202   4.412
   93   HG23  THR 148          HG23      THR 148  -4.271   0.330   4.779
   94    H    ASP 149           HN       ASP 149  -3.882   0.308   0.277
   95    HA   ASP 149           HA       ASP 149  -4.646   3.090   0.405
   96    HB2  ASP 149           HB2      ASP 149  -2.796   1.464  -1.258
   97    HB3  ASP 149           HB1      ASP 149  -3.465   2.907  -2.011
   98    H    PHE 150           HN       PHE 150  -5.091   0.465  -1.949
   99    HA   PHE 150           HA       PHE 150  -7.275   1.866  -3.218
  100    HB2  PHE 150           HB2      PHE 150  -6.113  -0.892  -3.644
  101    HB3  PHE 150           HB1      PHE 150  -7.466  -0.250  -4.566
  102    HD1  PHE 150           HD1      PHE 150  -7.134   1.569  -6.154
  103    HD2  PHE 150           HD2      PHE 150  -3.870  -0.150  -4.036
  104    HE1  PHE 150           HE1      PHE 150  -5.567   2.588  -7.752
  105    HE2  PHE 150           HE2      PHE 150  -2.297   0.866  -5.630
  106    HZ   PHE 150           HZ       PHE 150  -3.145   2.237  -7.491
  107    H    TYR 151           HN       TYR 151  -9.321   0.533  -3.595
  108    HA   TYR 151           HA       TYR 151 -11.251  -0.313  -2.779
  109    HB2  TYR 151           HB2      TYR 151  -9.378  -1.978  -1.086
  110    HB3  TYR 151           HB1      TYR 151 -11.101  -2.275  -1.267
  111    HD1  TYR 151           HD1      TYR 151  -7.869  -2.987  -2.540
  112    HD2  TYR 151           HD2      TYR 151 -11.956  -2.675  -3.680
  113    HE1  TYR 151           HE1      TYR 151  -7.416  -4.373  -4.518
  114    HE2  TYR 151           HE2      TYR 151 -11.514  -4.061  -5.659
  115    HH   TYR 151           HH       TYR 151  -8.698  -5.862  -6.060
  116    H    HIS 152           HN       HIS 152 -12.302  -0.961  -0.486
  117    HA   HIS 152           HA       HIS 152 -11.392   0.729   1.686
  118    HB2  HIS 152           HB2      HIS 152 -14.077   1.129   0.351
  119    HB3  HIS 152           HB1      HIS 152 -13.742   1.666   1.990
  120    HD1  HIS 152           HD1      HIS 152 -13.679   2.822  -1.410
  121    HD2  HIS 152           HD2      HIS 152 -11.456   3.583   2.018
  122    HE1  HIS 152           HE1      HIS 152 -12.489   4.992  -1.843
  123    HE2  HIS 152           HE2      HIS 152 -11.021   5.338   0.175
  Start of MODEL    3
    1    H1   GLY 139           HT1      GLY 139  15.715   0.141   1.494
    2    H2   GLY 139           HT2      GLY 139  15.197  -0.342   3.028
    3    H3   GLY 139           HT3      GLY 139  16.624   0.547   2.863
    4    HA2  GLY 139           HA1      GLY 139  14.849   1.952   3.677
    5    HA3  GLY 139           HA2      GLY 139  15.392   2.462   2.086
    6    H    ARG 140           HN       ARG 140  12.887   0.739   3.842
    7    HA   ARG 140           HA       ARG 140  10.764   0.144   3.348
    8    HB2  ARG 140           HB2      ARG 140  10.978   2.685   1.747
    9    HB3  ARG 140           HB1      ARG 140   9.477   1.783   1.898
   10    HG2  ARG 140           HG2      ARG 140   9.622   2.035   4.356
   11    HG3  ARG 140           HG1      ARG 140  11.054   3.042   4.131
   12    HD2  ARG 140           HD2      ARG 140   9.757   4.639   2.846
   13    HD3  ARG 140           HD1      ARG 140   8.327   3.619   2.983
   14    HE   ARG 140           HE       ARG 140   9.356   4.282   5.545
   15   HH11  ARG 140          HH11      ARG 140   7.547   5.618   2.866
   16   HH12  ARG 140          HH12      ARG 140   6.672   6.744   3.854
   17   HH21  ARG 140          HH21      ARG 140   8.204   5.760   6.848
   18   HH22  ARG 140          HH22      ARG 140   7.046   6.826   6.118
   19    H    LYS 141           HN       LYS 141  12.231  -1.557   2.147
   20    HA   LYS 141           HA       LYS 141  11.909  -1.671  -0.687
   21    HB2  LYS 141           HB2      LYS 141  13.744  -2.867   0.382
   22    HB3  LYS 141           HB1      LYS 141  12.606  -3.824   1.322
   23    HG2  LYS 141           HG2      LYS 141  11.724  -4.756  -0.807
   24    HG3  LYS 141           HG1      LYS 141  13.007  -3.898  -1.661
   25    HD2  LYS 141           HD2      LYS 141  14.697  -5.163  -0.531
   26    HD3  LYS 141           HD1      LYS 141  13.502  -5.885   0.549
   27    HE2  LYS 141           HE2      LYS 141  12.444  -6.980  -1.375
   28    HE3  LYS 141           HE1      LYS 141  13.665  -6.280  -2.434
   29    HZ1  LYS 141           HZ1      LYS 141  14.128  -8.596  -1.808
   30    HZ2  LYS 141           HZ2      LYS 141  14.255  -8.129  -0.187
   31    HZ3  LYS 141           HZ3      LYS 141  15.354  -7.539  -1.326
   32    H    ARG 142           HN       ARG 142   9.787  -1.469  -1.229
   33    HA   ARG 142           HA       ARG 142   8.166  -3.819  -0.959
   34    HB2  ARG 142           HB2      ARG 142   6.242  -2.725   0.087
   35    HB3  ARG 142           HB1      ARG 142   7.634  -2.713   1.159
   36    HG2  ARG 142           HG2      ARG 142   8.072  -0.380   0.557
   37    HG3  ARG 142           HG1      ARG 142   6.654  -0.396  -0.497
   38    HD2  ARG 142           HD2      ARG 142   5.279  -1.003   1.492
   39    HD3  ARG 142           HD1      ARG 142   6.712  -0.769   2.491
   40    HE   ARG 142           HE       ARG 142   6.559   1.586   1.251
   41   HH11  ARG 142          HH11      ARG 142   4.065  -0.340   2.775
   42   HH12  ARG 142          HH12      ARG 142   3.126   1.033   3.265
   43   HH21  ARG 142          HH21      ARG 142   5.325   3.402   1.914
   44   HH22  ARG 142          HH22      ARG 142   3.846   3.154   2.781
   45    H    ARG 143           HN       ARG 143   6.625  -3.957  -2.525
   46    HA   ARG 143           HA       ARG 143   7.000  -2.189  -4.770
   47    HB2  ARG 143           HB2      ARG 143   5.434  -3.774  -5.923
   48    HB3  ARG 143           HB1      ARG 143   6.878  -4.522  -5.261
   49    HG2  ARG 143           HG2      ARG 143   5.625  -5.386  -3.388
   50    HG3  ARG 143           HG1      ARG 143   4.178  -4.539  -3.930
   51    HD2  ARG 143           HD2      ARG 143   4.072  -5.894  -5.911
   52    HD3  ARG 143           HD1      ARG 143   5.617  -6.651  -5.523
   53    HE   ARG 143           HE       ARG 143   3.730  -7.015  -3.428
   54   HH11  ARG 143          HH11      ARG 143   4.565  -8.153  -6.625
   55   HH12  ARG 143          HH12      ARG 143   3.926  -9.745  -6.361
   56   HH21  ARG 143          HH21      ARG 143   2.880  -9.100  -3.071
   57   HH22  ARG 143          HH22      ARG 143   2.972 -10.287  -4.334
   58    H    GLN 144           HN       GLN 144   6.009  -0.508  -3.081
   59    HA   GLN 144           HA       GLN 144   4.339   0.938  -2.538
   60    HB2  GLN 144           HB2      GLN 144   3.251   0.029  -5.209
   61    HB3  GLN 144           HB1      GLN 144   2.693   1.439  -4.321
   62    HG2  GLN 144           HG2      GLN 144   4.977   2.378  -4.481
   63    HG3  GLN 144           HG1      GLN 144   5.424   1.011  -5.501
   64   HE21  GLN 144          HE21      GLN 144   3.544   3.928  -5.275
   65   HE22  GLN 144          HE22      GLN 144   3.219   4.086  -6.965
   66    H    THR 145           HN       THR 145   3.935  -0.942  -0.941
   67    HA   THR 145           HA       THR 145   1.507  -2.435  -1.400
   68    HB   THR 145           HB       THR 145   2.004  -3.278   0.955
   69    HG1  THR 145           HG1      THR 145   3.674  -2.464   1.972
   70   HG21  THR 145          HG21      THR 145   2.589  -4.537  -1.060
   71   HG22  THR 145          HG22      THR 145   3.823  -4.725   0.184
   72   HG23  THR 145          HG23      THR 145   4.105  -3.645  -1.180
   73    H    SER 146           HN       SER 146   0.554  -0.092  -1.574
   74    HA   SER 146           HA       SER 146  -0.103   1.150   0.920
   75    HB2  SER 146           HB2      SER 146  -1.276   1.569  -1.837
   76    HB3  SER 146           HB1      SER 146  -1.526   2.620  -0.444
   77    HG   SER 146           HG       SER 146   0.166   3.260  -1.976
   78    H    MET 147           HN       MET 147  -1.813   0.797   2.185
   79    HA   MET 147           HA       MET 147  -3.590  -1.389   1.527
   80    HB2  MET 147           HB2      MET 147  -3.521   0.375   3.988
   81    HB3  MET 147           HB1      MET 147  -4.436  -1.115   3.809
   82    HG2  MET 147           HG2      MET 147  -1.436  -0.866   3.779
   83    HG3  MET 147           HG1      MET 147  -2.417  -1.467   5.113
   84    HE1  MET 147           HE1      MET 147  -4.591  -3.253   3.741
   85    HE2  MET 147           HE2      MET 147  -3.650  -3.773   5.138
   86    HE3  MET 147           HE3      MET 147  -3.798  -4.828   3.733
   87    H    THR 148           HN       THR 148  -4.394  -0.126  -0.340
   88    HA   THR 148           HA       THR 148  -6.802   1.340   0.378
   89    HB   THR 148           HB       THR 148  -4.886   2.590  -1.602
   90    HG1  THR 148           HG1      THR 148  -5.007   2.838   1.205
   91   HG21  THR 148          HG21      THR 148  -7.242   3.233  -1.789
   92   HG22  THR 148          HG22      THR 148  -6.263   4.586  -1.221
   93   HG23  THR 148          HG23      THR 148  -7.261   3.680  -0.083
   94    H    ASP 149           HN       ASP 149  -7.038  -1.028  -0.495
   95    HA   ASP 149           HA       ASP 149  -7.980  -0.767  -3.244
   96    HB2  ASP 149           HB2      ASP 149  -6.987  -2.947  -3.877
   97    HB3  ASP 149           HB1      ASP 149  -5.758  -1.741  -3.509
   98    H    PHE 150           HN       PHE 150  -9.009  -0.947  -0.503
   99    HA   PHE 150           HA       PHE 150 -11.129  -2.839  -1.004
  100    HB2  PHE 150           HB2      PHE 150 -10.907  -3.931   1.210
  101    HB3  PHE 150           HB1      PHE 150  -9.516  -4.259   0.182
  102    HD1  PHE 150           HD1      PHE 150  -7.384  -2.980   0.585
  103    HD2  PHE 150           HD2      PHE 150 -10.654  -2.902   3.307
  104    HE1  PHE 150           HE1      PHE 150  -5.884  -2.173   2.357
  105    HE2  PHE 150           HE2      PHE 150  -9.158  -2.093   5.084
  106    HZ   PHE 150           HZ       PHE 150  -6.772  -1.728   4.611
  107    H    TYR 151           HN       TYR 151 -10.485   0.053  -0.687
  108    HA   TYR 151           HA       TYR 151 -12.620   0.862   1.030
  109    HB2  TYR 151           HB2      TYR 151 -10.942   0.523   2.749
  110    HB3  TYR 151           HB1      TYR 151  -9.750   1.422   1.821
  111    HD1  TYR 151           HD1      TYR 151  -9.392   3.651   2.317
  112    HD2  TYR 151           HD2      TYR 151 -13.092   1.871   3.431
  113    HE1  TYR 151           HE1      TYR 151 -10.030   5.716   3.486
  114    HE2  TYR 151           HE2      TYR 151 -13.739   3.934   4.600
  115    HH   TYR 151           HH       TYR 151 -12.123   6.856   4.177
  116    H    HIS 152           HN       HIS 152 -13.068   3.152   0.776
  117    HA   HIS 152           HA       HIS 152 -11.481   4.592  -1.188
  118    HB2  HIS 152           HB2      HIS 152 -13.140   3.266  -2.489
  119    HB3  HIS 152           HB1      HIS 152 -14.432   4.073  -1.610
  120    HD1  HIS 152           HD1      HIS 152 -15.230   6.254  -2.538
  121    HD2  HIS 152           HD2      HIS 152 -11.612   5.055  -4.191
  122    HE1  HIS 152           HE1      HIS 152 -14.787   7.853  -4.423
  123    HE2  HIS 152           HE2      HIS 152 -12.702   6.978  -5.532
  Start of MODEL    4
    1    H1   GLY 139           HT1      GLY 139  10.030   0.493   5.571
    2    H2   GLY 139           HT2      GLY 139  10.051   2.180   5.476
    3    H3   GLY 139           HT3      GLY 139  10.543   1.407   6.895
    4    HA2  GLY 139           HA1      GLY 139  12.445   2.205   5.647
    5    HA3  GLY 139           HA2      GLY 139  12.439   0.454   5.788
    6    H    ARG 140           HN       ARG 140  13.478  -0.138   3.976
    7    HA   ARG 140           HA       ARG 140  13.105   1.100   1.439
    8    HB2  ARG 140           HB2      ARG 140  14.281  -1.614   2.065
    9    HB3  ARG 140           HB1      ARG 140  14.499  -0.704   0.579
   10    HG2  ARG 140           HG2      ARG 140  15.762   0.985   1.742
   11    HG3  ARG 140           HG1      ARG 140  15.450   0.197   3.292
   12    HD2  ARG 140           HD2      ARG 140  16.632  -1.810   2.454
   13    HD3  ARG 140           HD1      ARG 140  17.020  -0.931   0.979
   14    HE   ARG 140           HE       ARG 140  17.989   0.674   2.934
   15   HH11  ARG 140          HH11      ARG 140  18.413  -2.716   2.172
   16   HH12  ARG 140          HH12      ARG 140  20.025  -2.793   2.806
   17   HH21  ARG 140          HH21      ARG 140  20.118   0.579   3.784
   18   HH22  ARG 140          HH22      ARG 140  20.998  -0.913   3.717
   19    H    LYS 141           HN       LYS 141  11.148   0.992   0.498
   20    HA   LYS 141           HA       LYS 141   9.631  -1.495   0.629
   21    HB2  LYS 141           HB2      LYS 141   8.930   1.278  -0.321
   22    HB3  LYS 141           HB1      LYS 141   7.864  -0.099  -0.547
   23    HG2  LYS 141           HG2      LYS 141   8.867   0.841   2.130
   24    HG3  LYS 141           HG1      LYS 141   7.313   1.294   1.428
   25    HD2  LYS 141           HD2      LYS 141   6.634  -1.039   1.375
   26    HD3  LYS 141           HD1      LYS 141   8.203  -1.528   2.008
   27    HE2  LYS 141           HE2      LYS 141   7.755  -0.256   4.059
   28    HE3  LYS 141           HE1      LYS 141   6.170   0.187   3.425
   29    HZ1  LYS 141           HZ1      LYS 141   6.081  -1.705   4.957
   30    HZ2  LYS 141           HZ2      LYS 141   7.080  -2.596   3.920
   31    HZ3  LYS 141           HZ3      LYS 141   5.539  -2.121   3.411
   32    H    ARG 142           HN       ARG 142   9.538  -2.894  -0.944
   33    HA   ARG 142           HA       ARG 142  10.956  -2.482  -3.411
   34    HB2  ARG 142           HB2      ARG 142  11.035  -4.653  -2.329
   35    HB3  ARG 142           HB1      ARG 142   9.284  -4.777  -2.365
   36    HG2  ARG 142           HG2      ARG 142   9.293  -4.998  -4.755
   37    HG3  ARG 142           HG1      ARG 142  11.029  -4.688  -4.817
   38    HD2  ARG 142           HD2      ARG 142  10.483  -7.085  -5.020
   39    HD3  ARG 142           HD1      ARG 142  11.476  -6.730  -3.609
   40    HE   ARG 142           HE       ARG 142   8.577  -6.915  -3.243
   41   HH11  ARG 142          HH11      ARG 142  11.760  -8.313  -2.768
   42   HH12  ARG 142          HH12      ARG 142  11.208  -9.472  -1.598
   43   HH21  ARG 142          HH21      ARG 142   7.867  -8.441  -1.699
   44   HH22  ARG 142          HH22      ARG 142   9.006  -9.545  -0.995
   45    H    ARG 143           HN       ARG 143   7.729  -2.239  -2.262
   46    HA   ARG 143           HA       ARG 143   6.833  -1.097  -4.746
   47    HB2  ARG 143           HB2      ARG 143   4.934  -2.612  -5.055
   48    HB3  ARG 143           HB1      ARG 143   6.450  -3.490  -5.174
   49    HG2  ARG 143           HG2      ARG 143   6.171  -4.369  -2.949
   50    HG3  ARG 143           HG1      ARG 143   4.722  -3.393  -2.710
   51    HD2  ARG 143           HD2      ARG 143   4.149  -5.701  -3.239
   52    HD3  ARG 143           HD1      ARG 143   3.600  -4.606  -4.505
   53    HE   ARG 143           HE       ARG 143   6.075  -5.482  -5.317
   54   HH11  ARG 143          HH11      ARG 143   3.022  -6.984  -4.494
   55   HH12  ARG 143          HH12      ARG 143   3.240  -8.319  -5.581
   56   HH21  ARG 143          HH21      ARG 143   6.370  -7.246  -6.747
   57   HH22  ARG 143          HH22      ARG 143   5.148  -8.476  -6.851
   58    H    GLN 144           HN       GLN 144   4.659  -0.150  -4.498
   59    HA   GLN 144           HA       GLN 144   4.296   0.843  -1.816
   60    HB2  GLN 144           HB2      GLN 144   4.048   2.378  -3.702
   61    HB3  GLN 144           HB1      GLN 144   2.746   1.391  -4.351
   62    HG2  GLN 144           HG2      GLN 144   1.337   1.918  -2.487
   63    HG3  GLN 144           HG1      GLN 144   2.651   2.770  -1.682
   64   HE21  GLN 144          HE21      GLN 144   2.123   3.031  -5.114
   65   HE22  GLN 144          HE22      GLN 144   1.547   4.661  -5.098
   66    H    THR 145           HN       THR 145   3.391  -0.520  -0.436
   67    HA   THR 145           HA       THR 145   1.385  -2.420  -1.256
   68    HB   THR 145           HB       THR 145   2.407  -1.768   1.518
   69    HG1  THR 145           HG1      THR 145   3.214  -3.786  -0.339
   70   HG21  THR 145          HG21      THR 145   0.930  -4.176   0.451
   71   HG22  THR 145          HG22      THR 145   0.284  -2.964   1.556
   72   HG23  THR 145          HG23      THR 145   1.594  -4.025   2.075
   73    H    SER 146           HN       SER 146  -0.731  -2.029  -1.287
   74    HA   SER 146           HA       SER 146  -1.952  -0.244   0.645
   75    HB2  SER 146           HB2      SER 146  -2.149   0.336  -2.324
   76    HB3  SER 146           HB1      SER 146  -2.995   1.202  -1.042
   77    HG   SER 146           HG       SER 146  -0.320   1.093  -0.582
   78    H    MET 147           HN       MET 147  -2.203  -2.985   0.328
   79    HA   MET 147           HA       MET 147  -4.578  -3.520  -1.245
   80    HB2  MET 147           HB2      MET 147  -2.959  -5.346   0.537
   81    HB3  MET 147           HB1      MET 147  -4.267  -5.856  -0.518
   82    HG2  MET 147           HG2      MET 147  -3.012  -5.208  -2.466
   83    HG3  MET 147           HG1      MET 147  -1.729  -4.549  -1.457
   84    HE1  MET 147           HE1      MET 147  -0.205  -7.765   0.161
   85    HE2  MET 147           HE2      MET 147  -1.451  -6.720   0.843
   86    HE3  MET 147           HE3      MET 147  -0.074  -6.014  -0.005
   87    H    THR 148           HN       THR 148  -3.775  -2.638   1.916
   88    HA   THR 148           HA       THR 148  -6.190  -3.583   3.156
   89    HB   THR 148           HB       THR 148  -4.443  -1.394   4.253
   90    HG1  THR 148           HG1      THR 148  -3.853  -4.127   4.686
   91   HG21  THR 148          HG21      THR 148  -5.003  -2.466   6.388
   92   HG22  THR 148          HG22      THR 148  -5.941  -3.682   5.528
   93   HG23  THR 148          HG23      THR 148  -6.451  -1.996   5.503
   94    H    ASP 149           HN       ASP 149  -5.151  -0.832   1.372
   95    HA   ASP 149           HA       ASP 149  -7.214   0.925   2.384
   96    HB2  ASP 149           HB2      ASP 149  -4.992   1.823   1.817
   97    HB3  ASP 149           HB1      ASP 149  -5.227   1.336   0.140
   98    H    PHE 150           HN       PHE 150  -9.122  -0.086   1.793
   99    HA   PHE 150           HA       PHE 150  -9.656  -0.661  -0.997
  100    HB2  PHE 150           HB2      PHE 150 -11.460  -0.780   1.428
  101    HB3  PHE 150           HB1      PHE 150 -11.906  -1.318  -0.188
  102    HD1  PHE 150           HD1      PHE 150 -10.441  -3.154  -1.244
  103    HD2  PHE 150           HD2      PHE 150 -10.481  -2.259   2.914
  104    HE1  PHE 150           HE1      PHE 150  -9.534  -5.386  -0.761
  105    HE2  PHE 150           HE2      PHE 150  -9.568  -4.491   3.406
  106    HZ   PHE 150           HZ       PHE 150  -9.097  -6.058   1.567
  107    H    TYR 151           HN       TYR 151  -9.077   1.726  -1.341
  108    HA   TYR 151           HA       TYR 151 -11.147   3.628  -0.719
  109    HB2  TYR 151           HB2      TYR 151  -8.799   4.331  -0.816
  110    HB3  TYR 151           HB1      TYR 151  -8.719   3.860  -2.509
  111    HD1  TYR 151           HD1      TYR 151  -9.177   5.428  -4.166
  112    HD2  TYR 151           HD2      TYR 151 -10.546   6.146  -0.202
  113    HE1  TYR 151           HE1      TYR 151  -9.917   7.674  -4.830
  114    HE2  TYR 151           HE2      TYR 151 -11.288   8.395  -0.861
  115    HH   TYR 151           HH       TYR 151 -10.775  10.069  -2.607
  116    H    HIS 152           HN       HIS 152 -12.646   4.474  -2.095
  117    HA   HIS 152           HA       HIS 152 -13.276   2.842  -4.414
  118    HB2  HIS 152           HB2      HIS 152 -15.001   3.519  -2.693
  119    HB3  HIS 152           HB1      HIS 152 -14.855   5.166  -3.294
  120    HD1  HIS 152           HD1      HIS 152 -16.496   5.763  -5.043
  121    HD2  HIS 152           HD2      HIS 152 -15.807   1.668  -4.902
  122    HE1  HIS 152           HE1      HIS 152 -18.086   4.752  -6.708
  123    HE2  HIS 152           HE2      HIS 152 -17.712   2.265  -6.542
  Start of MODEL    5
    1    H1   GLY 139           HT1      GLY 139  14.235  -0.260  -4.465
    2    H2   GLY 139           HT2      GLY 139  13.153   0.487  -5.527
    3    H3   GLY 139           HT3      GLY 139  12.594  -0.171  -4.076
    4    HA2  GLY 139           HA1      GLY 139  14.429   2.140  -4.332
    5    HA3  GLY 139           HA2      GLY 139  12.719   2.227  -3.932
    6    H    ARG 140           HN       ARG 140  13.872   3.418  -2.080
    7    HA   ARG 140           HA       ARG 140  15.210   1.919  -0.089
    8    HB2  ARG 140           HB2      ARG 140  15.411   4.332  -0.150
    9    HB3  ARG 140           HB1      ARG 140  13.679   4.521   0.075
   10    HG2  ARG 140           HG2      ARG 140  14.888   4.995   2.125
   11    HG3  ARG 140           HG1      ARG 140  13.854   3.579   2.316
   12    HD2  ARG 140           HD2      ARG 140  15.796   2.127   1.974
   13    HD3  ARG 140           HD1      ARG 140  16.825   3.547   1.791
   14    HE   ARG 140           HE       ARG 140  15.498   3.748   4.244
   15   HH11  ARG 140          HH11      ARG 140  17.901   1.733   2.697
   16   HH12  ARG 140          HH12      ARG 140  18.707   1.332   4.180
   17   HH21  ARG 140          HH21      ARG 140  16.566   3.219   6.205
   18   HH22  ARG 140          HH22      ARG 140  17.941   2.161   6.170
   19    H    LYS 141           HN       LYS 141  11.834   2.879  -0.508
   20    HA   LYS 141           HA       LYS 141  11.087   1.033   1.648
   21    HB2  LYS 141           HB2      LYS 141  10.277   3.365   1.854
   22    HB3  LYS 141           HB1      LYS 141   9.446   3.197   0.314
   23    HG2  LYS 141           HG2      LYS 141   7.892   2.954   2.153
   24    HG3  LYS 141           HG1      LYS 141   8.041   1.434   1.268
   25    HD2  LYS 141           HD2      LYS 141   9.570   0.584   2.972
   26    HD3  LYS 141           HD1      LYS 141   9.455   2.112   3.848
   27    HE2  LYS 141           HE2      LYS 141   7.154   0.252   3.276
   28    HE3  LYS 141           HE1      LYS 141   8.029   0.338   4.802
   29    HZ1  LYS 141           HZ1      LYS 141   6.449   2.525   3.567
   30    HZ2  LYS 141           HZ2      LYS 141   7.338   2.662   4.995
   31    HZ3  LYS 141           HZ3      LYS 141   6.012   1.617   4.925
   32    H    ARG 142           HN       ARG 142  10.137  -0.838   1.151
   33    HA   ARG 142           HA       ARG 142   9.668  -1.497  -1.603
   34    HB2  ARG 142           HB2      ARG 142   9.030  -3.716  -0.746
   35    HB3  ARG 142           HB1      ARG 142  10.585  -3.189  -0.124
   36    HG2  ARG 142           HG2      ARG 142   9.602  -2.646   2.005
   37    HG3  ARG 142           HG1      ARG 142   7.989  -3.012   1.390
   38    HD2  ARG 142           HD2      ARG 142  10.263  -4.985   1.596
   39    HD3  ARG 142           HD1      ARG 142   8.936  -4.843   2.750
   40    HE   ARG 142           HE       ARG 142   7.623  -5.210   0.443
   41   HH11  ARG 142          HH11      ARG 142  10.308  -6.937   1.872
   42   HH12  ARG 142          HH12      ARG 142   9.882  -8.452   1.147
   43   HH21  ARG 142          HH21      ARG 142   7.040  -7.198  -0.486
   44   HH22  ARG 142          HH22      ARG 142   8.008  -8.607  -0.189
   45    H    ARG 143           HN       ARG 143   7.741  -1.959  -2.594
   46    HA   ARG 143           HA       ARG 143   5.484  -0.465  -1.670
   47    HB2  ARG 143           HB2      ARG 143   5.905  -0.469  -4.022
   48    HB3  ARG 143           HB1      ARG 143   5.965  -2.223  -4.074
   49    HG2  ARG 143           HG2      ARG 143   3.906  -1.450  -5.049
   50    HG3  ARG 143           HG1      ARG 143   3.564  -2.302  -3.543
   51    HD2  ARG 143           HD2      ARG 143   3.492  -0.067  -2.412
   52    HD3  ARG 143           HD1      ARG 143   3.582   0.673  -4.010
   53    HE   ARG 143           HE       ARG 143   1.490  -1.093  -4.152
   54   HH11  ARG 143          HH11      ARG 143   2.299   1.679  -2.180
   55   HH12  ARG 143          HH12      ARG 143   0.647   2.084  -1.848
   56   HH21  ARG 143          HH21      ARG 143  -0.689  -0.570  -3.702
   57   HH22  ARG 143          HH22      ARG 143  -1.049   0.816  -2.717
   58    H    GLN 144           HN       GLN 144   3.844  -1.170  -0.464
   59    HA   GLN 144           HA       GLN 144   3.679  -3.941   0.289
   60    HB2  GLN 144           HB2      GLN 144   1.705  -3.216   1.625
   61    HB3  GLN 144           HB1      GLN 144   3.162  -2.306   1.985
   62    HG2  GLN 144           HG2      GLN 144   2.374  -0.415   0.765
   63    HG3  GLN 144           HG1      GLN 144   1.007  -1.330   0.127
   64   HE21  GLN 144          HE21      GLN 144   2.363   0.211   2.941
   65   HE22  GLN 144          HE22      GLN 144   0.896   0.280   3.853
   66    H    THR 145           HN       THR 145   2.404  -5.459  -0.554
   67    HA   THR 145           HA       THR 145   0.858  -4.835  -2.909
   68    HB   THR 145           HB       THR 145   0.989  -7.517  -1.544
   69    HG1  THR 145           HG1      THR 145   2.877  -6.570  -3.460
   70   HG21  THR 145          HG21      THR 145   0.797  -8.360  -3.839
   71   HG22  THR 145          HG22      THR 145   0.771  -6.706  -4.446
   72   HG23  THR 145          HG23      THR 145  -0.550  -7.294  -3.439
   73    H    SER 146           HN       SER 146  -0.408  -3.411  -1.233
   74    HA   SER 146           HA       SER 146  -2.934  -4.719  -0.744
   75    HB2  SER 146           HB2      SER 146  -1.415  -3.506   1.585
   76    HB3  SER 146           HB1      SER 146  -3.037  -4.197   1.641
   77    HG   SER 146           HG       SER 146  -1.433  -6.024   0.590
   78    H    MET 147           HN       MET 147  -4.342  -3.303  -1.541
   79    HA   MET 147           HA       MET 147  -3.947  -0.444  -0.966
   80    HB2  MET 147           HB2      MET 147  -5.542  -1.835  -3.117
   81    HB3  MET 147           HB1      MET 147  -5.754  -0.133  -2.739
   82    HG2  MET 147           HG2      MET 147  -3.376   0.245  -3.257
   83    HG3  MET 147           HG1      MET 147  -3.234  -1.450  -3.715
   84    HE1  MET 147           HE1      MET 147  -3.080   0.533  -7.129
   85    HE2  MET 147           HE2      MET 147  -2.231  -0.596  -6.075
   86    HE3  MET 147           HE3      MET 147  -2.461   1.079  -5.572
   87    H    THR 148           HN       THR 148  -4.681  -1.727   1.175
   88    HA   THR 148           HA       THR 148  -7.481  -2.280   1.371
   89    HB   THR 148           HB       THR 148  -5.616  -1.917   3.705
   90    HG1  THR 148           HG1      THR 148  -4.638  -3.795   3.246
   91   HG21  THR 148          HG21      THR 148  -7.977  -2.367   4.183
   92   HG22  THR 148          HG22      THR 148  -6.965  -3.731   4.658
   93   HG23  THR 148          HG23      THR 148  -7.911  -3.811   3.172
   94    H    ASP 149           HN       ASP 149  -5.418   0.446   1.950
   95    HA   ASP 149           HA       ASP 149  -7.361   1.920   3.492
   96    HB2  ASP 149           HB2      ASP 149  -4.826   2.830   2.107
   97    HB3  ASP 149           HB1      ASP 149  -5.808   3.835   3.166
   98    H    PHE 150           HN       PHE 150  -6.389   1.610   0.168
   99    HA   PHE 150           HA       PHE 150  -8.065   3.811  -0.705
  100    HB2  PHE 150           HB2      PHE 150  -6.378   1.860  -2.286
  101    HB3  PHE 150           HB1      PHE 150  -7.234   3.242  -2.963
  102    HD1  PHE 150           HD1      PHE 150  -4.308   2.117  -1.154
  103    HD2  PHE 150           HD2      PHE 150  -6.528   5.532  -2.393
  104    HE1  PHE 150           HE1      PHE 150  -2.365   3.553  -0.685
  105    HE2  PHE 150           HE2      PHE 150  -4.587   6.968  -1.932
  106    HZ   PHE 150           HZ       PHE 150  -2.501   5.977  -1.077
  107    H    TYR 151           HN       TYR 151 -10.126   3.056  -0.133
  108    HA   TYR 151           HA       TYR 151 -11.094   0.568  -1.215
  109    HB2  TYR 151           HB2      TYR 151 -12.432   2.817   0.286
  110    HB3  TYR 151           HB1      TYR 151 -13.327   1.438  -0.345
  111    HD1  TYR 151           HD1      TYR 151 -11.219   2.659   2.313
  112    HD2  TYR 151           HD2      TYR 151 -12.766  -0.854   0.485
  113    HE1  TYR 151           HE1      TYR 151 -10.674   1.371   4.337
  114    HE2  TYR 151           HE2      TYR 151 -12.228  -2.151   2.500
  115    HH   TYR 151           HH       TYR 151 -10.684  -2.022   4.405
  116    H    HIS 152           HN       HIS 152 -11.728   0.295  -3.204
  117    HA   HIS 152           HA       HIS 152 -12.575   0.606  -5.277
  118    HB2  HIS 152           HB2      HIS 152 -14.592   1.338  -4.025
  119    HB3  HIS 152           HB1      HIS 152 -13.994   2.991  -4.068
  120    HD1  HIS 152           HD1      HIS 152 -15.233   0.280  -6.401
  121    HD2  HIS 152           HD2      HIS 152 -14.637   4.392  -6.330
  122    HE1  HIS 152           HE1      HIS 152 -16.299   1.155  -8.502
  123    HE2  HIS 152           HE2      HIS 152 -16.101   3.657  -8.330
  Start of MODEL    6
    1    H1   GLY 139           HT1      GLY 139   2.709   0.529  -2.053
    2    H2   GLY 139           HT2      GLY 139   3.461  -0.883  -2.604
    3    H3   GLY 139           HT3      GLY 139   2.893   0.259  -3.710
    4    HA2  GLY 139           HA1      GLY 139   4.508   1.859  -2.997
    5    HA3  GLY 139           HA2      GLY 139   5.064   0.743  -1.757
    6    H    ARG 140           HN       ARG 140   6.994   1.611  -3.339
    7    HA   ARG 140           HA       ARG 140   7.309  -0.309  -5.520
    8    HB2  ARG 140           HB2      ARG 140   9.083   1.984  -4.660
    9    HB3  ARG 140           HB1      ARG 140   9.374   0.949  -6.051
   10    HG2  ARG 140           HG2      ARG 140   7.040   2.808  -5.658
   11    HG3  ARG 140           HG1      ARG 140   8.396   3.035  -6.762
   12    HD2  ARG 140           HD2      ARG 140   7.729   1.021  -7.989
   13    HD3  ARG 140           HD1      ARG 140   6.373   0.800  -6.886
   14    HE   ARG 140           HE       ARG 140   6.410   3.360  -8.206
   15   HH11  ARG 140          HH11      ARG 140   5.368   0.032  -8.404
   16   HH12  ARG 140          HH12      ARG 140   4.069   0.364  -9.504
   17   HH21  ARG 140          HH21      ARG 140   4.714   3.808  -9.675
   18   HH22  ARG 140          HH22      ARG 140   3.709   2.513 -10.245
   19    H    LYS 141           HN       LYS 141   8.775   0.588  -2.444
   20    HA   LYS 141           HA       LYS 141   9.523  -2.140  -1.995
   21    HB2  LYS 141           HB2      LYS 141  11.911  -1.796  -1.692
   22    HB3  LYS 141           HB1      LYS 141  11.446  -1.411  -3.342
   23    HG2  LYS 141           HG2      LYS 141  11.503   0.968  -2.811
   24    HG3  LYS 141           HG1      LYS 141  11.949   0.591  -1.147
   25    HD2  LYS 141           HD2      LYS 141  13.565  -0.111  -3.600
   26    HD3  LYS 141           HD1      LYS 141  13.896   1.231  -2.504
   27    HE2  LYS 141           HE2      LYS 141  13.895  -1.694  -1.762
   28    HE3  LYS 141           HE1      LYS 141  15.325  -0.705  -2.039
   29    HZ1  LYS 141           HZ1      LYS 141  14.846  -0.932   0.315
   30    HZ2  LYS 141           HZ2      LYS 141  13.312  -0.260   0.101
   31    HZ3  LYS 141           HZ3      LYS 141  14.687   0.680  -0.166
   32    H    ARG 142           HN       ARG 142   9.391   1.195  -0.970
   33    HA   ARG 142           HA       ARG 142  10.182   0.658   1.726
   34    HB2  ARG 142           HB2      ARG 142  10.518   2.863   0.667
   35    HB3  ARG 142           HB1      ARG 142   8.774   3.075   0.583
   36    HG2  ARG 142           HG2      ARG 142   8.645   3.014   3.021
   37    HG3  ARG 142           HG1      ARG 142  10.393   2.797   3.107
   38    HD2  ARG 142           HD2      ARG 142   8.977   5.177   1.910
   39    HD3  ARG 142           HD1      ARG 142   9.722   5.127   3.506
   40    HE   ARG 142           HE       ARG 142  11.475   4.502   1.279
   41   HH11  ARG 142          HH11      ARG 142  10.279   6.950   3.473
   42   HH12  ARG 142          HH12      ARG 142  11.627   8.013   3.226
   43   HH21  ARG 142          HH21      ARG 142  13.259   5.892   0.959
   44   HH22  ARG 142          HH22      ARG 142  13.326   7.405   1.803
   45    H    ARG 143           HN       ARG 143   7.066   1.944   0.526
   46    HA   ARG 143           HA       ARG 143   5.732   0.944   2.866
   47    HB2  ARG 143           HB2      ARG 143   4.606   2.264   0.390
   48    HB3  ARG 143           HB1      ARG 143   3.687   1.893   1.841
   49    HG2  ARG 143           HG2      ARG 143   5.357   3.361   3.076
   50    HG3  ARG 143           HG1      ARG 143   5.875   3.908   1.481
   51    HD2  ARG 143           HD2      ARG 143   3.090   4.104   2.623
   52    HD3  ARG 143           HD1      ARG 143   4.230   5.432   2.429
   53    HE   ARG 143           HE       ARG 143   3.910   4.355  -0.086
   54   HH11  ARG 143          HH11      ARG 143   1.812   5.776   2.327
   55   HH12  ARG 143          HH12      ARG 143   0.703   6.427   1.164
   56   HH21  ARG 143          HH21      ARG 143   2.427   5.195  -1.617
   57   HH22  ARG 143          HH22      ARG 143   1.046   6.091  -1.074
   58    H    GLN 144           HN       GLN 144   4.127  -0.642   2.929
   59    HA   GLN 144           HA       GLN 144   4.562  -2.830   1.124
   60    HB2  GLN 144           HB2      GLN 144   4.184  -3.221   3.518
   61    HB3  GLN 144           HB1      GLN 144   2.584  -2.504   3.390
   62    HG2  GLN 144           HG2      GLN 144   1.855  -4.298   1.945
   63    HG3  GLN 144           HG1      GLN 144   3.473  -4.998   1.955
   64   HE21  GLN 144          HE21      GLN 144   0.563  -4.461   3.775
   65   HE22  GLN 144          HE22      GLN 144   0.915  -5.581   5.048
   66    H    THR 145           HN       THR 145   3.351  -3.469  -0.535
   67    HA   THR 145           HA       THR 145   1.401  -1.602  -1.550
   68    HB   THR 145           HB       THR 145   2.290  -4.177  -2.837
   69    HG1  THR 145           HG1      THR 145   4.148  -3.234  -3.364
   70   HG21  THR 145          HG21      THR 145   1.813  -2.980  -4.916
   71   HG22  THR 145          HG22      THR 145   1.373  -1.539  -4.001
   72   HG23  THR 145          HG23      THR 145   0.388  -2.997  -3.879
   73    H    SER 146           HN       SER 146   0.102  -2.392   0.481
   74    HA   SER 146           HA       SER 146  -1.517  -4.724  -0.019
   75    HB2  SER 146           HB2      SER 146  -1.876  -2.480   1.987
   76    HB3  SER 146           HB1      SER 146  -2.750  -4.012   1.983
   77    HG   SER 146           HG       SER 146  -0.661  -5.039   2.196
   78    H    MET 147           HN       MET 147  -2.652  -4.533  -1.867
   79    HA   MET 147           HA       MET 147  -3.849  -2.042  -2.676
   80    HB2  MET 147           HB2      MET 147  -4.088  -4.806  -3.882
   81    HB3  MET 147           HB1      MET 147  -4.634  -3.313  -4.632
   82    HG2  MET 147           HG2      MET 147  -1.780  -3.950  -3.921
   83    HG3  MET 147           HG1      MET 147  -2.489  -4.117  -5.525
   84    HE1  MET 147           HE1      MET 147  -4.323  -1.615  -5.850
   85    HE2  MET 147           HE2      MET 147  -3.164  -2.123  -7.076
   86    HE3  MET 147           HE3      MET 147  -3.211  -0.439  -6.549
   87    H    THR 148           HN       THR 148  -4.951  -2.357  -0.379
   88    HA   THR 148           HA       THR 148  -7.734  -2.795  -0.976
   89    HB   THR 148           HB       THR 148  -7.177  -5.052  -0.313
   90    HG1  THR 148           HG1      THR 148  -9.123  -4.692   0.523
   91   HG21  THR 148          HG21      THR 148  -5.125  -4.611   0.933
   92   HG22  THR 148          HG22      THR 148  -6.244  -5.581   1.890
   93   HG23  THR 148          HG23      THR 148  -6.059  -3.859   2.226
   94    H    ASP 149           HN       ASP 149  -5.202  -1.886   1.271
   95    HA   ASP 149           HA       ASP 149  -6.968  -0.314   2.918
   96    HB2  ASP 149           HB2      ASP 149  -3.945  -0.407   2.785
   97    HB3  ASP 149           HB1      ASP 149  -4.874   0.470   3.995
   98    H    PHE 150           HN       PHE 150  -7.673   1.632   2.397
   99    HA   PHE 150           HA       PHE 150  -7.950   3.629   1.358
  100    HB2  PHE 150           HB2      PHE 150  -4.929   3.546   1.221
  101    HB3  PHE 150           HB1      PHE 150  -5.905   4.961   0.843
  102    HD1  PHE 150           HD1      PHE 150  -4.485   2.904   3.458
  103    HD2  PHE 150           HD2      PHE 150  -7.162   6.102   2.622
  104    HE1  PHE 150           HE1      PHE 150  -4.428   3.566   5.826
  105    HE2  PHE 150           HE2      PHE 150  -7.111   6.770   4.986
  106    HZ   PHE 150           HZ       PHE 150  -5.742   5.504   6.592
  107    H    TYR 151           HN       TYR 151  -8.092   1.241  -0.243
  108    HA   TYR 151           HA       TYR 151  -6.856   1.893  -2.770
  109    HB2  TYR 151           HB2      TYR 151  -7.150  -0.473  -2.079
  110    HB3  TYR 151           HB1      TYR 151  -8.896  -0.257  -2.155
  111    HD1  TYR 151           HD1      TYR 151  -5.871   0.195  -4.299
  112    HD2  TYR 151           HD2      TYR 151  -9.987  -0.863  -4.111
  113    HE1  TYR 151           HE1      TYR 151  -5.827  -0.373  -6.689
  114    HE2  TYR 151           HE2      TYR 151  -9.954  -1.437  -6.504
  115    HH   TYR 151           HH       TYR 151  -8.637  -0.874  -8.516
  116    H    HIS 152           HN       HIS 152  -7.636   3.470  -3.944
  117    HA   HIS 152           HA       HIS 152 -10.460   3.581  -4.577
  118    HB2  HIS 152           HB2      HIS 152 -10.324   4.981  -2.572
  119    HB3  HIS 152           HB1      HIS 152  -9.011   5.908  -3.286
  120    HD1  HIS 152           HD1      HIS 152  -9.764   8.077  -4.154
  121    HD2  HIS 152           HD2      HIS 152 -12.764   5.211  -4.401
  122    HE1  HIS 152           HE1      HIS 152 -11.759   9.268  -5.113
  123    HE2  HIS 152           HE2      HIS 152 -13.496   7.472  -5.424
  Start of MODEL    7
    1    H1   GLY 139           HT1      GLY 139  20.708   2.419  -2.269
    2    H2   GLY 139           HT2      GLY 139  20.099   3.043  -0.824
    3    H3   GLY 139           HT3      GLY 139  19.076   2.842  -2.148
    4    HA2  GLY 139           HA1      GLY 139  19.363   0.446  -2.038
    5    HA3  GLY 139           HA2      GLY 139  20.419   0.665  -0.652
    6    H    ARG 140           HN       ARG 140  17.131   1.107  -1.832
    7    HA   ARG 140           HA       ARG 140  16.135   0.390   0.794
    8    HB2  ARG 140           HB2      ARG 140  16.297   2.835   0.935
    9    HB3  ARG 140           HB1      ARG 140  15.347   2.993  -0.536
   10    HG2  ARG 140           HG2      ARG 140  13.425   2.006   0.571
   11    HG3  ARG 140           HG1      ARG 140  14.373   1.777   2.042
   12    HD2  ARG 140           HD2      ARG 140  13.725   4.422   0.749
   13    HD3  ARG 140           HD1      ARG 140  12.950   3.761   2.186
   14    HE   ARG 140           HE       ARG 140  15.746   3.889   2.569
   15   HH11  ARG 140          HH11      ARG 140  12.920   5.938   2.392
   16   HH12  ARG 140          HH12      ARG 140  13.596   7.174   3.403
   17   HH21  ARG 140          HH21      ARG 140  16.636   5.503   3.913
   18   HH22  ARG 140          HH22      ARG 140  15.707   6.925   4.275
   19    H    LYS 141           HN       LYS 141  15.253  -1.435  -0.065
   20    HA   LYS 141           HA       LYS 141  13.343  -1.142  -2.260
   21    HB2  LYS 141           HB2      LYS 141  15.042  -2.972  -2.340
   22    HB3  LYS 141           HB1      LYS 141  14.308  -3.667  -0.902
   23    HG2  LYS 141           HG2      LYS 141  12.198  -3.940  -2.139
   24    HG3  LYS 141           HG1      LYS 141  12.985  -3.300  -3.582
   25    HD2  LYS 141           HD2      LYS 141  14.626  -5.146  -3.455
   26    HD3  LYS 141           HD1      LYS 141  13.735  -5.808  -2.085
   27    HE2  LYS 141           HE2      LYS 141  13.055  -6.990  -4.044
   28    HE3  LYS 141           HE1      LYS 141  11.722  -5.946  -3.555
   29    HZ1  LYS 141           HZ1      LYS 141  12.061  -5.851  -5.930
   30    HZ2  LYS 141           HZ2      LYS 141  13.673  -5.388  -5.726
   31    HZ3  LYS 141           HZ3      LYS 141  12.428  -4.350  -5.244
   32    H    ARG 142           HN       ARG 142  11.462  -0.388  -1.485
   33    HA   ARG 142           HA       ARG 142   9.943  -2.080   0.270
   34    HB2  ARG 142           HB2      ARG 142  11.141  -0.700   1.926
   35    HB3  ARG 142           HB1      ARG 142  10.531   0.757   1.146
   36    HG2  ARG 142           HG2      ARG 142   8.217  -0.036   1.637
   37    HG3  ARG 142           HG1      ARG 142   8.925  -1.352   2.573
   38    HD2  ARG 142           HD2      ARG 142  10.036   0.311   4.011
   39    HD3  ARG 142           HD1      ARG 142   9.254   1.598   3.098
   40    HE   ARG 142           HE       ARG 142   7.393  -0.304   4.154
   41   HH11  ARG 142          HH11      ARG 142   9.267   2.547   4.918
   42   HH12  ARG 142          HH12      ARG 142   8.212   3.057   6.195
   43   HH21  ARG 142          HH21      ARG 142   6.002   0.354   5.849
   44   HH22  ARG 142          HH22      ARG 142   6.358   1.807   6.731
   45    H    ARG 143           HN       ARG 143   7.924  -2.086  -0.381
   46    HA   ARG 143           HA       ARG 143   6.541   0.299  -1.137
   47    HB2  ARG 143           HB2      ARG 143   5.854  -0.504  -3.372
   48    HB3  ARG 143           HB1      ARG 143   7.575  -0.168  -3.281
   49    HG2  ARG 143           HG2      ARG 143   8.011  -2.577  -3.028
   50    HG3  ARG 143           HG1      ARG 143   6.279  -2.885  -3.192
   51    HD2  ARG 143           HD2      ARG 143   7.481  -3.221  -5.309
   52    HD3  ARG 143           HD1      ARG 143   6.290  -1.926  -5.418
   53    HE   ARG 143           HE       ARG 143   8.650  -0.684  -4.755
   54   HH11  ARG 143          HH11      ARG 143   7.568  -2.748  -7.354
   55   HH12  ARG 143          HH12      ARG 143   8.615  -2.036  -8.535
   56   HH21  ARG 143          HH21      ARG 143  10.049   0.262  -6.293
   57   HH22  ARG 143          HH22      ARG 143  10.044  -0.321  -7.927
   58    H    GLN 144           HN       GLN 144   4.460   0.106  -0.579
   59    HA   GLN 144           HA       GLN 144   3.655  -2.369   0.669
   60    HB2  GLN 144           HB2      GLN 144   2.254   0.292   0.419
   61    HB3  GLN 144           HB1      GLN 144   1.652  -1.070   1.353
   62    HG2  GLN 144           HG2      GLN 144   3.521  -0.953   2.839
   63    HG3  GLN 144           HG1      GLN 144   4.290   0.282   1.844
   64   HE21  GLN 144          HE21      GLN 144   3.434   2.364   1.816
   65   HE22  GLN 144          HE22      GLN 144   2.368   2.931   3.057
   66    H    THR 145           HN       THR 145   1.356  -3.079   0.359
   67    HA   THR 145           HA       THR 145   0.258  -2.715  -2.299
   68    HB   THR 145           HB       THR 145   0.871  -5.525  -1.349
   69    HG1  THR 145           HG1      THR 145   2.544  -3.671  -2.456
   70   HG21  THR 145          HG21      THR 145   0.142  -4.413  -4.067
   71   HG22  THR 145          HG22      THR 145  -0.944  -5.293  -2.991
   72   HG23  THR 145          HG23      THR 145   0.453  -6.109  -3.693
   73    H    SER 146           HN       SER 146  -0.594  -1.925   0.250
   74    HA   SER 146           HA       SER 146  -2.564  -3.802   1.213
   75    HB2  SER 146           HB2      SER 146  -2.082  -0.911   1.973
   76    HB3  SER 146           HB1      SER 146  -3.106  -2.052   2.844
   77    HG   SER 146           HG       SER 146  -0.954  -3.336   2.811
   78    H    MET 147           HN       MET 147  -4.804  -3.541   1.089
   79    HA   MET 147           HA       MET 147  -5.655  -2.065  -1.278
   80    HB2  MET 147           HB2      MET 147  -7.074  -4.165   0.368
   81    HB3  MET 147           HB1      MET 147  -7.740  -3.406  -1.073
   82    HG2  MET 147           HG2      MET 147  -5.271  -5.121  -0.927
   83    HG3  MET 147           HG1      MET 147  -6.831  -5.576  -1.610
   84    HE1  MET 147           HE1      MET 147  -5.438  -6.350  -3.800
   85    HE2  MET 147           HE2      MET 147  -3.940  -5.772  -3.070
   86    HE3  MET 147           HE3      MET 147  -4.380  -5.265  -4.700
   87    H    THR 148           HN       THR 148  -5.093  -0.332   0.690
   88    HA   THR 148           HA       THR 148  -7.504   0.357   2.127
   89    HB   THR 148           HB       THR 148  -6.148   2.451   2.702
   90    HG1  THR 148           HG1      THR 148  -4.377   2.675   1.573
   91   HG21  THR 148          HG21      THR 148  -6.382   0.571   4.241
   92   HG22  THR 148          HG22      THR 148  -4.754   1.246   4.327
   93   HG23  THR 148          HG23      THR 148  -5.042  -0.258   3.450
   94    H    ASP 149           HN       ASP 149  -6.079   0.976  -0.911
   95    HA   ASP 149           HA       ASP 149  -7.597   3.379  -1.454
   96    HB2  ASP 149           HB2      ASP 149  -5.957   1.614  -3.285
   97    HB3  ASP 149           HB1      ASP 149  -6.685   3.149  -3.748
   98    H    PHE 150           HN       PHE 150  -8.551   0.386  -0.993
   99    HA   PHE 150           HA       PHE 150 -10.189  -0.035  -3.322
  100    HB2  PHE 150           HB2      PHE 150  -9.300  -1.943  -2.045
  101    HB3  PHE 150           HB1      PHE 150 -10.205  -1.420  -0.630
  102    HD1  PHE 150           HD1      PHE 150 -12.288  -2.324  -0.237
  103    HD2  PHE 150           HD2      PHE 150 -10.723  -2.368  -4.195
  104    HE1  PHE 150           HE1      PHE 150 -14.225  -3.643  -0.986
  105    HE2  PHE 150           HE2      PHE 150 -12.658  -3.686  -4.947
  106    HZ   PHE 150           HZ       PHE 150 -14.411  -4.322  -3.344
  107    H    TYR 151           HN       TYR 151 -10.745   0.748   0.093
  108    HA   TYR 151           HA       TYR 151 -12.304   1.993   1.153
  109    HB2  TYR 151           HB2      TYR 151 -13.217   2.845  -1.602
  110    HB3  TYR 151           HB1      TYR 151 -13.688   3.593  -0.079
  111    HD1  TYR 151           HD1      TYR 151 -11.635   4.393   1.408
  112    HD2  TYR 151           HD2      TYR 151 -11.507   3.821  -2.805
  113    HE1  TYR 151           HE1      TYR 151  -9.705   5.905   1.264
  114    HE2  TYR 151           HE2      TYR 151  -9.573   5.331  -2.959
  115    HH   TYR 151           HH       TYR 151  -8.602   7.226  -1.610
  116    H    HIS 152           HN       HIS 152 -14.278   1.621   2.016
  117    HA   HIS 152           HA       HIS 152 -15.700  -0.696   1.010
  118    HB2  HIS 152           HB2      HIS 152 -15.251  -0.527   3.412
  119    HB3  HIS 152           HB1      HIS 152 -16.125   0.996   3.487
  120    HD1  HIS 152           HD1      HIS 152 -18.636   0.891   3.734
  121    HD2  HIS 152           HD2      HIS 152 -16.911  -2.828   3.060
  122    HE1  HIS 152           HE1      HIS 152 -20.472  -0.784   4.119
  123    HE2  HIS 152           HE2      HIS 152 -19.439  -3.017   3.570
  Start of MODEL    8
    1    H1   GLY 139           HT1      GLY 139   5.947   5.718  -0.817
    2    H2   GLY 139           HT2      GLY 139   6.552   6.434   0.588
    3    H3   GLY 139           HT3      GLY 139   7.076   4.894   0.132
    4    HA2  GLY 139           HA1      GLY 139   7.573   7.402  -1.365
    5    HA3  GLY 139           HA2      GLY 139   8.749   6.567  -0.361
    6    H    ARG 140           HN       ARG 140  10.103   5.283  -1.394
    7    HA   ARG 140           HA       ARG 140   9.721   4.675  -4.176
    8    HB2  ARG 140           HB2      ARG 140  11.889   3.893  -2.225
    9    HB3  ARG 140           HB1      ARG 140  11.911   3.474  -3.930
   10    HG2  ARG 140           HG2      ARG 140  11.916   5.860  -4.501
   11    HG3  ARG 140           HG1      ARG 140  11.950   6.254  -2.779
   12    HD2  ARG 140           HD2      ARG 140  14.077   5.116  -2.533
   13    HD3  ARG 140           HD1      ARG 140  14.031   4.617  -4.224
   14    HE   ARG 140           HE       ARG 140  13.839   7.415  -4.087
   15   HH11  ARG 140          HH11      ARG 140  16.177   4.855  -3.550
   16   HH12  ARG 140          HH12      ARG 140  17.544   5.864  -3.903
   17   HH21  ARG 140          HH21      ARG 140  15.642   8.728  -4.571
   18   HH22  ARG 140          HH22      ARG 140  17.240   8.061  -4.487
   19    H    LYS 141           HN       LYS 141   9.309   3.001  -1.158
   20    HA   LYS 141           HA       LYS 141   8.864   0.480  -2.607
   21    HB2  LYS 141           HB2      LYS 141   9.381   0.911   0.339
   22    HB3  LYS 141           HB1      LYS 141   9.198  -0.646  -0.457
   23    HG2  LYS 141           HG2      LYS 141  11.222  -0.245  -1.742
   24    HG3  LYS 141           HG1      LYS 141  11.396   1.343  -0.989
   25    HD2  LYS 141           HD2      LYS 141  11.565   0.245   1.210
   26    HD3  LYS 141           HD1      LYS 141  11.464  -1.324   0.414
   27    HE2  LYS 141           HE2      LYS 141  13.513  -0.860  -0.804
   28    HE3  LYS 141           HE1      LYS 141  13.602   0.743  -0.079
   29    HZ1  LYS 141           HZ1      LYS 141  13.748  -1.830   1.389
   30    HZ2  LYS 141           HZ2      LYS 141  13.827  -0.297   2.092
   31    HZ3  LYS 141           HZ3      LYS 141  15.054  -0.812   1.047
   32    H    ARG 142           HN       ARG 142   6.797   0.045  -2.995
   33    HA   ARG 142           HA       ARG 142   4.675   1.204  -1.447
   34    HB2  ARG 142           HB2      ARG 142   4.550   0.639  -3.918
   35    HB3  ARG 142           HB1      ARG 142   4.457  -1.052  -3.447
   36    HG2  ARG 142           HG2      ARG 142   2.406  -0.591  -2.196
   37    HG3  ARG 142           HG1      ARG 142   2.497   1.103  -2.683
   38    HD2  ARG 142           HD2      ARG 142   0.935  -0.071  -4.105
   39    HD3  ARG 142           HD1      ARG 142   2.351   0.401  -5.045
   40    HE   ARG 142           HE       ARG 142   2.802  -2.173  -4.103
   41   HH11  ARG 142          HH11      ARG 142   0.589  -0.548  -6.277
   42   HH12  ARG 142          HH12      ARG 142   0.310  -1.960  -7.244
   43   HH21  ARG 142          HH21      ARG 142   2.438  -4.031  -5.375
   44   HH22  ARG 142          HH22      ARG 142   1.352  -3.942  -6.726
   45    H    ARG 143           HN       ARG 143   5.271   0.466   0.615
   46    HA   ARG 143           HA       ARG 143   5.373  -2.346   1.218
   47    HB2  ARG 143           HB2      ARG 143   5.701  -1.614   3.529
   48    HB3  ARG 143           HB1      ARG 143   6.772  -0.745   2.439
   49    HG2  ARG 143           HG2      ARG 143   5.249   1.173   2.488
   50    HG3  ARG 143           HG1      ARG 143   4.200   0.301   3.604
   51    HD2  ARG 143           HD2      ARG 143   7.059   1.111   4.112
   52    HD3  ARG 143           HD1      ARG 143   5.627   1.883   4.786
   53    HE   ARG 143           HE       ARG 143   6.052  -0.952   5.349
   54   HH11  ARG 143          HH11      ARG 143   6.149   2.368   6.459
   55   HH12  ARG 143          HH12      ARG 143   6.200   1.936   8.139
   56   HH21  ARG 143          HH21      ARG 143   6.129  -1.524   7.552
   57   HH22  ARG 143          HH22      ARG 143   6.184  -0.280   8.760
   58    H    GLN 144           HN       GLN 144   4.003  -3.341   2.833
   59    HA   GLN 144           HA       GLN 144   2.059  -3.919   3.829
   60    HB2  GLN 144           HB2      GLN 144   1.406  -0.982   3.538
   61    HB3  GLN 144           HB1      GLN 144   0.473  -2.128   4.489
   62    HG2  GLN 144           HG2      GLN 144   2.289  -2.470   5.996
   63    HG3  GLN 144           HG1      GLN 144   3.382  -1.542   4.971
   64   HE21  GLN 144          HE21      GLN 144   0.758  -1.388   7.242
   65   HE22  GLN 144          HE22      GLN 144   0.856   0.312   7.543
   66    H    THR 145           HN       THR 145   2.327  -4.242   1.041
   67    HA   THR 145           HA       THR 145  -0.204  -3.546  -0.175
   68    HB   THR 145           HB       THR 145   2.103  -5.209  -1.206
   69    HG1  THR 145           HG1      THR 145   1.342  -2.485  -1.443
   70   HG21  THR 145          HG21      THR 145  -0.286  -4.105  -2.686
   71   HG22  THR 145          HG22      THR 145   0.001  -5.805  -2.319
   72   HG23  THR 145          HG23      THR 145   1.084  -4.945  -3.411
   73    H    SER 146           HN       SER 146  -1.964  -4.772  -0.213
   74    HA   SER 146           HA       SER 146  -1.876  -7.641  -0.107
   75    HB2  SER 146           HB2      SER 146  -3.180  -7.830   2.015
   76    HB3  SER 146           HB1      SER 146  -1.543  -7.222   2.256
   77    HG   SER 146           HG       SER 146  -2.857  -5.899   3.416
   78    H    MET 147           HN       MET 147  -2.939  -5.678  -1.877
   79    HA   MET 147           HA       MET 147  -4.760  -5.338  -3.181
   80    HB2  MET 147           HB2      MET 147  -5.951  -7.501  -1.454
   81    HB3  MET 147           HB1      MET 147  -6.867  -6.703  -2.722
   82    HG2  MET 147           HG2      MET 147  -6.048  -8.733  -3.612
   83    HG3  MET 147           HG1      MET 147  -5.111  -7.433  -4.341
   84    HE1  MET 147           HE1      MET 147  -4.289 -10.528  -4.412
   85    HE2  MET 147           HE2      MET 147  -2.557 -10.404  -4.107
   86    HE3  MET 147           HE3      MET 147  -3.348  -9.246  -5.177
   87    H    THR 148           HN       THR 148  -4.656  -4.729   0.073
   88    HA   THR 148           HA       THR 148  -7.107  -3.161   0.171
   89    HB   THR 148           HB       THR 148  -6.408  -2.673   2.509
   90    HG1  THR 148           HG1      THR 148  -4.398  -4.630   2.350
   91   HG21  THR 148          HG21      THR 148  -7.818  -4.616   2.070
   92   HG22  THR 148          HG22      THR 148  -6.693  -4.952   3.385
   93   HG23  THR 148          HG23      THR 148  -6.388  -5.604   1.776
   94    H    ASP 149           HN       ASP 149  -4.560  -2.658  -1.468
   95    HA   ASP 149           HA       ASP 149  -3.382  -0.309  -0.337
   96    HB2  ASP 149           HB2      ASP 149  -3.085  -1.551  -3.075
   97    HB3  ASP 149           HB1      ASP 149  -2.104  -0.224  -2.457
   98    H    PHE 150           HN       PHE 150  -4.440   1.512  -0.267
   99    HA   PHE 150           HA       PHE 150  -5.481   2.693  -2.686
  100    HB2  PHE 150           HB2      PHE 150  -7.388   1.329  -1.740
  101    HB3  PHE 150           HB1      PHE 150  -7.328   2.350  -0.309
  102    HD1  PHE 150           HD1      PHE 150  -7.929   2.369  -3.954
  103    HD2  PHE 150           HD2      PHE 150  -8.398   4.444  -0.269
  104    HE1  PHE 150           HE1      PHE 150  -9.447   3.967  -5.048
  105    HE2  PHE 150           HE2      PHE 150  -9.913   6.046  -1.357
  106    HZ   PHE 150           HZ       PHE 150 -10.442   5.807  -3.750
  107    H    TYR 151           HN       TYR 151  -3.728   4.090  -2.232
  108    HA   TYR 151           HA       TYR 151  -3.645   5.518   0.277
  109    HB2  TYR 151           HB2      TYR 151  -2.000   5.979  -2.215
  110    HB3  TYR 151           HB1      TYR 151  -1.643   6.562  -0.593
  111    HD1  TYR 151           HD1      TYR 151  -1.241   3.885  -2.930
  112    HD2  TYR 151           HD2      TYR 151  -1.127   4.835   1.215
  113    HE1  TYR 151           HE1      TYR 151   0.071   1.853  -2.509
  114    HE2  TYR 151           HE2      TYR 151   0.188   2.802   1.648
  115    HH   TYR 151           HH       TYR 151   0.523   0.545   0.517
  116    H    HIS 152           HN       HIS 152  -5.672   6.568   0.204
  117    HA   HIS 152           HA       HIS 152  -5.534   9.139  -1.116
  118    HB2  HIS 152           HB2      HIS 152  -6.681   7.732  -2.793
  119    HB3  HIS 152           HB1      HIS 152  -7.877   7.272  -1.588
  120    HD1  HIS 152           HD1      HIS 152  -6.599  10.516  -3.142
  121    HD2  HIS 152           HD2      HIS 152 -10.110   8.779  -1.745
  122    HE1  HIS 152           HE1      HIS 152  -8.413  12.201  -3.584
  123    HE2  HIS 152           HE2      HIS 152 -10.527  11.145  -2.706
  Start of MODEL    9
    1    H1   GLY 139           HT1      GLY 139   8.676  -6.220   4.195
    2    H2   GLY 139           HT2      GLY 139   8.973  -4.564   4.064
    3    H3   GLY 139           HT3      GLY 139  10.218  -5.607   4.528
    4    HA2  GLY 139           HA1      GLY 139  10.162  -6.676   2.367
    5    HA3  GLY 139           HA2      GLY 139   8.875  -5.580   1.886
    6    H    ARG 140           HN       ARG 140  10.724  -5.371   0.188
    7    HA   ARG 140           HA       ARG 140  12.498  -3.180   1.044
    8    HB2  ARG 140           HB2      ARG 140  12.860  -5.298  -1.071
    9    HB3  ARG 140           HB1      ARG 140  13.852  -3.848  -1.014
   10    HG2  ARG 140           HG2      ARG 140  14.680  -4.444   1.169
   11    HG3  ARG 140           HG1      ARG 140  13.595  -5.833   1.232
   12    HD2  ARG 140           HD2      ARG 140  15.766  -5.453  -0.822
   13    HD3  ARG 140           HD1      ARG 140  15.942  -6.411   0.648
   14    HE   ARG 140           HE       ARG 140  13.691  -7.355  -0.671
   15   HH11  ARG 140          HH11      ARG 140  17.125  -7.131  -1.283
   16   HH12  ARG 140          HH12      ARG 140  17.172  -8.557  -2.267
   17   HH21  ARG 140          HH21      ARG 140  13.742  -9.225  -1.953
   18   HH22  ARG 140          HH22      ARG 140  15.238  -9.750  -2.659
   19    H    LYS 141           HN       LYS 141   9.661  -3.572  -0.339
   20    HA   LYS 141           HA       LYS 141   9.984  -1.969  -2.715
   21    HB2  LYS 141           HB2      LYS 141   7.512  -2.956  -1.284
   22    HB3  LYS 141           HB1      LYS 141   7.491  -2.075  -2.803
   23    HG2  LYS 141           HG2      LYS 141   8.723  -3.872  -3.885
   24    HG3  LYS 141           HG1      LYS 141   8.803  -4.749  -2.357
   25    HD2  LYS 141           HD2      LYS 141   6.257  -4.008  -3.804
   26    HD3  LYS 141           HD1      LYS 141   7.025  -5.596  -3.851
   27    HE2  LYS 141           HE2      LYS 141   6.743  -5.807  -1.435
   28    HE3  LYS 141           HE1      LYS 141   5.990  -4.216  -1.378
   29    HZ1  LYS 141           HZ1      LYS 141   4.239  -5.090  -2.852
   30    HZ2  LYS 141           HZ2      LYS 141   4.302  -5.891  -1.365
   31    HZ3  LYS 141           HZ3      LYS 141   4.934  -6.625  -2.745
   32    H    ARG 142           HN       ARG 142  10.266   0.148  -2.602
   33    HA   ARG 142           HA       ARG 142   9.561   1.683  -0.279
   34    HB2  ARG 142           HB2      ARG 142  10.606   2.484  -2.996
   35    HB3  ARG 142           HB1      ARG 142  10.327   3.622  -1.685
   36    HG2  ARG 142           HG2      ARG 142  12.004   2.597  -0.340
   37    HG3  ARG 142           HG1      ARG 142  12.175   1.259  -1.478
   38    HD2  ARG 142           HD2      ARG 142  12.806   4.152  -2.051
   39    HD3  ARG 142           HD1      ARG 142  13.990   2.891  -1.709
   40    HE   ARG 142           HE       ARG 142  12.809   1.807  -3.786
   41   HH11  ARG 142          HH11      ARG 142  13.684   5.163  -3.320
   42   HH12  ARG 142          HH12      ARG 142  13.896   5.475  -5.012
   43   HH21  ARG 142          HH21      ARG 142  13.080   2.212  -6.011
   44   HH22  ARG 142          HH22      ARG 142  13.548   3.793  -6.551
   45    H    ARG 143           HN       ARG 143   8.056   0.822  -3.234
   46    HA   ARG 143           HA       ARG 143   6.079   2.903  -3.189
   47    HB2  ARG 143           HB2      ARG 143   6.209   0.270  -4.669
   48    HB3  ARG 143           HB1      ARG 143   4.933   1.459  -4.891
   49    HG2  ARG 143           HG2      ARG 143   6.523   3.074  -5.711
   50    HG3  ARG 143           HG1      ARG 143   7.859   1.968  -5.383
   51    HD2  ARG 143           HD2      ARG 143   6.968   0.393  -7.009
   52    HD3  ARG 143           HD1      ARG 143   5.598   1.459  -7.312
   53    HE   ARG 143           HE       ARG 143   7.595   3.082  -7.913
   54   HH11  ARG 143          HH11      ARG 143   7.120  -0.275  -8.763
   55   HH12  ARG 143          HH12      ARG 143   8.009  -0.161 -10.248
   56   HH21  ARG 143          HH21      ARG 143   8.766   3.248  -9.863
   57   HH22  ARG 143          HH22      ARG 143   8.952   1.852 -10.874
   58    H    GLN 144           HN       GLN 144   4.618   3.005  -1.639
   59    HA   GLN 144           HA       GLN 144   4.111   0.729   0.039
   60    HB2  GLN 144           HB2      GLN 144   4.371   2.959   1.010
   61    HB3  GLN 144           HB1      GLN 144   2.972   3.527   0.113
   62    HG2  GLN 144           HG2      GLN 144   2.384   3.107   2.414
   63    HG3  GLN 144           HG1      GLN 144   1.549   1.972   1.356
   64   HE21  GLN 144          HE21      GLN 144   2.099  -0.202   1.421
   65   HE22  GLN 144          HE22      GLN 144   3.053  -0.876   2.695
   66    H    THR 145           HN       THR 145   3.020  -0.725  -1.280
   67    HA   THR 145           HA       THR 145   0.356  -0.007  -2.174
   68    HB   THR 145           HB       THR 145   1.466  -1.561  -3.617
   69    HG1  THR 145           HG1      THR 145  -0.236  -3.306  -2.190
   70   HG21  THR 145          HG21      THR 145   3.142  -2.481  -2.161
   71   HG22  THR 145          HG22      THR 145   2.192  -3.807  -2.829
   72   HG23  THR 145          HG23      THR 145   1.915  -3.269  -1.173
   73    H    SER 146           HN       SER 146  -1.205   0.142  -0.723
   74    HA   SER 146           HA       SER 146  -0.890  -0.985   1.901
   75    HB2  SER 146           HB2      SER 146  -3.180   0.070   2.248
   76    HB3  SER 146           HB1      SER 146  -1.891   1.180   1.785
   77    HG   SER 146           HG       SER 146  -3.359   1.723   0.347
   78    H    MET 147           HN       MET 147  -2.241  -2.540   2.879
   79    HA   MET 147           HA       MET 147  -3.254  -4.486   0.971
   80    HB2  MET 147           HB2      MET 147  -2.720  -4.628   3.934
   81    HB3  MET 147           HB1      MET 147  -3.493  -5.932   3.041
   82    HG2  MET 147           HG2      MET 147  -1.535  -6.125   1.609
   83    HG3  MET 147           HG1      MET 147  -0.760  -4.809   2.484
   84    HE1  MET 147           HE1      MET 147   1.235  -8.067   3.489
   85    HE2  MET 147           HE2      MET 147   1.345  -6.478   2.731
   86    HE3  MET 147           HE3      MET 147   0.445  -7.772   1.941
   87    H    THR 148           HN       THR 148  -4.610  -1.903   1.789
   88    HA   THR 148           HA       THR 148  -7.115  -2.827   2.886
   89    HB   THR 148           HB       THR 148  -7.823  -0.430   2.304
   90    HG1  THR 148           HG1      THR 148  -6.239   0.103   0.795
   91   HG21  THR 148          HG21      THR 148  -5.490  -0.857   4.174
   92   HG22  THR 148          HG22      THR 148  -7.190  -1.122   4.564
   93   HG23  THR 148          HG23      THR 148  -6.608   0.508   4.220
   94    H    ASP 149           HN       ASP 149  -5.634  -2.377  -0.175
   95    HA   ASP 149           HA       ASP 149  -6.230  -2.889  -2.290
   96    HB2  ASP 149           HB2      ASP 149  -7.135  -4.957  -1.246
   97    HB3  ASP 149           HB1      ASP 149  -8.697  -4.158  -1.095
   98    H    PHE 150           HN       PHE 150  -6.445  -0.574  -2.478
   99    HA   PHE 150           HA       PHE 150  -7.422   1.228  -3.424
  100    HB2  PHE 150           HB2      PHE 150  -9.553  -0.783  -4.174
  101    HB3  PHE 150           HB1      PHE 150  -9.466   0.856  -4.809
  102    HD1  PHE 150           HD1      PHE 150  -7.524   1.528  -6.210
  103    HD2  PHE 150           HD2      PHE 150  -8.201  -2.510  -5.051
  104    HE1  PHE 150           HE1      PHE 150  -6.014   0.769  -7.996
  105    HE2  PHE 150           HE2      PHE 150  -6.691  -3.278  -6.835
  106    HZ   PHE 150           HZ       PHE 150  -5.594  -1.638  -8.310
  107    H    TYR 151           HN       TYR 151  -9.912   2.248  -3.576
  108    HA   TYR 151           HA       TYR 151 -11.448   3.432  -2.430
  109    HB2  TYR 151           HB2      TYR 151 -12.287   1.116  -1.845
  110    HB3  TYR 151           HB1      TYR 151 -11.394   1.253  -0.334
  111    HD1  TYR 151           HD1      TYR 151 -12.189   2.667   1.453
  112    HD2  TYR 151           HD2      TYR 151 -14.247   2.525  -2.267
  113    HE1  TYR 151           HE1      TYR 151 -14.097   3.831   2.469
  114    HE2  TYR 151           HE2      TYR 151 -16.161   3.692  -1.259
  115    HH   TYR 151           HH       TYR 151 -15.979   5.223   1.770
  116    H    HIS 152           HN       HIS 152  -9.813   4.982  -2.140
  117    HA   HIS 152           HA       HIS 152  -8.537   6.459  -1.004
  118    HB2  HIS 152           HB2      HIS 152 -10.086   5.365   1.356
  119    HB3  HIS 152           HB1      HIS 152  -9.007   6.752   1.446
  120    HD1  HIS 152           HD1      HIS 152 -12.220   6.678   1.881
  121    HD2  HIS 152           HD2      HIS 152 -10.135   8.148  -1.405
  122    HE1  HIS 152           HE1      HIS 152 -13.762   8.330   0.782
  123    HE2  HIS 152           HE2      HIS 152 -12.528   9.120  -1.263
  Start of MODEL   10
    1    H1   GLY 139           HT1      GLY 139   8.663   7.556  -2.636
    2    H2   GLY 139           HT2      GLY 139   9.674   8.402  -1.583
    3    H3   GLY 139           HT3      GLY 139   8.559   7.286  -0.973
    4    HA2  GLY 139           HA1      GLY 139  10.882   6.633  -2.695
    5    HA3  GLY 139           HA2      GLY 139  10.802   6.380  -0.958
    6    H    ARG 140           HN       ARG 140  11.331   4.301  -2.688
    7    HA   ARG 140           HA       ARG 140   8.882   2.826  -3.151
    8    HB2  ARG 140           HB2      ARG 140  11.781   2.059  -3.517
    9    HB3  ARG 140           HB1      ARG 140  10.422   1.032  -3.944
   10    HG2  ARG 140           HG2      ARG 140   9.676   2.709  -5.562
   11    HG3  ARG 140           HG1      ARG 140  11.068   3.712  -5.146
   12    HD2  ARG 140           HD2      ARG 140  11.497   2.429  -7.175
   13    HD3  ARG 140           HD1      ARG 140  12.571   1.925  -5.872
   14    HE   ARG 140           HE       ARG 140  10.256   0.301  -5.915
   15   HH11  ARG 140          HH11      ARG 140  13.264   0.839  -7.621
   16   HH12  ARG 140          HH12      ARG 140  13.328  -0.770  -8.268
   17   HH21  ARG 140          HH21      ARG 140  10.350  -1.821  -6.748
   18   HH22  ARG 140          HH22      ARG 140  11.672  -2.280  -7.777
   19    H    LYS 141           HN       LYS 141   7.916   1.858  -1.480
   20    HA   LYS 141           HA       LYS 141   9.470   0.841   0.749
   21    HB2  LYS 141           HB2      LYS 141   6.514   0.880   0.146
   22    HB3  LYS 141           HB1      LYS 141   7.182   0.049   1.543
   23    HG2  LYS 141           HG2      LYS 141   7.520   2.986   0.976
   24    HG3  LYS 141           HG1      LYS 141   6.312   2.297   2.062
   25    HD2  LYS 141           HD2      LYS 141   8.131   1.305   3.404
   26    HD3  LYS 141           HD1      LYS 141   9.308   2.081   2.344
   27    HE2  LYS 141           HE2      LYS 141   7.237   3.523   3.992
   28    HE3  LYS 141           HE1      LYS 141   8.933   3.337   4.432
   29    HZ1  LYS 141           HZ1      LYS 141   7.920   4.737   2.018
   30    HZ2  LYS 141           HZ2      LYS 141   9.545   4.565   2.450
   31    HZ3  LYS 141           HZ3      LYS 141   8.507   5.483   3.417
   32    H    ARG 142           HN       ARG 142   7.987  -0.266  -2.147
   33    HA   ARG 142           HA       ARG 142   8.066  -2.198  -3.305
   34    HB2  ARG 142           HB2      ARG 142   9.957  -3.175  -1.161
   35    HB3  ARG 142           HB1      ARG 142   9.656  -3.965  -2.701
   36    HG2  ARG 142           HG2      ARG 142  10.518  -1.941  -3.848
   37    HG3  ARG 142           HG1      ARG 142  10.935  -1.275  -2.268
   38    HD2  ARG 142           HD2      ARG 142  12.019  -3.788  -3.528
   39    HD3  ARG 142           HD1      ARG 142  12.887  -2.282  -3.247
   40    HE   ARG 142           HE       ARG 142  11.819  -3.807  -0.972
   41   HH11  ARG 142          HH11      ARG 142  14.532  -2.447  -2.713
   42   HH12  ARG 142          HH12      ARG 142  15.681  -2.821  -1.471
   43   HH21  ARG 142          HH21      ARG 142  13.333  -4.323   0.661
   44   HH22  ARG 142          HH22      ARG 142  15.002  -3.892   0.448
   45    H    ARG 143           HN       ARG 143   8.345  -3.440   0.012
   46    HA   ARG 143           HA       ARG 143   6.040  -5.122  -0.399
   47    HB2  ARG 143           HB2      ARG 143   6.489  -6.023   1.778
   48    HB3  ARG 143           HB1      ARG 143   8.021  -5.864   0.933
   49    HG2  ARG 143           HG2      ARG 143   8.544  -3.862   2.183
   50    HG3  ARG 143           HG1      ARG 143   6.969  -3.920   2.977
   51    HD2  ARG 143           HD2      ARG 143   7.615  -6.176   3.872
   52    HD3  ARG 143           HD1      ARG 143   9.234  -5.889   3.237
   53    HE   ARG 143           HE       ARG 143   8.640  -3.695   4.793
   54   HH11  ARG 143          HH11      ARG 143   8.947  -7.146   5.279
   55   HH12  ARG 143          HH12      ARG 143   9.399  -7.000   6.946
   56   HH21  ARG 143          HH21      ARG 143   9.266  -3.500   6.984
   57   HH22  ARG 143          HH22      ARG 143   9.596  -4.926   7.912
   58    H    GLN 144           HN       GLN 144   4.427  -5.140   1.548
   59    HA   GLN 144           HA       GLN 144   2.727  -4.125   2.663
   60    HB2  GLN 144           HB2      GLN 144   4.628  -3.300   4.051
   61    HB3  GLN 144           HB1      GLN 144   4.698  -1.861   3.044
   62    HG2  GLN 144           HG2      GLN 144   2.319  -1.407   3.712
   63    HG3  GLN 144           HG1      GLN 144   2.483  -2.712   4.886
   64   HE21  GLN 144          HE21      GLN 144   3.453   0.494   4.007
   65   HE22  GLN 144          HE22      GLN 144   4.176   0.914   5.521
   66    H    THR 145           HN       THR 145   2.260  -4.007   0.125
   67    HA   THR 145           HA       THR 145   1.932  -1.288  -0.816
   68    HB   THR 145           HB       THR 145   0.945  -3.846  -2.097
   69    HG1  THR 145           HG1      THR 145   3.489  -2.641  -1.986
   70   HG21  THR 145          HG21      THR 145   1.017  -2.547  -4.160
   71   HG22  THR 145          HG22      THR 145   1.592  -1.138  -3.272
   72   HG23  THR 145          HG23      THR 145  -0.030  -1.762  -2.978
   73    H    SER 146           HN       SER 146  -0.050  -0.252  -1.134
   74    HA   SER 146           HA       SER 146  -2.061  -0.983   0.786
   75    HB2  SER 146           HB2      SER 146  -1.901   1.315  -1.174
   76    HB3  SER 146           HB1      SER 146  -3.131   1.144   0.075
   77    HG   SER 146           HG       SER 146  -1.292   1.052   1.587
   78    H    MET 147           HN       MET 147  -1.979  -3.002  -1.040
   79    HA   MET 147           HA       MET 147  -4.187  -2.609  -2.898
   80    HB2  MET 147           HB2      MET 147  -2.412  -4.982  -2.319
   81    HB3  MET 147           HB1      MET 147  -3.767  -5.048  -3.435
   82    HG2  MET 147           HG2      MET 147  -2.720  -3.269  -4.775
   83    HG3  MET 147           HG1      MET 147  -1.343  -3.282  -3.675
   84    HE1  MET 147           HE1      MET 147   0.264  -3.640  -5.809
   85    HE2  MET 147           HE2      MET 147  -1.164  -3.625  -6.841
   86    HE3  MET 147           HE3      MET 147   0.016  -4.926  -6.990
   87    H    THR 148           HN       THR 148  -3.860  -3.204   0.301
   88    HA   THR 148           HA       THR 148  -6.022  -5.075   0.631
   89    HB   THR 148           HB       THR 148  -5.809  -4.251   3.086
   90    HG1  THR 148           HG1      THR 148  -3.388  -3.503   3.166
   91   HG21  THR 148          HG21      THR 148  -3.848  -5.685   3.454
   92   HG22  THR 148          HG22      THR 148  -3.496  -5.642   1.727
   93   HG23  THR 148          HG23      THR 148  -4.972  -6.413   2.304
   94    H    ASP 149           HN       ASP 149  -5.577  -1.643   0.475
   95    HA   ASP 149           HA       ASP 149  -8.450  -1.259   0.341
   96    HB2  ASP 149           HB2      ASP 149  -6.709   0.149   2.370
   97    HB3  ASP 149           HB1      ASP 149  -8.254   0.797   1.839
   98    H    PHE 150           HN       PHE 150  -8.462  -0.507  -1.680
   99    HA   PHE 150           HA       PHE 150  -6.384   1.231  -2.667
  100    HB2  PHE 150           HB2      PHE 150  -8.950   0.266  -3.940
  101    HB3  PHE 150           HB1      PHE 150  -7.724   1.219  -4.766
  102    HD1  PHE 150           HD1      PHE 150  -5.354   0.228  -4.859
  103    HD2  PHE 150           HD2      PHE 150  -8.833  -2.045  -3.954
  104    HE1  PHE 150           HE1      PHE 150  -4.168  -1.833  -5.492
  105    HE2  PHE 150           HE2      PHE 150  -7.653  -4.110  -4.577
  106    HZ   PHE 150           HZ       PHE 150  -5.318  -4.007  -5.349
  107    H    TYR 151           HN       TYR 151  -9.269   1.656  -0.981
  108    HA   TYR 151           HA       TYR 151  -9.890   4.269  -2.018
  109    HB2  TYR 151           HB2      TYR 151 -10.850   2.826   0.462
  110    HB3  TYR 151           HB1      TYR 151 -11.449   4.392  -0.071
  111    HD1  TYR 151           HD1      TYR 151 -11.600   0.802  -0.556
  112    HD2  TYR 151           HD2      TYR 151 -12.766   4.561  -2.170
  113    HE1  TYR 151           HE1      TYR 151 -13.281  -0.325  -1.949
  114    HE2  TYR 151           HE2      TYR 151 -14.451   3.442  -3.569
  115    HH   TYR 151           HH       TYR 151 -14.951   1.277  -4.491
  116    H    HIS 152           HN       HIS 152  -9.200   6.186  -1.250
  117    HA   HIS 152           HA       HIS 152  -7.068   6.117   0.742
  118    HB2  HIS 152           HB2      HIS 152  -6.792   7.302  -1.475
  119    HB3  HIS 152           HB1      HIS 152  -7.981   8.472  -0.918
  120    HD1  HIS 152           HD1      HIS 152  -7.122  10.382   0.449
  121    HD2  HIS 152           HD2      HIS 152  -4.378   7.276   0.162
  122    HE1  HIS 152           HE1      HIS 152  -5.001  11.256   1.476
  123    HE2  HIS 152           HE2      HIS 152  -3.436   9.285   1.486
  Start of MODEL   11
    1    H1   GLY 139           HT1      GLY 139   7.484  -5.311  -3.919
    2    H2   GLY 139           HT2      GLY 139   6.487  -4.024  -3.470
    3    H3   GLY 139           HT3      GLY 139   6.484  -5.452  -2.563
    4    HA2  GLY 139           HA1      GLY 139   7.721  -3.747  -1.419
    5    HA3  GLY 139           HA2      GLY 139   8.767  -5.075  -1.899
    6    H    ARG 140           HN       ARG 140  10.406  -3.361  -1.563
    7    HA   ARG 140           HA       ARG 140  12.026  -2.025  -2.395
    8    HB2  ARG 140           HB2      ARG 140  10.700  -2.501  -5.066
    9    HB3  ARG 140           HB1      ARG 140  12.291  -1.793  -4.826
   10    HG2  ARG 140           HG2      ARG 140  13.111  -3.865  -3.892
   11    HG3  ARG 140           HG1      ARG 140  11.503  -4.582  -4.005
   12    HD2  ARG 140           HD2      ARG 140  13.192  -3.632  -6.312
   13    HD3  ARG 140           HD1      ARG 140  12.928  -5.311  -5.849
   14    HE   ARG 140           HE       ARG 140  10.437  -4.586  -6.256
   15   HH11  ARG 140          HH11      ARG 140  13.265  -3.753  -8.138
   16   HH12  ARG 140          HH12      ARG 140  12.391  -3.614  -9.628
   17   HH21  ARG 140          HH21      ARG 140   9.275  -4.385  -8.221
   18   HH22  ARG 140          HH22      ARG 140  10.121  -3.962  -9.676
   19    H    LYS 141           HN       LYS 141  11.778  -0.072  -1.577
   20    HA   LYS 141           HA       LYS 141  11.209   2.097  -1.308
   21    HB2  LYS 141           HB2      LYS 141  10.174   1.841  -4.136
   22    HB3  LYS 141           HB1      LYS 141  10.268   3.355  -3.249
   23    HG2  LYS 141           HG2      LYS 141  12.675   3.174  -3.127
   24    HG3  LYS 141           HG1      LYS 141  12.621   1.600  -3.919
   25    HD2  LYS 141           HD2      LYS 141  11.715   2.616  -5.929
   26    HD3  LYS 141           HD1      LYS 141  11.672   4.190  -5.137
   27    HE2  LYS 141           HE2      LYS 141  14.168   2.582  -5.651
   28    HE3  LYS 141           HE1      LYS 141  13.608   3.918  -6.650
   29    HZ1  LYS 141           HZ1      LYS 141  14.380   4.100  -3.787
   30    HZ2  LYS 141           HZ2      LYS 141  13.823   5.385  -4.736
   31    HZ3  LYS 141           HZ3      LYS 141  15.297   4.642  -5.100
   32    H    ARG 142           HN       ARG 142   9.774   2.129   0.278
   33    HA   ARG 142           HA       ARG 142   7.799   2.451   1.352
   34    HB2  ARG 142           HB2      ARG 142   7.108   3.840  -0.549
   35    HB3  ARG 142           HB1      ARG 142   6.571   2.406  -1.410
   36    HG2  ARG 142           HG2      ARG 142   4.910   2.007   0.383
   37    HG3  ARG 142           HG1      ARG 142   5.407   3.530   1.128
   38    HD2  ARG 142           HD2      ARG 142   4.826   4.692  -0.971
   39    HD3  ARG 142           HD1      ARG 142   4.234   3.167  -1.623
   40    HE   ARG 142           HE       ARG 142   3.006   3.879   0.867
   41   HH11  ARG 142          HH11      ARG 142   2.915   4.331  -2.597
   42   HH12  ARG 142          HH12      ARG 142   1.250   4.817  -2.621
   43   HH21  ARG 142          HH21      ARG 142   0.813   4.526   0.848
   44   HH22  ARG 142          HH22      ARG 142   0.040   4.896  -0.661
   45    H    ARG 143           HN       ARG 143   6.559   1.041   2.452
   46    HA   ARG 143           HA       ARG 143   6.459  -1.697   1.537
   47    HB2  ARG 143           HB2      ARG 143   5.281  -0.454   4.027
   48    HB3  ARG 143           HB1      ARG 143   5.413  -2.175   3.699
   49    HG2  ARG 143           HG2      ARG 143   7.896  -1.871   3.590
   50    HG3  ARG 143           HG1      ARG 143   7.646  -0.225   4.172
   51    HD2  ARG 143           HD2      ARG 143   6.849  -2.761   5.579
   52    HD3  ARG 143           HD1      ARG 143   8.185  -1.702   6.018
   53    HE   ARG 143           HE       ARG 143   6.405   0.028   6.421
   54   HH11  ARG 143          HH11      ARG 143   5.719  -3.395   6.673
   55   HH12  ARG 143          HH12      ARG 143   4.430  -3.185   7.811
   56   HH21  ARG 143          HH21      ARG 143   4.718   0.307   7.947
   57   HH22  ARG 143          HH22      ARG 143   3.879  -1.082   8.557
   58    H    GLN 144           HN       GLN 144   4.880  -2.530   0.361
   59    HA   GLN 144           HA       GLN 144   2.468  -1.024  -0.120
   60    HB2  GLN 144           HB2      GLN 144   3.501  -3.642  -1.206
   61    HB3  GLN 144           HB1      GLN 144   1.905  -3.024  -1.600
   62    HG2  GLN 144           HG2      GLN 144   3.344  -2.424  -3.375
   63    HG3  GLN 144           HG1      GLN 144   3.007  -0.957  -2.462
   64   HE21  GLN 144          HE21      GLN 144   4.825   0.098  -3.163
   65   HE22  GLN 144          HE22      GLN 144   6.419  -0.335  -2.641
   66    H    THR 145           HN       THR 145   1.921  -1.182   2.219
   67    HA   THR 145           HA       THR 145   0.889  -3.700   3.160
   68    HB   THR 145           HB       THR 145   0.036  -2.213   5.066
   69    HG1  THR 145           HG1      THR 145   0.041  -0.194   4.209
   70   HG21  THR 145          HG21      THR 145   2.278  -1.972   6.046
   71   HG22  THR 145          HG22      THR 145   2.995  -2.257   4.460
   72   HG23  THR 145          HG23      THR 145   2.080  -3.537   5.256
   73    H    SER 146           HN       SER 146  -0.683  -4.221   1.639
   74    HA   SER 146           HA       SER 146  -2.775  -4.367   0.783
   75    HB2  SER 146           HB2      SER 146  -3.504  -2.491   3.043
   76    HB3  SER 146           HB1      SER 146  -4.635  -3.450   2.092
   77    HG   SER 146           HG       SER 146  -4.297  -4.924   3.546
   78    H    MET 147           HN       MET 147  -1.134  -2.681  -0.546
   79    HA   MET 147           HA       MET 147  -2.621  -0.206  -1.017
   80    HB2  MET 147           HB2      MET 147   0.044  -1.119  -2.119
   81    HB3  MET 147           HB1      MET 147  -0.693   0.452  -2.408
   82    HG2  MET 147           HG2      MET 147   0.223  -0.636   0.243
   83    HG3  MET 147           HG1      MET 147   1.015   0.616  -0.711
   84    HE1  MET 147           HE1      MET 147   0.168   0.827   2.404
   85    HE2  MET 147           HE2      MET 147  -0.436   2.482   2.463
   86    HE3  MET 147           HE3      MET 147   1.027   2.112   1.554
   87    H    THR 148           HN       THR 148  -4.116  -2.250  -1.748
   88    HA   THR 148           HA       THR 148  -4.148  -2.100  -4.661
   89    HB   THR 148           HB       THR 148  -4.768  -4.666  -4.564
   90    HG1  THR 148           HG1      THR 148  -4.533  -5.183  -2.457
   91   HG21  THR 148          HG21      THR 148  -1.929  -3.646  -4.461
   92   HG22  THR 148          HG22      THR 148  -2.946  -3.775  -5.895
   93   HG23  THR 148          HG23      THR 148  -2.418  -5.233  -5.057
   94    H    ASP 149           HN       ASP 149  -5.721  -0.957  -2.556
   95    HA   ASP 149           HA       ASP 149  -8.331  -1.692  -3.527
   96    HB2  ASP 149           HB2      ASP 149  -9.292  -1.981  -1.242
   97    HB3  ASP 149           HB1      ASP 149  -8.189  -3.272  -1.699
   98    H    PHE 150           HN       PHE 150  -9.962  -0.122  -2.896
   99    HA   PHE 150           HA       PHE 150  -8.789   2.513  -2.746
  100    HB2  PHE 150           HB2      PHE 150 -11.606   1.544  -3.183
  101    HB3  PHE 150           HB1      PHE 150 -11.220   3.249  -2.989
  102    HD1  PHE 150           HD1      PHE 150 -11.512   0.562  -5.281
  103    HD2  PHE 150           HD2      PHE 150  -9.468   4.231  -4.595
  104    HE1  PHE 150           HE1      PHE 150 -11.005   0.726  -7.680
  105    HE2  PHE 150           HE2      PHE 150  -8.956   4.401  -6.995
  106    HZ   PHE 150           HZ       PHE 150  -9.726   2.648  -8.541
  107    H    TYR 151           HN       TYR 151  -8.120   1.558  -0.479
  108    HA   TYR 151           HA       TYR 151  -9.637   3.139   1.423
  109    HB2  TYR 151           HB2      TYR 151 -10.552   0.717   1.352
  110    HB3  TYR 151           HB1      TYR 151  -9.035   0.267   2.115
  111    HD1  TYR 151           HD1      TYR 151  -9.033   0.091   4.418
  112    HD2  TYR 151           HD2      TYR 151 -11.782   2.757   2.572
  113    HE1  TYR 151           HE1      TYR 151 -10.021   0.584   6.614
  114    HE2  TYR 151           HE2      TYR 151 -12.776   3.261   4.763
  115    HH   TYR 151           HH       TYR 151 -12.985   2.133   6.977
  116    H    HIS 152           HN       HIS 152  -6.972   2.929   0.046
  117    HA   HIS 152           HA       HIS 152  -5.270   3.311   2.357
  118    HB2  HIS 152           HB2      HIS 152  -4.829   1.090   0.360
  119    HB3  HIS 152           HB1      HIS 152  -3.504   1.776   1.290
  120    HD1  HIS 152           HD1      HIS 152  -6.389  -0.551   1.534
  121    HD2  HIS 152           HD2      HIS 152  -3.595   1.211   4.074
  122    HE1  HIS 152           HE1      HIS 152  -6.522  -1.831   3.696
  123    HE2  HIS 152           HE2      HIS 152  -4.924  -0.664   5.253
  Start of MODEL   12
    1    H1   GLY 139           HT1      GLY 139  17.748   1.610   4.805
    2    H2   GLY 139           HT2      GLY 139  18.120   3.041   3.991
    3    H3   GLY 139           HT3      GLY 139  19.263   1.801   4.080
    4    HA2  GLY 139           HA1      GLY 139  18.248   1.863   1.896
    5    HA3  GLY 139           HA2      GLY 139  17.872   0.368   2.743
    6    H    ARG 140           HN       ARG 140  16.271   1.097   0.679
    7    HA   ARG 140           HA       ARG 140  13.771   1.627   2.094
    8    HB2  ARG 140           HB2      ARG 140  14.597   3.765   1.013
    9    HB3  ARG 140           HB1      ARG 140  14.400   2.962  -0.540
   10    HG2  ARG 140           HG2      ARG 140  11.987   2.566   0.136
   11    HG3  ARG 140           HG1      ARG 140  12.280   3.705   1.451
   12    HD2  ARG 140           HD2      ARG 140  11.321   4.917  -0.361
   13    HD3  ARG 140           HD1      ARG 140  13.022   5.367  -0.253
   14    HE   ARG 140           HE       ARG 140  12.666   3.222  -2.075
   15   HH11  ARG 140          HH11      ARG 140  12.180   6.666  -1.759
   16   HH12  ARG 140          HH12      ARG 140  12.300   6.971  -3.461
   17   HH21  ARG 140          HH21      ARG 140  12.817   3.612  -4.323
   18   HH22  ARG 140          HH22      ARG 140  12.671   5.237  -4.918
   19    H    LYS 141           HN       LYS 141  12.020   0.560   1.243
   20    HA   LYS 141           HA       LYS 141  12.332  -0.891  -1.274
   21    HB2  LYS 141           HB2      LYS 141  11.545  -2.145   1.364
   22    HB3  LYS 141           HB1      LYS 141  11.305  -2.921  -0.194
   23    HG2  LYS 141           HG2      LYS 141  13.985  -2.062   0.877
   24    HG3  LYS 141           HG1      LYS 141  13.323  -3.692   1.025
   25    HD2  LYS 141           HD2      LYS 141  13.297  -3.954  -1.369
   26    HD3  LYS 141           HD1      LYS 141  13.767  -2.269  -1.599
   27    HE2  LYS 141           HE2      LYS 141  15.455  -4.335  -0.196
   28    HE3  LYS 141           HE1      LYS 141  15.631  -3.891  -1.892
   29    HZ1  LYS 141           HZ1      LYS 141  17.214  -2.682  -0.595
   30    HZ2  LYS 141           HZ2      LYS 141  16.019  -2.111   0.453
   31    HZ3  LYS 141           HZ3      LYS 141  16.052  -1.589  -1.156
   32    H    ARG 142           HN       ARG 142  10.517  -0.885  -2.467
   33    HA   ARG 142           HA       ARG 142   8.284   0.670  -1.501
   34    HB2  ARG 142           HB2      ARG 142   8.712  -0.686  -4.166
   35    HB3  ARG 142           HB1      ARG 142   7.394   0.410  -3.784
   36    HG2  ARG 142           HG2      ARG 142   9.128   2.164  -3.303
   37    HG3  ARG 142           HG1      ARG 142  10.322   1.054  -3.980
   38    HD2  ARG 142           HD2      ARG 142   9.570   2.639  -5.666
   39    HD3  ARG 142           HD1      ARG 142   9.073   1.001  -6.086
   40    HE   ARG 142           HE       ARG 142   7.013   2.277  -4.639
   41   HH11  ARG 142          HH11      ARG 142   8.556   2.332  -7.781
   42   HH12  ARG 142          HH12      ARG 142   7.155   2.943  -8.602
   43   HH21  ARG 142          HH21      ARG 142   5.153   3.055  -5.718
   44   HH22  ARG 142          HH22      ARG 142   5.216   3.350  -7.428
   45    H    ARG 143           HN       ARG 143   6.378  -0.069  -0.809
   46    HA   ARG 143           HA       ARG 143   6.005  -2.924  -0.523
   47    HB2  ARG 143           HB2      ARG 143   4.135  -0.670   0.242
   48    HB3  ARG 143           HB1      ARG 143   4.050  -2.339   0.794
   49    HG2  ARG 143           HG2      ARG 143   6.160  -2.081   1.967
   50    HG3  ARG 143           HG1      ARG 143   6.300  -0.426   1.374
   51    HD2  ARG 143           HD2      ARG 143   4.171   0.105   2.550
   52    HD3  ARG 143           HD1      ARG 143   4.203  -1.517   3.245
   53    HE   ARG 143           HE       ARG 143   6.616  -0.026   3.690
   54   HH11  ARG 143          HH11      ARG 143   3.399  -0.683   4.902
   55   HH12  ARG 143          HH12      ARG 143   3.776  -0.202   6.525
   56   HH21  ARG 143          HH21      ARG 143   7.115   0.612   5.821
   57   HH22  ARG 143          HH22      ARG 143   5.891   0.541   7.047
   58    H    GLN 144           HN       GLN 144   4.873  -4.167  -1.887
   59    HA   GLN 144           HA       GLN 144   3.723  -2.959  -4.230
   60    HB2  GLN 144           HB2      GLN 144   3.796  -5.855  -3.357
   61    HB3  GLN 144           HB1      GLN 144   3.282  -5.282  -4.939
   62    HG2  GLN 144           HG2      GLN 144   5.538  -4.347  -5.295
   63    HG3  GLN 144           HG1      GLN 144   6.035  -5.034  -3.749
   64   HE21  GLN 144          HE21      GLN 144   7.582  -6.346  -4.669
   65   HE22  GLN 144          HE22      GLN 144   7.184  -7.736  -5.617
   66    H    THR 145           HN       THR 145   1.623  -2.817  -4.774
   67    HA   THR 145           HA       THR 145  -0.545  -2.329  -4.462
   68    HB   THR 145           HB       THR 145  -2.010  -3.998  -3.427
   69    HG1  THR 145           HG1      THR 145   0.421  -4.957  -2.390
   70   HG21  THR 145          HG21      THR 145  -1.282  -4.353  -5.715
   71   HG22  THR 145          HG22      THR 145  -1.433  -5.897  -4.877
   72   HG23  THR 145          HG23      THR 145   0.160  -5.193  -5.146
   73    H    SER 146           HN       SER 146  -2.357  -2.203  -2.592
   74    HA   SER 146           HA       SER 146  -1.268  -1.445  -0.038
   75    HB2  SER 146           HB2      SER 146  -2.318   0.914  -0.283
   76    HB3  SER 146           HB1      SER 146  -0.742   0.621  -1.015
   77    HG   SER 146           HG       SER 146  -3.190   1.138  -2.199
   78    H    MET 147           HN       MET 147  -2.739  -3.196   0.429
   79    HA   MET 147           HA       MET 147  -5.544  -2.911  -0.100
   80    HB2  MET 147           HB2      MET 147  -4.048  -4.845   1.672
   81    HB3  MET 147           HB1      MET 147  -5.768  -4.942   1.314
   82    HG2  MET 147           HG2      MET 147  -3.549  -5.112  -0.711
   83    HG3  MET 147           HG1      MET 147  -4.440  -6.477  -0.047
   84    HE1  MET 147           HE1      MET 147  -4.061  -5.822  -3.178
   85    HE2  MET 147           HE2      MET 147  -5.672  -6.207  -3.780
   86    HE3  MET 147           HE3      MET 147  -4.910  -7.246  -2.577
   87    H    THR 148           HN       THR 148  -3.847  -1.061   1.773
   88    HA   THR 148           HA       THR 148  -5.489  -1.079   4.149
   89    HB   THR 148           HB       THR 148  -3.188  -0.342   4.389
   90    HG1  THR 148           HG1      THR 148  -5.138   0.841   5.433
   91   HG21  THR 148          HG21      THR 148  -2.742   0.516   2.171
   92   HG22  THR 148          HG22      THR 148  -2.402   1.770   3.364
   93   HG23  THR 148          HG23      THR 148  -3.890   1.833   2.419
   94    H    ASP 149           HN       ASP 149  -5.216   0.664   1.119
   95    HA   ASP 149           HA       ASP 149  -7.631   2.194   1.634
   96    HB2  ASP 149           HB2      ASP 149  -5.971   3.324   0.295
   97    HB3  ASP 149           HB1      ASP 149  -5.846   1.953  -0.802
   98    H    PHE 150           HN       PHE 150  -9.528   1.208   1.451
   99    HA   PHE 150           HA       PHE 150  -9.720  -1.273  -0.034
  100    HB2  PHE 150           HB2      PHE 150 -11.692   0.173   1.740
  101    HB3  PHE 150           HB1      PHE 150 -12.014  -1.370   0.956
  102    HD1  PHE 150           HD1      PHE 150 -10.283   0.313   3.669
  103    HD2  PHE 150           HD2      PHE 150 -10.777  -3.378   1.613
  104    HE1  PHE 150           HE1      PHE 150  -9.216  -0.871   5.544
  105    HE2  PHE 150           HE2      PHE 150  -9.715  -4.569   3.482
  106    HZ   PHE 150           HZ       PHE 150  -8.932  -3.316   5.452
  107    H    TYR 151           HN       TYR 151  -9.227   0.878  -1.647
  108    HA   TYR 151           HA       TYR 151  -9.829   1.832  -3.592
  109    HB2  TYR 151           HB2      TYR 151 -10.562  -0.537  -4.068
  110    HB3  TYR 151           HB1      TYR 151 -12.192  -0.051  -3.615
  111    HD1  TYR 151           HD1      TYR 151  -9.522   0.338  -6.099
  112    HD2  TYR 151           HD2      TYR 151 -13.527   1.330  -5.078
  113    HE1  TYR 151           HE1      TYR 151  -9.899   1.139  -8.391
  114    HE2  TYR 151           HE2      TYR 151 -13.919   2.131  -7.367
  115    HH   TYR 151           HH       TYR 151 -11.768   1.513  -9.923
  116    H    HIS 152           HN       HIS 152 -10.258   3.795  -2.526
  117    HA   HIS 152           HA       HIS 152 -13.036   4.418  -1.928
  118    HB2  HIS 152           HB2      HIS 152 -11.271   5.253  -0.427
  119    HB3  HIS 152           HB1      HIS 152 -10.562   6.154  -1.761
  120    HD1  HIS 152           HD1      HIS 152 -13.807   6.033   0.217
  121    HD2  HIS 152           HD2      HIS 152 -11.530   8.681  -2.038
  122    HE1  HIS 152           HE1      HIS 152 -14.927   8.266   0.458
  123    HE2  HIS 152           HE2      HIS 152 -13.614   9.818  -1.018
  Start of MODEL   13
    1    H1   GLY 139           HT1      GLY 139  10.763  -6.232   1.535
    2    H2   GLY 139           HT2      GLY 139  10.029  -7.150   0.326
    3    H3   GLY 139           HT3      GLY 139  10.309  -7.829   1.844
    4    HA2  GLY 139           HA1      GLY 139   7.984  -7.257   1.580
    5    HA3  GLY 139           HA2      GLY 139   8.741  -6.324   2.863
    6    H    ARG 140           HN       ARG 140   9.484  -4.137   2.301
    7    HA   ARG 140           HA       ARG 140   8.087  -2.954   0.010
    8    HB2  ARG 140           HB2      ARG 140   6.630  -2.642   1.958
    9    HB3  ARG 140           HB1      ARG 140   7.960  -1.912   2.848
   10    HG2  ARG 140           HG2      ARG 140   8.028  -0.085   1.205
   11    HG3  ARG 140           HG1      ARG 140   6.653  -0.810   0.368
   12    HD2  ARG 140           HD2      ARG 140   6.653   0.127   3.234
   13    HD3  ARG 140           HD1      ARG 140   6.002   1.034   1.870
   14    HE   ARG 140           HE       ARG 140   4.852  -1.576   2.086
   15   HH11  ARG 140          HH11      ARG 140   4.735   1.667   3.387
   16   HH12  ARG 140          HH12      ARG 140   3.072   1.558   3.869
   17   HH21  ARG 140          HH21      ARG 140   2.646  -1.729   2.692
   18   HH22  ARG 140          HH22      ARG 140   1.882  -0.378   3.476
   19    H    LYS 141           HN       LYS 141   9.802  -2.328  -1.140
   20    HA   LYS 141           HA       LYS 141  12.080  -1.094   0.215
   21    HB2  LYS 141           HB2      LYS 141  12.587  -2.917  -1.316
   22    HB3  LYS 141           HB1      LYS 141  11.739  -2.095  -2.617
   23    HG2  LYS 141           HG2      LYS 141  13.392  -0.298  -2.565
   24    HG3  LYS 141           HG1      LYS 141  14.245  -1.123  -1.260
   25    HD2  LYS 141           HD2      LYS 141  14.708  -3.009  -2.711
   26    HD3  LYS 141           HD1      LYS 141  13.766  -2.272  -4.008
   27    HE2  LYS 141           HE2      LYS 141  16.164  -1.949  -4.353
   28    HE3  LYS 141           HE1      LYS 141  15.333  -0.413  -4.111
   29    HZ1  LYS 141           HZ1      LYS 141  16.902  -1.886  -2.066
   30    HZ2  LYS 141           HZ2      LYS 141  16.074  -0.438  -1.799
   31    HZ3  LYS 141           HZ3      LYS 141  17.382  -0.477  -2.866
   32    H    ARG 142           HN       ARG 142   9.399  -0.309  -1.828
   33    HA   ARG 142           HA       ARG 142  10.060   2.494  -1.755
   34    HB2  ARG 142           HB2      ARG 142  11.435   1.692  -3.652
   35    HB3  ARG 142           HB1      ARG 142   9.982   1.077  -4.425
   36    HG2  ARG 142           HG2      ARG 142   9.102   3.426  -4.426
   37    HG3  ARG 142           HG1      ARG 142  10.704   3.946  -3.894
   38    HD2  ARG 142           HD2      ARG 142  10.001   2.512  -6.445
   39    HD3  ARG 142           HD1      ARG 142  10.586   4.166  -6.280
   40    HE   ARG 142           HE       ARG 142  12.676   3.088  -5.360
   41   HH11  ARG 142          HH11      ARG 142  10.611   1.471  -7.685
   42   HH12  ARG 142          HH12      ARG 142  11.895   0.501  -8.330
   43   HH21  ARG 142          HH21      ARG 142  14.358   1.790  -6.199
   44   HH22  ARG 142          HH22      ARG 142  14.017   0.675  -7.489
   45    H    ARG 143           HN       ARG 143   8.129   0.130  -3.582
   46    HA   ARG 143           HA       ARG 143   5.894   1.889  -3.802
   47    HB2  ARG 143           HB2      ARG 143   6.299  -1.031  -4.409
   48    HB3  ARG 143           HB1      ARG 143   4.730  -0.260  -4.574
   49    HG2  ARG 143           HG2      ARG 143   7.230   0.590  -6.019
   50    HG3  ARG 143           HG1      ARG 143   5.953  -0.420  -6.700
   51    HD2  ARG 143           HD2      ARG 143   5.721   2.439  -5.774
   52    HD3  ARG 143           HD1      ARG 143   5.623   1.845  -7.430
   53    HE   ARG 143           HE       ARG 143   3.641   0.584  -5.885
   54   HH11  ARG 143          HH11      ARG 143   4.408   3.707  -7.266
   55   HH12  ARG 143          HH12      ARG 143   2.751   4.223  -7.327
   56   HH21  ARG 143          HH21      ARG 143   1.471   1.257  -5.964
   57   HH22  ARG 143          HH22      ARG 143   1.084   2.833  -6.583
   58    H    GLN 144           HN       GLN 144   4.164   2.088  -2.538
   59    HA   GLN 144           HA       GLN 144   4.143   0.803   0.035
   60    HB2  GLN 144           HB2      GLN 144   3.436   3.156  -0.273
   61    HB3  GLN 144           HB1      GLN 144   2.095   2.614  -1.266
   62    HG2  GLN 144           HG2      GLN 144   1.252   1.337   0.701
   63    HG3  GLN 144           HG1      GLN 144   2.518   2.100   1.662
   64   HE21  GLN 144          HE21      GLN 144   2.405   4.321   2.071
   65   HE22  GLN 144          HE22      GLN 144   0.930   5.206   1.877
   66    H    THR 145           HN       THR 145   3.067  -1.012   0.566
   67    HA   THR 145           HA       THR 145   1.694  -2.431  -1.518
   68    HB   THR 145           HB       THR 145   1.429  -4.211   0.272
   69    HG1  THR 145           HG1      THR 145   2.224  -3.867   2.232
   70   HG21  THR 145          HG21      THR 145   3.244  -4.264  -1.368
   71   HG22  THR 145          HG22      THR 145   3.790  -4.859   0.200
   72   HG23  THR 145          HG23      THR 145   4.223  -3.232  -0.325
   73    H    SER 146           HN       SER 146  -0.402  -2.501  -1.852
   74    HA   SER 146           HA       SER 146  -2.103  -0.828  -0.258
   75    HB2  SER 146           HB2      SER 146  -2.714  -2.506  -2.700
   76    HB3  SER 146           HB1      SER 146  -3.779  -1.290  -1.995
   77    HG   SER 146           HG       SER 146  -1.668   0.053  -2.305
   78    H    MET 147           HN       MET 147  -2.102  -2.008   1.717
   79    HA   MET 147           HA       MET 147  -3.429  -4.571   1.820
   80    HB2  MET 147           HB2      MET 147  -2.633  -2.643   4.013
   81    HB3  MET 147           HB1      MET 147  -3.288  -4.252   4.284
   82    HG2  MET 147           HG2      MET 147  -1.366  -5.242   3.182
   83    HG3  MET 147           HG1      MET 147  -0.718  -3.640   2.843
   84    HE1  MET 147           HE1      MET 147  -1.145  -5.392   7.095
   85    HE2  MET 147           HE2      MET 147  -1.634  -6.242   5.627
   86    HE3  MET 147           HE3      MET 147  -2.525  -4.817   6.161
   87    H    THR 148           HN       THR 148  -5.379  -4.018   0.740
   88    HA   THR 148           HA       THR 148  -7.580  -3.450   0.611
   89    HB   THR 148           HB       THR 148  -7.499  -2.728   3.550
   90    HG1  THR 148           HG1      THR 148  -6.586  -4.874   3.059
   91   HG21  THR 148          HG21      THR 148  -9.832  -3.485   3.510
   92   HG22  THR 148          HG22      THR 148  -9.689  -3.849   1.791
   93   HG23  THR 148          HG23      THR 148  -9.572  -2.182   2.353
   94    H    ASP 149           HN       ASP 149  -5.542  -1.607   0.031
   95    HA   ASP 149           HA       ASP 149  -6.500   0.991   0.983
   96    HB2  ASP 149           HB2      ASP 149  -4.059   0.418   1.089
   97    HB3  ASP 149           HB1      ASP 149  -4.046   0.353  -0.668
   98    H    PHE 150           HN       PHE 150  -7.621  -0.930  -1.213
   99    HA   PHE 150           HA       PHE 150  -7.244   0.561  -3.641
  100    HB2  PHE 150           HB2      PHE 150  -7.505  -1.860  -3.746
  101    HB3  PHE 150           HB1      PHE 150  -9.100  -1.743  -3.011
  102    HD1  PHE 150           HD1      PHE 150 -11.011  -1.304  -4.318
  103    HD2  PHE 150           HD2      PHE 150  -7.133  -0.895  -6.016
  104    HE1  PHE 150           HE1      PHE 150 -12.016  -1.072  -6.549
  105    HE2  PHE 150           HE2      PHE 150  -8.132  -0.660  -8.251
  106    HZ   PHE 150           HZ       PHE 150 -10.578  -0.747  -8.519
  107    H    TYR 151           HN       TYR 151 -10.041  -0.104  -1.548
  108    HA   TYR 151           HA       TYR 151 -11.707   1.683  -3.072
  109    HB2  TYR 151           HB2      TYR 151 -12.615  -0.373  -2.057
  110    HB3  TYR 151           HB1      TYR 151 -12.255   0.264  -0.457
  111    HD1  TYR 151           HD1      TYR 151 -13.850   1.546   0.678
  112    HD2  TYR 151           HD2      TYR 151 -14.242   0.977  -3.519
  113    HE1  TYR 151           HE1      TYR 151 -16.065   2.610   0.745
  114    HE2  TYR 151           HE2      TYR 151 -16.456   2.041  -3.463
  115    HH   TYR 151           HH       TYR 151 -18.246   2.469  -1.866
  116    H    HIS 152           HN       HIS 152 -10.289   1.668   0.178
  117    HA   HIS 152           HA       HIS 152 -10.389   4.568   0.205
  118    HB2  HIS 152           HB2      HIS 152 -12.555   3.769   1.210
  119    HB3  HIS 152           HB1      HIS 152 -11.614   2.973   2.466
  120    HD1  HIS 152           HD1      HIS 152 -12.887   6.276   1.390
  121    HD2  HIS 152           HD2      HIS 152 -10.371   4.742   4.318
  122    HE1  HIS 152           HE1      HIS 152 -12.545   8.147   3.035
  123    HE2  HIS 152           HE2      HIS 152 -10.932   7.232   4.736
  Start of MODEL   14
    1    H1   GLY 139           HT1      GLY 139  16.314   5.099  -1.477
    2    H2   GLY 139           HT2      GLY 139  15.081   5.707  -0.494
    3    H3   GLY 139           HT3      GLY 139  14.697   4.858  -1.905
    4    HA2  GLY 139           HA1      GLY 139  15.637   2.838  -0.992
    5    HA3  GLY 139           HA2      GLY 139  16.071   3.716   0.466
    6    H    ARG 140           HN       ARG 140  13.080   4.439  -1.147
    7    HA   ARG 140           HA       ARG 140  11.582   3.560   1.161
    8    HB2  ARG 140           HB2      ARG 140   9.672   4.564   0.079
    9    HB3  ARG 140           HB1      ARG 140  11.035   5.662  -0.091
   10    HG2  ARG 140           HG2      ARG 140  11.391   4.867  -2.374
   11    HG3  ARG 140           HG1      ARG 140  10.021   3.772  -2.201
   12    HD2  ARG 140           HD2      ARG 140   8.555   5.719  -1.815
   13    HD3  ARG 140           HD1      ARG 140   9.937   6.783  -2.086
   14    HE   ARG 140           HE       ARG 140   9.716   5.076  -4.284
   15   HH11  ARG 140          HH11      ARG 140   7.941   7.698  -2.794
   16   HH12  ARG 140          HH12      ARG 140   7.195   8.203  -4.276
   17   HH21  ARG 140          HH21      ARG 140   8.732   5.729  -6.234
   18   HH22  ARG 140          HH22      ARG 140   7.643   7.080  -6.234
   19    H    LYS 141           HN       LYS 141   9.787   2.057   1.015
   20    HA   LYS 141           HA       LYS 141   9.633   0.391  -1.351
   21    HB2  LYS 141           HB2      LYS 141  10.771  -0.545   1.225
   22    HB3  LYS 141           HB1      LYS 141   9.657  -1.634   0.407
   23    HG2  LYS 141           HG2      LYS 141  11.032  -1.581  -1.589
   24    HG3  LYS 141           HG1      LYS 141  12.131  -0.435  -0.821
   25    HD2  LYS 141           HD2      LYS 141  12.770  -2.080   0.820
   26    HD3  LYS 141           HD1      LYS 141  11.559  -3.210   0.215
   27    HE2  LYS 141           HE2      LYS 141  13.884  -3.692  -0.544
   28    HE3  LYS 141           HE1      LYS 141  12.725  -3.465  -1.852
   29    HZ1  LYS 141           HZ1      LYS 141  14.861  -2.333  -2.224
   30    HZ2  LYS 141           HZ2      LYS 141  14.577  -1.360  -0.870
   31    HZ3  LYS 141           HZ3      LYS 141  13.551  -1.264  -2.213
   32    H    ARG 142           HN       ARG 142   7.680  -0.267  -1.754
   33    HA   ARG 142           HA       ARG 142   5.678  -0.687   0.296
   34    HB2  ARG 142           HB2      ARG 142   5.338   1.416  -1.863
   35    HB3  ARG 142           HB1      ARG 142   4.017   0.776  -0.902
   36    HG2  ARG 142           HG2      ARG 142   5.021   1.679   1.115
   37    HG3  ARG 142           HG1      ARG 142   6.389   2.282   0.178
   38    HD2  ARG 142           HD2      ARG 142   3.511   3.114  -0.173
   39    HD3  ARG 142           HD1      ARG 142   4.756   4.047   0.653
   40    HE   ARG 142           HE       ARG 142   5.356   3.337  -2.088
   41   HH11  ARG 142          HH11      ARG 142   4.004   5.730   0.081
   42   HH12  ARG 142          HH12      ARG 142   4.220   7.045  -1.032
   43   HH21  ARG 142          HH21      ARG 142   5.632   5.051  -3.551
   44   HH22  ARG 142          HH22      ARG 142   5.143   6.656  -3.105
   45    H    ARG 143           HN       ARG 143   6.872  -2.535  -1.131
   46    HA   ARG 143           HA       ARG 143   5.845  -2.916  -3.772
   47    HB2  ARG 143           HB2      ARG 143   8.105  -3.621  -3.047
   48    HB3  ARG 143           HB1      ARG 143   7.369  -4.817  -1.990
   49    HG2  ARG 143           HG2      ARG 143   6.426  -5.962  -3.914
   50    HG3  ARG 143           HG1      ARG 143   7.123  -4.747  -4.989
   51    HD2  ARG 143           HD2      ARG 143   8.651  -6.611  -3.178
   52    HD3  ARG 143           HD1      ARG 143   8.500  -6.756  -4.928
   53    HE   ARG 143           HE       ARG 143   9.570  -4.336  -4.733
   54   HH11  ARG 143          HH11      ARG 143  10.400  -7.295  -3.063
   55   HH12  ARG 143          HH12      ARG 143  12.081  -6.889  -2.911
   56   HH21  ARG 143          HH21      ARG 143  11.788  -3.787  -4.527
   57   HH22  ARG 143          HH22      ARG 143  12.870  -4.895  -3.746
   58    H    GLN 144           HN       GLN 144   3.655  -3.101  -3.679
   59    HA   GLN 144           HA       GLN 144   1.629  -4.100  -3.521
   60    HB2  GLN 144           HB2      GLN 144   3.198  -6.637  -3.020
   61    HB3  GLN 144           HB1      GLN 144   1.531  -6.533  -3.563
   62    HG2  GLN 144           HG2      GLN 144   3.994  -5.711  -5.081
   63    HG3  GLN 144           HG1      GLN 144   2.931  -7.074  -5.425
   64   HE21  GLN 144          HE21      GLN 144   0.925  -6.695  -6.372
   65   HE22  GLN 144          HE22      GLN 144   0.533  -5.186  -7.120
   66    H    THR 145           HN       THR 145   2.945  -3.049  -1.127
   67    HA   THR 145           HA       THR 145   2.059  -4.763   1.037
   68    HB   THR 145           HB       THR 145   3.240  -1.983   1.193
   69    HG1  THR 145           HG1      THR 145   4.421  -4.552   0.977
   70   HG21  THR 145          HG21      THR 145   3.070  -4.223   3.213
   71   HG22  THR 145          HG22      THR 145   2.134  -2.729   3.245
   72   HG23  THR 145          HG23      THR 145   3.884  -2.678   3.460
   73    H    SER 146           HN       SER 146   0.145  -4.614   1.990
   74    HA   SER 146           HA       SER 146  -1.900  -3.891   2.646
   75    HB2  SER 146           HB2      SER 146  -0.913  -1.093   2.036
   76    HB3  SER 146           HB1      SER 146  -2.268  -1.534   3.074
   77    HG   SER 146           HG       SER 146   0.032  -2.790   3.813
   78    H    MET 147           HN       MET 147  -2.620  -4.995   0.707
   79    HA   MET 147           HA       MET 147  -3.094  -3.463  -1.689
   80    HB2  MET 147           HB2      MET 147  -4.123  -5.540  -2.546
   81    HB3  MET 147           HB1      MET 147  -2.506  -5.799  -1.912
   82    HG2  MET 147           HG2      MET 147  -3.481  -6.686   0.160
   83    HG3  MET 147           HG1      MET 147  -5.092  -6.463  -0.518
   84    HE1  MET 147           HE1      MET 147  -1.724  -8.398  -0.694
   85    HE2  MET 147           HE2      MET 147  -1.786  -7.720  -2.321
   86    HE3  MET 147           HE3      MET 147  -1.954  -9.459  -2.084
   87    H    THR 148           HN       THR 148  -4.294  -2.188   0.324
   88    HA   THR 148           HA       THR 148  -7.044  -2.141  -0.525
   89    HB   THR 148           HB       THR 148  -7.191  -3.808   1.265
   90    HG1  THR 148           HG1      THR 148  -8.270  -1.236   1.724
   91   HG21  THR 148          HG21      THR 148  -5.200  -3.201   2.536
   92   HG22  THR 148          HG22      THR 148  -6.619  -3.237   3.583
   93   HG23  THR 148          HG23      THR 148  -5.964  -1.693   3.037
   94    H    ASP 149           HN       ASP 149  -4.683  -0.490  -0.654
   95    HA   ASP 149           HA       ASP 149  -4.886   1.586   1.330
   96    HB2  ASP 149           HB2      ASP 149  -2.710   0.993   0.369
   97    HB3  ASP 149           HB1      ASP 149  -3.281   1.445  -1.235
   98    H    PHE 150           HN       PHE 150  -5.905   1.084  -1.987
   99    HA   PHE 150           HA       PHE 150  -6.880   3.783  -2.281
  100    HB2  PHE 150           HB2      PHE 150  -7.190   1.306  -3.983
  101    HB3  PHE 150           HB1      PHE 150  -7.924   2.852  -4.392
  102    HD1  PHE 150           HD1      PHE 150  -4.862   0.915  -4.313
  103    HD2  PHE 150           HD2      PHE 150  -6.512   4.779  -4.965
  104    HE1  PHE 150           HE1      PHE 150  -2.786   1.607  -5.432
  105    HE2  PHE 150           HE2      PHE 150  -4.438   5.480  -6.088
  106    HZ   PHE 150           HZ       PHE 150  -2.570   3.890  -6.324
  107    H    TYR 151           HN       TYR 151  -8.137   3.733  -0.308
  108    HA   TYR 151           HA       TYR 151 -10.492   2.072  -0.204
  109    HB2  TYR 151           HB2      TYR 151  -9.149   2.874   1.804
  110    HB3  TYR 151           HB1      TYR 151  -9.851   4.463   1.527
  111    HD1  TYR 151           HD1      TYR 151 -10.649   0.954   2.377
  112    HD2  TYR 151           HD2      TYR 151 -12.048   4.971   2.271
  113    HE1  TYR 151           HE1      TYR 151 -12.595   0.306   3.729
  114    HE2  TYR 151           HE2      TYR 151 -14.000   4.331   3.621
  115    HH   TYR 151           HH       TYR 151 -15.301   2.306   4.137
  116    H    HIS 152           HN       HIS 152 -11.959   2.518  -1.729
  117    HA   HIS 152           HA       HIS 152 -12.524   5.264  -2.492
  118    HB2  HIS 152           HB2      HIS 152 -13.522   2.611  -3.528
  119    HB3  HIS 152           HB1      HIS 152 -14.147   4.153  -4.095
  120    HD1  HIS 152           HD1      HIS 152 -12.860   5.309  -5.901
  121    HD2  HIS 152           HD2      HIS 152 -10.719   2.202  -4.158
  122    HE1  HIS 152           HE1      HIS 152 -10.813   5.017  -7.327
  123    HE2  HIS 152           HE2      HIS 152  -9.454   3.257  -6.156
  Start of MODEL   15
    1    H1   GLY 139           HT1      GLY 139  14.782   3.646  -4.029
    2    H2   GLY 139           HT2      GLY 139  15.179   2.782  -2.636
    3    H3   GLY 139           HT3      GLY 139  15.516   4.436  -2.728
    4    HA2  GLY 139           HA1      GLY 139  13.594   4.116  -1.358
    5    HA3  GLY 139           HA2      GLY 139  13.142   4.919  -2.854
    6    H    ARG 140           HN       ARG 140  12.790   2.111  -0.901
    7    HA   ARG 140           HA       ARG 140  11.335   0.653  -2.947
    8    HB2  ARG 140           HB2      ARG 140  11.990   0.016  -0.070
    9    HB3  ARG 140           HB1      ARG 140  11.005  -1.026  -1.087
   10    HG2  ARG 140           HG2      ARG 140  13.838  -0.218  -1.698
   11    HG3  ARG 140           HG1      ARG 140  13.360  -1.740  -0.943
   12    HD2  ARG 140           HD2      ARG 140  12.094  -2.357  -2.911
   13    HD3  ARG 140           HD1      ARG 140  12.443  -0.798  -3.658
   14    HE   ARG 140           HE       ARG 140  14.902  -1.775  -3.215
   15   HH11  ARG 140          HH11      ARG 140  12.058  -3.209  -4.680
   16   HH12  ARG 140          HH12      ARG 140  12.967  -4.208  -5.767
   17   HH21  ARG 140          HH21      ARG 140  16.097  -3.085  -4.658
   18   HH22  ARG 140          HH22      ARG 140  15.261  -4.137  -5.754
   19    H    LYS 141           HN       LYS 141   9.444   1.604  -3.395
   20    HA   LYS 141           HA       LYS 141   7.769   2.730  -1.351
   21    HB2  LYS 141           HB2      LYS 141   7.878   3.629  -3.667
   22    HB3  LYS 141           HB1      LYS 141   7.136   2.147  -4.249
   23    HG2  LYS 141           HG2      LYS 141   5.094   2.633  -3.132
   24    HG3  LYS 141           HG1      LYS 141   5.825   3.978  -2.256
   25    HD2  LYS 141           HD2      LYS 141   4.457   4.802  -4.089
   26    HD3  LYS 141           HD1      LYS 141   6.156   5.171  -4.377
   27    HE2  LYS 141           HE2      LYS 141   5.118   4.401  -6.423
   28    HE3  LYS 141           HE1      LYS 141   6.304   3.222  -5.870
   29    HZ1  LYS 141           HZ1      LYS 141   4.169   2.262  -6.648
   30    HZ2  LYS 141           HZ2      LYS 141   3.398   2.998  -5.336
   31    HZ3  LYS 141           HZ3      LYS 141   4.580   1.821  -5.067
   32    H    ARG 142           HN       ARG 142   8.148  -0.334  -2.890
   33    HA   ARG 142           HA       ARG 142   5.622  -1.384  -2.005
   34    HB2  ARG 142           HB2      ARG 142   6.738  -2.365  -3.956
   35    HB3  ARG 142           HB1      ARG 142   8.111  -2.817  -2.954
   36    HG2  ARG 142           HG2      ARG 142   6.663  -4.300  -1.648
   37    HG3  ARG 142           HG1      ARG 142   5.297  -3.854  -2.672
   38    HD2  ARG 142           HD2      ARG 142   7.827  -5.205  -3.603
   39    HD3  ARG 142           HD1      ARG 142   6.279  -6.003  -3.329
   40    HE   ARG 142           HE       ARG 142   5.790  -3.954  -5.114
   41   HH11  ARG 142          HH11      ARG 142   7.748  -6.848  -5.011
   42   HH12  ARG 142          HH12      ARG 142   7.717  -7.088  -6.732
   43   HH21  ARG 142          HH21      ARG 142   5.721  -4.276  -7.369
   44   HH22  ARG 142          HH22      ARG 142   6.563  -5.620  -8.073
   45    H    ARG 143           HN       ARG 143   5.305  -1.387   0.112
   46    HA   ARG 143           HA       ARG 143   6.937  -3.064   1.786
   47    HB2  ARG 143           HB2      ARG 143   8.099  -0.855   1.873
   48    HB3  ARG 143           HB1      ARG 143   6.614  -0.136   2.479
   49    HG2  ARG 143           HG2      ARG 143   6.735  -1.521   4.473
   50    HG3  ARG 143           HG1      ARG 143   8.199  -2.295   3.857
   51    HD2  ARG 143           HD2      ARG 143   7.850   0.614   4.567
   52    HD3  ARG 143           HD1      ARG 143   8.804  -0.580   5.447
   53    HE   ARG 143           HE       ARG 143  10.055  -0.711   3.169
   54   HH11  ARG 143          HH11      ARG 143   8.805   2.160   4.730
   55   HH12  ARG 143          HH12      ARG 143   9.933   3.229   3.961
   56   HH21  ARG 143          HH21      ARG 143  11.545   0.695   2.152
   57   HH22  ARG 143          HH22      ARG 143  11.492   2.396   2.490
   58    H    GLN 144           HN       GLN 144   5.340  -4.300   2.521
   59    HA   GLN 144           HA       GLN 144   3.357  -4.991   3.381
   60    HB2  GLN 144           HB2      GLN 144   3.278  -2.198   4.547
   61    HB3  GLN 144           HB1      GLN 144   2.216  -3.517   5.016
   62    HG2  GLN 144           HG2      GLN 144   5.207  -3.450   5.350
   63    HG3  GLN 144           HG1      GLN 144   4.013  -3.203   6.623
   64   HE21  GLN 144          HE21      GLN 144   5.586  -5.510   4.575
   65   HE22  GLN 144          HE22      GLN 144   4.993  -6.926   5.371
   66    H    THR 145           HN       THR 145   3.258  -4.381   0.814
   67    HA   THR 145           HA       THR 145   1.205  -2.434   0.250
   68    HB   THR 145           HB       THR 145   1.570  -3.419  -2.142
   69    HG1  THR 145           HG1      THR 145   2.870  -5.103  -2.002
   70   HG21  THR 145          HG21      THR 145   2.284  -1.194  -1.456
   71   HG22  THR 145          HG22      THR 145   3.527  -1.962  -2.444
   72   HG23  THR 145          HG23      THR 145   3.721  -1.874  -0.694
   73    H    SER 146           HN       SER 146  -0.802  -2.837  -0.526
   74    HA   SER 146           HA       SER 146  -1.797  -5.501  -0.964
   75    HB2  SER 146           HB2      SER 146  -1.798  -5.350   1.520
   76    HB3  SER 146           HB1      SER 146  -2.771  -3.885   1.419
   77    HG   SER 146           HG       SER 146  -4.175  -5.548   1.773
   78    H    MET 147           HN       MET 147  -4.322  -5.250  -1.259
   79    HA   MET 147           HA       MET 147  -4.705  -3.096  -3.135
   80    HB2  MET 147           HB2      MET 147  -6.907  -4.126  -3.532
   81    HB3  MET 147           HB1      MET 147  -5.595  -5.287  -3.662
   82    HG2  MET 147           HG2      MET 147  -6.100  -6.108  -1.420
   83    HG3  MET 147           HG1      MET 147  -7.420  -4.947  -1.296
   84    HE1  MET 147           HE1      MET 147  -6.332  -7.057  -4.469
   85    HE2  MET 147           HE2      MET 147  -7.334  -8.491  -4.254
   86    HE3  MET 147           HE3      MET 147  -6.052  -8.130  -3.098
   87    H    THR 148           HN       THR 148  -4.467  -2.709  -0.160
   88    HA   THR 148           HA       THR 148  -6.945  -1.421   0.593
   89    HB   THR 148           HB       THR 148  -4.259  -1.419   1.997
   90    HG1  THR 148           HG1      THR 148  -5.410  -3.154   3.246
   91   HG21  THR 148          HG21      THR 148  -5.792   0.268   2.858
   92   HG22  THR 148          HG22      THR 148  -5.597  -1.038   4.027
   93   HG23  THR 148          HG23      THR 148  -7.055  -0.949   3.038
   94    H    ASP 149           HN       ASP 149  -4.565  -0.647  -1.479
   95    HA   ASP 149           HA       ASP 149  -3.841   1.971  -0.535
   96    HB2  ASP 149           HB2      ASP 149  -2.477   2.128  -2.517
   97    HB3  ASP 149           HB1      ASP 149  -2.271   0.532  -1.804
   98    H    PHE 150           HN       PHE 150  -6.549   0.829  -2.112
   99    HA   PHE 150           HA       PHE 150  -6.912   3.103  -3.861
  100    HB2  PHE 150           HB2      PHE 150  -8.761   0.822  -3.146
  101    HB3  PHE 150           HB1      PHE 150  -9.150   2.086  -4.306
  102    HD1  PHE 150           HD1      PHE 150  -8.200   2.094  -6.493
  103    HD2  PHE 150           HD2      PHE 150  -6.996  -0.812  -3.629
  104    HE1  PHE 150           HE1      PHE 150  -7.100   0.800  -8.274
  105    HE2  PHE 150           HE2      PHE 150  -5.891  -2.106  -5.401
  106    HZ   PHE 150           HZ       PHE 150  -5.944  -1.303  -7.728
  107    H    TYR 151           HN       TYR 151  -8.868   1.787  -1.172
  108    HA   TYR 151           HA       TYR 151  -9.048   4.378   0.050
  109    HB2  TYR 151           HB2      TYR 151 -10.747   4.571  -1.753
  110    HB3  TYR 151           HB1      TYR 151 -11.581   3.172  -1.085
  111    HD1  TYR 151           HD1      TYR 151 -13.161   3.435   0.633
  112    HD2  TYR 151           HD2      TYR 151 -10.514   6.640  -0.276
  113    HE1  TYR 151           HE1      TYR 151 -14.433   4.906   2.137
  114    HE2  TYR 151           HE2      TYR 151 -11.780   8.118   1.227
  115    HH   TYR 151           HH       TYR 151 -14.037   6.970   3.454
  116    H    HIS 152           HN       HIS 152 -10.651   1.197  -0.125
  117    HA   HIS 152           HA       HIS 152 -11.008   1.205   2.756
  118    HB2  HIS 152           HB2      HIS 152 -12.816   0.329   1.327
  119    HB3  HIS 152           HB1      HIS 152 -11.732  -0.922   0.728
  120    HD1  HIS 152           HD1      HIS 152 -12.307  -3.081   1.785
  121    HD2  HIS 152           HD2      HIS 152 -12.715   0.091   4.442
  122    HE1  HIS 152           HE1      HIS 152 -13.022  -4.109   3.964
  123    HE2  HIS 152           HE2      HIS 152 -13.407  -2.158   5.507
  Start of MODEL   16
    1    H1   GLY 139           HT1      GLY 139   5.570  -6.743  -1.791
    2    H2   GLY 139           HT2      GLY 139   6.372  -7.733  -0.684
    3    H3   GLY 139           HT3      GLY 139   6.977  -7.556  -2.250
    4    HA2  GLY 139           HA1      GLY 139   8.277  -6.263  -0.685
    5    HA3  GLY 139           HA2      GLY 139   7.461  -5.237  -1.857
    6    H    ARG 140           HN       ARG 140   8.408  -4.476   0.753
    7    HA   ARG 140           HA       ARG 140   5.872  -3.974   2.156
    8    HB2  ARG 140           HB2      ARG 140   8.688  -3.691   3.220
    9    HB3  ARG 140           HB1      ARG 140   7.203  -3.515   4.142
   10    HG2  ARG 140           HG2      ARG 140   8.125  -6.055   2.812
   11    HG3  ARG 140           HG1      ARG 140   8.305  -5.675   4.524
   12    HD2  ARG 140           HD2      ARG 140   5.920  -5.615   4.817
   13    HD3  ARG 140           HD1      ARG 140   5.659  -5.800   3.083
   14    HE   ARG 140           HE       ARG 140   7.048  -8.012   3.664
   15   HH11  ARG 140          HH11      ARG 140   4.289  -6.558   5.243
   16   HH12  ARG 140          HH12      ARG 140   3.630  -8.071   5.772
   17   HH21  ARG 140          HH21      ARG 140   6.180 -10.015   4.341
   18   HH22  ARG 140          HH22      ARG 140   4.702 -10.039   5.253
   19    H    LYS 141           HN       LYS 141   8.970  -2.335   1.481
   20    HA   LYS 141           HA       LYS 141   7.452   0.133   1.008
   21    HB2  LYS 141           HB2      LYS 141   9.183   1.424   2.203
   22    HB3  LYS 141           HB1      LYS 141   8.330   0.307   3.259
   23    HG2  LYS 141           HG2      LYS 141  10.201  -1.252   3.132
   24    HG3  LYS 141           HG1      LYS 141  11.058  -0.136   2.065
   25    HD2  LYS 141           HD2      LYS 141  11.041   1.556   3.835
   26    HD3  LYS 141           HD1      LYS 141  10.191   0.435   4.898
   27    HE2  LYS 141           HE2      LYS 141  12.082  -1.094   4.824
   28    HE3  LYS 141           HE1      LYS 141  12.928  -0.014   3.715
   29    HZ1  LYS 141           HZ1      LYS 141  12.127   0.660   6.494
   30    HZ2  LYS 141           HZ2      LYS 141  12.971   1.668   5.433
   31    HZ3  LYS 141           HZ3      LYS 141  13.692   0.248   5.997
   32    H    ARG 142           HN       ARG 142   9.122  -2.019  -0.538
   33    HA   ARG 142           HA       ARG 142  11.121  -0.406  -1.841
   34    HB2  ARG 142           HB2      ARG 142   9.987  -3.140  -2.373
   35    HB3  ARG 142           HB1      ARG 142  11.088  -2.370  -3.505
   36    HG2  ARG 142           HG2      ARG 142  12.783  -2.220  -1.748
   37    HG3  ARG 142           HG1      ARG 142  11.675  -2.998  -0.620
   38    HD2  ARG 142           HD2      ARG 142  11.632  -4.991  -2.032
   39    HD3  ARG 142           HD1      ARG 142  12.726  -4.210  -3.173
   40    HE   ARG 142           HE       ARG 142  13.699  -4.413  -0.452
   41   HH11  ARG 142          HH11      ARG 142  13.572  -5.885  -3.617
   42   HH12  ARG 142          HH12      ARG 142  15.029  -6.796  -3.394
   43   HH21  ARG 142          HH21      ARG 142  15.614  -5.631  -0.142
   44   HH22  ARG 142          HH22      ARG 142  16.196  -6.648  -1.423
   45    H    ARG 143           HN       ARG 143   7.794  -0.879  -2.081
   46    HA   ARG 143           HA       ARG 143   7.587   0.989  -4.290
   47    HB2  ARG 143           HB2      ARG 143   6.350  -1.776  -4.362
   48    HB3  ARG 143           HB1      ARG 143   5.877  -0.466  -5.430
   49    HG2  ARG 143           HG2      ARG 143   8.075  -0.435  -6.428
   50    HG3  ARG 143           HG1      ARG 143   8.638  -1.657  -5.287
   51    HD2  ARG 143           HD2      ARG 143   6.406  -2.060  -7.273
   52    HD3  ARG 143           HD1      ARG 143   8.076  -2.562  -7.531
   53    HE   ARG 143           HE       ARG 143   6.993  -3.620  -5.104
   54   HH11  ARG 143          HH11      ARG 143   7.102  -4.065  -8.570
   55   HH12  ARG 143          HH12      ARG 143   6.770  -5.764  -8.493
   56   HH21  ARG 143          HH21      ARG 143   6.581  -5.869  -4.996
   57   HH22  ARG 143          HH22      ARG 143   6.467  -6.792  -6.460
   58    H    GLN 144           HN       GLN 144   7.097   0.716  -1.383
   59    HA   GLN 144           HA       GLN 144   5.618   1.261   0.228
   60    HB2  GLN 144           HB2      GLN 144   3.980   2.222  -2.120
   61    HB3  GLN 144           HB1      GLN 144   3.517   2.466  -0.441
   62    HG2  GLN 144           HG2      GLN 144   5.572   3.735  -0.060
   63    HG3  GLN 144           HG1      GLN 144   6.026   3.494  -1.745
   64   HE21  GLN 144          HE21      GLN 144   4.945   4.616  -3.347
   65   HE22  GLN 144          HE22      GLN 144   3.940   5.983  -3.006
   66    H    THR 145           HN       THR 145   3.470   0.688   1.156
   67    HA   THR 145           HA       THR 145   2.892  -2.075   0.492
   68    HB   THR 145           HB       THR 145   1.738  -0.355   2.699
   69    HG1  THR 145           HG1      THR 145   4.218  -1.278   2.402
   70   HG21  THR 145          HG21      THR 145   1.851  -3.356   2.380
   71   HG22  THR 145          HG22      THR 145   0.412  -2.356   2.201
   72   HG23  THR 145          HG23      THR 145   1.202  -2.489   3.770
   73    H    SER 146           HN       SER 146   1.428  -2.491  -1.049
   74    HA   SER 146           HA       SER 146  -0.499  -0.502  -1.829
   75    HB2  SER 146           HB2      SER 146  -0.076  -3.318  -2.854
   76    HB3  SER 146           HB1      SER 146  -1.078  -2.083  -3.617
   77    HG   SER 146           HG       SER 146   1.019  -0.807  -3.520
   78    H    MET 147           HN       MET 147  -0.504  -2.623   0.627
   79    HA   MET 147           HA       MET 147  -3.192  -3.633   0.427
   80    HB2  MET 147           HB2      MET 147  -1.239  -3.573   2.735
   81    HB3  MET 147           HB1      MET 147  -2.810  -4.356   2.795
   82    HG2  MET 147           HG2      MET 147  -0.557  -5.075   0.933
   83    HG3  MET 147           HG1      MET 147  -1.014  -5.952   2.392
   84    HE1  MET 147           HE1      MET 147  -4.549  -7.336   1.450
   85    HE2  MET 147           HE2      MET 147  -4.220  -5.800   2.250
   86    HE3  MET 147           HE3      MET 147  -3.298  -7.239   2.690
   87    H    THR 148           HN       THR 148  -3.820  -1.278  -0.049
   88    HA   THR 148           HA       THR 148  -5.203  -0.312   2.274
   89    HB   THR 148           HB       THR 148  -3.112   0.852   2.640
   90    HG1  THR 148           HG1      THR 148  -3.922   3.044   2.485
   91   HG21  THR 148          HG21      THR 148  -3.427   1.950  -0.157
   92   HG22  THR 148          HG22      THR 148  -2.223   0.771   0.364
   93   HG23  THR 148          HG23      THR 148  -2.181   2.414   1.002
   94    H    ASP 149           HN       ASP 149  -4.451  -0.157  -1.132
   95    HA   ASP 149           HA       ASP 149  -6.586   1.668  -1.747
   96    HB2  ASP 149           HB2      ASP 149  -4.599   0.138  -3.382
   97    HB3  ASP 149           HB1      ASP 149  -6.012   0.840  -4.164
   98    H    PHE 150           HN       PHE 150  -8.312   0.605  -0.810
   99    HA   PHE 150           HA       PHE 150  -9.731  -1.124  -2.607
  100    HB2  PHE 150           HB2      PHE 150  -8.477  -2.826  -1.388
  101    HB3  PHE 150           HB1      PHE 150  -8.970  -2.128   0.150
  102    HD1  PHE 150           HD1      PHE 150 -10.363  -3.673  -2.935
  103    HD2  PHE 150           HD2      PHE 150 -10.852  -2.930   1.228
  104    HE1  PHE 150           HE1      PHE 150 -12.342  -5.133  -2.909
  105    HE2  PHE 150           HE2      PHE 150 -12.831  -4.389   1.260
  106    HZ   PHE 150           HZ       PHE 150 -13.580  -5.492  -0.812
  107    H    TYR 151           HN       TYR 151  -9.474   0.546   0.449
  108    HA   TYR 151           HA       TYR 151 -12.315   0.566   0.919
  109    HB2  TYR 151           HB2      TYR 151 -10.221   2.225   2.325
  110    HB3  TYR 151           HB1      TYR 151 -11.797   1.730   2.937
  111    HD1  TYR 151           HD1      TYR 151  -8.325   0.925   2.735
  112    HD2  TYR 151           HD2      TYR 151 -12.176  -0.772   3.342
  113    HE1  TYR 151           HE1      TYR 151  -7.283  -1.053   3.752
  114    HE2  TYR 151           HE2      TYR 151 -11.144  -2.755   4.368
  115    HH   TYR 151           HH       TYR 151  -8.911  -3.925   4.262
  116    H    HIS 152           HN       HIS 152 -13.029   1.575  -1.007
  117    HA   HIS 152           HA       HIS 152 -12.161   4.284  -1.566
  118    HB2  HIS 152           HB2      HIS 152 -12.584   2.667  -3.406
  119    HB3  HIS 152           HB1      HIS 152 -14.278   2.601  -2.931
  120    HD1  HIS 152           HD1      HIS 152 -11.738   5.093  -4.242
  121    HD2  HIS 152           HD2      HIS 152 -15.849   4.503  -4.088
  122    HE1  HIS 152           HE1      HIS 152 -12.734   6.887  -5.693
  123    HE2  HIS 152           HE2      HIS 152 -15.224   6.622  -5.433
  Start of MODEL   17
    1    H1   GLY 139           HT1      GLY 139  11.895   5.268  -0.508
    2    H2   GLY 139           HT2      GLY 139  13.327   5.924  -1.121
    3    H3   GLY 139           HT3      GLY 139  12.965   6.068   0.524
    4    HA2  GLY 139           HA1      GLY 139  14.641   4.365   0.129
    5    HA3  GLY 139           HA2      GLY 139  13.174   3.712   0.845
    6    H    ARG 140           HN       ARG 140  14.058   1.686  -0.056
    7    HA   ARG 140           HA       ARG 140  13.453   1.410  -2.923
    8    HB2  ARG 140           HB2      ARG 140  14.815  -0.626  -2.870
    9    HB3  ARG 140           HB1      ARG 140  15.736   0.765  -2.317
   10    HG2  ARG 140           HG2      ARG 140  15.383   0.067   0.004
   11    HG3  ARG 140           HG1      ARG 140  14.474  -1.334  -0.565
   12    HD2  ARG 140           HD2      ARG 140  16.462  -2.130  -1.755
   13    HD3  ARG 140           HD1      ARG 140  17.369  -0.737  -1.169
   14    HE   ARG 140           HE       ARG 140  16.181  -2.296   0.932
   15   HH11  ARG 140          HH11      ARG 140  18.951  -1.975  -1.175
   16   HH12  ARG 140          HH12      ARG 140  20.023  -2.827  -0.111
   17   HH21  ARG 140          HH21      ARG 140  17.581  -3.445   2.330
   18   HH22  ARG 140          HH22      ARG 140  19.241  -3.672   1.881
   19    H    LYS 141           HN       LYS 141  12.195   0.861   0.096
   20    HA   LYS 141           HA       LYS 141  10.740  -1.553  -0.713
   21    HB2  LYS 141           HB2      LYS 141  11.997  -1.639   1.415
   22    HB3  LYS 141           HB1      LYS 141  11.038  -0.297   2.019
   23    HG2  LYS 141           HG2      LYS 141   9.016  -1.680   1.844
   24    HG3  LYS 141           HG1      LYS 141  10.009  -3.031   1.289
   25    HD2  LYS 141           HD2      LYS 141  11.264  -2.957   3.400
   26    HD3  LYS 141           HD1      LYS 141  10.238  -1.630   3.951
   27    HE2  LYS 141           HE2      LYS 141   8.279  -3.084   3.801
   28    HE3  LYS 141           HE1      LYS 141   9.302  -4.405   3.240
   29    HZ1  LYS 141           HZ1      LYS 141  10.471  -4.356   5.339
   30    HZ2  LYS 141           HZ2      LYS 141   8.816  -4.578   5.602
   31    HZ3  LYS 141           HZ3      LYS 141   9.522  -3.067   5.877
   32    H    ARG 142           HN       ARG 142   8.572  -1.556  -0.934
   33    HA   ARG 142           HA       ARG 142   6.902   0.498   0.177
   34    HB2  ARG 142           HB2      ARG 142   7.662   1.655  -1.857
   35    HB3  ARG 142           HB1      ARG 142   7.153   0.286  -2.835
   36    HG2  ARG 142           HG2      ARG 142   4.825   0.665  -2.031
   37    HG3  ARG 142           HG1      ARG 142   5.391   2.138  -1.245
   38    HD2  ARG 142           HD2      ARG 142   6.071   3.049  -3.391
   39    HD3  ARG 142           HD1      ARG 142   5.603   1.551  -4.197
   40    HE   ARG 142           HE       ARG 142   3.476   2.801  -2.706
   41   HH11  ARG 142          HH11      ARG 142   5.111   2.668  -5.805
   42   HH12  ARG 142          HH12      ARG 142   3.738   3.260  -6.688
   43   HH21  ARG 142          HH21      ARG 142   1.683   3.563  -3.868
   44   HH22  ARG 142          HH22      ARG 142   1.791   3.760  -5.588
   45    H    ARG 143           HN       ARG 143   5.623  -0.992   1.114
   46    HA   ARG 143           HA       ARG 143   4.861  -3.399  -0.262
   47    HB2  ARG 143           HB2      ARG 143   3.998  -2.271   2.403
   48    HB3  ARG 143           HB1      ARG 143   3.537  -3.853   1.789
   49    HG2  ARG 143           HG2      ARG 143   5.860  -4.552   1.781
   50    HG3  ARG 143           HG1      ARG 143   6.357  -2.955   2.340
   51    HD2  ARG 143           HD2      ARG 143   4.577  -4.880   3.823
   52    HD3  ARG 143           HD1      ARG 143   6.271  -4.551   4.181
   53    HE   ARG 143           HE       ARG 143   5.336  -2.130   4.446
   54   HH11  ARG 143          HH11      ARG 143   3.804  -5.114   5.447
   55   HH12  ARG 143          HH12      ARG 143   2.960  -4.382   6.774
   56   HH21  ARG 143          HH21      ARG 143   4.227  -1.168   6.203
   57   HH22  ARG 143          HH22      ARG 143   3.217  -2.149   7.215
   58    H    GLN 144           HN       GLN 144   3.322  -3.438  -1.726
   59    HA   GLN 144           HA       GLN 144   1.171  -1.505  -1.749
   60    HB2  GLN 144           HB2      GLN 144   1.694  -3.924  -3.488
   61    HB3  GLN 144           HB1      GLN 144   0.419  -2.744  -3.760
   62    HG2  GLN 144           HG2      GLN 144   2.082  -1.005  -4.101
   63    HG3  GLN 144           HG1      GLN 144   3.373  -2.163  -3.790
   64   HE21  GLN 144          HE21      GLN 144   3.863  -3.710  -5.332
   65   HE22  GLN 144          HE22      GLN 144   3.282  -3.613  -6.957
   66    H    THR 145           HN       THR 145   1.385  -3.220   0.544
   67    HA   THR 145           HA       THR 145  -0.702  -5.206   0.341
   68    HB   THR 145           HB       THR 145   0.737  -4.251   2.819
   69    HG1  THR 145           HG1      THR 145   2.186  -5.970   2.398
   70   HG21  THR 145          HG21      THR 145  -1.295  -5.578   3.214
   71   HG22  THR 145          HG22      THR 145   0.154  -6.453   3.703
   72   HG23  THR 145          HG23      THR 145  -0.652  -6.860   2.188
   73    H    SER 146           HN       SER 146  -2.682  -4.381   0.162
   74    HA   SER 146           HA       SER 146  -4.663  -3.490   0.779
   75    HB2  SER 146           HB2      SER 146  -3.306  -2.606   3.333
   76    HB3  SER 146           HB1      SER 146  -5.041  -2.751   3.049
   77    HG   SER 146           HG       SER 146  -4.853  -4.948   2.964
   78    H    MET 147           HN       MET 147  -1.808  -1.502   1.011
   79    HA   MET 147           HA       MET 147  -3.283   0.982   0.887
   80    HB2  MET 147           HB2      MET 147  -0.336   0.350   0.878
   81    HB3  MET 147           HB1      MET 147  -0.966   1.985   0.730
   82    HG2  MET 147           HG2      MET 147  -2.046   1.779   2.900
   83    HG3  MET 147           HG1      MET 147  -1.453   0.128   3.049
   84    HE1  MET 147           HE1      MET 147   2.355   0.565   3.521
   85    HE2  MET 147           HE2      MET 147   1.468   0.155   2.053
   86    HE3  MET 147           HE3      MET 147   0.983  -0.540   3.600
   87    H    THR 148           HN       THR 148  -3.740  -0.767  -1.305
   88    HA   THR 148           HA       THR 148  -3.246   1.132  -3.421
   89    HB   THR 148           HB       THR 148  -2.252  -1.716  -3.716
   90    HG1  THR 148           HG1      THR 148  -1.048   0.545  -2.882
   91   HG21  THR 148          HG21      THR 148  -1.518  -0.990  -5.958
   92   HG22  THR 148          HG22      THR 148  -2.322   0.560  -5.706
   93   HG23  THR 148          HG23      THR 148  -3.272  -0.925  -5.783
   94    H    ASP 149           HN       ASP 149  -4.546  -2.008  -2.464
   95    HA   ASP 149           HA       ASP 149  -6.588  -1.977  -4.496
   96    HB2  ASP 149           HB2      ASP 149  -6.045  -3.781  -2.137
   97    HB3  ASP 149           HB1      ASP 149  -7.464  -3.969  -3.159
   98    H    PHE 150           HN       PHE 150  -6.739  -2.076  -0.949
   99    HA   PHE 150           HA       PHE 150  -9.430  -1.027  -1.007
  100    HB2  PHE 150           HB2      PHE 150  -7.666  -1.813   1.321
  101    HB3  PHE 150           HB1      PHE 150  -9.364  -1.368   1.442
  102    HD1  PHE 150           HD1      PHE 150 -11.056  -2.792   0.196
  103    HD2  PHE 150           HD2      PHE 150  -7.041  -4.013   0.893
  104    HE1  PHE 150           HE1      PHE 150 -11.703  -5.133  -0.194
  105    HE2  PHE 150           HE2      PHE 150  -7.681  -6.354   0.505
  106    HZ   PHE 150           HZ       PHE 150 -10.015  -6.917  -0.041
  107    H    TYR 151           HN       TYR 151  -9.639   1.100  -1.315
  108    HA   TYR 151           HA       TYR 151  -7.658   2.957  -0.339
  109    HB2  TYR 151           HB2      TYR 151 -10.270   3.340  -1.805
  110    HB3  TYR 151           HB1      TYR 151  -9.259   4.680  -1.275
  111    HD1  TYR 151           HD1      TYR 151  -9.504   1.832  -3.587
  112    HD2  TYR 151           HD2      TYR 151  -7.197   5.197  -2.389
  113    HE1  TYR 151           HE1      TYR 151  -8.164   1.638  -5.639
  114    HE2  TYR 151           HE2      TYR 151  -5.853   5.013  -4.438
  115    HH   TYR 151           HH       TYR 151  -6.753   3.191  -7.072
  116    H    HIS 152           HN       HIS 152  -7.992   4.550   1.192
  117    HA   HIS 152           HA       HIS 152  -8.595   5.341   3.227
  118    HB2  HIS 152           HB2      HIS 152 -11.327   4.336   2.402
  119    HB3  HIS 152           HB1      HIS 152 -11.023   5.283   3.854
  120    HD1  HIS 152           HD1      HIS 152 -10.234   7.786   3.466
  121    HD2  HIS 152           HD2      HIS 152 -11.586   5.782   0.084
  122    HE1  HIS 152           HE1      HIS 152 -10.689   9.574   1.759
  123    HE2  HIS 152           HE2      HIS 152 -11.690   8.353  -0.204
  Start of MODEL   18
    1    H1   GLY 139           HT1      GLY 139  10.384   1.421   6.472
    2    H2   GLY 139           HT2      GLY 139  10.503   0.006   5.558
    3    H3   GLY 139           HT3      GLY 139   9.028   0.821   5.658
    4    HA2  GLY 139           HA1      GLY 139   9.940   2.705   4.478
    5    HA3  GLY 139           HA2      GLY 139  11.491   1.879   4.395
    6    H    ARG 140           HN       ARG 140  11.343   2.095   2.100
    7    HA   ARG 140           HA       ARG 140  10.976   1.325   0.007
    8    HB2  ARG 140           HB2      ARG 140  11.700  -0.795   1.160
    9    HB3  ARG 140           HB1      ARG 140  10.003  -1.198   1.351
   10    HG2  ARG 140           HG2      ARG 140   9.699  -1.373  -1.007
   11    HG3  ARG 140           HG1      ARG 140  11.309  -0.719  -1.315
   12    HD2  ARG 140           HD2      ARG 140  10.731  -3.300   0.128
   13    HD3  ARG 140           HD1      ARG 140  11.199  -3.177  -1.567
   14    HE   ARG 140           HE       ARG 140  13.198  -1.878  -0.325
   15   HH11  ARG 140          HH11      ARG 140  11.730  -5.002   0.274
   16   HH12  ARG 140          HH12      ARG 140  13.194  -5.712   0.873
   17   HH21  ARG 140          HH21      ARG 140  15.120  -2.811   0.490
   18   HH22  ARG 140          HH22      ARG 140  15.117  -4.469   1.001
   19    H    LYS 141           HN       LYS 141   9.056   2.964   0.896
   20    HA   LYS 141           HA       LYS 141   6.435   1.819   0.536
   21    HB2  LYS 141           HB2      LYS 141   7.325   4.694   0.807
   22    HB3  LYS 141           HB1      LYS 141   5.649   4.164   0.764
   23    HG2  LYS 141           HG2      LYS 141   6.088   2.807   2.798
   24    HG3  LYS 141           HG1      LYS 141   7.704   3.512   2.861
   25    HD2  LYS 141           HD2      LYS 141   6.738   5.740   3.063
   26    HD3  LYS 141           HD1      LYS 141   5.113   5.055   2.965
   27    HE2  LYS 141           HE2      LYS 141   5.617   3.733   5.010
   28    HE3  LYS 141           HE1      LYS 141   7.157   4.584   5.130
   29    HZ1  LYS 141           HZ1      LYS 141   4.466   5.830   5.234
   30    HZ2  LYS 141           HZ2      LYS 141   5.934   6.664   5.307
   31    HZ3  LYS 141           HZ3      LYS 141   5.508   5.599   6.545
   32    H    ARG 142           HN       ARG 142   6.286   1.025  -1.497
   33    HA   ARG 142           HA       ARG 142   5.797   2.887  -3.615
   34    HB2  ARG 142           HB2      ARG 142   8.297   2.653  -3.644
   35    HB3  ARG 142           HB1      ARG 142   8.082   0.940  -3.975
   36    HG2  ARG 142           HG2      ARG 142   6.845   1.561  -6.041
   37    HG3  ARG 142           HG1      ARG 142   7.267   3.246  -5.726
   38    HD2  ARG 142           HD2      ARG 142   9.171   0.959  -6.205
   39    HD3  ARG 142           HD1      ARG 142   8.836   2.301  -7.297
   40    HE   ARG 142           HE       ARG 142   9.710   3.523  -5.031
   41   HH11  ARG 142          HH11      ARG 142  11.010   0.995  -7.073
   42   HH12  ARG 142          HH12      ARG 142  12.664   1.397  -6.732
   43   HH21  ARG 142          HH21      ARG 142  11.884   4.045  -4.576
   44   HH22  ARG 142          HH22      ARG 142  13.163   3.128  -5.314
   45    H    ARG 143           HN       ARG 143   6.429  -0.449  -2.686
   46    HA   ARG 143           HA       ARG 143   3.956  -1.348  -3.825
   47    HB2  ARG 143           HB2      ARG 143   5.350  -1.335  -5.832
   48    HB3  ARG 143           HB1      ARG 143   6.590  -2.262  -5.001
   49    HG2  ARG 143           HG2      ARG 143   5.019  -4.144  -4.804
   50    HG3  ARG 143           HG1      ARG 143   3.823  -3.212  -5.710
   51    HD2  ARG 143           HD2      ARG 143   5.021  -4.783  -7.156
   52    HD3  ARG 143           HD1      ARG 143   5.326  -3.111  -7.622
   53    HE   ARG 143           HE       ARG 143   7.284  -4.299  -5.840
   54   HH11  ARG 143          HH11      ARG 143   6.389  -3.617  -9.154
   55   HH12  ARG 143          HH12      ARG 143   8.013  -3.723  -9.747
   56   HH21  ARG 143          HH21      ARG 143   9.423  -4.436  -6.617
   57   HH22  ARG 143          HH22      ARG 143   9.741  -4.182  -8.305
   58    H    GLN 144           HN       GLN 144   3.201  -2.850  -2.483
   59    HA   GLN 144           HA       GLN 144   4.911  -4.887  -1.368
   60    HB2  GLN 144           HB2      GLN 144   4.463  -4.426   0.961
   61    HB3  GLN 144           HB1      GLN 144   5.204  -3.009   0.237
   62    HG2  GLN 144           HG2      GLN 144   2.236  -3.286   0.625
   63    HG3  GLN 144           HG1      GLN 144   3.308  -2.592   1.838
   64   HE21  GLN 144          HE21      GLN 144   4.300  -0.612   1.430
   65   HE22  GLN 144          HE22      GLN 144   3.718   0.464   0.207
   66    H    THR 145           HN       THR 145   3.670  -6.569  -0.282
   67    HA   THR 145           HA       THR 145   1.089  -6.888  -1.553
   68    HB   THR 145           HB       THR 145   2.474  -8.824   0.295
   69    HG1  THR 145           HG1      THR 145   2.850  -8.243  -2.451
   70   HG21  THR 145          HG21      THR 145   0.112  -9.306  -0.168
   71   HG22  THR 145          HG22      THR 145   1.163 -10.505  -0.920
   72   HG23  THR 145          HG23      THR 145   0.435  -9.232  -1.899
   73    H    SER 146           HN       SER 146   0.014  -5.238  -0.374
   74    HA   SER 146           HA       SER 146  -1.299  -6.261   1.987
   75    HB2  SER 146           HB2      SER 146   0.152  -3.597   2.064
   76    HB3  SER 146           HB1      SER 146  -0.908  -4.225   3.326
   77    HG   SER 146           HG       SER 146   0.947  -6.064   2.743
   78    H    MET 147           HN       MET 147  -3.398  -5.668   1.987
   79    HA   MET 147           HA       MET 147  -4.314  -4.117  -0.280
   80    HB2  MET 147           HB2      MET 147  -5.697  -5.840   1.756
   81    HB3  MET 147           HB1      MET 147  -6.607  -4.816   0.655
   82    HG2  MET 147           HG2      MET 147  -4.685  -6.987  -0.141
   83    HG3  MET 147           HG1      MET 147  -6.445  -7.094  -0.173
   84    HE1  MET 147           HE1      MET 147  -4.715  -7.808  -2.712
   85    HE2  MET 147           HE2      MET 147  -5.615  -6.977  -3.979
   86    HE3  MET 147           HE3      MET 147  -6.479  -7.826  -2.697
   87    H    THR 148           HN       THR 148  -3.013  -2.427   1.339
   88    HA   THR 148           HA       THR 148  -4.926  -1.007   2.989
   89    HB   THR 148           HB       THR 148  -2.992   0.694   3.091
   90    HG1  THR 148           HG1      THR 148  -1.705   0.087   1.399
   91   HG21  THR 148          HG21      THR 148  -2.567  -2.112   4.123
   92   HG22  THR 148          HG22      THR 148  -3.515  -0.849   4.910
   93   HG23  THR 148          HG23      THR 148  -1.770  -0.661   4.732
   94    H    ASP 149           HN       ASP 149  -4.152  -1.217  -0.245
   95    HA   ASP 149           HA       ASP 149  -4.768   1.515  -0.972
   96    HB2  ASP 149           HB2      ASP 149  -3.115   0.289  -2.280
   97    HB3  ASP 149           HB1      ASP 149  -4.296  -0.961  -2.645
   98    H    PHE 150           HN       PHE 150  -6.769   2.240  -1.209
   99    HA   PHE 150           HA       PHE 150  -8.828   0.605  -2.395
  100    HB2  PHE 150           HB2      PHE 150  -9.038  -0.051  -0.047
  101    HB3  PHE 150           HB1      PHE 150  -9.129   1.639   0.438
  102    HD1  PHE 150           HD1      PHE 150 -11.176   2.774   0.461
  103    HD2  PHE 150           HD2      PHE 150 -10.879  -1.000  -1.482
  104    HE1  PHE 150           HE1      PHE 150 -13.622   2.713   0.218
  105    HE2  PHE 150           HE2      PHE 150 -13.326  -1.068  -1.729
  106    HZ   PHE 150           HZ       PHE 150 -14.700   0.790  -0.880
  107    H    TYR 151           HN       TYR 151  -8.084   3.615  -0.671
  108    HA   TYR 151           HA       TYR 151  -9.271   5.166  -2.808
  109    HB2  TYR 151           HB2      TYR 151 -11.190   4.599  -1.314
  110    HB3  TYR 151           HB1      TYR 151 -10.350   5.392   0.013
  111    HD1  TYR 151           HD1      TYR 151 -11.737   6.027  -3.379
  112    HD2  TYR 151           HD2      TYR 151 -10.647   7.680   0.384
  113    HE1  TYR 151           HE1      TYR 151 -12.774   8.159  -4.023
  114    HE2  TYR 151           HE2      TYR 151 -11.678   9.820  -0.251
  115    HH   TYR 151           HH       TYR 151 -13.718  10.136  -2.975
  116    H    HIS 152           HN       HIS 152  -7.762   6.618  -3.190
  117    HA   HIS 152           HA       HIS 152  -5.974   7.486  -1.066
  118    HB2  HIS 152           HB2      HIS 152  -5.946   7.972  -4.051
  119    HB3  HIS 152           HB1      HIS 152  -4.758   8.641  -2.938
  120    HD1  HIS 152           HD1      HIS 152  -2.852   7.150  -2.244
  121    HD2  HIS 152           HD2      HIS 152  -5.829   5.107  -4.302
  122    HE1  HIS 152           HE1      HIS 152  -1.911   4.862  -2.705
  123    HE2  HIS 152           HE2      HIS 152  -3.812   3.582  -3.764
  Start of MODEL   19
    1    H1   GLY 139           HT1      GLY 139  14.165   4.749  -2.241
    2    H2   GLY 139           HT2      GLY 139  13.240   3.599  -1.410
    3    H3   GLY 139           HT3      GLY 139  13.231   3.633  -3.100
    4    HA2  GLY 139           HA1      GLY 139  15.548   3.009  -3.175
    5    HA3  GLY 139           HA2      GLY 139  15.583   2.998  -1.417
    6    H    ARG 140           HN       ARG 140  15.648   0.985  -0.695
    7    HA   ARG 140           HA       ARG 140  14.364  -1.144  -2.193
    8    HB2  ARG 140           HB2      ARG 140  16.055  -1.178   0.309
    9    HB3  ARG 140           HB1      ARG 140  15.387  -2.618  -0.448
   10    HG2  ARG 140           HG2      ARG 140  16.638  -2.112  -2.492
   11    HG3  ARG 140           HG1      ARG 140  17.325  -0.689  -1.707
   12    HD2  ARG 140           HD2      ARG 140  18.379  -2.109  -0.033
   13    HD3  ARG 140           HD1      ARG 140  17.660  -3.538  -0.777
   14    HE   ARG 140           HE       ARG 140  19.123  -2.179  -2.730
   15   HH11  ARG 140          HH11      ARG 140  19.697  -3.956   0.232
   16   HH12  ARG 140          HH12      ARG 140  21.269  -4.501  -0.256
   17   HH21  ARG 140          HH21      ARG 140  21.170  -2.906  -3.384
   18   HH22  ARG 140          HH22      ARG 140  22.110  -3.902  -2.320
   19    H    LYS 141           HN       LYS 141  13.134  -2.809  -0.871
   20    HA   LYS 141           HA       LYS 141  11.179  -3.331   0.154
   21    HB2  LYS 141           HB2      LYS 141  11.868  -1.072   2.050
   22    HB3  LYS 141           HB1      LYS 141  10.707  -2.359   2.344
   23    HG2  LYS 141           HG2      LYS 141  13.683  -2.692   2.022
   24    HG3  LYS 141           HG1      LYS 141  12.776  -2.775   3.535
   25    HD2  LYS 141           HD2      LYS 141  11.591  -4.732   2.761
   26    HD3  LYS 141           HD1      LYS 141  12.366  -4.616   1.180
   27    HE2  LYS 141           HE2      LYS 141  14.550  -4.974   2.248
   28    HE3  LYS 141           HE1      LYS 141  13.748  -5.131   3.811
   29    HZ1  LYS 141           HZ1      LYS 141  13.353  -6.908   1.467
   30    HZ2  LYS 141           HZ2      LYS 141  12.552  -7.052   2.950
   31    HZ3  LYS 141           HZ3      LYS 141  14.223  -7.284   2.865
   32    H    ARG 142           HN       ARG 142  11.292  -1.417  -1.987
   33    HA   ARG 142           HA       ARG 142   9.371   0.655  -1.478
   34    HB2  ARG 142           HB2      ARG 142  11.203   0.917  -3.123
   35    HB3  ARG 142           HB1      ARG 142  10.493  -0.361  -4.097
   36    HG2  ARG 142           HG2      ARG 142   8.463   1.032  -4.367
   37    HG3  ARG 142           HG1      ARG 142   9.285   2.331  -3.498
   38    HD2  ARG 142           HD2      ARG 142  11.001   2.431  -5.190
   39    HD3  ARG 142           HD1      ARG 142  10.307   1.043  -6.022
   40    HE   ARG 142           HE       ARG 142   8.868   3.604  -5.745
   41   HH11  ARG 142          HH11      ARG 142   9.978   0.904  -7.688
   42   HH12  ARG 142          HH12      ARG 142   9.157   1.441  -9.116
   43   HH21  ARG 142          HH21      ARG 142   7.788   4.294  -7.632
   44   HH22  ARG 142          HH22      ARG 142   7.911   3.358  -9.086
   45    H    ARG 143           HN       ARG 143   7.765  -0.820  -0.624
   46    HA   ARG 143           HA       ARG 143   5.757  -1.393  -2.567
   47    HB2  ARG 143           HB2      ARG 143   7.196  -3.440  -2.712
   48    HB3  ARG 143           HB1      ARG 143   6.878  -3.736  -1.009
   49    HG2  ARG 143           HG2      ARG 143   4.498  -3.978  -1.487
   50    HG3  ARG 143           HG1      ARG 143   4.807  -3.662  -3.195
   51    HD2  ARG 143           HD2      ARG 143   5.903  -5.967  -1.591
   52    HD3  ARG 143           HD1      ARG 143   4.585  -6.055  -2.756
   53    HE   ARG 143           HE       ARG 143   6.462  -5.140  -4.336
   54   HH11  ARG 143          HH11      ARG 143   6.751  -7.577  -1.834
   55   HH12  ARG 143          HH12      ARG 143   8.066  -8.400  -2.613
   56   HH21  ARG 143          HH21      ARG 143   8.196  -6.228  -5.359
   57   HH22  ARG 143          HH22      ARG 143   8.884  -7.635  -4.610
   58    H    GLN 144           HN       GLN 144   4.451  -0.066  -1.389
   59    HA   GLN 144           HA       GLN 144   4.218  -0.318   1.468
   60    HB2  GLN 144           HB2      GLN 144   2.605   1.274  -0.531
   61    HB3  GLN 144           HB1      GLN 144   2.421   1.385   1.212
   62    HG2  GLN 144           HG2      GLN 144   4.631   2.267   1.447
   63    HG3  GLN 144           HG1      GLN 144   4.969   1.991  -0.261
   64   HE21  GLN 144          HE21      GLN 144   3.260   3.955   2.040
   65   HE22  GLN 144          HE22      GLN 144   2.889   5.249   0.956
   66    H    THR 145           HN       THR 145   2.354  -0.978   2.605
   67    HA   THR 145           HA       THR 145   0.848  -3.057   1.265
   68    HB   THR 145           HB       THR 145  -0.182  -3.318   3.598
   69    HG1  THR 145           HG1      THR 145   0.446  -1.217   4.358
   70   HG21  THR 145          HG21      THR 145   2.799  -3.657   3.260
   71   HG22  THR 145          HG22      THR 145   1.559  -4.805   2.761
   72   HG23  THR 145          HG23      THR 145   1.809  -4.466   4.472
   73    H    SER 146           HN       SER 146  -0.748  -2.340   0.009
   74    HA   SER 146           HA       SER 146  -2.837  -0.693   1.157
   75    HB2  SER 146           HB2      SER 146  -1.428   0.167  -1.384
   76    HB3  SER 146           HB1      SER 146  -2.770   0.993  -0.594
   77    HG   SER 146           HG       SER 146  -0.979   0.798   1.262
   78    H    MET 147           HN       MET 147  -3.126  -3.267   0.627
   79    HA   MET 147           HA       MET 147  -3.892  -3.877  -2.044
   80    HB2  MET 147           HB2      MET 147  -3.195  -5.616  -0.431
   81    HB3  MET 147           HB1      MET 147  -4.633  -5.289   0.528
   82    HG2  MET 147           HG2      MET 147  -4.898  -7.280  -0.852
   83    HG3  MET 147           HG1      MET 147  -6.049  -6.022  -1.302
   84    HE1  MET 147           HE1      MET 147  -5.465  -8.520  -3.183
   85    HE2  MET 147           HE2      MET 147  -5.362  -7.712  -4.747
   86    HE3  MET 147           HE3      MET 147  -6.584  -7.216  -3.576
   87    H    THR 148           HN       THR 148  -5.347  -2.401  -2.778
   88    HA   THR 148           HA       THR 148  -7.405  -1.537  -3.236
   89    HB   THR 148           HB       THR 148  -8.588  -3.536  -1.298
   90    HG1  THR 148           HG1      THR 148  -7.186  -4.010  -3.581
   91   HG21  THR 148          HG21      THR 148 -10.132  -1.866  -2.184
   92   HG22  THR 148          HG22      THR 148 -10.495  -3.460  -2.842
   93   HG23  THR 148          HG23      THR 148  -9.647  -2.274  -3.830
   94    H    ASP 149           HN       ASP 149  -5.899  -0.192  -1.484
   95    HA   ASP 149           HA       ASP 149  -7.108   0.136   1.102
   96    HB2  ASP 149           HB2      ASP 149  -4.641   0.332   0.602
   97    HB3  ASP 149           HB1      ASP 149  -4.992   1.863  -0.192
   98    H    PHE 150           HN       PHE 150  -7.456   1.599  -1.981
   99    HA   PHE 150           HA       PHE 150  -8.521   4.087  -1.010
  100    HB2  PHE 150           HB2      PHE 150  -8.699   2.877  -3.779
  101    HB3  PHE 150           HB1      PHE 150  -9.063   4.544  -3.353
  102    HD1  PHE 150           HD1      PHE 150  -7.060   5.788  -2.113
  103    HD2  PHE 150           HD2      PHE 150  -6.652   2.428  -4.689
  104    HE1  PHE 150           HE1      PHE 150  -4.718   6.407  -2.545
  105    HE2  PHE 150           HE2      PHE 150  -4.309   3.039  -5.125
  106    HZ   PHE 150           HZ       PHE 150  -3.340   5.031  -4.051
  107    H    TYR 151           HN       TYR 151  -9.842   1.083  -2.325
  108    HA   TYR 151           HA       TYR 151 -12.550   2.085  -2.141
  109    HB2  TYR 151           HB2      TYR 151 -11.495  -0.621  -2.970
  110    HB3  TYR 151           HB1      TYR 151 -13.184  -0.133  -3.047
  111    HD1  TYR 151           HD1      TYR 151 -13.915   1.566  -4.668
  112    HD2  TYR 151           HD2      TYR 151  -9.902   0.149  -4.597
  113    HE1  TYR 151           HE1      TYR 151 -13.542   2.515  -6.906
  114    HE2  TYR 151           HE2      TYR 151  -9.521   1.095  -6.834
  115    HH   TYR 151           HH       TYR 151 -11.674   3.288  -8.288
  116    H    HIS 152           HN       HIS 152 -10.432  -0.023  -0.312
  117    HA   HIS 152           HA       HIS 152 -12.437  -0.146   1.800
  118    HB2  HIS 152           HB2      HIS 152 -11.150  -2.616   0.616
  119    HB3  HIS 152           HB1      HIS 152 -12.033  -2.594   2.134
  120    HD1  HIS 152           HD1      HIS 152 -14.653  -1.918   1.890
  121    HD2  HIS 152           HD2      HIS 152 -12.676  -3.063  -1.583
  122    HE1  HIS 152           HE1      HIS 152 -16.462  -2.495   0.242
  123    HE2  HIS 152           HE2      HIS 152 -15.245  -3.269  -1.821
  Start of MODEL   20
    1    H1   GLY 139           HT1      GLY 139  14.657  -2.427  -3.379
    2    H2   GLY 139           HT2      GLY 139  16.084  -1.531  -3.495
    3    H3   GLY 139           HT3      GLY 139  14.683  -0.807  -2.902
    4    HA2  GLY 139           HA1      GLY 139  16.167  -3.015  -1.603
    5    HA3  GLY 139           HA2      GLY 139  16.213  -1.327  -1.111
    6    H    ARG 140           HN       ARG 140  15.148  -1.143   0.734
    7    HA   ARG 140           HA       ARG 140  13.054  -2.903   1.525
    8    HB2  ARG 140           HB2      ARG 140  14.612  -1.821   3.108
    9    HB3  ARG 140           HB1      ARG 140  13.911  -0.260   2.716
   10    HG2  ARG 140           HG2      ARG 140  11.755  -1.010   3.604
   11    HG3  ARG 140           HG1      ARG 140  12.479  -2.568   4.013
   12    HD2  ARG 140           HD2      ARG 140  13.234   0.132   5.116
   13    HD3  ARG 140           HD1      ARG 140  12.429  -1.179   5.979
   14    HE   ARG 140           HE       ARG 140  14.857  -2.148   4.986
   15   HH11  ARG 140          HH11      ARG 140  13.701   0.141   7.368
   16   HH12  ARG 140          HH12      ARG 140  15.097  -0.024   8.384
   17   HH21  ARG 140          HH21      ARG 140  16.699  -2.356   6.322
   18   HH22  ARG 140          HH22      ARG 140  16.799  -1.426   7.787
   19    H    LYS 141           HN       LYS 141  13.046   0.614   0.946
   20    HA   LYS 141           HA       LYS 141  10.175   0.679   0.835
   21    HB2  LYS 141           HB2      LYS 141  12.252   2.794   0.261
   22    HB3  LYS 141           HB1      LYS 141  10.520   3.083   0.253
   23    HG2  LYS 141           HG2      LYS 141  12.121   2.159   2.630
   24    HG3  LYS 141           HG1      LYS 141  11.577   3.811   2.336
   25    HD2  LYS 141           HD2      LYS 141   9.225   2.911   2.286
   26    HD3  LYS 141           HD1      LYS 141   9.881   1.373   2.852
   27    HE2  LYS 141           HE2      LYS 141   9.050   2.631   4.735
   28    HE3  LYS 141           HE1      LYS 141  10.809   2.533   4.825
   29    HZ1  LYS 141           HZ1      LYS 141  10.955   4.770   3.948
   30    HZ2  LYS 141           HZ2      LYS 141   9.986   4.760   5.334
   31    HZ3  LYS 141           HZ3      LYS 141   9.271   4.862   3.805
   32    H    ARG 142           HN       ARG 142   9.290  -0.302  -0.857
   33    HA   ARG 142           HA       ARG 142   9.575   0.871  -3.448
   34    HB2  ARG 142           HB2      ARG 142  11.486  -0.663  -3.498
   35    HB3  ARG 142           HB1      ARG 142  10.437  -2.001  -3.056
   36    HG2  ARG 142           HG2      ARG 142   9.255  -1.817  -5.156
   37    HG3  ARG 142           HG1      ARG 142  10.215  -0.401  -5.596
   38    HD2  ARG 142           HD2      ARG 142  12.226  -1.712  -5.644
   39    HD3  ARG 142           HD1      ARG 142  11.372  -3.120  -5.021
   40    HE   ARG 142           HE       ARG 142  10.194  -2.245  -7.438
   41   HH11  ARG 142          HH11      ARG 142  13.056  -3.839  -6.215
   42   HH12  ARG 142          HH12      ARG 142  13.284  -4.811  -7.632
   43   HH21  ARG 142          HH21      ARG 142  10.487  -3.520  -9.318
   44   HH22  ARG 142          HH22      ARG 142  11.827  -4.618  -9.402
   45    H    ARG 143           HN       ARG 143   8.608  -2.292  -2.138
   46    HA   ARG 143           HA       ARG 143   5.998  -2.056  -3.353
   47    HB2  ARG 143           HB2      ARG 143   7.095  -4.187  -1.514
   48    HB3  ARG 143           HB1      ARG 143   5.600  -4.285  -2.433
   49    HG2  ARG 143           HG2      ARG 143   6.847  -4.229  -4.513
   50    HG3  ARG 143           HG1      ARG 143   8.358  -4.073  -3.615
   51    HD2  ARG 143           HD2      ARG 143   6.454  -6.409  -3.535
   52    HD3  ARG 143           HD1      ARG 143   8.031  -6.368  -4.318
   53    HE   ARG 143           HE       ARG 143   7.811  -5.948  -1.419
   54   HH11  ARG 143          HH11      ARG 143   9.004  -7.802  -4.137
   55   HH12  ARG 143          HH12      ARG 143  10.062  -8.774  -3.167
   56   HH21  ARG 143          HH21      ARG 143   9.190  -7.215  -0.139
   57   HH22  ARG 143          HH22      ARG 143  10.162  -8.446  -0.881
   58    H    GLN 144           HN       GLN 144   4.515  -0.814  -2.381
   59    HA   GLN 144           HA       GLN 144   4.714  -0.242   0.437
   60    HB2  GLN 144           HB2      GLN 144   2.783   1.224   0.085
   61    HB3  GLN 144           HB1      GLN 144   4.059   1.541  -1.078
   62    HG2  GLN 144           HG2      GLN 144   2.850   0.370  -2.794
   63    HG3  GLN 144           HG1      GLN 144   1.610  -0.112  -1.637
   64   HE21  GLN 144          HE21      GLN 144   1.640   2.472  -0.283
   65   HE22  GLN 144          HE22      GLN 144   0.816   3.571  -1.332
   66    H    THR 145           HN       THR 145   3.221  -0.745   2.023
   67    HA   THR 145           HA       THR 145   1.775  -3.210   1.537
   68    HB   THR 145           HB       THR 145   3.053  -3.254   3.519
   69    HG1  THR 145           HG1      THR 145   0.294  -2.880   4.108
   70   HG21  THR 145          HG21      THR 145   2.680  -1.663   5.397
   71   HG22  THR 145          HG22      THR 145   1.686  -0.689   4.313
   72   HG23  THR 145          HG23      THR 145   3.398  -0.923   3.968
   73    H    SER 146           HN       SER 146   0.093  -2.598   0.303
   74    HA   SER 146           HA       SER 146  -2.194  -1.633   1.737
   75    HB2  SER 146           HB2      SER 146  -2.714   0.127  -0.021
   76    HB3  SER 146           HB1      SER 146  -1.402   0.528   1.087
   77    HG   SER 146           HG       SER 146  -0.953  -0.677  -1.442
   78    H    MET 147           HN       MET 147  -3.559  -3.207   1.259
   79    HA   MET 147           HA       MET 147  -3.516  -4.443  -1.382
   80    HB2  MET 147           HB2      MET 147  -5.088  -5.154   1.104
   81    HB3  MET 147           HB1      MET 147  -5.090  -6.075  -0.393
   82    HG2  MET 147           HG2      MET 147  -2.721  -5.604   1.400
   83    HG3  MET 147           HG1      MET 147  -3.643  -7.098   1.255
   84    HE1  MET 147           HE1      MET 147  -0.451  -6.885   0.957
   85    HE2  MET 147           HE2      MET 147  -0.200  -7.979  -0.404
   86    HE3  MET 147           HE3      MET 147  -1.356  -8.396   0.860
   87    H    THR 148           HN       THR 148  -4.260  -2.048  -1.865
   88    HA   THR 148           HA       THR 148  -5.843  -0.686  -2.734
   89    HB   THR 148           HB       THR 148  -7.676  -3.087  -2.809
   90    HG1  THR 148           HG1      THR 148  -5.332  -2.499  -4.224
   91   HG21  THR 148          HG21      THR 148  -8.655  -0.897  -3.422
   92   HG22  THR 148          HG22      THR 148  -8.587  -2.005  -4.792
   93   HG23  THR 148          HG23      THR 148  -7.406  -0.704  -4.650
   94    H    ASP 149           HN       ASP 149  -5.761   0.136  -0.443
   95    HA   ASP 149           HA       ASP 149  -8.123  -0.349   1.163
   96    HB2  ASP 149           HB2      ASP 149  -5.781   1.530   1.491
   97    HB3  ASP 149           HB1      ASP 149  -7.140   1.478   2.611
   98    H    PHE 150           HN       PHE 150  -7.491   1.372  -1.534
   99    HA   PHE 150           HA       PHE 150  -9.017   3.737  -0.995
  100    HB2  PHE 150           HB2      PHE 150  -7.311   3.751  -2.744
  101    HB3  PHE 150           HB1      PHE 150  -8.138   2.454  -3.597
  102    HD1  PHE 150           HD1      PHE 150  -8.561   5.961  -2.464
  103    HD2  PHE 150           HD2      PHE 150  -9.724   2.941  -5.224
  104    HE1  PHE 150           HE1      PHE 150  -9.837   7.627  -3.745
  105    HE2  PHE 150           HE2      PHE 150 -11.000   4.599  -6.508
  106    HZ   PHE 150           HZ       PHE 150 -11.060   6.948  -5.769
  107    H    TYR 151           HN       TYR 151 -11.127   4.170  -1.601
  108    HA   TYR 151           HA       TYR 151 -13.327   3.786  -1.960
  109    HB2  TYR 151           HB2      TYR 151 -12.767   2.750  -4.087
  110    HB3  TYR 151           HB1      TYR 151 -12.396   1.230  -3.283
  111    HD1  TYR 151           HD1      TYR 151 -14.119  -0.311  -2.708
  112    HD2  TYR 151           HD2      TYR 151 -15.128   3.543  -4.195
  113    HE1  TYR 151           HE1      TYR 151 -16.448  -1.040  -2.989
  114    HE2  TYR 151           HE2      TYR 151 -17.463   2.827  -4.480
  115    HH   TYR 151           HH       TYR 151 -18.676   0.615  -4.831
  116    H    HIS 152           HN       HIS 152 -14.429   3.533  -0.200
  117    HA   HIS 152           HA       HIS 152 -14.715   0.923   1.016
  118    HB2  HIS 152           HB2      HIS 152 -12.747   1.887   2.181
  119    HB3  HIS 152           HB1      HIS 152 -13.710   3.290   2.622
  120    HD1  HIS 152           HD1      HIS 152 -13.082  -0.263   3.539
  121    HD2  HIS 152           HD2      HIS 152 -15.566   2.855   4.709
  122    HE1  HIS 152           HE1      HIS 152 -14.070  -0.975   5.737
  123    HE2  HIS 152           HE2      HIS 152 -15.588   0.917   6.417