*HEADER    ANTIFREEZE PROTEIN                      16-FEB-02   1L1I              
*TITLE     SOLUTION STRUCTURE OF THE TENEBRIO MOLITOR ANTIFREEZE                 
*TITLE    2 PROTEIN                                                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: THERMAL HYSTERESIS PROTEIN ISOFORM YL-1 (2-14);            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: TENEBRIO MOLITOR;                               
*SOURCE   3 ORGANISM_COMMON: BEETLE;                                             
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    BETA-HELIX                                                            
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    M.E.DALEY, L.SPYRACOPOULOS, Z.JIA, P.L.DAVIES, B.D.SYKES              
*REVDAT   1   22-MAY-02 1L1I    0                                                

! NOEs from 15N-edited NOESY
assign (resid 3 and name HG2#) (resid 3 and name HN) 	 4.968 3.268 0.000
assign (resid 3 and name HA) (resid 3 and name HN) 	 4.203 2.503 0.000
assign (resid 3 and name HB) (resid 3 and name HN) 	 3.932 2.232 0.000
assign (resid 3 and name HA) (resid 4 and name HN) 	 3.668 1.968 0.000
assign ((resid 4 and name HA2) or (resid 4 and name HA1)) (resid 4 and name HN) 	 4.380 2.680 0.000
assign ((resid 4 and name HA1) or (resid 4 and name HA2)) (resid 4 and name HN) 	 4.065 2.365 0.315
assign (resid 3 and name HG2#) (resid 4 and name HN) 	 5.000 3.300 0.000
assign ((resid 5 and name HA2) or (resid 5 and name HA1)) (resid 5 and name HN) 	 5.000 3.300 0.000
assign ((resid 4 and name HA2) or (resid 4 and name HA1)) (resid 5 and name HN) 	 5.000 3.300 0.000
assign ((resid 5 and name HA1) or (resid 5 and name HA2)) (resid 5 and name HN) 	 4.485 2.785 0.515
assign ((resid 7 and name HB2) or (resid 7 and name HB1)) (resid 7 and name HN) 	 5.000 3.300 0.000
assign (resid 6 and name HB#) (resid 7 and name HN) 	 5.000 3.300 0.000
assign ((resid 8 and name HB1) or (resid 8 and name HB2)) (resid 8 and name HN) 	 4.316 2.616 0.500
assign ((resid 20 and name HB1) or (resid 20 and name HB2)) (resid 8 and name HN) 	 3.741 2.042 1.259
assign (resid 9 and name HN) (resid 8 and name HN) 	 4.450 2.750 0.000
assign (resid 20 and name HN) (resid 8 and name HN) 	 4.830 3.130 0.000
assign (resid 7 and name HA) (resid 8 and name HN) 	 3.152 1.452 0.000
assign (resid 8 and name HA) (resid 8 and name HN) 	 4.312 2.612 0.000
assign ((resid 20 and name HB2) or (resid 20 and name HB1)) (resid 8 and name HN) 	 5.000 3.300 0.000
assign (resid 8 and name HN) (resid 9 and name HN) 	 4.592 2.892 0.000
assign (resid 8 and name HA) (resid 9 and name HN) 	 5.000 3.300 0.000
assign (resid 9 and name HB) (resid 9 and name HN) 	 4.328 2.628 0.000
assign (resid 9 and name HG2#) (resid 9 and name HN) 	 5.000 3.300 0.000
assign (resid 8 and name HA) (resid 11 and name HN) 	 5.000 3.300 0.000
assign (resid 11 and name HA) (resid 11 and name HN) 	 3.880 2.180 0.000
assign (resid 10 and name HA) (resid 11 and name HN) 	 4.287 2.587 0.000
assign ((resid 11 and name HB1) or (resid 11 and name HB2)) (resid 11 and name HN) 	 3.357 1.657 0.083
assign ((resid 11 and name HB2) or (resid 11 and name HB1)) (resid 11 and name HN) 	 3.440 1.740 0.000
assign (resid 12 and name HB) (resid 12 and name HN) 	 5.000 3.300 0.000
assign (resid 13 and name HN) (resid 12 and name HN) 	 3.752 2.052 0.000
assign (resid 12 and name HA) (resid 12 and name HN) 	 3.878 2.178 0.000
assign (resid 11 and name HA) (resid 12 and name HN) 	 3.215 1.515 0.000
assign (resid 12 and name HG2#) (resid 12 and name HN) 	 4.133 2.433 0.000
assign (resid 12 and name HN) (resid 13 and name HN) 	 4.155 2.455 0.000
assign (resid 12 and name HA) (resid 13 and name HN) 	 5.000 3.300 0.000
assign ((resid 13 and name HA2) or (resid 13 and name HA1)) (resid 13 and name HN) 	 4.715 3.015 0.000
assign (resid 11 and name HA) (resid 13 and name HN) 	 5.000 3.300 0.000
assign ((resid 13 and name HA1) or (resid 13 and name HA2)) (resid 13 and name HN) 	 4.320 2.620 0.396
assign ((resid 13 and name HA1) or (resid 13 and name HA2)) (resid 14 and name HN) 	 3.163 1.463 0.669
assign (resid 14 and name HA) (resid 14 and name HN) 	 4.151 2.451 0.000
assign ((resid 13 and name HA2) or (resid 13 and name HA1)) (resid 14 and name HN) 	 3.832 2.132 0.000
assign (resid 14 and name HB#) (resid 14 and name HN) 	 3.158 1.458 0.000
assign (resid 15 and name HA) (resid 15 and name HN) 	 4.194 2.494 0.000
assign (resid 14 and name HB#) (resid 15 and name HN) 	 4.030 2.330 0.000
assign (resid 27 and name HA) (resid 15 and name HN) 	 4.077 2.377 0.000
assign (resid 14 and name HA) (resid 15 and name HN) 	 2.773 1.073 0.000
assign ((resid 15 and name HB2) or (resid 15 and name HB1)) (resid 15 and name HN) 	 3.293 1.593 0.969
assign ((resid 15 and name HB1) or (resid 15 and name HB2)) (resid 15 and name HN) 	 4.262 2.562 0.000
assign (resid 24 and name HB#) (resid 15 and name HN) 	 3.648 1.948 0.000
assign (resid 15 and name HA) (resid 16 and name HN) 	 4.411 2.711 0.000
assign (resid 16 and name HB) (resid 16 and name HN) 	 5.000 3.300 0.000
assign (resid 16 and name HG2#) (resid 16 and name HN) 	 5.000 3.300 0.000
assign (resid 3 and name HA) (resid 16 and name HN) 	 5.000 3.300 0.000
assign (resid 18 and name HN) (resid 17 and name HN) 	 5.000 3.300 0.000
assign (resid 16 and name HA) (resid 17 and name HN) 	 3.907 2.207 0.000
assign ((resid 17 and name HA2) or (resid 17 and name HA1)) (resid 17 and name HN) 	 4.353 2.653 0.229
assign (resid 28 and name HB) (resid 17 and name HN) 	 5.000 3.300 0.000
assign ((resid 17 and name HA1) or (resid 17 and name HA2)) (resid 17 and name HN) 	 4.581 2.881 0.000
assign ((resid 29 and name HB2) or (resid 29 and name HB1)) (resid 17 and name HN) 	 5.000 3.300 0.000
assign ((resid 29 and name HB1) or (resid 29 and name HB2)) (resid 17 and name HN) 	 4.995 3.295 0.005
assign (resid 16 and name HG2#) (resid 17 and name HN) 	 4.830 3.130 0.000
assign (resid 30 and name HA) (resid 18 and name HN) 	 3.864 2.164 0.000
assign (resid 18 and name HA) (resid 18 and name HN) 	 3.890 2.191 0.000
assign ((resid 17 and name HA2) or (resid 17 and name HA1)) (resid 18 and name HN) 	 4.521 2.821 0.479
assign ((resid 17 and name HA1) or (resid 17 and name HA2)) (resid 18 and name HN) 	 5.000 3.300 0.000
assign ((resid 18 and name HB2) or (resid 18 and name HB1)) (resid 18 and name HN) 	 3.851 2.151 0.199
assign ((resid 18 and name HB1) or (resid 18 and name HB2)) (resid 18 and name HN) 	 4.050 2.350 0.000
assign (resid 17 and name HN) (resid 18 and name HN) 	 5.000 3.300 0.000
assign (resid 18 and name HA) (resid 19 and name HN) 	 4.367 2.667 0.000
assign (resid 6 and name HA) (resid 19 and name HN) 	 5.000 3.300 0.000
assign ((resid 19 and name HA2) or (resid 19 and name HA1)) (resid 19 and name HN) 	 5.000 3.300 0.000
assign ((resid 19 and name HA1) or (resid 19 and name HA2)) (resid 19 and name HN) 	 4.544 2.844 0.456
assign (resid 8 and name HN) (resid 20 and name HN) 	 4.367 2.667 0.000
assign (resid 7 and name HA) (resid 20 and name HN) 	 4.781 3.081 0.000
assign (resid 20 and name HA) (resid 20 and name HN) 	 3.926 2.226 0.000
assign ((resid 19 and name HA2) or (resid 19 and name HA1)) (resid 20 and name HN) 	 4.872 3.172 0.067
assign ((resid 19 and name HA1) or (resid 19 and name HA2)) (resid 20 and name HN) 	 4.938 3.238 0.000
assign ((resid 20 and name HB2) or (resid 20 and name HB1)) (resid 20 and name HN) 	 4.422 2.722 0.055
assign ((resid 20 and name HB1) or (resid 20 and name HB2)) (resid 20 and name HN) 	 4.477 2.777 0.000
assign (resid 21 and name HA) (resid 21 and name HN) 	 4.458 2.758 0.000
assign (resid 20 and name HA) (resid 21 and name HN) 	 2.730 1.030 0.000
assign ((resid 32 and name HB1) or (resid 32 and name HB2)) (resid 21 and name HN) 	 4.130 2.430 0.500
assign ((resid 21 and name HB1) or (resid 21 and name HB2)) (resid 21 and name HN) 	 4.288 2.588 0.000
assign ((resid 21 and name HB2) or (resid 21 and name HB1)) (resid 21 and name HN) 	 2.934 1.234 1.353
assign (resid 24 and name HN) (resid 23 and name HN) 	 2.869 1.169 0.000
assign (resid 23 and name HA) (resid 23 and name HN) 	 4.233 2.533 0.000
assign ((resid 21 and name HB1) or (resid 21 and name HB2)) (resid 23 and name HN) 	 5.000 3.300 0.000
assign ((resid 23 and name HB2) or (resid 23 and name HB1)) (resid 23 and name HN) 	 4.497 2.797 0.000
assign ((resid 23 and name HB1) or (resid 23 and name HB2)) (resid 23 and name HN) 	 3.523 1.823 0.973
assign (resid 23 and name HN) (resid 24 and name HN) 	 2.993 1.293 0.000
assign (resid 23 and name HA) (resid 24 and name HN) 	 4.824 3.124 0.000
assign (resid 24 and name HB#) (resid 24 and name HN) 	 3.080 1.380 0.000
assign (resid 24 and name HA) (resid 24 and name HN) 	 3.971 2.271 0.000
assign ((resid 23 and name HB1) or (resid 23 and name HB2)) (resid 24 and name HN) 	 5.000 3.300 0.000
assign ((resid 13 and name HA2) or (resid 13 and name HA1)) (resid 25 and name HN) 	 5.000 3.300 0.000
assign (resid 26 and name HN) (resid 25 and name HN) 	 3.249 1.549 0.000
assign (resid 25 and name HA) (resid 25 and name HN) 	 3.940 2.240 0.000
assign (resid 24 and name HA) (resid 25 and name HN) 	 2.892 1.192 0.000
assign (resid 25 and name HB) (resid 25 and name HN) 	 3.885 2.186 0.000
assign (resid 24 and name HB#) (resid 25 and name HN) 	 3.638 1.938 0.000
assign ((resid 25 and name HG1#) or (resid 25 and name HG2#)) (resid 25 and name HN)  3.143 1.443 0.000
assign (resid 26 and name HA) (resid 26 and name HN) 	 3.941 2.241 0.000
assign (resid 14 and name HA) (resid 26 and name HN) 	 3.717 2.017 0.000
assign (resid 25 and name HA) (resid 26 and name HN) 	 5.000 3.300 0.000
assign (resid 24 and name HB#) (resid 26 and name HN) 	 3.735 2.035 0.000
assign (resid 26 and name HG2#) (resid 26 and name HN) 	 5.000 3.300 0.000
assign ((resid 25 and name HG1#) or (resid 25 and name HG2#)) (resid 26 and name HN)   4.064 2.364 0.000
assign (resid 25 and name HN) (resid 26 and name HN) 	 3.373 1.673 0.000
assign (resid 26 and name HB) (resid 26 and name HN) 	 4.698 2.998 0.000
assign (resid 39 and name HA) (resid 27 and name HN) 	 3.771 2.071 0.000
assign ((resid 27 and name HB1) or (resid 27 and name HB2)) (resid 27 and name HN) 	 5.000 3.300 0.000
assign (resid 27 and name HA) (resid 27 and name HN) 	 4.042 2.342 0.000
assign (resid 26 and name HA) (resid 27 and name HN) 	 2.887 1.187 0.000
assign (resid 26 and name HB) (resid 27 and name HN) 	 3.607 1.907 0.000
assign ((resid 27 and name HB2) or (resid 27 and name HB1)) (resid 27 and name HN) 	 3.656 1.956 1.344
assign (resid 36 and name HB#) (resid 27 and name HN) 	 3.671 1.971 0.000
assign (resid 26 and name HG2#) (resid 27 and name HN) 	 3.775 2.075 0.000
assign (resid 27 and name HA) (resid 28 and name HN) 	 4.396 2.696 0.000
assign (resid 28 and name HB) (resid 28 and name HN) 	 5.000 3.300 0.000
assign (resid 28 and name HG2#) (resid 28 and name HN) 	 5.000 3.300 0.000
assign (resid 16 and name HA) (resid 28 and name HN) 	 5.000 3.300 0.000
assign ((resid 41 and name HA1) or (resid 41 and name HA2)) (resid 29 and name HN) 	 5.000 3.300 0.000
assign (resid 30 and name HN) (resid 29 and name HN) 	 5.000 3.300 0.000
assign (resid 28 and name HA) (resid 29 and name HN) 	 3.676 1.976 0.000
assign (resid 29 and name HA) (resid 29 and name HN) 	 3.762 2.062 0.000
assign ((resid 29 and name HB1) or (resid 29 and name HB2)) (resid 29 and name HN) 	 5.000 3.300 0.000
assign (resid 28 and name HG2#) (resid 29 and name HN) 	 4.587 2.887 0.000
assign ((resid 42 and name HB2) or (resid 42 and name HB1)) (resid 30 and name HN) 	 4.811 3.111 0.189
assign (resid 29 and name HN) (resid 30 and name HN) 	 4.203 2.503 0.000
assign (resid 42 and name HA) (resid 30 and name HN) 	 3.321 1.621 0.000
assign (resid 30 and name HA) (resid 30 and name HN) 	 4.325 2.625 0.000
assign (resid 29 and name HA) (resid 30 and name HN) 	 3.465 1.765 0.000
assign ((resid 30 and name HB2) or (resid 30 and name HB1)) (resid 30 and name HN) 	 5.000 3.300 0.000
assign ((resid 30 and name HB1) or (resid 30 and name HB2)) (resid 30 and name HN) 	 3.698 1.998 1.302
assign ((resid 30 and name HB1) or (resid 30 and name HB2)) (resid 31 and name HN) 	 4.899 3.199 0.000
assign (resid 30 and name HA) (resid 31 and name HN) 	 3.460 1.760 0.000
assign (resid 31 and name HA) (resid 31 and name HN) 	 3.896 2.196 0.000
assign ((resid 30 and name HB2) or (resid 30 and name HB1)) (resid 31 and name HN) 	 3.675 1.975 1.224
assign ((resid 31 and name HB1) or (resid 31 and name HB2)) (resid 31 and name HN) 	 4.888 3.188 0.000
assign ((resid 19 and name HA2) or (resid 19 and name HA1)) (resid 31 and name HN) 	 5.000 3.300 0.000
assign ((resid 31 and name HG1) or (resid 31 and name HG2)) (resid 31 and name HN) 	 4.715 3.015 0.285
assign ((resid 31 and name HB2) or (resid 31 and name HB1)) (resid 31 and name HN) 	 3.780 2.080 1.108
assign (resid 33 and name HN) (resid 32 and name HN) 	 4.515 2.815 0.000
assign (resid 31 and name HA) (resid 32 and name HN) 	 3.456 1.756 0.000
assign ((resid 44 and name HB1) or (resid 44 and name HB2)) (resid 32 and name HN) 	 4.735 3.035 0.265
assign ((resid 31 and name HB2) or (resid 31 and name HB1)) (resid 32 and name HN) 	 5.000 3.300 0.000
assign ((resid 31 and name HB1) or (resid 31 and name HB2)) (resid 32 and name HN) 	 4.174 2.474 0.826
assign (resid 32 and name HA) (resid 32 and name HN) 	 3.810 2.110 0.000
assign (resid 33 and name HA) (resid 33 and name HN) 	 4.078 2.378 0.000
assign (resid 32 and name HA) (resid 33 and name HN) 	 3.725 2.026 0.000
assign ((resid 33 and name HB2) or (resid 33 and name HB1)) (resid 33 and name HN) 	 3.289 1.589 0.773
assign ((resid 33 and name HB1) or (resid 33 and name HB2)) (resid 33 and name HN) 	 4.062 2.362 0.000
assign (resid 32 and name HN) (resid 33 and name HN) 	 3.541 1.841 0.000
assign ((resid 44 and name HB1) or (resid 44 and name HB2)) (resid 33 and name HN) 	 3.351 1.651 0.500
assign (resid 35 and name HN) (resid 34 and name HN) 	 4.363 2.663 0.000
assign (resid 33 and name HA) (resid 34 and name HN) 	 3.433 1.733 0.000
assign (resid 34 and name HA) (resid 34 and name HN) 	 3.816 2.116 0.000
assign (resid 34 and name HB) (resid 34 and name HN) 	 5.000 3.300 0.000
assign ((resid 34 and name HG1#) or (resid 34 and name HG2#)) (resid 34 and name HN)   3.267 1.567 0.000
assign (resid 33 and name HA) (resid 35 and name HN) 	 5.000 3.300 0.000
assign ((resid 35 and name HD2) or (resid 35 and name HD1)) (resid 35 and name HN) 	 4.479 2.779 0.500
assign ((resid 34 and name HG1#) or (resid 34 and name HG2#)) (resid 35 and name HN)   3.812 2.112 0.000
assign (resid 34 and name HN) (resid 35 and name HN) 	 4.120 2.420 0.000
assign (resid 36 and name HN) (resid 35 and name HN) 	 2.901 1.201 0.000
assign (resid 35 and name HA) (resid 35 and name HN) 	 4.020 2.320 0.000
assign (resid 34 and name HA) (resid 35 and name HN) 	 5.000 3.300 0.000
assign ((resid 35 and name HB2) or (resid 35 and name HB1)) (resid 35 and name HN) 	 3.340 1.640 0.500
assign (resid 36 and name HB#) (resid 35 and name HN) 	 5.000 3.300 0.000
assign (resid 35 and name HN) (resid 36 and name HN) 	 3.030 1.330 0.000
assign (resid 35 and name HA) (resid 36 and name HN) 	 4.326 2.626 0.000
assign (resid 36 and name HA) (resid 36 and name HN) 	 3.827 2.127 0.000
assign ((resid 33 and name HB1) or (resid 33 and name HB2)) (resid 36 and name HN) 	 5.000 3.300 0.000
assign ((resid 35 and name HB2) or (resid 35 and name HB1)) (resid 36 and name HN) 	 5.000 3.300 0.000
assign (resid 36 and name HB#) (resid 36 and name HN) 	 3.076 1.376 0.000
assign (resid 26 and name HA) (resid 37 and name HN) 	 5.000 3.300 0.000
assign (resid 38 and name HN) (resid 37 and name HN) 	 3.296 1.596 0.000
assign (resid 37 and name HA) (resid 37 and name HN) 	 3.924 2.224 0.000
assign (resid 25 and name HA) (resid 37 and name HN) 	 3.730 2.030 0.000
assign (resid 36 and name HA) (resid 37 and name HN) 	 2.897 1.197 0.000
assign ((resid 37 and name HB2) or (resid 37 and name HB1)) (resid 37 and name HN) 	 3.877 2.177 0.179
assign ((resid 37 and name HB1) or (resid 37 and name HB2)) (resid 37 and name HN) 	 4.056 2.356 0.000
assign (resid 36 and name HB#) (resid 37 and name HN) 	 3.738 2.038 0.000
assign ((resid 25 and name HG1#) or (resid 25 and name HG2#)) (resid 37 and name HN)   5.000 3.300 0.000
assign ((resid 37 and name HB1) or (resid 37 and name HB2)) (resid 38 and name HN) 	 5.000 3.300 0.000
assign (resid 37 and name HN) (resid 38 and name HN) 	 3.546 1.846 0.000
assign (resid 26 and name HA) (resid 38 and name HN) 	 3.407 1.707 0.000
assign (resid 36 and name HA) (resid 38 and name HN) 	 5.000 3.300 0.000
assign ((resid 37 and name HB2) or (resid 37 and name HB1)) (resid 38 and name HN) 	 5.000 3.300 0.000
assign (resid 36 and name HB#) (resid 38 and name HN) 	 3.777 2.077 0.000
assign (resid 37 and name HA) (resid 38 and name HN) 	 4.997 3.297 0.000
assign ((resid 39 and name HB2) or (resid 39 and name HB1)) (resid 39 and name HN) 	 3.567 1.867 1.433
assign (resid 50 and name HN) (resid 39 and name HN) 	 4.466 2.766 0.000
assign (resid 39 and name HA) (resid 39 and name HN) 	 4.058 2.358 0.000
assign (resid 51 and name HA) (resid 39 and name HN) 	 3.852 2.152 0.000
assign (resid 38 and name HA) (resid 39 and name HN) 	 2.754 1.054 0.000
assign (resid 38 and name HB) (resid 39 and name HN) 	 3.953 2.253 0.000
assign ((resid 39 and name HB1) or (resid 39 and name HB2)) (resid 39 and name HN) 	 5.000 3.300 0.000
assign (resid 48 and name HB#) (resid 39 and name HN) 	 3.895 2.195 0.000
assign (resid 38 and name HG2#) (resid 39 and name HN) 	 3.379 1.679 0.000
assign (resid 39 and name HA) (resid 40 and name HN) 	 2.946 1.246 0.000
assign (resid 28 and name HA) (resid 40 and name HN) 	 3.863 2.163 0.000
assign (resid 40 and name HB) (resid 40 and name HN) 	 3.495 1.795 0.000
assign (resid 40 and name HA) (resid 40 and name HN) 	 4.020 2.320 0.000
assign ((resid 39 and name HB1) or (resid 39 and name HB2)) (resid 40 and name HN) 	 5.000 3.300 0.000
assign (resid 40 and name HG2#) (resid 40 and name HN) 	 4.996 3.296 0.000
assign ((resid 41 and name HA1) or (resid 41 and name HA2)) (resid 41 and name HN) 	 4.628 2.928 0.000
assign (resid 42 and name HN) (resid 41 and name HN) 	 5.000 3.300 0.000
assign (resid 40 and name HA) (resid 41 and name HN) 	 3.732 2.032 0.000
assign ((resid 41 and name HA2) or (resid 41 and name HA1)) (resid 41 and name HN) 	 4.145 2.445 0.483
assign (resid 40 and name HB) (resid 41 and name HN) 	 5.000 3.300 0.000
assign ((resid 53 and name HB2) or (resid 53 and name HB1)) (resid 41 and name HN) 	 4.409 2.709 0.591
assign ((resid 53 and name HB1) or (resid 53 and name HB2)) (resid 41 and name HN) 	 5.000 3.300 0.000
assign (resid 40 and name HG2#) (resid 41 and name HN) 	 4.433 2.733 0.000
assign ((resid 41 and name HA2) or (resid 41 and name HA1)) (resid 42 and name HN) 	 5.000 3.300 0.000
assign (resid 41 and name HN) (resid 42 and name HN) 	 4.151 2.451 0.000
assign (resid 42 and name HA) (resid 42 and name HN) 	 4.132 2.432 0.000
assign (resid 54 and name HA) (resid 42 and name HN) 	 3.459 1.759 0.000
assign ((resid 42 and name HB2) or (resid 42 and name HB1)) (resid 42 and name HN) 	 4.347 2.647 0.000
assign ((resid 39 and name HB1) or (resid 39 and name HB2)) (resid 42 and name HN) 	 5.000 3.300 0.000
assign ((resid 42 and name HB1) or (resid 42 and name HB2)) (resid 42 and name HN) 	 3.696 1.996 0.651
assign ((resid 54 and name HB2) or (resid 54 and name HB1)) (resid 42 and name HN) 	 4.454 2.754 0.546
assign (resid 42 and name HA) (resid 43 and name HN) 	 3.818 2.118 0.000
assign (resid 31 and name HA) (resid 43 and name HN) 	 3.556 1.856 0.000
assign ((resid 42 and name HB2) or (resid 42 and name HB1)) (resid 43 and name HN) 	 4.108 2.408 0.500
assign (resid 43 and name HG2#) (resid 43 and name HN) 	 3.958 2.258 0.000
assign (resid 43 and name HA) (resid 43 and name HN) 	 3.863 2.163 0.000
assign (resid 45 and name HN) (resid 44 and name HN) 	 4.837 3.137 0.000
assign (resid 43 and name HA) (resid 44 and name HN) 	 4.156 2.456 0.000
assign (resid 43 and name HB) (resid 44 and name HN) 	 3.682 1.982 0.000
assign (resid 44 and name HA) (resid 44 and name HN) 	 3.740 2.040 0.000
assign ((resid 44 and name HB1) or (resid 44 and name HB2)) (resid 44 and name HN) 	 5.000 3.300 0.000
assign ((resid 56 and name HB2) or (resid 56 and name HB1)) (resid 44 and name HN) 	 5.000 3.300 0.000
assign ((resid 55 and name HB1) or (resid 55 and name HB2)) (resid 44 and name HN) 	 4.334 2.634 0.500
assign (resid 43 and name HG2#) (resid 44 and name HN) 	 5.000 3.300 0.000
assign (resid 46 and name HN) (resid 45 and name HN) 	 5.000 3.300 0.000
assign (resid 45 and name HA) (resid 45 and name HN) 	 4.018 2.318 0.000
assign (resid 44 and name HN) (resid 45 and name HN) 	 3.752 2.053 0.000
assign (resid 44 and name HA) (resid 45 and name HN) 	 3.527 1.827 0.000
assign ((resid 45 and name HB2) or (resid 45 and name HB1)) (resid 45 and name HN) 	 3.171 1.471 0.566
assign ((resid 45 and name HB1) or (resid 45 and name HB2)) (resid 45 and name HN) 	 3.737 2.037 0.000
assign ((resid 56 and name HB2) or (resid 56 and name HB1)) (resid 45 and name HN) 	 5.000 3.300 0.000
assign (resid 45 and name HN) (resid 46 and name HN) 	 5.000 3.300 0.000
assign (resid 47 and name HN) (resid 46 and name HN) 	 3.957 2.257 0.000
assign (resid 45 and name HA) (resid 46 and name HN) 	 3.728 2.027 0.000
assign (resid 34 and name HA) (resid 46 and name HN) 	 3.199 1.499 0.000
assign (resid 46 and name HA) (resid 46 and name HN) 	 3.858 2.158 0.000
assign ((resid 46 and name HB2) or (resid 46 and name HB1)) (resid 46 and name HN) 	 4.512 2.812 0.000
assign ((resid 46 and name HB1) or (resid 46 and name HB2)) (resid 46 and name HN) 	 3.668 1.968 0.844
assign ((resid 34 and name HG1#) or (resid 34 and name HG2#)) (resid 46 and name HN)   4.408 2.708 0.000
assign (resid 46 and name HN) (resid 47 and name HN) 	 4.678 2.978 0.000
assign (resid 48 and name HN) (resid 47 and name HN) 	 2.929 1.229 0.000
assign (resid 45 and name HA) (resid 47 and name HN) 	 3.719 2.019 0.000
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assign (resid 35 and name HA) (resid 47 and name HN) 	 3.873 2.173 0.000
assign ((resid 46 and name HB1) or (resid 46 and name HB2)) (resid 47 and name HN) 	 5.000 3.300 0.000
assign (resid 47 and name HG2#) (resid 47 and name HN) 	 3.966 2.266 0.000
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assign (resid 47 and name HN) (resid 48 and name HN) 	 3.129 1.429 0.000
assign (resid 45 and name HA) (resid 48 and name HN) 	 3.699 1.999 0.000
assign (resid 48 and name HA) (resid 48 and name HN) 	 3.788 2.088 0.000
assign (resid 34 and name HA) (resid 48 and name HN) 	 5.000 3.300 0.000
assign (resid 48 and name HB#) (resid 48 and name HN) 	 3.244 1.544 0.000
assign (resid 50 and name HN) (resid 49 and name HN) 	 5.000 3.300 0.000
assign (resid 37 and name HA) (resid 49 and name HN) 	 5.000 3.300 0.000
assign (resid 48 and name HA) (resid 49 and name HN) 	 4.369 2.669 0.000
assign ((resid 49 and name HG1) or (resid 49 and name HG2)) (resid 49 and name HN) 	 5.000 3.300 0.000
assign ((resid 49 and name HB1) or (resid 49 and name HB2)) (resid 49 and name HN) 	 5.000 3.300 0.000
assign (resid 48 and name HB#) (resid 49 and name HN) 	 5.000 3.300 0.000
assign (resid 39 and name HN) (resid 50 and name HN) 	 5.000 3.300 0.000
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assign ((resid 49 and name HB1) or (resid 49 and name HB2)) (resid 50 and name HN) 	 4.062 2.362 0.500
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assign (resid 50 and name HB) (resid 51 and name HN) 	 5.000 3.300 0.000
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assign (resid 50 and name HA) (resid 51 and name HN) 	 2.770 1.070 0.000
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assign (resid 60 and name HB#) (resid 51 and name HN) 	 4.070 2.370 0.000
assign (resid 50 and name HG2#) (resid 51 and name HN) 	 3.635 1.935 0.000
assign ((resid 51 and name HB2) or (resid 51 and name HB1)) (resid 51 and name HN) 	 3.727 2.027 1.135
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assign (resid 51 and name HA) (resid 52 and name HN) 	 2.851 1.151 0.000
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assign ((resid 51 and name HB1) or (resid 51 and name HB2)) (resid 52 and name HN) 	 5.000 3.300 0.000
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assign (resid 55 and name HA) (resid 55 and name HN) 	 4.004 2.304 0.000
assign (resid 43 and name HA) (resid 55 and name HN) 	 3.828 2.128 0.000
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assign (resid 56 and name HA) (resid 56 and name HN) 	 3.768 2.069 0.000
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assign (resid 58 and name HN) (resid 57 and name HN) 	 5.000 3.300 0.000
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assign ((resid 68 and name HB2) or (resid 68 and name HB1)) (resid 57 and name HN) 	 4.950 3.250 0.050
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assign (resid 58 and name HA) (resid 58 and name HN) 	 3.815 2.115 0.000
assign (resid 46 and name HA) (resid 58 and name HN) 	 3.423 1.723 0.000
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assign (resid 60 and name HN) (resid 59 and name HN) 	 3.184 1.484 0.000
assign (resid 58 and name HA) (resid 59 and name HN) 	 4.089 2.389 0.000
assign (resid 59 and name HA) (resid 59 and name HN) 	 3.872 2.172 0.000
assign ((resid 59 and name HG1) or (resid 59 and name HG2)) (resid 59 and name HN) 	 5.000 3.300 0.000
assign ((resid 59 and name HB2) or (resid 59 and name HB1)) (resid 59 and name HN) 	 4.111 2.411 0.000
assign ((resid 59 and name HB1) or (resid 59 and name HB2)) (resid 59 and name HN) 	 3.749 2.049 0.362
assign (resid 58 and name HN) (resid 59 and name HN) 	 5.000 3.300 0.000
assign ((resid 58 and name HB1) or (resid 58 and name HB2)) (resid 59 and name HN) 	 5.000 3.300 0.000
assign (resid 60 and name HB#) (resid 59 and name HN) 	 5.000 3.300 0.000
assign (resid 59 and name HN) (resid 60 and name HN) 	 3.049 1.349 0.000
assign (resid 59 and name HA) (resid 60 and name HN) 	 4.309 2.609 0.000
assign (resid 60 and name HA) (resid 60 and name HN) 	 3.853 2.153 0.000
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assign ((resid 59 and name HB1) or (resid 59 and name HB2)) (resid 60 and name HN) 	 5.000 3.300 0.000
assign (resid 60 and name HB#) (resid 60 and name HN) 	 3.057 1.357 0.000
assign (resid 62 and name HN) (resid 61 and name HN) 	 3.247 1.547 0.000
assign (resid 61 and name HA) (resid 61 and name HN) 	 3.869 2.169 0.000
assign (resid 49 and name HA) (resid 61 and name HN) 	 3.552 1.852 0.000
assign (resid 60 and name HA) (resid 61 and name HN) 	 3.056 1.356 0.000
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assign ((resid 61 and name HB1) or (resid 61 and name HB2)) (resid 62 and name HN) 	 4.337 2.637 0.500
assign (resid 62 and name HA) (resid 62 and name HN) 	 3.973 2.272 0.000
assign (resid 60 and name HA) (resid 62 and name HN) 	 4.616 2.916 0.000
assign (resid 50 and name HA) (resid 62 and name HN) 	 3.841 2.141 0.000
assign (resid 62 and name HB) (resid 62 and name HN) 	 3.525 1.825 0.000
assign (resid 50 and name HG2#) (resid 62 and name HN) 	 5.000 3.300 0.000
assign (resid 61 and name HN) (resid 62 and name HN) 	 3.091 1.391 0.000
assign (resid 61 and name HA) (resid 62 and name HN) 	 5.000 3.300 0.000
assign (resid 60 and name HB#) (resid 62 and name HN) 	 3.464 1.764 0.000
assign (resid 62 and name HA) (resid 63 and name HN) 	 4.378 2.678 0.000
assign (resid 75 and name HA) (resid 63 and name HN) 	 5.000 3.300 0.000
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assign (resid 63 and name HA) (resid 64 and name HN) 	 3.024 1.324 0.000
assign (resid 64 and name HA) (resid 64 and name HN) 	 3.979 2.279 0.000
assign (resid 52 and name HA) (resid 64 and name HN) 	 3.704 2.004 0.000
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assign (resid 64 and name HA) (resid 65 and name HN) 	 3.707 2.007 0.000
assign (resid 65 and name HA) (resid 65 and name HN) 	 3.744 2.044 0.000
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assign ((resid 65 and name HB2) or (resid 65 and name HB1)) (resid 65 and name HN) 	 5.000 3.300 0.000
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assign (resid 66 and name HA) (resid 66 and name HN) 	 4.132 2.432 0.000
assign (resid 78 and name HA) (resid 66 and name HN) 	 3.634 1.934 0.000
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assign ((resid 66 and name HB1) or (resid 66 and name HB2)) (resid 66 and name HN) 	 3.759 2.059 1.241
assign (resid 65 and name HN) (resid 66 and name HN) 	 4.116 2.416 0.000
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assign (resid 66 and name HA) (resid 67 and name HN) 	 3.346 1.646 0.000
assign (resid 67 and name HA) (resid 67 and name HN) 	 4.194 2.494 0.000
assign (resid 55 and name HA) (resid 67 and name HN) 	 3.257 1.557 0.000
assign (resid 67 and name HB) (resid 67 and name HN) 	 3.310 1.610 0.000
assign ((resid 66 and name HB1) or (resid 66 and name HB2)) (resid 67 and name HN) 	 4.555 2.855 0.445
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assign (resid 69 and name HN) (resid 68 and name HN) 	 4.943 3.243 0.000
assign (resid 67 and name HA) (resid 68 and name HN) 	 3.455 1.755 0.000
assign (resid 67 and name HB) (resid 68 and name HN) 	 4.060 2.360 0.000
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assign (resid 67 and name HA) (resid 69 and name HN) 	 5.000 3.300 0.000
assign (resid 69 and name HA) (resid 69 and name HN) 	 3.978 2.278 0.000
assign (resid 68 and name HN) (resid 69 and name HN) 	 3.514 1.814 0.000
assign (resid 70 and name HN) (resid 69 and name HN) 	 5.000 3.300 0.000
assign ((resid 80 and name HA2) or (resid 80 and name HA1)) (resid 69 and name HN) 	 5.000 3.300 0.000
assign ((resid 80 and name HA1) or (resid 80 and name HA2)) (resid 69 and name HN) 	 3.911 2.211 1.089
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assign (resid 71 and name HN) (resid 70 and name HN) 	 4.067 2.367 0.000
assign (resid 69 and name HN) (resid 70 and name HN) 	 5.000 3.300 0.000
assign (resid 70 and name HD1) (resid 70 and name HN) 	 4.082 2.382 0.000
assign (resid 69 and name HA) (resid 70 and name HN) 	 3.253 1.553 0.000
assign (resid 58 and name HA) (resid 70 and name HN) 	 3.641 1.941 0.000
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assign ((resid 70 and name HB1) or (resid 70 and name HB2)) (resid 70 and name HN) 	 3.733 2.033 0.691
assign (resid 70 and name HA) (resid 70 and name HN) 	 3.836 2.136 0.000
assign (resid 72 and name HN) (resid 71 and name HN) 	 3.146 1.446 0.000
assign (resid 70 and name HN) (resid 71 and name HN) 	 4.410 2.710 0.000
assign (resid 71 and name HA) (resid 71 and name HN) 	 3.925 2.225 0.000
assign ((resid 70 and name HB1) or (resid 70 and name HB2)) (resid 71 and name HN) 	 5.000 3.300 0.000
assign ((resid 71 and name HB2) or (resid 71 and name HB1)) (resid 71 and name HN) 	 4.842 3.142 0.000
assign ((resid 71 and name HG1) or (resid 71 and name HG2)) (resid 71 and name HN) 	 5.000 3.300 0.000
assign ((resid 71 and name HB1) or (resid 71 and name HB2)) (resid 71 and name HN) 	 3.434 1.734 1.408
assign (resid 71 and name HN) (resid 72 and name HN) 	 3.082 1.382 0.000
assign (resid 81 and name HA) (resid 72 and name HN) 	 4.874 3.174 0.000
assign (resid 71 and name HA) (resid 72 and name HN) 	 4.272 2.572 0.000
assign (resid 72 and name HA) (resid 72 and name HN) 	 3.860 2.160 0.000
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assign ((resid 82 and name HD1) or (resid 82 and name HD2)) (resid 72 and name HN) 	 4.091 2.391 0.338
assign ((resid 69 and name HB1) or (resid 69 and name HB2)) (resid 72 and name HN) 	 4.666 2.966 0.334
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assign (resid 74 and name HN) (resid 73 and name HN) 	 3.050 1.350 0.000
assign (resid 61 and name HA) (resid 73 and name HN) 	 3.593 1.893 0.000
assign (resid 72 and name HA) (resid 73 and name HN) 	 2.784 1.084 0.000
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assign ((resid 61 and name HB1) or (resid 61 and name HB2)) (resid 73 and name HN) 	 5.000 3.300 0.000
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assign (resid 74 and name HA) (resid 74 and name HN) 	 3.808 2.107 0.000
assign (resid 73 and name HN) (resid 74 and name HN) 	 3.441 1.741 0.000
assign (resid 72 and name HA) (resid 74 and name HN) 	 4.383 2.683 0.000
assign (resid 73 and name HA) (resid 74 and name HN) 	 4.997 3.297 0.000
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assign (resid 72 and name HB#) (resid 74 and name HN) 	 4.383 2.683 0.000
assign (resid 62 and name HA) (resid 74 and name HN) 	 4.274 2.574 0.000
assign (resid 64 and name HA) (resid 76 and name HN) 	 4.138 2.438 0.000
assign (resid 75 and name HA) (resid 76 and name HN) 	 3.067 1.367 0.000
assign (resid 76 and name HA) (resid 76 and name HN) 	 3.889 2.189 0.000
assign (resid 76 and name HB) (resid 76 and name HN) 	 3.577 1.877 0.000
assign (resid 76 and name HG2#) (resid 76 and name HN) 	 4.978 3.278 0.000
assign (resid 64 and name HG2#) (resid 76 and name HN) 	 5.000 3.300 0.000
assign (resid 78 and name HA) (resid 78 and name HN) 	 4.044 2.344 0.000
assign (resid 77 and name HA) (resid 78 and name HN) 	 3.394 1.694 0.000
assign ((resid 78 and name HB1) or (resid 78 and name HB2)) (resid 78 and name HN) 	 3.940 2.240 0.500
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assign (resid 78 and name HA) (resid 79 and name HN) 	 3.378 1.678 0.000
assign (resid 67 and name HA) (resid 79 and name HN) 	 3.529 1.829 0.000
assign (resid 79 and name HA) (resid 79 and name HN) 	 3.871 2.171 0.000
assign ((resid 79 and name HB2) or (resid 79 and name HB1)) (resid 79 and name HN) 	 5.000 3.300 0.000
assign ((resid 79 and name HB1) or (resid 79 and name HB2)) (resid 79 and name HN) 	 4.076 2.376 0.924
assign ((resid 78 and name HB2) or (resid 78 and name HB1)) (resid 79 and name HN) 	 4.044 2.344 0.956
assign ((resid 78 and name HB1) or (resid 78 and name HB2)) (resid 79 and name HN) 	 5.000 3.300 0.000
assign (resid 67 and name HG2#) (resid 79 and name HN) 	 5.000 3.300 0.000
assign (resid 81 and name HN) (resid 80 and name HN) 	 5.000 3.300 0.000
assign (resid 79 and name HA) (resid 80 and name HN) 	 4.460 2.760 0.000
assign ((resid 79 and name HB2) or (resid 79 and name HB1)) (resid 80 and name HN) 	 5.000 3.300 0.000
assign ((resid 80 and name HA2) or (resid 80 and name HA1)) (resid 80 and name HN) 	 5.000 3.300 0.000
assign ((resid 80 and name HA1) or (resid 80 and name HA2)) (resid 80 and name HN) 	 5.000 3.300 0.000
assign ((resid 79 and name HB2) or (resid 79 and name HB1)) (resid 81 and name HN) 	 5.000 3.300 0.000
assign ((resid 80 and name HA2) or (resid 80 and name HA1)) (resid 81 and name HN) 	 4.258 2.558 0.238
assign ((resid 80 and name HA1) or (resid 80 and name HA2)) (resid 81 and name HN) 	 4.497 2.797 0.000
assign (resid 79 and name HA) (resid 81 and name HN) 	 4.660 2.960 0.000
assign (resid 80 and name HN) (resid 81 and name HN) 	 4.020 2.320 0.000
assign (resid 81 and name HA) (resid 81 and name HN) 	 3.898 2.198 0.000
assign ((resid 81 and name HB1) or (resid 81 and name HB2)) (resid 81 and name HN) 	 3.244 1.544 0.500
assign (resid 82 and name HA) (resid 83 and name HN) 	 5.000 3.300 0.000

! 2d noesy
assign (resid 4 and name HA1 ) (resid 4 and name HA2 )     3.400 1.6 0.0
assign (resid 7 and name HB1 ) (resid 7 and name HB2 )     3.400 1.6 0.0
assign (resid 8 and name HB1 ) (resid 8 and name HB2 )     5.000 3.2 0.0
assign (resid 10 and name HB1 ) (resid 10 and name HA )     3.400 1.6 0.0
assign (resid 8 and name HB1 ) (resid 11 and name HB2 )     3.400 1.6 1.0
assign (resid 17 and name HA1 ) (resid 17 and name HA2 )     5.000 3.2 0.0
assign (resid 18 and name HB1 ) (resid 18 and name HB2 )     3.400 1.6 0.0
assign (resid 19 and name HA1 ) (resid 19 and name HA2 )     5.000 3.2 0.0
assign (resid 21 and name HB1 ) (resid 21 and name HB2 )     3.400 1.6 0.0
assign (resid 8 and name HB1 ) (resid 22 and name HD1 )     3.400 1.6 0.0
assign (resid 23 and name HB1 ) (resid 23 and name HB2 )     5.000 3.2 0.0
assign (resid 24 and name HB# ) (resid 22 and name HD1 )     5.000 3.2 0.0
assign (resid 24 and name HB# ) (resid 22 and name HD2 )     5.000 3.2 0.0
assign (resid 25 and name HG## ) (resid 25 and name HB )     3.400 1.6 0.0
assign (resid 27 and name HB1 ) (resid 27 and name HB2 )     3.400 1.6 0.0
assign (resid 28 and name HB ) (resid 16 and name HA )     5.000 3.2 0.0
assign (resid 28 and name HG2# ) (resid 28 and name HB )     3.400 1.6 0.0
assign (resid 29 and name HB1 ) (resid 29 and name HB2 )     2.800 1.0 0.0
assign (resid 30 and name HB1 ) (resid 27 and name HB1 )     5.000 3.2 0.0
assign (resid 27 and name HB1 ) (resid 30 and name HB2 )     5.000 3.2 0.0
assign (resid 31 and name HB1 ) (resid 31 and name HB2 )     2.800 1.0 1.0
assign (resid 31 and name HB2 ) (resid 31 and name HG# )     2.800 1.0 1.0
assign (resid 31 and name HG# ) (resid 32 and name HB2 )     5.000 3.2 0.0
assign (resid 32 and name HB1 ) (resid 32 and name HB2 )     3.400 1.6 0.0
assign (resid 33 and name HB1 ) (resid 33 and name HB2 )     3.400 1.6 0.0
assign (resid 34 and name HG## ) (resid 34 and name HB )     3.400 1.6 0.0
assign (resid 34 and name HG## ) (resid 35 and name HB2 )     5.000 3.2 0.0
assign (resid 36 and name HB# ) (resid 36 and name HA )     5.000 3.2 0.0
assign (resid 38 and name HG2# ) (resid 38 and name HB )     3.400 1.6 0.0
assign (resid 39 and name HB1 ) (resid 39 and name HB2 )     3.400 1.6 0.0
assign (resid 29 and name HB1 ) (resid 41 and name HA1 )     5.000 3.2 0.0
assign (resid 31 and name HA ) (resid 42 and name HA )     5.000 3.2 0.0
assign (resid 42 and name HB1 ) (resid 39 and name HB1 )     5.000 3.2 0.0
assign (resid 41 and name HA1 ) (resid 42 and name HA )     3.400 1.6 1.0
assign (resid 43 and name HG2# ) (resid 42 and name HA )     3.400 1.6 0.0
assign (resid 34 and name HG## ) (resid 44 and name HB1 )     5.000 3.2 0.0
assign (resid 45 and name HB2 ) (resid 39 and name HB2 )     5.000 3.2 0.0
assign (resid 45 and name HB1 ) (resid 45 and name HB2 )     2.800 1.0 0.0
assign (resid 46 and name HB1 ) (resid 46 and name HB2 )     2.800 1.0 0.0
assign (resid 51 and name HB1 ) (resid 51 and name HB2 )     3.400 1.6 0.0
assign (resid 52 and name HB ) (resid 40 and name HA )     5.000 3.2 0.0
assign (resid 52 and name HG2# ) (resid 52 and name HB )     3.400 1.6 0.0
assign (resid 53 and name HB2 ) (resid 41 and name HA1 )     5.000 3.2 0.0
assign (resid 53 and name HB1 ) (resid 53 and name HA )     5.000 3.2 0.0
assign (resid 53 and name HB1 ) (resid 53 and name HB2 )     3.400 1.6 0.0
assign (resid 43 and name HB ) (resid 54 and name HA )     3.400 1.6 0.0
assign (resid 43 and name HG2# ) (resid 54 and name HA )     3.400 1.6 0.0
assign (resid 54 and name HB2 ) (resid 54 and name HA )     5.000 3.2 0.0
assign (resid 54 and name HB1 ) (resid 54 and name HB2 )     5.000 3.2 0.0
assign (resid 55 and name HA ) (resid 54 and name HA )     5.000 3.2 0.0
assign (resid 55 and name HG1 ) (resid 54 and name HA )     5.000 3.2 0.0
assign (resid 55 and name HG2 ) (resid 55 and name HE# )     5.000 3.2 0.0
assign (resid 56 and name HB1 ) (resid 56 and name HB2 )     3.400 1.6 0.0
assign (resid 57 and name HB1 ) (resid 57 and name HB2 )     3.400 1.6 0.0
assign (resid 46 and name HA ) (resid 58 and name HN )     3.400 1.6 1.0
assign (resid 56 and name HB1 ) (resid 58 and name HD# )     3.400 1.6 1.0
assign (resid 57 and name HA ) (resid 58 and name HN )     3.400 1.6 0.0
assign (resid 58 and name HB1 ) (resid 58 and name HB2 )     5.000 3.2 0.0
assign (resid 58 and name HA ) (resid 58 and name HE# )     5.000 3.2 0.5
assign (resid 58 and name HB2 ) (resid 58 and name HE# )     5.000 3.2 0.5
assign (resid 58 and name HA ) (resid 58 and name HN )     3.400 1.6 1.0
assign (resid 58 and name HB1 ) (resid 58 and name HN )     5.000 3.2 0.0
assign (resid 58 and name HB2 ) (resid 58 and name HN )     5.000 3.2 0.0
assign (resid 58 and name HB1 ) (resid 58 and name HZ )     5.000 3.2 0.5
assign (resid 58 and name HB2 ) (resid 58 and name HZ )     5.000 3.2 0.5
assign (resid 59 and name HB1 ) (resid 59 and name HB2 )     3.400 1.6 0.0
assign (resid 59 and name HB2 ) (resid 59 and name HG# )     2.800 1.0 1.0
assign (resid 63 and name HB1 ) (resid 63 and name HB2 )     5.000 3.2 0.0
assign (resid 64 and name HG2# ) (resid 64 and name HB )     5.000 3.2 0.0
assign (resid 65 and name HB1 ) (resid 65 and name HB2 )     3.400 1.6 0.0
assign (resid 66 and name HB2 ) (resid 66 and name HA )     5.000 3.2 0.0
assign (resid 66 and name HB1 ) (resid 66 and name HB2 )     5.000 3.2 0.0
assign (resid 67 and name HG2# ) (resid 55 and name HB# )     5.000 3.2 0.0
assign (resid 67 and name HG2# ) (resid 55 and name HG2 )     5.000 3.2 0.0
assign (resid 68 and name HB2 ) (resid 58 and name HE# )     5.000 3.2 0.0
assign (resid 68 and name HB1 ) (resid 68 and name HB2 )     3.400 1.6 0.0
assign (resid 69 and name HB1 ) (resid 69 and name HB2 )     3.400 1.6 0.0
assign (resid 58 and name HA ) (resid 70 and name HD# )     5.000 3.2 0.5
assign (resid 58 and name HB2 ) (resid 70 and name HD# )     5.000 3.2 0.5
assign (resid 70 and name HD# ) (resid 58 and name HE# )     5.000 3.2 0.5
assign (resid 58 and name HA ) (resid 70 and name HN )     3.400 1.6 1.0
assign (resid 69 and name HA ) (resid 70 and name HN )     3.400 1.6 0.0
assign (resid 70 and name HB1 ) (resid 70 and name HB2 )     3.400 1.6 0.0
assign (resid 70 and name HA ) (resid 70 and name HD# )     5.000 3.2 0.5
assign (resid 70 and name HB1 ) (resid 70 and name HD# )     5.000 3.2 0.5
assign (resid 70 and name HB2 ) (resid 70 and name HD# )     5.000 3.2 0.5
assign (resid 70 and name HE# ) (resid 70 and name HD# )     2.800 1.0 1.0
assign (resid 70 and name HB1 ) (resid 70 and name HN )     5.000 3.2 0.0
assign (resid 70 and name HB2 ) (resid 70 and name HN )     5.000 3.2 0.0
assign (resid 70 and name HN ) (resid 70 and name HD# )     5.000 3.2 0.5
assign (resid 71 and name HB1 ) (resid 71 and name HB2 )     2.800 1.0 1.0
assign (resid 71 and name HD# ) (resid 71 and name HE# )     3.400 1.6 1.0
assign (resid 75 and name HB1 ) (resid 75 and name HB2 )     3.400 1.6 0.0
assign (resid 77 and name HB1 ) (resid 77 and name HB2 )     3.400 1.6 0.0
assign (resid 78 and name HB1 ) (resid 78 and name HA )     5.000 3.2 0.0
assign (resid 78 and name HB2 ) (resid 78 and name HA )     5.000 3.2 0.0
assign (resid 78 and name HB1 ) (resid 78 and name HB2 )     5.000 3.2 0.0
assign (resid 80 and name HA1 ) (resid 70 and name HD# )     5.000 3.2 0.5
assign (resid 80 and name HA2 ) (resid 70 and name HD# )     5.000 3.2 0.5
assign (resid 80 and name HA1 ) (resid 80 and name HA2 )     3.400 1.6 0.0
assign (resid 81 and name HB1 ) (resid 81 and name HB2 )     3.400 1.6 0.0
assign (resid 75 and name HB1 ) (resid 82 and name HA )     5.000 3.2 0.0
assign (resid 82 and name HB1 ) (resid 82 and name HB2 )     2.800 1.0 0.0
assign (resid 82 and name HG# ) (resid 82 and name HB2 )     3.400 1.6 0.0
assign (resid 82 and name HG# ) (resid 82 and name HD1 )     5.000 3.2 0.0
assign (resid 82 and name HG# ) (resid 82 and name HD2 )     5.000 3.2 0.0

! ARIA-derived NOEs - duplicate NOEs removed
assign (resid 16 and name HA ) (resid 16 and name HN ) 2.700 0.900 0.900 
assign (resid 20 and name HB1 ) (resid 20 and name HD21 ) 3.100 1.200 1.200 
assign (resid 20 and name HD22 ) (resid 20 and name HD21 ) 2.000 0.500 0.500 
assign (resid 23 and name HB1 ) (resid 23 and name HD21 ) 2.800 1.000 1.000 
assign (resid 23 and name HB1 ) (resid 23 and name HD22 ) 3.000 1.100 1.100 
assign (resid 23 and name HB2 ) (resid 23 and name HD21 ) 3.100 1.200 1.200 
assign (resid 23 and name HD22 ) (resid 23 and name HD21 ) 2.000 0.500 0.500 
assign (resid 24 and name HB# ) (resid 24 and name HA ) 5.000 3.100 1.500 
assign (resid 29 and name HD22 ) (resid 29 and name HD21 ) 1.900 0.500 0.500 
assign (resid 35 and name HB# ) (resid 35 and name HD# ) 5.000 3.100 2.500 
assign (resid 35 and name HG# ) (resid 35 and name HD# ) 5.000 3.100 2.500 
assign (resid 37 and name HB1 ) (resid 37 and name HD21 ) 3.200 1.300 1.300 
assign (resid 37 and name HD22 ) (resid 37 and name HD21 ) 1.800 0.400 0.400 
assign (resid 42 and name HB1 ) (resid 42 and name HB2 ) 5.000 5.000 0.000 
assign (resid 42 and name HB2 ) (resid 42 and name HA ) 5.000 3.100 0.500 
assign (resid 49 and name HB# ) (resid 49 and name HG# ) 5.000 3.100 2.500 
assign (resid 53 and name HD22 ) (resid 53 and name HD21 ) 1.800 0.400 0.400 
assign (resid 55 and name HD# ) (resid 55 and name HE# ) 5.000 3.100 2.500 
assign (resid 58 and name HE# ) (resid 58 and name HN ) 2.600 2.600 4.300 
assign (resid 58 and name HZ ) (resid 58 and name HE# ) 5.000 3.100 2.900 
assign (resid 59 and name HB1 ) (resid 59 and name HG# ) 5.000 3.100 1.500 
assign (resid 61 and name HB# ) (resid 61 and name HD21 ) 3.100 1.200 2.200 
assign (resid 61 and name HD22 ) (resid 61 and name HD21 ) 2.000 0.500 0.500 
assign (resid 69 and name HB1 ) (resid 69 and name HN ) 2.800 1.000 1.000 
assign (resid 69 and name HB2 ) (resid 69 and name HN ) 2.200 0.600 0.600 
assign (resid 71 and name HD# ) (resid 71 and name HB2 ) 5.000 3.100 1.500 
assign (resid 71 and name HG# ) (resid 71 and name HB2 ) 5.000 3.100 1.500 
assign (resid 77 and name HB1 ) (resid 77 and name HA ) 5.000 3.100 0.500 
assign (resid 79 and name HB1 ) (resid 79 and name HB2 ) 5.000 5.000 0.000 
assign (resid 9 and name HG2# ) (resid 9 and name HB ) 5.000 3.100 1.500 
assign (resid 13 and name HA2 ) (resid 12 and name HN ) 3.200 1.300 1.300 
assign (resid 20 and name HB2 ) (resid 21 and name HN ) 2.900 1.100 1.100 
assign (resid 22 and name HB1 ) (resid 23 and name HD21 ) 3.200 1.300 1.300 
assign (resid 23 and name HD21 ) (resid 24 and name HN ) 3.000 1.100 1.100 
assign (resid 43 and name HA ) (resid 42 and name HN ) 5.000 3.100 0.500 
assign (resid 52 and name HN ) (resid 51 and name HN ) 5.000 3.100 0.500 
assign (resid 58 and name HD# ) (resid 57 and name HN ) 5.000 3.100 2.900 
assign (resid 74 and name HA ) (resid 75 and name HN ) 2.400 0.700 0.700 
assign (resid 78 and name HN ) (resid 77 and name HN ) 5.000 3.100 0.500 
assign (resid 18 and name HN ) (resid 16 and name HN ) 3.300 1.400 1.400 
assign (resid 24 and name HB# ) (resid 21 and name HB1 ) 5.000 3.100 1.500 
assign (resid 30 and name HB1 ) (resid 27 and name HB1 ) 5.000 3.100 0.500 
assign (resid 36 and name HB# ) (resid 33 and name HB1 ) 5.000 3.100 1.500 
assign (resid 48 and name HB# ) (resid 45 and name HB1 ) 5.000 3.100 1.500 
assign (resid 56 and name HA ) (resid 58 and name HZ ) 5.000 3.100 0.500 
assign (resid 60 and name HB# ) (resid 57 and name HB1 ) 5.000 3.100 1.500 
assign (resid 68 and name HA ) (resid 70 and name HE# ) 5.000 3.100 2.900 
assign (resid 68 and name HB1 ) (resid 70 and name HE# ) 5.000 3.100 2.900 
assign (resid 69 and name HB1 ) (resid 71 and name HN ) 3.300 1.400 1.400 
assign (resid 69 and name HB1 ) (resid 72 and name HN ) 3.000 1.100 1.100 
assign (resid 72 and name HB# ) (resid 69 and name HB1 ) 5.000 3.100 1.500 
assign (resid 72 and name HB# ) (resid 75 and name HB1 ) 5.000 3.100 1.500 
assign (resid 12 and name HG2# ) (resid 23 and name HB2 ) 5.000 3.100 1.500 
assign (resid 15 and name HN ) (resid 26 and name HN ) 3.300 1.400 1.400 
assign (resid 20 and name HB2 ) (resid 32 and name HB1 ) 5.000 3.100 0.500 
assign (resid 24 and name HB# ) (resid 15 and name HB2 ) 5.000 3.100 1.500 
assign (resid 25 and name HG2# ) (resid 37 and name HD22 ) 3.400 1.400 3.800 
assign (resid 30 and name HB1 ) (resid 18 and name HB2 ) 5.000 3.100 0.500 
assign (resid 31 and name HB2 ) (resid 19 and name HA1 ) 5.000 3.100 0.500 
assign (resid 35 and name HG# ) (resid 24 and name HB# ) 5.000 3.100 2.500 
assign (resid 36 and name HN ) (resid 48 and name HN ) 3.300 1.400 1.400 
assign (resid 42 and name HB1 ) (resid 33 and name HN ) 3.200 1.300 1.300 
assign (resid 43 and name HG2# ) (resid 55 and name HB# ) 5.000 3.100 2.500 
assign (resid 43 and name HN ) (resid 55 and name HN ) 5.000 3.100 0.500 
assign (resid 44 and name HN ) (resid 55 and name HN ) 3.300 1.400 1.400 
assign (resid 45 and name HA ) (resid 36 and name HN ) 2.500 2.500 2.000 
assign (resid 45 and name HB2 ) (resid 56 and name HA ) 5.000 3.100 0.500 
assign (resid 45 and name HN ) (resid 57 and name HN ) 3.200 1.300 1.300 
assign (resid 46 and name HA ) (resid 58 and name HE# ) 5.000 3.100 2.900 
assign (resid 46 and name HB2 ) (resid 58 and name HE# ) 5.000 3.100 2.900 
assign (resid 46 and name HB2 ) (resid 58 and name HN ) 5.000 3.100 0.500 
assign (resid 46 and name HB2 ) (resid 58 and name HZ ) 5.000 3.100 0.500 
assign (resid 51 and name HB2 ) (resid 42 and name HN ) 3.000 1.100 1.100 
assign (resid 52 and name HB ) (resid 41 and name HN ) 3.200 1.300 1.300 
assign (resid 52 and name HN ) (resid 40 and name HN ) 5.000 3.100 0.500 
assign (resid 63 and name HB2 ) (resid 69 and name HB2 ) 5.000 3.100 0.500 
assign (resid 68 and name HB1 ) (resid 58 and name HE# ) 5.000 3.100 2.900 
assign (resid 68 and name HB1 ) (resid 58 and name HZ ) 5.000 3.100 0.500 
assign (resid 68 and name HB2 ) (resid 56 and name HA ) 5.000 3.100 0.500 
assign (resid 68 and name HB2 ) (resid 58 and name HZ ) 5.000 3.100 0.500 
assign (resid 70 and name HE# ) (resid 58 and name HZ ) 5.000 3.100 2.900 
assign (resid 70 and name HN ) (resid 58 and name HN ) 5.000 3.100 0.500 
assign (resid 72 and name HB# ) (resid 63 and name HB1 ) 5.000 3.100 1.500 
assign (resid 74 and name HB# ) (resid 62 and name HA ) 5.000 3.100 1.500 
assign (resid 79 and name HA ) (resid 68 and name HN ) 3.000 1.100 1.100 
assign (resid 79 and name HB2 ) (resid 68 and name HN ) 3.300 1.400 1.400 
assign (resid 80 and name HA1 ) (resid 68 and name HN ) 3.000 1.100 1.100 
assign (resid 80 and name HA2 ) (resid 68 and name HN ) 2.900 1.100 1.100 
assign (resid 80 and name HN ) (resid 68 and name HN ) 2.800 1.000 1.000 

!phi restraints
assign (resid   2 and name    C) (resid   3 and name    N)
       (resid   3 and name   CA) (resid   3 and name    C)  1.0 -128.0   38.0 2
assign (resid   6 and name    C) (resid   7 and name    N)
       (resid   7 and name   CA) (resid   7 and name    C)  1.0 -130.5   27.5 2
assign (resid  10 and name    C) (resid  11 and name    N)
       (resid  11 and name   CA) (resid  11 and name    C)  1.0 -120.0   44.0 2
assign (resid  11 and name    C) (resid  12 and name    N)
       (resid  12 and name   CA) (resid  12 and name    C)  1.0 -120.0   24.0 2
assign (resid  13 and name    C) (resid  14 and name    N)
       (resid  14 and name   CA) (resid  14 and name    C)  1.0 -103.0   32.0 2
assign (resid  14 and name    C) (resid  15 and name    N)
       (resid  15 and name   CA) (resid  15 and name    C)  1.0 -120.0   34.0 2
assign (resid  15 and name    C) (resid  16 and name    N)
       (resid  16 and name   CA) (resid  16 and name    C)  1.0 -120.0   20.0 2
assign (resid  17 and name    C) (resid  18 and name    N)
       (resid  18 and name   CA) (resid  18 and name    C)  1.0 -120.0   27.0 2
assign (resid  19 and name    C) (resid  20 and name    N)
       (resid  20 and name   CA) (resid  20 and name    C)  1.0 -120.0   37.0 2
assign (resid  20 and name    C) (resid  21 and name    N)
       (resid  21 and name   CA) (resid  21 and name    C)  1.0 -120.0   20.0 2
assign (resid  24 and name    C) (resid  25 and name    N)
       (resid  25 and name   CA) (resid  25 and name    C)  1.0 -103.5   20.0 2
assign (resid  26 and name    C) (resid  27 and name    N)
       (resid  27 and name   CA) (resid  27 and name    C)  1.0 -134.5   20.0 2
assign (resid  27 and name    C) (resid  28 and name    N)
       (resid  28 and name   CA) (resid  28 and name    C)  1.0 -120.0   22.0 2
assign (resid  28 and name    C) (resid  29 and name    N)
       (resid  29 and name   CA) (resid  29 and name    C)  1.0   60.0   21.0 2
assign (resid  29 and name    C) (resid  30 and name    N)
       (resid  30 and name   CA) (resid  30 and name    C)  1.0   60.0   21.0 2
assign (resid  30 and name    C) (resid  31 and name    N)
       (resid  31 and name   CA) (resid  31 and name    C)  1.0 -120.0   20.0 2
assign (resid  32 and name    C) (resid  33 and name    N)
       (resid  33 and name   CA) (resid  33 and name    C)  1.0 -128.5   32.5 2
assign (resid  33 and name    C) (resid  34 and name    N)
       (resid  34 and name   CA) (resid  34 and name    C)  1.0  -74.5   20.0 2
assign (resid  34 and name    C) (resid  35 and name    N)
       (resid  35 and name   CA) (resid  35 and name    C)  1.0 -120.0   25.0 2
assign (resid  35 and name    C) (resid  36 and name    N)
       (resid  36 and name   CA) (resid  36 and name    C)  1.0 -120.0   55.0 2
assign (resid  36 and name    C) (resid  37 and name    N)
       (resid  37 and name   CA) (resid  37 and name    C)  1.0  -81.5   20.0 2
assign (resid  38 and name    C) (resid  39 and name    N)
       (resid  39 and name   CA) (resid  39 and name    C)  1.0 -120.0   26.0 2
assign (resid  39 and name    C) (resid  40 and name    N)
       (resid  40 and name   CA) (resid  40 and name    C)  1.0 -120.0   31.0 2
assign (resid  41 and name    C) (resid  42 and name    N)
       (resid  42 and name   CA) (resid  42 and name    C)  1.0 -147.5   20.0 2
assign (resid  42 and name    C) (resid  43 and name    N)
       (resid  43 and name   CA) (resid  43 and name    C)  1.0 -120.0   20.0 2
assign (resid  44 and name    C) (resid  45 and name    N)
       (resid  45 and name   CA) (resid  45 and name    C)  1.0 -156.0   20.0 2
assign (resid  45 and name    C) (resid  46 and name    N)
       (resid  46 and name   CA) (resid  46 and name    C)  1.0 -114.0   61.0 2
assign (resid  46 and name    C) (resid  47 and name    N)
       (resid  47 and name   CA) (resid  47 and name    C)  1.0 -112.5   40.5 2
assign (resid  47 and name    C) (resid  48 and name    N)
       (resid  48 and name   CA) (resid  48 and name    C)  1.0  -51.0   20.0 2
assign (resid  48 and name    C) (resid  49 and name    N)
       (resid  49 and name   CA) (resid  49 and name    C)  1.0  -93.5   20.0 2
assign (resid  50 and name    C) (resid  51 and name    N)
       (resid  51 and name   CA) (resid  51 and name    C)  1.0 -157.5   20.0 2
assign (resid  53 and name    C) (resid  54 and name    N)
       (resid  54 and name   CA) (resid  54 and name    C)  1.0 -120.0   25.0 2
assign (resid  54 and name    C) (resid  55 and name    N)
       (resid  55 and name   CA) (resid  55 and name    C)  1.0 -120.0   28.0 2
assign (resid  55 and name    C) (resid  56 and name    N)
       (resid  56 and name   CA) (resid  56 and name    C)  1.0 -120.0   28.0 2
assign (resid  58 and name    C) (resid  59 and name    N)
       (resid  59 and name   CA) (resid  59 and name    C)  1.0 -120.0   26.0 2
assign (resid  61 and name    C) (resid  62 and name    N)
       (resid  62 and name   CA) (resid  62 and name    C)  1.0 -120.0   31.0 2
assign (resid  62 and name    C) (resid  63 and name    N)
       (resid  63 and name   CA) (resid  63 and name    C)  1.0 -115.5   44.5 2
assign (resid  63 and name    C) (resid  64 and name    N)
       (resid  64 and name   CA) (resid  64 and name    C)  1.0 -120.0   25.0 2
assign (resid  65 and name    C) (resid  66 and name    N)
       (resid  66 and name   CA) (resid  66 and name    C)  1.0 -144.5   24.5 2
assign (resid  66 and name    C) (resid  67 and name    N)
       (resid  67 and name   CA) (resid  67 and name    C)  1.0 -120.0   20.0 2
assign (resid  68 and name    C) (resid  69 and name    N)
       (resid  69 and name   CA) (resid  69 and name    C)  1.0 -121.5   36.5 2
assign (resid  71 and name    C) (resid  72 and name    N)
       (resid  72 and name   CA) (resid  72 and name    C)  1.0 -115.0   63.0 2
assign (resid  72 and name    C) (resid  73 and name    N)
       (resid  73 and name   CA) (resid  73 and name    C)  1.0  -98.0   22.0 2
assign (resid  73 and name    C) (resid  74 and name    N)
       (resid  74 and name   CA) (resid  74 and name    C)  1.0 -120.0   25.0 2
assign (resid  74 and name    C) (resid  75 and name    N)
       (resid  75 and name   CA) (resid  75 and name    C)  1.0 -120.0   29.0 2
assign (resid  77 and name    C) (resid  78 and name    N)
       (resid  78 and name   CA) (resid  78 and name    C)  1.0 -120.0   41.0 2
assign (resid  78 and name    C) (resid  79 and name    N)
       (resid  79 and name   CA) (resid  79 and name    C)  1.0 -111.0   31.0 2
assign (resid  80 and name    C) (resid  81 and name    N)
       (resid  81 and name   CA) (resid  81 and name    C)  1.0 -120.0   39.0 2

!psi restraints
assign (resid   7 and name 	  N) (resid   7 and name   CA)
       (resid   7 and name    C) (resid   8 and name    N)  1.0  120.0  100.0 2
assign (resid  10 and name    N) (resid  10 and name   CA)
       (resid  10 and name    C) (resid  11 and name    N)  1.0  -30.0  110.0 2
assign (resid  11 and name    N) (resid  11 and name   CA)
       (resid  11 and name    C) (resid  12 and name    N)  1.0  120.0  100.0 2
assign (resid  14 and name    N) (resid  14 and name   CA)
       (resid  14 and name    C) (resid  15 and name    N)  1.0  120.0  100.0 2
assign (resid  20 and name    N) (resid  20 and name   CA)
       (resid  20 and name    C) (resid  21 and name    N)  1.0  120.0  100.0 2
assign (resid  23 and name    N) (resid  23 and name   CA)
       (resid  23 and name    C) (resid  24 and name    N)  1.0  -30.0  110.0 2
assign (resid  24 and name    N) (resid  24 and name   CA)
       (resid  24 and name    C) (resid  25 and name    N)  1.0  120.0  100.0 2
assign (resid  25 and name    N) (resid  25 and name   CA)
       (resid  25 and name    C) (resid  26 and name    N)  1.0  -30.0  110.0 2
assign (resid  26 and name    N) (resid  26 and name   CA)
       (resid  26 and name    C) (resid  27 and name    N)  1.0  120.0  100.0 2
assign (resid  28 and name    N) (resid  28 and name   CA)
       (resid  28 and name    C) (resid  29 and name    N)  1.0  110.0  110.0 2
assign (resid  29 and name    N) (resid  29 and name   CA)
       (resid  29 and name    C) (resid  30 and name    N)  1.0  120.0  100.0 2
assign (resid  30 and name    N) (resid  30 and name   CA)
       (resid  30 and name    C) (resid  31 and name    N)  1.0  120.0  100.0 2
assign (resid  31 and name    N) (resid  31 and name   CA)
       (resid  31 and name    C) (resid  32 and name    N)  1.0  120.0  100.0 2
assign (resid  32 and name    N) (resid  32 and name   CA)
       (resid  32 and name    C) (resid  33 and name    N)  1.0  120.0  100.0 2
assign (resid  33 and name    N) (resid  33 and name   CA)
       (resid  33 and name    C) (resid  34 and name    N)  1.0  120.0  100.0 2
assign (resid  34 and name    N) (resid  34 and name   CA)
       (resid  34 and name    C) (resid  35 and name    N)  1.0  -30.0  110.0 2
assign (resid  35 and name    N) (resid  35 and name   CA)
       (resid  35 and name    C) (resid  36 and name    N)  1.0  -30.0  110.0 2
assign (resid  36 and name    N) (resid  36 and name   CA)
       (resid  36 and name    C) (resid  37 and name    N)  1.0  120.0  100.0 2
assign (resid  38 and name    N) (resid  38 and name   CA)
       (resid  38 and name    C) (resid  39 and name    N)  1.0  120.0  100.0 2
assign (resid  39 and name    N) (resid  39 and name   CA)
       (resid  39 and name    C) (resid  40 and name    N)  1.0  120.0  100.0 2
assign (resid  42 and name    N) (resid  42 and name   CA)
       (resid  42 and name    C) (resid  43 and name    N)  1.0  110.0  110.0 2
assign (resid  43 and name    N) (resid  43 and name   CA)
       (resid  43 and name    C) (resid  44 and name    N)  1.0  -30.0  110.0 2
assign (resid  44 and name    N) (resid  44 and name   CA)
       (resid  44 and name    C) (resid  45 and name    N)  1.0  120.0  100.0 2
assign (resid  45 and name    N) (resid  45 and name   CA)
       (resid  45 and name    C) (resid  46 and name    N)  1.0  110.0  110.0 2
assign (resid  49 and name    N) (resid  49 and name   CA)
       (resid  49 and name    C) (resid  50 and name    N)  1.0  110.0  110.0 2
assign (resid  50 and name    N) (resid  50 and name   CA)
       (resid  50 and name    C) (resid  51 and name    N)  1.0  120.0  100.0 2
assign (resid  51 and name    N) (resid  51 and name   CA)
       (resid  51 and name    C) (resid  52 and name    N)  1.0  120.0  100.0 2
assign (resid  52 and name    N) (resid  52 and name   CA)
       (resid  52 and name    C) (resid  53 and name    N)  1.0  110.0  110.0 2
assign (resid  53 and name    N) (resid  53 and name   CA)
       (resid  53 and name    C) (resid  54 and name    N)  1.0  120.0  100.0 2
assign (resid  54 and name    N) (resid  54 and name   CA)
       (resid  54 and name    C) (resid  55 and name    N)  1.0  120.0  100.0 2
assign (resid  55 and name    N) (resid  55 and name   CA)
       (resid  55 and name    C) (resid  56 and name    N)  1.0  120.0  100.0 2
assign (resid  56 and name    N) (resid  56 and name   CA)
       (resid  56 and name    C) (resid  57 and name    N)  1.0  120.0  100.0 2
assign (resid  57 and name    N) (resid  57 and name   CA)
       (resid  57 and name    C) (resid  58 and name    N)  1.0  120.0  100.0 2
assign (resid  58 and name    N) (resid  58 and name   CA)
       (resid  58 and name    C) (resid  59 and name    N)  1.0  -30.0  110.0 2
assign (resid  59 and name    N) (resid  59 and name   CA)
       (resid  59 and name    C) (resid  60 and name    N)  1.0  -30.0  110.0 2
assign (resid  60 and name    N) (resid  60 and name   CA)
       (resid  60 and name    C) (resid  61 and name    N)  1.0  120.0  100.0 2
assign (resid  61 and name    N) (resid  61 and name   CA)
       (resid  61 and name    C) (resid  62 and name    N)  1.0  -30.0  110.0 2
assign (resid  63 and name    N) (resid  63 and name   CA)
       (resid  63 and name    C) (resid  64 and name    N)  1.0  120.0  100.0 2
assign (resid  64 and name    N) (resid  64 and name   CA)
       (resid  64 and name    C) (resid  65 and name    N)  1.0  110.0  110.0 2
assign (resid  65 and name    N) (resid  65 and name   CA)
       (resid  65 and name    C) (resid  66 and name    N)  1.0  120.0  100.0 2
assign (resid  66 and name    N) (resid  66 and name   CA)
       (resid  66 and name    C) (resid  67 and name    N)  1.0  120.0  100.0 2
assign (resid  67 and name    N) (resid  67 and name   CA)
       (resid  67 and name    C) (resid  68 and name    N)  1.0  120.0  100.0 2
assign (resid  68 and name    N) (resid  68 and name   CA)
       (resid  68 and name    C) (resid  69 and name    N)  1.0  120.0  100.0 2
assign (resid  69 and name    N) (resid  69 and name   CA)
       (resid  69 and name    C) (resid  70 and name    N)  1.0  120.0  100.0 2
assign (resid  71 and name    N) (resid  71 and name   CA)
       (resid  71 and name    C) (resid  72 and name    N)  1.0  -30.0  110.0 2
assign (resid  72 and name    N) (resid  72 and name   CA)
       (resid  72 and name    C) (resid  73 and name    N)  1.0  120.0  100.0 2
assign (resid  73 and name    N) (resid  73 and name   CA)
       (resid  73 and name    C) (resid  74 and name    N)  1.0  -30.0  110.0 2
assign (resid  75 and name    N) (resid  75 and name   CA)
       (resid  75 and name    C) (resid  76 and name    N)  1.0  120.0  100.0 2
assign (resid  77 and name    N) (resid  77 and name   CA)
       (resid  77 and name    C) (resid  78 and name    N)  1.0  120.0  100.0 2
assign (resid  78 and name    N) (resid  78 and name   CA)
       (resid  78 and name    C) (resid  79 and name    N)  1.0  120.0  100.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLN   1          1H        GLN   1 -11.325  20.413  -0.002
    2   2H    GLN   1          2H        GLN   1 -11.575  22.099   0.199
    3   3H    GLN   1          3H        GLN   1 -12.282  20.987   1.298
    4    HA   GLN   1           HA       GLN   1 -10.267  22.205   2.063
    5   1HB   GLN   1          1HB       GLN   1 -11.329  19.984   2.879
    6   2HB   GLN   1          2HB       GLN   1  -9.969  19.211   2.079
    7   1HG   GLN   1          1HG       GLN   1  -9.807  21.243   4.295
    8   2HG   GLN   1          2HG       GLN   1  -9.538  19.507   4.445
    9   1HE2  GLN   1          1HE2      GLN   1  -7.676  18.595   3.512
   10   2HE2  GLN   1          2HE2      GLN   1  -6.293  19.560   3.139
   11    H    CYS   2           H        CYS   2  -9.559  19.392  -0.016
   12    HA   CYS   2           HA       CYS   2  -7.630  20.665  -1.592
   13   1HB   CYS   2          1HB       CYS   2  -6.298  20.805   0.446
   14   2HB   CYS   2          2HB       CYS   2  -6.496  19.079   0.724
   15    H    THR   3           H        THR   3  -8.583  17.651  -0.030
   16    HA   THR   3           HA       THR   3  -8.153  16.263  -2.594
   17    HB   THR   3           HB       THR   3  -7.986  15.109   0.195
   18    HG1  THR   3           HG1      THR   3  -5.938  15.532  -1.718
   19   1HG2  THR   3          1HG2      THR   3  -7.986  13.073  -0.656
   20   2HG2  THR   3          2HG2      THR   3  -6.779  13.520  -1.862
   21   3HG2  THR   3          3HG2      THR   3  -8.493  13.771  -2.194
   22    H    GLY   4           H        GLY   4 -10.191  16.432  -3.439
   23   1HA   GLY   4          1HA       GLY   4 -12.154  14.606  -2.535
   24   2HA   GLY   4          2HA       GLY   4 -12.605  16.240  -2.055
   25    H    GLY   5           H        GLY   5 -12.312  13.994  -4.666
   26   1HA   GLY   5          1HA       GLY   5 -14.244  14.903  -6.293
   27   2HA   GLY   5          2HA       GLY   5 -12.910  15.969  -6.707
   28    H    ALA   6           H        ALA   6 -11.463  15.296  -8.172
   29    HA   ALA   6           HA       ALA   6 -10.970  12.484  -8.618
   30   1HB   ALA   6          1HB       ALA   6 -11.849  12.244 -10.739
   31   2HB   ALA   6          2HB       ALA   6 -11.913  13.983 -11.024
   32   3HB   ALA   6          3HB       ALA   6 -13.082  13.224  -9.942
   33    H    ASP   7           H        ASP   7  -9.548  15.062  -7.962
   34    HA   ASP   7           HA       ASP   7  -7.255  14.587  -9.639
   35   1HB   ASP   7          1HB       ASP   7  -8.603  17.299  -9.689
   36   2HB   ASP   7          2HB       ASP   7  -7.035  16.921 -10.407
   37    H    CYS   8           H        CYS   8  -5.586  14.590  -8.285
   38    HA   CYS   8           HA       CYS   8  -5.663  16.429  -5.984
   39   1HB   CYS   8          1HB       CYS   8  -4.859  13.563  -6.193
   40   2HB   CYS   8          2HB       CYS   8  -3.982  14.589  -5.055
   41    H    THR   9           H        THR   9  -2.853  14.488  -6.689
   42    HA   THR   9           HA       THR   9  -0.681  15.132  -7.003
   43    HB   THR   9           HB       THR   9  -0.595  16.711  -9.157
   44    HG1  THR   9           HG1      THR   9  -2.476  16.285 -10.410
   45   1HG2  THR   9          1HG2      THR   9  -1.292  13.805  -9.023
   46   2HG2  THR   9          2HG2      THR   9   0.251  14.564  -9.415
   47   3HG2  THR   9          3HG2      THR   9  -1.084  14.635 -10.566
   48    H    SER  10           H        SER  10  -2.175  16.826  -5.149
   49    HA   SER  10           HA       SER  10  -0.519  19.245  -5.387
   50   1HB   SER  10          1HB       SER  10  -2.867  19.769  -6.010
   51   2HB   SER  10          2HB       SER  10  -3.388  19.208  -4.421
   52    HG   SER  10           HG       SER  10  -2.150  20.865  -3.494
   53    H    CYS  11           H        CYS  11  -2.688  17.559  -3.106
   54    HA   CYS  11           HA       CYS  11  -1.211  18.474  -0.826
   55   1HB   CYS  11          1HB       CYS  11  -3.651  16.916  -1.328
   56   2HB   CYS  11          2HB       CYS  11  -2.759  16.407   0.101
   57    H    THR  12           H        THR  12  -0.414  16.848   0.833
   58    HA   THR  12           HA       THR  12   0.964  14.616  -0.508
   59    HB   THR  12           HB       THR  12   2.532  16.457  -0.040
   60    HG1  THR  12           HG1      THR  12   2.855  14.170   1.602
   61   1HG2  THR  12          1HG2      THR  12   2.359  16.009   2.880
   62   2HG2  THR  12          2HG2      THR  12   1.175  17.085   2.135
   63   3HG2  THR  12          3HG2      THR  12   2.899  17.424   1.975
   64    H    GLY  13           H        GLY  13  -1.549  14.785   1.113
   65   1HA   GLY  13          1HA       GLY  13  -0.756  13.158   3.430
   66   2HA   GLY  13          2HA       GLY  13  -2.292  13.994   3.256
   67    H    ALA  14           H        ALA  14  -3.905  12.606   3.059
   68    HA   ALA  14           HA       ALA  14  -3.439  10.099   1.586
   69   1HB   ALA  14          1HB       ALA  14  -5.868  10.344   3.236
   70   2HB   ALA  14          2HB       ALA  14  -4.339  10.344   4.114
   71   3HB   ALA  14          3HB       ALA  14  -4.747   8.995   3.054
   72    H    CYS  15           H        CYS  15  -4.627   9.626  -0.183
   73    HA   CYS  15           HA       CYS  15  -6.398  11.715  -1.180
   74   1HB   CYS  15          1HB       CYS  15  -6.075   9.376  -2.908
   75   2HB   CYS  15          2HB       CYS  15  -5.812  11.077  -3.259
   76    H    THR  16           H        THR  16  -8.552  11.465  -1.612
   77    HA   THR  16           HA       THR  16  -9.792   8.871  -1.066
   78    HB   THR  16           HB       THR  16 -10.718  11.455   0.207
   79    HG1  THR  16           HG1      THR  16  -9.611   9.165   1.453
   80   1HG2  THR  16          1HG2      THR  16 -12.636  10.138  -0.089
   81   2HG2  THR  16          2HG2      THR  16 -12.125   9.867   1.576
   82   3HG2  THR  16          3HG2      THR  16 -11.783   8.656   0.341
   83    H    GLY  17           H        GLY  17  -9.686   9.304  -3.525
   84   1HA   GLY  17          1HA       GLY  17 -11.421   9.231  -5.188
   85   2HA   GLY  17          2HA       GLY  17 -12.278  10.479  -4.284
   86    H    CYS  18           H        CYS  18  -9.222   9.942  -6.026
   87    HA   CYS  18           HA       CYS  18  -9.543  12.600  -7.234
   88   1HB   CYS  18          1HB       CYS  18  -7.322  11.655  -5.530
   89   2HB   CYS  18          2HB       CYS  18  -6.837  12.468  -7.020
   90    H    GLY  19           H        GLY  19  -6.939  10.189  -7.389
   91   1HA   GLY  19          1HA       GLY  19  -7.139   8.559  -9.320
   92   2HA   GLY  19          2HA       GLY  19  -7.445   9.994 -10.293
   93    H    ASN  20           H        ASN  20  -5.372  11.327  -8.367
   94    HA   ASN  20           HA       ASN  20  -2.910  10.069  -9.181
   95   1HB   ASN  20          1HB       ASN  20  -2.742  12.826 -10.041
   96   2HB   ASN  20          2HB       ASN  20  -2.343  11.357 -10.922
   97   1HD2  ASN  20          1HD2      ASN  20  -4.781  13.732 -10.258
   98   2HD2  ASN  20          2HD2      ASN  20  -5.849  13.294 -11.544
   99    H    CYS  21           H        CYS  21  -1.737  10.147  -7.400
  100    HA   CYS  21           HA       CYS  21  -1.779  12.621  -5.801
  101   1HB   CYS  21          1HB       CYS  21  -2.126   9.824  -5.013
  102   2HB   CYS  21          2HB       CYS  21  -0.892  10.663  -4.068
  103    HA   PRO  22           HA       PRO  22   2.591  12.677  -6.291
  104   1HB   PRO  22          1HB       PRO  22   3.364  14.099  -4.124
  105   2HB   PRO  22          2HB       PRO  22   2.468  14.804  -5.469
  106   1HG   PRO  22          1HG       PRO  22   1.552  14.134  -2.748
  107   2HG   PRO  22          2HG       PRO  22   0.916  15.324  -3.891
  108   1HD   PRO  22          1HD       PRO  22  -0.116  12.731  -3.328
  109   2HD   PRO  22          2HD       PRO  22  -0.682  13.876  -4.558
  110    H    ASN  23           H        ASN  23   2.766  12.626  -2.758
  111    HA   ASN  23           HA       ASN  23   4.135  10.022  -2.943
  112   1HB   ASN  23          1HB       ASN  23   4.952  11.826  -0.746
  113   2HB   ASN  23          2HB       ASN  23   5.924  10.745  -1.744
  114   1HD2  ASN  23          1HD2      ASN  23   4.116  13.782  -1.889
  115   2HD2  ASN  23          2HD2      ASN  23   5.196  14.577  -2.980
  116    H    ALA  24           H        ALA  24   1.322  10.776  -2.196
  117    HA   ALA  24           HA       ALA  24   0.826  10.634   0.518
  118   1HB   ALA  24          1HB       ALA  24  -0.800   9.312  -1.653
  119   2HB   ALA  24          2HB       ALA  24  -0.899  11.014  -1.200
  120   3HB   ALA  24          3HB       ALA  24  -1.367   9.765  -0.045
  121    H    VAL  25           H        VAL  25   0.425   8.941   1.978
  122    HA   VAL  25           HA       VAL  25   2.023   6.576   1.500
  123    HB   VAL  25           HB       VAL  25   1.813   6.080   3.792
  124   1HG1  VAL  25          1HG1      VAL  25   1.766   9.086   3.564
  125   2HG1  VAL  25          2HG1      VAL  25   3.178   8.055   3.335
  126   3HG1  VAL  25          3HG1      VAL  25   2.406   8.157   4.919
  127   1HG2  VAL  25          1HG2      VAL  25  -0.588   6.207   4.027
  128   2HG2  VAL  25          2HG2      VAL  25  -0.541   7.965   3.874
  129   3HG2  VAL  25          3HG2      VAL  25   0.178   7.183   5.281
  130    H    THR  26           H        THR  26  -1.343   7.451   1.644
  131    HA   THR  26           HA       THR  26  -2.059   4.878   0.545
  132    HB   THR  26           HB       THR  26  -2.185   4.481   2.974
  133    HG1  THR  26           HG1      THR  26  -3.825   3.276   2.543
  134   1HG2  THR  26          1HG2      THR  26  -2.787   6.824   3.616
  135   2HG2  THR  26          2HG2      THR  26  -3.748   5.558   4.384
  136   3HG2  THR  26          3HG2      THR  26  -4.418   6.481   3.037
  137    H    CYS  27           H        CYS  27  -4.480   4.815   0.132
  138    HA   CYS  27           HA       CYS  27  -5.756   7.384  -0.180
  139   1HB   CYS  27          1HB       CYS  27  -5.968   6.246  -2.778
  140   2HB   CYS  27          2HB       CYS  27  -5.246   7.785  -2.316
  141    H    THR  28           H        THR  28  -7.918   7.226  -0.172
  142    HA   THR  28           HA       THR  28  -9.050   4.529  -0.055
  143    HB   THR  28           HB       THR  28 -10.274   7.183   0.734
  144    HG1  THR  28           HG1      THR  28  -9.332   6.909   2.574
  145   1HG2  THR  28          1HG2      THR  28 -11.416   4.547   0.501
  146   2HG2  THR  28          2HG2      THR  28 -12.195   6.093   0.838
  147   3HG2  THR  28          3HG2      THR  28 -11.500   5.150   2.156
  148    H    ASN  29           H        ASN  29  -9.409   3.925  -2.136
  149    HA   ASN  29           HA       ASN  29 -10.658   3.692  -3.993
  150   1HB   ASN  29          1HB       ASN  29 -11.869   6.417  -3.562
  151   2HB   ASN  29          2HB       ASN  29 -12.521   5.063  -4.487
  152   1HD2  ASN  29          1HD2      ASN  29 -13.276   3.211  -3.319
  153   2HD2  ASN  29          2HD2      ASN  29 -13.866   3.389  -1.705
  154    H    SER  30           H        SER  30 -11.147   5.225  -6.011
  155    HA   SER  30           HA       SER  30 -10.356   6.603  -7.682
  156   1HB   SER  30          1HB       SER  30  -9.136   7.747  -5.479
  157   2HB   SER  30          2HB       SER  30  -7.772   7.325  -6.515
  158    HG   SER  30           HG       SER  30  -9.041   8.393  -8.234
  159    H    GLN  31           H        GLN  31  -7.656   6.882  -8.539
  160    HA   GLN  31           HA       GLN  31  -6.705   4.122  -8.778
  161   1HB   GLN  31          1HB       GLN  31  -8.207   4.542 -10.685
  162   2HB   GLN  31          2HB       GLN  31  -7.230   5.939 -11.137
  163   1HG   GLN  31          1HG       GLN  31  -5.285   4.240 -11.238
  164   2HG   GLN  31          2HG       GLN  31  -6.566   3.031 -11.318
  165   1HE2  GLN  31          1HE2      GLN  31  -5.910   6.214 -12.755
  166   2HE2  GLN  31          2HE2      GLN  31  -6.273   5.745 -14.379
  167    H    HIS  32           H        HIS  32  -4.952   4.834  -7.443
  168    HA   HIS  32           HA       HIS  32  -2.606   5.397  -8.722
  169   1HB   HIS  32          1HB       HIS  32  -4.163   7.780  -8.525
  170   2HB   HIS  32          2HB       HIS  32  -2.766   7.953  -7.459
  171    HD1  HIS  32           HD1      HIS  32  -3.485   6.991 -11.071
  172    HD2  HIS  32           HD2      HIS  32  -0.512   8.732  -8.745
  173    HE1  HIS  32           HE1      HIS  32  -1.714   7.739 -12.692
  174    HE2  HIS  32           HE2      HIS  32   0.032   8.870 -11.270
  175    H    CYS  33           H        CYS  33  -3.253   3.738  -6.747
  176    HA   CYS  33           HA       CYS  33  -1.965   4.854  -4.340
  177   1HB   CYS  33          1HB       CYS  33  -4.430   3.566  -4.597
  178   2HB   CYS  33          2HB       CYS  33  -3.357   2.331  -3.940
  179    H    VAL  34           H        VAL  34  -0.677   3.703  -6.749
  180    HA   VAL  34           HA       VAL  34   0.175   1.082  -6.402
  181    HB   VAL  34           HB       VAL  34   0.575   2.374  -8.457
  182   1HG1  VAL  34          1HG1      VAL  34   2.829   3.717  -6.979
  183   2HG1  VAL  34          2HG1      VAL  34   1.266   4.475  -7.284
  184   3HG1  VAL  34          3HG1      VAL  34   2.299   4.011  -8.636
  185   1HG2  VAL  34          1HG2      VAL  34   3.253   1.488  -7.449
  186   2HG2  VAL  34          2HG2      VAL  34   2.543   1.285  -9.051
  187   3HG2  VAL  34          3HG2      VAL  34   1.948   0.327  -7.695
  188    H    LYS  35           H        LYS  35   1.744   4.063  -5.239
  189    HA   LYS  35           HA       LYS  35   3.617   2.425  -3.710
  190   1HB   LYS  35          1HB       LYS  35   5.036   4.265  -3.604
  191   2HB   LYS  35          2HB       LYS  35   4.298   4.429  -5.187
  192   1HG   LYS  35          1HG       LYS  35   3.698   6.006  -2.699
  193   2HG   LYS  35          2HG       LYS  35   4.364   6.584  -4.224
  194   1HD   LYS  35          1HD       LYS  35   2.225   5.985  -5.328
  195   2HD   LYS  35          2HD       LYS  35   1.571   5.549  -3.748
  196   1HE   LYS  35          1HE       LYS  35   1.794   7.799  -2.966
  197   2HE   LYS  35          2HE       LYS  35   2.681   8.269  -4.414
  198   1HZ   LYS  35          1HZ       LYS  35  -0.157   7.394  -4.343
  199   2HZ   LYS  35          2HZ       LYS  35   0.696   7.869  -5.724
  200   3HZ   LYS  35          3HZ       LYS  35   0.375   8.993  -4.501
  201    H    ALA  36           H        ALA  36   0.848   2.567  -2.913
  202    HA   ALA  36           HA       ALA  36   1.003   4.124  -0.429
  203   1HB   ALA  36          1HB       ALA  36  -1.204   3.239  -2.171
  204   2HB   ALA  36          2HB       ALA  36  -1.016   4.724  -1.238
  205   3HB   ALA  36          3HB       ALA  36  -1.529   3.239  -0.439
  206    H    ASN  37           H        ASN  37   0.425   3.175   1.582
  207    HA   ASN  37           HA       ASN  37   1.440   0.528   1.917
  208   1HB   ASN  37          1HB       ASN  37   0.441   2.687   3.683
  209   2HB   ASN  37          2HB       ASN  37   0.328   1.048   4.319
  210   1HD2  ASN  37          1HD2      ASN  37   2.117   3.597   4.628
  211   2HD2  ASN  37          2HD2      ASN  37   3.700   2.916   4.756
  212    H    THR  38           H        THR  38  -1.708   1.824   1.356
  213    HA   THR  38           HA       THR  38  -2.833  -0.819   1.270
  214    HB   THR  38           HB       THR  38  -4.385   0.963   3.062
  215    HG1  THR  38           HG1      THR  38  -3.151   0.261   4.856
  216   1HG2  THR  38          1HG2      THR  38  -5.330  -0.927   3.825
  217   2HG2  THR  38          2HG2      THR  38  -3.825  -1.842   3.755
  218   3HG2  THR  38          3HG2      THR  38  -4.763  -1.571   2.285
  219    H    CYS  39           H        CYS  39  -4.123  -0.858  -0.439
  220    HA   CYS  39           HA       CYS  39  -5.475   1.639  -1.237
  221   1HB   CYS  39          1HB       CYS  39  -5.351  -0.432  -3.302
  222   2HB   CYS  39          2HB       CYS  39  -4.936   1.278  -3.398
  223    H    THR  40           H        THR  40  -7.626   1.631  -0.975
  224    HA   THR  40           HA       THR  40  -8.985  -0.885  -0.500
  225    HB   THR  40           HB       THR  40 -10.893   0.589   0.092
  226    HG1  THR  40           HG1      THR  40 -10.709   2.757  -0.034
  227   1HG2  THR  40          1HG2      THR  40  -9.679   0.148   1.990
  228   2HG2  THR  40          2HG2      THR  40  -9.667   1.910   1.942
  229   3HG2  THR  40          3HG2      THR  40  -8.254   1.003   1.401
  230    H    GLY  41           H        GLY  41 -11.398   0.967  -1.687
  231   1HA   GLY  41          1HA       GLY  41 -11.634  -0.539  -4.084
  232   2HA   GLY  41          2HA       GLY  41 -12.633   0.832  -3.630
  233    H    SER  42           H        SER  42  -9.340   0.109  -4.745
  234    HA   SER  42           HA       SER  42  -9.613   2.279  -6.681
  235   1HB   SER  42          1HB       SER  42  -7.044   2.039  -5.133
  236   2HB   SER  42          2HB       SER  42  -7.696   3.441  -5.975
  237    HG   SER  42           HG       SER  42  -7.940   3.789  -3.796
  238    H    THR  43           H        THR  43  -6.623   1.900  -7.136
  239    HA   THR  43           HA       THR  43  -6.568  -0.876  -7.975
  240    HB   THR  43           HB       THR  43  -6.302  -0.515 -10.224
  241    HG1  THR  43           HG1      THR  43  -5.575   2.142  -9.569
  242   1HG2  THR  43          1HG2      THR  43  -8.551   0.014  -9.901
  243   2HG2  THR  43          2HG2      THR  43  -7.929   1.284 -10.959
  244   3HG2  THR  43          3HG2      THR  43  -8.179   1.609  -9.239
  245    H    ASP  44           H        ASP  44  -4.135   0.039  -9.701
  246    HA   ASP  44           HA       ASP  44  -1.895  -0.471  -9.138
  247   1HB   ASP  44          1HB       ASP  44  -2.742   2.309  -8.938
  248   2HB   ASP  44          2HB       ASP  44  -1.257   1.996  -8.047
  249    H    CYS  45           H        CYS  45  -1.858  -2.020  -7.485
  250    HA   CYS  45           HA       CYS  45  -1.257  -0.938  -4.820
  251   1HB   CYS  45          1HB       CYS  45  -3.626  -2.164  -5.349
  252   2HB   CYS  45          2HB       CYS  45  -2.642  -3.552  -4.893
  253    H    ASN  46           H        ASN  46   0.954  -1.265  -5.662
  254    HA   ASN  46           HA       ASN  46   1.771  -4.087  -5.733
  255   1HB   ASN  46          1HB       ASN  46   2.326  -2.431  -7.635
  256   2HB   ASN  46          2HB       ASN  46   3.524  -1.771  -6.518
  257   1HD2  ASN  46          1HD2      ASN  46   3.408  -3.544  -9.094
  258   2HD2  ASN  46          2HD2      ASN  46   4.607  -4.745  -8.766
  259    H    THR  47           H        THR  47   2.109  -1.145  -3.920
  260    HA   THR  47           HA       THR  47   4.282  -2.301  -2.329
  261    HB   THR  47           HB       THR  47   4.445  -0.050  -1.309
  262    HG1  THR  47           HG1      THR  47   2.463   0.673  -3.199
  263   1HG2  THR  47          1HG2      THR  47   5.158   1.216  -3.309
  264   2HG2  THR  47          2HG2      THR  47   4.494  -0.073  -4.315
  265   3HG2  THR  47          3HG2      THR  47   5.835  -0.411  -3.221
  266    H    ALA  48           H        ALA  48   0.902  -1.572  -2.208
  267    HA   ALA  48           HA       ALA  48   0.620  -1.550   0.623
  268   1HB   ALA  48          1HB       ALA  48  -1.380  -0.799   0.058
  269   2HB   ALA  48          2HB       ALA  48  -1.800  -2.374  -0.614
  270   3HB   ALA  48          3HB       ALA  48  -1.035  -1.154  -1.631
  271    H    GLN  49           H        GLN  49  -1.048  -3.220   1.595
  272    HA   GLN  49           HA       GLN  49   0.003  -5.896   0.962
  273   1HB   GLN  49          1HB       GLN  49  -0.887  -6.244   3.466
  274   2HB   GLN  49          2HB       GLN  49   0.745  -5.710   3.090
  275   1HG   GLN  49          1HG       GLN  49  -1.387  -3.666   3.462
  276   2HG   GLN  49          2HG       GLN  49  -0.712  -4.473   4.876
  277   1HE2  GLN  49          1HE2      GLN  49   1.016  -3.586   5.744
  278   2HE2  GLN  49          2HE2      GLN  49   2.103  -2.495   4.962
  279    H    THR  50           H        THR  50  -2.745  -4.177   0.474
  280    HA   THR  50           HA       THR  50  -4.293  -6.469  -0.061
  281    HB   THR  50           HB       THR  50  -4.326  -6.341   2.491
  282    HG1  THR  50           HG1      THR  50  -6.879  -6.250   1.284
  283   1HG2  THR  50          1HG2      THR  50  -6.311  -4.147   1.965
  284   2HG2  THR  50          2HG2      THR  50  -4.729  -3.935   2.714
  285   3HG2  THR  50          3HG2      THR  50  -5.962  -4.907   3.517
  286    H    CYS  51           H        CYS  51  -6.588  -5.932  -0.639
  287    HA   CYS  51           HA       CYS  51  -7.140  -3.145  -1.191
  288   1HB   CYS  51          1HB       CYS  51  -7.460  -3.443  -3.594
  289   2HB   CYS  51          2HB       CYS  51  -5.792  -3.830  -3.142
  290    H    THR  52           H        THR  52  -9.301  -3.005  -2.486
  291    HA   THR  52           HA       THR  52 -11.108  -5.173  -1.686
  292    HB   THR  52           HB       THR  52 -11.075  -3.227  -0.024
  293    HG1  THR  52           HG1      THR  52 -13.064  -3.761   0.433
  294   1HG2  THR  52          1HG2      THR  52 -11.548  -1.166  -0.639
  295   2HG2  THR  52          2HG2      THR  52 -13.056  -1.695  -1.383
  296   3HG2  THR  52          3HG2      THR  52 -11.563  -1.695  -2.321
  297    H    ASN  53           H        ASN  53  -9.910  -3.747  -4.206
  298    HA   ASN  53           HA       ASN  53 -11.580  -4.505  -6.152
  299   1HB   ASN  53          1HB       ASN  53 -13.371  -3.110  -5.152
  300   2HB   ASN  53          2HB       ASN  53 -12.368  -1.678  -5.390
  301   1HD2  ASN  53          1HD2      ASN  53 -14.215  -0.914  -6.607
  302   2HD2  ASN  53          2HD2      ASN  53 -14.385  -1.375  -8.264
  303    H    SER  54           H        SER  54  -8.848  -4.010  -5.710
  304    HA   SER  54           HA       SER  54  -8.192  -1.848  -7.589
  305   1HB   SER  54          1HB       SER  54  -6.777  -1.470  -5.835
  306   2HB   SER  54          2HB       SER  54  -6.740  -3.167  -5.352
  307    HG   SER  54           HG       SER  54  -4.909  -3.261  -6.366
  308    H    LYS  55           H        LYS  55  -7.154  -2.227  -9.503
  309    HA   LYS  55           HA       LYS  55  -7.168  -4.990 -10.427
  310   1HB   LYS  55          1HB       LYS  55  -6.627  -2.468 -11.998
  311   2HB   LYS  55          2HB       LYS  55  -6.962  -4.064 -12.654
  312   1HG   LYS  55          1HG       LYS  55  -9.210  -3.987 -11.993
  313   2HG   LYS  55          2HG       LYS  55  -8.930  -2.623 -10.912
  314   1HD   LYS  55          1HD       LYS  55  -9.316  -1.163 -12.548
  315   2HD   LYS  55          2HD       LYS  55  -8.144  -1.957 -13.602
  316   1HE   LYS  55          1HE       LYS  55 -10.922  -3.026 -13.184
  317   2HE   LYS  55          2HE       LYS  55 -10.549  -1.833 -14.427
  318   1HZ   LYS  55          1HZ       LYS  55 -10.225  -3.696 -15.636
  319   2HZ   LYS  55          2HZ       LYS  55  -9.852  -4.658 -14.296
  320   3HZ   LYS  55          3HZ       LYS  55  -8.681  -3.626 -14.946
  321    H    ASP  56           H        ASP  56  -5.035  -3.811  -8.609
  322    HA   ASP  56           HA       ASP  56  -2.799  -4.928 -10.084
  323   1HB   ASP  56          1HB       ASP  56  -2.973  -2.074  -9.214
  324   2HB   ASP  56          2HB       ASP  56  -1.407  -2.889  -9.194
  325    H    CYS  57           H        CYS  57  -4.365  -5.764  -7.792
  326    HA   CYS  57           HA       CYS  57  -2.822  -5.332  -5.420
  327   1HB   CYS  57          1HB       CYS  57  -4.745  -7.615  -5.832
  328   2HB   CYS  57          2HB       CYS  57  -4.339  -6.779  -4.332
  329    H    PHE  58           H        PHE  58  -0.746  -5.896  -6.535
  330    HA   PHE  58           HA       PHE  58  -0.262  -8.689  -7.062
  331   1HB   PHE  58          1HB       PHE  58   1.813  -6.508  -6.832
  332   2HB   PHE  58          2HB       PHE  58   1.943  -8.034  -7.699
  333    HD1  PHE  58           HD1      PHE  58   1.040  -4.610  -7.834
  334    HD2  PHE  58           HD2      PHE  58   0.525  -8.391  -9.707
  335    HE1  PHE  58           HE1      PHE  58   0.341  -3.487  -9.901
  336    HE2  PHE  58           HE2      PHE  58  -0.181  -7.276 -11.775
  337    HZ   PHE  58           HZ       PHE  58  -0.253  -4.837 -11.845
  338    H    GLU  59           H        GLU  59   1.007  -6.346  -4.694
  339    HA   GLU  59           HA       GLU  59   1.976  -8.566  -3.058
  340   1HB   GLU  59          1HB       GLU  59   2.566  -5.650  -3.223
  341   2HB   GLU  59          2HB       GLU  59   2.808  -6.453  -1.673
  342   1HG   GLU  59          1HG       GLU  59   3.961  -7.968  -3.847
  343   2HG   GLU  59          2HG       GLU  59   4.595  -6.324  -3.789
  344    H    ALA  60           H        ALA  60  -0.803  -8.317  -3.202
  345    HA   ALA  60           HA       ALA  60  -1.498  -7.228  -0.559
  346   1HB   ALA  60          1HB       ALA  60  -3.904  -7.578  -1.639
  347   2HB   ALA  60          2HB       ALA  60  -2.969  -7.387  -3.121
  348   3HB   ALA  60          3HB       ALA  60  -2.953  -6.115  -1.900
  349    H    ASN  61           H        ASN  61  -2.418  -8.498   0.966
  350    HA   ASN  61           HA       ASN  61  -2.332 -11.362   0.512
  351   1HB   ASN  61          1HB       ASN  61  -2.885 -11.448   2.986
  352   2HB   ASN  61          2HB       ASN  61  -1.358 -10.674   2.571
  353   1HD2  ASN  61          1HD2      ASN  61  -1.357  -9.559   4.532
  354   2HD2  ASN  61          2HD2      ASN  61  -2.383  -8.196   4.804
  355    H    THR  62           H        THR  62  -4.677  -8.820   0.951
  356    HA   THR  62           HA       THR  62  -6.821 -10.801   0.560
  357    HB   THR  62           HB       THR  62  -7.657  -8.360   1.939
  358    HG1  THR  62           HG1      THR  62  -6.491  -8.528   3.699
  359   1HG2  THR  62          1HG2      THR  62  -8.288 -10.391   3.596
  360   2HG2  THR  62          2HG2      THR  62  -8.197 -11.239   2.052
  361   3HG2  THR  62          3HG2      THR  62  -9.285  -9.863   2.239
  362    H    CYS  63           H        CYS  63  -8.249 -10.359  -1.035
  363    HA   CYS  63           HA       CYS  63  -8.504  -7.659  -2.064
  364   1HB   CYS  63          1HB       CYS  63  -8.022  -8.388  -4.405
  365   2HB   CYS  63          2HB       CYS  63  -6.610  -8.393  -3.347
  366    H    THR  64           H        THR  64 -10.646  -7.516  -1.835
  367    HA   THR  64           HA       THR  64 -12.308  -9.625  -3.051
  368    HB   THR  64           HB       THR  64 -14.065  -8.309  -1.476
  369    HG1  THR  64           HG1      THR  64 -13.099  -7.208   0.000
  370   1HG2  THR  64          1HG2      THR  64 -12.506 -10.206   0.106
  371   2HG2  THR  64          2HG2      THR  64 -13.014 -10.811  -1.470
  372   3HG2  THR  64          3HG2      THR  64 -14.216 -10.214  -0.327
  373    H    ASP  65           H        ASP  65 -13.558  -9.056  -4.729
  374    HA   ASP  65           HA       ASP  65 -14.779  -7.771  -6.190
  375   1HB   ASP  65          1HB       ASP  65 -14.136  -5.298  -4.593
  376   2HB   ASP  65          2HB       ASP  65 -15.539  -5.615  -5.620
  377    H    SER  66           H        SER  66 -11.742  -8.071  -6.022
  378    HA   SER  66           HA       SER  66 -11.110  -5.952  -7.966
  379   1HB   SER  66          1HB       SER  66  -9.097  -5.504  -6.977
  380   2HB   SER  66          2HB       SER  66  -9.996  -6.002  -5.542
  381    HG   SER  66           HG       SER  66  -7.837  -7.150  -6.702
  382    H    THR  67           H        THR  67  -8.833  -6.689  -9.028
  383    HA   THR  67           HA       THR  67  -8.973  -9.514  -9.749
  384    HB   THR  67           HB       THR  67 -10.281  -8.530 -11.456
  385    HG1  THR  67           HG1      THR  67  -7.677  -8.661 -12.551
  386   1HG2  THR  67          1HG2      THR  67  -9.507  -6.182 -11.028
  387   2HG2  THR  67          2HG2      THR  67  -9.768  -6.625 -12.716
  388   3HG2  THR  67          3HG2      THR  67  -8.129  -6.543 -12.068
  389    H    ASN  68           H        ASN  68  -7.070 -10.200 -11.051
  390    HA   ASN  68           HA       ASN  68  -4.825 -10.444 -11.295
  391   1HB   ASN  68          1HB       ASN  68  -4.648  -7.447 -10.952
  392   2HB   ASN  68          2HB       ASN  68  -3.498  -8.502 -11.774
  393   1HD2  ASN  68          1HD2      ASN  68  -4.908 -10.003 -13.403
  394   2HD2  ASN  68          2HD2      ASN  68  -5.815  -9.060 -14.532
  395    H    CYS  69           H        CYS  69  -5.523 -11.188  -8.879
  396    HA   CYS  69           HA       CYS  69  -4.009  -9.725  -6.876
  397   1HB   CYS  69          1HB       CYS  69  -6.317 -11.124  -6.684
  398   2HB   CYS  69          2HB       CYS  69  -5.161 -12.359  -6.181
  399    H    TYR  70           H        TYR  70  -2.029 -10.156  -8.198
  400    HA   TYR  70           HA       TYR  70  -0.832 -12.563  -8.662
  401   1HB   TYR  70          1HB       TYR  70  -0.019  -9.831  -8.539
  402   2HB   TYR  70          2HB       TYR  70   1.205 -10.808  -7.725
  403    HD1  TYR  70           HD1      TYR  70  -0.910 -11.792 -10.621
  404    HD2  TYR  70           HD2      TYR  70   2.979 -10.729  -9.258
  405    HE1  TYR  70           HE1      TYR  70   0.023 -12.426 -12.805
  406    HE2  TYR  70           HE2      TYR  70   3.922 -11.362 -11.439
  407    HH   TYR  70           HH       TYR  70   2.964 -13.155 -13.408
  408    H    LYS  71           H        LYS  71  -1.204 -14.081  -7.110
  409    HA   LYS  71           HA       LYS  71  -0.593 -15.411  -5.360
  410   1HB   LYS  71          1HB       LYS  71   1.597 -13.588  -5.580
  411   2HB   LYS  71          2HB       LYS  71   1.245 -13.827  -3.869
  412   1HG   LYS  71          1HG       LYS  71   2.421 -15.698  -3.971
  413   2HG   LYS  71          2HG       LYS  71   1.151 -16.378  -4.990
  414   1HD   LYS  71          1HD       LYS  71   3.313 -14.684  -6.184
  415   2HD   LYS  71          2HD       LYS  71   3.602 -16.390  -5.839
  416   1HE   LYS  71          1HE       LYS  71   2.615 -16.912  -7.758
  417   2HE   LYS  71          2HE       LYS  71   1.107 -16.239  -7.139
  418   1HZ   LYS  71          1HZ       LYS  71   1.375 -14.957  -8.974
  419   2HZ   LYS  71          2HZ       LYS  71   3.063 -15.053  -8.958
  420   3HZ   LYS  71          3HZ       LYS  71   2.266 -14.013  -7.889
  421    H    ALA  72           H        ALA  72  -2.754 -14.975  -4.620
  422    HA   ALA  72           HA       ALA  72  -2.872 -13.158  -2.305
  423   1HB   ALA  72          1HB       ALA  72  -4.978 -12.580  -2.855
  424   2HB   ALA  72          2HB       ALA  72  -5.398 -14.205  -3.393
  425   3HB   ALA  72          3HB       ALA  72  -4.496 -13.129  -4.460
  426    H    THR  73           H        THR  73  -4.558 -13.909  -0.641
  427    HA   THR  73           HA       THR  73  -4.150 -16.783  -0.135
  428    HB   THR  73           HB       THR  73  -4.234 -16.276   2.250
  429    HG1  THR  73           HG1      THR  73  -4.416 -13.551   1.496
  430   1HG2  THR  73          1HG2      THR  73  -2.195 -15.084   2.549
  431   2HG2  THR  73          2HG2      THR  73  -2.338 -14.335   0.958
  432   3HG2  THR  73          3HG2      THR  73  -2.046 -16.069   1.094
  433    H    ALA  74           H        ALA  74  -6.405 -14.082   0.115
  434    HA   ALA  74           HA       ALA  74  -8.607 -16.030   0.345
  435   1HB   ALA  74          1HB       ALA  74  -9.542 -13.551   1.280
  436   2HB   ALA  74          2HB       ALA  74  -7.964 -13.796   2.029
  437   3HB   ALA  74          3HB       ALA  74  -9.229 -15.011   2.219
  438    H    CYS  75           H        CYS  75  -9.919 -16.056  -1.358
  439    HA   CYS  75           HA       CYS  75 -10.531 -13.586  -2.765
  440   1HB   CYS  75          1HB       CYS  75  -8.664 -14.223  -4.053
  441   2HB   CYS  75          2HB       CYS  75  -9.111 -15.931  -4.027
  442    H    THR  76           H        THR  76 -12.559 -13.529  -3.534
  443    HA   THR  76           HA       THR  76 -14.104 -16.039  -3.514
  444    HB   THR  76           HB       THR  76 -15.037 -13.272  -2.723
  445    HG1  THR  76           HG1      THR  76 -14.563 -15.627  -1.223
  446   1HG2  THR  76          1HG2      THR  76 -16.791 -15.407  -1.953
  447   2HG2  THR  76          2HG2      THR  76 -16.590 -15.366  -3.704
  448   3HG2  THR  76          3HG2      THR  76 -17.142 -13.928  -2.846
  449    H    ASN  77           H        ASN  77 -14.679 -12.693  -4.595
  450    HA   ASN  77           HA       ASN  77 -15.371 -13.769  -7.252
  451   1HB   ASN  77          1HB       ASN  77 -16.941 -11.902  -7.495
  452   2HB   ASN  77          2HB       ASN  77 -17.325 -12.860  -6.063
  453   1HD2  ASN  77          1HD2      ASN  77 -17.273  -9.843  -7.135
  454   2HD2  ASN  77          2HD2      ASN  77 -16.903  -8.984  -5.682
  455    H    SER  78           H        SER  78 -12.737 -13.105  -6.552
  456    HA   SER  78           HA       SER  78 -12.297 -10.621  -8.078
  457   1HB   SER  78          1HB       SER  78 -11.441 -10.287  -5.881
  458   2HB   SER  78          2HB       SER  78 -10.695 -11.889  -5.851
  459    HG   SER  78           HG       SER  78  -9.231 -11.163  -7.433
  460    H    SER  79           H        SER  79 -10.290 -10.583  -9.379
  461    HA   SER  79           HA       SER  79  -9.849 -13.208 -10.625
  462   1HB   SER  79          1HB       SER  79 -10.175 -10.522 -11.668
  463   2HB   SER  79          2HB       SER  79  -8.689 -11.261 -12.262
  464    HG   SER  79           HG       SER  79  -9.857 -12.905 -13.142
  465    H    GLY  80           H        GLY  80  -7.639 -13.608 -11.498
  466   1HA   GLY  80          1HA       GLY  80  -5.368 -13.812 -11.220
  467   2HA   GLY  80          2HA       GLY  80  -5.387 -12.185 -10.547
  468    H    CYS  81           H        CYS  81  -7.441 -14.418  -8.966
  469    HA   CYS  81           HA       CYS  81  -5.412 -14.843  -6.868
  470   1HB   CYS  81          1HB       CYS  81  -7.517 -14.859  -5.330
  471   2HB   CYS  81          2HB       CYS  81  -6.826 -13.320  -5.831
  472    HA   PRO  82           HA       PRO  82  -5.977 -19.189  -6.262
  473   1HB   PRO  82          1HB       PRO  82  -8.128 -18.511  -4.282
  474   2HB   PRO  82          2HB       PRO  82  -6.870 -19.756  -4.185
  475   1HG   PRO  82          1HG       PRO  82  -6.637 -17.350  -2.962
  476   2HG   PRO  82          2HG       PRO  82  -5.244 -18.254  -3.579
  477   1HD   PRO  82          1HD       PRO  82  -6.361 -15.743  -4.529
  478   2HD   PRO  82          2HD       PRO  82  -4.841 -16.527  -4.988
  479    H    GLY  83           H        GLY  83  -6.855 -19.488  -8.345
  480   1HA   GLY  83          1HA       GLY  83  -9.210 -20.858  -8.582
  481   2HA   GLY  83          2HA       GLY  83  -9.663 -19.181  -8.857
  482    H    HIS  84           H        HIS  84  -7.039 -18.566 -10.071
  483    HA   HIS  84           HA       HIS  84  -7.511 -19.838 -12.684
  484   1HB   HIS  84          1HB       HIS  84  -7.941 -17.459 -12.762
  485   2HB   HIS  84          2HB       HIS  84  -6.393 -17.111 -12.003
  486    HD1  HIS  84           HD1      HIS  84  -6.020 -19.703 -14.515
  487    HD2  HIS  84           HD2      HIS  84  -6.093 -15.548 -14.480
  488    HE1  HIS  84           HE1      HIS  84  -5.004 -18.995 -16.703
  489    HE2  HIS  84           HE2      HIS  84  -4.972 -16.477 -16.617
  Start of MODEL    2
    1   1H    GLN   1          1H        GLN   1  -7.536  13.390   1.358
    2   2H    GLN   1          2H        GLN   1  -8.993  13.194   2.244
    3   3H    GLN   1          3H        GLN   1  -7.516  12.581   2.868
    4    HA   GLN   1           HA       GLN   1  -8.196  14.592   3.961
    5   1HB   GLN   1          1HB       GLN   1  -5.827  13.944   3.724
    6   2HB   GLN   1          2HB       GLN   1  -5.738  14.837   2.212
    7   1HG   GLN   1          1HG       GLN   1  -4.984  16.516   3.464
    8   2HG   GLN   1          2HG       GLN   1  -6.669  16.737   3.931
    9   1HE2  GLN   1          1HE2      GLN   1  -5.570  17.711   5.825
   10   2HE2  GLN   1          2HE2      GLN   1  -5.155  16.670   7.140
   11    H    CYS   2           H        CYS   2  -7.280  15.208   0.568
   12    HA   CYS   2           HA       CYS   2  -8.884  17.673   0.669
   13   1HB   CYS   2          1HB       CYS   2  -7.560  18.277  -1.419
   14   2HB   CYS   2          2HB       CYS   2  -6.658  18.238   0.092
   15    H    THR   3           H        THR   3  -9.983  18.268  -1.381
   16    HA   THR   3           HA       THR   3 -11.110  15.866  -2.663
   17    HB   THR   3           HB       THR   3 -13.191  16.919  -2.804
   18    HG1  THR   3           HG1      THR   3 -12.851  18.879  -3.620
   19   1HG2  THR   3          1HG2      THR   3 -11.902  17.825  -0.255
   20   2HG2  THR   3          2HG2      THR   3 -12.946  16.429  -0.519
   21   3HG2  THR   3          3HG2      THR   3 -13.615  18.059  -0.601
   22    H    GLY   4           H        GLY   4  -8.703  17.261  -3.490
   23   1HA   GLY   4          1HA       GLY   4  -8.903  19.066  -5.534
   24   2HA   GLY   4          2HA       GLY   4  -7.719  17.762  -5.514
   25    H    GLY   5           H        GLY   5  -9.997  19.158  -7.367
   26   1HA   GLY   5          1HA       GLY   5 -11.551  17.084  -8.403
   27   2HA   GLY   5          2HA       GLY   5 -11.090  18.531  -9.284
   28    H    ALA   6           H        ALA   6 -11.259  15.510  -9.870
   29    HA   ALA   6           HA       ALA   6 -10.234  14.072 -11.305
   30   1HB   ALA   6          1HB       ALA   6  -8.020  15.429 -12.329
   31   2HB   ALA   6          2HB       ALA   6  -9.240  16.671 -12.052
   32   3HB   ALA   6          3HB       ALA   6  -9.616  15.278 -13.066
   33    H    ASP   7           H        ASP   7  -7.378  15.938 -10.305
   34    HA   ASP   7           HA       ASP   7  -6.279  13.458  -9.158
   35   1HB   ASP   7          1HB       ASP   7  -4.700  15.857 -10.097
   36   2HB   ASP   7          2HB       ASP   7  -4.083  14.253  -9.691
   37    H    CYS   8           H        CYS   8  -4.230  14.372  -7.672
   38    HA   CYS   8           HA       CYS   8  -5.492  16.152  -5.692
   39   1HB   CYS   8          1HB       CYS   8  -4.348  13.460  -5.392
   40   2HB   CYS   8          2HB       CYS   8  -3.766  14.628  -4.202
   41    H    THR   9           H        THR   9  -4.269  17.760  -7.030
   42    HA   THR   9           HA       THR   9  -1.392  17.775  -6.634
   43    HB   THR   9           HB       THR   9  -1.861  20.154  -7.788
   44    HG1  THR   9           HG1      THR   9  -4.183  19.650  -7.678
   45   1HG2  THR   9          1HG2      THR   9  -2.142  17.757  -9.541
   46   2HG2  THR   9          2HG2      THR   9  -0.633  18.069  -8.683
   47   3HG2  THR   9          3HG2      THR   9  -1.262  19.259  -9.823
   48    H    SER  10           H        SER  10  -0.261  19.300  -5.438
   49    HA   SER  10           HA       SER  10   0.144  20.875  -3.837
   50   1HB   SER  10          1HB       SER  10  -1.796  22.091  -5.088
   51   2HB   SER  10          2HB       SER  10  -2.763  21.613  -3.694
   52    HG   SER  10           HG       SER  10  -1.957  23.504  -3.059
   53    H    CYS  11           H        CYS  11  -1.452  18.114  -3.467
   54    HA   CYS  11           HA       CYS  11  -2.130  18.516  -0.642
   55   1HB   CYS  11          1HB       CYS  11  -2.727  16.219  -2.516
   56   2HB   CYS  11          2HB       CYS  11  -3.181  16.263  -0.816
   57    H    THR  12           H        THR  12  -1.609  16.506   0.755
   58    HA   THR  12           HA       THR  12   0.949  15.292   0.051
   59    HB   THR  12           HB       THR  12   1.507  17.370   1.266
   60    HG1  THR  12           HG1      THR  12   1.985  14.936   2.629
   61   1HG2  THR  12          1HG2      THR  12   0.261  16.189   3.717
   62   2HG2  THR  12          2HG2      THR  12  -0.604  17.333   2.691
   63   3HG2  THR  12          3HG2      THR  12   0.904  17.812   3.471
   64    H    GLY  13           H        GLY  13  -1.665  15.565   2.430
   65   1HA   GLY  13          1HA       GLY  13  -1.144  13.111   3.728
   66   2HA   GLY  13          2HA       GLY  13  -2.657  13.998   3.781
   67    H    ALA  14           H        ALA  14  -3.961  12.192   3.608
   68    HA   ALA  14           HA       ALA  14  -3.613  10.209   1.596
   69   1HB   ALA  14          1HB       ALA  14  -6.298  10.614   2.770
   70   2HB   ALA  14          2HB       ALA  14  -4.984  10.248   3.889
   71   3HB   ALA  14          3HB       ALA  14  -5.355   9.137   2.572
   72    H    CYS  15           H        CYS  15  -4.684   9.912  -0.337
   73    HA   CYS  15           HA       CYS  15  -5.734  12.337  -1.552
   74   1HB   CYS  15          1HB       CYS  15  -5.279   9.650  -2.855
   75   2HB   CYS  15          2HB       CYS  15  -5.493  11.201  -3.659
   76    H    THR  16           H        THR  16  -7.795  12.641  -2.225
   77    HA   THR  16           HA       THR  16  -9.715  10.472  -1.682
   78    HB   THR  16           HB       THR  16 -10.574  13.331  -1.622
   79    HG1  THR  16           HG1      THR  16  -9.933  13.517   0.511
   80   1HG2  THR  16          1HG2      THR  16 -11.935  11.053  -1.186
   81   2HG2  THR  16          2HG2      THR  16 -12.349  12.608  -0.462
   82   3HG2  THR  16          3HG2      THR  16 -11.408  11.430   0.453
   83    H    GLY  17           H        GLY  17 -10.197   9.648  -3.632
   84   1HA   GLY  17          1HA       GLY  17 -10.980   9.517  -5.789
   85   2HA   GLY  17          2HA       GLY  17 -11.789  11.049  -5.461
   86    H    CYS  18           H        CYS  18  -8.333  10.225  -5.639
   87    HA   CYS  18           HA       CYS  18  -8.087  12.144  -7.860
   88   1HB   CYS  18          1HB       CYS  18  -6.094  11.727  -5.622
   89   2HB   CYS  18          2HB       CYS  18  -5.937  12.867  -6.961
   90    H    GLY  19           H        GLY  19  -7.101  11.403  -9.632
   91   1HA   GLY  19          1HA       GLY  19  -6.182   8.673  -9.699
   92   2HA   GLY  19          2HA       GLY  19  -6.252   9.789 -11.060
   93    H    ASN  20           H        ASN  20  -4.629  11.250  -8.512
   94    HA   ASN  20           HA       ASN  20  -2.037  10.091  -9.048
   95   1HB   ASN  20          1HB       ASN  20  -2.540  12.988  -9.737
   96   2HB   ASN  20          2HB       ASN  20  -1.015  12.123  -9.886
   97   1HD2  ASN  20          1HD2      ASN  20  -0.920  10.366 -11.426
   98   2HD2  ASN  20          2HD2      ASN  20  -1.896  10.436 -12.851
   99    H    CYS  21           H        CYS  21  -0.653  10.365  -7.376
  100    HA   CYS  21           HA       CYS  21  -1.451  12.246  -5.255
  101   1HB   CYS  21          1HB       CYS  21  -0.378   9.434  -4.967
  102   2HB   CYS  21          2HB       CYS  21  -0.508  10.576  -3.628
  103    HA   PRO  22           HA       PRO  22   2.728  13.665  -5.686
  104   1HB   PRO  22          1HB       PRO  22   2.812  15.393  -3.636
  105   2HB   PRO  22          2HB       PRO  22   1.821  15.694  -5.068
  106   1HG   PRO  22          1HG       PRO  22   1.007  14.745  -2.364
  107   2HG   PRO  22          2HG       PRO  22   0.159  15.829  -3.478
  108   1HD   PRO  22          1HD       PRO  22  -0.382  13.119  -3.130
  109   2HD   PRO  22          2HD       PRO  22  -0.885  14.100  -4.518
  110    H    ASN  23           H        ASN  23   1.751  12.920  -2.330
  111    HA   ASN  23           HA       ASN  23   3.993  11.145  -2.003
  112   1HB   ASN  23          1HB       ASN  23   4.138  12.990   0.220
  113   2HB   ASN  23          2HB       ASN  23   5.418  12.453  -0.869
  114   1HD2  ASN  23          1HD2      ASN  23   2.575  14.585  -0.922
  115   2HD2  ASN  23          2HD2      ASN  23   3.351  15.876  -1.769
  116    H    ALA  24           H        ALA  24   1.140  10.929  -1.888
  117    HA   ALA  24           HA       ALA  24   0.353  10.776   0.874
  118   1HB   ALA  24          1HB       ALA  24  -1.110  11.187  -1.250
  119   2HB   ALA  24          2HB       ALA  24  -1.762  10.278   0.115
  120   3HB   ALA  24          3HB       ALA  24  -1.166   9.426  -1.310
  121    H    VAL  25           H        VAL  25   0.413   9.067   2.204
  122    HA   VAL  25           HA       VAL  25   1.774   6.668   1.286
  123    HB   VAL  25           HB       VAL  25   2.469   7.700   3.404
  124   1HG1  VAL  25          1HG1      VAL  25  -0.164   8.144   3.869
  125   2HG1  VAL  25          2HG1      VAL  25   1.094   8.217   5.104
  126   3HG1  VAL  25          3HG1      VAL  25   0.133   6.750   4.909
  127   1HG2  VAL  25          1HG2      VAL  25   2.571   5.683   4.726
  128   2HG2  VAL  25          2HG2      VAL  25   2.746   5.272   3.020
  129   3HG2  VAL  25          3HG2      VAL  25   1.209   4.995   3.842
  130    H    THR  26           H        THR  26  -1.429   7.718   1.870
  131    HA   THR  26           HA       THR  26  -2.431   5.061   1.283
  132    HB   THR  26           HB       THR  26  -4.079   6.049   3.397
  133    HG1  THR  26           HG1      THR  26  -2.633   6.924   4.629
  134   1HG2  THR  26          1HG2      THR  26  -4.120   3.762   3.083
  135   2HG2  THR  26          2HG2      THR  26  -3.152   3.944   4.546
  136   3HG2  THR  26          3HG2      THR  26  -2.363   3.639   3.000
  137    H    CYS  27           H        CYS  27  -4.223   5.120   0.051
  138    HA   CYS  27           HA       CYS  27  -5.609   7.712  -0.217
  139   1HB   CYS  27          1HB       CYS  27  -5.720   5.952  -2.576
  140   2HB   CYS  27          2HB       CYS  27  -5.466   7.695  -2.487
  141    H    THR  28           H        THR  28  -7.775   7.699  -0.158
  142    HA   THR  28           HA       THR  28  -9.102   5.119   0.272
  143    HB   THR  28           HB       THR  28 -10.129   7.933   0.739
  144    HG1  THR  28           HG1      THR  28  -8.656   7.623   2.288
  145   1HG2  THR  28          1HG2      THR  28 -12.118   6.935   0.828
  146   2HG2  THR  28          2HG2      THR  28 -11.559   6.297   2.374
  147   3HG2  THR  28          3HG2      THR  28 -11.415   5.321   0.912
  148    H    ASN  29           H        ASN  29  -9.436   4.344  -1.780
  149    HA   ASN  29           HA       ASN  29 -10.624   4.034  -3.655
  150   1HB   ASN  29          1HB       ASN  29 -11.686   6.852  -3.500
  151   2HB   ASN  29          2HB       ASN  29 -12.390   5.462  -4.329
  152   1HD2  ASN  29          1HD2      ASN  29 -13.326   3.788  -3.050
  153   2HD2  ASN  29          2HD2      ASN  29 -13.952   4.140  -1.479
  154    H    SER  30           H        SER  30 -10.979   5.820  -5.719
  155    HA   SER  30           HA       SER  30  -9.916   7.119  -7.313
  156   1HB   SER  30          1HB       SER  30  -7.335   7.139  -5.799
  157   2HB   SER  30          2HB       SER  30  -8.054   8.401  -6.792
  158    HG   SER  30           HG       SER  30  -9.742   8.247  -4.934
  159    H    GLN  31           H        GLN  31  -7.401   6.971  -8.356
  160    HA   GLN  31           HA       GLN  31  -6.784   4.121  -8.628
  161   1HB   GLN  31          1HB       GLN  31  -6.659   4.463 -11.138
  162   2HB   GLN  31          2HB       GLN  31  -8.278   4.420 -10.439
  163   1HG   GLN  31          1HG       GLN  31  -8.137   6.964 -10.393
  164   2HG   GLN  31          2HG       GLN  31  -6.740   6.786 -11.453
  165   1HE2  GLN  31          1HE2      GLN  31  -8.587   8.192 -12.555
  166   2HE2  GLN  31          2HE2      GLN  31  -9.537   7.307 -13.695
  167    H    HIS  32           H        HIS  32  -5.006   5.130  -7.255
  168    HA   HIS  32           HA       HIS  32  -2.652   5.261  -8.757
  169   1HB   HIS  32          1HB       HIS  32  -3.773   7.586  -9.170
  170   2HB   HIS  32          2HB       HIS  32  -3.183   7.957  -7.549
  171    HD1  HIS  32           HD1      HIS  32  -2.150   7.863 -11.039
  172    HD2  HIS  32           HD2      HIS  32  -0.274   7.694  -7.334
  173    HE1  HIS  32           HE1      HIS  32   0.272   8.369 -11.488
  174    HE2  HIS  32           HE2      HIS  32   1.373   8.337  -9.222
  175    H    CYS  33           H        CYS  33  -3.281   3.752  -6.659
  176    HA   CYS  33           HA       CYS  33  -1.654   4.863  -4.468
  177   1HB   CYS  33          1HB       CYS  33  -4.305   4.208  -4.273
  178   2HB   CYS  33          2HB       CYS  33  -3.529   2.712  -3.750
  179    H    VAL  34           H        VAL  34  -0.375   3.609  -6.481
  180    HA   VAL  34           HA       VAL  34  -0.114   0.786  -6.065
  181    HB   VAL  34           HB       VAL  34   0.310   1.867  -8.258
  182   1HG1  VAL  34          1HG1      VAL  34   1.419   3.885  -7.569
  183   2HG1  VAL  34          2HG1      VAL  34   2.517   2.966  -8.598
  184   3HG1  VAL  34          3HG1      VAL  34   2.741   2.967  -6.847
  185   1HG2  VAL  34          1HG2      VAL  34   2.769   0.462  -7.231
  186   2HG2  VAL  34          2HG2      VAL  34   2.133   0.466  -8.876
  187   3HG2  VAL  34          3HG2      VAL  34   1.253  -0.365  -7.594
  188    H    LYS  35           H        LYS  35   1.594   3.641  -4.961
  189    HA   LYS  35           HA       LYS  35   3.528   1.920  -3.576
  190   1HB   LYS  35          1HB       LYS  35   5.070   3.686  -3.627
  191   2HB   LYS  35          2HB       LYS  35   4.299   3.730  -5.202
  192   1HG   LYS  35          1HG       LYS  35   3.871   5.872  -4.871
  193   2HG   LYS  35          2HG       LYS  35   2.761   5.409  -3.582
  194   1HD   LYS  35          1HD       LYS  35   4.084   6.442  -2.124
  195   2HD   LYS  35          2HD       LYS  35   5.351   5.270  -2.486
  196   1HE   LYS  35          1HE       LYS  35   5.395   7.098  -4.604
  197   2HE   LYS  35          2HE       LYS  35   5.196   8.071  -3.148
  198   1HZ   LYS  35          1HZ       LYS  35   7.553   7.464  -3.933
  199   2HZ   LYS  35          2HZ       LYS  35   7.239   5.949  -3.249
  200   3HZ   LYS  35          3HZ       LYS  35   7.192   7.338  -2.285
  201    H    ALA  36           H        ALA  36   0.908   2.209  -2.518
  202    HA   ALA  36           HA       ALA  36   1.408   3.900  -0.151
  203   1HB   ALA  36          1HB       ALA  36  -0.577   4.566  -1.366
  204   2HB   ALA  36          2HB       ALA  36  -1.027   3.881   0.195
  205   3HB   ALA  36          3HB       ALA  36  -1.212   2.924  -1.274
  206    H    ASN  37           H        ASN  37   0.915   3.086   1.922
  207    HA   ASN  37           HA       ASN  37   1.695   0.428   2.380
  208   1HB   ASN  37          1HB       ASN  37   0.554   2.615   4.064
  209   2HB   ASN  37          2HB       ASN  37   0.588   0.982   4.722
  210   1HD2  ASN  37          1HD2      ASN  37   1.997   2.210   6.267
  211   2HD2  ASN  37          2HD2      ASN  37   3.688   2.252   5.920
  212    H    THR  38           H        THR  38  -1.465   1.942   2.124
  213    HA   THR  38           HA       THR  38  -2.699  -0.625   1.673
  214    HB   THR  38           HB       THR  38  -3.880   1.021   3.891
  215    HG1  THR  38           HG1      THR  38  -2.579   0.163   5.318
  216   1HG2  THR  38          1HG2      THR  38  -5.424  -0.554   3.881
  217   2HG2  THR  38          2HG2      THR  38  -4.189  -1.740   4.301
  218   3HG2  THR  38          3HG2      THR  38  -4.571  -1.427   2.609
  219    H    CYS  39           H        CYS  39  -4.674  -0.471   0.604
  220    HA   CYS  39           HA       CYS  39  -5.750   2.207   0.129
  221   1HB   CYS  39          1HB       CYS  39  -6.002   1.223  -2.372
  222   2HB   CYS  39          2HB       CYS  39  -4.657   2.241  -1.861
  223    H    THR  40           H        THR  40  -7.900   2.230  -0.714
  224    HA   THR  40           HA       THR  40  -9.386  -0.250  -0.138
  225    HB   THR  40           HB       THR  40 -10.820   2.348  -0.195
  226    HG1  THR  40           HG1      THR  40  -9.198   3.117   0.998
  227   1HG2  THR  40          1HG2      THR  40 -11.821   0.115   0.461
  228   2HG2  THR  40          2HG2      THR  40 -12.089   1.468   1.561
  229   3HG2  THR  40          3HG2      THR  40 -10.873   0.249   1.942
  230    H    GLY  41           H        GLY  41 -11.838   1.020  -1.307
  231   1HA   GLY  41          1HA       GLY  41 -11.923  -0.068  -3.807
  232   2HA   GLY  41          2HA       GLY  41 -12.867   1.335  -3.350
  233    H    SER  42           H        SER  42  -9.727   0.354  -4.632
  234    HA   SER  42           HA       SER  42  -9.784   2.701  -6.354
  235   1HB   SER  42          1HB       SER  42  -7.248   2.029  -4.860
  236   2HB   SER  42          2HB       SER  42  -7.677   3.537  -5.659
  237    HG   SER  42           HG       SER  42  -8.014   2.863  -3.111
  238    H    THR  43           H        THR  43  -6.956   2.129  -7.106
  239    HA   THR  43           HA       THR  43  -7.130  -0.622  -8.029
  240    HB   THR  43           HB       THR  43  -7.097  -0.197 -10.281
  241    HG1  THR  43           HG1      THR  43  -5.995   1.374 -11.152
  242   1HG2  THR  43          1HG2      THR  43  -8.695   2.013  -9.043
  243   2HG2  THR  43          2HG2      THR  43  -9.250   0.498  -9.757
  244   3HG2  THR  43          3HG2      THR  43  -8.619   1.781 -10.791
  245    H    ASP  44           H        ASP  44  -4.847   0.236  -9.974
  246    HA   ASP  44           HA       ASP  44  -2.601  -0.539  -9.549
  247   1HB   ASP  44          1HB       ASP  44  -2.924   2.432  -9.154
  248   2HB   ASP  44          2HB       ASP  44  -1.360   1.652  -9.369
  249    H    CYS  45           H        CYS  45  -2.780  -1.818  -7.569
  250    HA   CYS  45           HA       CYS  45  -1.483  -0.462  -5.300
  251   1HB   CYS  45          1HB       CYS  45  -3.967  -2.163  -5.277
  252   2HB   CYS  45          2HB       CYS  45  -2.925  -2.074  -3.850
  253    H    ASN  46           H        ASN  46   0.496  -1.382  -5.759
  254    HA   ASN  46           HA       ASN  46   0.630  -4.320  -5.765
  255   1HB   ASN  46          1HB       ASN  46   1.616  -3.222  -7.734
  256   2HB   ASN  46          2HB       ASN  46   2.694  -2.302  -6.680
  257   1HD2  ASN  46          1HD2      ASN  46   4.652  -3.087  -6.504
  258   2HD2  ASN  46          2HD2      ASN  46   5.113  -4.742  -6.687
  259    H    THR  47           H        THR  47   1.971  -1.418  -4.265
  260    HA   THR  47           HA       THR  47   3.713  -2.886  -2.519
  261    HB   THR  47           HB       THR  47   4.136  -0.726  -1.449
  262    HG1  THR  47           HG1      THR  47   2.019   0.176  -3.100
  263   1HG2  THR  47          1HG2      THR  47   4.956   0.561  -3.340
  264   2HG2  THR  47          2HG2      THR  47   4.020  -0.449  -4.442
  265   3HG2  THR  47          3HG2      THR  47   5.344  -1.149  -3.513
  266    H    ALA  48           H        ALA  48   0.456  -1.635  -2.362
  267    HA   ALA  48           HA       ALA  48   0.092  -1.725   0.425
  268   1HB   ALA  48          1HB       ALA  48  -2.395  -2.211  -0.449
  269   2HB   ALA  48          2HB       ALA  48  -1.670  -1.623  -1.945
  270   3HB   ALA  48          3HB       ALA  48  -1.650  -0.614  -0.498
  271    H    GLN  49           H        GLN  49  -0.733  -3.297   1.790
  272    HA   GLN  49           HA       GLN  49  -0.165  -6.015   1.015
  273   1HB   GLN  49          1HB       GLN  49  -1.385  -5.093   3.614
  274   2HB   GLN  49          2HB       GLN  49  -0.489  -6.575   3.310
  275   1HG   GLN  49          1HG       GLN  49   1.179  -5.418   4.271
  276   2HG   GLN  49          2HG       GLN  49   1.385  -4.789   2.638
  277   1HE2  GLN  49          1HE2      GLN  49   2.142  -2.799   3.103
  278   2HE2  GLN  49          2HE2      GLN  49   1.257  -1.599   3.976
  279    H    THR  50           H        THR  50  -2.771  -4.111   0.482
  280    HA   THR  50           HA       THR  50  -4.453  -6.194  -0.315
  281    HB   THR  50           HB       THR  50  -4.614  -6.337   2.232
  282    HG1  THR  50           HG1      THR  50  -6.179  -7.180   0.701
  283   1HG2  THR  50          1HG2      THR  50  -5.890  -4.850   3.454
  284   2HG2  THR  50          2HG2      THR  50  -6.568  -4.092   2.014
  285   3HG2  THR  50          3HG2      THR  50  -4.888  -3.794   2.459
  286    H    CYS  51           H        CYS  51  -6.688  -5.347  -0.896
  287    HA   CYS  51           HA       CYS  51  -7.257  -2.606  -0.964
  288   1HB   CYS  51          1HB       CYS  51  -6.902  -2.450  -3.573
  289   2HB   CYS  51          2HB       CYS  51  -5.590  -2.068  -2.457
  290    H    THR  52           H        THR  52  -9.296  -2.223  -1.687
  291    HA   THR  52           HA       THR  52 -10.760  -4.564  -2.685
  292    HB   THR  52           HB       THR  52 -11.438  -3.439  -0.504
  293    HG1  THR  52           HG1      THR  52 -13.478  -3.985  -0.883
  294   1HG2  THR  52          1HG2      THR  52 -12.389  -1.307  -2.389
  295   2HG2  THR  52          2HG2      THR  52 -11.289  -1.128  -1.024
  296   3HG2  THR  52          3HG2      THR  52 -12.984  -1.520  -0.744
  297    H    ASN  53           H        ASN  53 -12.279  -4.333  -4.380
  298    HA   ASN  53           HA       ASN  53 -12.769  -3.729  -6.529
  299   1HB   ASN  53          1HB       ASN  53 -13.084  -1.203  -4.935
  300   2HB   ASN  53          2HB       ASN  53 -13.405  -1.214  -6.671
  301   1HD2  ASN  53          1HD2      ASN  53 -15.224  -0.766  -4.445
  302   2HD2  ASN  53          2HD2      ASN  53 -16.466  -1.959  -4.590
  303    H    SER  54           H        SER  54  -9.897  -3.661  -5.820
  304    HA   SER  54           HA       SER  54  -8.942  -1.560  -7.641
  305   1HB   SER  54          1HB       SER  54  -7.639  -1.303  -5.768
  306   2HB   SER  54          2HB       SER  54  -7.722  -3.013  -5.340
  307    HG   SER  54           HG       SER  54  -6.110  -3.451  -6.724
  308    H    LYS  55           H        LYS  55  -8.047  -2.064  -9.565
  309    HA   LYS  55           HA       LYS  55  -8.091  -4.864 -10.369
  310   1HB   LYS  55          1HB       LYS  55  -8.122  -2.248 -11.793
  311   2HB   LYS  55          2HB       LYS  55  -7.469  -3.642 -12.646
  312   1HG   LYS  55          1HG       LYS  55  -9.677  -4.795 -11.908
  313   2HG   LYS  55          2HG       LYS  55 -10.249  -3.141 -11.686
  314   1HD   LYS  55          1HD       LYS  55 -10.821  -3.952 -13.907
  315   2HD   LYS  55          2HD       LYS  55  -9.653  -2.635 -14.013
  316   1HE   LYS  55          1HE       LYS  55  -7.891  -4.093 -14.540
  317   2HE   LYS  55          2HE       LYS  55  -8.792  -5.510 -14.002
  318   1HZ   LYS  55          1HZ       LYS  55  -8.941  -4.062 -16.530
  319   2HZ   LYS  55          2HZ       LYS  55 -10.389  -4.691 -15.924
  320   3HZ   LYS  55          3HZ       LYS  55  -9.080  -5.720 -16.222
  321    H    ASP  56           H        ASP  56  -5.945  -3.799  -8.621
  322    HA   ASP  56           HA       ASP  56  -3.724  -4.825 -10.178
  323   1HB   ASP  56          1HB       ASP  56  -3.888  -2.030  -9.145
  324   2HB   ASP  56          2HB       ASP  56  -2.323  -2.846  -9.177
  325    H    CYS  57           H        CYS  57  -5.371  -5.556  -7.785
  326    HA   CYS  57           HA       CYS  57  -3.662  -5.402  -5.501
  327   1HB   CYS  57          1HB       CYS  57  -6.094  -7.070  -6.145
  328   2HB   CYS  57          2HB       CYS  57  -5.236  -7.199  -4.610
  329    H    PHE  58           H        PHE  58  -1.837  -6.214  -7.123
  330    HA   PHE  58           HA       PHE  58  -1.732  -9.028  -7.590
  331   1HB   PHE  58          1HB       PHE  58   0.698  -7.262  -7.552
  332   2HB   PHE  58          2HB       PHE  58   0.363  -8.656  -8.570
  333    HD1  PHE  58           HD1      PHE  58   0.240  -5.130  -8.226
  334    HD2  PHE  58           HD2      PHE  58  -1.358  -8.449 -10.345
  335    HE1  PHE  58           HE1      PHE  58  -0.468  -3.629 -10.035
  336    HE2  PHE  58           HE2      PHE  58  -2.074  -6.954 -12.155
  337    HZ   PHE  58           HZ       PHE  58  -1.609  -4.565 -11.978
  338    H    GLU  59           H        GLU  59   0.004  -6.878  -5.339
  339    HA   GLU  59           HA       GLU  59   0.874  -9.223  -3.821
  340   1HB   GLU  59          1HB       GLU  59   2.086  -6.757  -4.461
  341   2HB   GLU  59          2HB       GLU  59   1.800  -6.725  -2.722
  342   1HG   GLU  59          1HG       GLU  59   2.929  -9.236  -3.715
  343   2HG   GLU  59          2HG       GLU  59   3.966  -7.827  -3.938
  344    H    ALA  60           H        ALA  60  -1.865  -8.620  -3.698
  345    HA   ALA  60           HA       ALA  60  -2.256  -7.324  -1.104
  346   1HB   ALA  60          1HB       ALA  60  -4.703  -7.635  -1.674
  347   2HB   ALA  60          2HB       ALA  60  -4.167  -8.188  -3.261
  348   3HB   ALA  60          3HB       ALA  60  -3.791  -6.550  -2.723
  349    H    ASN  61           H        ASN  61  -2.795  -8.392   0.709
  350    HA   ASN  61           HA       ASN  61  -2.598 -11.267   0.713
  351   1HB   ASN  61          1HB       ASN  61  -3.200  -9.394   3.012
  352   2HB   ASN  61          2HB       ASN  61  -2.704 -11.080   3.137
  353   1HD2  ASN  61          1HD2      ASN  61  -0.695 -11.205   1.291
  354   2HD2  ASN  61          2HD2      ASN  61   0.618 -10.198   1.790
  355    H    THR  62           H        THR  62  -5.122  -8.860   0.993
  356    HA   THR  62           HA       THR  62  -7.094 -11.041   1.212
  357    HB   THR  62           HB       THR  62  -7.351  -8.218   2.267
  358    HG1  THR  62           HG1      THR  62  -5.954  -9.750   3.431
  359   1HG2  THR  62          1HG2      THR  62  -9.333 -10.242   1.769
  360   2HG2  THR  62          2HG2      THR  62  -9.532  -8.574   2.307
  361   3HG2  THR  62          3HG2      THR  62  -9.234  -9.850   3.486
  362    H    CYS  63           H        CYS  63  -6.722 -10.934  -1.203
  363    HA   CYS  63           HA       CYS  63  -7.731  -8.711  -2.670
  364   1HB   CYS  63          1HB       CYS  63  -6.138 -10.177  -3.727
  365   2HB   CYS  63          2HB       CYS  63  -7.177 -11.578  -3.460
  366    H    THR  64           H        THR  64  -9.800  -8.129  -2.338
  367    HA   THR  64           HA       THR  64 -11.862 -10.179  -2.785
  368    HB   THR  64           HB       THR  64 -13.144  -8.428  -1.141
  369    HG1  THR  64           HG1      THR  64 -10.498  -8.660  -0.150
  370   1HG2  THR  64          1HG2      THR  64 -13.472 -10.244   0.074
  371   2HG2  THR  64          2HG2      THR  64 -11.764 -10.343   0.498
  372   3HG2  THR  64          3HG2      THR  64 -12.346 -11.084  -0.993
  373    H    ASP  65           H        ASP  65 -13.396  -9.652  -4.223
  374    HA   ASP  65           HA       ASP  65 -14.514  -8.505  -5.838
  375   1HB   ASP  65          1HB       ASP  65 -14.293  -6.595  -3.582
  376   2HB   ASP  65          2HB       ASP  65 -14.728  -5.904  -5.148
  377    H    SER  66           H        SER  66 -11.605  -8.727  -5.996
  378    HA   SER  66           HA       SER  66 -11.135  -6.508  -7.862
  379   1HB   SER  66          1HB       SER  66  -9.365  -7.448  -5.628
  380   2HB   SER  66          2HB       SER  66  -8.647  -6.756  -7.089
  381    HG   SER  66           HG       SER  66  -9.657  -5.463  -5.035
  382    H    THR  67           H        THR  67  -8.959  -7.089  -9.118
  383    HA   THR  67           HA       THR  67  -8.920  -9.937  -9.771
  384    HB   THR  67           HB       THR  67 -10.434  -9.123 -11.381
  385    HG1  THR  67           HG1      THR  67  -9.215  -9.282 -13.323
  386   1HG2  THR  67          1HG2      THR  67 -10.191  -6.763 -11.175
  387   2HG2  THR  67          2HG2      THR  67  -9.940  -7.214 -12.861
  388   3HG2  THR  67          3HG2      THR  67  -8.557  -6.828 -11.836
  389    H    ASN  68           H        ASN  68  -7.104 -10.423 -11.349
  390    HA   ASN  68           HA       ASN  68  -4.896 -10.399 -11.903
  391   1HB   ASN  68          1HB       ASN  68  -4.849  -7.494 -11.071
  392   2HB   ASN  68          2HB       ASN  68  -3.736  -8.318 -12.167
  393   1HD2  ASN  68          1HD2      ASN  68  -4.839  -6.072 -13.050
  394   2HD2  ASN  68          2HD2      ASN  68  -6.054  -6.389 -14.236
  395    H    CYS  69           H        CYS  69  -5.760 -11.122  -9.263
  396    HA   CYS  69           HA       CYS  69  -3.597 -10.166  -7.537
  397   1HB   CYS  69          1HB       CYS  69  -5.958 -11.943  -6.875
  398   2HB   CYS  69          2HB       CYS  69  -4.806 -11.273  -5.718
  399    H    TYR  70           H        TYR  70  -2.086 -11.384  -9.020
  400    HA   TYR  70           HA       TYR  70  -2.123 -14.271  -8.659
  401   1HB   TYR  70          1HB       TYR  70  -0.353 -14.365 -10.282
  402   2HB   TYR  70          2HB       TYR  70  -1.592 -13.261 -10.880
  403    HD1  TYR  70           HD1      TYR  70  -1.183 -10.760 -10.629
  404    HD2  TYR  70           HD2      TYR  70   1.871 -13.665 -10.052
  405    HE1  TYR  70           HE1      TYR  70   0.528  -9.022 -10.953
  406    HE2  TYR  70           HE2      TYR  70   3.588 -11.934 -10.371
  407    HH   TYR  70           HH       TYR  70   3.561  -9.229 -10.028
  408    H    LYS  71           H        LYS  71  -1.840 -13.182  -6.248
  409    HA   LYS  71           HA       LYS  71   0.436 -14.364  -5.200
  410   1HB   LYS  71          1HB       LYS  71   1.107 -11.944  -6.408
  411   2HB   LYS  71          2HB       LYS  71   1.004 -11.554  -4.692
  412   1HG   LYS  71          1HG       LYS  71   2.424 -13.922  -4.736
  413   2HG   LYS  71          2HG       LYS  71   3.021 -13.047  -6.148
  414   1HD   LYS  71          1HD       LYS  71   4.084 -11.520  -4.893
  415   2HD   LYS  71          2HD       LYS  71   2.741 -11.384  -3.756
  416   1HE   LYS  71          1HE       LYS  71   4.554 -13.776  -3.772
  417   2HE   LYS  71          2HE       LYS  71   4.970 -12.309  -2.886
  418   1HZ   LYS  71          1HZ       LYS  71   2.506 -13.923  -2.499
  419   2HZ   LYS  71          2HZ       LYS  71   2.905 -12.518  -1.647
  420   3HZ   LYS  71          3HZ       LYS  71   3.849 -13.910  -1.469
  421    H    ALA  72           H        ALA  72  -2.256 -14.279  -4.575
  422    HA   ALA  72           HA       ALA  72  -2.238 -12.908  -1.964
  423   1HB   ALA  72          1HB       ALA  72  -4.514 -12.394  -2.149
  424   2HB   ALA  72          2HB       ALA  72  -4.750 -13.519  -3.487
  425   3HB   ALA  72          3HB       ALA  72  -3.849 -12.024  -3.740
  426    H    THR  73           H        THR  73  -3.665 -13.939  -0.331
  427    HA   THR  73           HA       THR  73  -3.519 -16.868  -0.575
  428    HB   THR  73           HB       THR  73  -2.154 -16.255   1.229
  429    HG1  THR  73           HG1      THR  73  -4.658 -16.674   2.481
  430   1HG2  THR  73          1HG2      THR  73  -4.300 -14.340   2.107
  431   2HG2  THR  73          2HG2      THR  73  -2.699 -13.936   1.489
  432   3HG2  THR  73          3HG2      THR  73  -2.865 -14.746   3.047
  433    H    ALA  74           H        ALA  74  -5.586 -14.163   0.246
  434    HA   ALA  74           HA       ALA  74  -7.835 -16.009   0.674
  435   1HB   ALA  74          1HB       ALA  74  -8.911 -14.343   1.925
  436   2HB   ALA  74          2HB       ALA  74  -7.872 -13.069   1.285
  437   3HB   ALA  74          3HB       ALA  74  -7.221 -14.250   2.420
  438    H    CYS  75           H        CYS  75  -8.516 -16.451  -1.381
  439    HA   CYS  75           HA       CYS  75  -9.424 -14.145  -2.975
  440   1HB   CYS  75          1HB       CYS  75  -7.498 -15.326  -3.998
  441   2HB   CYS  75          2HB       CYS  75  -8.450 -16.810  -4.032
  442    H    THR  76           H        THR  76 -11.535 -14.111  -2.339
  443    HA   THR  76           HA       THR  76 -13.123 -16.485  -2.120
  444    HB   THR  76           HB       THR  76 -14.322 -13.756  -2.396
  445    HG1  THR  76           HG1      THR  76 -12.742 -14.682  -0.246
  446   1HG2  THR  76          1HG2      THR  76 -15.728 -15.768  -1.941
  447   2HG2  THR  76          2HG2      THR  76 -15.856 -14.479  -0.744
  448   3HG2  THR  76          3HG2      THR  76 -14.897 -15.917  -0.393
  449    H    ASN  77           H        ASN  77 -13.318 -13.676  -4.311
  450    HA   ASN  77           HA       ASN  77 -13.921 -15.422  -6.544
  451   1HB   ASN  77          1HB       ASN  77 -16.062 -14.491  -5.113
  452   2HB   ASN  77          2HB       ASN  77 -15.889 -13.239  -6.346
  453   1HD2  ASN  77          1HD2      ASN  77 -15.520 -16.773  -6.292
  454   2HD2  ASN  77          2HD2      ASN  77 -16.562 -17.070  -7.637
  455    H    SER  78           H        SER  78 -11.672 -14.103  -6.405
  456    HA   SER  78           HA       SER  78 -12.040 -11.690  -8.058
  457   1HB   SER  78          1HB       SER  78 -10.112 -12.322  -5.858
  458   2HB   SER  78          2HB       SER  78  -9.597 -11.242  -7.160
  459    HG   SER  78           HG       SER  78 -10.840 -10.471  -5.104
  460    H    SER  79           H        SER  79 -10.332 -11.276  -9.649
  461    HA   SER  79           HA       SER  79  -9.507 -13.767 -10.918
  462   1HB   SER  79          1HB       SER  79 -10.160 -11.079 -11.823
  463   2HB   SER  79          2HB       SER  79  -8.669 -11.680 -12.548
  464    HG   SER  79           HG       SER  79 -11.272 -12.508 -12.910
  465    H    GLY  80           H        GLY  80  -7.358 -14.144 -11.648
  466   1HA   GLY  80          1HA       GLY  80  -5.035 -13.804 -11.679
  467   2HA   GLY  80          2HA       GLY  80  -5.252 -12.417 -10.616
  468    H    CYS  81           H        CYS  81  -6.905 -13.975  -8.721
  469    HA   CYS  81           HA       CYS  81  -4.681 -15.316  -7.368
  470   1HB   CYS  81          1HB       CYS  81  -6.265 -15.175  -5.359
  471   2HB   CYS  81          2HB       CYS  81  -5.575 -13.667  -5.954
  472    HA   PRO  82           HA       PRO  82  -6.029 -19.482  -7.508
  473   1HB   PRO  82          1HB       PRO  82  -6.484 -19.314  -4.557
  474   2HB   PRO  82          2HB       PRO  82  -5.598 -20.530  -5.493
  475   1HG   PRO  82          1HG       PRO  82  -4.289 -18.655  -4.128
  476   2HG   PRO  82          2HG       PRO  82  -3.727 -19.178  -5.726
  477   1HD   PRO  82          1HD       PRO  82  -5.100 -16.664  -4.929
  478   2HD   PRO  82          2HD       PRO  82  -3.909 -16.943  -6.213
  479    H    GLY  83           H        GLY  83  -7.897 -20.692  -7.654
  480   1HA   GLY  83          1HA       GLY  83 -10.159 -21.160  -6.852
  481   2HA   GLY  83          2HA       GLY  83 -10.359 -19.430  -6.619
  482    H    HIS  84           H        HIS  84  -8.958 -18.899  -9.204
  483    HA   HIS  84           HA       HIS  84 -11.141 -19.693 -11.018
  484   1HB   HIS  84          1HB       HIS  84 -11.295 -17.315 -10.455
  485   2HB   HIS  84          2HB       HIS  84  -9.625 -17.074 -10.958
  486    HD1  HIS  84           HD1      HIS  84  -9.348 -16.270 -13.279
  487    HD2  HIS  84           HD2      HIS  84 -12.961 -18.253 -12.753
  488    HE1  HIS  84           HE1      HIS  84 -10.557 -16.057 -15.473
  489    HE2  HIS  84           HE2      HIS  84 -12.702 -17.341 -15.159
  Start of MODEL    3
    1   1H    GLN   1          1H        GLN   1 -11.547  19.521  -1.138
    2   2H    GLN   1          2H        GLN   1 -10.776  19.928  -2.616
    3   3H    GLN   1          3H        GLN   1 -11.415  21.163  -1.612
    4    HA   GLN   1           HA       GLN   1  -9.154  21.213  -1.276
    5   1HB   GLN   1          1HB       GLN   1 -10.350  19.517   0.925
    6   2HB   GLN   1          2HB       GLN   1  -8.990  20.620   1.076
    7   1HG   GLN   1          1HG       GLN   1 -11.738  21.528   0.277
    8   2HG   GLN   1          2HG       GLN   1 -11.204  21.440   1.955
    9   1HE2  GLN   1          1HE2      GLN   1 -11.857  23.634  -0.133
   10   2HE2  GLN   1          2HE2      GLN   1 -10.576  24.770   0.092
   11    H    CYS   2           H        CYS   2 -10.396  17.918  -1.223
   12    HA   CYS   2           HA       CYS   2  -7.916  16.931  -2.307
   13   1HB   CYS   2          1HB       CYS   2  -7.546  16.947   0.182
   14   2HB   CYS   2          2HB       CYS   2  -8.868  15.793   0.326
   15    H    THR   3           H        THR   3 -10.700  17.104  -3.110
   16    HA   THR   3           HA       THR   3 -11.100  14.287  -3.759
   17    HB   THR   3           HB       THR   3 -13.320  14.163  -3.040
   18    HG1  THR   3           HG1      THR   3 -13.328  16.960  -2.596
   19   1HG2  THR   3          1HG2      THR   3 -12.424  15.992  -0.874
   20   2HG2  THR   3          2HG2      THR   3 -11.566  14.475  -1.142
   21   3HG2  THR   3          3HG2      THR   3 -13.291  14.459  -0.772
   22    H    GLY   4           H        GLY   4 -10.251  16.794  -5.137
   23   1HA   GLY   4          1HA       GLY   4 -12.198  17.846  -6.813
   24   2HA   GLY   4          2HA       GLY   4 -10.492  17.703  -7.233
   25    H    GLY   5           H        GLY   5 -11.940  17.511  -9.342
   26   1HA   GLY   5          1HA       GLY   5 -13.126  14.991  -9.889
   27   2HA   GLY   5          2HA       GLY   5 -12.653  16.191 -11.083
   28    H    ALA   6           H        ALA   6 -11.459  13.540  -9.082
   29    HA   ALA   6           HA       ALA   6  -9.780  12.034  -9.385
   30   1HB   ALA   6          1HB       ALA   6  -9.343  11.275 -11.607
   31   2HB   ALA   6          2HB       ALA   6  -9.930  12.787 -12.297
   32   3HB   ALA   6          3HB       ALA   6 -11.055  11.686 -11.504
   33    H    ASP   7           H        ASP   7  -9.129  14.887  -8.904
   34    HA   ASP   7           HA       ASP   7  -6.325  14.746  -9.749
   35   1HB   ASP   7          1HB       ASP   7  -8.272  16.793 -10.497
   36   2HB   ASP   7          2HB       ASP   7  -6.827  17.466  -9.738
   37    H    CYS   8           H        CYS   8  -4.885  15.250  -8.203
   38    HA   CYS   8           HA       CYS   8  -5.937  15.886  -5.559
   39   1HB   CYS   8          1HB       CYS   8  -3.337  14.773  -6.575
   40   2HB   CYS   8          2HB       CYS   8  -3.450  15.421  -4.937
   41    H    THR   9           H        THR   9  -5.983  17.910  -4.881
   42    HA   THR   9           HA       THR   9  -4.573  20.002  -6.233
   43    HB   THR   9           HB       THR   9  -5.752  20.597  -3.595
   44    HG1  THR   9           HG1      THR   9  -7.256  19.449  -5.691
   45   1HG2  THR   9          1HG2      THR   9  -5.217  22.023  -5.903
   46   2HG2  THR   9          2HG2      THR   9  -6.148  22.573  -4.509
   47   3HG2  THR   9          3HG2      THR   9  -6.971  21.849  -5.891
   48    H    SER  10           H        SER  10  -4.484  18.839  -2.859
   49    HA   SER  10           HA       SER  10  -1.611  19.282  -2.790
   50   1HB   SER  10          1HB       SER  10  -2.819  21.430  -2.073
   51   2HB   SER  10          2HB       SER  10  -3.312  20.532  -0.637
   52    HG   SER  10           HG       SER  10  -1.254  20.431   0.028
   53    H    CYS  11           H        CYS  11  -3.270  16.941  -2.705
   54    HA   CYS  11           HA       CYS  11  -3.399  16.034   0.023
   55   1HB   CYS  11          1HB       CYS  11  -3.612  14.355  -2.478
   56   2HB   CYS  11          2HB       CYS  11  -4.222  13.967  -0.873
   57    H    THR  12           H        THR  12  -1.830  15.111   1.160
   58    HA   THR  12           HA       THR  12   0.419  13.872  -0.270
   59    HB   THR  12           HB       THR  12   1.057  16.125   0.561
   60    HG1  THR  12           HG1      THR  12   2.550  14.299   0.489
   61   1HG2  THR  12          1HG2      THR  12   0.702  16.862   2.620
   62   2HG2  THR  12          2HG2      THR  12   1.321  15.375   3.338
   63   3HG2  THR  12          3HG2      THR  12  -0.367  15.476   2.835
   64    H    GLY  13           H        GLY  13  -1.699  13.937   2.500
   65   1HA   GLY  13          1HA       GLY  13  -0.379  11.672   3.745
   66   2HA   GLY  13          2HA       GLY  13  -1.787  12.523   4.359
   67    H    ALA  14           H        ALA  14  -3.861  12.026   3.472
   68    HA   ALA  14           HA       ALA  14  -3.962   9.348   2.243
   69   1HB   ALA  14          1HB       ALA  14  -6.408   9.573   3.312
   70   2HB   ALA  14          2HB       ALA  14  -5.508  10.599   4.429
   71   3HB   ALA  14          3HB       ALA  14  -5.028   8.917   4.192
   72    H    CYS  15           H        CYS  15  -4.858   9.181   0.293
   73    HA   CYS  15           HA       CYS  15  -6.036  11.531  -0.929
   74   1HB   CYS  15          1HB       CYS  15  -5.858   8.882  -2.314
   75   2HB   CYS  15          2HB       CYS  15  -5.695  10.502  -2.982
   76    H    THR  16           H        THR  16  -8.117  11.783  -1.572
   77    HA   THR  16           HA       THR  16 -10.005   9.582  -1.186
   78    HB   THR  16           HB       THR  16 -10.533  12.351  -0.102
   79    HG1  THR  16           HG1      THR  16  -9.859  10.026   1.369
   80   1HG2  THR  16          1HG2      THR  16 -11.987   9.739   0.190
   81   2HG2  THR  16          2HG2      THR  16 -12.581  11.235  -0.531
   82   3HG2  THR  16          3HG2      THR  16 -12.285  11.151   1.205
   83    H    GLY  17           H        GLY  17 -10.745   9.344  -3.219
   84   1HA   GLY  17          1HA       GLY  17 -11.810   9.839  -5.198
   85   2HA   GLY  17          2HA       GLY  17 -12.401  11.303  -4.410
   86    H    CYS  18           H        CYS  18  -9.331  10.003  -5.659
   87    HA   CYS  18           HA       CYS  18  -8.981  12.390  -7.290
   88   1HB   CYS  18          1HB       CYS  18  -7.859  13.182  -5.373
   89   2HB   CYS  18          2HB       CYS  18  -7.154  11.602  -5.027
   90    H    GLY  19           H        GLY  19  -6.675   9.939  -6.188
   91   1HA   GLY  19          1HA       GLY  19  -6.272   7.913  -7.483
   92   2HA   GLY  19          2HA       GLY  19  -6.626   8.848  -8.935
   93    H    ASN  20           H        ASN  20  -5.116  10.948  -8.984
   94    HA   ASN  20           HA       ASN  20  -2.420   9.875  -9.038
   95   1HB   ASN  20          1HB       ASN  20  -1.899  12.110 -10.126
   96   2HB   ASN  20          2HB       ASN  20  -3.024  11.075 -10.999
   97   1HD2  ASN  20          1HD2      ASN  20  -5.054  11.764 -11.374
   98   2HD2  ASN  20          2HD2      ASN  20  -5.661  13.306 -10.893
   99    H    CYS  21           H        CYS  21  -1.799   9.766  -6.891
  100    HA   CYS  21           HA       CYS  21  -1.735  12.292  -5.394
  101   1HB   CYS  21          1HB       CYS  21  -2.132   9.514  -4.651
  102   2HB   CYS  21          2HB       CYS  21  -0.846  10.261  -3.699
  103    HA   PRO  22           HA       PRO  22   2.648  12.460  -5.700
  104   1HB   PRO  22          1HB       PRO  22   3.302  13.829  -3.462
  105   2HB   PRO  22          2HB       PRO  22   2.445  14.557  -4.819
  106   1HG   PRO  22          1HG       PRO  22   1.434  13.767  -2.160
  107   2HG   PRO  22          2HG       PRO  22   0.830  14.999  -3.276
  108   1HD   PRO  22          1HD       PRO  22  -0.204  12.386  -2.866
  109   2HD   PRO  22          2HD       PRO  22  -0.709  13.563  -4.093
  110    H    ASN  23           H        ASN  23   2.575  12.237  -2.154
  111    HA   ASN  23           HA       ASN  23   4.105   9.726  -2.374
  112   1HB   ASN  23          1HB       ASN  23   4.526  11.676  -0.124
  113   2HB   ASN  23          2HB       ASN  23   5.601  10.399  -0.702
  114   1HD2  ASN  23          1HD2      ASN  23   4.109  13.440  -1.694
  115   2HD2  ASN  23          2HD2      ASN  23   5.442  13.990  -2.648
  116    H    ALA  24           H        ALA  24   1.171  10.551  -1.677
  117    HA   ALA  24           HA       ALA  24   0.555  10.029   0.948
  118   1HB   ALA  24          1HB       ALA  24  -1.146  10.688  -0.619
  119   2HB   ALA  24          2HB       ALA  24  -1.618   9.161   0.131
  120   3HB   ALA  24          3HB       ALA  24  -0.967   9.176  -1.509
  121    H    VAL  25           H        VAL  25   0.493   8.303   2.265
  122    HA   VAL  25           HA       VAL  25   1.737   5.852   1.350
  123    HB   VAL  25           HB       VAL  25   0.614   5.863   4.074
  124   1HG1  VAL  25          1HG1      VAL  25   2.048   4.109   3.677
  125   2HG1  VAL  25          2HG1      VAL  25   3.122   5.267   4.463
  126   3HG1  VAL  25          3HG1      VAL  25   3.151   5.087   2.709
  127   1HG2  VAL  25          1HG2      VAL  25   1.146   8.153   4.143
  128   2HG2  VAL  25          2HG2      VAL  25   2.633   7.920   3.221
  129   3HG2  VAL  25          3HG2      VAL  25   2.525   7.335   4.883
  130    H    THR  26           H        THR  26  -1.408   6.948   2.466
  131    HA   THR  26           HA       THR  26  -2.525   4.337   1.677
  132    HB   THR  26           HB       THR  26  -4.260   5.811   3.462
  133    HG1  THR  26           HG1      THR  26  -1.639   5.255   4.379
  134   1HG2  THR  26          1HG2      THR  26  -4.818   3.704   3.828
  135   2HG2  THR  26          2HG2      THR  26  -3.341   3.550   4.780
  136   3HG2  THR  26          3HG2      THR  26  -3.338   3.114   3.071
  137    H    CYS  27           H        CYS  27  -4.092   4.342   0.180
  138    HA   CYS  27           HA       CYS  27  -5.162   6.961  -0.639
  139   1HB   CYS  27          1HB       CYS  27  -4.515   4.501  -2.262
  140   2HB   CYS  27          2HB       CYS  27  -5.541   5.799  -2.881
  141    H    THR  28           H        THR  28  -7.210   7.235  -0.106
  142    HA   THR  28           HA       THR  28  -8.931   4.894   0.254
  143    HB   THR  28           HB       THR  28  -9.424   7.789   0.991
  144    HG1  THR  28           HG1      THR  28  -9.017   7.020   3.118
  145   1HG2  THR  28          1HG2      THR  28 -11.516   7.199   1.377
  146   2HG2  THR  28          2HG2      THR  28 -10.925   6.092   2.617
  147   3HG2  THR  28          3HG2      THR  28 -11.173   5.519   0.967
  148    H    ASN  29           H        ASN  29  -9.591   4.324  -1.762
  149    HA   ASN  29           HA       ASN  29 -10.923   4.330  -3.575
  150   1HB   ASN  29          1HB       ASN  29 -11.789   7.042  -2.558
  151   2HB   ASN  29          2HB       ASN  29 -12.474   6.256  -3.981
  152   1HD2  ASN  29          1HD2      ASN  29 -12.266   6.252  -0.524
  153   2HD2  ASN  29          2HD2      ASN  29 -13.536   5.115  -0.243
  154    H    SER  30           H        SER  30 -11.091   5.362  -5.697
  155    HA   SER  30           HA       SER  30 -10.294   6.565  -7.491
  156   1HB   SER  30          1HB       SER  30  -9.272   8.109  -5.334
  157   2HB   SER  30          2HB       SER  30  -7.988   7.901  -6.524
  158    HG   SER  30           HG       SER  30 -10.623   8.730  -7.161
  159    H    GLN  31           H        GLN  31  -8.782   6.056  -9.058
  160    HA   GLN  31           HA       GLN  31  -6.906   3.941  -8.293
  161   1HB   GLN  31          1HB       GLN  31  -6.781   3.653 -10.847
  162   2HB   GLN  31          2HB       GLN  31  -8.263   3.165 -10.026
  163   1HG   GLN  31          1HG       GLN  31  -8.253   5.943 -10.946
  164   2HG   GLN  31          2HG       GLN  31  -8.118   4.751 -12.236
  165   1HE2  GLN  31          1HE2      GLN  31  -9.727   2.967 -12.158
  166   2HE2  GLN  31          2HE2      GLN  31 -11.340   3.363 -11.682
  167    H    HIS  32           H        HIS  32  -4.864   3.820  -9.595
  168    HA   HIS  32           HA       HIS  32  -2.965   4.734 -10.540
  169   1HB   HIS  32          1HB       HIS  32  -4.658   6.741 -11.167
  170   2HB   HIS  32          2HB       HIS  32  -3.655   7.563  -9.967
  171    HD1  HIS  32           HD1      HIS  32  -0.957   7.331 -10.503
  172    HD2  HIS  32           HD2      HIS  32  -3.604   6.788 -13.658
  173    HE1  HIS  32           HE1      HIS  32   0.410   7.648 -12.589
  174    HE2  HIS  32           HE2      HIS  32  -1.188   7.196 -14.484
  175    H    CYS  33           H        CYS  33  -3.297   3.884  -7.923
  176    HA   CYS  33           HA       CYS  33  -1.464   5.687  -6.483
  177   1HB   CYS  33          1HB       CYS  33  -3.959   4.357  -5.600
  178   2HB   CYS  33          2HB       CYS  33  -2.616   4.318  -4.455
  179    H    VAL  34           H        VAL  34  -0.370   3.866  -8.134
  180    HA   VAL  34           HA       VAL  34   0.066   1.283  -7.230
  181    HB   VAL  34           HB       VAL  34   0.814   2.085  -9.425
  182   1HG1  VAL  34          1HG1      VAL  34   3.075   3.270  -9.470
  183   2HG1  VAL  34          2HG1      VAL  34   2.766   3.665  -7.779
  184   3HG1  VAL  34          3HG1      VAL  34   1.663   4.234  -9.032
  185   1HG2  VAL  34          1HG2      VAL  34   3.211   1.079  -7.912
  186   2HG2  VAL  34          2HG2      VAL  34   2.747   0.745  -9.581
  187   3HG2  VAL  34          3HG2      VAL  34   1.809   0.063  -8.252
  188    H    LYS  35           H        LYS  35   1.349   4.280  -6.031
  189    HA   LYS  35           HA       LYS  35   3.320   2.899  -4.376
  190   1HB   LYS  35          1HB       LYS  35   3.872   5.012  -5.639
  191   2HB   LYS  35          2HB       LYS  35   2.777   5.864  -4.558
  192   1HG   LYS  35          1HG       LYS  35   4.170   5.612  -2.734
  193   2HG   LYS  35          2HG       LYS  35   5.017   4.234  -3.443
  194   1HD   LYS  35          1HD       LYS  35   5.900   5.823  -5.188
  195   2HD   LYS  35          2HD       LYS  35   5.245   7.136  -4.209
  196   1HE   LYS  35          1HE       LYS  35   7.196   5.084  -3.180
  197   2HE   LYS  35          2HE       LYS  35   7.674   6.651  -3.830
  198   1HZ   LYS  35          1HZ       LYS  35   7.498   7.263  -1.690
  199   2HZ   LYS  35          2HZ       LYS  35   6.454   5.997  -1.282
  200   3HZ   LYS  35          3HZ       LYS  35   5.846   7.383  -2.036
  201    H    ALA  36           H        ALA  36   0.479   2.532  -3.880
  202    HA   ALA  36           HA       ALA  36   0.114   3.960  -1.341
  203   1HB   ALA  36          1HB       ALA  36  -2.238   2.984  -1.518
  204   2HB   ALA  36          2HB       ALA  36  -1.805   2.560  -3.174
  205   3HB   ALA  36          3HB       ALA  36  -1.793   4.248  -2.663
  206    H    ASN  37           H        ASN  37  -0.246   2.894   0.573
  207    HA   ASN  37           HA       ASN  37   0.772   0.174   0.687
  208   1HB   ASN  37          1HB       ASN  37   1.804   1.164   2.433
  209   2HB   ASN  37          2HB       ASN  37   0.627   2.468   2.507
  210   1HD2  ASN  37          1HD2      ASN  37  -0.038   2.581   4.523
  211   2HD2  ASN  37          2HD2      ASN  37  -0.574   1.257   5.492
  212    H    THR  38           H        THR  38  -2.214   1.912   1.008
  213    HA   THR  38           HA       THR  38  -3.622  -0.625   1.362
  214    HB   THR  38           HB       THR  38  -4.747   1.637   2.903
  215    HG1  THR  38           HG1      THR  38  -2.441   0.239   3.779
  216   1HG2  THR  38          1HG2      THR  38  -5.402  -0.946   2.764
  217   2HG2  THR  38          2HG2      THR  38  -5.682   0.049   4.194
  218   3HG2  THR  38          3HG2      THR  38  -4.270  -1.005   4.116
  219    H    CYS  39           H        CYS  39  -5.272  -0.805  -0.011
  220    HA   CYS  39           HA       CYS  39  -6.413   1.660  -1.156
  221   1HB   CYS  39          1HB       CYS  39  -6.593  -0.661  -2.920
  222   2HB   CYS  39          2HB       CYS  39  -6.031   0.974  -3.266
  223    H    THR  40           H        THR  40  -8.256   1.725   0.076
  224    HA   THR  40           HA       THR  40  -9.930  -0.646   0.324
  225    HB   THR  40           HB       THR  40  -9.571   0.844   2.267
  226    HG1  THR  40           HG1      THR  40 -11.455   0.134   2.803
  227   1HG2  THR  40          1HG2      THR  40 -10.302   2.879   0.384
  228   2HG2  THR  40          2HG2      THR  40  -9.615   3.036   2.004
  229   3HG2  THR  40          3HG2      THR  40 -11.363   2.918   1.794
  230    H    GLY  41           H        GLY  41  -9.771   0.025  -2.286
  231   1HA   GLY  41          1HA       GLY  41 -11.867  -0.119  -3.670
  232   2HA   GLY  41          2HA       GLY  41 -12.332   1.373  -2.873
  233    H    SER  42           H        SER  42  -9.455   0.125  -4.552
  234    HA   SER  42           HA       SER  42  -9.638   2.359  -6.391
  235   1HB   SER  42          1HB       SER  42  -7.276   1.910  -4.537
  236   2HB   SER  42          2HB       SER  42  -7.235   2.978  -5.937
  237    HG   SER  42           HG       SER  42  -8.015   3.588  -3.527
  238    H    THR  43           H        THR  43  -6.937   1.939  -7.379
  239    HA   THR  43           HA       THR  43  -6.884  -0.903  -7.999
  240    HB   THR  43           HB       THR  43  -7.131  -0.724 -10.266
  241    HG1  THR  43           HG1      THR  43  -6.757   1.226 -11.420
  242   1HG2  THR  43          1HG2      THR  43  -9.277  -0.141  -9.630
  243   2HG2  THR  43          2HG2      THR  43  -8.847   1.095 -10.812
  244   3HG2  THR  43          3HG2      THR  43  -8.793   1.467  -9.088
  245    H    ASP  44           H        ASP  44  -4.890  -0.025 -10.247
  246    HA   ASP  44           HA       ASP  44  -2.547  -0.490 -10.007
  247   1HB   ASP  44          1HB       ASP  44  -3.461   2.033 -10.638
  248   2HB   ASP  44          2HB       ASP  44  -2.253   2.356  -9.399
  249    H    CYS  45           H        CYS  45  -2.388  -1.696  -8.010
  250    HA   CYS  45           HA       CYS  45  -1.133  -0.122  -5.872
  251   1HB   CYS  45          1HB       CYS  45  -3.400  -2.070  -5.651
  252   2HB   CYS  45          2HB       CYS  45  -2.263  -1.896  -4.308
  253    H    ASN  46           H        ASN  46   0.896  -0.837  -6.649
  254    HA   ASN  46           HA       ASN  46   1.410  -3.703  -6.678
  255   1HB   ASN  46          1HB       ASN  46   2.336  -2.367  -8.497
  256   2HB   ASN  46          2HB       ASN  46   3.210  -1.361  -7.337
  257   1HD2  ASN  46          1HD2      ASN  46   2.774  -4.842  -7.908
  258   2HD2  ASN  46          2HD2      ASN  46   4.456  -5.234  -7.845
  259    H    THR  47           H        THR  47   2.302  -0.831  -4.815
  260    HA   THR  47           HA       THR  47   4.093  -2.349  -3.124
  261    HB   THR  47           HB       THR  47   4.478   0.056  -3.758
  262    HG1  THR  47           HG1      THR  47   4.355  -0.641  -1.017
  263   1HG2  THR  47          1HG2      THR  47   3.350   1.820  -2.723
  264   2HG2  THR  47          2HG2      THR  47   2.511   0.743  -1.606
  265   3HG2  THR  47          3HG2      THR  47   2.074   0.755  -3.316
  266    H    ALA  48           H        ALA  48   0.775  -1.333  -3.083
  267    HA   ALA  48           HA       ALA  48   0.224  -1.387  -0.353
  268   1HB   ALA  48          1HB       ALA  48  -1.276  -0.694  -2.323
  269   2HB   ALA  48          2HB       ALA  48  -2.034  -1.450  -0.920
  270   3HB   ALA  48          3HB       ALA  48  -1.738  -2.396  -2.380
  271    H    GLN  49           H        GLN  49   0.000  -2.942   1.129
  272    HA   GLN  49           HA       GLN  49   0.569  -5.687   0.369
  273   1HB   GLN  49          1HB       GLN  49   0.023  -4.637   3.144
  274   2HB   GLN  49          2HB       GLN  49   0.867  -6.113   2.699
  275   1HG   GLN  49          1HG       GLN  49   2.814  -5.063   2.521
  276   2HG   GLN  49          2HG       GLN  49   2.117  -3.763   1.555
  277   1HE2  GLN  49          1HE2      GLN  49   1.624  -4.878   4.890
  278   2HE2  GLN  49          2HE2      GLN  49   1.924  -3.344   5.628
  279    H    THR  50           H        THR  50  -2.143  -3.991   0.232
  280    HA   THR  50           HA       THR  50  -3.864  -6.187   0.161
  281    HB   THR  50           HB       THR  50  -3.446  -5.873   2.692
  282    HG1  THR  50           HG1      THR  50  -5.643  -6.376   3.103
  283   1HG2  THR  50          1HG2      THR  50  -3.861  -3.370   2.585
  284   2HG2  THR  50          2HG2      THR  50  -4.653  -4.271   3.877
  285   3HG2  THR  50          3HG2      THR  50  -5.571  -3.780   2.454
  286    H    CYS  51           H        CYS  51  -6.174  -5.473  -0.170
  287    HA   CYS  51           HA       CYS  51  -6.782  -2.732  -0.515
  288   1HB   CYS  51          1HB       CYS  51  -6.823  -2.630  -2.973
  289   2HB   CYS  51          2HB       CYS  51  -5.190  -2.901  -2.357
  290    H    THR  52           H        THR  52  -8.656  -2.626  -2.348
  291    HA   THR  52           HA       THR  52 -10.395  -4.919  -2.327
  292    HB   THR  52           HB       THR  52 -10.632  -2.934  -0.273
  293    HG1  THR  52           HG1      THR  52 -12.059  -4.407   0.526
  294   1HG2  THR  52          1HG2      THR  52 -12.098  -1.719  -1.864
  295   2HG2  THR  52          2HG2      THR  52 -12.924  -2.283  -0.411
  296   3HG2  THR  52          3HG2      THR  52 -13.130  -3.148  -1.934
  297    H    ASN  53           H        ASN  53 -11.550  -4.934  -4.166
  298    HA   ASN  53           HA       ASN  53 -12.455  -4.276  -6.148
  299   1HB   ASN  53          1HB       ASN  53 -12.520  -1.465  -5.041
  300   2HB   ASN  53          2HB       ASN  53 -13.557  -2.162  -6.289
  301   1HD2  ASN  53          1HD2      ASN  53 -14.092  -0.888  -3.635
  302   2HD2  ASN  53          2HD2      ASN  53 -15.106  -2.016  -2.807
  303    H    SER  54           H        SER  54  -9.542  -4.149  -5.625
  304    HA   SER  54           HA       SER  54  -8.662  -1.997  -7.401
  305   1HB   SER  54          1HB       SER  54  -7.487  -3.457  -5.213
  306   2HB   SER  54          2HB       SER  54  -6.457  -3.599  -6.642
  307    HG   SER  54           HG       SER  54  -5.879  -1.614  -6.326
  308    H    LYS  55           H        LYS  55  -6.609  -2.914  -8.790
  309    HA   LYS  55           HA       LYS  55  -7.289  -5.459 -10.035
  310   1HB   LYS  55          1HB       LYS  55  -6.851  -3.324 -12.019
  311   2HB   LYS  55          2HB       LYS  55  -7.946  -4.696 -12.064
  312   1HG   LYS  55          1HG       LYS  55  -9.601  -3.548 -10.846
  313   2HG   LYS  55          2HG       LYS  55  -8.472  -2.282 -10.357
  314   1HD   LYS  55          1HD       LYS  55  -9.439  -2.810 -13.167
  315   2HD   LYS  55          2HD       LYS  55  -9.969  -1.493 -12.117
  316   1HE   LYS  55          1HE       LYS  55  -8.318  -0.258 -12.949
  317   2HE   LYS  55          2HE       LYS  55  -7.177  -1.341 -12.153
  318   1HZ   LYS  55          1HZ       LYS  55  -8.287  -1.967 -14.818
  319   2HZ   LYS  55          2HZ       LYS  55  -6.890  -2.579 -14.088
  320   3HZ   LYS  55          3HZ       LYS  55  -6.922  -0.982 -14.644
  321    H    ASP  56           H        ASP  56  -5.001  -4.038  -8.562
  322    HA   ASP  56           HA       ASP  56  -2.922  -5.099 -10.285
  323   1HB   ASP  56          1HB       ASP  56  -3.334  -2.235  -9.826
  324   2HB   ASP  56          2HB       ASP  56  -1.691  -2.782  -9.481
  325    H    CYS  57           H        CYS  57  -4.124  -5.779  -7.689
  326    HA   CYS  57           HA       CYS  57  -2.085  -5.172  -5.735
  327   1HB   CYS  57          1HB       CYS  57  -4.792  -6.223  -5.711
  328   2HB   CYS  57          2HB       CYS  57  -3.718  -7.168  -4.674
  329    H    PHE  58           H        PHE  58  -0.321  -6.129  -6.937
  330    HA   PHE  58           HA       PHE  58  -0.265  -8.980  -7.335
  331   1HB   PHE  58          1HB       PHE  58   2.086  -7.084  -7.420
  332   2HB   PHE  58          2HB       PHE  58   1.947  -8.659  -8.194
  333    HD1  PHE  58           HD1      PHE  58   0.929  -8.920 -10.266
  334    HD2  PHE  58           HD2      PHE  58   0.855  -5.176  -8.255
  335    HE1  PHE  58           HE1      PHE  58   0.197  -7.827 -12.337
  336    HE2  PHE  58           HE2      PHE  58   0.118  -4.075 -10.320
  337    HZ   PHE  58           HZ       PHE  58  -0.192  -5.415 -12.336
  338    H    GLU  59           H        GLU  59   1.314  -6.691  -5.118
  339    HA   GLU  59           HA       GLU  59   2.237  -8.961  -3.503
  340   1HB   GLU  59          1HB       GLU  59   3.886  -7.225  -4.271
  341   2HB   GLU  59          2HB       GLU  59   3.046  -6.062  -3.248
  342   1HG   GLU  59          1HG       GLU  59   4.468  -6.661  -1.654
  343   2HG   GLU  59          2HG       GLU  59   3.531  -8.150  -1.533
  344    H    ALA  60           H        ALA  60  -0.480  -8.419  -3.357
  345    HA   ALA  60           HA       ALA  60  -0.784  -7.027  -0.783
  346   1HB   ALA  60          1HB       ALA  60  -2.305  -6.012  -2.162
  347   2HB   ALA  60          2HB       ALA  60  -3.305  -7.287  -1.465
  348   3HB   ALA  60          3HB       ALA  60  -2.624  -7.483  -3.081
  349    H    ASN  61           H        ASN  61  -2.161  -7.969   0.829
  350    HA   ASN  61           HA       ASN  61  -1.951 -10.890   0.848
  351   1HB   ASN  61          1HB       ASN  61  -2.123  -8.806   2.998
  352   2HB   ASN  61          2HB       ASN  61  -2.546 -10.478   3.354
  353   1HD2  ASN  61          1HD2      ASN  61  -0.930 -11.376   4.400
  354   2HD2  ASN  61          2HD2      ASN  61   0.744 -11.249   3.994
  355    H    THR  62           H        THR  62  -4.298  -8.295   0.989
  356    HA   THR  62           HA       THR  62  -6.425 -10.315   0.841
  357    HB   THR  62           HB       THR  62  -7.044  -7.841   2.360
  358    HG1  THR  62           HG1      THR  62  -5.143  -8.372   3.362
  359   1HG2  THR  62          1HG2      THR  62  -8.125  -9.663   3.841
  360   2HG2  THR  62          2HG2      THR  62  -7.881 -10.701   2.435
  361   3HG2  THR  62          3HG2      THR  62  -8.864  -9.243   2.296
  362    H    CYS  63           H        CYS  63  -7.798  -9.970  -0.791
  363    HA   CYS  63           HA       CYS  63  -8.405  -7.272  -1.668
  364   1HB   CYS  63          1HB       CYS  63  -7.874  -7.880  -4.070
  365   2HB   CYS  63          2HB       CYS  63  -6.480  -7.613  -3.021
  366    H    THR  64           H        THR  64 -10.553  -7.525  -1.306
  367    HA   THR  64           HA       THR  64 -11.922  -9.865  -2.392
  368    HB   THR  64           HB       THR  64 -13.900  -8.429  -1.238
  369    HG1  THR  64           HG1      THR  64 -13.091  -7.408   0.579
  370   1HG2  THR  64          1HG2      THR  64 -12.795 -10.775  -0.676
  371   2HG2  THR  64          2HG2      THR  64 -13.927  -9.970   0.411
  372   3HG2  THR  64          3HG2      THR  64 -12.191  -9.856   0.703
  373    H    ASP  65           H        ASP  65 -13.118  -9.818  -4.194
  374    HA   ASP  65           HA       ASP  65 -14.108  -9.073  -6.101
  375   1HB   ASP  65          1HB       ASP  65 -15.566  -7.931  -4.363
  376   2HB   ASP  65          2HB       ASP  65 -14.598  -6.478  -4.632
  377    H    SER  66           H        SER  66 -11.363  -8.854  -6.012
  378    HA   SER  66           HA       SER  66 -10.924  -6.455  -7.654
  379   1HB   SER  66          1HB       SER  66  -8.662  -7.478  -6.001
  380   2HB   SER  66          2HB       SER  66  -9.016  -5.830  -6.532
  381    HG   SER  66           HG       SER  66  -9.353  -6.163  -4.268
  382    H    THR  67           H        THR  67  -9.219  -6.654  -9.222
  383    HA   THR  67           HA       THR  67  -8.900  -9.400 -10.142
  384    HB   THR  67           HB       THR  67  -9.379  -8.542 -12.129
  385    HG1  THR  67           HG1      THR  67  -7.260  -6.696 -11.879
  386   1HG2  THR  67          1HG2      THR  67  -9.200  -5.789 -10.985
  387   2HG2  THR  67          2HG2      THR  67 -10.638  -6.809 -11.013
  388   3HG2  THR  67          3HG2      THR  67  -9.930  -6.243 -12.526
  389    H    ASN  68           H        ASN  68  -6.873 -10.129 -10.963
  390    HA   ASN  68           HA       ASN  68  -4.632 -10.503 -10.791
  391   1HB   ASN  68          1HB       ASN  68  -4.280  -8.561 -12.099
  392   2HB   ASN  68          2HB       ASN  68  -4.709  -7.488 -10.764
  393   1HD2  ASN  68          1HD2      ASN  68  -3.187  -6.948  -9.266
  394   2HD2  ASN  68          2HD2      ASN  68  -1.516  -7.353  -9.417
  395    H    CYS  69           H        CYS  69  -4.646 -11.616  -8.852
  396    HA   CYS  69           HA       CYS  69  -3.526 -10.152  -6.582
  397   1HB   CYS  69          1HB       CYS  69  -5.982 -11.893  -6.538
  398   2HB   CYS  69          2HB       CYS  69  -4.989 -11.681  -5.095
  399    H    TYR  70           H        TYR  70  -1.535 -11.076  -7.065
  400    HA   TYR  70           HA       TYR  70  -1.230 -13.907  -7.379
  401   1HB   TYR  70          1HB       TYR  70   0.753 -11.646  -7.113
  402   2HB   TYR  70          2HB       TYR  70   1.235 -13.334  -7.308
  403    HD1  TYR  70           HD1      TYR  70   1.460 -10.646  -9.108
  404    HD2  TYR  70           HD2      TYR  70  -0.800 -14.249  -9.277
  405    HE1  TYR  70           HE1      TYR  70   1.275 -10.411 -11.548
  406    HE2  TYR  70           HE2      TYR  70  -0.989 -14.021 -11.717
  407    HH   TYR  70           HH       TYR  70   0.859 -12.314 -13.557
  408    H    LYS  71           H        LYS  71  -1.978 -14.874  -5.538
  409    HA   LYS  71           HA       LYS  71  -1.662 -15.954  -3.552
  410   1HB   LYS  71          1HB       LYS  71   0.875 -15.299  -4.158
  411   2HB   LYS  71          2HB       LYS  71   0.667 -14.321  -2.706
  412   1HG   LYS  71          1HG       LYS  71   1.638 -16.477  -2.169
  413   2HG   LYS  71          2HG       LYS  71   0.036 -16.316  -1.447
  414   1HD   LYS  71          1HD       LYS  71   0.426 -18.544  -2.449
  415   2HD   LYS  71          2HD       LYS  71  -0.931 -17.691  -3.184
  416   1HE   LYS  71          1HE       LYS  71   0.482 -17.032  -5.058
  417   2HE   LYS  71          2HE       LYS  71   1.863 -17.835  -4.313
  418   1HZ   LYS  71          1HZ       LYS  71  -0.495 -19.484  -4.695
  419   2HZ   LYS  71          2HZ       LYS  71   1.137 -19.854  -4.939
  420   3HZ   LYS  71          3HZ       LYS  71   0.283 -18.988  -6.114
  421    H    ALA  72           H        ALA  72  -3.621 -14.842  -2.991
  422    HA   ALA  72           HA       ALA  72  -3.189 -12.843  -0.871
  423   1HB   ALA  72          1HB       ALA  72  -4.382 -12.234  -3.223
  424   2HB   ALA  72          2HB       ALA  72  -4.727 -11.421  -1.697
  425   3HB   ALA  72          3HB       ALA  72  -5.778 -12.720  -2.259
  426    H    THR  73           H        THR  73  -4.954 -12.776   0.738
  427    HA   THR  73           HA       THR  73  -5.738 -15.477   1.445
  428    HB   THR  73           HB       THR  73  -4.756 -13.984   3.144
  429    HG1  THR  73           HG1      THR  73  -6.420 -15.625   3.642
  430   1HG2  THR  73          1HG2      THR  73  -7.133 -12.434   3.679
  431   2HG2  THR  73          2HG2      THR  73  -6.415 -12.028   2.120
  432   3HG2  THR  73          3HG2      THR  73  -5.446 -11.928   3.590
  433    H    ALA  74           H        ALA  74  -7.214 -12.502   0.360
  434    HA   ALA  74           HA       ALA  74  -9.882 -13.700   0.636
  435   1HB   ALA  74          1HB       ALA  74 -10.411 -11.187  -0.157
  436   2HB   ALA  74          2HB       ALA  74  -8.859 -10.933   0.642
  437   3HB   ALA  74          3HB       ALA  74 -10.202 -11.652   1.531
  438    H    CYS  75           H        CYS  75  -9.055 -15.095  -1.237
  439    HA   CYS  75           HA       CYS  75  -9.160 -13.762  -3.825
  440   1HB   CYS  75          1HB       CYS  75  -8.770 -16.693  -3.172
  441   2HB   CYS  75          2HB       CYS  75  -8.554 -15.950  -4.754
  442    H    THR  76           H        THR  76 -11.437 -13.134  -3.529
  443    HA   THR  76           HA       THR  76 -13.314 -15.369  -3.908
  444    HB   THR  76           HB       THR  76 -13.988 -14.121  -2.021
  445    HG1  THR  76           HG1      THR  76 -15.954 -13.293  -2.679
  446   1HG2  THR  76          1HG2      THR  76 -13.509 -11.649  -3.654
  447   2HG2  THR  76          2HG2      THR  76 -12.701 -12.137  -2.166
  448   3HG2  THR  76          3HG2      THR  76 -14.399 -11.662  -2.132
  449    H    ASN  77           H        ASN  77 -13.467 -15.738  -6.045
  450    HA   ASN  77           HA       ASN  77 -13.848 -15.415  -8.268
  451   1HB   ASN  77          1HB       ASN  77 -15.616 -13.393  -6.937
  452   2HB   ASN  77          2HB       ASN  77 -15.504 -13.423  -8.699
  453   1HD2  ASN  77          1HD2      ASN  77 -16.113 -15.353  -9.798
  454   2HD2  ASN  77          2HD2      ASN  77 -17.246 -16.444  -9.084
  455    H    SER  78           H        SER  78 -11.489 -14.199  -7.198
  456    HA   SER  78           HA       SER  78 -11.192 -11.598  -8.407
  457   1HB   SER  78          1HB       SER  78  -9.997 -12.187  -6.333
  458   2HB   SER  78          2HB       SER  78  -9.124 -13.452  -7.206
  459    HG   SER  78           HG       SER  78  -8.200 -11.824  -8.501
  460    H    SER  79           H        SER  79  -9.451 -11.149  -9.989
  461    HA   SER  79           HA       SER  79  -9.667 -12.960 -12.209
  462   1HB   SER  79          1HB       SER  79  -9.277 -10.227 -11.920
  463   2HB   SER  79          2HB       SER  79  -7.761 -10.813 -12.599
  464    HG   SER  79           HG       SER  79  -9.860 -10.294 -13.953
  465    H    GLY  80           H        GLY  80  -7.029 -11.865 -10.096
  466   1HA   GLY  80          1HA       GLY  80  -5.244 -13.778 -11.433
  467   2HA   GLY  80          2HA       GLY  80  -4.730 -12.466 -10.383
  468    H    CYS  81           H        CYS  81  -6.992 -13.344  -8.493
  469    HA   CYS  81           HA       CYS  81  -5.348 -15.134  -6.937
  470   1HB   CYS  81          1HB       CYS  81  -7.404 -13.250  -6.409
  471   2HB   CYS  81          2HB       CYS  81  -7.980 -14.809  -5.832
  472    HA   PRO  82           HA       PRO  82  -6.681 -19.179  -8.099
  473   1HB   PRO  82          1HB       PRO  82  -7.605 -19.277  -5.248
  474   2HB   PRO  82          2HB       PRO  82  -6.725 -20.495  -6.186
  475   1HG   PRO  82          1HG       PRO  82  -5.490 -18.831  -4.446
  476   2HG   PRO  82          2HG       PRO  82  -4.705 -19.444  -5.910
  477   1HD   PRO  82          1HD       PRO  82  -5.566 -16.726  -5.280
  478   2HD   PRO  82          2HD       PRO  82  -4.518 -17.292  -6.592
  479    H    GLY  83           H        GLY  83  -8.400 -18.580  -9.469
  480   1HA   GLY  83          1HA       GLY  83 -11.056 -18.785  -8.199
  481   2HA   GLY  83          2HA       GLY  83 -10.734 -17.575  -9.432
  482    H    HIS  84           H        HIS  84  -9.917 -21.031  -9.170
  483    HA   HIS  84           HA       HIS  84 -10.253 -21.600 -11.879
  484   1HB   HIS  84          1HB       HIS  84 -10.770 -23.624  -9.708
  485   2HB   HIS  84          2HB       HIS  84 -10.076 -23.886 -11.305
  486    HD1  HIS  84           HD1      HIS  84  -7.638 -22.561 -11.600
  487    HD2  HIS  84           HD2      HIS  84  -8.903 -23.521  -7.761
  488    HE1  HIS  84           HE1      HIS  84  -5.570 -22.483 -10.172
  489    HE2  HIS  84           HE2      HIS  84  -6.364 -23.040  -7.846
  Start of MODEL    4
    1   1H    GLN   1          1H        GLN   1  -7.195  21.115  -1.881
    2   2H    GLN   1          2H        GLN   1  -7.231  22.491  -2.906
    3   3H    GLN   1          3H        GLN   1  -6.058  21.264  -3.154
    4    HA   GLN   1           HA       GLN   1  -8.945  20.766  -3.314
    5   1HB   GLN   1          1HB       GLN   1  -8.563  20.942  -5.803
    6   2HB   GLN   1          2HB       GLN   1  -8.513  22.468  -4.930
    7   1HG   GLN   1          1HG       GLN   1  -5.921  21.128  -5.235
    8   2HG   GLN   1          2HG       GLN   1  -6.671  21.667  -6.737
    9   1HE2  GLN   1          1HE2      GLN   1  -4.288  22.716  -5.791
   10   2HE2  GLN   1          2HE2      GLN   1  -4.536  24.369  -5.352
   11    H    CYS   2           H        CYS   2  -8.486  18.727  -2.348
   12    HA   CYS   2           HA       CYS   2  -7.091  16.876  -4.163
   13   1HB   CYS   2          1HB       CYS   2  -6.297  15.602  -2.243
   14   2HB   CYS   2          2HB       CYS   2  -5.745  17.270  -2.130
   15    H    THR   3           H        THR   3  -9.842  17.475  -4.247
   16    HA   THR   3           HA       THR   3 -10.917  14.820  -3.707
   17    HB   THR   3           HB       THR   3 -11.655  15.892  -1.736
   18    HG1  THR   3           HG1      THR   3 -13.699  15.476  -1.994
   19   1HG2  THR   3          1HG2      THR   3 -12.743  18.038  -1.631
   20   2HG2  THR   3          2HG2      THR   3 -12.587  18.234  -3.377
   21   3HG2  THR   3          3HG2      THR   3 -11.146  18.209  -2.360
   22    H    GLY   4           H        GLY   4 -10.348  15.252  -6.144
   23   1HA   GLY   4          1HA       GLY   4 -12.900  15.958  -7.427
   24   2HA   GLY   4          2HA       GLY   4 -11.409  16.684  -8.024
   25    H    GLY   5           H        GLY   5 -11.280  15.782 -10.016
   26   1HA   GLY   5          1HA       GLY   5 -11.862  13.027 -10.518
   27   2HA   GLY   5          2HA       GLY   5 -11.132  14.158 -11.647
   28    H    ALA   6           H        ALA   6  -9.260  13.383 -12.354
   29    HA   ALA   6           HA       ALA   6  -7.677  11.606 -10.703
   30   1HB   ALA   6          1HB       ALA   6  -8.142  11.629 -13.348
   31   2HB   ALA   6          2HB       ALA   6  -6.718  10.888 -12.619
   32   3HB   ALA   6          3HB       ALA   6  -6.614  12.509 -13.304
   33    H    ASP   7           H        ASP   7  -7.626  13.802  -9.306
   34    HA   ASP   7           HA       ASP   7  -4.884  14.666  -9.461
   35   1HB   ASP   7          1HB       ASP   7  -5.542  17.119  -9.392
   36   2HB   ASP   7          2HB       ASP   7  -5.725  16.314 -10.953
   37    H    CYS   8           H        CYS   8  -4.088  15.092  -7.479
   38    HA   CYS   8           HA       CYS   8  -5.908  15.795  -5.308
   39   1HB   CYS   8          1HB       CYS   8  -4.767  13.166  -5.672
   40   2HB   CYS   8          2HB       CYS   8  -4.180  13.885  -4.171
   41    H    THR   9           H        THR   9  -4.496  17.724  -6.088
   42    HA   THR   9           HA       THR   9  -1.809  17.751  -5.027
   43    HB   THR   9           HB       THR   9  -3.259  20.227  -5.890
   44    HG1  THR   9           HG1      THR   9  -3.793  18.896  -7.546
   45   1HG2  THR   9          1HG2      THR   9  -0.971  20.452  -7.107
   46   2HG2  THR   9          2HG2      THR   9  -0.447  19.255  -5.922
   47   3HG2  THR   9          3HG2      THR   9  -1.102  20.801  -5.383
   48    H    SER  10           H        SER  10  -1.219  19.748  -3.643
   49    HA   SER  10           HA       SER  10  -1.412  20.961  -1.723
   50   1HB   SER  10          1HB       SER  10  -3.428  21.889  -1.148
   51   2HB   SER  10          2HB       SER  10  -3.854  21.312  -2.758
   52    HG   SER  10           HG       SER  10  -4.973  19.667  -1.893
   53    H    CYS  11           H        CYS  11  -3.669  18.191  -1.506
   54    HA   CYS  11           HA       CYS  11  -2.896  17.633   1.196
   55   1HB   CYS  11          1HB       CYS  11  -4.554  16.072  -0.790
   56   2HB   CYS  11          2HB       CYS  11  -4.315  15.587   0.885
   57    H    THR  12           H        THR  12  -1.344  16.313   1.926
   58    HA   THR  12           HA       THR  12   0.048  14.611  -0.035
   59    HB   THR  12           HB       THR  12   2.028  14.940   1.621
   60    HG1  THR  12           HG1      THR  12   0.914  16.049   3.222
   61   1HG2  THR  12          1HG2      THR  12   2.920  16.655   0.364
   62   2HG2  THR  12          2HG2      THR  12   1.356  17.438   0.132
   63   3HG2  THR  12          3HG2      THR  12   1.735  15.947  -0.732
   64    H    GLY  13           H        GLY  13  -1.354  14.886   3.134
   65   1HA   GLY  13          1HA       GLY  13  -0.309  12.634   4.382
   66   2HA   GLY  13          2HA       GLY  13  -1.899  13.308   4.701
   67    H    ALA  14           H        ALA  14  -3.655  12.654   3.231
   68    HA   ALA  14           HA       ALA  14  -3.201  10.042   1.968
   69   1HB   ALA  14          1HB       ALA  14  -4.972   8.999   3.062
   70   2HB   ALA  14          2HB       ALA  14  -5.662  10.528   3.608
   71   3HB   ALA  14          3HB       ALA  14  -4.181   9.916   4.344
   72    H    CYS  15           H        CYS  15  -4.409   9.635   0.155
   73    HA   CYS  15           HA       CYS  15  -5.716  11.933  -1.036
   74   1HB   CYS  15          1HB       CYS  15  -4.798   9.260  -2.031
   75   2HB   CYS  15          2HB       CYS  15  -5.958  10.185  -2.977
   76    H    THR  16           H        THR  16  -7.856  11.921  -1.862
   77    HA   THR  16           HA       THR  16  -9.605   9.880  -0.654
   78    HB   THR  16           HB       THR  16 -10.271  12.805  -1.006
   79    HG1  THR  16           HG1      THR  16  -9.674  13.102   1.014
   80   1HG2  THR  16          1HG2      THR  16 -12.359  12.086  -0.744
   81   2HG2  THR  16          2HG2      THR  16 -11.905  11.810   0.938
   82   3HG2  THR  16          3HG2      THR  16 -11.842  10.483  -0.223
   83    H    GLY  17           H        GLY  17  -9.641   8.699  -2.605
   84   1HA   GLY  17          1HA       GLY  17 -10.347   8.149  -4.726
   85   2HA   GLY  17          2HA       GLY  17 -11.782   9.061  -4.267
   86    H    CYS  18           H        CYS  18  -8.578   9.345  -5.733
   87    HA   CYS  18           HA       CYS  18  -9.643  11.421  -7.494
   88   1HB   CYS  18          1HB       CYS  18  -7.187  12.453  -7.169
   89   2HB   CYS  18          2HB       CYS  18  -8.569  12.958  -6.196
   90    H    GLY  19           H        GLY  19  -6.428  10.013  -6.875
   91   1HA   GLY  19          1HA       GLY  19  -6.065   8.085  -8.617
   92   2HA   GLY  19          2HA       GLY  19  -6.181   9.440  -9.738
   93    H    ASN  20           H        ASN  20  -4.616  11.219  -9.429
   94    HA   ASN  20           HA       ASN  20  -1.992  10.123  -8.913
   95   1HB   ASN  20          1HB       ASN  20  -2.095  11.478 -10.842
   96   2HB   ASN  20          2HB       ASN  20  -2.975  12.753 -10.008
   97   1HD2  ASN  20          1HD2      ASN  20  -0.006  10.971  -9.237
   98   2HD2  ASN  20          2HD2      ASN  20   0.997  12.369  -9.080
   99    H    CYS  21           H        CYS  21  -0.791  10.426  -7.167
  100    HA   CYS  21           HA       CYS  21  -1.661  12.434  -5.194
  101   1HB   CYS  21          1HB       CYS  21  -0.589   9.655  -4.654
  102   2HB   CYS  21          2HB       CYS  21  -0.917  10.870  -3.415
  103    HA   PRO  22           HA       PRO  22   2.540  13.787  -5.216
  104   1HB   PRO  22          1HB       PRO  22   2.757  14.984  -2.829
  105   2HB   PRO  22          2HB       PRO  22   1.679  15.608  -4.082
  106   1HG   PRO  22          1HG       PRO  22   1.029  14.007  -1.649
  107   2HG   PRO  22          2HG       PRO  22   0.136  15.350  -2.381
  108   1HD   PRO  22          1HD       PRO  22  -0.466  12.664  -2.712
  109   2HD   PRO  22          2HD       PRO  22  -0.992  13.967  -3.795
  110    H    ASN  23           H        ASN  23   1.697  12.218  -2.125
  111    HA   ASN  23           HA       ASN  23   3.691  10.254  -2.290
  112   1HB   ASN  23          1HB       ASN  23   5.358  11.012  -0.746
  113   2HB   ASN  23          2HB       ASN  23   5.156  12.277  -1.961
  114   1HD2  ASN  23          1HD2      ASN  23   3.295  13.860  -1.278
  115   2HD2  ASN  23          2HD2      ASN  23   3.443  14.473   0.329
  116    H    ALA  24           H        ALA  24   0.950  10.500  -1.578
  117    HA   ALA  24           HA       ALA  24   0.658  10.292   1.260
  118   1HB   ALA  24          1HB       ALA  24  -1.567  10.287   0.872
  119   2HB   ALA  24          2HB       ALA  24  -1.441   9.156  -0.475
  120   3HB   ALA  24          3HB       ALA  24  -1.066  10.863  -0.718
  121    H    VAL  25           H        VAL  25   0.681   8.534   2.535
  122    HA   VAL  25           HA       VAL  25   1.609   6.040   1.392
  123    HB   VAL  25           HB       VAL  25   1.613   5.286   3.821
  124   1HG1  VAL  25          1HG1      VAL  25   3.643   5.969   2.723
  125   2HG1  VAL  25          2HG1      VAL  25   3.626   6.626   4.360
  126   3HG1  VAL  25          3HG1      VAL  25   3.259   7.669   2.987
  127   1HG2  VAL  25          1HG2      VAL  25  -0.057   7.067   4.497
  128   2HG2  VAL  25          2HG2      VAL  25   1.278   8.216   4.411
  129   3HG2  VAL  25          3HG2      VAL  25   1.343   6.871   5.550
  130    H    THR  26           H        THR  26  -1.392   7.402   2.179
  131    HA   THR  26           HA       THR  26  -2.671   4.794   1.854
  132    HB   THR  26           HB       THR  26  -4.150   6.411   3.752
  133    HG1  THR  26           HG1      THR  26  -1.542   5.591   4.506
  134   1HG2  THR  26          1HG2      THR  26  -4.531   4.019   3.398
  135   2HG2  THR  26          2HG2      THR  26  -4.164   4.399   5.081
  136   3HG2  THR  26          3HG2      THR  26  -2.928   3.679   4.049
  137    H    CYS  27           H        CYS  27  -4.351   4.860   0.488
  138    HA   CYS  27           HA       CYS  27  -5.478   7.500  -0.183
  139   1HB   CYS  27          1HB       CYS  27  -5.304   5.278  -2.196
  140   2HB   CYS  27          2HB       CYS  27  -5.494   7.010  -2.473
  141    H    THR  28           H        THR  28  -7.654   7.562  -0.828
  142    HA   THR  28           HA       THR  28  -9.232   5.257   0.098
  143    HB   THR  28           HB       THR  28 -10.254   8.076  -0.240
  144    HG1  THR  28           HG1      THR  28  -8.749   8.367   1.287
  145   1HG2  THR  28          1HG2      THR  28 -11.306   6.371   1.887
  146   2HG2  THR  28          2HG2      THR  28 -11.642   5.800   0.252
  147   3HG2  THR  28          3HG2      THR  28 -12.145   7.417   0.742
  148    H    ASN  29           H        ASN  29  -9.048   4.194  -1.925
  149    HA   ASN  29           HA       ASN  29 -10.016   3.458  -3.820
  150   1HB   ASN  29          1HB       ASN  29 -11.463   6.105  -4.054
  151   2HB   ASN  29          2HB       ASN  29 -11.874   4.580  -4.837
  152   1HD2  ASN  29          1HD2      ASN  29 -12.240   6.533  -2.072
  153   2HD2  ASN  29          2HD2      ASN  29 -13.237   5.458  -1.158
  154    H    SER  30           H        SER  30 -10.606   5.626  -5.881
  155    HA   SER  30           HA       SER  30  -9.536   6.941  -7.434
  156   1HB   SER  30          1HB       SER  30  -7.520   7.939  -6.973
  157   2HB   SER  30          2HB       SER  30  -7.958   7.435  -5.344
  158    HG   SER  30           HG       SER  30  -5.821   6.749  -6.759
  159    H    GLN  31           H        GLN  31  -7.320   6.627  -8.881
  160    HA   GLN  31           HA       GLN  31  -7.043   3.771  -9.457
  161   1HB   GLN  31          1HB       GLN  31  -7.249   4.480 -11.956
  162   2HB   GLN  31          2HB       GLN  31  -8.704   4.183 -11.007
  163   1HG   GLN  31          1HG       GLN  31  -9.430   6.211 -11.494
  164   2HG   GLN  31          2HG       GLN  31  -8.018   6.916 -10.711
  165   1HE2  GLN  31          1HE2      GLN  31  -6.415   7.769 -11.933
  166   2HE2  GLN  31          2HE2      GLN  31  -6.454   7.857 -13.657
  167    H    HIS  32           H        HIS  32  -4.984   4.988  -8.269
  168    HA   HIS  32           HA       HIS  32  -2.868   4.645 -10.036
  169   1HB   HIS  32          1HB       HIS  32  -4.073   7.049 -10.606
  170   2HB   HIS  32          2HB       HIS  32  -2.761   7.531  -9.527
  171    HD1  HIS  32           HD1      HIS  32  -1.527   8.684 -11.494
  172    HD2  HIS  32           HD2      HIS  32  -2.077   4.594 -11.981
  173    HE1  HIS  32           HE1      HIS  32  -0.022   8.026 -13.397
  174    HE2  HIS  32           HE2      HIS  32  -0.301   5.531 -13.612
  175    H    CYS  33           H        CYS  33  -3.495   4.007  -7.319
  176    HA   CYS  33           HA       CYS  33  -1.327   5.454  -5.940
  177   1HB   CYS  33          1HB       CYS  33  -3.975   4.530  -5.022
  178   2HB   CYS  33          2HB       CYS  33  -2.642   4.227  -3.902
  179    H    VAL  34           H        VAL  34  -0.206   3.781  -7.413
  180    HA   VAL  34           HA       VAL  34  -0.146   1.056  -6.624
  181    HB   VAL  34           HB       VAL  34   1.788   0.846  -8.055
  182   1HG1  VAL  34          1HG1      VAL  34   0.873   1.751 -10.147
  183   2HG1  VAL  34          2HG1      VAL  34  -0.245   2.747  -9.216
  184   3HG1  VAL  34          3HG1      VAL  34  -0.369   0.988  -9.154
  185   1HG2  VAL  34          1HG2      VAL  34   1.821   3.865  -8.106
  186   2HG2  VAL  34          2HG2      VAL  34   2.826   2.818  -9.111
  187   3HG2  VAL  34          3HG2      VAL  34   3.028   2.817  -7.355
  188    H    LYS  35           H        LYS  35   1.751   3.883  -5.755
  189    HA   LYS  35           HA       LYS  35   3.502   2.264  -4.084
  190   1HB   LYS  35          1HB       LYS  35   5.002   4.013  -4.131
  191   2HB   LYS  35          2HB       LYS  35   4.206   4.202  -5.681
  192   1HG   LYS  35          1HG       LYS  35   2.637   5.768  -4.147
  193   2HG   LYS  35          2HG       LYS  35   4.186   5.952  -3.320
  194   1HD   LYS  35          1HD       LYS  35   3.687   6.407  -6.263
  195   2HD   LYS  35          2HD       LYS  35   3.878   7.666  -5.041
  196   1HE   LYS  35          1HE       LYS  35   6.051   5.706  -5.086
  197   2HE   LYS  35          2HE       LYS  35   5.889   6.631  -6.578
  198   1HZ   LYS  35          1HZ       LYS  35   7.152   8.093  -5.457
  199   2HZ   LYS  35          2HZ       LYS  35   6.705   7.507  -3.935
  200   3HZ   LYS  35          3HZ       LYS  35   5.682   8.568  -4.765
  201    H    ALA  36           H        ALA  36   0.706   2.599  -3.352
  202    HA   ALA  36           HA       ALA  36   0.881   4.277  -0.952
  203   1HB   ALA  36          1HB       ALA  36  -1.561   2.920  -2.082
  204   2HB   ALA  36          2HB       ALA  36  -1.057   4.558  -2.497
  205   3HB   ALA  36          3HB       ALA  36  -1.509   4.167  -0.837
  206    H    ASN  37           H        ASN  37   0.641   3.468   1.096
  207    HA   ASN  37           HA       ASN  37   1.490   0.842   1.603
  208   1HB   ASN  37          1HB       ASN  37   1.407   3.042   3.101
  209   2HB   ASN  37          2HB       ASN  37  -0.078   2.295   3.680
  210   1HD2  ASN  37          1HD2      ASN  37   2.371   2.797   5.119
  211   2HD2  ASN  37          2HD2      ASN  37   2.938   1.264   5.679
  212    H    THR  38           H        THR  38  -1.713   2.259   1.378
  213    HA   THR  38           HA       THR  38  -2.889  -0.360   1.117
  214    HB   THR  38           HB       THR  38  -4.541   0.939   3.046
  215    HG1  THR  38           HG1      THR  38  -3.090   0.985   4.797
  216   1HG2  THR  38          1HG2      THR  38  -3.893  -1.056   4.451
  217   2HG2  THR  38          2HG2      THR  38  -2.891  -1.563   3.091
  218   3HG2  THR  38          3HG2      THR  38  -4.636  -1.398   2.889
  219    H    CYS  39           H        CYS  39  -4.953  -0.317   0.172
  220    HA   CYS  39           HA       CYS  39  -6.139   2.280  -0.409
  221   1HB   CYS  39          1HB       CYS  39  -6.346   1.503  -2.872
  222   2HB   CYS  39          2HB       CYS  39  -4.815   2.192  -2.328
  223    H    THR  40           H        THR  40  -8.302   2.220  -0.523
  224    HA   THR  40           HA       THR  40  -9.602  -0.422  -0.622
  225    HB   THR  40           HB       THR  40 -10.701   1.947   0.885
  226    HG1  THR  40           HG1      THR  40  -8.721   1.452   1.829
  227   1HG2  THR  40          1HG2      THR  40 -11.909   0.266   2.160
  228   2HG2  THR  40          2HG2      THR  40 -11.192  -1.007   1.171
  229   3HG2  THR  40          3HG2      THR  40 -12.291   0.164   0.440
  230    H    GLY  41           H        GLY  41 -10.465  -0.539  -2.609
  231   1HA   GLY  41          1HA       GLY  41 -12.118  -0.089  -4.193
  232   2HA   GLY  41          2HA       GLY  41 -12.467   1.417  -3.363
  233    H    SER  42           H        SER  42  -9.381   0.252  -4.639
  234    HA   SER  42           HA       SER  42  -9.454   2.475  -6.560
  235   1HB   SER  42          1HB       SER  42  -7.877   2.674  -4.418
  236   2HB   SER  42          2HB       SER  42  -6.835   1.605  -5.357
  237    HG   SER  42           HG       SER  42  -6.600   3.998  -5.602
  238    H    THR  43           H        THR  43  -6.796   1.646  -7.599
  239    HA   THR  43           HA       THR  43  -7.301  -1.094  -8.391
  240    HB   THR  43           HB       THR  43  -7.445  -0.768 -10.663
  241    HG1  THR  43           HG1      THR  43  -6.574   0.858 -11.708
  242   1HG2  THR  43          1HG2      THR  43  -9.522  -0.125  -9.788
  243   2HG2  THR  43          2HG2      THR  43  -9.122   1.060 -11.034
  244   3HG2  THR  43          3HG2      THR  43  -8.925   1.472  -9.326
  245    H    ASP  44           H        ASP  44  -5.163   1.234  -9.930
  246    HA   ASP  44           HA       ASP  44  -2.929  -0.341 -10.038
  247   1HB   ASP  44          1HB       ASP  44  -3.560   2.278 -10.733
  248   2HB   ASP  44          2HB       ASP  44  -2.231   2.452  -9.591
  249    H    CYS  45           H        CYS  45  -2.914  -1.435  -8.074
  250    HA   CYS  45           HA       CYS  45  -1.499  -0.023  -5.912
  251   1HB   CYS  45          1HB       CYS  45  -3.920  -1.790  -5.755
  252   2HB   CYS  45          2HB       CYS  45  -2.807  -1.683  -4.387
  253    H    ASN  46           H        ASN  46   0.430  -0.983  -6.865
  254    HA   ASN  46           HA       ASN  46   0.636  -3.871  -6.856
  255   1HB   ASN  46          1HB       ASN  46   2.768  -3.597  -7.864
  256   2HB   ASN  46          2HB       ASN  46   1.723  -2.373  -8.588
  257   1HD2  ASN  46          1HD2      ASN  46   4.711  -2.682  -7.993
  258   2HD2  ASN  46          2HD2      ASN  46   5.139  -1.159  -7.298
  259    H    THR  47           H        THR  47   1.917  -1.156  -4.975
  260    HA   THR  47           HA       THR  47   3.466  -2.887  -3.273
  261    HB   THR  47           HB       THR  47   3.890  -0.381  -3.898
  262    HG1  THR  47           HG1      THR  47   4.246  -1.246  -1.224
  263   1HG2  THR  47          1HG2      THR  47   3.113   1.267  -2.452
  264   2HG2  THR  47          2HG2      THR  47   2.468   0.091  -1.308
  265   3HG2  THR  47          3HG2      THR  47   1.672   0.337  -2.861
  266    H    ALA  48           H        ALA  48   0.289  -1.472  -3.236
  267    HA   ALA  48           HA       ALA  48  -0.419  -1.469  -0.596
  268   1HB   ALA  48          1HB       ALA  48  -2.329  -2.631  -2.573
  269   2HB   ALA  48          2HB       ALA  48  -1.793  -0.960  -2.751
  270   3HB   ALA  48          3HB       ALA  48  -2.619  -1.469  -1.278
  271    H    GLN  49           H        GLN  49  -0.769  -2.923   0.974
  272    HA   GLN  49           HA       GLN  49  -0.144  -5.701   0.436
  273   1HB   GLN  49          1HB       GLN  49   0.644  -4.305   2.460
  274   2HB   GLN  49          2HB       GLN  49  -0.966  -4.590   3.106
  275   1HG   GLN  49          1HG       GLN  49  -0.587  -7.005   2.970
  276   2HG   GLN  49          2HG       GLN  49   1.035  -6.707   2.346
  277   1HE2  GLN  49          1HE2      GLN  49  -0.970  -6.858   5.121
  278   2HE2  GLN  49          2HE2      GLN  49   0.251  -6.530   6.299
  279    H    THR  50           H        THR  50  -2.892  -3.995   0.084
  280    HA   THR  50           HA       THR  50  -4.554  -6.250  -0.031
  281    HB   THR  50           HB       THR  50  -4.289  -5.898   2.486
  282    HG1  THR  50           HG1      THR  50  -6.121  -6.948   1.237
  283   1HG2  THR  50          1HG2      THR  50  -5.540  -4.268   3.596
  284   2HG2  THR  50          2HG2      THR  50  -6.355  -3.764   2.115
  285   3HG2  THR  50          3HG2      THR  50  -4.647  -3.396   2.350
  286    H    CYS  51           H        CYS  51  -6.875  -5.647  -0.397
  287    HA   CYS  51           HA       CYS  51  -7.543  -2.935  -0.982
  288   1HB   CYS  51          1HB       CYS  51  -7.889  -3.352  -3.461
  289   2HB   CYS  51          2HB       CYS  51  -6.210  -3.189  -2.939
  290    H    THR  52           H        THR  52  -9.718  -2.845  -2.176
  291    HA   THR  52           HA       THR  52 -11.322  -5.232  -1.553
  292    HB   THR  52           HB       THR  52 -11.562  -3.474   0.208
  293    HG1  THR  52           HG1      THR  52 -13.761  -4.254  -1.373
  294   1HG2  THR  52          1HG2      THR  52 -13.007  -1.530  -0.336
  295   2HG2  THR  52          2HG2      THR  52 -12.751  -1.880  -2.047
  296   3HG2  THR  52          3HG2      THR  52 -11.383  -1.440  -1.022
  297    H    ASN  53           H        ASN  53 -10.264  -3.440  -4.000
  298    HA   ASN  53           HA       ASN  53 -12.050  -4.352  -5.894
  299   1HB   ASN  53          1HB       ASN  53 -13.234  -2.281  -4.432
  300   2HB   ASN  53          2HB       ASN  53 -12.724  -1.529  -5.947
  301   1HD2  ASN  53          1HD2      ASN  53 -13.164  -3.150  -7.876
  302   2HD2  ASN  53          2HD2      ASN  53 -14.788  -3.733  -7.933
  303    H    SER  54           H        SER  54  -9.265  -3.947  -5.606
  304    HA   SER  54           HA       SER  54  -8.631  -1.811  -7.503
  305   1HB   SER  54          1HB       SER  54  -7.225  -3.078  -5.311
  306   2HB   SER  54          2HB       SER  54  -6.249  -3.093  -6.787
  307    HG   SER  54           HG       SER  54  -5.838  -1.098  -6.275
  308    H    LYS  55           H        LYS  55  -6.440  -2.695  -8.792
  309    HA   LYS  55           HA       LYS  55  -7.143  -5.234 -10.064
  310   1HB   LYS  55          1HB       LYS  55  -7.024  -2.549 -11.401
  311   2HB   LYS  55          2HB       LYS  55  -6.686  -4.018 -12.308
  312   1HG   LYS  55          1HG       LYS  55  -8.844  -4.663 -12.335
  313   2HG   LYS  55          2HG       LYS  55  -9.162  -4.045 -10.713
  314   1HD   LYS  55          1HD       LYS  55 -10.435  -2.717 -12.216
  315   2HD   LYS  55          2HD       LYS  55  -9.069  -1.728 -11.694
  316   1HE   LYS  55          1HE       LYS  55  -8.923  -1.337 -13.924
  317   2HE   LYS  55          2HE       LYS  55  -7.975  -2.822 -13.865
  318   1HZ   LYS  55          1HZ       LYS  55  -9.560  -3.980 -14.939
  319   2HZ   LYS  55          2HZ       LYS  55 -10.030  -2.458 -15.508
  320   3HZ   LYS  55          3HZ       LYS  55 -10.841  -3.160 -14.200
  321    H    ASP  56           H        ASP  56  -4.851  -4.002  -8.400
  322    HA   ASP  56           HA       ASP  56  -2.757  -5.193 -10.012
  323   1HB   ASP  56          1HB       ASP  56  -3.034  -2.349  -9.739
  324   2HB   ASP  56          2HB       ASP  56  -1.528  -2.879  -8.981
  325    H    CYS  57           H        CYS  57  -4.191  -5.614  -7.358
  326    HA   CYS  57           HA       CYS  57  -2.122  -5.252  -5.388
  327   1HB   CYS  57          1HB       CYS  57  -4.410  -7.116  -4.927
  328   2HB   CYS  57          2HB       CYS  57  -3.631  -5.996  -3.811
  329    H    PHE  58           H        PHE  58  -0.700  -6.474  -7.087
  330    HA   PHE  58           HA       PHE  58  -0.836  -9.279  -7.256
  331   1HB   PHE  58          1HB       PHE  58   1.745  -7.739  -7.411
  332   2HB   PHE  58          2HB       PHE  58   1.275  -9.185  -8.296
  333    HD1  PHE  58           HD1      PHE  58   1.238  -5.599  -8.159
  334    HD2  PHE  58           HD2      PHE  58  -0.282  -9.037 -10.147
  335    HE1  PHE  58           HE1      PHE  58   0.602  -4.204 -10.073
  336    HE2  PHE  58           HE2      PHE  58  -0.926  -7.646 -12.064
  337    HZ   PHE  58           HZ       PHE  58  -0.466  -5.248 -12.002
  338    H    GLU  59           H        GLU  59   0.543  -7.123  -4.876
  339    HA   GLU  59           HA       GLU  59   1.454  -9.469  -3.342
  340   1HB   GLU  59          1HB       GLU  59   2.662  -6.770  -3.741
  341   2HB   GLU  59          2HB       GLU  59   2.894  -7.567  -2.184
  342   1HG   GLU  59          1HG       GLU  59   4.726  -8.346  -3.253
  343   2HG   GLU  59          2HG       GLU  59   3.581  -9.589  -3.752
  344    H    ALA  60           H        ALA  60  -1.136  -8.925  -3.063
  345    HA   ALA  60           HA       ALA  60  -1.341  -7.380  -0.560
  346   1HB   ALA  60          1HB       ALA  60  -3.153  -7.664  -2.879
  347   2HB   ALA  60          2HB       ALA  60  -2.852  -6.274  -1.835
  348   3HB   ALA  60          3HB       ALA  60  -3.903  -7.582  -1.286
  349    H    ASN  61           H        ASN  61  -2.556  -8.223   1.151
  350    HA   ASN  61           HA       ASN  61  -2.518 -11.107   1.311
  351   1HB   ASN  61          1HB       ASN  61  -2.612  -8.869   3.185
  352   2HB   ASN  61          2HB       ASN  61  -3.700 -10.176   3.641
  353   1HD2  ASN  61          1HD2      ASN  61  -2.787 -11.431   5.082
  354   2HD2  ASN  61          2HD2      ASN  61  -1.140 -11.954   5.087
  355    H    THR  62           H        THR  62  -4.928  -8.517   1.338
  356    HA   THR  62           HA       THR  62  -7.033 -10.564   1.070
  357    HB   THR  62           HB       THR  62  -7.845  -7.806   1.736
  358    HG1  THR  62           HG1      THR  62  -6.614  -7.616   3.402
  359   1HG2  THR  62          1HG2      THR  62  -9.346  -8.869   3.253
  360   2HG2  THR  62          2HG2      THR  62  -8.508 -10.411   3.078
  361   3HG2  THR  62          3HG2      THR  62  -9.402  -9.733   1.717
  362    H    CYS  63           H        CYS  63  -8.300 -10.557  -0.705
  363    HA   CYS  63           HA       CYS  63  -8.277  -8.220  -2.463
  364   1HB   CYS  63          1HB       CYS  63  -7.199 -10.921  -3.116
  365   2HB   CYS  63          2HB       CYS  63  -8.079 -10.057  -4.377
  366    H    THR  64           H        THR  64 -10.406  -7.789  -2.151
  367    HA   THR  64           HA       THR  64 -12.306  -9.854  -3.049
  368    HB   THR  64           HB       THR  64 -13.826  -8.183  -1.492
  369    HG1  THR  64           HG1      THR  64 -11.378  -8.564  -0.120
  370   1HG2  THR  64          1HG2      THR  64 -13.417  -9.958   0.347
  371   2HG2  THR  64          2HG2      THR  64 -12.491 -10.783  -0.907
  372   3HG2  THR  64          3HG2      THR  64 -14.199 -10.426  -1.162
  373    H    ASP  65           H        ASP  65 -13.475  -9.308  -4.776
  374    HA   ASP  65           HA       ASP  65 -14.540  -8.074  -6.371
  375   1HB   ASP  65          1HB       ASP  65 -15.192  -6.731  -4.175
  376   2HB   ASP  65          2HB       ASP  65 -14.139  -5.508  -4.894
  377    H    SER  66           H        SER  66 -11.529  -8.293  -6.044
  378    HA   SER  66           HA       SER  66 -10.814  -6.087  -7.864
  379   1HB   SER  66          1HB       SER  66  -8.537  -6.180  -6.973
  380   2HB   SER  66          2HB       SER  66  -9.691  -5.904  -5.662
  381    HG   SER  66           HG       SER  66  -8.984  -7.664  -4.784
  382    H    THR  67           H        THR  67  -8.637  -6.754  -9.043
  383    HA   THR  67           HA       THR  67  -8.747  -9.554  -9.872
  384    HB   THR  67           HB       THR  67  -9.976  -7.602 -11.367
  385    HG1  THR  67           HG1      THR  67 -10.272  -9.215 -12.758
  386   1HG2  THR  67          1HG2      THR  67  -7.668  -6.736 -11.956
  387   2HG2  THR  67          2HG2      THR  67  -8.763  -7.098 -13.289
  388   3HG2  THR  67          3HG2      THR  67  -7.474  -8.227 -12.875
  389    H    ASN  68           H        ASN  68  -6.823 -10.202 -11.133
  390    HA   ASN  68           HA       ASN  68  -4.556 -10.379 -11.319
  391   1HB   ASN  68          1HB       ASN  68  -5.120  -7.490 -11.768
  392   2HB   ASN  68          2HB       ASN  68  -3.435  -7.964 -11.536
  393   1HD2  ASN  68          1HD2      ASN  68  -5.752  -7.448 -13.785
  394   2HD2  ASN  68          2HD2      ASN  68  -5.132  -8.416 -15.075
  395    H    CYS  69           H        CYS  69  -4.944 -11.002  -8.908
  396    HA   CYS  69           HA       CYS  69  -3.418  -9.187  -7.167
  397   1HB   CYS  69          1HB       CYS  69  -5.535 -11.238  -6.629
  398   2HB   CYS  69          2HB       CYS  69  -4.416 -10.768  -5.350
  399    H    TYR  70           H        TYR  70  -2.467 -11.290  -9.154
  400    HA   TYR  70           HA       TYR  70  -0.885 -12.904  -9.339
  401   1HB   TYR  70          1HB       TYR  70   0.018 -11.006  -7.319
  402   2HB   TYR  70          2HB       TYR  70   0.771 -12.592  -7.142
  403    HD1  TYR  70           HD1      TYR  70  -0.286 -11.313 -10.421
  404    HD2  TYR  70           HD2      TYR  70   2.973 -11.787  -7.727
  405    HE1  TYR  70           HE1      TYR  70   1.284 -10.763 -12.232
  406    HE2  TYR  70           HE2      TYR  70   4.552 -11.237  -9.529
  407    HH   TYR  70           HH       TYR  70   3.999  -9.708 -12.060
  408    H    LYS  71           H        LYS  71  -0.815 -12.874  -5.790
  409    HA   LYS  71           HA       LYS  71  -2.250 -15.376  -5.631
  410   1HB   LYS  71          1HB       LYS  71  -0.372 -16.570  -4.514
  411   2HB   LYS  71          2HB       LYS  71  -0.078 -16.231  -6.220
  412   1HG   LYS  71          1HG       LYS  71   1.866 -15.359  -5.616
  413   2HG   LYS  71          2HG       LYS  71   0.967 -14.033  -4.878
  414   1HD   LYS  71          1HD       LYS  71   0.803 -15.973  -2.958
  415   2HD   LYS  71          2HD       LYS  71   2.408 -16.260  -3.634
  416   1HE   LYS  71          1HE       LYS  71   3.242 -14.389  -2.729
  417   2HE   LYS  71          2HE       LYS  71   1.830 -13.435  -3.180
  418   1HZ   LYS  71          1HZ       LYS  71   1.666 -15.351  -0.949
  419   2HZ   LYS  71          2HZ       LYS  71   0.747 -13.960  -1.230
  420   3HZ   LYS  71          3HZ       LYS  71   2.348 -13.823  -0.702
  421    H    ALA  72           H        ALA  72  -3.490 -13.709  -4.427
  422    HA   ALA  72           HA       ALA  72  -2.475 -12.712  -1.946
  423   1HB   ALA  72          1HB       ALA  72  -4.378 -11.504  -1.845
  424   2HB   ALA  72          2HB       ALA  72  -5.397 -12.875  -2.284
  425   3HB   ALA  72          3HB       ALA  72  -4.533 -11.983  -3.535
  426    H    THR  73           H        THR  73  -3.689 -13.173   0.147
  427    HA   THR  73           HA       THR  73  -3.703 -16.054   0.532
  428    HB   THR  73           HB       THR  73  -2.593 -14.194   2.048
  429    HG1  THR  73           HG1      THR  73  -3.966 -16.372   3.224
  430   1HG2  THR  73          1HG2      THR  73  -3.796 -13.185   3.643
  431   2HG2  THR  73          2HG2      THR  73  -4.896 -14.551   3.827
  432   3HG2  THR  73          3HG2      THR  73  -5.129 -13.402   2.512
  433    H    ALA  74           H        ALA  74  -5.925 -13.374   0.496
  434    HA   ALA  74           HA       ALA  74  -8.131 -15.232   1.116
  435   1HB   ALA  74          1HB       ALA  74  -9.361 -13.032   1.706
  436   2HB   ALA  74          2HB       ALA  74  -7.739 -12.349   1.825
  437   3HB   ALA  74          3HB       ALA  74  -8.206 -13.701   2.858
  438    H    CYS  75           H        CYS  75  -9.549 -15.582  -0.476
  439    HA   CYS  75           HA       CYS  75 -10.062 -13.517  -2.458
  440   1HB   CYS  75          1HB       CYS  75  -8.332 -15.758  -2.966
  441   2HB   CYS  75          2HB       CYS  75  -9.767 -15.873  -3.989
  442    H    THR  76           H        THR  76 -11.937 -13.918  -3.754
  443    HA   THR  76           HA       THR  76 -13.624 -16.175  -3.077
  444    HB   THR  76           HB       THR  76 -14.522 -13.341  -2.518
  445    HG1  THR  76           HG1      THR  76 -13.416 -13.847  -0.762
  446   1HG2  THR  76          1HG2      THR  76 -16.613 -14.044  -2.443
  447   2HG2  THR  76          2HG2      THR  76 -16.174 -15.378  -1.376
  448   3HG2  THR  76          3HG2      THR  76 -16.079 -15.580  -3.125
  449    H    ASN  77           H        ASN  77 -13.453 -13.021  -4.702
  450    HA   ASN  77           HA       ASN  77 -14.354 -14.260  -7.170
  451   1HB   ASN  77          1HB       ASN  77 -15.952 -12.287  -5.609
  452   2HB   ASN  77          2HB       ASN  77 -15.929 -12.115  -7.367
  453   1HD2  ASN  77          1HD2      ASN  77 -17.696 -13.305  -4.972
  454   2HD2  ASN  77          2HD2      ASN  77 -18.431 -14.661  -5.749
  455    H    SER  78           H        SER  78 -11.872 -13.560  -6.923
  456    HA   SER  78           HA       SER  78 -11.642 -11.047  -8.428
  457   1HB   SER  78          1HB       SER  78 -10.862 -10.314  -6.349
  458   2HB   SER  78          2HB       SER  78 -10.123 -11.875  -5.969
  459    HG   SER  78           HG       SER  78  -8.875  -9.824  -6.866
  460    H    SER  79           H        SER  79 -10.057 -11.021 -10.034
  461    HA   SER  79           HA       SER  79  -9.119 -13.650 -10.839
  462   1HB   SER  79          1HB       SER  79 -10.077 -11.583 -12.297
  463   2HB   SER  79          2HB       SER  79  -8.343 -11.294 -12.439
  464    HG   SER  79           HG       SER  79  -8.168 -12.992 -13.670
  465    H    GLY  80           H        GLY  80  -6.865 -13.899 -11.634
  466   1HA   GLY  80          1HA       GLY  80  -4.568 -13.536 -11.467
  467   2HA   GLY  80          2HA       GLY  80  -4.893 -12.110 -10.491
  468    H    CYS  81           H        CYS  81  -6.479 -13.256  -8.503
  469    HA   CYS  81           HA       CYS  81  -4.462 -14.826  -7.066
  470   1HB   CYS  81          1HB       CYS  81  -4.864 -13.040  -5.687
  471   2HB   CYS  81          2HB       CYS  81  -6.508 -12.817  -6.282
  472    HA   PRO  82           HA       PRO  82  -6.834 -18.543  -7.094
  473   1HB   PRO  82          1HB       PRO  82  -6.214 -18.792  -4.201
  474   2HB   PRO  82          2HB       PRO  82  -5.872 -19.913  -5.528
  475   1HG   PRO  82          1HG       PRO  82  -3.925 -18.462  -4.419
  476   2HG   PRO  82          2HG       PRO  82  -3.953 -18.781  -6.162
  477   1HD   PRO  82          1HD       PRO  82  -4.696 -16.299  -4.675
  478   2HD   PRO  82          2HD       PRO  82  -3.852 -16.474  -6.226
  479    H    GLY  83           H        GLY  83  -8.155 -19.653  -4.831
  480   1HA   GLY  83          1HA       GLY  83 -10.165 -19.573  -3.725
  481   2HA   GLY  83          2HA       GLY  83  -9.905 -17.843  -3.561
  482    H    HIS  84           H        HIS  84 -12.141 -19.882  -4.500
  483    HA   HIS  84           HA       HIS  84 -13.642 -18.043  -5.969
  484   1HB   HIS  84          1HB       HIS  84 -13.646 -19.376  -8.176
  485   2HB   HIS  84          2HB       HIS  84 -12.292 -18.293  -7.872
  486    HD1  HIS  84           HD1      HIS  84 -12.691 -21.811  -6.523
  487    HD2  HIS  84           HD2      HIS  84 -10.297 -19.653  -9.145
  488    HE1  HIS  84           HE1      HIS  84 -10.843 -23.379  -7.191
  489    HE2  HIS  84           HE2      HIS  84  -9.452 -22.078  -8.840
  Start of MODEL    5
    1   1H    GLN   1          1H        GLN   1  -6.182  20.892   3.942
    2   2H    GLN   1          2H        GLN   1  -6.909  21.243   2.427
    3   3H    GLN   1          3H        GLN   1  -6.182  22.499   3.345
    4    HA   GLN   1           HA       GLN   1  -4.658  22.052   1.729
    5   1HB   GLN   1          1HB       GLN   1  -4.166  21.477   4.423
    6   2HB   GLN   1          2HB       GLN   1  -3.366  20.186   3.537
    7   1HG   GLN   1          1HG       GLN   1  -2.924  23.144   3.234
    8   2HG   GLN   1          2HG       GLN   1  -1.806  21.956   3.903
    9   1HE2  GLN   1          1HE2      GLN   1  -0.569  20.744   2.552
   10   2HE2  GLN   1          2HE2      GLN   1  -0.522  20.960   0.838
   11    H    CYS   2           H        CYS   2  -6.195  19.152   2.926
   12    HA   CYS   2           HA       CYS   2  -5.637  17.827   0.398
   13   1HB   CYS   2          1HB       CYS   2  -4.600  16.905   3.046
   14   2HB   CYS   2          2HB       CYS   2  -5.112  15.698   1.870
   15    H    THR   3           H        THR   3  -7.577  17.254  -0.300
   16    HA   THR   3           HA       THR   3  -9.336  15.716   1.422
   17    HB   THR   3           HB       THR   3 -10.094  17.969   1.883
   18    HG1  THR   3           HG1      THR   3 -11.750  16.479   1.672
   19   1HG2  THR   3          1HG2      THR   3  -9.501  18.459  -0.849
   20   2HG2  THR   3          2HG2      THR   3  -9.977  19.602   0.407
   21   3HG2  THR   3          3HG2      THR   3 -11.208  18.800  -0.568
   22    H    GLY   4           H        GLY   4 -11.491  15.319   0.004
   23   1HA   GLY   4          1HA       GLY   4 -10.460  14.205  -2.509
   24   2HA   GLY   4          2HA       GLY   4 -11.917  13.680  -1.669
   25    H    GLY   5           H        GLY   5 -12.021  14.103  -4.351
   26   1HA   GLY   5          1HA       GLY   5 -14.229  15.597  -4.808
   27   2HA   GLY   5          2HA       GLY   5 -12.938  16.785  -4.919
   28    H    ALA   6           H        ALA   6 -11.044  16.000  -6.362
   29    HA   ALA   6           HA       ALA   6 -11.901  14.344  -8.591
   30   1HB   ALA   6          1HB       ALA   6 -11.086  17.208  -9.060
   31   2HB   ALA   6          2HB       ALA   6 -12.746  16.615  -9.118
   32   3HB   ALA   6          3HB       ALA   6 -11.556  16.023 -10.280
   33    H    ASP   7           H        ASP   7  -9.389  16.612  -7.471
   34    HA   ASP   7           HA       ASP   7  -7.378  14.596  -8.197
   35   1HB   ASP   7          1HB       ASP   7  -5.870  16.542  -8.844
   36   2HB   ASP   7          2HB       ASP   7  -7.190  16.173  -9.958
   37    H    CYS   8           H        CYS   8  -5.421  14.680  -6.978
   38    HA   CYS   8           HA       CYS   8  -5.608  16.224  -4.478
   39   1HB   CYS   8          1HB       CYS   8  -5.086  13.299  -4.879
   40   2HB   CYS   8          2HB       CYS   8  -4.369  14.132  -3.497
   41    H    THR   9           H        THR   9  -4.200  17.136  -6.667
   42    HA   THR   9           HA       THR   9  -1.436  16.369  -6.479
   43    HB   THR   9           HB       THR   9  -2.402  17.143  -8.603
   44    HG1  THR   9           HG1      THR   9  -0.388  17.638  -8.872
   45   1HG2  THR   9          1HG2      THR   9  -3.205  19.246  -9.027
   46   2HG2  THR   9          2HG2      THR   9  -2.399  19.955  -7.628
   47   3HG2  THR   9          3HG2      THR   9  -3.832  18.951  -7.405
   48    H    SER  10           H        SER  10   0.285  17.676  -5.756
   49    HA   SER  10           HA       SER  10   1.372  19.169  -4.423
   50   1HB   SER  10          1HB       SER  10  -0.204  20.835  -5.538
   51   2HB   SER  10          2HB       SER  10  -1.217  20.689  -4.102
   52    HG   SER  10           HG       SER  10   0.058  22.239  -3.429
   53    H    CYS  11           H        CYS  11  -0.757  17.002  -3.464
   54    HA   CYS  11           HA       CYS  11  -1.268  17.831  -0.762
   55   1HB   CYS  11          1HB       CYS  11  -2.063  15.661  -2.495
   56   2HB   CYS  11          2HB       CYS  11  -1.568  15.039  -0.925
   57    H    THR  12           H        THR  12  -0.705  15.790   0.859
   58    HA   THR  12           HA       THR  12   2.113  15.097   0.563
   59    HB   THR  12           HB       THR  12   2.316  15.806   3.085
   60    HG1  THR  12           HG1      THR  12   1.076  17.695   3.481
   61   1HG2  THR  12          1HG2      THR  12   3.189  17.954   2.498
   62   2HG2  THR  12          2HG2      THR  12   2.303  17.945   0.974
   63   3HG2  THR  12          3HG2      THR  12   3.618  16.799   1.237
   64    H    GLY  13           H        GLY  13  -0.812  14.869   2.558
   65   1HA   GLY  13          1HA       GLY  13   0.073  12.363   3.716
   66   2HA   GLY  13          2HA       GLY  13  -1.437  13.194   4.057
   67    H    ALA  14           H        ALA  14  -2.879  11.573   3.758
   68    HA   ALA  14           HA       ALA  14  -2.705   9.782   1.513
   69   1HB   ALA  14          1HB       ALA  14  -3.665   8.637   3.216
   70   2HB   ALA  14          2HB       ALA  14  -5.141   9.265   2.483
   71   3HB   ALA  14          3HB       ALA  14  -4.442  10.069   3.889
   72    H    CYS  15           H        CYS  15  -4.710   9.431   0.133
   73    HA   CYS  15           HA       CYS  15  -6.011  11.977  -0.539
   74   1HB   CYS  15          1HB       CYS  15  -5.790  11.150  -2.998
   75   2HB   CYS  15          2HB       CYS  15  -4.417  11.939  -2.231
   76    H    THR  16           H        THR  16  -8.066  11.822  -1.456
   77    HA   THR  16           HA       THR  16  -9.260   9.159  -1.666
   78    HB   THR  16           HB       THR  16 -10.558  11.397  -0.103
   79    HG1  THR  16           HG1      THR  16  -9.346   9.051   0.920
   80   1HG2  THR  16          1HG2      THR  16 -11.593   8.968   0.710
   81   2HG2  THR  16          2HG2      THR  16 -11.499   8.839  -1.046
   82   3HG2  THR  16          3HG2      THR  16 -12.387  10.170  -0.305
   83    H    GLY  17           H        GLY  17 -10.238   9.027  -3.580
   84   1HA   GLY  17          1HA       GLY  17 -11.474   9.600  -5.436
   85   2HA   GLY  17          2HA       GLY  17 -12.079  10.980  -4.519
   86    H    CYS  18           H        CYS  18  -8.887   9.995  -5.738
   87    HA   CYS  18           HA       CYS  18  -8.766  12.377  -7.414
   88   1HB   CYS  18          1HB       CYS  18  -6.663  11.789  -5.316
   89   2HB   CYS  18          2HB       CYS  18  -6.612  13.095  -6.502
   90    H    GLY  19           H        GLY  19  -8.106  11.703  -9.347
   91   1HA   GLY  19          1HA       GLY  19  -7.080   9.153  -9.872
   92   2HA   GLY  19          2HA       GLY  19  -7.024  10.514 -10.988
   93    H    ASN  20           H        ASN  20  -5.437  11.941  -8.714
   94    HA   ASN  20           HA       ASN  20  -2.880  10.559  -9.168
   95   1HB   ASN  20          1HB       ASN  20  -3.059  12.447 -10.735
   96   2HB   ASN  20          2HB       ASN  20  -3.331  13.543  -9.383
   97   1HD2  ASN  20          1HD2      ASN  20  -1.529  14.772  -9.809
   98   2HD2  ASN  20          2HD2      ASN  20   0.079  14.198  -9.550
   99    H    CYS  21           H        CYS  21  -1.368  10.693  -7.548
  100    HA   CYS  21           HA       CYS  21  -2.042  12.203  -5.133
  101   1HB   CYS  21          1HB       CYS  21  -1.428   9.239  -5.189
  102   2HB   CYS  21          2HB       CYS  21  -1.498  10.219  -3.723
  103    HA   PRO  22           HA       PRO  22   2.309  12.911  -5.221
  104   1HB   PRO  22          1HB       PRO  22   2.693  13.883  -2.727
  105   2HB   PRO  22          2HB       PRO  22   1.847  14.784  -3.985
  106   1HG   PRO  22          1HG       PRO  22   0.759  13.360  -1.625
  107   2HG   PRO  22          2HG       PRO  22   0.140  14.786  -2.467
  108   1HD   PRO  22          1HD       PRO  22  -0.793  12.149  -2.737
  109   2HD   PRO  22          2HD       PRO  22  -1.192  13.520  -3.787
  110    H    ASN  23           H        ASN  23   2.236  12.167  -1.788
  111    HA   ASN  23           HA       ASN  23   3.728   9.688  -2.327
  112   1HB   ASN  23          1HB       ASN  23   4.410  11.140   0.158
  113   2HB   ASN  23          2HB       ASN  23   5.455  10.265  -0.963
  114   1HD2  ASN  23          1HD2      ASN  23   3.538  13.230  -0.703
  115   2HD2  ASN  23          2HD2      ASN  23   4.634  14.224  -1.595
  116    H    ALA  24           H        ALA  24   0.887  10.235  -1.657
  117    HA   ALA  24           HA       ALA  24   0.249   9.700   0.986
  118   1HB   ALA  24          1HB       ALA  24  -1.194   8.974  -1.554
  119   2HB   ALA  24          2HB       ALA  24  -1.470  10.370  -0.511
  120   3HB   ALA  24          3HB       ALA  24  -1.880   8.751   0.055
  121    H    VAL  25           H        VAL  25   0.345   7.964   2.262
  122    HA   VAL  25           HA       VAL  25   1.433   5.494   1.161
  123    HB   VAL  25           HB       VAL  25   1.706   4.782   3.493
  124   1HG1  VAL  25          1HG1      VAL  25   3.354   6.285   2.239
  125   2HG1  VAL  25          2HG1      VAL  25   3.527   6.160   3.990
  126   3HG1  VAL  25          3HG1      VAL  25   2.761   7.581   3.280
  127   1HG2  VAL  25          1HG2      VAL  25   1.321   7.020   5.037
  128   2HG2  VAL  25          2HG2      VAL  25   0.249   5.622   4.967
  129   3HG2  VAL  25          3HG2      VAL  25  -0.082   7.037   3.969
  130    H    THR  26           H        THR  26  -1.580   6.737   1.584
  131    HA   THR  26           HA       THR  26  -2.859   4.216   1.251
  132    HB   THR  26           HB       THR  26  -4.117   5.417   3.581
  133    HG1  THR  26           HG1      THR  26  -2.337   5.825   4.618
  134   1HG2  THR  26          1HG2      THR  26  -4.822   3.290   3.380
  135   2HG2  THR  26          2HG2      THR  26  -3.427   2.984   4.413
  136   3HG2  THR  26          3HG2      THR  26  -3.306   2.733   2.671
  137    H    CYS  27           H        CYS  27  -4.693   4.510   0.119
  138    HA   CYS  27           HA       CYS  27  -5.992   7.141   0.226
  139   1HB   CYS  27          1HB       CYS  27  -6.116   5.991  -2.443
  140   2HB   CYS  27          2HB       CYS  27  -5.654   7.616  -1.941
  141    H    THR  28           H        THR  28  -8.183   7.154  -0.001
  142    HA   THR  28           HA       THR  28  -9.480   4.530   0.119
  143    HB   THR  28           HB       THR  28 -10.960   7.088   0.571
  144    HG1  THR  28           HG1      THR  28  -9.894   7.563   2.306
  145   1HG2  THR  28          1HG2      THR  28 -12.184   5.855   2.185
  146   2HG2  THR  28          2HG2      THR  28 -11.043   4.513   2.115
  147   3HG2  THR  28          3HG2      THR  28 -12.077   4.864   0.730
  148    H    ASN  29           H        ASN  29  -9.535   3.978  -2.057
  149    HA   ASN  29           HA       ASN  29 -10.646   3.743  -4.012
  150   1HB   ASN  29          1HB       ASN  29 -12.425   5.333  -2.638
  151   2HB   ASN  29          2HB       ASN  29 -12.039   6.325  -4.046
  152   1HD2  ASN  29          1HD2      ASN  29 -12.952   5.852  -5.941
  153   2HD2  ASN  29          2HD2      ASN  29 -13.949   4.473  -6.244
  154    H    SER  30           H        SER  30 -11.037   5.258  -6.021
  155    HA   SER  30           HA       SER  30 -10.222   6.749  -7.596
  156   1HB   SER  30          1HB       SER  30  -9.301   7.948  -5.348
  157   2HB   SER  30          2HB       SER  30  -7.784   7.517  -6.142
  158    HG   SER  30           HG       SER  30  -9.928   8.923  -7.355
  159    H    GLN  31           H        GLN  31  -7.489   7.191  -8.263
  160    HA   GLN  31           HA       GLN  31  -6.392   4.485  -8.508
  161   1HB   GLN  31          1HB       GLN  31  -5.902   5.107 -10.972
  162   2HB   GLN  31          2HB       GLN  31  -7.520   4.556 -10.541
  163   1HG   GLN  31          1HG       GLN  31  -7.686   7.282 -10.222
  164   2HG   GLN  31          2HG       GLN  31  -6.625   7.107 -11.617
  165   1HE2  GLN  31          1HE2      GLN  31  -9.816   6.946 -10.454
  166   2HE2  GLN  31          2HE2      GLN  31 -10.575   6.435 -11.920
  167    H    HIS  32           H        HIS  32  -4.251   4.687  -9.891
  168    HA   HIS  32           HA       HIS  32  -2.103   5.401 -10.015
  169   1HB   HIS  32          1HB       HIS  32  -3.400   7.591 -10.637
  170   2HB   HIS  32          2HB       HIS  32  -2.849   8.137  -9.050
  171    HD1  HIS  32           HD1      HIS  32  -1.444   9.941 -10.409
  172    HD2  HIS  32           HD2      HIS  32  -0.277   5.989 -10.943
  173    HE1  HIS  32           HE1      HIS  32   0.846  10.050 -11.441
  174    HE2  HIS  32           HE2      HIS  32   1.562   7.647 -11.692
  175    H    CYS  33           H        CYS  33  -3.232   4.337  -7.536
  176    HA   CYS  33           HA       CYS  33  -1.428   5.614  -5.587
  177   1HB   CYS  33          1HB       CYS  33  -4.079   4.267  -5.305
  178   2HB   CYS  33          2HB       CYS  33  -2.933   4.156  -3.967
  179    H    VAL  34           H        VAL  34  -0.136   4.069  -7.284
  180    HA   VAL  34           HA       VAL  34  -0.024   1.306  -6.620
  181    HB   VAL  34           HB       VAL  34   2.007   1.237  -7.957
  182   1HG1  VAL  34          1HG1      VAL  34   0.002   3.091  -9.234
  183   2HG1  VAL  34          2HG1      VAL  34  -0.197   1.345  -9.084
  184   3HG1  VAL  34          3HG1      VAL  34   1.117   2.004 -10.060
  185   1HG2  VAL  34          1HG2      VAL  34   3.069   3.207  -8.834
  186   2HG2  VAL  34          2HG2      VAL  34   2.970   3.366  -7.079
  187   3HG2  VAL  34          3HG2      VAL  34   1.841   4.246  -8.112
  188    H    LYS  35           H        LYS  35   1.562   4.168  -5.414
  189    HA   LYS  35           HA       LYS  35   3.448   2.586  -3.856
  190   1HB   LYS  35          1HB       LYS  35   4.746   4.456  -3.729
  191   2HB   LYS  35          2HB       LYS  35   3.855   4.846  -5.186
  192   1HG   LYS  35          1HG       LYS  35   2.214   6.028  -3.551
  193   2HG   LYS  35          2HG       LYS  35   3.590   5.995  -2.447
  194   1HD   LYS  35          1HD       LYS  35   3.627   7.154  -5.232
  195   2HD   LYS  35          2HD       LYS  35   3.459   8.090  -3.745
  196   1HE   LYS  35          1HE       LYS  35   5.823   6.494  -4.691
  197   2HE   LYS  35          2HE       LYS  35   5.740   8.219  -4.337
  198   1HZ   LYS  35          1HZ       LYS  35   5.221   7.493  -1.976
  199   2HZ   LYS  35          2HZ       LYS  35   6.811   7.277  -2.510
  200   3HZ   LYS  35          3HZ       LYS  35   5.759   5.956  -2.436
  201    H    ALA  36           H        ALA  36   0.494   2.714  -3.292
  202    HA   ALA  36           HA       ALA  36   0.480   3.984  -0.656
  203   1HB   ALA  36          1HB       ALA  36  -1.404   4.175  -2.443
  204   2HB   ALA  36          2HB       ALA  36  -1.828   3.979  -0.743
  205   3HB   ALA  36          3HB       ALA  36  -1.889   2.593  -1.833
  206    H    ASN  37           H        ASN  37   0.477   2.862   1.218
  207    HA   ASN  37           HA       ASN  37   1.313   0.183   1.269
  208   1HB   ASN  37          1HB       ASN  37   0.386   2.149   3.308
  209   2HB   ASN  37          2HB       ASN  37   0.435   0.451   3.770
  210   1HD2  ASN  37          1HD2      ASN  37   2.233  -0.093   4.747
  211   2HD2  ASN  37          2HD2      ASN  37   3.803   0.562   4.446
  212    H    THR  38           H        THR  38  -1.879   1.634   1.535
  213    HA   THR  38           HA       THR  38  -3.060  -1.007   1.132
  214    HB   THR  38           HB       THR  38  -3.934   0.878   3.332
  215    HG1  THR  38           HG1      THR  38  -2.681  -1.663   3.402
  216   1HG2  THR  38          1HG2      THR  38  -5.172  -1.455   3.862
  217   2HG2  THR  38          2HG2      THR  38  -5.240  -1.441   2.099
  218   3HG2  THR  38          3HG2      THR  38  -5.922  -0.100   3.019
  219    H    CYS  39           H        CYS  39  -5.123  -0.970   0.164
  220    HA   CYS  39           HA       CYS  39  -5.998   1.668  -0.808
  221   1HB   CYS  39          1HB       CYS  39  -6.050  -0.858  -2.462
  222   2HB   CYS  39          2HB       CYS  39  -6.410   0.784  -2.998
  223    H    THR  40           H        THR  40  -8.237   1.737  -1.534
  224    HA   THR  40           HA       THR  40 -10.006  -0.377  -0.633
  225    HB   THR  40           HB       THR  40 -10.749   2.304   0.398
  226    HG1  THR  40           HG1      THR  40  -9.451   2.041   2.228
  227   1HG2  THR  40          1HG2      THR  40 -11.439   0.945   2.370
  228   2HG2  THR  40          2HG2      THR  40 -10.965  -0.494   1.467
  229   3HG2  THR  40          3HG2      THR  40 -12.261   0.538   0.863
  230    H    GLY  41           H        GLY  41 -10.764  -0.594  -2.713
  231   1HA   GLY  41          1HA       GLY  41 -12.314  -0.144  -4.384
  232   2HA   GLY  41          2HA       GLY  41 -12.673   1.381  -3.590
  233    H    SER  42           H        SER  42  -9.563   0.166  -4.727
  234    HA   SER  42           HA       SER  42  -9.545   2.321  -6.717
  235   1HB   SER  42          1HB       SER  42  -7.671   1.825  -4.469
  236   2HB   SER  42          2HB       SER  42  -6.915   2.199  -6.015
  237    HG   SER  42           HG       SER  42  -8.711   3.954  -5.894
  238    H    THR  43           H        THR  43  -6.884   1.611  -7.656
  239    HA   THR  43           HA       THR  43  -7.173  -1.203  -8.300
  240    HB   THR  43           HB       THR  43  -7.323  -0.993 -10.582
  241    HG1  THR  43           HG1      THR  43  -6.862   1.781 -10.595
  242   1HG2  THR  43          1HG2      THR  43  -9.433  -0.360  -9.733
  243   2HG2  THR  43          2HG2      THR  43  -9.068   0.717 -11.084
  244   3HG2  THR  43          3HG2      THR  43  -8.888   1.290  -9.423
  245    H    ASP  44           H        ASP  44  -5.151   1.152  -9.950
  246    HA   ASP  44           HA       ASP  44  -2.823  -0.213 -10.010
  247   1HB   ASP  44          1HB       ASP  44  -2.976   2.767  -9.534
  248   2HB   ASP  44          2HB       ASP  44  -1.679   1.883 -10.333
  249    H    CYS  45           H        CYS  45  -2.768  -1.378  -8.068
  250    HA   CYS  45           HA       CYS  45  -1.416   0.055  -5.880
  251   1HB   CYS  45          1HB       CYS  45  -3.666  -1.945  -5.673
  252   2HB   CYS  45          2HB       CYS  45  -2.632  -1.517  -4.304
  253    H    ASN  46           H        ASN  46   0.572  -0.756  -6.698
  254    HA   ASN  46           HA       ASN  46   0.939  -3.640  -6.804
  255   1HB   ASN  46          1HB       ASN  46   1.964  -2.225  -8.541
  256   2HB   ASN  46          2HB       ASN  46   2.914  -1.400  -7.302
  257   1HD2  ASN  46          1HD2      ASN  46   3.171  -3.561  -9.655
  258   2HD2  ASN  46          2HD2      ASN  46   4.419  -4.578  -9.031
  259    H    THR  47           H        THR  47   2.047  -0.878  -4.882
  260    HA   THR  47           HA       THR  47   3.656  -2.569  -3.176
  261    HB   THR  47           HB       THR  47   4.267  -0.553  -2.019
  262    HG1  THR  47           HG1      THR  47   3.174   1.313  -2.213
  263   1HG2  THR  47          1HG2      THR  47   4.598  -0.816  -4.798
  264   2HG2  THR  47          2HG2      THR  47   5.596   0.085  -3.657
  265   3HG2  THR  47          3HG2      THR  47   4.253   0.883  -4.476
  266    H    ALA  48           H        ALA  48   0.407  -1.487  -3.256
  267    HA   ALA  48           HA       ALA  48  -0.261  -1.314  -0.567
  268   1HB   ALA  48          1HB       ALA  48  -2.485  -1.494  -1.216
  269   2HB   ALA  48          2HB       ALA  48  -2.110  -2.584  -2.551
  270   3HB   ALA  48          3HB       ALA  48  -1.691  -0.874  -2.664
  271    H    GLN  49           H        GLN  49  -0.939  -2.767   0.981
  272    HA   GLN  49           HA       GLN  49  -0.100  -5.536   0.529
  273   1HB   GLN  49          1HB       GLN  49  -0.240  -3.747   2.883
  274   2HB   GLN  49          2HB       GLN  49  -0.609  -5.440   3.179
  275   1HG   GLN  49          1HG       GLN  49   1.629  -5.726   1.742
  276   2HG   GLN  49          2HG       GLN  49   1.943  -4.149   2.465
  277   1HE2  GLN  49          1HE2      GLN  49   3.604  -6.127   3.112
  278   2HE2  GLN  49          2HE2      GLN  49   3.330  -6.674   4.727
  279    H    THR  50           H        THR  50  -2.881  -3.861   0.241
  280    HA   THR  50           HA       THR  50  -4.527  -6.126   0.219
  281    HB   THR  50           HB       THR  50  -4.152  -5.710   2.733
  282    HG1  THR  50           HG1      THR  50  -6.829  -5.780   1.816
  283   1HG2  THR  50          1HG2      THR  50  -6.293  -3.651   2.325
  284   2HG2  THR  50          2HG2      THR  50  -4.598  -3.255   2.617
  285   3HG2  THR  50          3HG2      THR  50  -5.523  -4.135   3.836
  286    H    CYS  51           H        CYS  51  -6.828  -5.569  -0.156
  287    HA   CYS  51           HA       CYS  51  -7.572  -2.863  -0.667
  288   1HB   CYS  51          1HB       CYS  51  -7.932  -3.277  -3.172
  289   2HB   CYS  51          2HB       CYS  51  -6.278  -2.967  -2.634
  290    H    THR  52           H        THR  52  -9.673  -2.999  -2.245
  291    HA   THR  52           HA       THR  52 -11.232  -5.375  -1.579
  292    HB   THR  52           HB       THR  52 -11.588  -3.813   0.287
  293    HG1  THR  52           HG1      THR  52 -13.622  -4.339   0.331
  294   1HG2  THR  52          1HG2      THR  52 -12.501  -1.696   0.100
  295   2HG2  THR  52          2HG2      THR  52 -13.006  -1.953  -1.570
  296   3HG2  THR  52          3HG2      THR  52 -11.298  -1.734  -1.189
  297    H    ASN  53           H        ASN  53 -10.177  -3.726  -4.000
  298    HA   ASN  53           HA       ASN  53 -12.004  -4.493  -5.887
  299   1HB   ASN  53          1HB       ASN  53 -13.049  -2.295  -4.410
  300   2HB   ASN  53          2HB       ASN  53 -12.651  -1.704  -6.024
  301   1HD2  ASN  53          1HD2      ASN  53 -14.629  -3.864  -4.163
  302   2HD2  ASN  53          2HD2      ASN  53 -15.742  -4.257  -5.426
  303    H    SER  54           H        SER  54  -9.211  -4.162  -5.594
  304    HA   SER  54           HA       SER  54  -8.497  -1.996  -7.421
  305   1HB   SER  54          1HB       SER  54  -6.919  -3.820  -5.623
  306   2HB   SER  54          2HB       SER  54  -6.120  -2.908  -6.909
  307    HG   SER  54           HG       SER  54  -7.055  -2.055  -4.502
  308    H    LYS  55           H        LYS  55  -6.465  -2.786  -8.855
  309    HA   LYS  55           HA       LYS  55  -7.147  -5.298 -10.193
  310   1HB   LYS  55          1HB       LYS  55  -6.895  -2.611 -11.557
  311   2HB   LYS  55          2HB       LYS  55  -6.953  -4.153 -12.405
  312   1HG   LYS  55          1HG       LYS  55  -9.181  -4.485 -11.931
  313   2HG   LYS  55          2HG       LYS  55  -9.143  -3.439 -10.512
  314   1HD   LYS  55          1HD       LYS  55 -10.167  -1.975 -11.889
  315   2HD   LYS  55          2HD       LYS  55  -8.522  -1.659 -12.444
  316   1HE   LYS  55          1HE       LYS  55  -9.271  -2.166 -14.484
  317   2HE   LYS  55          2HE       LYS  55  -9.277  -3.843 -13.939
  318   1HZ   LYS  55          1HZ       LYS  55 -11.643  -2.837 -13.027
  319   2HZ   LYS  55          2HZ       LYS  55 -11.438  -3.808 -14.396
  320   3HZ   LYS  55          3HZ       LYS  55 -11.479  -2.124 -14.553
  321    H    ASP  56           H        ASP  56  -4.896  -4.051  -8.518
  322    HA   ASP  56           HA       ASP  56  -2.753  -5.150 -10.132
  323   1HB   ASP  56          1HB       ASP  56  -3.096  -2.306  -9.719
  324   2HB   ASP  56          2HB       ASP  56  -1.560  -2.865  -9.050
  325    H    CYS  57           H        CYS  57  -4.284  -5.600  -7.546
  326    HA   CYS  57           HA       CYS  57  -2.360  -5.282  -5.450
  327   1HB   CYS  57          1HB       CYS  57  -5.088  -6.411  -5.737
  328   2HB   CYS  57          2HB       CYS  57  -4.103  -7.069  -4.430
  329    H    PHE  58           H        PHE  58  -0.755  -6.416  -7.058
  330    HA   PHE  58           HA       PHE  58  -0.881  -9.281  -7.129
  331   1HB   PHE  58          1HB       PHE  58   1.653  -7.755  -7.623
  332   2HB   PHE  58          2HB       PHE  58   1.058  -9.208  -8.416
  333    HD1  PHE  58           HD1      PHE  58   1.194  -5.637  -8.415
  334    HD2  PHE  58           HD2      PHE  58  -0.728  -9.047 -10.073
  335    HE1  PHE  58           HE1      PHE  58   0.414  -4.276 -10.300
  336    HE2  PHE  58           HE2      PHE  58  -1.516  -7.690 -11.960
  337    HZ   PHE  58           HZ       PHE  58  -0.926  -5.322 -12.051
  338    H    GLU  59           H        GLU  59   0.578  -6.872  -5.071
  339    HA   GLU  59           HA       GLU  59   1.988  -8.954  -3.564
  340   1HB   GLU  59          1HB       GLU  59   3.186  -6.864  -4.344
  341   2HB   GLU  59          2HB       GLU  59   2.205  -5.970  -3.183
  342   1HG   GLU  59          1HG       GLU  59   4.297  -6.391  -2.163
  343   2HG   GLU  59          2HG       GLU  59   3.122  -7.458  -1.396
  344    H    ALA  60           H        ALA  60  -0.922  -7.297  -3.493
  345    HA   ALA  60           HA       ALA  60  -1.284  -6.625  -0.820
  346   1HB   ALA  60          1HB       ALA  60  -3.266  -7.630  -2.847
  347   2HB   ALA  60          2HB       ALA  60  -2.907  -5.954  -2.431
  348   3HB   ALA  60          3HB       ALA  60  -3.717  -7.000  -1.262
  349    H    ASN  61           H        ASN  61  -2.852  -7.785   0.673
  350    HA   ASN  61           HA       ASN  61  -2.141 -10.642   0.787
  351   1HB   ASN  61          1HB       ASN  61  -2.758  -8.793   3.101
  352   2HB   ASN  61          2HB       ASN  61  -2.283 -10.485   3.218
  353   1HD2  ASN  61          1HD2      ASN  61  -1.092  -7.823   4.084
  354   2HD2  ASN  61          2HD2      ASN  61   0.551  -7.920   3.559
  355    H    THR  62           H        THR  62  -4.678  -8.246   1.259
  356    HA   THR  62           HA       THR  62  -6.642 -10.443   1.375
  357    HB   THR  62           HB       THR  62  -7.589  -7.800   2.224
  358    HG1  THR  62           HG1      THR  62  -5.697  -7.492   3.220
  359   1HG2  THR  62          1HG2      THR  62  -8.754 -10.022   2.551
  360   2HG2  THR  62          2HG2      THR  62  -8.654  -8.960   3.955
  361   3HG2  THR  62          3HG2      THR  62  -7.564 -10.339   3.813
  362    H    CYS  63           H        CYS  63  -7.095 -10.678  -0.770
  363    HA   CYS  63           HA       CYS  63  -7.804  -8.302  -2.323
  364   1HB   CYS  63          1HB       CYS  63  -7.143 -11.144  -3.056
  365   2HB   CYS  63          2HB       CYS  63  -7.920 -10.062  -4.213
  366    H    THR  64           H        THR  64  -9.852  -7.688  -2.147
  367    HA   THR  64           HA       THR  64 -11.944  -9.756  -2.310
  368    HB   THR  64           HB       THR  64 -13.198  -7.684  -1.032
  369    HG1  THR  64           HG1      THR  64 -10.630  -7.889   0.141
  370   1HG2  THR  64          1HG2      THR  64 -11.726  -9.741   0.562
  371   2HG2  THR  64          2HG2      THR  64 -13.106 -10.169  -0.451
  372   3HG2  THR  64          3HG2      THR  64 -13.303  -9.014   0.868
  373    H    ASP  65           H        ASP  65 -12.594  -9.584  -4.381
  374    HA   ASP  65           HA       ASP  65 -13.758  -8.734  -6.154
  375   1HB   ASP  65          1HB       ASP  65 -13.880  -6.043  -4.802
  376   2HB   ASP  65          2HB       ASP  65 -14.992  -6.726  -5.992
  377    H    SER  66           H        SER  66 -10.834  -8.552  -5.733
  378    HA   SER  66           HA       SER  66 -10.257  -6.396  -7.659
  379   1HB   SER  66          1HB       SER  66  -8.244  -7.534  -5.716
  380   2HB   SER  66          2HB       SER  66  -8.128  -6.045  -6.662
  381    HG   SER  66           HG       SER  66  -8.908  -6.187  -4.231
  382    H    THR  67           H        THR  67  -8.924  -6.882  -9.399
  383    HA   THR  67           HA       THR  67  -8.524  -9.757  -9.855
  384    HB   THR  67           HB       THR  67  -9.845  -8.969 -11.601
  385    HG1  THR  67           HG1      THR  67  -7.252  -8.531 -12.648
  386   1HG2  THR  67          1HG2      THR  67  -8.168  -6.486 -11.581
  387   2HG2  THR  67          2HG2      THR  67  -9.903  -6.647 -11.307
  388   3HG2  THR  67          3HG2      THR  67  -9.237  -6.906 -12.919
  389    H    ASN  68           H        ASN  68  -6.615 -10.468 -10.982
  390    HA   ASN  68           HA       ASN  68  -4.372 -10.598 -11.335
  391   1HB   ASN  68          1HB       ASN  68  -4.974  -7.766 -11.714
  392   2HB   ASN  68          2HB       ASN  68  -3.318  -8.038 -11.168
  393   1HD2  ASN  68          1HD2      ASN  68  -4.499  -7.174 -13.769
  394   2HD2  ASN  68          2HD2      ASN  68  -3.811  -8.242 -14.941
  395    H    CYS  69           H        CYS  69  -4.902 -11.381  -8.944
  396    HA   CYS  69           HA       CYS  69  -3.166  -9.887  -7.098
  397   1HB   CYS  69          1HB       CYS  69  -5.514 -11.710  -6.637
  398   2HB   CYS  69          2HB       CYS  69  -4.345 -11.391  -5.351
  399    H    TYR  70           H        TYR  70  -1.328 -10.860  -8.186
  400    HA   TYR  70           HA       TYR  70  -0.840 -13.597  -8.355
  401   1HB   TYR  70          1HB       TYR  70   0.913 -11.169  -8.289
  402   2HB   TYR  70          2HB       TYR  70   1.645 -12.773  -8.217
  403    HD1  TYR  70           HD1      TYR  70  -1.120 -11.194 -10.189
  404    HD2  TYR  70           HD2      TYR  70   2.473 -13.471 -10.245
  405    HE1  TYR  70           HE1      TYR  70  -1.280 -11.373 -12.637
  406    HE2  TYR  70           HE2      TYR  70   2.326 -13.655 -12.692
  407    HH   TYR  70           HH       TYR  70   1.303 -12.540 -14.566
  408    H    LYS  71           H        LYS  71  -1.443 -14.638  -6.502
  409    HA   LYS  71           HA       LYS  71  -0.871 -15.807  -4.611
  410   1HB   LYS  71          1HB       LYS  71   1.538 -14.970  -5.200
  411   2HB   LYS  71          2HB       LYS  71   1.265 -13.838  -3.875
  412   1HG   LYS  71          1HG       LYS  71   1.069 -15.572  -2.299
  413   2HG   LYS  71          2HG       LYS  71   0.897 -16.801  -3.554
  414   1HD   LYS  71          1HD       LYS  71   3.120 -16.905  -2.601
  415   2HD   LYS  71          2HD       LYS  71   3.213 -16.348  -4.273
  416   1HE   LYS  71          1HE       LYS  71   3.960 -14.300  -3.686
  417   2HE   LYS  71          2HE       LYS  71   2.951 -14.233  -2.242
  418   1HZ   LYS  71          1HZ       LYS  71   4.504 -15.493  -1.033
  419   2HZ   LYS  71          2HZ       LYS  71   5.421 -14.345  -1.869
  420   3HZ   LYS  71          3HZ       LYS  71   5.363 -15.942  -2.420
  421    H    ALA  72           H        ALA  72  -2.947 -15.006  -3.966
  422    HA   ALA  72           HA       ALA  72  -2.754 -13.068  -1.756
  423   1HB   ALA  72          1HB       ALA  72  -4.168 -11.744  -2.851
  424   2HB   ALA  72          2HB       ALA  72  -5.399 -12.991  -2.649
  425   3HB   ALA  72          3HB       ALA  72  -4.414 -12.952  -4.111
  426    H    THR  73           H        THR  73  -3.775 -13.620   0.132
  427    HA   THR  73           HA       THR  73  -4.457 -16.381   0.471
  428    HB   THR  73           HB       THR  73  -3.275 -15.090   2.213
  429    HG1  THR  73           HG1      THR  73  -4.449 -16.896   2.871
  430   1HG2  THR  73          1HG2      THR  73  -3.963 -13.077   2.799
  431   2HG2  THR  73          2HG2      THR  73  -5.350 -13.834   3.582
  432   3HG2  THR  73          3HG2      THR  73  -5.475 -13.276   1.915
  433    H    ALA  74           H        ALA  74  -6.224 -13.410   0.052
  434    HA   ALA  74           HA       ALA  74  -8.750 -14.879   0.441
  435   1HB   ALA  74          1HB       ALA  74  -9.558 -12.320   0.457
  436   2HB   ALA  74          2HB       ALA  74  -7.922 -12.118   1.083
  437   3HB   ALA  74          3HB       ALA  74  -9.056 -13.186   1.909
  438    H    CYS  75           H        CYS  75 -10.002 -15.213  -1.288
  439    HA   CYS  75           HA       CYS  75  -9.784 -13.418  -3.584
  440   1HB   CYS  75          1HB       CYS  75  -8.260 -15.482  -3.821
  441   2HB   CYS  75          2HB       CYS  75  -9.757 -16.395  -4.024
  442    H    THR  76           H        THR  76 -11.862 -12.738  -2.778
  443    HA   THR  76           HA       THR  76 -14.042 -14.665  -3.098
  444    HB   THR  76           HB       THR  76 -14.162 -11.809  -2.107
  445    HG1  THR  76           HG1      THR  76 -13.435 -12.551  -0.305
  446   1HG2  THR  76          1HG2      THR  76 -16.135 -14.064  -1.851
  447   2HG2  THR  76          2HG2      THR  76 -16.330 -12.601  -2.815
  448   3HG2  THR  76          3HG2      THR  76 -16.262 -12.495  -1.056
  449    H    ASN  77           H        ASN  77 -14.167 -14.861  -5.331
  450    HA   ASN  77           HA       ASN  77 -14.859 -14.350  -7.440
  451   1HB   ASN  77          1HB       ASN  77 -16.864 -13.488  -6.247
  452   2HB   ASN  77          2HB       ASN  77 -16.091 -11.904  -6.142
  453   1HD2  ASN  77          1HD2      ASN  77 -16.442 -14.319  -8.724
  454   2HD2  ASN  77          2HD2      ASN  77 -17.117 -13.229  -9.882
  455    H    SER  78           H        SER  78 -12.282 -13.616  -6.669
  456    HA   SER  78           HA       SER  78 -11.852 -11.090  -8.121
  457   1HB   SER  78          1HB       SER  78 -10.544 -12.315  -5.748
  458   2HB   SER  78          2HB       SER  78  -9.508 -11.422  -6.867
  459    HG   SER  78           HG       SER  78 -10.882 -10.373  -4.988
  460    H    SER  79           H        SER  79 -10.003 -10.955  -9.518
  461    HA   SER  79           HA       SER  79  -9.450 -13.496 -10.849
  462   1HB   SER  79          1HB       SER  79  -9.977 -10.926 -11.798
  463   2HB   SER  79          2HB       SER  79  -8.259 -11.174 -12.103
  464    HG   SER  79           HG       SER  79 -10.467 -12.454 -13.192
  465    H    GLY  80           H        GLY  80  -7.287 -14.028 -11.551
  466   1HA   GLY  80          1HA       GLY  80  -4.974 -14.096 -11.359
  467   2HA   GLY  80          2HA       GLY  80  -5.049 -12.674 -10.323
  468    H    CYS  81           H        CYS  81  -6.641 -13.493  -8.272
  469    HA   CYS  81           HA       CYS  81  -4.859 -15.263  -6.852
  470   1HB   CYS  81          1HB       CYS  81  -6.446 -14.824  -4.933
  471   2HB   CYS  81          2HB       CYS  81  -5.680 -13.390  -5.615
  472    HA   PRO  82           HA       PRO  82  -6.793 -19.213  -6.916
  473   1HB   PRO  82          1HB       PRO  82  -7.685 -18.747  -4.094
  474   2HB   PRO  82          2HB       PRO  82  -6.900 -20.167  -4.807
  475   1HG   PRO  82          1HG       PRO  82  -5.490 -18.450  -3.352
  476   2HG   PRO  82          2HG       PRO  82  -4.804 -19.161  -4.824
  477   1HD   PRO  82          1HD       PRO  82  -5.827 -16.410  -4.348
  478   2HD   PRO  82          2HD       PRO  82  -4.526 -16.960  -5.421
  479    H    GLY  83           H        GLY  83  -8.453 -18.699  -8.364
  480   1HA   GLY  83          1HA       GLY  83 -11.048 -19.234  -7.635
  481   2HA   GLY  83          2HA       GLY  83 -10.906 -17.485  -7.531
  482    H    HIS  84           H        HIS  84  -9.446 -19.766  -9.816
  483    HA   HIS  84           HA       HIS  84 -10.068 -18.104 -12.047
  484   1HB   HIS  84          1HB       HIS  84  -9.286 -20.986 -12.333
  485   2HB   HIS  84          2HB       HIS  84  -8.845 -19.611 -13.339
  486    HD1  HIS  84           HD1      HIS  84  -7.255 -17.789 -11.909
  487    HD2  HIS  84           HD2      HIS  84  -7.262 -21.774 -10.734
  488    HE1  HIS  84           HE1      HIS  84  -5.160 -18.093 -10.552
  489    HE2  HIS  84           HE2      HIS  84  -5.244 -20.482  -9.759
  Start of MODEL    6
    1   1H    GLN   1          1H        GLN   1  -9.027  21.866   3.551
    2   2H    GLN   1          2H        GLN   1  -8.357  22.131   1.993
    3   3H    GLN   1          3H        GLN   1  -7.344  22.147   3.378
    4    HA   GLN   1           HA       GLN   1  -8.091  19.807   3.755
    5   1HB   GLN   1          1HB       GLN   1  -9.739  20.485   1.615
    6   2HB   GLN   1          2HB       GLN   1  -8.518  19.445   0.898
    7   1HG   GLN   1          1HG       GLN   1 -10.360  18.092   1.564
    8   2HG   GLN   1          2HG       GLN   1  -9.010  17.756   2.647
    9   1HE2  GLN   1          1HE2      GLN   1 -11.825  17.300   3.093
   10   2HE2  GLN   1          2HE2      GLN   1 -12.260  18.215   4.492
   11    H    CYS   2           H        CYS   2  -7.042  18.078   1.933
   12    HA   CYS   2           HA       CYS   2  -4.654  19.131   0.731
   13   1HB   CYS   2          1HB       CYS   2  -3.926  19.068   3.059
   14   2HB   CYS   2          2HB       CYS   2  -4.422  17.385   3.191
   15    H    THR   3           H        THR   3  -6.280  17.988  -0.799
   16    HA   THR   3           HA       THR   3  -5.072  15.533  -1.597
   17    HB   THR   3           HB       THR   3  -6.469  14.551   0.092
   18    HG1  THR   3           HG1      THR   3  -7.769  14.221  -2.404
   19   1HG2  THR   3          1HG2      THR   3  -8.631  15.018   0.547
   20   2HG2  THR   3          2HG2      THR   3  -9.012  15.442  -1.121
   21   3HG2  THR   3          3HG2      THR   3  -8.153  16.590  -0.092
   22    H    GLY   4           H        GLY   4  -8.037  17.484  -1.882
   23   1HA   GLY   4          1HA       GLY   4  -8.537  18.723  -3.866
   24   2HA   GLY   4          2HA       GLY   4  -7.587  17.560  -4.788
   25    H    GLY   5           H        GLY   5  -9.799  17.980  -5.988
   26   1HA   GLY   5          1HA       GLY   5 -11.719  15.935  -5.065
   27   2HA   GLY   5          2HA       GLY   5 -12.158  17.339  -6.028
   28    H    ALA   6           H        ALA   6 -10.304  17.328  -8.020
   29    HA   ALA   6           HA       ALA   6 -10.780  14.736  -9.343
   30   1HB   ALA   6          1HB       ALA   6 -11.475  15.756 -11.230
   31   2HB   ALA   6          2HB       ALA   6 -10.349  17.100 -11.046
   32   3HB   ALA   6          3HB       ALA   6 -11.853  17.078 -10.126
   33    H    ASP   7           H        ASP   7  -8.560  17.461  -8.988
   34    HA   ASP   7           HA       ASP   7  -6.400  15.738 -10.014
   35   1HB   ASP   7          1HB       ASP   7  -5.246  17.932 -10.598
   36   2HB   ASP   7          2HB       ASP   7  -6.637  17.493 -11.592
   37    H    CYS   8           H        CYS   8  -4.341  15.941  -9.015
   38    HA   CYS   8           HA       CYS   8  -4.525  16.798  -6.215
   39   1HB   CYS   8          1HB       CYS   8  -2.269  15.161  -7.341
   40   2HB   CYS   8          2HB       CYS   8  -2.884  15.210  -5.686
   41    H    THR   9           H        THR   9  -3.985  18.916  -6.146
   42    HA   THR   9           HA       THR   9  -2.149  20.231  -7.782
   43    HB   THR   9           HB       THR   9  -2.182  22.019  -6.112
   44    HG1  THR   9           HG1      THR   9  -2.326  21.430  -4.117
   45   1HG2  THR   9          1HG2      THR   9  -4.128  22.466  -7.091
   46   2HG2  THR   9          2HG2      THR   9  -4.858  21.765  -5.646
   47   3HG2  THR   9          3HG2      THR   9  -4.625  20.773  -7.086
   48    H    SER  10           H        SER  10  -1.604  19.584  -4.319
   49    HA   SER  10           HA       SER  10   0.954  18.389  -4.783
   50   1HB   SER  10          1HB       SER  10   0.763  21.284  -4.202
   51   2HB   SER  10          2HB       SER  10   1.939  20.388  -3.242
   52    HG   SER  10           HG       SER  10   2.243  21.263  -5.684
   53    H    CYS  11           H        CYS  11  -0.466  16.907  -3.522
   54    HA   CYS  11           HA       CYS  11   0.138  17.200  -0.690
   55   1HB   CYS  11          1HB       CYS  11  -2.577  17.329  -1.835
   56   2HB   CYS  11          2HB       CYS  11  -2.395  16.224  -0.477
   57    H    THR  12           H        THR  12   0.768  15.320   0.183
   58    HA   THR  12           HA       THR  12   0.245  12.865  -1.360
   59    HB   THR  12           HB       THR  12   2.571  13.314  -1.478
   60    HG1  THR  12           HG1      THR  12   3.432  11.572  -0.256
   61   1HG2  THR  12          1HG2      THR  12   3.621  13.266   1.070
   62   2HG2  THR  12          2HG2      THR  12   2.242  14.358   1.198
   63   3HG2  THR  12          3HG2      THR  12   3.504  14.668   0.006
   64    H    GLY  13           H        GLY  13  -0.080  14.408   1.699
   65   1HA   GLY  13          1HA       GLY  13  -0.043  12.554   3.633
   66   2HA   GLY  13          2HA       GLY  13  -1.364  13.703   3.505
   67    H    ALA  14           H        ALA  14  -3.144  13.020   1.945
   68    HA   ALA  14           HA       ALA  14  -3.487  10.101   1.921
   69   1HB   ALA  14          1HB       ALA  14  -4.645  11.019   3.901
   70   2HB   ALA  14          2HB       ALA  14  -5.750  10.275   2.745
   71   3HB   ALA  14          3HB       ALA  14  -5.618  12.032   2.834
   72    H    CYS  15           H        CYS  15  -4.132   9.369  -0.001
   73    HA   CYS  15           HA       CYS  15  -4.860  11.267  -2.068
   74   1HB   CYS  15          1HB       CYS  15  -3.388   8.963  -2.100
   75   2HB   CYS  15          2HB       CYS  15  -4.932   8.395  -2.723
   76    H    THR  16           H        THR  16  -6.900  11.806  -0.943
   77    HA   THR  16           HA       THR  16  -9.001   9.789  -1.258
   78    HB   THR  16           HB       THR  16  -9.184  12.486   0.090
   79    HG1  THR  16           HG1      THR  16  -8.128  11.604   1.651
   80   1HG2  THR  16          1HG2      THR  16 -10.981  10.091   0.057
   81   2HG2  THR  16          2HG2      THR  16 -11.371  11.772  -0.305
   82   3HG2  THR  16          3HG2      THR  16 -11.029  11.285   1.355
   83    H    GLY  17           H        GLY  17 -10.271   9.836  -2.983
   84   1HA   GLY  17          1HA       GLY  17 -11.325  10.569  -4.889
   85   2HA   GLY  17          2HA       GLY  17 -11.564  12.077  -4.009
   86    H    CYS  18           H        CYS  18  -8.574  10.532  -5.155
   87    HA   CYS  18           HA       CYS  18  -8.123  12.885  -6.872
   88   1HB   CYS  18          1HB       CYS  18  -6.650  12.211  -4.604
   89   2HB   CYS  18          2HB       CYS  18  -5.663  11.630  -5.948
   90    H    GLY  19           H        GLY  19  -7.838  12.402  -8.946
   91   1HA   GLY  19          1HA       GLY  19  -7.978   9.834  -9.996
   92   2HA   GLY  19          2HA       GLY  19  -7.361  11.237 -10.866
   93    H    ASN  20           H        ASN  20  -5.159  11.646  -8.964
   94    HA   ASN  20           HA       ASN  20  -3.519   9.274  -9.553
   95   1HB   ASN  20          1HB       ASN  20  -3.225  11.415 -11.063
   96   2HB   ASN  20          2HB       ASN  20  -2.299  12.003  -9.686
   97   1HD2  ASN  20          1HD2      ASN  20  -2.414   9.797 -12.326
   98   2HD2  ASN  20          2HD2      ASN  20  -0.800   9.198 -12.175
   99    H    CYS  21           H        CYS  21  -1.321   9.501  -8.331
  100    HA   CYS  21           HA       CYS  21  -1.686  10.766  -5.721
  101   1HB   CYS  21          1HB       CYS  21  -1.012   7.844  -6.112
  102   2HB   CYS  21          2HB       CYS  21  -0.927   8.698  -4.570
  103    HA   PRO  22           HA       PRO  22   2.570  11.704  -6.598
  104   1HB   PRO  22          1HB       PRO  22   3.144  13.030  -4.299
  105   2HB   PRO  22          2HB       PRO  22   2.206  13.736  -5.614
  106   1HG   PRO  22          1HG       PRO  22   1.294  12.655  -3.005
  107   2HG   PRO  22          2HG       PRO  22   0.626  13.975  -3.975
  108   1HD   PRO  22          1HD       PRO  22  -0.394  11.390  -3.829
  109   2HD   PRO  22          2HD       PRO  22  -0.767  12.578  -5.090
  110    H    ASN  23           H        ASN  23   2.580  11.311  -3.075
  111    HA   ASN  23           HA       ASN  23   4.050   8.797  -3.326
  112   1HB   ASN  23          1HB       ASN  23   5.149  10.790  -1.395
  113   2HB   ASN  23          2HB       ASN  23   5.969   9.482  -2.251
  114   1HD2  ASN  23          1HD2      ASN  23   4.379  12.589  -2.810
  115   2HD2  ASN  23          2HD2      ASN  23   5.444  13.107  -4.069
  116    H    ALA  24           H        ALA  24   1.394   9.784  -2.340
  117    HA   ALA  24           HA       ALA  24   1.138   9.846   0.390
  118   1HB   ALA  24          1HB       ALA  24  -0.616   9.952  -1.586
  119   2HB   ALA  24          2HB       ALA  24  -1.100   9.553   0.063
  120   3HB   ALA  24          3HB       ALA  24  -0.872   8.270  -1.125
  121    H    VAL  25           H        VAL  25   0.569   8.289   1.973
  122    HA   VAL  25           HA       VAL  25   1.858   5.694   1.507
  123    HB   VAL  25           HB       VAL  25   2.751   7.013   3.371
  124   1HG1  VAL  25          1HG1      VAL  25   1.234   7.153   5.441
  125   2HG1  VAL  25          2HG1      VAL  25  -0.098   6.941   4.303
  126   3HG1  VAL  25          3HG1      VAL  25   0.986   8.323   4.145
  127   1HG2  VAL  25          1HG2      VAL  25   1.365   4.829   4.804
  128   2HG2  VAL  25          2HG2      VAL  25   3.085   5.204   4.693
  129   3HG2  VAL  25          3HG2      VAL  25   2.275   4.376   3.363
  130    H    THR  26           H        THR  26  -1.187   7.179   2.337
  131    HA   THR  26           HA       THR  26  -2.481   4.578   2.091
  132    HB   THR  26           HB       THR  26  -3.548   6.231   4.297
  133    HG1  THR  26           HG1      THR  26  -1.914   5.996   5.612
  134   1HG2  THR  26          1HG2      THR  26  -4.362   4.302   5.077
  135   2HG2  THR  26          2HG2      THR  26  -2.875   3.415   4.739
  136   3HG2  THR  26          3HG2      THR  26  -4.037   3.715   3.446
  137    H    CYS  27           H        CYS  27  -4.493   4.672   1.180
  138    HA   CYS  27           HA       CYS  27  -5.798   7.265   0.898
  139   1HB   CYS  27          1HB       CYS  27  -6.140   6.698  -1.597
  140   2HB   CYS  27          2HB       CYS  27  -4.582   7.355  -1.097
  141    H    THR  28           H        THR  28  -7.984   7.175   0.666
  142    HA   THR  28           HA       THR  28  -9.207   4.533   1.009
  143    HB   THR  28           HB       THR  28 -10.624   7.181   1.256
  144    HG1  THR  28           HG1      THR  28 -10.080   7.089   3.486
  145   1HG2  THR  28          1HG2      THR  28 -11.484   4.551   1.561
  146   2HG2  THR  28          2HG2      THR  28 -12.331   6.022   2.044
  147   3HG2  THR  28          3HG2      THR  28 -11.300   5.178   3.199
  148    H    ASN  29           H        ASN  29  -9.309   3.757  -1.093
  149    HA   ASN  29           HA       ASN  29 -10.287   3.366  -3.065
  150   1HB   ASN  29          1HB       ASN  29 -11.867   5.925  -2.765
  151   2HB   ASN  29          2HB       ASN  29 -12.281   4.494  -3.711
  152   1HD2  ASN  29          1HD2      ASN  29 -12.439   6.036  -0.666
  153   2HD2  ASN  29          2HD2      ASN  29 -13.329   4.810   0.164
  154    H    SER  30           H        SER  30 -11.077   5.570  -4.825
  155    HA   SER  30           HA       SER  30 -10.216   7.180  -6.232
  156   1HB   SER  30          1HB       SER  30  -8.683   7.591  -3.985
  157   2HB   SER  30          2HB       SER  30  -7.463   7.202  -5.197
  158    HG   SER  30           HG       SER  30  -7.958   8.970  -6.294
  159    H    GLN  31           H        GLN  31  -7.545   7.278  -7.259
  160    HA   GLN  31           HA       GLN  31  -7.077   4.572  -8.264
  161   1HB   GLN  31          1HB       GLN  31  -6.760   5.774 -10.585
  162   2HB   GLN  31          2HB       GLN  31  -8.353   5.233 -10.060
  163   1HG   GLN  31          1HG       GLN  31  -7.731   7.939  -9.189
  164   2HG   GLN  31          2HG       GLN  31  -7.696   7.750 -10.942
  165   1HE2  GLN  31          1HE2      GLN  31  -9.637   5.944 -11.416
  166   2HE2  GLN  31          2HE2      GLN  31 -11.174   6.559 -10.924
  167    H    HIS  32           H        HIS  32  -5.022   4.418  -9.499
  168    HA   HIS  32           HA       HIS  32  -2.776   4.707  -9.687
  169   1HB   HIS  32          1HB       HIS  32  -3.793   7.120 -10.300
  170   2HB   HIS  32          2HB       HIS  32  -2.842   7.559  -8.878
  171    HD1  HIS  32           HD1      HIS  32  -0.229   7.007  -9.034
  172    HD2  HIS  32           HD2      HIS  32  -2.351   6.783 -12.598
  173    HE1  HIS  32           HE1      HIS  32   1.506   7.055 -10.852
  174    HE2  HIS  32           HE2      HIS  32   0.189   7.047 -13.001
  175    H    CYS  33           H        CYS  33  -3.814   3.859  -7.179
  176    HA   CYS  33           HA       CYS  33  -2.079   5.183  -5.220
  177   1HB   CYS  33          1HB       CYS  33  -4.527   3.499  -5.058
  178   2HB   CYS  33          2HB       CYS  33  -3.367   3.357  -3.736
  179    H    VAL  34           H        VAL  34  -0.963   3.573  -7.313
  180    HA   VAL  34           HA       VAL  34  -0.368   0.952  -6.673
  181    HB   VAL  34           HB       VAL  34   0.234   2.065  -8.807
  182   1HG1  VAL  34          1HG1      VAL  34   1.141   4.140  -7.858
  183   2HG1  VAL  34          2HG1      VAL  34   2.283   3.373  -8.961
  184   3HG1  VAL  34          3HG1      VAL  34   2.518   3.241  -7.216
  185   1HG2  VAL  34          1HG2      VAL  34   1.201  -0.050  -8.495
  186   2HG2  VAL  34          2HG2      VAL  34   2.330   0.550  -7.279
  187   3HG2  VAL  34          3HG2      VAL  34   2.543   0.990  -8.974
  188    H    LYS  35           H        LYS  35   1.220   3.909  -5.576
  189    HA   LYS  35           HA       LYS  35   3.050   2.329  -3.940
  190   1HB   LYS  35          1HB       LYS  35   4.394   4.252  -3.767
  191   2HB   LYS  35          2HB       LYS  35   3.820   4.247  -5.423
  192   1HG   LYS  35          1HG       LYS  35   1.906   5.746  -4.244
  193   2HG   LYS  35          2HG       LYS  35   3.306   6.154  -3.251
  194   1HD   LYS  35          1HD       LYS  35   4.012   7.534  -4.844
  195   2HD   LYS  35          2HD       LYS  35   4.161   6.166  -5.947
  196   1HE   LYS  35          1HE       LYS  35   1.547   7.572  -5.476
  197   2HE   LYS  35          2HE       LYS  35   2.697   8.115  -6.696
  198   1HZ   LYS  35          1HZ       LYS  35   1.478   6.711  -7.959
  199   2HZ   LYS  35          2HZ       LYS  35   1.015   5.733  -6.658
  200   3HZ   LYS  35          3HZ       LYS  35   2.556   5.564  -7.337
  201    H    ALA  36           H        ALA  36   0.258   2.446  -3.245
  202    HA   ALA  36           HA       ALA  36   0.323   4.033  -0.768
  203   1HB   ALA  36          1HB       ALA  36  -2.032   2.845  -2.234
  204   2HB   ALA  36          2HB       ALA  36  -1.560   4.544  -2.212
  205   3HB   ALA  36          3HB       ALA  36  -2.123   3.766  -0.733
  206    H    ASN  37           H        ASN  37   0.267   3.064   1.183
  207    HA   ASN  37           HA       ASN  37   0.900   0.342   1.446
  208   1HB   ASN  37          1HB       ASN  37   1.206   2.363   3.099
  209   2HB   ASN  37          2HB       ASN  37  -0.368   1.850   3.702
  210   1HD2  ASN  37          1HD2      ASN  37  -0.575  -0.221   4.621
  211   2HD2  ASN  37          2HD2      ASN  37   0.799  -1.066   5.240
  212    H    THR  38           H        THR  38  -2.146   2.070   2.060
  213    HA   THR  38           HA       THR  38  -3.559  -0.487   1.732
  214    HB   THR  38           HB       THR  38  -4.692   1.543   3.596
  215    HG1  THR  38           HG1      THR  38  -2.557  -0.204   4.243
  216   1HG2  THR  38          1HG2      THR  38  -4.556  -1.355   4.188
  217   2HG2  THR  38          2HG2      THR  38  -5.635  -0.819   2.899
  218   3HG2  THR  38          3HG2      THR  38  -5.827  -0.183   4.533
  219    H    CYS  39           H        CYS  39  -5.075  -0.422   0.212
  220    HA   CYS  39           HA       CYS  39  -6.366   2.138  -0.404
  221   1HB   CYS  39          1HB       CYS  39  -6.218   1.113  -2.895
  222   2HB   CYS  39          2HB       CYS  39  -5.028   2.238  -2.237
  223    H    THR  40           H        THR  40  -8.313   1.555   0.453
  224    HA   THR  40           HA       THR  40  -9.553  -0.947  -0.388
  225    HB   THR  40           HB       THR  40 -10.693   1.157   1.454
  226    HG1  THR  40           HG1      THR  40  -9.024  -1.053   2.040
  227   1HG2  THR  40          1HG2      THR  40 -11.231  -1.787   1.518
  228   2HG2  THR  40          2HG2      THR  40 -12.187  -0.684   0.529
  229   3HG2  THR  40          3HG2      THR  40 -12.134  -0.479   2.281
  230    H    GLY  41           H        GLY  41 -10.707  -0.987  -2.208
  231   1HA   GLY  41          1HA       GLY  41 -12.303  -0.375  -3.771
  232   2HA   GLY  41          2HA       GLY  41 -12.717   0.983  -2.738
  233    H    SER  42           H        SER  42  -9.746   0.039  -4.456
  234    HA   SER  42           HA       SER  42  -9.926   2.578  -5.911
  235   1HB   SER  42          1HB       SER  42  -8.243   2.316  -3.771
  236   2HB   SER  42          2HB       SER  42  -7.199   1.754  -5.075
  237    HG   SER  42           HG       SER  42  -6.887   3.801  -5.397
  238    H    THR  43           H        THR  43  -7.815   2.435  -7.539
  239    HA   THR  43           HA       THR  43  -7.629  -0.304  -8.486
  240    HB   THR  43           HB       THR  43  -8.395   0.010 -10.577
  241    HG1  THR  43           HG1      THR  43  -7.556   1.830 -11.373
  242   1HG2  THR  43          1HG2      THR  43 -10.580   1.296 -10.391
  243   2HG2  THR  43          2HG2      THR  43 -10.101   1.609  -8.718
  244   3HG2  THR  43          3HG2      THR  43 -10.316  -0.050  -9.282
  245    H    ASP  44           H        ASP  44  -5.667  -0.180  -7.742
  246    HA   ASP  44           HA       ASP  44  -3.506  -0.142  -9.236
  247   1HB   ASP  44          1HB       ASP  44  -4.285   2.680  -8.796
  248   2HB   ASP  44          2HB       ASP  44  -2.583   2.317  -8.526
  249    H    CYS  45           H        CYS  45  -2.798  -1.553  -7.669
  250    HA   CYS  45           HA       CYS  45  -1.613  -0.352  -5.305
  251   1HB   CYS  45          1HB       CYS  45  -3.624  -2.604  -5.108
  252   2HB   CYS  45          2HB       CYS  45  -2.671  -1.956  -3.769
  253    H    ASN  46           H        ASN  46   0.216  -0.997  -6.737
  254    HA   ASN  46           HA       ASN  46   0.758  -3.830  -6.956
  255   1HB   ASN  46          1HB       ASN  46   1.418  -2.237  -8.745
  256   2HB   ASN  46          2HB       ASN  46   2.550  -1.484  -7.617
  257   1HD2  ASN  46          1HD2      ASN  46   2.477  -3.415 -10.152
  258   2HD2  ASN  46          2HD2      ASN  46   3.809  -4.463  -9.814
  259    H    THR  47           H        THR  47   1.650  -1.172  -4.880
  260    HA   THR  47           HA       THR  47   3.629  -2.860  -3.519
  261    HB   THR  47           HB       THR  47   4.520  -0.877  -2.550
  262    HG1  THR  47           HG1      THR  47   2.964   0.440  -1.963
  263   1HG2  THR  47          1HG2      THR  47   5.325  -0.969  -4.742
  264   2HG2  THR  47          2HG2      THR  47   4.779   0.694  -4.523
  265   3HG2  THR  47          3HG2      THR  47   3.783  -0.451  -5.423
  266    H    ALA  48           H        ALA  48   0.493  -1.440  -3.143
  267    HA   ALA  48           HA       ALA  48   0.213  -1.298  -0.395
  268   1HB   ALA  48          1HB       ALA  48  -1.983  -0.979  -0.797
  269   2HB   ALA  48          2HB       ALA  48  -2.105  -2.383  -1.857
  270   3HB   ALA  48          3HB       ALA  48  -1.438  -0.868  -2.471
  271    H    GLN  49           H        GLN  49  -0.258  -2.715   1.232
  272    HA   GLN  49           HA       GLN  49   0.341  -5.500   0.728
  273   1HB   GLN  49          1HB       GLN  49   0.296  -5.745   3.151
  274   2HB   GLN  49          2HB       GLN  49   1.276  -4.359   2.693
  275   1HG   GLN  49          1HG       GLN  49   0.080  -3.517   4.455
  276   2HG   GLN  49          2HG       GLN  49  -0.913  -3.017   3.087
  277   1HE2  GLN  49          1HE2      GLN  49  -2.676  -2.860   4.553
  278   2HE2  GLN  49          2HE2      GLN  49  -3.535  -4.274   5.051
  279    H    THR  50           H        THR  50  -2.412  -3.750   0.420
  280    HA   THR  50           HA       THR  50  -4.087  -5.980   0.213
  281    HB   THR  50           HB       THR  50  -3.779  -5.670   2.779
  282    HG1  THR  50           HG1      THR  50  -6.390  -5.817   1.684
  283   1HG2  THR  50          1HG2      THR  50  -4.350  -3.203   2.648
  284   2HG2  THR  50          2HG2      THR  50  -5.161  -4.156   3.894
  285   3HG2  THR  50          3HG2      THR  50  -6.020  -3.723   2.414
  286    H    CYS  51           H        CYS  51  -6.315  -5.385  -0.315
  287    HA   CYS  51           HA       CYS  51  -7.235  -2.755  -0.508
  288   1HB   CYS  51          1HB       CYS  51  -7.045  -2.807  -3.181
  289   2HB   CYS  51          2HB       CYS  51  -5.831  -2.039  -2.156
  290    H    THR  52           H        THR  52  -9.102  -2.575  -2.114
  291    HA   THR  52           HA       THR  52 -10.326  -5.143  -2.758
  292    HB   THR  52           HB       THR  52 -11.065  -4.552  -0.448
  293    HG1  THR  52           HG1      THR  52 -12.417  -5.689  -2.016
  294   1HG2  THR  52          1HG2      THR  52 -11.104  -2.122  -0.627
  295   2HG2  THR  52          2HG2      THR  52 -12.664  -2.763  -0.114
  296   3HG2  THR  52          3HG2      THR  52 -12.435  -2.229  -1.779
  297    H    ASN  53           H        ASN  53 -11.736  -5.057  -4.478
  298    HA   ASN  53           HA       ASN  53 -12.626  -4.265  -6.418
  299   1HB   ASN  53          1HB       ASN  53 -13.120  -2.035  -4.486
  300   2HB   ASN  53          2HB       ASN  53 -13.458  -1.767  -6.199
  301   1HD2  ASN  53          1HD2      ASN  53 -14.121  -3.973  -3.520
  302   2HD2  ASN  53          2HD2      ASN  53 -15.709  -4.409  -4.040
  303    H    SER  54           H        SER  54  -9.818  -4.159  -6.151
  304    HA   SER  54           HA       SER  54  -9.112  -1.691  -7.597
  305   1HB   SER  54          1HB       SER  54  -7.876  -2.951  -5.416
  306   2HB   SER  54          2HB       SER  54  -6.835  -3.301  -6.801
  307    HG   SER  54           HG       SER  54  -6.121  -1.369  -6.254
  308    H    LYS  55           H        LYS  55  -6.948  -2.286  -8.986
  309    HA   LYS  55           HA       LYS  55  -7.532  -4.719 -10.527
  310   1HB   LYS  55          1HB       LYS  55  -7.552  -1.904 -11.457
  311   2HB   LYS  55          2HB       LYS  55  -6.823  -3.090 -12.533
  312   1HG   LYS  55          1HG       LYS  55  -9.099  -4.374 -11.931
  313   2HG   LYS  55          2HG       LYS  55  -9.643  -2.703 -11.770
  314   1HD   LYS  55          1HD       LYS  55  -8.629  -2.280 -14.042
  315   2HD   LYS  55          2HD       LYS  55  -8.421  -4.027 -14.183
  316   1HE   LYS  55          1HE       LYS  55 -10.464  -3.383 -15.283
  317   2HE   LYS  55          2HE       LYS  55 -10.854  -4.304 -13.831
  318   1HZ   LYS  55          1HZ       LYS  55 -11.635  -2.446 -12.754
  319   2HZ   LYS  55          2HZ       LYS  55 -12.120  -2.125 -14.343
  320   3HZ   LYS  55          3HZ       LYS  55 -10.749  -1.366 -13.709
  321    H    ASP  56           H        ASP  56  -5.330  -3.639  -8.625
  322    HA   ASP  56           HA       ASP  56  -3.161  -4.747 -10.191
  323   1HB   ASP  56          1HB       ASP  56  -3.390  -1.897  -9.644
  324   2HB   ASP  56          2HB       ASP  56  -1.868  -2.578  -9.062
  325    H    CYS  57           H        CYS  57  -4.757  -5.294  -7.684
  326    HA   CYS  57           HA       CYS  57  -3.009  -5.005  -5.463
  327   1HB   CYS  57          1HB       CYS  57  -5.377  -6.821  -5.949
  328   2HB   CYS  57          2HB       CYS  57  -4.538  -6.703  -4.403
  329    H    PHE  58           H        PHE  58  -1.209  -5.901  -7.116
  330    HA   PHE  58           HA       PHE  58  -0.965  -8.649  -7.541
  331   1HB   PHE  58          1HB       PHE  58   1.183  -6.551  -7.250
  332   2HB   PHE  58          2HB       PHE  58   1.450  -8.171  -7.866
  333    HD1  PHE  58           HD1      PHE  58   1.222  -4.963  -8.799
  334    HD2  PHE  58           HD2      PHE  58  -0.472  -8.749  -9.731
  335    HE1  PHE  58           HE1      PHE  58   0.717  -4.173 -11.066
  336    HE2  PHE  58           HE2      PHE  58  -0.983  -7.964 -12.002
  337    HZ   PHE  58           HZ       PHE  58  -0.373  -5.685 -12.638
  338    H    GLU  59           H        GLU  59   0.870  -6.745  -5.133
  339    HA   GLU  59           HA       GLU  59   1.291  -9.197  -3.603
  340   1HB   GLU  59          1HB       GLU  59   3.027  -8.020  -2.438
  341   2HB   GLU  59          2HB       GLU  59   3.218  -7.710  -4.163
  342   1HG   GLU  59          1HG       GLU  59   3.277  -5.552  -3.702
  343   2HG   GLU  59          2HG       GLU  59   1.584  -5.653  -3.220
  344    H    ALA  60           H        ALA  60  -1.320  -8.217  -3.555
  345    HA   ALA  60           HA       ALA  60  -1.646  -6.820  -1.020
  346   1HB   ALA  60          1HB       ALA  60  -3.029  -6.157  -2.928
  347   2HB   ALA  60          2HB       ALA  60  -4.011  -6.743  -1.585
  348   3HB   ALA  60          3HB       ALA  60  -3.723  -7.777  -2.983
  349    H    ASN  61           H        ASN  61  -2.460  -7.703   0.823
  350    HA   ASN  61           HA       ASN  61  -2.317 -10.558   1.094
  351   1HB   ASN  61          1HB       ASN  61  -3.086  -8.378   3.044
  352   2HB   ASN  61          2HB       ASN  61  -2.967 -10.081   3.474
  353   1HD2  ASN  61          1HD2      ASN  61  -0.755 -10.936   2.265
  354   2HD2  ASN  61          2HD2      ASN  61   0.634 -10.073   2.818
  355    H    THR  62           H        THR  62  -4.864  -8.151   0.906
  356    HA   THR  62           HA       THR  62  -6.825 -10.334   0.716
  357    HB   THR  62           HB       THR  62  -7.321  -7.727   2.163
  358    HG1  THR  62           HG1      THR  62  -6.284  -8.704   3.703
  359   1HG2  THR  62          1HG2      THR  62  -9.004 -10.123   1.620
  360   2HG2  THR  62          2HG2      THR  62  -9.421  -8.410   1.544
  361   3HG2  THR  62          3HG2      THR  62  -9.232  -9.205   3.109
  362    H    CYS  63           H        CYS  63  -8.200 -10.174  -0.962
  363    HA   CYS  63           HA       CYS  63  -8.709  -7.596  -2.200
  364   1HB   CYS  63          1HB       CYS  63  -8.221  -8.905  -4.486
  365   2HB   CYS  63          2HB       CYS  63  -6.990  -7.954  -3.654
  366    H    THR  64           H        THR  64 -10.831  -7.510  -2.385
  367    HA   THR  64           HA       THR  64 -12.286  -9.955  -3.155
  368    HB   THR  64           HB       THR  64 -14.184  -8.355  -1.978
  369    HG1  THR  64           HG1      THR  64 -13.198  -7.007  -0.734
  370   1HG2  THR  64          1HG2      THR  64 -13.127  -9.885   0.121
  371   2HG2  THR  64          2HG2      THR  64 -12.871 -10.810  -1.359
  372   3HG2  THR  64          3HG2      THR  64 -14.494 -10.269  -0.926
  373    H    ASP  65           H        ASP  65 -13.555  -9.857  -4.914
  374    HA   ASP  65           HA       ASP  65 -14.543  -9.070  -6.806
  375   1HB   ASP  65          1HB       ASP  65 -14.958  -6.783  -4.905
  376   2HB   ASP  65          2HB       ASP  65 -15.444  -6.629  -6.596
  377    H    SER  66           H        SER  66 -11.698  -8.883  -6.555
  378    HA   SER  66           HA       SER  66 -11.213  -6.725  -8.484
  379   1HB   SER  66          1HB       SER  66  -9.146  -6.095  -7.406
  380   2HB   SER  66          2HB       SER  66 -10.445  -6.018  -6.209
  381    HG   SER  66           HG       SER  66  -9.530  -7.573  -5.124
  382    H    THR  67           H        THR  67  -8.813  -7.043  -9.336
  383    HA   THR  67           HA       THR  67  -8.369  -9.908  -9.828
  384    HB   THR  67           HB       THR  67  -9.415  -9.198 -11.811
  385    HG1  THR  67           HG1      THR  67  -6.677  -8.785 -12.382
  386   1HG2  THR  67          1HG2      THR  67  -9.102  -7.208 -12.971
  387   2HG2  THR  67          2HG2      THR  67  -7.606  -6.836 -12.113
  388   3HG2  THR  67          3HG2      THR  67  -9.155  -6.723 -11.277
  389    H    ASN  68           H        ASN  68  -6.147 -10.294 -10.831
  390    HA   ASN  68           HA       ASN  68  -3.877 -10.151 -10.685
  391   1HB   ASN  68          1HB       ASN  68  -4.289  -7.204 -10.140
  392   2HB   ASN  68          2HB       ASN  68  -2.825  -7.983 -10.748
  393   1HD2  ASN  68          1HD2      ASN  68  -3.577  -9.538 -12.722
  394   2HD2  ASN  68          2HD2      ASN  68  -4.389  -8.660 -13.968
  395    H    CYS  69           H        CYS  69  -4.053 -11.415  -8.744
  396    HA   CYS  69           HA       CYS  69  -2.964 -10.026  -6.432
  397   1HB   CYS  69          1HB       CYS  69  -5.692 -10.713  -6.564
  398   2HB   CYS  69          2HB       CYS  69  -4.949 -11.917  -5.513
  399    H    TYR  70           H        TYR  70  -1.249 -11.411  -7.692
  400    HA   TYR  70           HA       TYR  70  -1.386 -14.236  -7.092
  401   1HB   TYR  70          1HB       TYR  70   0.743 -14.427  -8.236
  402   2HB   TYR  70          2HB       TYR  70  -0.365 -13.445  -9.193
  403    HD1  TYR  70           HD1      TYR  70  -0.016 -10.983  -9.335
  404    HD2  TYR  70           HD2      TYR  70   2.788 -13.540  -7.406
  405    HE1  TYR  70           HE1      TYR  70   1.693  -9.225  -9.493
  406    HE2  TYR  70           HE2      TYR  70   4.499 -11.782  -7.552
  407    HH   TYR  70           HH       TYR  70   3.918  -8.681  -8.042
  408    H    LYS  71           H        LYS  71  -1.611 -13.013  -4.744
  409    HA   LYS  71           HA       LYS  71   0.278 -14.182  -3.116
  410   1HB   LYS  71          1HB       LYS  71   1.867 -12.528  -4.048
  411   2HB   LYS  71          2HB       LYS  71   0.825 -11.224  -3.482
  412   1HG   LYS  71          1HG       LYS  71   2.083 -11.221  -1.650
  413   2HG   LYS  71          2HG       LYS  71   1.245 -12.709  -1.207
  414   1HD   LYS  71          1HD       LYS  71   3.057 -13.981  -1.583
  415   2HD   LYS  71          2HD       LYS  71   3.484 -13.103  -3.053
  416   1HE   LYS  71          1HE       LYS  71   5.208 -12.860  -1.340
  417   2HE   LYS  71          2HE       LYS  71   4.453 -11.312  -1.714
  418   1HZ   LYS  71          1HZ       LYS  71   2.964 -11.829   0.277
  419   2HZ   LYS  71          2HZ       LYS  71   4.556 -11.353   0.590
  420   3HZ   LYS  71          3HZ       LYS  71   4.127 -12.986   0.696
  421    H    ALA  72           H        ALA  72  -2.447 -13.977  -3.093
  422    HA   ALA  72           HA       ALA  72  -2.955 -12.292  -0.722
  423   1HB   ALA  72          1HB       ALA  72  -4.114 -11.811  -3.052
  424   2HB   ALA  72          2HB       ALA  72  -4.972 -11.605  -1.526
  425   3HB   ALA  72          3HB       ALA  72  -5.215 -13.065  -2.484
  426    H    THR  73           H        THR  73  -4.838 -13.076   0.595
  427    HA   THR  73           HA       THR  73  -4.644 -15.992   0.895
  428    HB   THR  73           HB       THR  73  -3.962 -14.874   2.887
  429    HG1  THR  73           HG1      THR  73  -5.616 -15.543   4.346
  430   1HG2  THR  73          1HG2      THR  73  -4.644 -12.820   3.328
  431   2HG2  THR  73          2HG2      THR  73  -6.171 -13.512   3.874
  432   3HG2  THR  73          3HG2      THR  73  -5.998 -12.962   2.208
  433    H    ALA  74           H        ALA  74  -6.885 -13.338   0.484
  434    HA   ALA  74           HA       ALA  74  -9.144 -15.219   0.480
  435   1HB   ALA  74          1HB       ALA  74 -10.427 -12.929   0.380
  436   2HB   ALA  74          2HB       ALA  74  -8.906 -12.297   1.010
  437   3HB   ALA  74          3HB       ALA  74  -9.783 -13.538   1.905
  438    H    CYS  75           H        CYS  75  -9.805 -15.922  -1.439
  439    HA   CYS  75           HA       CYS  75  -9.571 -14.110  -3.748
  440   1HB   CYS  75          1HB       CYS  75  -8.817 -17.009  -3.515
  441   2HB   CYS  75          2HB       CYS  75  -9.282 -16.333  -5.079
  442    H    THR  76           H        THR  76 -11.709 -13.475  -3.650
  443    HA   THR  76           HA       THR  76 -13.723 -15.583  -4.053
  444    HB   THR  76           HB       THR  76 -15.286 -13.540  -3.482
  445    HG1  THR  76           HG1      THR  76 -14.080 -11.854  -3.109
  446   1HG2  THR  76          1HG2      THR  76 -13.881 -14.352  -1.036
  447   2HG2  THR  76          2HG2      THR  76 -14.500 -15.666  -2.036
  448   3HG2  THR  76          3HG2      THR  76 -15.596 -14.416  -1.444
  449    H    ASN  77           H        ASN  77 -13.302 -15.751  -6.299
  450    HA   ASN  77           HA       ASN  77 -13.730 -15.327  -8.494
  451   1HB   ASN  77          1HB       ASN  77 -15.442 -13.017  -7.560
  452   2HB   ASN  77          2HB       ASN  77 -15.558 -13.893  -9.089
  453   1HD2  ASN  77          1HD2      ASN  77 -17.541 -13.422  -6.973
  454   2HD2  ASN  77          2HD2      ASN  77 -18.097 -14.988  -6.501
  455    H    SER  78           H        SER  78 -11.423 -14.225  -7.322
  456    HA   SER  78           HA       SER  78 -11.151 -11.670  -8.758
  457   1HB   SER  78          1HB       SER  78 -10.673 -11.226  -6.494
  458   2HB   SER  78          2HB       SER  78  -9.782 -12.739  -6.296
  459    HG   SER  78           HG       SER  78  -8.909 -10.305  -7.153
  460    H    SER  79           H        SER  79  -9.531 -11.397 -10.235
  461    HA   SER  79           HA       SER  79  -8.319 -13.806 -11.263
  462   1HB   SER  79          1HB       SER  79  -8.815 -12.624 -13.114
  463   2HB   SER  79          2HB       SER  79  -8.826 -11.091 -12.246
  464    HG   SER  79           HG       SER  79  -7.114 -11.031 -13.647
  465    H    GLY  80           H        GLY  80  -5.973 -13.611 -12.048
  466   1HA   GLY  80          1HA       GLY  80  -3.746 -13.475 -11.506
  467   2HA   GLY  80          2HA       GLY  80  -4.141 -11.986 -10.660
  468    H    CYS  81           H        CYS  81  -6.022 -14.496  -9.458
  469    HA   CYS  81           HA       CYS  81  -4.028 -15.356  -7.512
  470   1HB   CYS  81          1HB       CYS  81  -4.943 -14.385  -5.662
  471   2HB   CYS  81          2HB       CYS  81  -5.412 -13.174  -6.856
  472    HA   PRO  82           HA       PRO  82  -5.838 -19.344  -7.208
  473   1HB   PRO  82          1HB       PRO  82  -6.729 -18.590  -4.451
  474   2HB   PRO  82          2HB       PRO  82  -5.916 -20.063  -5.007
  475   1HG   PRO  82          1HG       PRO  82  -4.565 -18.116  -3.756
  476   2HG   PRO  82          2HG       PRO  82  -3.839 -19.050  -5.075
  477   1HD   PRO  82          1HD       PRO  82  -4.769 -16.247  -5.043
  478   2HD   PRO  82          2HD       PRO  82  -3.564 -17.026  -6.083
  479    H    GLY  83           H        GLY  83  -7.890 -20.490  -6.970
  480   1HA   GLY  83          1HA       GLY  83 -10.282 -20.370  -6.518
  481   2HA   GLY  83          2HA       GLY  83 -10.228 -18.687  -7.018
  482    H    HIS  84           H        HIS  84  -9.516 -21.938  -8.292
  483    HA   HIS  84           HA       HIS  84  -9.928 -22.898 -10.311
  484   1HB   HIS  84          1HB       HIS  84 -12.263 -22.205  -9.792
  485   2HB   HIS  84          2HB       HIS  84 -11.972 -20.692 -10.643
  486    HD1  HIS  84           HD1      HIS  84 -12.568 -20.693 -13.047
  487    HD2  HIS  84           HD2      HIS  84 -11.937 -24.537 -11.602
  488    HE1  HIS  84           HE1      HIS  84 -13.146 -22.229 -14.951
  489    HE2  HIS  84           HE2      HIS  84 -12.859 -24.552 -14.019
  Start of MODEL    7
    1   1H    GLN   1          1H        GLN   1 -12.171  13.481   1.931
    2   2H    GLN   1          2H        GLN   1 -12.746  15.078   1.678
    3   3H    GLN   1          3H        GLN   1 -12.675  14.431   3.265
    4    HA   GLN   1           HA       GLN   1 -10.881  15.831   3.116
    5   1HB   GLN   1          1HB       GLN   1 -10.409  13.638   4.093
    6   2HB   GLN   1          2HB       GLN   1 -10.009  12.998   2.506
    7   1HG   GLN   1          1HG       GLN   1  -7.903  13.472   3.036
    8   2HG   GLN   1          2HG       GLN   1  -8.335  15.148   2.699
    9   1HE2  GLN   1          1HE2      GLN   1  -6.342  15.052   4.282
   10   2HE2  GLN   1          2HE2      GLN   1  -6.753  15.278   5.944
   11    H    CYS   2           H        CYS   2 -10.235  13.448   0.542
   12    HA   CYS   2           HA       CYS   2  -9.498  15.675  -1.235
   13   1HB   CYS   2          1HB       CYS   2  -7.983  13.078  -1.260
   14   2HB   CYS   2          2HB       CYS   2  -7.510  14.634  -1.930
   15    H    THR   3           H        THR   3 -11.954  14.147  -1.069
   16    HA   THR   3           HA       THR   3 -11.880  12.370  -3.370
   17    HB   THR   3           HB       THR   3 -13.196  11.682  -1.438
   18    HG1  THR   3           HG1      THR   3 -14.840  12.407  -3.631
   19   1HG2  THR   3          1HG2      THR   3 -13.980  14.345  -1.268
   20   2HG2  THR   3          2HG2      THR   3 -14.543  12.995  -0.281
   21   3HG2  THR   3          3HG2      THR   3 -15.432  13.459  -1.732
   22    H    GLY   4           H        GLY   4 -11.349  13.968  -4.956
   23   1HA   GLY   4          1HA       GLY   4 -13.739  15.305  -5.979
   24   2HA   GLY   4          2HA       GLY   4 -12.338  16.320  -5.642
   25    H    GLY   5           H        GLY   5 -13.688  13.869  -7.719
   26   1HA   GLY   5          1HA       GLY   5 -13.229  13.533  -9.972
   27   2HA   GLY   5          2HA       GLY   5 -11.889  14.662  -9.838
   28    H    ALA   6           H        ALA   6 -10.322  13.470 -10.817
   29    HA   ALA   6           HA       ALA   6  -9.518  11.010  -9.416
   30   1HB   ALA   6          1HB       ALA   6 -10.272  10.001 -11.312
   31   2HB   ALA   6          2HB       ALA   6  -8.640  10.403 -11.846
   32   3HB   ALA   6          3HB       ALA   6  -9.999  11.427 -12.314
   33    H    ASP   7           H        ASP   7  -8.530  13.588  -8.886
   34    HA   ASP   7           HA       ASP   7  -5.724  13.132  -9.340
   35   1HB   ASP   7          1HB       ASP   7  -7.210  15.272 -10.783
   36   2HB   ASP   7          2HB       ASP   7  -5.616  15.677 -10.140
   37    H    CYS   8           H        CYS   8  -5.306  13.140  -7.190
   38    HA   CYS   8           HA       CYS   8  -6.466  14.946  -5.342
   39   1HB   CYS   8          1HB       CYS   8  -4.413  12.834  -5.287
   40   2HB   CYS   8          2HB       CYS   8  -4.177  14.113  -4.093
   41    H    THR   9           H        THR   9  -2.955  14.723  -5.703
   42    HA   THR   9           HA       THR   9  -1.329  16.291  -5.950
   43    HB   THR   9           HB       THR   9  -3.478  18.128  -7.013
   44    HG1  THR   9           HG1      THR   9  -2.949  17.247  -9.041
   45   1HG2  THR   9          1HG2      THR   9  -1.166  18.429  -8.495
   46   2HG2  THR   9          2HG2      THR   9  -0.605  18.322  -6.826
   47   3HG2  THR   9          3HG2      THR   9  -1.796  19.541  -7.280
   48    H    SER  10           H        SER  10  -4.211  18.228  -5.117
   49    HA   SER  10           HA       SER  10  -3.068  20.123  -3.536
   50   1HB   SER  10          1HB       SER  10  -5.505  19.928  -4.184
   51   2HB   SER  10          2HB       SER  10  -5.696  18.808  -2.835
   52    HG   SER  10           HG       SER  10  -6.211  20.878  -2.145
   53    H    CYS  11           H        CYS  11  -4.292  16.985  -2.361
   54    HA   CYS  11           HA       CYS  11  -3.290  17.425   0.288
   55   1HB   CYS  11          1HB       CYS  11  -4.258  14.866  -1.003
   56   2HB   CYS  11          2HB       CYS  11  -4.018  15.128   0.721
   57    H    THR  12           H        THR  12  -1.670  16.121   1.349
   58    HA   THR  12           HA       THR  12   0.256  14.792  -0.396
   59    HB   THR  12           HB       THR  12   2.104  16.048   0.882
   60    HG1  THR  12           HG1      THR  12   1.497  17.574   2.162
   61   1HG2  THR  12          1HG2      THR  12   2.363  17.006  -1.088
   62   2HG2  THR  12          2HG2      THR  12   1.188  18.232  -0.612
   63   3HG2  THR  12          3HG2      THR  12   0.655  16.785  -1.465
   64    H    GLY  13           H        GLY  13  -1.670  14.033   1.755
   65   1HA   GLY  13          1HA       GLY  13   0.284  12.639   3.465
   66   2HA   GLY  13          2HA       GLY  13  -1.129  13.406   4.173
   67    H    ALA  14           H        ALA  14  -3.260  12.677   3.219
   68    HA   ALA  14           HA       ALA  14  -3.157   9.774   2.709
   69   1HB   ALA  14          1HB       ALA  14  -4.231  10.914   4.905
   70   2HB   ALA  14          2HB       ALA  14  -4.799   9.395   4.212
   71   3HB   ALA  14          3HB       ALA  14  -5.636  10.902   3.840
   72    H    CYS  15           H        CYS  15  -4.088   9.059   0.893
   73    HA   CYS  15           HA       CYS  15  -5.338  10.984  -0.876
   74   1HB   CYS  15          1HB       CYS  15  -3.785   8.657  -1.222
   75   2HB   CYS  15          2HB       CYS  15  -5.364   8.294  -1.909
   76    H    THR  16           H        THR  16  -7.430  10.988  -1.551
   77    HA   THR  16           HA       THR  16  -9.247   9.061  -0.260
   78    HB   THR  16           HB       THR  16 -10.327  11.711  -1.014
   79    HG1  THR  16           HG1      THR  16  -8.634  11.425   1.241
   80   1HG2  THR  16          1HG2      THR  16 -11.686  11.482   0.830
   81   2HG2  THR  16          2HG2      THR  16 -10.554  10.416   1.663
   82   3HG2  THR  16          3HG2      THR  16 -11.489   9.814   0.294
   83    H    GLY  17           H        GLY  17 -11.527  10.325  -1.738
   84   1HA   GLY  17          1HA       GLY  17 -11.480   8.623  -4.005
   85   2HA   GLY  17          2HA       GLY  17 -12.706   9.837  -3.646
   86    H    CYS  18           H        CYS  18  -9.341   9.593  -4.795
   87    HA   CYS  18           HA       CYS  18  -9.990  11.613  -6.825
   88   1HB   CYS  18          1HB       CYS  18  -7.764  12.636  -6.517
   89   2HB   CYS  18          2HB       CYS  18  -8.743  12.739  -5.053
   90    H    GLY  19           H        GLY  19  -6.866  11.231  -7.398
   91   1HA   GLY  19          1HA       GLY  19  -7.151   8.621  -8.733
   92   2HA   GLY  19          2HA       GLY  19  -6.626  10.029  -9.647
   93    H    ASN  20           H        ASN  20  -4.604  11.076  -8.935
   94    HA   ASN  20           HA       ASN  20  -2.726   9.055  -7.911
   95   1HB   ASN  20          1HB       ASN  20  -2.297   9.778 -10.219
   96   2HB   ASN  20          2HB       ASN  20  -2.186  11.450  -9.679
   97   1HD2  ASN  20          1HD2      ASN  20  -0.884   8.423  -8.373
   98   2HD2  ASN  20          2HD2      ASN  20   0.767   8.930  -8.380
   99    H    CYS  21           H        CYS  21  -1.201   9.588  -6.373
  100    HA   CYS  21           HA       CYS  21  -1.699  12.110  -4.936
  101   1HB   CYS  21          1HB       CYS  21  -1.578   9.369  -4.033
  102   2HB   CYS  21          2HB       CYS  21  -0.351  10.336  -3.213
  103    HA   PRO  22           HA       PRO  22   2.539  13.167  -5.473
  104   1HB   PRO  22          1HB       PRO  22   3.109  14.524  -3.194
  105   2HB   PRO  22          2HB       PRO  22   2.070  15.165  -4.467
  106   1HG   PRO  22          1HG       PRO  22   1.346  14.035  -1.824
  107   2HG   PRO  22          2HG       PRO  22   0.534  15.284  -2.776
  108   1HD   PRO  22          1HD       PRO  22  -0.244  12.608  -2.569
  109   2HD   PRO  22          2HD       PRO  22  -0.802  13.763  -3.792
  110    H    ASN  23           H        ASN  23   2.639  12.715  -1.951
  111    HA   ASN  23           HA       ASN  23   4.553  10.518  -2.352
  112   1HB   ASN  23          1HB       ASN  23   4.813  12.551  -0.139
  113   2HB   ASN  23          2HB       ASN  23   6.004  11.363  -0.676
  114   1HD2  ASN  23          1HD2      ASN  23   4.289  14.284  -1.614
  115   2HD2  ASN  23          2HD2      ASN  23   5.502  14.870  -2.697
  116    H    ALA  24           H        ALA  24   1.592  11.209  -1.226
  117    HA   ALA  24           HA       ALA  24   1.439  10.269   1.378
  118   1HB   ALA  24          1HB       ALA  24  -0.523  11.202   0.583
  119   2HB   ALA  24          2HB       ALA  24  -0.910   9.482   0.614
  120   3HB   ALA  24          3HB       ALA  24  -0.487  10.264  -0.910
  121    H    VAL  25           H        VAL  25   1.139   8.259   2.311
  122    HA   VAL  25           HA       VAL  25   2.142   6.022   0.730
  123    HB   VAL  25           HB       VAL  25   2.458   4.854   2.823
  124   1HG1  VAL  25          1HG1      VAL  25   3.896   6.978   2.011
  125   2HG1  VAL  25          2HG1      VAL  25   4.316   5.993   3.412
  126   3HG1  VAL  25          3HG1      VAL  25   3.447   7.512   3.630
  127   1HG2  VAL  25          1HG2      VAL  25   0.930   7.161   3.997
  128   2HG2  VAL  25          2HG2      VAL  25   1.965   6.122   4.977
  129   3HG2  VAL  25          3HG2      VAL  25   0.584   5.436   4.120
  130    H    THR  26           H        THR  26  -0.704   6.966   2.599
  131    HA   THR  26           HA       THR  26  -2.026   4.464   1.831
  132    HB   THR  26           HB       THR  26  -3.449   6.416   3.541
  133    HG1  THR  26           HG1      THR  26  -1.279   4.929   4.585
  134   1HG2  THR  26          1HG2      THR  26  -4.602   4.461   3.537
  135   2HG2  THR  26          2HG2      THR  26  -3.552   4.184   4.926
  136   3HG2  THR  26          3HG2      THR  26  -3.151   3.473   3.363
  137    H    CYS  27           H        CYS  27  -3.835   4.404   0.565
  138    HA   CYS  27           HA       CYS  27  -4.915   6.948  -0.407
  139   1HB   CYS  27          1HB       CYS  27  -4.096   4.656  -2.207
  140   2HB   CYS  27          2HB       CYS  27  -4.907   6.137  -2.730
  141    H    THR  28           H        THR  28  -7.008   6.942  -0.025
  142    HA   THR  28           HA       THR  28  -8.448   4.395   0.086
  143    HB   THR  28           HB       THR  28  -9.445   7.138   0.878
  144    HG1  THR  28           HG1      THR  28  -8.908   6.493   2.999
  145   1HG2  THR  28          1HG2      THR  28 -10.393   4.414   1.731
  146   2HG2  THR  28          2HG2      THR  28 -11.196   5.446   0.548
  147   3HG2  THR  28          3HG2      THR  28 -11.059   5.970   2.226
  148    H    ASN  29           H        ASN  29  -9.037   3.831  -1.933
  149    HA   ASN  29           HA       ASN  29 -10.352   3.790  -3.760
  150   1HB   ASN  29          1HB       ASN  29 -11.519   5.904  -2.324
  151   2HB   ASN  29          2HB       ASN  29 -11.188   6.562  -3.928
  152   1HD2  ASN  29          1HD2      ASN  29 -12.855   4.056  -2.148
  153   2HD2  ASN  29          2HD2      ASN  29 -14.008   3.683  -3.378
  154    H    SER  30           H        SER  30 -10.615   5.766  -5.660
  155    HA   SER  30           HA       SER  30  -9.533   7.031  -7.250
  156   1HB   SER  30          1HB       SER  30  -7.044   6.660  -5.563
  157   2HB   SER  30          2HB       SER  30  -7.190   7.723  -6.954
  158    HG   SER  30           HG       SER  30  -7.985   8.111  -4.382
  159    H    GLN  31           H        GLN  31  -7.535   6.732  -8.798
  160    HA   GLN  31           HA       GLN  31  -6.945   3.887  -9.152
  161   1HB   GLN  31          1HB       GLN  31  -7.457   4.974 -11.736
  162   2HB   GLN  31          2HB       GLN  31  -8.293   3.656 -10.918
  163   1HG   GLN  31          1HG       GLN  31  -8.979   6.534 -10.419
  164   2HG   GLN  31          2HG       GLN  31  -9.685   5.616 -11.750
  165   1HE2  GLN  31          1HE2      GLN  31 -11.149   6.758  -9.640
  166   2HE2  GLN  31          2HE2      GLN  31 -11.878   5.479  -8.735
  167    H    HIS  32           H        HIS  32  -4.963   5.255  -8.230
  168    HA   HIS  32           HA       HIS  32  -3.013   5.231 -10.251
  169   1HB   HIS  32          1HB       HIS  32  -4.488   7.663 -10.097
  170   2HB   HIS  32          2HB       HIS  32  -2.849   7.983  -9.525
  171    HD1  HIS  32           HD1      HIS  32  -3.293   9.424 -11.958
  172    HD2  HIS  32           HD2      HIS  32  -2.336   5.382 -12.099
  173    HE1  HIS  32           HE1      HIS  32  -2.395   9.025 -14.273
  174    HE2  HIS  32           HE2      HIS  32  -1.742   6.592 -14.305
  175    H    CYS  33           H        CYS  33  -3.417   4.311  -7.526
  176    HA   CYS  33           HA       CYS  33  -1.077   5.592  -6.269
  177   1HB   CYS  33          1HB       CYS  33  -3.721   4.925  -5.166
  178   2HB   CYS  33          2HB       CYS  33  -2.363   4.392  -4.170
  179    H    VAL  34           H        VAL  34   0.086   4.000  -7.588
  180    HA   VAL  34           HA       VAL  34  -0.170   1.204  -7.004
  181    HB   VAL  34           HB       VAL  34   1.721   0.878  -8.444
  182   1HG1  VAL  34          1HG1      VAL  34   0.531   3.139  -9.907
  183   2HG1  VAL  34          2HG1      VAL  34  -0.610   1.961  -9.260
  184   3HG1  VAL  34          3HG1      VAL  34   0.669   1.439 -10.356
  185   1HG2  VAL  34          1HG2      VAL  34   3.124   2.716  -7.513
  186   2HG2  VAL  34          2HG2      VAL  34   2.146   3.869  -8.422
  187   3HG2  VAL  34          3HG2      VAL  34   3.112   2.670  -9.278
  188    H    LYS  35           H        LYS  35   1.849   3.832  -5.897
  189    HA   LYS  35           HA       LYS  35   3.532   2.009  -4.383
  190   1HB   LYS  35          1HB       LYS  35   5.054   3.766  -4.181
  191   2HB   LYS  35          2HB       LYS  35   4.377   3.975  -5.779
  192   1HG   LYS  35          1HG       LYS  35   3.181   5.470  -3.491
  193   2HG   LYS  35          2HG       LYS  35   4.695   6.022  -4.204
  194   1HD   LYS  35          1HD       LYS  35   3.542   7.013  -5.822
  195   2HD   LYS  35          2HD       LYS  35   2.954   5.433  -6.344
  196   1HE   LYS  35          1HE       LYS  35   0.911   5.798  -5.506
  197   2HE   LYS  35          2HE       LYS  35   1.550   6.465  -4.006
  198   1HZ   LYS  35          1HZ       LYS  35   0.363   7.844  -6.098
  199   2HZ   LYS  35          2HZ       LYS  35   1.998   8.277  -6.124
  200   3HZ   LYS  35          3HZ       LYS  35   1.088   8.496  -4.715
  201    H    ALA  36           H        ALA  36   0.722   2.427  -3.625
  202    HA   ALA  36           HA       ALA  36   0.931   3.887  -1.105
  203   1HB   ALA  36          1HB       ALA  36  -1.474   2.526  -2.313
  204   2HB   ALA  36          2HB       ALA  36  -1.047   4.221  -2.549
  205   3HB   ALA  36          3HB       ALA  36  -1.464   3.632  -0.939
  206    H    ASN  37           H        ASN  37   0.269   2.902   0.912
  207    HA   ASN  37           HA       ASN  37   1.311   0.227   1.179
  208   1HB   ASN  37          1HB       ASN  37   1.302   2.415   2.821
  209   2HB   ASN  37          2HB       ASN  37   0.019   1.438   3.531
  210   1HD2  ASN  37          1HD2      ASN  37   3.370   1.288   2.424
  211   2HD2  ASN  37          2HD2      ASN  37   3.885   0.112   3.580
  212    H    THR  38           H        THR  38  -1.822   1.797   1.273
  213    HA   THR  38           HA       THR  38  -3.093  -0.832   1.210
  214    HB   THR  38           HB       THR  38  -4.350   1.249   2.947
  215    HG1  THR  38           HG1      THR  38  -2.366  -0.552   3.867
  216   1HG2  THR  38          1HG2      THR  38  -5.235  -0.613   4.150
  217   2HG2  THR  38          2HG2      THR  38  -4.226  -1.739   3.243
  218   3HG2  THR  38          3HG2      THR  38  -5.525  -0.868   2.430
  219    H    CYS  39           H        CYS  39  -5.328  -0.753   0.451
  220    HA   CYS  39           HA       CYS  39  -6.070   1.728  -0.917
  221   1HB   CYS  39          1HB       CYS  39  -5.832  -0.980  -2.240
  222   2HB   CYS  39          2HB       CYS  39  -6.650   0.405  -2.967
  223    H    THR  40           H        THR  40  -8.282   1.907  -1.440
  224    HA   THR  40           HA       THR  40 -10.123  -0.163  -0.578
  225    HB   THR  40           HB       THR  40 -10.742   2.501   0.565
  226    HG1  THR  40           HG1      THR  40  -8.821   0.800   1.769
  227   1HG2  THR  40          1HG2      THR  40 -11.439  -0.265   1.052
  228   2HG2  THR  40          2HG2      THR  40 -12.285   1.216   1.503
  229   3HG2  THR  40          3HG2      THR  40 -10.994   0.590   2.529
  230    H    GLY  41           H        GLY  41 -11.104  -0.303  -2.538
  231   1HA   GLY  41          1HA       GLY  41 -12.625   0.309  -4.182
  232   2HA   GLY  41          2HA       GLY  41 -12.832   1.846  -3.352
  233    H    SER  42           H        SER  42  -9.880   0.381  -4.603
  234    HA   SER  42           HA       SER  42  -9.692   2.609  -6.504
  235   1HB   SER  42          1HB       SER  42  -7.237   1.478  -5.175
  236   2HB   SER  42          2HB       SER  42  -7.460   3.066  -5.903
  237    HG   SER  42           HG       SER  42  -7.637   2.460  -3.371
  238    H    THR  43           H        THR  43  -7.275   1.747  -7.690
  239    HA   THR  43           HA       THR  43  -7.756  -1.037  -8.361
  240    HB   THR  43           HB       THR  43  -8.230  -0.779 -10.561
  241    HG1  THR  43           HG1      THR  43  -7.342   1.863 -10.811
  242   1HG2  THR  43          1HG2      THR  43  -9.657   1.252 -10.964
  243   2HG2  THR  43          2HG2      THR  43  -9.257   1.745  -9.317
  244   3HG2  THR  43          3HG2      THR  43 -10.110   0.226  -9.602
  245    H    ASP  44           H        ASP  44  -5.775   1.552  -9.743
  246    HA   ASP  44           HA       ASP  44  -3.495   0.042 -10.173
  247   1HB   ASP  44          1HB       ASP  44  -3.884   3.009  -9.787
  248   2HB   ASP  44          2HB       ASP  44  -2.321   2.304 -10.188
  249    H    CYS  45           H        CYS  45  -3.388  -1.173  -8.249
  250    HA   CYS  45           HA       CYS  45  -1.813   0.132  -6.137
  251   1HB   CYS  45          1HB       CYS  45  -4.106  -1.810  -5.768
  252   2HB   CYS  45          2HB       CYS  45  -2.989  -1.346  -4.480
  253    H    ASN  46           H        ASN  46   0.055  -0.772  -7.145
  254    HA   ASN  46           HA       ASN  46   0.223  -3.645  -7.454
  255   1HB   ASN  46          1HB       ASN  46   2.013  -1.338  -8.095
  256   2HB   ASN  46          2HB       ASN  46   2.696  -2.961  -8.014
  257   1HD2  ASN  46          1HD2      ASN  46  -0.459  -1.844  -9.184
  258   2HD2  ASN  46          2HD2      ASN  46  -0.259  -2.436 -10.794
  259    H    THR  47           H        THR  47   1.569  -1.175  -5.293
  260    HA   THR  47           HA       THR  47   3.022  -3.244  -3.830
  261    HB   THR  47           HB       THR  47   3.900  -0.857  -4.480
  262    HG1  THR  47           HG1      THR  47   4.305  -2.198  -2.032
  263   1HG2  THR  47          1HG2      THR  47   3.705   0.820  -2.823
  264   2HG2  THR  47          2HG2      THR  47   2.775  -0.241  -1.765
  265   3HG2  THR  47          3HG2      THR  47   2.067   0.345  -3.270
  266    H    ALA  48           H        ALA  48   0.109  -1.425  -3.587
  267    HA   ALA  48           HA       ALA  48  -0.369  -1.144  -0.918
  268   1HB   ALA  48          1HB       ALA  48  -1.896  -0.586  -2.867
  269   2HB   ALA  48          2HB       ALA  48  -2.672  -1.160  -1.391
  270   3HB   ALA  48          3HB       ALA  48  -2.466  -2.251  -2.761
  271    H    GLN  49           H        GLN  49  -1.034  -2.398   0.787
  272    HA   GLN  49           HA       GLN  49  -0.377  -5.200   0.642
  273   1HB   GLN  49          1HB       GLN  49  -1.313  -3.409   2.878
  274   2HB   GLN  49          2HB       GLN  49  -1.070  -5.136   3.093
  275   1HG   GLN  49          1HG       GLN  49   1.052  -3.214   2.169
  276   2HG   GLN  49          2HG       GLN  49   0.841  -3.757   3.833
  277   1HE2  GLN  49          1HE2      GLN  49   2.396  -4.327   0.949
  278   2HE2  GLN  49          2HE2      GLN  49   2.950  -5.935   1.252
  279    H    THR  50           H        THR  50  -3.077  -3.565  -0.226
  280    HA   THR  50           HA       THR  50  -4.682  -5.811  -0.533
  281    HB   THR  50           HB       THR  50  -4.740  -5.461   2.021
  282    HG1  THR  50           HG1      THR  50  -6.262  -6.701   0.692
  283   1HG2  THR  50          1HG2      THR  50  -5.231  -2.963   1.750
  284   2HG2  THR  50          2HG2      THR  50  -6.134  -3.876   2.961
  285   3HG2  THR  50          3HG2      THR  50  -6.885  -3.478   1.415
  286    H    CYS  51           H        CYS  51  -6.921  -5.210  -1.262
  287    HA   CYS  51           HA       CYS  51  -7.596  -2.512  -1.761
  288   1HB   CYS  51          1HB       CYS  51  -7.254  -2.465  -4.205
  289   2HB   CYS  51          2HB       CYS  51  -5.732  -2.587  -3.320
  290    H    THR  52           H        THR  52  -9.723  -2.600  -1.689
  291    HA   THR  52           HA       THR  52 -11.129  -4.975  -2.630
  292    HB   THR  52           HB       THR  52 -12.989  -3.139  -1.628
  293    HG1  THR  52           HG1      THR  52 -10.676  -3.180   0.007
  294   1HG2  THR  52          1HG2      THR  52 -13.296  -4.626   0.166
  295   2HG2  THR  52          2HG2      THR  52 -11.647  -5.239   0.037
  296   3HG2  THR  52          3HG2      THR  52 -12.830  -5.618  -1.215
  297    H    ASN  53           H        ASN  53 -12.371  -5.008  -4.436
  298    HA   ASN  53           HA       ASN  53 -13.284  -4.348  -6.419
  299   1HB   ASN  53          1HB       ASN  53 -13.675  -1.857  -4.766
  300   2HB   ASN  53          2HB       ASN  53 -14.194  -1.938  -6.453
  301   1HD2  ASN  53          1HD2      ASN  53 -15.171  -2.330  -3.347
  302   2HD2  ASN  53          2HD2      ASN  53 -16.533  -3.363  -3.598
  303    H    SER  54           H        SER  54 -10.444  -4.177  -6.016
  304    HA   SER  54           HA       SER  54  -9.624  -1.810  -7.523
  305   1HB   SER  54          1HB       SER  54  -8.426  -3.385  -5.499
  306   2HB   SER  54          2HB       SER  54  -7.447  -3.603  -6.955
  307    HG   SER  54           HG       SER  54  -8.079  -1.214  -5.586
  308    H    LYS  55           H        LYS  55  -7.408  -2.760  -8.827
  309    HA   LYS  55           HA       LYS  55  -8.279  -4.901 -10.612
  310   1HB   LYS  55          1HB       LYS  55  -7.485  -2.135 -11.552
  311   2HB   LYS  55          2HB       LYS  55  -7.709  -3.527 -12.601
  312   1HG   LYS  55          1HG       LYS  55 -10.083  -3.606 -11.525
  313   2HG   LYS  55          2HG       LYS  55  -9.742  -1.919 -11.134
  314   1HD   LYS  55          1HD       LYS  55  -9.715  -1.273 -13.339
  315   2HD   LYS  55          2HD       LYS  55  -9.248  -2.875 -13.912
  316   1HE   LYS  55          1HE       LYS  55 -11.578  -2.241 -14.499
  317   2HE   LYS  55          2HE       LYS  55 -11.461  -3.719 -13.544
  318   1HZ   LYS  55          1HZ       LYS  55 -11.878  -1.153 -12.174
  319   2HZ   LYS  55          2HZ       LYS  55 -12.348  -2.709 -11.704
  320   3HZ   LYS  55          3HZ       LYS  55 -13.191  -1.905 -12.931
  321    H    ASP  56           H        ASP  56  -6.120  -4.252  -8.545
  322    HA   ASP  56           HA       ASP  56  -3.935  -5.368 -10.056
  323   1HB   ASP  56          1HB       ASP  56  -3.969  -2.623  -8.925
  324   2HB   ASP  56          2HB       ASP  56  -2.476  -3.541  -8.743
  325    H    CYS  57           H        CYS  57  -2.320  -4.447  -7.557
  326    HA   CYS  57           HA       CYS  57  -1.956  -5.073  -5.379
  327   1HB   CYS  57          1HB       CYS  57  -4.549  -6.471  -5.795
  328   2HB   CYS  57          2HB       CYS  57  -3.469  -7.139  -4.575
  329    H    PHE  58           H        PHE  58   0.000  -5.887  -5.691
  330    HA   PHE  58           HA       PHE  58   0.262  -8.581  -6.820
  331   1HB   PHE  58          1HB       PHE  58   2.323  -6.414  -6.347
  332   2HB   PHE  58          2HB       PHE  58   2.684  -8.005  -7.006
  333    HD1  PHE  58           HD1      PHE  58   3.339  -7.732  -9.127
  334    HD2  PHE  58           HD2      PHE  58  -0.069  -5.615  -7.717
  335    HE1  PHE  58           HE1      PHE  58   2.942  -6.866 -11.387
  336    HE2  PHE  58           HE2      PHE  58  -0.475  -4.757  -9.974
  337    HZ   PHE  58           HZ       PHE  58   1.046  -5.383 -11.774
  338    H    GLU  59           H        GLU  59   1.083  -6.642  -3.992
  339    HA   GLU  59           HA       GLU  59   1.776  -9.130  -2.571
  340   1HB   GLU  59          1HB       GLU  59   2.779  -6.425  -1.725
  341   2HB   GLU  59          2HB       GLU  59   3.424  -8.017  -1.327
  342   1HG   GLU  59          1HG       GLU  59   3.552  -6.679  -4.022
  343   2HG   GLU  59          2HG       GLU  59   4.877  -6.825  -2.868
  344    H    ALA  60           H        ALA  60  -0.864  -8.319  -2.763
  345    HA   ALA  60           HA       ALA  60  -1.500  -6.906  -0.296
  346   1HB   ALA  60          1HB       ALA  60  -2.964  -6.107  -1.835
  347   2HB   ALA  60          2HB       ALA  60  -3.915  -7.477  -1.260
  348   3HB   ALA  60          3HB       ALA  60  -2.989  -7.613  -2.754
  349    H    ASN  61           H        ASN  61  -2.744  -7.765   1.367
  350    HA   ASN  61           HA       ASN  61  -2.439 -10.628   1.723
  351   1HB   ASN  61          1HB       ASN  61  -3.475  -8.494   3.604
  352   2HB   ASN  61          2HB       ASN  61  -3.204 -10.181   4.035
  353   1HD2  ASN  61          1HD2      ASN  61  -1.750  -9.469   5.644
  354   2HD2  ASN  61          2HD2      ASN  61  -0.143  -8.983   5.238
  355    H    THR  62           H        THR  62  -5.018  -8.246   1.382
  356    HA   THR  62           HA       THR  62  -6.937 -10.477   1.184
  357    HB   THR  62           HB       THR  62  -7.476  -7.674   2.187
  358    HG1  THR  62           HG1      THR  62  -7.401 -10.151   3.563
  359   1HG2  THR  62          1HG2      THR  62  -9.268  -9.662   1.208
  360   2HG2  THR  62          2HG2      THR  62  -9.622  -8.060   1.856
  361   3HG2  THR  62          3HG2      THR  62  -9.516  -9.446   2.940
  362    H    CYS  63           H        CYS  63  -7.940 -10.680  -0.703
  363    HA   CYS  63           HA       CYS  63  -7.990  -8.358  -2.518
  364   1HB   CYS  63          1HB       CYS  63  -7.142 -11.167  -2.979
  365   2HB   CYS  63          2HB       CYS  63  -8.062 -10.393  -4.271
  366    H    THR  64           H        THR  64 -10.108  -7.889  -1.671
  367    HA   THR  64           HA       THR  64 -12.203  -9.824  -2.310
  368    HB   THR  64           HB       THR  64 -13.426  -7.541  -1.282
  369    HG1  THR  64           HG1      THR  64 -11.071  -8.066   0.200
  370   1HG2  THR  64          1HG2      THR  64 -13.025 -10.247  -0.494
  371   2HG2  THR  64          2HG2      THR  64 -14.311  -9.131  -0.037
  372   3HG2  THR  64          3HG2      THR  64 -12.822  -9.195   0.907
  373    H    ASP  65           H        ASP  65 -12.494  -9.767  -4.485
  374    HA   ASP  65           HA       ASP  65 -13.362  -9.046  -6.463
  375   1HB   ASP  65          1HB       ASP  65 -14.063  -6.437  -5.109
  376   2HB   ASP  65          2HB       ASP  65 -14.810  -7.149  -6.541
  377    H    SER  66           H        SER  66 -10.973  -9.055  -6.889
  378    HA   SER  66           HA       SER  66 -10.261  -6.589  -8.193
  379   1HB   SER  66          1HB       SER  66  -9.350  -5.962  -6.099
  380   2HB   SER  66          2HB       SER  66  -8.715  -7.585  -5.802
  381    HG   SER  66           HG       SER  66  -6.949  -6.688  -6.553
  382    H    THR  67           H        THR  67  -8.806  -6.887  -9.851
  383    HA   THR  67           HA       THR  67  -8.137  -9.684 -10.422
  384    HB   THR  67           HB       THR  67  -9.301  -8.883 -12.258
  385    HG1  THR  67           HG1      THR  67  -7.829  -8.793 -13.878
  386   1HG2  THR  67          1HG2      THR  67  -8.924  -6.701 -13.326
  387   2HG2  THR  67          2HG2      THR  67  -7.828  -6.278 -12.012
  388   3HG2  THR  67          3HG2      THR  67  -9.533  -6.574 -11.677
  389    H    ASN  68           H        ASN  68  -6.071 -10.151 -11.465
  390    HA   ASN  68           HA       ASN  68  -3.799 -10.132 -11.551
  391   1HB   ASN  68          1HB       ASN  68  -4.125  -7.154 -11.093
  392   2HB   ASN  68          2HB       ASN  68  -2.612  -7.952 -11.529
  393   1HD2  ASN  68          1HD2      ASN  68  -2.535  -6.643 -13.397
  394   2HD2  ASN  68          2HD2      ASN  68  -3.496  -7.015 -14.782
  395    H    CYS  69           H        CYS  69  -5.002 -10.864  -9.164
  396    HA   CYS  69           HA       CYS  69  -3.468  -9.598  -7.033
  397   1HB   CYS  69          1HB       CYS  69  -5.757 -11.534  -7.107
  398   2HB   CYS  69          2HB       CYS  69  -4.775 -11.387  -5.646
  399    H    TYR  70           H        TYR  70  -1.795 -10.540  -5.969
  400    HA   TYR  70           HA       TYR  70  -1.067 -13.281  -6.741
  401   1HB   TYR  70          1HB       TYR  70   0.836 -10.941  -6.494
  402   2HB   TYR  70          2HB       TYR  70   1.302 -12.614  -6.813
  403    HD1  TYR  70           HD1      TYR  70   1.290  -9.699  -8.388
  404    HD2  TYR  70           HD2      TYR  70  -0.572 -13.498  -8.824
  405    HE1  TYR  70           HE1      TYR  70   1.048  -9.296 -10.802
  406    HE2  TYR  70           HE2      TYR  70  -0.820 -13.107 -11.240
  407    HH   TYR  70           HH       TYR  70   0.182 -11.757 -12.998
  408    H    LYS  71           H        LYS  71  -1.266 -14.453  -4.960
  409    HA   LYS  71           HA       LYS  71  -0.815 -15.263  -2.876
  410   1HB   LYS  71          1HB       LYS  71   1.383 -13.758  -3.342
  411   2HB   LYS  71          2HB       LYS  71   0.717 -12.904  -1.950
  412   1HG   LYS  71          1HG       LYS  71   2.267 -14.507  -1.138
  413   2HG   LYS  71          2HG       LYS  71   0.649 -15.093  -0.746
  414   1HD   LYS  71          1HD       LYS  71   1.914 -16.947  -1.565
  415   2HD   LYS  71          2HD       LYS  71   0.750 -16.501  -2.813
  416   1HE   LYS  71          1HE       LYS  71   3.315 -15.117  -3.044
  417   2HE   LYS  71          2HE       LYS  71   3.440 -16.869  -3.195
  418   1HZ   LYS  71          1HZ       LYS  71   1.612 -15.140  -4.775
  419   2HZ   LYS  71          2HZ       LYS  71   1.787 -16.815  -4.942
  420   3HZ   LYS  71          3HZ       LYS  71   3.073 -15.788  -5.335
  421    H    ALA  72           H        ALA  72  -3.201 -14.250  -3.146
  422    HA   ALA  72           HA       ALA  72  -3.624 -12.354  -0.938
  423   1HB   ALA  72          1HB       ALA  72  -6.060 -12.625  -2.163
  424   2HB   ALA  72          2HB       ALA  72  -4.934 -12.792  -3.511
  425   3HB   ALA  72          3HB       ALA  72  -4.883 -11.352  -2.492
  426    H    THR  73           H        THR  73  -4.885 -12.865   0.798
  427    HA   THR  73           HA       THR  73  -5.288 -15.652   1.340
  428    HB   THR  73           HB       THR  73  -5.990 -14.947   3.534
  429    HG1  THR  73           HG1      THR  73  -6.026 -12.299   2.523
  430   1HG2  THR  73          1HG2      THR  73  -3.521 -14.287   2.511
  431   2HG2  THR  73          2HG2      THR  73  -3.979 -14.311   4.214
  432   3HG2  THR  73          3HG2      THR  73  -4.060 -12.804   3.300
  433    H    ALA  74           H        ALA  74  -7.433 -12.848   0.928
  434    HA   ALA  74           HA       ALA  74  -9.752 -14.627   0.862
  435   1HB   ALA  74          1HB       ALA  74 -10.088 -11.711   0.486
  436   2HB   ALA  74          2HB       ALA  74  -9.486 -12.249   2.053
  437   3HB   ALA  74          3HB       ALA  74 -11.030 -12.848   1.449
  438    H    CYS  75           H        CYS  75  -9.265 -15.619  -1.165
  439    HA   CYS  75           HA       CYS  75  -9.515 -13.861  -3.506
  440   1HB   CYS  75          1HB       CYS  75  -8.306 -16.579  -3.091
  441   2HB   CYS  75          2HB       CYS  75  -8.802 -16.067  -4.707
  442    H    THR  76           H        THR  76 -11.867 -13.829  -2.701
  443    HA   THR  76           HA       THR  76 -13.431 -16.178  -3.288
  444    HB   THR  76           HB       THR  76 -14.336 -13.346  -2.730
  445    HG1  THR  76           HG1      THR  76 -13.839 -15.545  -1.027
  446   1HG2  THR  76          1HG2      THR  76 -16.083 -14.743  -3.751
  447   2HG2  THR  76          2HG2      THR  76 -16.448 -14.293  -2.085
  448   3HG2  THR  76          3HG2      THR  76 -15.868 -15.918  -2.453
  449    H    ASN  77           H        ASN  77 -13.181 -12.913  -4.692
  450    HA   ASN  77           HA       ASN  77 -13.803 -14.049  -7.314
  451   1HB   ASN  77          1HB       ASN  77 -15.941 -13.223  -6.391
  452   2HB   ASN  77          2HB       ASN  77 -15.218 -11.627  -6.169
  453   1HD2  ASN  77          1HD2      ASN  77 -15.120 -13.981  -8.823
  454   2HD2  ASN  77          2HD2      ASN  77 -15.699 -12.894 -10.035
  455    H    SER  78           H        SER  78 -11.307 -13.450  -6.658
  456    HA   SER  78           HA       SER  78 -10.800 -10.825  -7.899
  457   1HB   SER  78          1HB       SER  78  -8.458 -11.319  -6.663
  458   2HB   SER  78          2HB       SER  78  -9.795 -10.470  -5.878
  459    HG   SER  78           HG       SER  78  -9.498 -13.281  -5.749
  460    H    SER  79           H        SER  79  -9.523 -10.741  -9.670
  461    HA   SER  79           HA       SER  79  -8.763 -13.257 -10.886
  462   1HB   SER  79          1HB       SER  79  -9.582 -10.768 -11.860
  463   2HB   SER  79          2HB       SER  79  -7.895 -10.922 -12.351
  464    HG   SER  79           HG       SER  79  -8.580 -13.106 -13.088
  465    H    GLY  80           H        GLY  80  -6.648 -13.663 -11.766
  466   1HA   GLY  80          1HA       GLY  80  -4.322 -13.430 -11.850
  467   2HA   GLY  80          2HA       GLY  80  -4.437 -12.089 -10.713
  468    H    CYS  81           H        CYS  81  -6.161 -13.787  -8.921
  469    HA   CYS  81           HA       CYS  81  -3.973 -15.394  -7.777
  470   1HB   CYS  81          1HB       CYS  81  -4.659 -14.801  -5.617
  471   2HB   CYS  81          2HB       CYS  81  -4.843 -13.310  -6.535
  472    HA   PRO  82           HA       PRO  82  -6.175 -19.201  -7.602
  473   1HB   PRO  82          1HB       PRO  82  -6.624 -18.891  -4.666
  474   2HB   PRO  82          2HB       PRO  82  -5.952 -20.261  -5.566
  475   1HG   PRO  82          1HG       PRO  82  -4.351 -18.642  -4.198
  476   2HG   PRO  82          2HG       PRO  82  -3.866 -19.258  -5.789
  477   1HD   PRO  82          1HD       PRO  82  -4.857 -16.551  -5.022
  478   2HD   PRO  82          2HD       PRO  82  -3.636 -17.006  -6.229
  479    H    GLY  83           H        GLY  83  -8.013 -18.515  -8.743
  480   1HA   GLY  83          1HA       GLY  83 -10.368 -17.976  -7.038
  481   2HA   GLY  83          2HA       GLY  83 -10.142 -17.217  -8.608
  482    H    HIS  84           H        HIS  84 -11.320 -18.080 -10.170
  483    HA   HIS  84           HA       HIS  84 -11.486 -20.938 -10.505
  484   1HB   HIS  84          1HB       HIS  84 -13.999 -19.346  -9.949
  485   2HB   HIS  84          2HB       HIS  84 -13.954 -21.025 -10.478
  486    HD1  HIS  84           HD1      HIS  84 -12.352 -22.550  -8.700
  487    HD2  HIS  84           HD2      HIS  84 -14.313 -19.173  -7.281
  488    HE1  HIS  84           HE1      HIS  84 -12.477 -22.844  -6.206
  489    HE2  HIS  84           HE2      HIS  84 -13.585 -20.745  -5.361
  Start of MODEL    8
    1   1H    GLN   1          1H        GLN   1  -7.342  16.177   6.787
    2   2H    GLN   1          2H        GLN   1  -6.589  14.995   5.796
    3   3H    GLN   1          3H        GLN   1  -8.029  15.768   5.271
    4    HA   GLN   1           HA       GLN   1  -6.781  17.893   5.387
    5   1HB   GLN   1          1HB       GLN   1  -4.950  16.418   6.700
    6   2HB   GLN   1          2HB       GLN   1  -4.301  16.292   5.071
    7   1HG   GLN   1          1HG       GLN   1  -3.435  18.320   5.202
    8   2HG   GLN   1          2HG       GLN   1  -5.005  19.009   5.611
    9   1HE2  GLN   1          1HE2      GLN   1  -1.914  18.654   6.642
   10   2HE2  GLN   1          2HE2      GLN   1  -2.142  18.879   8.339
   11    H    CYS   2           H        CYS   2  -7.112  18.560   3.375
   12    HA   CYS   2           HA       CYS   2  -7.191  18.654   1.105
   13   1HB   CYS   2          1HB       CYS   2  -4.773  18.353   1.211
   14   2HB   CYS   2          2HB       CYS   2  -4.972  16.606   1.312
   15    H    THR   3           H        THR   3  -8.558  17.812  -0.366
   16    HA   THR   3           HA       THR   3  -9.075  14.935  -0.352
   17    HB   THR   3           HB       THR   3 -10.854  15.445   1.011
   18    HG1  THR   3           HG1      THR   3 -12.599  15.196  -0.213
   19   1HG2  THR   3          1HG2      THR   3 -12.208  17.686   0.071
   20   2HG2  THR   3          2HG2      THR   3 -10.504  18.140   0.078
   21   3HG2  THR   3          3HG2      THR   3 -11.264  17.546   1.554
   22    H    GLY   4           H        GLY   4 -10.523  17.838  -1.854
   23   1HA   GLY   4          1HA       GLY   4 -10.361  18.494  -4.099
   24   2HA   GLY   4          2HA       GLY   4  -9.552  16.971  -4.460
   25    H    GLY   5           H        GLY   5 -11.236  17.464  -6.308
   26   1HA   GLY   5          1HA       GLY   5 -13.748  16.085  -5.583
   27   2HA   GLY   5          2HA       GLY   5 -13.643  17.319  -6.830
   28    H    ALA   6           H        ALA   6 -11.752  16.699  -8.479
   29    HA   ALA   6           HA       ALA   6 -11.880  13.841  -9.100
   30   1HB   ALA   6          1HB       ALA   6 -13.640  15.478 -10.307
   31   2HB   ALA   6          2HB       ALA   6 -12.973  14.031 -11.064
   32   3HB   ALA   6          3HB       ALA   6 -12.280  15.614 -11.421
   33    H    ASP   7           H        ASP   7  -9.827  15.904  -8.243
   34    HA   ASP   7           HA       ASP   7  -7.738  14.985  -9.999
   35   1HB   ASP   7          1HB       ASP   7  -8.849  17.180 -10.957
   36   2HB   ASP   7          2HB       ASP   7  -7.861  17.962  -9.720
   37    H    CYS   8           H        CYS   8  -6.379  14.247  -8.502
   38    HA   CYS   8           HA       CYS   8  -5.990  15.768  -6.033
   39   1HB   CYS   8          1HB       CYS   8  -5.713  12.935  -6.819
   40   2HB   CYS   8          2HB       CYS   8  -4.480  13.528  -5.703
   41    H    THR   9           H        THR   9  -4.906  17.270  -7.808
   42    HA   THR   9           HA       THR   9  -2.117  16.535  -8.251
   43    HB   THR   9           HB       THR   9  -3.226  17.502 -10.152
   44    HG1  THR   9           HG1      THR   9  -1.087  18.191  -9.859
   45   1HG2  THR   9          1HG2      THR   9  -4.948  18.860  -9.755
   46   2HG2  THR   9          2HG2      THR   9  -3.728  20.131  -9.686
   47   3HG2  THR   9          3HG2      THR   9  -4.306  19.381  -8.197
   48    H    SER  10           H        SER  10  -4.083  18.677  -6.326
   49    HA   SER  10           HA       SER  10  -1.704  20.009  -5.254
   50   1HB   SER  10          1HB       SER  10  -3.699  21.233  -3.950
   51   2HB   SER  10          2HB       SER  10  -3.209  21.706  -5.576
   52    HG   SER  10           HG       SER  10  -4.948  20.709  -6.410
   53    H    CYS  11           H        CYS  11  -2.329  17.209  -4.671
   54    HA   CYS  11           HA       CYS  11  -2.741  17.415  -1.760
   55   1HB   CYS  11          1HB       CYS  11  -4.216  15.916  -3.559
   56   2HB   CYS  11          2HB       CYS  11  -3.088  14.741  -2.892
   57    H    THR  12           H        THR  12  -1.432  16.149  -0.405
   58    HA   THR  12           HA       THR  12   0.881  14.853  -1.650
   59    HB   THR  12           HB       THR  12   0.895  17.312  -0.090
   60    HG1  THR  12           HG1      THR  12   2.911  15.892  -1.485
   61   1HG2  THR  12          1HG2      THR  12   2.837  15.192   0.797
   62   2HG2  THR  12          2HG2      THR  12   1.513  15.830   1.772
   63   3HG2  THR  12          3HG2      THR  12   2.831  16.890   1.274
   64    H    GLY  13           H        GLY  13  -1.041  15.401   1.267
   65   1HA   GLY  13          1HA       GLY  13   0.086  13.335   2.815
   66   2HA   GLY  13          2HA       GLY  13  -1.500  14.050   3.063
   67    H    ALA  14           H        ALA  14  -3.282  13.221   1.757
   68    HA   ALA  14           HA       ALA  14  -2.836  10.511   0.716
   69   1HB   ALA  14          1HB       ALA  14  -3.620  10.177   2.961
   70   2HB   ALA  14          2HB       ALA  14  -4.918   9.760   1.841
   71   3HB   ALA  14          3HB       ALA  14  -4.960  11.296   2.706
   72    H    CYS  15           H        CYS  15  -4.222   9.862  -0.927
   73    HA   CYS  15           HA       CYS  15  -5.528  12.037  -2.335
   74   1HB   CYS  15          1HB       CYS  15  -4.665   9.268  -3.014
   75   2HB   CYS  15          2HB       CYS  15  -5.980   9.966  -3.953
   76    H    THR  16           H        THR  16  -7.668  12.367  -2.495
   77    HA   THR  16           HA       THR  16  -9.512  10.241  -1.684
   78    HB   THR  16           HB       THR  16 -10.123  12.986  -0.710
   79    HG1  THR  16           HG1      THR  16  -8.143  12.920   0.143
   80   1HG2  THR  16          1HG2      THR  16 -10.534  11.159   1.315
   81   2HG2  THR  16          2HG2      THR  16 -10.976  10.282  -0.150
   82   3HG2  THR  16          3HG2      THR  16 -11.755  11.819   0.226
   83    H    GLY  17           H        GLY  17 -11.158  10.048  -3.065
   84   1HA   GLY  17          1HA       GLY  17 -12.557  10.471  -4.837
   85   2HA   GLY  17          2HA       GLY  17 -12.676  12.096  -4.165
   86    H    CYS  18           H        CYS  18 -10.161  10.209  -5.853
   87    HA   CYS  18           HA       CYS  18 -10.106  12.198  -7.980
   88   1HB   CYS  18          1HB       CYS  18  -7.409  11.890  -7.574
   89   2HB   CYS  18          2HB       CYS  18  -8.358  13.273  -7.033
   90    H    GLY  19           H        GLY  19  -7.824  11.376  -9.293
   91   1HA   GLY  19          1HA       GLY  19  -8.153   8.475  -9.661
   92   2HA   GLY  19          2HA       GLY  19  -8.318   9.547 -11.050
   93    H    ASN  20           H        ASN  20  -6.051  10.679  -8.803
   94    HA   ASN  20           HA       ASN  20  -3.793   9.196  -9.805
   95   1HB   ASN  20          1HB       ASN  20  -3.913  10.659 -11.662
   96   2HB   ASN  20          2HB       ASN  20  -4.314  12.043 -10.651
   97   1HD2  ASN  20          1HD2      ASN  20  -2.734  13.400 -10.222
   98   2HD2  ASN  20          2HD2      ASN  20  -1.042  13.059 -10.323
   99    H    CYS  21           H        CYS  21  -1.851   9.650  -8.660
  100    HA   CYS  21           HA       CYS  21  -2.070  11.479  -6.388
  101   1HB   CYS  21          1HB       CYS  21  -2.483   8.770  -6.062
  102   2HB   CYS  21          2HB       CYS  21  -0.774   8.956  -5.662
  103    HA   PRO  22           HA       PRO  22   2.122  12.232  -7.573
  104   1HB   PRO  22          1HB       PRO  22   2.873  13.806  -5.495
  105   2HB   PRO  22          2HB       PRO  22   1.801  14.351  -6.786
  106   1HG   PRO  22          1HG       PRO  22   1.177  13.662  -3.990
  107   2HG   PRO  22          2HG       PRO  22   0.308  14.717  -5.111
  108   1HD   PRO  22          1HD       PRO  22  -0.343  12.047  -4.396
  109   2HD   PRO  22          2HD       PRO  22  -1.123  13.052  -5.629
  110    H    ASN  23           H        ASN  23   2.205  12.021  -4.014
  111    HA   ASN  23           HA       ASN  23   3.863   9.640  -4.150
  112   1HB   ASN  23          1HB       ASN  23   5.184  11.453  -2.350
  113   2HB   ASN  23          2HB       ASN  23   5.840  10.615  -3.758
  114   1HD2  ASN  23          1HD2      ASN  23   3.773  13.389  -2.960
  115   2HD2  ASN  23          2HD2      ASN  23   4.425  14.438  -4.168
  116    H    ALA  24           H        ALA  24   1.248  10.159  -3.148
  117    HA   ALA  24           HA       ALA  24   1.204  10.560  -0.358
  118   1HB   ALA  24          1HB       ALA  24  -1.055   9.819  -0.428
  119   2HB   ALA  24          2HB       ALA  24  -0.791   8.959  -1.944
  120   3HB   ALA  24          3HB       ALA  24  -0.754  10.722  -1.913
  121    H    VAL  25           H        VAL  25   0.894   9.059   1.339
  122    HA   VAL  25           HA       VAL  25   2.219   6.485   0.859
  123    HB   VAL  25           HB       VAL  25   3.220   7.914   2.582
  124   1HG1  VAL  25          1HG1      VAL  25   1.509   9.205   3.471
  125   2HG1  VAL  25          2HG1      VAL  25   1.861   8.071   4.775
  126   3HG1  VAL  25          3HG1      VAL  25   0.460   7.813   3.736
  127   1HG2  VAL  25          1HG2      VAL  25   3.066   5.335   2.711
  128   2HG2  VAL  25          2HG2      VAL  25   1.952   5.632   4.045
  129   3HG2  VAL  25          3HG2      VAL  25   3.608   6.231   4.131
  130    H    THR  26           H        THR  26  -0.820   7.882   1.671
  131    HA   THR  26           HA       THR  26  -2.028   5.242   1.750
  132    HB   THR  26           HB       THR  26  -3.024   7.038   3.878
  133    HG1  THR  26           HG1      THR  26  -1.153   7.249   4.776
  134   1HG2  THR  26          1HG2      THR  26  -2.376   4.464   4.827
  135   2HG2  THR  26          2HG2      THR  26  -3.140   4.275   3.249
  136   3HG2  THR  26          3HG2      THR  26  -3.970   5.158   4.531
  137    H    CYS  27           H        CYS  27  -4.092   5.226   0.938
  138    HA   CYS  27           HA       CYS  27  -5.517   7.734   0.588
  139   1HB   CYS  27          1HB       CYS  27  -5.841   6.772  -1.933
  140   2HB   CYS  27          2HB       CYS  27  -4.668   8.012  -1.493
  141    H    THR  28           H        THR  28  -7.702   7.504   0.387
  142    HA   THR  28           HA       THR  28  -8.736   4.799   0.826
  143    HB   THR  28           HB       THR  28 -10.213   7.425   1.084
  144    HG1  THR  28           HG1      THR  28  -8.381   7.242   2.515
  145   1HG2  THR  28          1HG2      THR  28 -11.968   6.099   1.369
  146   2HG2  THR  28          2HG2      THR  28 -11.237   5.653   2.912
  147   3HG2  THR  28          3HG2      THR  28 -10.964   4.654   1.484
  148    H    ASN  29           H        ASN  29  -8.987   3.867  -1.155
  149    HA   ASN  29           HA       ASN  29 -10.050   3.338  -3.037
  150   1HB   ASN  29          1HB       ASN  29 -11.502   5.978  -2.997
  151   2HB   ASN  29          2HB       ASN  29 -12.005   4.464  -3.754
  152   1HD2  ASN  29          1HD2      ASN  29 -12.642   6.463  -1.282
  153   2HD2  ASN  29          2HD2      ASN  29 -13.312   5.346  -0.147
  154    H    SER  30           H        SER  30 -10.740   5.084  -5.113
  155    HA   SER  30           HA       SER  30  -9.917   6.464  -6.771
  156   1HB   SER  30          1HB       SER  30  -8.495   7.406  -4.664
  157   2HB   SER  30          2HB       SER  30  -7.191   6.732  -5.639
  158    HG   SER  30           HG       SER  30  -9.128   8.628  -6.475
  159    H    GLN  31           H        GLN  31  -7.407   6.502  -7.940
  160    HA   GLN  31           HA       GLN  31  -6.702   3.688  -8.352
  161   1HB   GLN  31          1HB       GLN  31  -6.662   4.292 -10.883
  162   2HB   GLN  31          2HB       GLN  31  -8.197   3.881 -10.118
  163   1HG   GLN  31          1HG       GLN  31  -8.986   6.022 -10.241
  164   2HG   GLN  31          2HG       GLN  31  -7.375   6.737 -10.214
  165   1HE2  GLN  31          1HE2      GLN  31  -6.075   6.520 -12.154
  166   2HE2  GLN  31          2HE2      GLN  31  -6.859   6.479 -13.694
  167    H    HIS  32           H        HIS  32  -4.860   4.626  -7.056
  168    HA   HIS  32           HA       HIS  32  -2.589   4.876  -8.615
  169   1HB   HIS  32          1HB       HIS  32  -4.026   7.341  -8.463
  170   2HB   HIS  32          2HB       HIS  32  -2.518   7.523  -7.564
  171    HD1  HIS  32           HD1      HIS  32  -0.297   7.250  -8.921
  172    HD2  HIS  32           HD2      HIS  32  -3.759   7.173 -11.216
  173    HE1  HIS  32           HE1      HIS  32   0.467   7.540 -11.299
  174    HE2  HIS  32           HE2      HIS  32  -1.654   7.583 -12.660
  175    H    CYS  33           H        CYS  33  -3.378   3.543  -6.290
  176    HA   CYS  33           HA       CYS  33  -1.765   4.792  -4.178
  177   1HB   CYS  33          1HB       CYS  33  -3.794   2.553  -4.063
  178   2HB   CYS  33          2HB       CYS  33  -2.837   3.096  -2.684
  179    H    VAL  34           H        VAL  34  -0.553   3.540  -6.471
  180    HA   VAL  34           HA       VAL  34   0.292   0.913  -6.007
  181    HB   VAL  34           HB       VAL  34   2.327   1.597  -7.397
  182   1HG1  VAL  34          1HG1      VAL  34  -0.132   2.337  -8.883
  183   2HG1  VAL  34          2HG1      VAL  34  -0.074   0.747  -8.122
  184   3HG1  VAL  34          3HG1      VAL  34   1.151   1.202  -9.306
  185   1HG2  VAL  34          1HG2      VAL  34   1.306   4.180  -6.781
  186   2HG2  VAL  34          2HG2      VAL  34   1.178   3.935  -8.523
  187   3HG2  VAL  34          3HG2      VAL  34   2.737   3.755  -7.720
  188    H    LYS  35           H        LYS  35   1.285   3.914  -4.593
  189    HA   LYS  35           HA       LYS  35   3.447   2.518  -3.157
  190   1HB   LYS  35          1HB       LYS  35   4.133   4.435  -4.637
  191   2HB   LYS  35          2HB       LYS  35   3.189   5.498  -3.603
  192   1HG   LYS  35          1HG       LYS  35   5.621   5.497  -3.120
  193   2HG   LYS  35          2HG       LYS  35   4.614   5.069  -1.737
  194   1HD   LYS  35          1HD       LYS  35   5.521   3.028  -1.579
  195   2HD   LYS  35          2HD       LYS  35   5.416   2.756  -3.318
  196   1HE   LYS  35          1HE       LYS  35   7.745   2.789  -2.318
  197   2HE   LYS  35          2HE       LYS  35   7.473   3.829  -3.716
  198   1HZ   LYS  35          1HZ       LYS  35   7.771   5.681  -2.504
  199   2HZ   LYS  35          2HZ       LYS  35   8.612   4.654  -1.454
  200   3HZ   LYS  35          3HZ       LYS  35   7.002   5.058  -1.130
  201    H    ALA  36           H        ALA  36   0.750   2.330  -2.362
  202    HA   ALA  36           HA       ALA  36   0.640   4.053   0.020
  203   1HB   ALA  36          1HB       ALA  36  -1.280   3.884  -1.751
  204   2HB   ALA  36          2HB       ALA  36  -1.654   3.970  -0.030
  205   3HB   ALA  36          3HB       ALA  36  -1.688   2.416  -0.864
  206    H    ASN  37           H        ASN  37   0.827   3.198   1.996
  207    HA   ASN  37           HA       ASN  37   1.728   0.567   2.379
  208   1HB   ASN  37          1HB       ASN  37   1.738   2.804   3.902
  209   2HB   ASN  37          2HB       ASN  37   0.452   1.899   4.694
  210   1HD2  ASN  37          1HD2      ASN  37   1.007   0.416   6.132
  211   2HD2  ASN  37          2HD2      ASN  37   2.598  -0.217   6.362
  212    H    THR  38           H        THR  38  -1.467   1.933   2.358
  213    HA   THR  38           HA       THR  38  -2.642  -0.696   2.371
  214    HB   THR  38           HB       THR  38  -3.889   1.058   4.408
  215    HG1  THR  38           HG1      THR  38  -1.927   1.316   5.241
  216   1HG2  THR  38          1HG2      THR  38  -4.532  -1.357   3.751
  217   2HG2  THR  38          2HG2      THR  38  -4.507  -0.897   5.453
  218   3HG2  THR  38          3HG2      THR  38  -3.165  -1.813   4.768
  219    H    CYS  39           H        CYS  39  -4.329  -0.692   0.999
  220    HA   CYS  39           HA       CYS  39  -5.758   1.843   0.571
  221   1HB   CYS  39          1HB       CYS  39  -5.923   1.045  -1.893
  222   2HB   CYS  39          2HB       CYS  39  -4.426   1.799  -1.344
  223    H    THR  40           H        THR  40  -7.930   1.662  -0.074
  224    HA   THR  40           HA       THR  40  -9.119  -0.973   0.477
  225    HB   THR  40           HB       THR  40  -9.915   0.558   2.092
  226    HG1  THR  40           HG1      THR  40 -12.052   0.515   1.706
  227   1HG2  THR  40          1HG2      THR  40 -11.101   2.695   1.320
  228   2HG2  THR  40          2HG2      THR  40 -10.155   2.510  -0.157
  229   3HG2  THR  40          3HG2      THR  40  -9.339   2.688   1.397
  230    H    GLY  41           H        GLY  41 -11.433   1.104  -0.831
  231   1HA   GLY  41          1HA       GLY  41 -11.679  -0.403  -3.227
  232   2HA   GLY  41          2HA       GLY  41 -12.532   1.080  -2.848
  233    H    SER  42           H        SER  42  -9.244   0.013  -3.685
  234    HA   SER  42           HA       SER  42  -9.189   2.080  -5.732
  235   1HB   SER  42          1HB       SER  42  -8.197   2.873  -3.405
  236   2HB   SER  42          2HB       SER  42  -6.819   1.889  -3.886
  237    HG   SER  42           HG       SER  42  -6.944   3.154  -5.923
  238    H    THR  43           H        THR  43  -7.566   1.636  -7.321
  239    HA   THR  43           HA       THR  43  -6.770  -1.170  -7.238
  240    HB   THR  43           HB       THR  43  -7.280  -1.267  -9.413
  241    HG1  THR  43           HG1      THR  43  -6.397   0.061 -10.934
  242   1HG2  THR  43          1HG2      THR  43  -8.916   0.631  -8.356
  243   2HG2  THR  43          2HG2      THR  43  -9.075  -0.074  -9.969
  244   3HG2  THR  43          3HG2      THR  43  -8.244   1.467  -9.760
  245    H    ASP  44           H        ASP  44  -4.764  -0.398  -9.489
  246    HA   ASP  44           HA       ASP  44  -2.429  -0.569  -9.269
  247   1HB   ASP  44          1HB       ASP  44  -3.555   2.049  -9.475
  248   2HB   ASP  44          2HB       ASP  44  -2.067   2.156  -8.541
  249    H    CYS  45           H        CYS  45  -2.478  -1.917  -7.214
  250    HA   CYS  45           HA       CYS  45  -1.154  -0.398  -5.067
  251   1HB   CYS  45          1HB       CYS  45  -3.566  -2.158  -4.845
  252   2HB   CYS  45          2HB       CYS  45  -2.413  -2.117  -3.508
  253    H    ASN  46           H        ASN  46   0.864  -1.166  -5.370
  254    HA   ASN  46           HA       ASN  46   1.226  -4.083  -5.458
  255   1HB   ASN  46          1HB       ASN  46   2.178  -2.846  -7.365
  256   2HB   ASN  46          2HB       ASN  46   3.164  -1.895  -6.248
  257   1HD2  ASN  46          1HD2      ASN  46   5.033  -2.722  -5.493
  258   2HD2  ASN  46          2HD2      ASN  46   5.658  -4.271  -5.930
  259    H    THR  47           H        THR  47   2.270  -1.136  -3.810
  260    HA   THR  47           HA       THR  47   4.020  -2.598  -2.034
  261    HB   THR  47           HB       THR  47   4.397  -0.213  -2.848
  262    HG1  THR  47           HG1      THR  47   4.522  -0.931  -0.122
  263   1HG2  THR  47          1HG2      THR  47   3.459   1.564  -1.429
  264   2HG2  THR  47          2HG2      THR  47   2.354   0.384  -0.726
  265   3HG2  THR  47          3HG2      THR  47   2.248   0.778  -2.441
  266    H    ALA  48           H        ALA  48   0.721  -1.521  -2.052
  267    HA   ALA  48           HA       ALA  48   0.243  -1.468   0.724
  268   1HB   ALA  48          1HB       ALA  48  -1.810  -2.262  -1.320
  269   2HB   ALA  48          2HB       ALA  48  -1.246  -0.599  -1.150
  270   3HB   ALA  48          3HB       ALA  48  -2.045  -1.401   0.202
  271    H    GLN  49           H        GLN  49  -0.896  -3.012   2.037
  272    HA   GLN  49           HA       GLN  49  -0.098  -5.759   1.424
  273   1HB   GLN  49          1HB       GLN  49  -0.441  -6.210   3.787
  274   2HB   GLN  49          2HB       GLN  49   0.595  -4.804   3.584
  275   1HG   GLN  49          1HG       GLN  49  -0.747  -3.850   5.084
  276   2HG   GLN  49          2HG       GLN  49  -1.860  -3.649   3.732
  277   1HE2  GLN  49          1HE2      GLN  49  -3.707  -3.771   4.941
  278   2HE2  GLN  49          2HE2      GLN  49  -4.235  -5.217   5.722
  279    H    THR  50           H        THR  50  -2.700  -4.002   0.752
  280    HA   THR  50           HA       THR  50  -4.390  -6.184   0.292
  281    HB   THR  50           HB       THR  50  -4.509  -5.872   2.860
  282    HG1  THR  50           HG1      THR  50  -6.709  -6.429   2.801
  283   1HG2  THR  50          1HG2      THR  50  -6.512  -3.768   2.132
  284   2HG2  THR  50          2HG2      THR  50  -4.886  -3.387   2.702
  285   3HG2  THR  50          3HG2      THR  50  -5.997  -4.286   3.737
  286    H    CYS  51           H        CYS  51  -6.542  -5.470  -0.556
  287    HA   CYS  51           HA       CYS  51  -6.989  -2.693  -1.016
  288   1HB   CYS  51          1HB       CYS  51  -6.808  -3.438  -3.684
  289   2HB   CYS  51          2HB       CYS  51  -5.691  -2.397  -2.808
  290    H    THR  52           H        THR  52  -9.043  -3.229  -0.237
  291    HA   THR  52           HA       THR  52 -10.684  -5.219  -1.482
  292    HB   THR  52           HB       THR  52 -12.289  -3.270  -0.150
  293    HG1  THR  52           HG1      THR  52 -11.215  -2.831   1.645
  294   1HG2  THR  52          1HG2      THR  52 -11.351  -6.024   0.550
  295   2HG2  THR  52          2HG2      THR  52 -12.954  -5.491   0.045
  296   3HG2  THR  52          3HG2      THR  52 -12.350  -5.075   1.649
  297    H    ASN  53           H        ASN  53 -11.966  -5.017  -3.253
  298    HA   ASN  53           HA       ASN  53 -12.944  -4.105  -5.104
  299   1HB   ASN  53          1HB       ASN  53 -13.158  -1.732  -3.238
  300   2HB   ASN  53          2HB       ASN  53 -13.868  -1.759  -4.855
  301   1HD2  ASN  53          1HD2      ASN  53 -14.066  -2.939  -1.613
  302   2HD2  ASN  53          2HD2      ASN  53 -15.610  -3.702  -1.761
  303    H    SER  54           H        SER  54 -10.537  -4.383  -5.645
  304    HA   SER  54           HA       SER  54  -9.501  -1.845  -6.762
  305   1HB   SER  54          1HB       SER  54  -7.249  -2.564  -6.203
  306   2HB   SER  54          2HB       SER  54  -8.237  -2.585  -4.736
  307    HG   SER  54           HG       SER  54  -7.485  -4.794  -6.344
  308    H    LYS  55           H        LYS  55  -7.414  -2.759  -8.183
  309    HA   LYS  55           HA       LYS  55  -8.156  -5.131  -9.688
  310   1HB   LYS  55          1HB       LYS  55  -8.294  -2.353 -10.774
  311   2HB   LYS  55          2HB       LYS  55  -7.710  -3.631 -11.830
  312   1HG   LYS  55          1HG       LYS  55  -9.742  -4.634 -11.974
  313   2HG   LYS  55          2HG       LYS  55 -10.231  -4.129 -10.357
  314   1HD   LYS  55          1HD       LYS  55 -11.540  -2.994 -12.086
  315   2HD   LYS  55          2HD       LYS  55 -10.569  -1.850 -11.158
  316   1HE   LYS  55          1HE       LYS  55 -10.617  -1.550 -13.687
  317   2HE   LYS  55          2HE       LYS  55  -9.035  -1.561 -12.908
  318   1HZ   LYS  55          1HZ       LYS  55  -9.201  -2.913 -14.978
  319   2HZ   LYS  55          2HZ       LYS  55 -10.248  -3.959 -14.161
  320   3HZ   LYS  55          3HZ       LYS  55  -8.655  -3.772 -13.626
  321    H    ASP  56           H        ASP  56  -5.947  -3.843  -7.990
  322    HA   ASP  56           HA       ASP  56  -3.750  -4.957  -9.482
  323   1HB   ASP  56          1HB       ASP  56  -3.740  -2.078  -8.585
  324   2HB   ASP  56          2HB       ASP  56  -2.303  -2.957  -9.105
  325    H    CYS  57           H        CYS  57  -3.181  -6.414  -7.990
  326    HA   CYS  57           HA       CYS  57  -2.246  -5.487  -5.409
  327   1HB   CYS  57          1HB       CYS  57  -4.385  -7.623  -5.592
  328   2HB   CYS  57          2HB       CYS  57  -3.597  -7.066  -4.117
  329    H    PHE  58           H        PHE  58  -0.238  -6.141  -6.344
  330    HA   PHE  58           HA       PHE  58   0.122  -8.962  -6.944
  331   1HB   PHE  58          1HB       PHE  58   2.256  -6.831  -6.950
  332   2HB   PHE  58          2HB       PHE  58   2.257  -8.369  -7.806
  333    HD1  PHE  58           HD1      PHE  58   1.350  -8.584  -9.911
  334    HD2  PHE  58           HD2      PHE  58   0.734  -5.036  -7.651
  335    HE1  PHE  58           HE1      PHE  58   0.483  -7.461 -11.913
  336    HE2  PHE  58           HE2      PHE  58  -0.139  -3.910  -9.648
  337    HZ   PHE  58           HZ       PHE  58  -0.243  -5.138 -11.753
  338    H    GLU  59           H        GLU  59   0.663  -6.784  -4.309
  339    HA   GLU  59           HA       GLU  59   2.184  -8.900  -2.932
  340   1HB   GLU  59          1HB       GLU  59   3.113  -6.395  -3.496
  341   2HB   GLU  59          2HB       GLU  59   2.476  -6.178  -1.864
  342   1HG   GLU  59          1HG       GLU  59   4.558  -8.157  -2.758
  343   2HG   GLU  59          2HG       GLU  59   4.795  -6.745  -1.731
  344    H    ALA  60           H        ALA  60  -0.637  -6.966  -2.883
  345    HA   ALA  60           HA       ALA  60  -1.137  -6.695  -0.163
  346   1HB   ALA  60          1HB       ALA  60  -3.626  -7.213  -1.296
  347   2HB   ALA  60          2HB       ALA  60  -2.665  -6.516  -2.602
  348   3HB   ALA  60          3HB       ALA  60  -2.859  -5.638  -1.087
  349    H    ASN  61           H        ASN  61  -2.937  -7.891   1.020
  350    HA   ASN  61           HA       ASN  61  -2.419 -10.778   0.792
  351   1HB   ASN  61          1HB       ASN  61  -3.025  -8.986   3.120
  352   2HB   ASN  61          2HB       ASN  61  -3.374 -10.709   3.219
  353   1HD2  ASN  61          1HD2      ASN  61  -1.532 -12.149   2.597
  354   2HD2  ASN  61          2HD2      ASN  61   0.043 -11.689   3.137
  355    H    THR  62           H        THR  62  -4.975  -8.366   1.126
  356    HA   THR  62           HA       THR  62  -6.975 -10.500   0.805
  357    HB   THR  62           HB       THR  62  -7.844  -7.722   1.367
  358    HG1  THR  62           HG1      THR  62  -6.672  -9.321   3.390
  359   1HG2  THR  62          1HG2      THR  62  -8.709  -9.879   3.123
  360   2HG2  THR  62          2HG2      THR  62  -9.089 -10.144   1.422
  361   3HG2  THR  62          3HG2      THR  62  -9.653  -8.684   2.234
  362    H    CYS  63           H        CYS  63  -8.355 -10.544  -0.912
  363    HA   CYS  63           HA       CYS  63  -8.306  -8.321  -2.808
  364   1HB   CYS  63          1HB       CYS  63  -7.178 -11.013  -3.274
  365   2HB   CYS  63          2HB       CYS  63  -8.210 -10.390  -4.564
  366    H    THR  64           H        THR  64 -10.446  -7.862  -2.408
  367    HA   THR  64           HA       THR  64 -12.397  -9.988  -2.994
  368    HB   THR  64           HB       THR  64 -13.912  -7.996  -1.957
  369    HG1  THR  64           HG1      THR  64 -12.256  -6.629  -1.443
  370   1HG2  THR  64          1HG2      THR  64 -14.338  -9.457  -0.346
  371   2HG2  THR  64          2HG2      THR  64 -12.665  -9.446   0.216
  372   3HG2  THR  64          3HG2      THR  64 -13.142 -10.499  -1.115
  373    H    ASP  65           H        ASP  65 -12.907  -9.916  -5.100
  374    HA   ASP  65           HA       ASP  65 -13.657  -9.146  -7.108
  375   1HB   ASP  65          1HB       ASP  65 -15.363  -8.052  -5.500
  376   2HB   ASP  65          2HB       ASP  65 -14.449  -6.564  -5.768
  377    H    SER  66           H        SER  66 -11.268  -9.081  -7.462
  378    HA   SER  66           HA       SER  66 -10.553  -6.568  -8.658
  379   1HB   SER  66          1HB       SER  66  -9.834  -6.066  -6.403
  380   2HB   SER  66          2HB       SER  66  -8.978  -7.609  -6.292
  381    HG   SER  66           HG       SER  66  -7.424  -6.860  -7.589
  382    H    THR  67           H        THR  67  -9.060  -6.810 -10.279
  383    HA   THR  67           HA       THR  67  -8.269  -9.572 -10.840
  384    HB   THR  67           HB       THR  67  -9.410  -8.628 -12.679
  385    HG1  THR  67           HG1      THR  67  -7.849  -8.641 -14.262
  386   1HG2  THR  67          1HG2      THR  67  -9.608  -6.423 -12.777
  387   2HG2  THR  67          2HG2      THR  67  -8.064  -6.447 -13.628
  388   3HG2  THR  67          3HG2      THR  67  -8.108  -6.159 -11.889
  389    H    ASN  68           H        ASN  68  -6.156 -10.138 -11.410
  390    HA   ASN  68           HA       ASN  68  -3.860  -9.970 -11.495
  391   1HB   ASN  68          1HB       ASN  68  -4.054  -7.055 -10.713
  392   2HB   ASN  68          2HB       ASN  68  -2.731  -7.878 -11.547
  393   1HD2  ASN  68          1HD2      ASN  68  -3.871  -5.552 -12.502
  394   2HD2  ASN  68          2HD2      ASN  68  -4.705  -5.894 -13.977
  395    H    CYS  69           H        CYS  69  -4.907 -11.091  -9.355
  396    HA   CYS  69           HA       CYS  69  -3.530  -9.877  -7.050
  397   1HB   CYS  69          1HB       CYS  69  -5.985 -11.625  -7.193
  398   2HB   CYS  69          2HB       CYS  69  -5.101 -11.358  -5.688
  399    H    TYR  70           H        TYR  70  -1.572 -10.908  -7.933
  400    HA   TYR  70           HA       TYR  70  -1.455 -13.808  -7.768
  401   1HB   TYR  70          1HB       TYR  70   0.864 -11.959  -8.308
  402   2HB   TYR  70          2HB       TYR  70   0.684 -13.653  -8.771
  403    HD1  TYR  70           HD1      TYR  70  -0.190 -10.197  -9.593
  404    HD2  TYR  70           HD2      TYR  70  -0.683 -14.278 -10.690
  405    HE1  TYR  70           HE1      TYR  70  -1.061  -9.497 -11.784
  406    HE2  TYR  70           HE2      TYR  70  -1.555 -13.589 -12.884
  407    HH   TYR  70           HH       TYR  70  -2.804 -11.198 -13.701
  408    H    LYS  71           H        LYS  71  -2.041 -12.671  -5.301
  409    HA   LYS  71           HA       LYS  71  -0.204 -13.903  -3.617
  410   1HB   LYS  71          1HB       LYS  71   0.921 -11.589  -4.518
  411   2HB   LYS  71          2HB       LYS  71   0.129 -11.027  -3.047
  412   1HG   LYS  71          1HG       LYS  71   2.257 -11.607  -2.337
  413   2HG   LYS  71          2HG       LYS  71   1.283 -13.016  -1.907
  414   1HD   LYS  71          1HD       LYS  71   2.236 -14.336  -3.516
  415   2HD   LYS  71          2HD       LYS  71   2.588 -12.972  -4.580
  416   1HE   LYS  71          1HE       LYS  71   4.248 -12.287  -2.694
  417   2HE   LYS  71          2HE       LYS  71   4.114 -13.977  -2.213
  418   1HZ   LYS  71          1HZ       LYS  71   4.723 -14.555  -4.543
  419   2HZ   LYS  71          2HZ       LYS  71   5.953 -13.786  -3.674
  420   3HZ   LYS  71          3HZ       LYS  71   5.058 -12.918  -4.817
  421    H    ALA  72           H        ALA  72  -3.012 -13.657  -3.933
  422    HA   ALA  72           HA       ALA  72  -3.851 -12.186  -1.536
  423   1HB   ALA  72          1HB       ALA  72  -5.145 -11.606  -3.446
  424   2HB   ALA  72          2HB       ALA  72  -6.164 -12.608  -2.412
  425   3HB   ALA  72          3HB       ALA  72  -5.418 -13.301  -3.852
  426    H    THR  73           H        THR  73  -5.029 -13.173   0.111
  427    HA   THR  73           HA       THR  73  -4.423 -15.970   0.500
  428    HB   THR  73           HB       THR  73  -4.183 -14.365   2.347
  429    HG1  THR  73           HG1      THR  73  -6.189 -16.329   2.728
  430   1HG2  THR  73          1HG2      THR  73  -5.827 -13.100   3.246
  431   2HG2  THR  73          2HG2      THR  73  -7.105 -14.218   2.772
  432   3HG2  THR  73          3HG2      THR  73  -6.393 -13.134   1.576
  433    H    ALA  74           H        ALA  74  -7.234 -14.005  -0.221
  434    HA   ALA  74           HA       ALA  74  -8.752 -16.446  -0.752
  435   1HB   ALA  74          1HB       ALA  74  -9.313 -15.808   1.553
  436   2HB   ALA  74          2HB       ALA  74 -10.701 -15.677   0.471
  437   3HB   ALA  74          3HB       ALA  74  -9.834 -14.225   0.976
  438    H    CYS  75           H        CYS  75 -10.273 -16.256  -2.368
  439    HA   CYS  75           HA       CYS  75 -10.915 -13.636  -3.443
  440   1HB   CYS  75          1HB       CYS  75  -8.859 -14.156  -4.634
  441   2HB   CYS  75          2HB       CYS  75  -9.489 -15.739  -5.095
  442    H    THR  76           H        THR  76 -12.948 -13.563  -4.187
  443    HA   THR  76           HA       THR  76 -14.465 -16.057  -4.267
  444    HB   THR  76           HB       THR  76 -15.408 -13.185  -4.397
  445    HG1  THR  76           HG1      THR  76 -15.186 -13.241  -2.330
  446   1HG2  THR  76          1HG2      THR  76 -17.549 -13.851  -4.444
  447   2HG2  THR  76          2HG2      THR  76 -17.232 -15.309  -3.503
  448   3HG2  THR  76          3HG2      THR  76 -16.868 -15.275  -5.228
  449    H    ASN  77           H        ASN  77 -14.462 -13.080  -6.221
  450    HA   ASN  77           HA       ASN  77 -14.361 -14.682  -8.660
  451   1HB   ASN  77          1HB       ASN  77 -16.765 -14.359  -8.194
  452   2HB   ASN  77          2HB       ASN  77 -16.512 -12.611  -8.137
  453   1HD2  ASN  77          1HD2      ASN  77 -17.893 -12.191  -9.825
  454   2HD2  ASN  77          2HD2      ASN  77 -17.526 -12.604 -11.462
  455    H    SER  78           H        SER  78 -12.436 -13.880  -9.339
  456    HA   SER  78           HA       SER  78 -12.380 -11.169 -10.299
  457   1HB   SER  78          1HB       SER  78 -10.940 -10.202  -8.847
  458   2HB   SER  78          2HB       SER  78 -11.641 -11.373  -7.727
  459    HG   SER  78           HG       SER  78  -9.398 -11.483  -7.613
  460    H    SER  79           H        SER  79  -9.781 -10.770 -10.841
  461    HA   SER  79           HA       SER  79  -9.012 -13.124 -12.426
  462   1HB   SER  79          1HB       SER  79  -9.455 -10.410 -13.223
  463   2HB   SER  79          2HB       SER  79  -7.773 -10.844 -13.526
  464    HG   SER  79           HG       SER  79  -8.424 -12.474 -14.842
  465    H    GLY  80           H        GLY  80  -6.775 -13.504 -12.801
  466   1HA   GLY  80          1HA       GLY  80  -4.624 -13.804 -12.072
  467   2HA   GLY  80          2HA       GLY  80  -4.677 -12.110 -11.597
  468    H    CYS  81           H        CYS  81  -7.050 -14.093 -10.130
  469    HA   CYS  81           HA       CYS  81  -5.496 -14.064  -7.634
  470   1HB   CYS  81          1HB       CYS  81  -7.491 -13.747  -6.445
  471   2HB   CYS  81          2HB       CYS  81  -7.716 -12.765  -7.889
  472    HA   PRO  82           HA       PRO  82  -5.546 -18.392  -6.773
  473   1HB   PRO  82          1HB       PRO  82  -7.943 -18.098  -5.008
  474   2HB   PRO  82          2HB       PRO  82  -6.418 -18.949  -4.705
  475   1HG   PRO  82          1HG       PRO  82  -6.854 -16.571  -3.614
  476   2HG   PRO  82          2HG       PRO  82  -5.256 -16.982  -4.267
  477   1HD   PRO  82          1HD       PRO  82  -7.367 -15.210  -5.394
  478   2HD   PRO  82          2HD       PRO  82  -5.602 -15.067  -5.499
  479    H    GLY  83           H        GLY  83  -8.879 -17.179  -7.087
  480   1HA   GLY  83          1HA       GLY  83  -9.725 -18.202  -9.370
  481   2HA   GLY  83          2HA       GLY  83  -9.668 -19.666  -8.402
  482    H    HIS  84           H        HIS  84 -12.031 -19.402  -9.235
  483    HA   HIS  84           HA       HIS  84 -13.548 -18.026  -7.117
  484   1HB   HIS  84          1HB       HIS  84 -15.413 -17.991  -8.938
  485   2HB   HIS  84          2HB       HIS  84 -14.133 -16.784  -8.993
  486    HD1  HIS  84           HD1      HIS  84 -12.862 -16.612 -11.128
  487    HD2  HIS  84           HD2      HIS  84 -14.976 -20.178 -10.842
  488    HE1  HIS  84           HE1      HIS  84 -12.604 -17.729 -13.367
  489    HE2  HIS  84           HE2      HIS  84 -13.820 -19.923 -13.140
  Start of MODEL    9
    1   1H    GLN   1          1H        GLN   1  -8.027  23.420   0.772
    2   2H    GLN   1          2H        GLN   1  -8.252  22.708  -0.774
    3   3H    GLN   1          3H        GLN   1  -6.670  22.898  -0.135
    4    HA   GLN   1           HA       GLN   1  -7.170  21.382   1.621
    5   1HB   GLN   1          1HB       GLN   1  -9.751  22.056   1.132
    6   2HB   GLN   1          2HB       GLN   1  -9.672  20.505   0.306
    7   1HG   GLN   1          1HG       GLN   1 -10.241  19.720   2.332
    8   2HG   GLN   1          2HG       GLN   1  -8.506  19.834   2.623
    9   1HE2  GLN   1          1HE2      GLN   1 -11.276  22.059   2.638
   10   2HE2  GLN   1          2HE2      GLN   1 -10.917  22.768   4.171
   11    H    CYS   2           H        CYS   2  -8.063  18.874   0.928
   12    HA   CYS   2           HA       CYS   2  -6.508  18.298  -1.507
   13   1HB   CYS   2          1HB       CYS   2  -6.746  16.751   1.073
   14   2HB   CYS   2          2HB       CYS   2  -6.097  16.042  -0.403
   15    H    THR   3           H        THR   3  -8.568  18.586  -2.640
   16    HA   THR   3           HA       THR   3 -10.399  16.307  -2.317
   17    HB   THR   3           HB       THR   3 -11.722  17.920  -4.023
   18    HG1  THR   3           HG1      THR   3 -10.285  19.702  -2.355
   19   1HG2  THR   3          1HG2      THR   3 -12.517  19.120  -1.773
   20   2HG2  THR   3          2HG2      THR   3 -11.702  17.715  -1.087
   21   3HG2  THR   3          3HG2      THR   3 -13.019  17.495  -2.238
   22    H    GLY   4           H        GLY   4  -9.451  18.383  -5.059
   23   1HA   GLY   4          1HA       GLY   4  -8.824  17.862  -7.204
   24   2HA   GLY   4          2HA       GLY   4  -8.113  16.401  -6.522
   25    H    GLY   5           H        GLY   5 -10.471  17.623  -8.569
   26   1HA   GLY   5          1HA       GLY   5 -12.404  15.513  -8.277
   27   2HA   GLY   5          2HA       GLY   5 -12.355  16.714  -9.558
   28    H    ALA   6           H        ALA   6  -9.653  16.137 -10.380
   29    HA   ALA   6           HA       ALA   6 -10.095  13.506 -11.636
   30   1HB   ALA   6          1HB       ALA   6  -8.254  15.393 -12.953
   31   2HB   ALA   6          2HB       ALA   6  -9.954  15.858 -12.941
   32   3HB   ALA   6          3HB       ALA   6  -9.467  14.317 -13.644
   33    H    ASP   7           H        ASP   7  -7.715  15.675 -10.202
   34    HA   ASP   7           HA       ASP   7  -6.042  13.365  -9.585
   35   1HB   ASP   7          1HB       ASP   7  -3.997  14.739 -10.247
   36   2HB   ASP   7          2HB       ASP   7  -4.966  14.084 -11.571
   37    H    CYS   8           H        CYS   8  -4.257  13.986  -8.041
   38    HA   CYS   8           HA       CYS   8  -4.947  16.304  -6.387
   39   1HB   CYS   8          1HB       CYS   8  -5.025  13.438  -5.581
   40   2HB   CYS   8          2HB       CYS   8  -4.393  14.599  -4.411
   41    H    THR   9           H        THR   9  -2.784  15.874  -8.222
   42    HA   THR   9           HA       THR   9  -0.420  15.187  -6.772
   43    HB   THR   9           HB       THR   9  -0.710  16.718  -9.364
   44    HG1  THR   9           HG1      THR   9  -1.184  14.869 -10.191
   45   1HG2  THR   9          1HG2      THR   9   1.487  16.846  -9.473
   46   2HG2  THR   9          2HG2      THR   9   1.621  15.102  -9.254
   47   3HG2  THR   9          3HG2      THR   9   1.600  16.168  -7.850
   48    H    SER  10           H        SER  10  -0.723  16.555  -4.897
   49    HA   SER  10           HA       SER  10   0.765  18.967  -5.074
   50   1HB   SER  10          1HB       SER  10  -0.867  20.612  -4.639
   51   2HB   SER  10          2HB       SER  10  -1.581  19.620  -5.910
   52    HG   SER  10           HG       SER  10  -2.349  19.958  -3.284
   53    H    CYS  11           H        CYS  11  -1.540  17.056  -3.193
   54    HA   CYS  11           HA       CYS  11  -0.598  18.021  -0.665
   55   1HB   CYS  11          1HB       CYS  11  -2.212  15.525  -1.214
   56   2HB   CYS  11          2HB       CYS  11  -2.082  16.391   0.313
   57    H    THR  12           H        THR  12  -0.316  15.788   0.894
   58    HA   THR  12           HA       THR  12   1.827  14.183  -0.269
   59    HB   THR  12           HB       THR  12   3.200  14.620   1.838
   60    HG1  THR  12           HG1      THR  12   1.574  16.936   1.958
   61   1HG2  THR  12          1HG2      THR  12   2.888  17.091   0.175
   62   2HG2  THR  12          2HG2      THR  12   3.661  15.631  -0.442
   63   3HG2  THR  12          3HG2      THR  12   4.336  16.463   0.959
   64    H    GLY  13           H        GLY  13  -0.252  14.838   2.520
   65   1HA   GLY  13          1HA       GLY  13   0.177  12.499   3.958
   66   2HA   GLY  13          2HA       GLY  13  -1.315  13.424   3.978
   67    H    ALA  14           H        ALA  14  -3.096  12.563   3.073
   68    HA   ALA  14           HA       ALA  14  -2.750  10.116   1.464
   69   1HB   ALA  14          1HB       ALA  14  -5.113   9.596   2.480
   70   2HB   ALA  14          2HB       ALA  14  -4.574  10.696   3.748
   71   3HB   ALA  14          3HB       ALA  14  -3.644   9.241   3.388
   72    H    CYS  15           H        CYS  15  -4.435   9.665  -0.086
   73    HA   CYS  15           HA       CYS  15  -5.542  12.133  -1.209
   74   1HB   CYS  15          1HB       CYS  15  -5.418   9.424  -2.533
   75   2HB   CYS  15          2HB       CYS  15  -5.687  10.984  -3.302
   76    H    THR  16           H        THR  16  -7.697  12.245  -1.954
   77    HA   THR  16           HA       THR  16  -9.540  10.175  -1.014
   78    HB   THR  16           HB       THR  16 -11.018  12.278  -0.328
   79    HG1  THR  16           HG1      THR  16  -8.368  13.157   0.165
   80   1HG2  THR  16          1HG2      THR  16  -9.563  10.387   1.103
   81   2HG2  THR  16          2HG2      THR  16 -10.848  11.434   1.706
   82   3HG2  THR  16          3HG2      THR  16  -9.163  11.940   1.837
   83    H    GLY  17           H        GLY  17 -10.031   9.588  -3.109
   84   1HA   GLY  17          1HA       GLY  17 -11.233   9.675  -5.072
   85   2HA   GLY  17          2HA       GLY  17 -11.988  11.148  -4.460
   86    H    CYS  18           H        CYS  18  -8.934   9.966  -5.848
   87    HA   CYS  18           HA       CYS  18  -8.860  12.293  -7.602
   88   1HB   CYS  18          1HB       CYS  18  -6.370  11.605  -6.061
   89   2HB   CYS  18          2HB       CYS  18  -6.743  13.079  -6.957
   90    H    GLY  19           H        GLY  19  -8.258  11.715  -9.593
   91   1HA   GLY  19          1HA       GLY  19  -7.832   9.105 -10.385
   92   2HA   GLY  19          2HA       GLY  19  -7.349  10.512 -11.328
   93    H    ASN  20           H        ASN  20  -5.470  11.381  -9.171
   94    HA   ASN  20           HA       ASN  20  -3.494   9.246  -9.143
   95   1HB   ASN  20          1HB       ASN  20  -2.810  11.929 -10.352
   96   2HB   ASN  20          2HB       ASN  20  -1.768  10.514 -10.237
   97   1HD2  ASN  20          1HD2      ASN  20  -4.543  11.911 -11.822
   98   2HD2  ASN  20          2HD2      ASN  20  -4.557  10.837 -13.174
   99    H    CYS  21           H        CYS  21  -1.433  10.036  -8.011
  100    HA   CYS  21           HA       CYS  21  -2.062  12.024  -5.943
  101   1HB   CYS  21          1HB       CYS  21  -0.979   9.238  -5.499
  102   2HB   CYS  21          2HB       CYS  21  -0.941  10.508  -4.273
  103    HA   PRO  22           HA       PRO  22   2.111  13.311  -6.626
  104   1HB   PRO  22          1HB       PRO  22   2.646  14.636  -4.354
  105   2HB   PRO  22          2HB       PRO  22   1.429  15.204  -5.498
  106   1HG   PRO  22          1HG       PRO  22   1.077  13.861  -2.878
  107   2HG   PRO  22          2HG       PRO  22   0.048  15.059  -3.676
  108   1HD   PRO  22          1HD       PRO  22  -0.353  12.270  -3.605
  109   2HD   PRO  22          2HD       PRO  22  -1.216  13.436  -4.624
  110    H    ASN  23           H        ASN  23   1.746  12.030  -3.319
  111    HA   ASN  23           HA       ASN  23   3.657  10.001  -3.594
  112   1HB   ASN  23          1HB       ASN  23   5.240  11.283  -1.810
  113   2HB   ASN  23          2HB       ASN  23   5.535  11.280  -3.550
  114   1HD2  ASN  23          1HD2      ASN  23   2.994  13.039  -1.854
  115   2HD2  ASN  23          2HD2      ASN  23   3.583  14.616  -2.235
  116    H    ALA  24           H        ALA  24   1.202   9.918  -2.596
  117    HA   ALA  24           HA       ALA  24   1.198  10.238   0.278
  118   1HB   ALA  24          1HB       ALA  24  -0.920   8.818  -1.298
  119   2HB   ALA  24          2HB       ALA  24  -0.786  10.577  -1.322
  120   3HB   ALA  24          3HB       ALA  24  -1.078   9.735   0.200
  121    H    VAL  25           H        VAL  25   1.315   8.645   1.803
  122    HA   VAL  25           HA       VAL  25   2.401   6.100   0.923
  123    HB   VAL  25           HB       VAL  25   3.092   5.716   3.132
  124   1HG1  VAL  25          1HG1      VAL  25   3.877   7.947   1.847
  125   2HG1  VAL  25          2HG1      VAL  25   4.565   7.403   3.376
  126   3HG1  VAL  25          3HG1      VAL  25   3.312   8.643   3.365
  127   1HG2  VAL  25          1HG2      VAL  25   2.279   6.973   5.077
  128   2HG2  VAL  25          2HG2      VAL  25   0.972   6.111   4.264
  129   3HG2  VAL  25          3HG2      VAL  25   1.158   7.851   4.036
  130    H    THR  26           H        THR  26  -0.632   7.199   1.178
  131    HA   THR  26           HA       THR  26  -1.745   4.560   1.439
  132    HB   THR  26           HB       THR  26  -3.440   5.720   3.191
  133    HG1  THR  26           HG1      THR  26  -0.895   6.724   3.920
  134   1HG2  THR  26          1HG2      THR  26  -0.869   4.452   4.095
  135   2HG2  THR  26          2HG2      THR  26  -2.265   3.558   3.492
  136   3HG2  THR  26          3HG2      THR  26  -2.401   4.515   4.966
  137    H    CYS  27           H        CYS  27  -4.078   4.547   0.930
  138    HA   CYS  27           HA       CYS  27  -5.149   6.994  -0.209
  139   1HB   CYS  27          1HB       CYS  27  -4.235   4.669  -1.841
  140   2HB   CYS  27          2HB       CYS  27  -5.694   5.529  -2.343
  141    H    THR  28           H        THR  28  -7.329   7.047  -0.343
  142    HA   THR  28           HA       THR  28  -8.795   4.615   0.443
  143    HB   THR  28           HB       THR  28  -9.663   7.416   1.155
  144    HG1  THR  28           HG1      THR  28  -8.132   7.412   2.570
  145   1HG2  THR  28          1HG2      THR  28 -10.449   5.541   3.082
  146   2HG2  THR  28          2HG2      THR  28 -10.814   4.828   1.510
  147   3HG2  THR  28          3HG2      THR  28 -11.467   6.411   1.934
  148    H    ASN  29           H        ASN  29  -9.363   4.065  -1.643
  149    HA   ASN  29           HA       ASN  29 -10.818   3.981  -3.363
  150   1HB   ASN  29          1HB       ASN  29 -12.743   5.125  -3.203
  151   2HB   ASN  29          2HB       ASN  29 -12.077   5.860  -1.746
  152   1HD2  ASN  29          1HD2      ASN  29 -12.899   6.302  -5.064
  153   2HD2  ASN  29          2HD2      ASN  29 -12.617   8.005  -5.133
  154    H    SER  30           H        SER  30 -11.219   5.305  -5.429
  155    HA   SER  30           HA       SER  30 -10.448   6.570  -7.204
  156   1HB   SER  30          1HB       SER  30  -9.192   7.862  -5.106
  157   2HB   SER  30          2HB       SER  30  -7.856   7.379  -6.151
  158    HG   SER  30           HG       SER  30  -9.173   8.311  -7.902
  159    H    GLN  31           H        GLN  31  -7.773   6.783  -8.132
  160    HA   GLN  31           HA       GLN  31  -6.796   4.022  -8.131
  161   1HB   GLN  31          1HB       GLN  31  -6.653   5.082 -10.812
  162   2HB   GLN  31          2HB       GLN  31  -7.362   3.572 -10.243
  163   1HG   GLN  31          1HG       GLN  31  -9.367   5.031  -9.550
  164   2HG   GLN  31          2HG       GLN  31  -8.661   6.240 -10.622
  165   1HE2  GLN  31          1HE2      GLN  31 -10.949   3.989 -10.498
  166   2HE2  GLN  31          2HE2      GLN  31 -10.995   3.479 -12.148
  167    H    HIS  32           H        HIS  32  -4.752   3.914  -9.599
  168    HA   HIS  32           HA       HIS  32  -2.598   4.514  -9.975
  169   1HB   HIS  32          1HB       HIS  32  -4.031   6.707 -10.731
  170   2HB   HIS  32          2HB       HIS  32  -2.950   7.399  -9.519
  171    HD1  HIS  32           HD1      HIS  32  -0.766   8.134 -10.403
  172    HD2  HIS  32           HD2      HIS  32  -2.453   5.152 -12.753
  173    HE1  HIS  32           HE1      HIS  32   0.806   7.837 -12.342
  174    HE2  HIS  32           HE2      HIS  32  -0.188   5.964 -13.702
  175    H    CYS  33           H        CYS  33  -3.375   3.838  -7.319
  176    HA   CYS  33           HA       CYS  33  -1.525   5.531  -5.767
  177   1HB   CYS  33          1HB       CYS  33  -4.024   4.065  -4.964
  178   2HB   CYS  33          2HB       CYS  33  -2.800   4.493  -3.766
  179    H    VAL  34           H        VAL  34  -0.317   3.706  -7.282
  180    HA   VAL  34           HA       VAL  34  -0.046   1.106  -6.288
  181    HB   VAL  34           HB       VAL  34   2.273   1.220  -7.370
  182   1HG1  VAL  34          1HG1      VAL  34  -0.142   0.665  -8.383
  183   2HG1  VAL  34          2HG1      VAL  34   1.339   0.610  -9.338
  184   3HG1  VAL  34          3HG1      VAL  34   0.295   2.029  -9.411
  185   1HG2  VAL  34          1HG2      VAL  34   3.092   3.152  -8.110
  186   2HG2  VAL  34          2HG2      VAL  34   1.777   3.957  -7.253
  187   3HG2  VAL  34          3HG2      VAL  34   1.593   3.537  -8.956
  188    H    LYS  35           H        LYS  35   1.090   4.077  -4.988
  189    HA   LYS  35           HA       LYS  35   2.997   2.652  -3.274
  190   1HB   LYS  35          1HB       LYS  35   3.806   4.609  -4.624
  191   2HB   LYS  35          2HB       LYS  35   2.736   5.634  -3.678
  192   1HG   LYS  35          1HG       LYS  35   3.997   4.658  -1.640
  193   2HG   LYS  35          2HG       LYS  35   5.217   4.204  -2.831
  194   1HD   LYS  35          1HD       LYS  35   4.362   6.916  -3.257
  195   2HD   LYS  35          2HD       LYS  35   4.882   6.694  -1.584
  196   1HE   LYS  35          1HE       LYS  35   7.010   5.825  -2.313
  197   2HE   LYS  35          2HE       LYS  35   6.490   5.871  -3.997
  198   1HZ   LYS  35          1HZ       LYS  35   6.622   8.304  -2.315
  199   2HZ   LYS  35          2HZ       LYS  35   6.511   8.205  -4.000
  200   3HZ   LYS  35          3HZ       LYS  35   7.944   7.757  -3.219
  201    H    ALA  36           H        ALA  36   0.248   2.382  -2.762
  202    HA   ALA  36           HA       ALA  36  -0.201   4.093  -0.415
  203   1HB   ALA  36          1HB       ALA  36  -2.534   3.095  -0.525
  204   2HB   ALA  36          2HB       ALA  36  -2.063   2.430  -2.089
  205   3HB   ALA  36          3HB       ALA  36  -2.074   4.176  -1.839
  206    H    ASN  37           H        ASN  37   0.044   3.291   1.578
  207    HA   ASN  37           HA       ASN  37   1.027   0.689   2.027
  208   1HB   ASN  37          1HB       ASN  37   1.280   2.798   3.492
  209   2HB   ASN  37          2HB       ASN  37  -0.287   2.356   4.164
  210   1HD2  ASN  37          1HD2      ASN  37   2.780   2.288   4.906
  211   2HD2  ASN  37          2HD2      ASN  37   2.900   0.794   5.766
  212    H    THR  38           H        THR  38  -2.198   2.033   2.087
  213    HA   THR  38           HA       THR  38  -3.302  -0.654   2.225
  214    HB   THR  38           HB       THR  38  -4.619   1.327   4.011
  215    HG1  THR  38           HG1      THR  38  -3.109   1.310   5.471
  216   1HG2  THR  38          1HG2      THR  38  -5.697  -0.449   4.756
  217   2HG2  THR  38          2HG2      THR  38  -4.181  -1.268   5.134
  218   3HG2  THR  38          3HG2      THR  38  -4.881  -1.411   3.522
  219    H    CYS  39           H        CYS  39  -4.806  -0.831   0.697
  220    HA   CYS  39           HA       CYS  39  -6.046   1.626  -0.329
  221   1HB   CYS  39          1HB       CYS  39  -6.299  -0.987  -1.753
  222   2HB   CYS  39          2HB       CYS  39  -6.220   0.646  -2.413
  223    H    THR  40           H        THR  40  -8.282   1.612  -0.901
  224    HA   THR  40           HA       THR  40  -9.982  -0.483   0.163
  225    HB   THR  40           HB       THR  40 -10.751   2.234   1.075
  226    HG1  THR  40           HG1      THR  40  -8.657   0.760   2.289
  227   1HG2  THR  40          1HG2      THR  40 -10.879   0.474   3.195
  228   2HG2  THR  40          2HG2      THR  40 -11.305  -0.509   1.793
  229   3HG2  THR  40          3HG2      THR  40 -12.212   0.962   2.149
  230    H    GLY  41           H        GLY  41 -10.544  -0.729  -2.037
  231   1HA   GLY  41          1HA       GLY  41 -12.085  -0.414  -3.750
  232   2HA   GLY  41          2HA       GLY  41 -12.667   1.016  -2.909
  233    H    SER  42           H        SER  42  -9.580   0.002  -4.357
  234    HA   SER  42           HA       SER  42  -9.697   2.369  -6.053
  235   1HB   SER  42          1HB       SER  42  -8.012   2.102  -3.720
  236   2HB   SER  42          2HB       SER  42  -6.997   2.154  -5.158
  237    HG   SER  42           HG       SER  42  -7.302   4.237  -4.642
  238    H    THR  43           H        THR  43  -6.962   1.965  -6.959
  239    HA   THR  43           HA       THR  43  -6.972  -0.805  -7.844
  240    HB   THR  43           HB       THR  43  -7.124  -0.405 -10.087
  241    HG1  THR  43           HG1      THR  43  -6.177   1.220 -11.072
  242   1HG2  THR  43          1HG2      THR  43  -8.705   1.552 -10.541
  243   2HG2  THR  43          2HG2      THR  43  -8.709   1.776  -8.790
  244   3HG2  THR  43          3HG2      THR  43  -9.260   0.252  -9.487
  245    H    ASP  44           H        ASP  44  -4.821   0.219  -9.885
  246    HA   ASP  44           HA       ASP  44  -2.505  -0.359  -9.516
  247   1HB   ASP  44          1HB       ASP  44  -3.304   2.485  -9.424
  248   2HB   ASP  44          2HB       ASP  44  -1.640   2.139  -8.962
  249    H    CYS  45           H        CYS  45  -2.601  -1.692  -7.531
  250    HA   CYS  45           HA       CYS  45  -1.411  -0.248  -5.260
  251   1HB   CYS  45          1HB       CYS  45  -3.803  -2.046  -5.276
  252   2HB   CYS  45          2HB       CYS  45  -2.748  -2.041  -3.859
  253    H    ASN  46           H        ASN  46   0.604  -1.071  -6.075
  254    HA   ASN  46           HA       ASN  46   0.962  -3.967  -5.954
  255   1HB   ASN  46          1HB       ASN  46   1.902  -2.905  -7.909
  256   2HB   ASN  46          2HB       ASN  46   2.793  -1.754  -6.905
  257   1HD2  ASN  46          1HD2      ASN  46   4.868  -2.188  -6.937
  258   2HD2  ASN  46          2HD2      ASN  46   5.587  -3.758  -6.893
  259    H    THR  47           H        THR  47   2.117  -1.008  -4.360
  260    HA   THR  47           HA       THR  47   3.948  -2.422  -2.669
  261    HB   THR  47           HB       THR  47   3.971   0.081  -3.401
  262    HG1  THR  47           HG1      THR  47   5.590  -0.541  -2.117
  263   1HG2  THR  47          1HG2      THR  47   3.160   1.608  -1.657
  264   2HG2  THR  47          2HG2      THR  47   2.308   0.264  -0.899
  265   3HG2  THR  47          3HG2      THR  47   1.848   0.800  -2.515
  266    H    ALA  48           H        ALA  48   0.644  -1.257  -2.353
  267    HA   ALA  48           HA       ALA  48   0.272  -1.499   0.380
  268   1HB   ALA  48          1HB       ALA  48  -1.920  -1.171  -0.043
  269   2HB   ALA  48          2HB       ALA  48  -1.972  -2.393  -1.313
  270   3HB   ALA  48          3HB       ALA  48  -1.319  -0.793  -1.657
  271    H    GLN  49           H        GLN  49  -0.859  -3.139   1.615
  272    HA   GLN  49           HA       GLN  49   0.009  -5.833   0.848
  273   1HB   GLN  49          1HB       GLN  49  -0.239  -6.404   3.207
  274   2HB   GLN  49          2HB       GLN  49   0.795  -4.994   3.018
  275   1HG   GLN  49          1HG       GLN  49  -0.912  -3.531   3.757
  276   2HG   GLN  49          2HG       GLN  49  -2.132  -4.799   3.662
  277   1HE2  GLN  49          1HE2      GLN  49  -2.732  -4.583   5.799
  278   2HE2  GLN  49          2HE2      GLN  49  -1.726  -5.094   7.107
  279    H    THR  50           H        THR  50  -2.616  -4.116   0.300
  280    HA   THR  50           HA       THR  50  -4.306  -6.295  -0.138
  281    HB   THR  50           HB       THR  50  -4.338  -6.019   2.444
  282    HG1  THR  50           HG1      THR  50  -6.106  -7.125   2.274
  283   1HG2  THR  50          1HG2      THR  50  -6.442  -3.986   1.830
  284   2HG2  THR  50          2HG2      THR  50  -4.796  -3.527   2.270
  285   3HG2  THR  50          3HG2      THR  50  -5.782  -4.462   3.396
  286    H    CYS  51           H        CYS  51  -6.460  -5.614  -0.925
  287    HA   CYS  51           HA       CYS  51  -7.214  -2.939  -1.225
  288   1HB   CYS  51          1HB       CYS  51  -6.728  -2.963  -3.834
  289   2HB   CYS  51          2HB       CYS  51  -5.550  -2.343  -2.680
  290    H    THR  52           H        THR  52  -9.327  -3.039  -1.526
  291    HA   THR  52           HA       THR  52 -10.446  -5.381  -2.894
  292    HB   THR  52           HB       THR  52 -11.176  -4.730  -0.528
  293    HG1  THR  52           HG1      THR  52 -12.985  -5.115  -2.657
  294   1HG2  THR  52          1HG2      THR  52 -11.696  -2.255  -1.685
  295   2HG2  THR  52          2HG2      THR  52 -12.168  -2.807  -0.078
  296   3HG2  THR  52          3HG2      THR  52 -13.277  -2.994  -1.437
  297    H    ASN  53           H        ASN  53 -11.859  -5.165  -4.627
  298    HA   ASN  53           HA       ASN  53 -12.733  -4.237  -6.513
  299   1HB   ASN  53          1HB       ASN  53 -13.535  -2.577  -4.453
  300   2HB   ASN  53          2HB       ASN  53 -12.805  -1.456  -5.605
  301   1HD2  ASN  53          1HD2      ASN  53 -15.355  -3.749  -5.048
  302   2HD2  ASN  53          2HD2      ASN  53 -16.321  -3.311  -6.412
  303    H    SER  54           H        SER  54  -9.780  -4.109  -5.807
  304    HA   SER  54           HA       SER  54  -8.900  -1.851  -7.442
  305   1HB   SER  54          1HB       SER  54  -7.455  -1.920  -5.667
  306   2HB   SER  54          2HB       SER  54  -7.624  -3.666  -5.457
  307    HG   SER  54           HG       SER  54  -5.738  -2.281  -6.798
  308    H    LYS  55           H        LYS  55  -6.944  -2.455  -8.935
  309    HA   LYS  55           HA       LYS  55  -7.471  -5.001 -10.293
  310   1HB   LYS  55          1HB       LYS  55  -6.959  -2.478 -11.852
  311   2HB   LYS  55          2HB       LYS  55  -7.564  -4.020 -12.439
  312   1HG   LYS  55          1HG       LYS  55  -9.699  -3.603 -11.763
  313   2HG   LYS  55          2HG       LYS  55  -9.193  -2.566 -10.429
  314   1HD   LYS  55          1HD       LYS  55 -10.105  -1.045 -11.916
  315   2HD   LYS  55          2HD       LYS  55  -8.387  -0.971 -12.312
  316   1HE   LYS  55          1HE       LYS  55  -8.896  -2.742 -14.078
  317   2HE   LYS  55          2HE       LYS  55 -10.595  -2.360 -13.804
  318   1HZ   LYS  55          1HZ       LYS  55  -9.646  -1.113 -15.663
  319   2HZ   LYS  55          2HZ       LYS  55  -8.521  -0.398 -14.623
  320   3HZ   LYS  55          3HZ       LYS  55 -10.171  -0.082 -14.428
  321    H    ASP  56           H        ASP  56  -5.315  -3.790  -8.519
  322    HA   ASP  56           HA       ASP  56  -3.095  -4.799 -10.075
  323   1HB   ASP  56          1HB       ASP  56  -3.424  -1.962  -9.334
  324   2HB   ASP  56          2HB       ASP  56  -1.825  -2.655  -9.047
  325    H    CYS  57           H        CYS  57  -4.481  -5.843  -7.893
  326    HA   CYS  57           HA       CYS  57  -2.994  -5.380  -5.478
  327   1HB   CYS  57          1HB       CYS  57  -5.094  -7.408  -6.259
  328   2HB   CYS  57          2HB       CYS  57  -4.337  -7.377  -4.667
  329    H    PHE  58           H        PHE  58  -0.910  -5.832  -6.718
  330    HA   PHE  58           HA       PHE  58  -0.259  -8.492  -7.459
  331   1HB   PHE  58          1HB       PHE  58   1.417  -6.057  -6.874
  332   2HB   PHE  58          2HB       PHE  58   2.139  -7.606  -7.294
  333    HD1  PHE  58           HD1      PHE  58  -0.471  -5.276  -8.501
  334    HD2  PHE  58           HD2      PHE  58   2.658  -7.988  -9.439
  335    HE1  PHE  58           HE1      PHE  58  -0.707  -4.712 -10.872
  336    HE2  PHE  58           HE2      PHE  58   2.431  -7.431 -11.818
  337    HZ   PHE  58           HZ       PHE  58   0.755  -5.792 -12.496
  338    H    GLU  59           H        GLU  59   0.067  -6.657  -4.479
  339    HA   GLU  59           HA       GLU  59   0.838  -9.145  -3.116
  340   1HB   GLU  59          1HB       GLU  59   1.883  -6.432  -2.310
  341   2HB   GLU  59          2HB       GLU  59   2.413  -8.012  -1.736
  342   1HG   GLU  59          1HG       GLU  59   3.337  -8.511  -3.932
  343   2HG   GLU  59          2HG       GLU  59   2.780  -6.948  -4.529
  344    H    ALA  60           H        ALA  60  -1.705  -8.758  -3.139
  345    HA   ALA  60           HA       ALA  60  -2.449  -7.191  -0.767
  346   1HB   ALA  60          1HB       ALA  60  -4.762  -7.405  -1.595
  347   2HB   ALA  60          2HB       ALA  60  -4.156  -8.296  -2.990
  348   3HB   ALA  60          3HB       ALA  60  -3.692  -6.611  -2.750
  349    H    ASN  61           H        ASN  61  -2.579  -8.291   1.057
  350    HA   ASN  61           HA       ASN  61  -2.638 -11.097   1.249
  351   1HB   ASN  61          1HB       ASN  61  -2.864  -8.820   3.127
  352   2HB   ASN  61          2HB       ASN  61  -3.567 -10.338   3.679
  353   1HD2  ASN  61          1HD2      ASN  61  -1.010  -8.625   4.172
  354   2HD2  ASN  61          2HD2      ASN  61   0.230  -9.825   4.256
  355    H    THR  62           H        THR  62  -5.161  -8.693   1.064
  356    HA   THR  62           HA       THR  62  -7.163 -10.853   1.179
  357    HB   THR  62           HB       THR  62  -7.988  -8.074   1.843
  358    HG1  THR  62           HG1      THR  62  -6.692  -9.735   3.737
  359   1HG2  THR  62          1HG2      THR  62  -9.807  -9.114   2.528
  360   2HG2  THR  62          2HG2      THR  62  -8.858 -10.002   3.720
  361   3HG2  THR  62          3HG2      THR  62  -9.089 -10.668   2.102
  362    H    CYS  63           H        CYS  63  -7.472 -11.198  -0.963
  363    HA   CYS  63           HA       CYS  63  -7.909  -8.906  -2.726
  364   1HB   CYS  63          1HB       CYS  63  -6.350 -10.626  -3.503
  365   2HB   CYS  63          2HB       CYS  63  -7.611 -11.854  -3.352
  366    H    THR  64           H        THR  64  -9.936  -8.177  -2.788
  367    HA   THR  64           HA       THR  64 -12.099 -10.132  -3.112
  368    HB   THR  64           HB       THR  64 -13.352  -8.119  -1.753
  369    HG1  THR  64           HG1      THR  64 -10.834  -8.491  -0.509
  370   1HG2  THR  64          1HG2      THR  64 -12.728 -10.815  -1.279
  371   2HG2  THR  64          2HG2      THR  64 -13.956  -9.824  -0.493
  372   3HG2  THR  64          3HG2      THR  64 -12.336  -9.929   0.194
  373    H    ASP  65           H        ASP  65 -13.135  -9.776  -4.946
  374    HA   ASP  65           HA       ASP  65 -13.987  -8.771  -6.797
  375   1HB   ASP  65          1HB       ASP  65 -14.469  -6.854  -4.595
  376   2HB   ASP  65          2HB       ASP  65 -14.618  -6.202  -6.230
  377    H    SER  66           H        SER  66 -11.082  -8.616  -6.303
  378    HA   SER  66           HA       SER  66 -10.494  -6.249  -7.957
  379   1HB   SER  66          1HB       SER  66  -8.546  -7.586  -6.069
  380   2HB   SER  66          2HB       SER  66  -8.355  -6.036  -6.898
  381    HG   SER  66           HG       SER  66 -10.174  -6.678  -4.817
  382    H    THR  67           H        THR  67  -8.849  -6.494  -9.577
  383    HA   THR  67           HA       THR  67  -8.669  -9.223 -10.574
  384    HB   THR  67           HB       THR  67  -7.846  -7.911 -12.631
  385    HG1  THR  67           HG1      THR  67  -7.502  -5.911 -12.040
  386   1HG2  THR  67          1HG2      THR  67 -10.429  -6.892 -12.653
  387   2HG2  THR  67          2HG2      THR  67 -10.506  -8.363 -11.683
  388   3HG2  THR  67          3HG2      THR  67  -9.878  -8.425 -13.330
  389    H    ASN  68           H        ASN  68  -6.711 -10.188 -11.098
  390    HA   ASN  68           HA       ASN  68  -4.478 -10.616 -11.032
  391   1HB   ASN  68          1HB       ASN  68  -4.200  -7.601 -10.866
  392   2HB   ASN  68          2HB       ASN  68  -2.876  -8.734 -11.146
  393   1HD2  ASN  68          1HD2      ASN  68  -5.818  -7.390 -12.478
  394   2HD2  ASN  68          2HD2      ASN  68  -5.486  -7.797 -14.123
  395    H    CYS  69           H        CYS  69  -4.565 -11.703  -9.096
  396    HA   CYS  69           HA       CYS  69  -3.398 -10.278  -6.821
  397   1HB   CYS  69          1HB       CYS  69  -5.795 -12.120  -6.727
  398   2HB   CYS  69          2HB       CYS  69  -4.890 -11.610  -5.300
  399    H    TYR  70           H        TYR  70  -1.435 -11.260  -7.521
  400    HA   TYR  70           HA       TYR  70  -1.220 -14.126  -7.645
  401   1HB   TYR  70          1HB       TYR  70   1.113 -12.234  -7.480
  402   2HB   TYR  70          2HB       TYR  70   1.015 -13.800  -8.289
  403    HD1  TYR  70           HD1      TYR  70   0.996 -10.325  -8.773
  404    HD2  TYR  70           HD2      TYR  70  -0.771 -13.904 -10.245
  405    HE1  TYR  70           HE1      TYR  70   0.468  -9.186 -10.887
  406    HE2  TYR  70           HE2      TYR  70  -1.304 -12.776 -12.365
  407    HH   TYR  70           HH       TYR  70  -1.160  -9.430 -12.754
  408    H    LYS  71           H        LYS  71  -0.896 -11.734  -5.173
  409    HA   LYS  71           HA       LYS  71   0.166 -13.806  -3.370
  410   1HB   LYS  71          1HB       LYS  71   1.126 -11.102  -3.883
  411   2HB   LYS  71          2HB       LYS  71   0.808 -11.382  -2.173
  412   1HG   LYS  71          1HG       LYS  71   3.041 -11.969  -2.443
  413   2HG   LYS  71          2HG       LYS  71   2.191 -13.516  -2.459
  414   1HD   LYS  71          1HD       LYS  71   2.227 -13.466  -4.932
  415   2HD   LYS  71          2HD       LYS  71   3.167 -11.973  -4.862
  416   1HE   LYS  71          1HE       LYS  71   4.487 -14.098  -5.208
  417   2HE   LYS  71          2HE       LYS  71   5.013 -13.070  -3.876
  418   1HZ   LYS  71          1HZ       LYS  71   4.200 -14.536  -2.312
  419   2HZ   LYS  71          2HZ       LYS  71   4.776 -15.592  -3.500
  420   3HZ   LYS  71          3HZ       LYS  71   3.118 -15.272  -3.385
  421    H    ALA  72           H        ALA  72  -2.419 -13.887  -3.556
  422    HA   ALA  72           HA       ALA  72  -3.421 -12.411  -1.209
  423   1HB   ALA  72          1HB       ALA  72  -5.588 -12.243  -2.210
  424   2HB   ALA  72          2HB       ALA  72  -5.090 -13.240  -3.576
  425   3HB   ALA  72          3HB       ALA  72  -4.404 -11.630  -3.365
  426    H    THR  73           H        THR  73  -3.997 -13.661   0.428
  427    HA   THR  73           HA       THR  73  -4.112 -16.523   0.114
  428    HB   THR  73           HB       THR  73  -3.039 -15.736   2.085
  429    HG1  THR  73           HG1      THR  73  -5.614 -16.564   2.923
  430   1HG2  THR  73          1HG2      THR  73  -4.375 -14.488   3.837
  431   2HG2  THR  73          2HG2      THR  73  -5.506 -14.097   2.542
  432   3HG2  THR  73          3HG2      THR  73  -3.828 -13.562   2.440
  433    H    ALA  74           H        ALA  74  -6.341 -14.154  -0.429
  434    HA   ALA  74           HA       ALA  74  -8.564 -15.992   0.152
  435   1HB   ALA  74          1HB       ALA  74  -8.237 -13.160   0.927
  436   2HB   ALA  74          2HB       ALA  74  -9.123 -14.462   1.721
  437   3HB   ALA  74          3HB       ALA  74  -9.829 -13.637   0.332
  438    H    CYS  75           H        CYS  75  -8.624 -16.734  -1.974
  439    HA   CYS  75           HA       CYS  75  -8.965 -14.794  -4.117
  440   1HB   CYS  75          1HB       CYS  75  -7.515 -16.584  -4.695
  441   2HB   CYS  75          2HB       CYS  75  -8.631 -17.796  -4.071
  442    H    THR  76           H        THR  76 -10.989 -13.941  -3.509
  443    HA   THR  76           HA       THR  76 -13.246 -15.714  -4.157
  444    HB   THR  76           HB       THR  76 -13.753 -13.495  -2.257
  445    HG1  THR  76           HG1      THR  76 -12.234 -14.151  -0.973
  446   1HG2  THR  76          1HG2      THR  76 -15.014 -15.396  -1.111
  447   2HG2  THR  76          2HG2      THR  76 -14.713 -16.309  -2.588
  448   3HG2  THR  76          3HG2      THR  76 -15.631 -14.806  -2.653
  449    H    ASN  77           H        ASN  77 -13.812 -15.015  -6.131
  450    HA   ASN  77           HA       ASN  77 -14.620 -13.673  -7.778
  451   1HB   ASN  77          1HB       ASN  77 -15.165 -11.745  -5.508
  452   2HB   ASN  77          2HB       ASN  77 -15.836 -11.632  -7.137
  453   1HD2  ASN  77          1HD2      ASN  77 -17.201 -13.399  -7.853
  454   2HD2  ASN  77          2HD2      ASN  77 -18.166 -14.240  -6.693
  455    H    SER  78           H        SER  78 -12.220 -13.660  -8.249
  456    HA   SER  78           HA       SER  78 -11.360 -10.872  -8.511
  457   1HB   SER  78          1HB       SER  78  -9.160 -12.778  -8.023
  458   2HB   SER  78          2HB       SER  78  -9.380 -11.131  -7.428
  459    HG   SER  78           HG       SER  78 -10.583 -11.872  -5.769
  460    H    SER  79           H        SER  79  -8.931 -11.346  -9.789
  461    HA   SER  79           HA       SER  79  -9.784 -12.808 -12.198
  462   1HB   SER  79          1HB       SER  79  -9.423 -10.138 -12.101
  463   2HB   SER  79          2HB       SER  79  -7.797 -10.656 -12.537
  464    HG   SER  79           HG       SER  79  -9.776 -10.356 -14.163
  465    H    GLY  80           H        GLY  80  -7.045 -11.866 -10.183
  466   1HA   GLY  80          1HA       GLY  80  -5.506 -14.045 -11.447
  467   2HA   GLY  80          2HA       GLY  80  -4.772 -12.589 -10.789
  468    H    CYS  81           H        CYS  81  -7.372 -13.900  -8.976
  469    HA   CYS  81           HA       CYS  81  -5.587 -14.495  -6.795
  470   1HB   CYS  81          1HB       CYS  81  -7.546 -14.756  -5.453
  471   2HB   CYS  81          2HB       CYS  81  -7.819 -13.375  -6.515
  472    HA   PRO  82           HA       PRO  82  -4.983 -18.828  -7.376
  473   1HB   PRO  82          1HB       PRO  82  -5.428 -19.070  -4.449
  474   2HB   PRO  82          2HB       PRO  82  -4.047 -19.591  -5.426
  475   1HG   PRO  82          1HG       PRO  82  -3.878 -17.443  -3.855
  476   2HG   PRO  82          2HG       PRO  82  -3.097 -17.477  -5.447
  477   1HD   PRO  82          1HD       PRO  82  -5.619 -16.117  -4.599
  478   2HD   PRO  82          2HD       PRO  82  -4.363 -15.567  -5.726
  479    H    GLY  83           H        GLY  83  -7.019 -19.129  -8.475
  480   1HA   GLY  83          1HA       GLY  83  -8.623 -21.129  -7.489
  481   2HA   GLY  83          2HA       GLY  83  -9.422 -19.640  -7.008
  482    H    HIS  84           H        HIS  84  -8.249 -21.481  -9.778
  483    HA   HIS  84           HA       HIS  84 -10.521 -20.615 -11.332
  484   1HB   HIS  84          1HB       HIS  84  -7.851 -19.463 -11.731
  485   2HB   HIS  84          2HB       HIS  84  -8.556 -20.134 -13.197
  486    HD1  HIS  84           HD1      HIS  84  -8.363 -17.373 -13.658
  487    HD2  HIS  84           HD2      HIS  84 -11.420 -18.777 -11.219
  488    HE1  HIS  84           HE1      HIS  84 -10.089 -15.544 -13.622
  489    HE2  HIS  84           HE2      HIS  84 -11.891 -16.382 -12.073
  Start of MODEL   10
    1   1H    GLN   1          1H        GLN   1  -7.826  15.396   5.843
    2   2H    GLN   1          2H        GLN   1  -8.606  16.484   6.917
    3   3H    GLN   1          3H        GLN   1  -7.801  17.080   5.523
    4    HA   GLN   1           HA       GLN   1 -10.051  15.206   5.371
    5   1HB   GLN   1          1HB       GLN   1 -10.551  17.349   6.653
    6   2HB   GLN   1          2HB       GLN   1 -10.212  18.213   5.160
    7   1HG   GLN   1          1HG       GLN   1 -12.616  17.827   5.560
    8   2HG   GLN   1          2HG       GLN   1 -12.035  17.137   4.046
    9   1HE2  GLN   1          1HE2      GLN   1 -13.654  15.627   3.891
   10   2HE2  GLN   1          2HE2      GLN   1 -13.779  14.268   4.949
   11    H    CYS   2           H        CYS   2  -7.514  15.460   3.895
   12    HA   CYS   2           HA       CYS   2  -8.079  16.790   1.422
   13   1HB   CYS   2          1HB       CYS   2  -5.776  16.128   2.553
   14   2HB   CYS   2          2HB       CYS   2  -5.998  14.656   1.614
   15    H    THR   3           H        THR   3 -10.245  15.596   1.352
   16    HA   THR   3           HA       THR   3  -9.897  13.128  -0.221
   17    HB   THR   3           HB       THR   3 -11.842  12.175   0.729
   18    HG1  THR   3           HG1      THR   3 -13.351  13.294   1.782
   19   1HG2  THR   3          1HG2      THR   3  -9.734  12.845   2.394
   20   2HG2  THR   3          2HG2      THR   3 -10.988  11.641   2.699
   21   3HG2  THR   3          3HG2      THR   3 -11.177  13.287   3.306
   22    H    GLY   4           H        GLY   4 -11.348  12.807  -1.957
   23   1HA   GLY   4          1HA       GLY   4 -12.641  13.453  -3.741
   24   2HA   GLY   4          2HA       GLY   4 -13.431  14.581  -2.642
   25    H    GLY   5           H        GLY   5 -11.940  14.471  -5.490
   26   1HA   GLY   5          1HA       GLY   5 -11.725  17.091  -6.042
   27   2HA   GLY   5          2HA       GLY   5 -10.210  16.782  -5.205
   28    H    ALA   6           H        ALA   6  -9.700  17.651  -7.540
   29    HA   ALA   6           HA       ALA   6  -9.717  15.579  -9.565
   30   1HB   ALA   6          1HB       ALA   6  -9.847  18.263  -9.747
   31   2HB   ALA   6          2HB       ALA   6  -9.302  17.219 -11.058
   32   3HB   ALA   6          3HB       ALA   6  -8.122  18.015 -10.018
   33    H    ASP   7           H        ASP   7  -7.248  17.427  -7.782
   34    HA   ASP   7           HA       ASP   7  -5.445  15.131  -8.048
   35   1HB   ASP   7          1HB       ASP   7  -4.979  17.910  -9.011
   36   2HB   ASP   7          2HB       ASP   7  -3.619  17.068  -8.262
   37    H    CYS   8           H        CYS   8  -4.597  14.563  -6.157
   38    HA   CYS   8           HA       CYS   8  -4.842  16.417  -3.906
   39   1HB   CYS   8          1HB       CYS   8  -4.578  13.434  -4.129
   40   2HB   CYS   8          2HB       CYS   8  -4.196  14.252  -2.611
   41    H    THR   9           H        THR   9  -2.764  16.776  -5.878
   42    HA   THR   9           HA       THR   9  -0.304  15.846  -4.685
   43    HB   THR   9           HB       THR   9   0.791  17.128  -6.477
   44    HG1  THR   9           HG1      THR   9  -0.517  18.236  -7.974
   45   1HG2  THR   9          1HG2      THR   9   0.356  15.645  -8.091
   46   2HG2  THR   9          2HG2      THR   9  -1.381  15.946  -8.047
   47   3HG2  THR   9          3HG2      THR   9  -0.642  14.872  -6.860
   48    H    SER  10           H        SER  10  -0.803  16.848  -2.574
   49    HA   SER  10           HA       SER  10   0.680  19.222  -2.207
   50   1HB   SER  10          1HB       SER  10  -1.149  20.484  -3.002
   51   2HB   SER  10          2HB       SER  10  -2.324  19.463  -2.175
   52    HG   SER  10           HG       SER  10  -1.918  20.463  -0.318
   53    H    CYS  11           H        CYS  11  -1.942  17.243  -0.865
   54    HA   CYS  11           HA       CYS  11  -1.076  17.663   1.847
   55   1HB   CYS  11          1HB       CYS  11  -2.988  15.540   0.875
   56   2HB   CYS  11          2HB       CYS  11  -2.889  16.249   2.482
   57    H    THR  12           H        THR  12  -0.881  15.536   3.224
   58    HA   THR  12           HA       THR  12   0.711  13.511   1.849
   59    HB   THR  12           HB       THR  12   2.331  15.201   2.602
   60    HG1  THR  12           HG1      THR  12   3.500  13.499   2.880
   61   1HG2  THR  12          1HG2      THR  12   1.647  14.544   5.439
   62   2HG2  THR  12          2HG2      THR  12   0.919  15.918   4.608
   63   3HG2  THR  12          3HG2      THR  12   2.668  15.836   4.810
   64    H    GLY  13           H        GLY  13  -1.910  13.434   2.989
   65   1HA   GLY  13          1HA       GLY  13  -1.456  11.700   5.338
   66   2HA   GLY  13          2HA       GLY  13  -2.933  12.608   5.052
   67    H    ALA  14           H        ALA  14  -4.462  11.830   3.598
   68    HA   ALA  14           HA       ALA  14  -3.974   9.094   2.613
   69   1HB   ALA  14          1HB       ALA  14  -5.907   8.325   3.482
   70   2HB   ALA  14          2HB       ALA  14  -6.759   9.844   3.210
   71   3HB   ALA  14          3HB       ALA  14  -5.693   9.669   4.603
   72    H    CYS  15           H        CYS  15  -4.707   8.573   0.589
   73    HA   CYS  15           HA       CYS  15  -5.425  10.834  -1.111
   74   1HB   CYS  15          1HB       CYS  15  -3.909   8.402  -1.445
   75   2HB   CYS  15          2HB       CYS  15  -5.155   8.513  -2.683
   76    H    THR  16           H        THR  16  -7.561  11.222  -1.086
   77    HA   THR  16           HA       THR  16  -9.358   8.962  -1.673
   78    HB   THR  16           HB       THR  16 -10.980  10.805  -0.434
   79    HG1  THR  16           HG1      THR  16  -8.528  10.719   0.987
   80   1HG2  THR  16          1HG2      THR  16  -9.519   8.557   0.929
   81   2HG2  THR  16          2HG2      THR  16 -11.010   8.406   0.000
   82   3HG2  THR  16          3HG2      THR  16 -10.992   9.341   1.494
   83    H    GLY  17           H        GLY  17 -10.769   9.230  -3.322
   84   1HA   GLY  17          1HA       GLY  17 -11.572  10.131  -5.288
   85   2HA   GLY  17          2HA       GLY  17 -11.968  11.508  -4.264
   86    H    CYS  18           H        CYS  18  -8.902  10.159  -5.468
   87    HA   CYS  18           HA       CYS  18  -8.422  12.577  -7.018
   88   1HB   CYS  18          1HB       CYS  18  -6.888  11.811  -4.569
   89   2HB   CYS  18          2HB       CYS  18  -6.018  12.546  -5.918
   90    H    GLY  19           H        GLY  19  -7.264  12.181  -8.841
   91   1HA   GLY  19          1HA       GLY  19  -6.457   9.410  -9.293
   92   2HA   GLY  19          2HA       GLY  19  -6.616  10.660 -10.524
   93    H    ASN  20           H        ASN  20  -4.881  11.450  -7.647
   94    HA   ASN  20           HA       ASN  20  -2.299  10.669  -8.658
   95   1HB   ASN  20          1HB       ASN  20  -2.923  13.618  -8.399
   96   2HB   ASN  20          2HB       ASN  20  -1.383  12.907  -8.870
   97   1HD2  ASN  20          1HD2      ASN  20  -1.298  11.746 -10.885
   98   2HD2  ASN  20          2HD2      ASN  20  -2.356  12.194 -12.175
   99    H    CYS  21           H        CYS  21  -0.822  10.495  -7.039
  100    HA   CYS  21           HA       CYS  21  -1.577  11.593  -4.412
  101   1HB   CYS  21          1HB       CYS  21  -1.532   8.921  -5.042
  102   2HB   CYS  21          2HB       CYS  21   0.075   9.165  -4.353
  103    HA   PRO  22           HA       PRO  22   2.509  13.322  -4.678
  104   1HB   PRO  22          1HB       PRO  22   2.540  14.607  -2.306
  105   2HB   PRO  22          2HB       PRO  22   1.582  15.169  -3.679
  106   1HG   PRO  22          1HG       PRO  22   0.715  13.766  -1.212
  107   2HG   PRO  22          2HG       PRO  22  -0.149  14.957  -2.195
  108   1HD   PRO  22          1HD       PRO  22  -0.523  12.179  -2.247
  109   2HD   PRO  22          2HD       PRO  22  -1.118  13.339  -3.448
  110    H    ASN  23           H        ASN  23   1.753  12.166  -1.371
  111    HA   ASN  23           HA       ASN  23   3.890  10.250  -1.449
  112   1HB   ASN  23          1HB       ASN  23   4.453  11.871   0.871
  113   2HB   ASN  23          2HB       ASN  23   5.536  11.380  -0.433
  114   1HD2  ASN  23          1HD2      ASN  23   2.955  13.705   0.277
  115   2HD2  ASN  23          2HD2      ASN  23   3.655  15.012  -0.611
  116    H    ALA  24           H        ALA  24   1.020  10.322  -0.939
  117    HA   ALA  24           HA       ALA  24   0.516  10.033   1.838
  118   1HB   ALA  24          1HB       ALA  24  -1.107  10.395  -0.214
  119   2HB   ALA  24          2HB       ALA  24  -1.649   9.591   1.260
  120   3HB   ALA  24          3HB       ALA  24  -1.195   8.634  -0.150
  121    H    VAL  25           H        VAL  25  -0.268   7.989   2.834
  122    HA   VAL  25           HA       VAL  25   1.635   5.855   2.266
  123    HB   VAL  25           HB       VAL  25  -0.315   5.502   4.467
  124   1HG1  VAL  25          1HG1      VAL  25   1.904   4.210   3.738
  125   2HG1  VAL  25          2HG1      VAL  25   1.346   4.285   5.410
  126   3HG1  VAL  25          3HG1      VAL  25   2.614   5.378   4.854
  127   1HG2  VAL  25          1HG2      VAL  25   1.733   7.709   4.477
  128   2HG2  VAL  25          2HG2      VAL  25   1.060   7.011   5.950
  129   3HG2  VAL  25          3HG2      VAL  25   0.003   7.828   4.799
  130    H    THR  26           H        THR  26  -1.863   6.339   2.529
  131    HA   THR  26           HA       THR  26  -2.233   3.843   1.006
  132    HB   THR  26           HB       THR  26  -2.963   3.501   3.312
  133    HG1  THR  26           HG1      THR  26  -5.130   2.934   2.840
  134   1HG2  THR  26          1HG2      THR  26  -3.493   5.908   3.788
  135   2HG2  THR  26          2HG2      THR  26  -4.676   4.733   4.365
  136   3HG2  THR  26          3HG2      THR  26  -5.000   5.665   2.903
  137    H    CYS  27           H        CYS  27  -4.627   3.833   0.125
  138    HA   CYS  27           HA       CYS  27  -5.465   6.485  -0.737
  139   1HB   CYS  27          1HB       CYS  27  -4.730   4.295  -2.691
  140   2HB   CYS  27          2HB       CYS  27  -5.529   5.812  -3.116
  141    H    THR  28           H        THR  28  -7.505   6.490  -0.101
  142    HA   THR  28           HA       THR  28  -9.121   4.063  -0.382
  143    HB   THR  28           HB       THR  28 -10.078   6.607   0.896
  144    HG1  THR  28           HG1      THR  28  -8.048   6.135   1.830
  145   1HG2  THR  28          1HG2      THR  28 -11.817   5.329   1.369
  146   2HG2  THR  28          2HG2      THR  28 -10.765   4.399   2.436
  147   3HG2  THR  28          3HG2      THR  28 -11.000   3.887   0.765
  148    H    ASN  29           H        ASN  29  -9.855   3.935  -2.429
  149    HA   ASN  29           HA       ASN  29 -11.262   4.344  -4.148
  150   1HB   ASN  29          1HB       ASN  29 -12.796   5.504  -2.641
  151   2HB   ASN  29          2HB       ASN  29 -11.834   6.970  -2.773
  152   1HD2  ASN  29          1HD2      ASN  29 -12.818   8.416  -3.966
  153   2HD2  ASN  29          2HD2      ASN  29 -13.711   8.109  -5.413
  154    H    SER  30           H        SER  30 -11.358   5.765  -6.068
  155    HA   SER  30           HA       SER  30 -10.443   7.172  -7.649
  156   1HB   SER  30          1HB       SER  30  -9.318   8.241  -5.354
  157   2HB   SER  30          2HB       SER  30  -7.933   7.861  -6.379
  158    HG   SER  30           HG       SER  30 -10.208   9.385  -7.122
  159    H    GLN  31           H        GLN  31  -7.883   7.426  -8.542
  160    HA   GLN  31           HA       GLN  31  -6.753   4.724  -8.601
  161   1HB   GLN  31          1HB       GLN  31  -6.479   5.171 -11.171
  162   2HB   GLN  31          2HB       GLN  31  -7.982   4.504 -10.538
  163   1HG   GLN  31          1HG       GLN  31  -8.951   6.113 -11.738
  164   2HG   GLN  31          2HG       GLN  31  -8.474   7.179 -10.420
  165   1HE2  GLN  31          1HE2      GLN  31  -8.197   8.999 -11.626
  166   2HE2  GLN  31          2HE2      GLN  31  -6.959   9.177 -12.817
  167    H    HIS  32           H        HIS  32  -4.777   4.906 -10.323
  168    HA   HIS  32           HA       HIS  32  -2.702   5.711 -10.759
  169   1HB   HIS  32          1HB       HIS  32  -4.286   8.116 -10.415
  170   2HB   HIS  32          2HB       HIS  32  -2.625   8.358  -9.871
  171    HD1  HIS  32           HD1      HIS  32  -1.371   6.417 -12.069
  172    HD2  HIS  32           HD2      HIS  32  -3.996   9.564 -12.757
  173    HE1  HIS  32           HE1      HIS  32  -1.001   7.090 -14.464
  174    HE2  HIS  32           HE2      HIS  32  -2.558   9.035 -14.841
  175    H    CYS  33           H        CYS  33  -3.494   4.598  -8.153
  176    HA   CYS  33           HA       CYS  33  -1.394   5.819  -6.482
  177   1HB   CYS  33          1HB       CYS  33  -4.097   4.838  -5.857
  178   2HB   CYS  33          2HB       CYS  33  -2.846   4.293  -4.738
  179    H    VAL  34           H        VAL  34  -0.074   4.398  -7.981
  180    HA   VAL  34           HA       VAL  34  -0.146   1.566  -7.600
  181    HB   VAL  34           HB       VAL  34   0.738   2.701  -9.652
  182   1HG1  VAL  34          1HG1      VAL  34   3.073   3.322  -7.837
  183   2HG1  VAL  34          2HG1      VAL  34   2.011   4.485  -8.635
  184   3HG1  VAL  34          3HG1      VAL  34   3.090   3.475  -9.596
  185   1HG2  VAL  34          1HG2      VAL  34   1.498   0.632  -9.948
  186   2HG2  VAL  34          2HG2      VAL  34   1.835   0.440  -8.228
  187   3HG2  VAL  34          3HG2      VAL  34   3.039   1.178  -9.286
  188    H    LYS  35           H        LYS  35   1.664   4.223  -6.200
  189    HA   LYS  35           HA       LYS  35   3.298   2.367  -4.657
  190   1HB   LYS  35          1HB       LYS  35   4.764   4.133  -4.266
  191   2HB   LYS  35          2HB       LYS  35   4.184   4.444  -5.891
  192   1HG   LYS  35          1HG       LYS  35   3.643   6.489  -5.252
  193   2HG   LYS  35          2HG       LYS  35   2.416   5.796  -4.190
  194   1HD   LYS  35          1HD       LYS  35   3.715   7.126  -2.770
  195   2HD   LYS  35          2HD       LYS  35   4.327   5.492  -2.504
  196   1HE   LYS  35          1HE       LYS  35   6.255   6.795  -2.713
  197   2HE   LYS  35          2HE       LYS  35   6.062   6.053  -4.302
  198   1HZ   LYS  35          1HZ       LYS  35   5.416   8.032  -5.244
  199   2HZ   LYS  35          2HZ       LYS  35   6.555   8.569  -4.116
  200   3HZ   LYS  35          3HZ       LYS  35   4.903   8.707  -3.780
  201    H    ALA  36           H        ALA  36   0.463   2.609  -4.093
  202    HA   ALA  36           HA       ALA  36   0.420   3.967  -1.499
  203   1HB   ALA  36          1HB       ALA  36  -1.925   3.894  -1.593
  204   2HB   ALA  36          2HB       ALA  36  -1.922   2.619  -2.813
  205   3HB   ALA  36          3HB       ALA  36  -1.418   4.253  -3.245
  206    H    ASN  37           H        ASN  37   0.261   2.902   0.414
  207    HA   ASN  37           HA       ASN  37   1.086   0.226   0.589
  208   1HB   ASN  37          1HB       ASN  37  -0.065   2.178   2.554
  209   2HB   ASN  37          2HB       ASN  37   0.164   0.497   3.023
  210   1HD2  ASN  37          1HD2      ASN  37   1.903   3.190   1.509
  211   2HD2  ASN  37          2HD2      ASN  37   3.426   2.842   2.243
  212    H    THR  38           H        THR  38  -2.067   1.640   0.281
  213    HA   THR  38           HA       THR  38  -3.219  -1.038   0.149
  214    HB   THR  38           HB       THR  38  -4.418   1.165   1.834
  215    HG1  THR  38           HG1      THR  38  -3.880  -0.131   3.567
  216   1HG2  THR  38          1HG2      THR  38  -6.253  -0.039   1.092
  217   2HG2  THR  38          2HG2      THR  38  -5.855  -0.792   2.637
  218   3HG2  THR  38          3HG2      THR  38  -5.381  -1.572   1.128
  219    H    CYS  39           H        CYS  39  -5.410  -1.022  -0.819
  220    HA   CYS  39           HA       CYS  39  -5.963   1.355  -2.441
  221   1HB   CYS  39          1HB       CYS  39  -4.925  -1.170  -3.417
  222   2HB   CYS  39          2HB       CYS  39  -6.502  -0.829  -4.130
  223    H    THR  40           H        THR  40  -7.666   1.488  -0.765
  224    HA   THR  40           HA       THR  40  -9.780  -0.504  -0.917
  225    HB   THR  40           HB       THR  40  -9.601   2.052   0.690
  226    HG1  THR  40           HG1      THR  40  -8.725   0.882   2.227
  227   1HG2  THR  40          1HG2      THR  40 -11.891   0.704   0.191
  228   2HG2  THR  40          2HG2      THR  40 -11.566   1.625   1.660
  229   3HG2  THR  40          3HG2      THR  40 -11.314  -0.120   1.640
  230    H    GLY  41           H        GLY  41 -10.798  -0.337  -2.868
  231   1HA   GLY  41          1HA       GLY  41 -12.491   0.510  -4.232
  232   2HA   GLY  41          2HA       GLY  41 -12.515   1.964  -3.241
  233    H    SER  42           H        SER  42  -9.574   0.712  -4.677
  234    HA   SER  42           HA       SER  42  -9.707   2.871  -6.658
  235   1HB   SER  42          1HB       SER  42  -7.261   2.253  -4.970
  236   2HB   SER  42          2HB       SER  42  -7.412   3.541  -6.165
  237    HG   SER  42           HG       SER  42  -7.913   4.626  -4.405
  238    H    THR  43           H        THR  43  -7.175   2.423  -7.781
  239    HA   THR  43           HA       THR  43  -7.099  -0.437  -8.321
  240    HB   THR  43           HB       THR  43  -7.611  -0.357 -10.526
  241    HG1  THR  43           HG1      THR  43  -7.198   1.438 -11.862
  242   1HG2  THR  43          1HG2      THR  43  -9.274   1.471 -11.074
  243   2HG2  THR  43          2HG2      THR  43  -9.011   2.055  -9.430
  244   3HG2  THR  43          3HG2      THR  43  -9.644   0.430  -9.698
  245    H    ASP  44           H        ASP  44  -5.309   0.394 -10.742
  246    HA   ASP  44           HA       ASP  44  -2.970   0.033 -10.780
  247   1HB   ASP  44          1HB       ASP  44  -3.285   2.935  -9.991
  248   2HB   ASP  44          2HB       ASP  44  -1.969   2.234 -10.929
  249    H    CYS  45           H        CYS  45  -2.675  -1.345  -8.914
  250    HA   CYS  45           HA       CYS  45  -1.109  -0.029  -6.824
  251   1HB   CYS  45          1HB       CYS  45  -3.714  -1.277  -6.461
  252   2HB   CYS  45          2HB       CYS  45  -2.477  -2.039  -5.458
  253    H    ASN  46           H        ASN  46   0.821  -0.952  -6.902
  254    HA   ASN  46           HA       ASN  46   0.975  -3.845  -7.434
  255   1HB   ASN  46          1HB       ASN  46   2.913  -3.561  -8.661
  256   2HB   ASN  46          2HB       ASN  46   2.055  -2.069  -9.051
  257   1HD2  ASN  46          1HD2      ASN  46   4.536  -3.460  -6.978
  258   2HD2  ASN  46          2HD2      ASN  46   5.428  -1.998  -6.752
  259    H    THR  47           H        THR  47   1.981  -1.212  -5.379
  260    HA   THR  47           HA       THR  47   3.618  -2.988  -3.740
  261    HB   THR  47           HB       THR  47   4.424  -1.032  -2.648
  262    HG1  THR  47           HG1      THR  47   2.830   0.317  -2.263
  263   1HG2  THR  47          1HG2      THR  47   5.155   0.446  -4.459
  264   2HG2  THR  47          2HG2      THR  47   4.035  -0.366  -5.555
  265   3HG2  THR  47          3HG2      THR  47   5.381  -1.259  -4.850
  266    H    ALA  48           H        ALA  48   0.469  -1.574  -3.812
  267    HA   ALA  48           HA       ALA  48  -0.228  -1.324  -1.166
  268   1HB   ALA  48          1HB       ALA  48  -2.004  -0.722  -2.410
  269   2HB   ALA  48          2HB       ALA  48  -2.503  -2.395  -2.160
  270   3HB   ALA  48          3HB       ALA  48  -1.680  -1.933  -3.650
  271    H    GLN  49           H        GLN  49  -1.077  -2.690   0.425
  272    HA   GLN  49           HA       GLN  49  -0.235  -5.482   0.149
  273   1HB   GLN  49          1HB       GLN  49  -0.141  -3.556   2.273
  274   2HB   GLN  49          2HB       GLN  49  -1.061  -4.958   2.802
  275   1HG   GLN  49          1HG       GLN  49   0.752  -6.249   2.923
  276   2HG   GLN  49          2HG       GLN  49   1.399  -5.647   1.397
  277   1HE2  GLN  49          1HE2      GLN  49   1.107  -4.980   4.831
  278   2HE2  GLN  49          2HE2      GLN  49   2.497  -3.961   4.944
  279    H    THR  50           H        THR  50  -3.013  -3.780  -0.280
  280    HA   THR  50           HA       THR  50  -4.664  -6.015  -0.398
  281    HB   THR  50           HB       THR  50  -4.329  -5.737   2.138
  282    HG1  THR  50           HG1      THR  50  -6.520  -6.307   2.488
  283   1HG2  THR  50          1HG2      THR  50  -5.572  -4.184   3.327
  284   2HG2  THR  50          2HG2      THR  50  -6.516  -3.717   1.911
  285   3HG2  THR  50          3HG2      THR  50  -4.822  -3.239   2.040
  286    H    CYS  51           H        CYS  51  -6.973  -5.442  -0.726
  287    HA   CYS  51           HA       CYS  51  -7.715  -2.716  -1.126
  288   1HB   CYS  51          1HB       CYS  51  -8.108  -3.039  -3.640
  289   2HB   CYS  51          2HB       CYS  51  -6.451  -2.739  -3.110
  290    H    THR  52           H        THR  52  -9.930  -2.490  -1.840
  291    HA   THR  52           HA       THR  52 -11.468  -4.983  -1.515
  292    HB   THR  52           HB       THR  52 -11.632  -3.363   0.386
  293    HG1  THR  52           HG1      THR  52 -13.348  -4.839  -0.223
  294   1HG2  THR  52          1HG2      THR  52 -11.753  -1.372  -1.385
  295   2HG2  THR  52          2HG2      THR  52 -12.441  -1.271   0.236
  296   3HG2  THR  52          3HG2      THR  52 -13.477  -1.649  -1.139
  297    H    ASN  53           H        ASN  53 -10.555  -2.920  -3.834
  298    HA   ASN  53           HA       ASN  53 -12.520  -3.695  -5.670
  299   1HB   ASN  53          1HB       ASN  53 -13.367  -1.563  -4.024
  300   2HB   ASN  53          2HB       ASN  53 -12.989  -0.851  -5.595
  301   1HD2  ASN  53          1HD2      ASN  53 -13.713  -2.681  -7.374
  302   2HD2  ASN  53          2HD2      ASN  53 -15.399  -3.043  -7.257
  303    H    SER  54           H        SER  54  -9.774  -3.661  -5.680
  304    HA   SER  54           HA       SER  54  -9.084  -1.495  -7.552
  305   1HB   SER  54          1HB       SER  54  -6.952  -1.492  -6.736
  306   2HB   SER  54          2HB       SER  54  -7.753  -2.155  -5.309
  307    HG   SER  54           HG       SER  54  -5.880  -3.278  -6.839
  308    H    LYS  55           H        LYS  55  -7.791  -2.036  -9.417
  309    HA   LYS  55           HA       LYS  55  -8.461  -4.687 -10.468
  310   1HB   LYS  55          1HB       LYS  55  -7.519  -2.188 -11.888
  311   2HB   LYS  55          2HB       LYS  55  -7.908  -3.711 -12.678
  312   1HG   LYS  55          1HG       LYS  55  -9.980  -2.476 -10.951
  313   2HG   LYS  55          2HG       LYS  55  -9.647  -1.732 -12.516
  314   1HD   LYS  55          1HD       LYS  55  -9.983  -3.964 -13.572
  315   2HD   LYS  55          2HD       LYS  55 -10.471  -4.588 -11.995
  316   1HE   LYS  55          1HE       LYS  55 -12.547  -3.977 -12.523
  317   2HE   LYS  55          2HE       LYS  55 -12.012  -2.309 -12.321
  318   1HZ   LYS  55          1HZ       LYS  55 -11.976  -1.961 -14.532
  319   2HZ   LYS  55          2HZ       LYS  55 -13.087  -3.236 -14.561
  320   3HZ   LYS  55          3HZ       LYS  55 -11.456  -3.529 -14.902
  321    H    ASP  56           H        ASP  56  -6.290  -4.200  -8.560
  322    HA   ASP  56           HA       ASP  56  -4.177  -5.501 -10.025
  323   1HB   ASP  56          1HB       ASP  56  -3.642  -3.010  -8.395
  324   2HB   ASP  56          2HB       ASP  56  -2.445  -3.979  -9.261
  325    H    CYS  57           H        CYS  57  -2.538  -4.696  -7.506
  326    HA   CYS  57           HA       CYS  57  -2.133  -5.453  -5.391
  327   1HB   CYS  57          1HB       CYS  57  -4.902  -6.676  -5.540
  328   2HB   CYS  57          2HB       CYS  57  -3.877  -6.645  -4.107
  329    H    PHE  58           H        PHE  58  -0.488  -6.670  -6.325
  330    HA   PHE  58           HA       PHE  58  -1.074  -9.435  -7.026
  331   1HB   PHE  58          1HB       PHE  58   1.560  -7.977  -7.227
  332   2HB   PHE  58          2HB       PHE  58   1.117  -9.491  -7.997
  333    HD1  PHE  58           HD1      PHE  58  -0.337  -9.543  -9.887
  334    HD2  PHE  58           HD2      PHE  58   0.866  -5.889  -8.083
  335    HE1  PHE  58           HE1      PHE  58  -1.026  -8.330 -11.900
  336    HE2  PHE  58           HE2      PHE  58   0.171  -4.665 -10.091
  337    HZ   PHE  58           HZ       PHE  58  -0.761  -5.904 -11.977
  338    H    GLU  59           H        GLU  59   0.515  -7.518  -4.584
  339    HA   GLU  59           HA       GLU  59   1.248 -10.001  -3.176
  340   1HB   GLU  59          1HB       GLU  59   2.898  -8.447  -1.943
  341   2HB   GLU  59          2HB       GLU  59   3.296  -8.956  -3.583
  342   1HG   GLU  59          1HG       GLU  59   1.768  -6.472  -3.467
  343   2HG   GLU  59          2HG       GLU  59   3.330  -6.389  -2.653
  344    H    ALA  60           H        ALA  60  -1.322  -8.691  -3.096
  345    HA   ALA  60           HA       ALA  60  -1.464  -7.288  -0.575
  346   1HB   ALA  60          1HB       ALA  60  -3.087  -6.426  -1.910
  347   2HB   ALA  60          2HB       ALA  60  -4.035  -7.701  -1.144
  348   3HB   ALA  60          3HB       ALA  60  -3.358  -7.951  -2.752
  349    H    ASN  61           H        ASN  61  -2.436  -8.027   1.310
  350    HA   ASN  61           HA       ASN  61  -2.243 -10.873   1.735
  351   1HB   ASN  61          1HB       ASN  61  -2.808  -8.525   3.536
  352   2HB   ASN  61          2HB       ASN  61  -2.953 -10.185   4.109
  353   1HD2  ASN  61          1HD2      ASN  61  -0.697  -7.999   2.478
  354   2HD2  ASN  61          2HD2      ASN  61   0.729  -8.652   3.200
  355    H    THR  62           H        THR  62  -4.770  -8.476   1.380
  356    HA   THR  62           HA       THR  62  -6.747 -10.651   1.504
  357    HB   THR  62           HB       THR  62  -7.626  -7.946   2.348
  358    HG1  THR  62           HG1      THR  62  -6.512  -7.903   4.124
  359   1HG2  THR  62          1HG2      THR  62  -8.985 -10.168   2.275
  360   2HG2  THR  62          2HG2      THR  62  -9.190  -9.034   3.610
  361   3HG2  THR  62          3HG2      THR  62  -8.186 -10.469   3.818
  362    H    CYS  63           H        CYS  63  -6.328 -10.575  -0.859
  363    HA   CYS  63           HA       CYS  63  -7.127  -8.293  -2.374
  364   1HB   CYS  63          1HB       CYS  63  -6.138 -10.989  -2.921
  365   2HB   CYS  63          2HB       CYS  63  -7.367 -10.476  -4.077
  366    H    THR  64           H        THR  64  -9.178  -7.913  -1.241
  367    HA   THR  64           HA       THR  64 -11.332  -9.770  -1.901
  368    HB   THR  64           HB       THR  64 -12.200  -7.386  -0.516
  369    HG1  THR  64           HG1      THR  64 -10.238  -7.147   0.388
  370   1HG2  THR  64          1HG2      THR  64 -12.020 -10.261   0.346
  371   2HG2  THR  64          2HG2      THR  64 -13.418  -9.457  -0.368
  372   3HG2  THR  64          3HG2      THR  64 -12.847  -8.981   1.232
  373    H    ASP  65           H        ASP  65 -12.609  -9.474  -3.598
  374    HA   ASP  65           HA       ASP  65 -13.542  -8.546  -5.456
  375   1HB   ASP  65          1HB       ASP  65 -14.633  -7.264  -3.482
  376   2HB   ASP  65          2HB       ASP  65 -13.612  -5.916  -3.994
  377    H    SER  66           H        SER  66 -11.073  -8.808  -6.039
  378    HA   SER  66           HA       SER  66 -10.376  -6.392  -7.494
  379   1HB   SER  66          1HB       SER  66  -8.345  -5.967  -6.521
  380   2HB   SER  66          2HB       SER  66  -9.159  -6.656  -5.112
  381    HG   SER  66           HG       SER  66  -7.351  -7.922  -6.885
  382    H    THR  67           H        THR  67  -8.216  -6.967  -8.797
  383    HA   THR  67           HA       THR  67  -8.332  -9.754  -9.670
  384    HB   THR  67           HB       THR  67  -9.811  -8.695 -11.194
  385    HG1  THR  67           HG1      THR  67  -8.774  -9.080 -13.083
  386   1HG2  THR  67          1HG2      THR  67  -8.669  -6.765 -12.626
  387   2HG2  THR  67          2HG2      THR  67  -7.902  -6.457 -11.069
  388   3HG2  THR  67          3HG2      THR  67  -9.662  -6.450 -11.204
  389    H    ASN  68           H        ASN  68  -6.485 -10.458 -10.921
  390    HA   ASN  68           HA       ASN  68  -4.289 -10.471 -11.557
  391   1HB   ASN  68          1HB       ASN  68  -4.106  -7.549 -10.811
  392   2HB   ASN  68          2HB       ASN  68  -3.073  -8.452 -11.926
  393   1HD2  ASN  68          1HD2      ASN  68  -5.043  -9.841 -13.329
  394   2HD2  ASN  68          2HD2      ASN  68  -5.951  -8.709 -14.267
  395    H    CYS  69           H        CYS  69  -4.952 -11.304  -8.979
  396    HA   CYS  69           HA       CYS  69  -2.732 -10.292  -7.332
  397   1HB   CYS  69          1HB       CYS  69  -4.998 -12.087  -6.439
  398   2HB   CYS  69          2HB       CYS  69  -3.844 -11.233  -5.412
  399    H    TYR  70           H        TYR  70  -1.718 -12.074  -5.912
  400    HA   TYR  70           HA       TYR  70  -1.807 -14.751  -6.593
  401   1HB   TYR  70          1HB       TYR  70   0.274 -15.089  -7.877
  402   2HB   TYR  70          2HB       TYR  70  -0.963 -14.222  -8.780
  403    HD1  TYR  70           HD1      TYR  70  -0.454 -12.199  -9.816
  404    HD2  TYR  70           HD2      TYR  70   2.167 -13.701  -6.818
  405    HE1  TYR  70           HE1      TYR  70   1.212 -10.486 -10.409
  406    HE2  TYR  70           HE2      TYR  70   3.823 -11.982  -7.389
  407    HH   TYR  70           HH       TYR  70   3.200  -9.302  -9.039
  408    H    LYS  71           H        LYS  71  -1.567 -13.194  -4.298
  409    HA   LYS  71           HA       LYS  71   0.394 -14.678  -2.901
  410   1HB   LYS  71          1HB       LYS  71   1.075 -11.896  -3.716
  411   2HB   LYS  71          2HB       LYS  71   1.513 -12.399  -2.085
  412   1HG   LYS  71          1HG       LYS  71   2.491 -14.483  -3.403
  413   2HG   LYS  71          2HG       LYS  71   2.573 -13.293  -4.704
  414   1HD   LYS  71          1HD       LYS  71   3.567 -12.410  -2.066
  415   2HD   LYS  71          2HD       LYS  71   4.525 -13.647  -2.884
  416   1HE   LYS  71          1HE       LYS  71   4.297 -12.080  -4.946
  417   2HE   LYS  71          2HE       LYS  71   3.902 -10.850  -3.746
  418   1HZ   LYS  71          1HZ       LYS  71   6.275 -12.459  -3.232
  419   2HZ   LYS  71          2HZ       LYS  71   6.005 -10.811  -2.961
  420   3HZ   LYS  71          3HZ       LYS  71   6.375 -11.362  -4.517
  421    H    ALA  72           H        ALA  72  -2.425 -14.063  -2.772
  422    HA   ALA  72           HA       ALA  72  -2.526 -12.791  -0.111
  423   1HB   ALA  72          1HB       ALA  72  -4.568 -11.786  -0.595
  424   2HB   ALA  72          2HB       ALA  72  -4.876 -12.848  -1.968
  425   3HB   ALA  72          3HB       ALA  72  -3.651 -11.585  -2.088
  426    H    THR  73           H        THR  73  -4.063 -13.629   1.385
  427    HA   THR  73           HA       THR  73  -4.482 -16.496   1.060
  428    HB   THR  73           HB       THR  73  -3.439 -15.705   3.133
  429    HG1  THR  73           HG1      THR  73  -6.061 -16.703   3.542
  430   1HG2  THR  73          1HG2      THR  73  -5.914 -14.600   4.248
  431   2HG2  THR  73          2HG2      THR  73  -5.092 -13.578   3.070
  432   3HG2  THR  73          3HG2      THR  73  -4.235 -14.131   4.509
  433    H    ALA  74           H        ALA  74  -6.288 -13.517   1.477
  434    HA   ALA  74           HA       ALA  74  -8.823 -14.975   1.445
  435   1HB   ALA  74          1HB       ALA  74  -9.764 -13.200   2.479
  436   2HB   ALA  74          2HB       ALA  74  -8.838 -12.027   1.544
  437   3HB   ALA  74          3HB       ALA  74  -8.092 -12.846   2.917
  438    H    CYS  75           H        CYS  75  -9.236 -15.605  -0.613
  439    HA   CYS  75           HA       CYS  75  -9.171 -13.527  -2.701
  440   1HB   CYS  75          1HB       CYS  75  -8.906 -16.530  -2.941
  441   2HB   CYS  75          2HB       CYS  75  -9.051 -15.436  -4.319
  442    H    THR  76           H        THR  76 -11.114 -12.751  -3.141
  443    HA   THR  76           HA       THR  76 -13.367 -14.619  -3.362
  444    HB   THR  76           HB       THR  76 -13.810 -13.660  -1.261
  445    HG1  THR  76           HG1      THR  76 -15.598 -12.313  -1.670
  446   1HG2  THR  76          1HG2      THR  76 -12.082 -11.798  -1.565
  447   2HG2  THR  76          2HG2      THR  76 -13.515 -11.458  -0.593
  448   3HG2  THR  76          3HG2      THR  76 -13.414 -10.867  -2.251
  449    H    ASN  77           H        ASN  77 -13.396 -14.561  -5.576
  450    HA   ASN  77           HA       ASN  77 -14.018 -13.809  -7.633
  451   1HB   ASN  77          1HB       ASN  77 -15.569 -12.310  -5.882
  452   2HB   ASN  77          2HB       ASN  77 -14.821 -11.093  -6.918
  453   1HD2  ASN  77          1HD2      ASN  77 -16.154 -10.537  -8.466
  454   2HD2  ASN  77          2HD2      ASN  77 -17.166 -11.600  -9.378
  455    H    SER  78           H        SER  78 -11.724 -13.819  -8.080
  456    HA   SER  78           HA       SER  78 -10.794 -11.168  -8.841
  457   1HB   SER  78          1HB       SER  78  -8.756 -12.911  -7.540
  458   2HB   SER  78          2HB       SER  78  -8.846 -11.148  -7.617
  459    HG   SER  78           HG       SER  78 -10.040 -12.923  -5.829
  460    H    SER  79           H        SER  79  -8.910 -11.265 -10.304
  461    HA   SER  79           HA       SER  79  -9.194 -13.480 -12.139
  462   1HB   SER  79          1HB       SER  79  -9.120 -11.013 -12.812
  463   2HB   SER  79          2HB       SER  79  -7.384 -11.121 -12.522
  464    HG   SER  79           HG       SER  79  -8.802 -12.860 -14.255
  465    H    GLY  80           H        GLY  80  -6.771 -12.085 -10.035
  466   1HA   GLY  80          1HA       GLY  80  -4.894 -14.202 -10.845
  467   2HA   GLY  80          2HA       GLY  80  -4.441 -12.697 -10.063
  468    H    CYS  81           H        CYS  81  -6.905 -13.166  -8.257
  469    HA   CYS  81           HA       CYS  81  -5.398 -14.485  -6.191
  470   1HB   CYS  81          1HB       CYS  81  -7.234 -12.502  -6.133
  471   2HB   CYS  81          2HB       CYS  81  -8.254 -13.880  -5.712
  472    HA   PRO  82           HA       PRO  82  -6.577 -18.681  -7.220
  473   1HB   PRO  82          1HB       PRO  82  -6.265 -18.813  -4.242
  474   2HB   PRO  82          2HB       PRO  82  -5.680 -19.932  -5.485
  475   1HG   PRO  82          1HG       PRO  82  -4.047 -18.141  -4.339
  476   2HG   PRO  82          2HG       PRO  82  -3.895 -18.579  -6.050
  477   1HD   PRO  82          1HD       PRO  82  -4.876 -16.079  -4.828
  478   2HD   PRO  82          2HD       PRO  82  -4.204 -16.359  -6.445
  479    H    GLY  83           H        GLY  83  -8.580 -19.410  -7.503
  480   1HA   GLY  83          1HA       GLY  83 -10.483 -20.030  -5.685
  481   2HA   GLY  83          2HA       GLY  83 -10.772 -18.319  -5.966
  482    H    HIS  84           H        HIS  84 -12.537 -20.538  -6.547
  483    HA   HIS  84           HA       HIS  84 -12.549 -21.251  -9.253
  484   1HB   HIS  84          1HB       HIS  84 -13.996 -22.087  -7.224
  485   2HB   HIS  84          2HB       HIS  84 -15.118 -20.846  -7.768
  486    HD1  HIS  84           HD1      HIS  84 -13.272 -23.825  -9.252
  487    HD2  HIS  84           HD2      HIS  84 -16.826 -21.715  -9.676
  488    HE1  HIS  84           HE1      HIS  84 -14.597 -25.082 -10.980
  489    HE2  HIS  84           HE2      HIS  84 -16.781 -23.838 -11.154
  Start of MODEL   11
    1   1H    GLN   1          1H        GLN   1  -3.697  21.073   4.830
    2   2H    GLN   1          2H        GLN   1  -4.284  20.726   6.406
    3   3H    GLN   1          3H        GLN   1  -5.307  21.483   5.254
    4    HA   GLN   1           HA       GLN   1  -4.130  18.830   4.831
    5   1HB   GLN   1          1HB       GLN   1  -6.669  19.643   6.246
    6   2HB   GLN   1          2HB       GLN   1  -6.440  18.038   5.567
    7   1HG   GLN   1          1HG       GLN   1  -5.112  17.384   7.240
    8   2HG   GLN   1          2HG       GLN   1  -4.256  18.924   7.296
    9   1HE2  GLN   1          1HE2      GLN   1  -6.075  20.732   7.919
   10   2HE2  GLN   1          2HE2      GLN   1  -6.832  20.388   9.433
   11    H    CYS   2           H        CYS   2  -4.412  18.277   2.777
   12    HA   CYS   2           HA       CYS   2  -6.601  19.546   1.266
   13   1HB   CYS   2          1HB       CYS   2  -5.209  19.349  -0.736
   14   2HB   CYS   2          2HB       CYS   2  -4.382  20.281   0.508
   15    H    THR   3           H        THR   3  -7.548  18.270  -0.453
   16    HA   THR   3           HA       THR   3  -7.050  15.441  -0.556
   17    HB   THR   3           HB       THR   3  -9.672  15.176  -0.029
   18    HG1  THR   3           HG1      THR   3 -10.367  16.926   0.875
   19   1HG2  THR   3          1HG2      THR   3  -9.145  14.190   1.996
   20   2HG2  THR   3          2HG2      THR   3  -7.819  15.310   2.310
   21   3HG2  THR   3          3HG2      THR   3  -7.645  14.060   1.078
   22    H    GLY   4           H        GLY   4 -10.028  17.310  -1.086
   23   1HA   GLY   4          1HA       GLY   4 -11.068  17.953  -3.047
   24   2HA   GLY   4          2HA       GLY   4  -9.600  17.513  -3.918
   25    H    GLY   5           H        GLY   5 -12.748  16.881  -3.837
   26   1HA   GLY   5          1HA       GLY   5 -12.590  13.978  -4.060
   27   2HA   GLY   5          2HA       GLY   5 -14.055  14.947  -4.107
   28    H    ALA   6           H        ALA   6 -11.045  14.898  -6.021
   29    HA   ALA   6           HA       ALA   6 -12.233  13.856  -8.352
   30   1HB   ALA   6          1HB       ALA   6 -13.436  15.703  -8.885
   31   2HB   ALA   6          2HB       ALA   6 -11.896  16.196  -9.587
   32   3HB   ALA   6          3HB       ALA   6 -12.371  16.791  -7.996
   33    H    ASP   7           H        ASP   7 -10.006  16.609  -7.992
   34    HA   ASP   7           HA       ASP   7  -7.852  14.877  -9.019
   35   1HB   ASP   7          1HB       ASP   7  -6.899  17.025  -9.994
   36   2HB   ASP   7          2HB       ASP   7  -8.359  16.401 -10.767
   37    H    CYS   8           H        CYS   8  -5.752  15.230  -8.223
   38    HA   CYS   8           HA       CYS   8  -5.630  16.803  -5.734
   39   1HB   CYS   8          1HB       CYS   8  -4.693  14.040  -6.361
   40   2HB   CYS   8          2HB       CYS   8  -3.740  15.010  -5.235
   41    H    THR   9           H        THR   9  -4.218  18.406  -5.764
   42    HA   THR   9           HA       THR   9  -1.752  18.131  -7.317
   43    HB   THR   9           HB       THR   9  -3.204  19.327  -8.817
   44    HG1  THR   9           HG1      THR   9  -1.598  20.592  -9.206
   45   1HG2  THR   9          1HG2      THR   9  -3.620  21.705  -7.193
   46   2HG2  THR   9          2HG2      THR   9  -4.502  20.292  -6.617
   47   3HG2  THR   9          3HG2      THR   9  -4.724  20.855  -8.274
   48    H    SER  10           H        SER  10   0.003  19.009  -6.368
   49    HA   SER  10           HA       SER  10   1.294  20.257  -4.943
   50   1HB   SER  10          1HB       SER  10  -0.650  21.959  -5.075
   51   2HB   SER  10          2HB       SER  10  -1.142  21.296  -3.517
   52    HG   SER  10           HG       SER  10   1.478  22.241  -4.023
   53    H    CYS  11           H        CYS  11  -1.037  17.967  -4.066
   54    HA   CYS  11           HA       CYS  11  -0.169  17.761  -1.303
   55   1HB   CYS  11          1HB       CYS  11  -2.033  15.947  -2.846
   56   2HB   CYS  11          2HB       CYS  11  -1.826  16.004  -1.099
   57    H    THR  12           H        THR  12   0.490  15.577  -0.477
   58    HA   THR  12           HA       THR  12   1.917  13.940  -2.425
   59    HB   THR  12           HB       THR  12   3.493  15.712  -1.599
   60    HG1  THR  12           HG1      THR  12   5.013  14.288  -1.816
   61   1HG2  THR  12          1HG2      THR  12   4.297  15.789   0.568
   62   2HG2  THR  12          2HG2      THR  12   3.600  14.225   0.988
   63   3HG2  THR  12          3HG2      THR  12   2.555  15.630   0.786
   64    H    GLY  13           H        GLY  13   0.936  14.426   0.936
   65   1HA   GLY  13          1HA       GLY  13   1.459  11.825   1.855
   66   2HA   GLY  13          2HA       GLY  13   0.312  12.945   2.570
   67    H    ALA  14           H        ALA  14  -1.445  11.725   2.924
   68    HA   ALA  14           HA       ALA  14  -2.318   9.735   1.033
   69   1HB   ALA  14          1HB       ALA  14  -4.323   9.692   2.704
   70   2HB   ALA  14          2HB       ALA  14  -3.251  10.664   3.712
   71   3HB   ALA  14          3HB       ALA  14  -2.753   9.055   3.189
   72    H    CYS  15           H        CYS  15  -4.428   9.693   0.056
   73    HA   CYS  15           HA       CYS  15  -5.770  12.274  -0.232
   74   1HB   CYS  15          1HB       CYS  15  -5.878  11.413  -2.814
   75   2HB   CYS  15          2HB       CYS  15  -4.728  12.599  -2.210
   76    H    THR  16           H        THR  16  -7.916  12.128  -1.089
   77    HA   THR  16           HA       THR  16  -9.076   9.446  -1.224
   78    HB   THR  16           HB       THR  16 -11.003  10.293   0.199
   79    HG1  THR  16           HG1      THR  16  -9.098  12.225   1.011
   80   1HG2  THR  16          1HG2      THR  16 -10.144   9.257   1.962
   81   2HG2  THR  16          2HG2      THR  16  -8.822  10.416   2.107
   82   3HG2  THR  16          3HG2      THR  16  -8.685   9.057   0.992
   83    H    GLY  17           H        GLY  17 -10.683   9.261  -2.718
   84   1HA   GLY  17          1HA       GLY  17 -11.993   9.839  -4.517
   85   2HA   GLY  17          2HA       GLY  17 -12.412  11.274  -3.580
   86    H    CYS  18           H        CYS  18  -9.402  10.150  -5.107
   87    HA   CYS  18           HA       CYS  18  -9.384  12.600  -6.738
   88   1HB   CYS  18          1HB       CYS  18  -7.469  11.766  -4.688
   89   2HB   CYS  18          2HB       CYS  18  -6.708  12.106  -6.244
   90    H    GLY  19           H        GLY  19  -9.444  11.983  -8.805
   91   1HA   GLY  19          1HA       GLY  19  -9.099   9.492  -9.873
   92   2HA   GLY  19          2HA       GLY  19  -8.789  10.974 -10.774
   93    H    ASN  20           H        ASN  20  -6.583  11.721  -8.938
   94    HA   ASN  20           HA       ASN  20  -4.598   9.656  -9.559
   95   1HB   ASN  20          1HB       ASN  20  -4.532  11.308 -11.392
   96   2HB   ASN  20          2HB       ASN  20  -4.260  12.592 -10.218
   97   1HD2  ASN  20          1HD2      ASN  20  -2.268  12.768  -9.214
   98   2HD2  ASN  20          2HD2      ASN  20  -0.865  11.942  -9.792
   99    H    CYS  21           H        CYS  21  -2.769   9.656  -8.207
  100    HA   CYS  21           HA       CYS  21  -2.873  11.489  -5.915
  101   1HB   CYS  21          1HB       CYS  21  -2.916   8.510  -5.917
  102   2HB   CYS  21          2HB       CYS  21  -1.987   9.318  -4.653
  103    HA   PRO  22           HA       PRO  22   1.449  11.765  -6.916
  104   1HB   PRO  22          1HB       PRO  22   2.129  13.672  -5.187
  105   2HB   PRO  22          2HB       PRO  22   1.026  14.008  -6.527
  106   1HG   PRO  22          1HG       PRO  22   0.424  13.576  -3.638
  107   2HG   PRO  22          2HG       PRO  22  -0.331  14.693  -4.787
  108   1HD   PRO  22          1HD       PRO  22  -1.336  12.197  -4.016
  109   2HD   PRO  22          2HD       PRO  22  -1.855  13.138  -5.428
  110    H    ASN  23           H        ASN  23   2.158   9.677  -6.232
  111    HA   ASN  23           HA       ASN  23   3.294   8.167  -4.952
  112   1HB   ASN  23          1HB       ASN  23   4.488  10.729  -3.869
  113   2HB   ASN  23          2HB       ASN  23   5.169   9.117  -3.628
  114   1HD2  ASN  23          1HD2      ASN  23   3.772  10.765  -6.442
  115   2HD2  ASN  23          2HD2      ASN  23   5.140  10.535  -7.472
  116    H    ALA  24           H        ALA  24   0.759   9.313  -3.871
  117    HA   ALA  24           HA       ALA  24   0.743   9.743  -1.158
  118   1HB   ALA  24          1HB       ALA  24  -1.517   9.271  -1.186
  119   2HB   ALA  24          2HB       ALA  24  -1.336   7.965  -2.357
  120   3HB   ALA  24          3HB       ALA  24  -1.196   9.644  -2.879
  121    H    VAL  25           H        VAL  25   1.091   8.582   0.635
  122    HA   VAL  25           HA       VAL  25   2.114   5.892   0.369
  123    HB   VAL  25           HB       VAL  25   3.231   7.483   1.866
  124   1HG1  VAL  25          1HG1      VAL  25   1.503   8.843   2.691
  125   2HG1  VAL  25          2HG1      VAL  25   2.078   7.937   4.091
  126   3HG1  VAL  25          3HG1      VAL  25   0.583   7.460   3.285
  127   1HG2  VAL  25          1HG2      VAL  25   2.222   5.548   3.835
  128   2HG2  VAL  25          2HG2      VAL  25   3.868   5.852   3.280
  129   3HG2  VAL  25          3HG2      VAL  25   2.784   4.847   2.318
  130    H    THR  26           H        THR  26  -0.901   7.322   1.029
  131    HA   THR  26           HA       THR  26  -2.144   4.776   1.405
  132    HB   THR  26           HB       THR  26  -2.889   6.497   3.667
  133    HG1  THR  26           HG1      THR  26  -1.051   6.083   4.854
  134   1HG2  THR  26          1HG2      THR  26  -2.097   4.044   4.636
  135   2HG2  THR  26          2HG2      THR  26  -2.748   3.676   3.039
  136   3HG2  THR  26          3HG2      THR  26  -3.741   4.528   4.221
  137    H    CYS  27           H        CYS  27  -4.248   4.837   0.764
  138    HA   CYS  27           HA       CYS  27  -5.717   7.327   0.757
  139   1HB   CYS  27          1HB       CYS  27  -6.119   6.510  -1.876
  140   2HB   CYS  27          2HB       CYS  27  -5.206   7.920  -1.343
  141    H    THR  28           H        THR  28  -7.892   7.058   0.721
  142    HA   THR  28           HA       THR  28  -8.855   4.293   0.827
  143    HB   THR  28           HB       THR  28 -10.231   6.862   1.651
  144    HG1  THR  28           HG1      THR  28  -8.622   6.534   3.092
  145   1HG2  THR  28          1HG2      THR  28 -12.034   5.511   1.505
  146   2HG2  THR  28          2HG2      THR  28 -11.463   5.007   3.095
  147   3HG2  THR  28          3HG2      THR  28 -11.085   4.035   1.673
  148    H    ASN  29           H        ASN  29  -9.281   3.655  -1.235
  149    HA   ASN  29           HA       ASN  29 -10.468   3.410  -3.105
  150   1HB   ASN  29          1HB       ASN  29 -11.931   5.967  -2.424
  151   2HB   ASN  29          2HB       ASN  29 -12.434   4.720  -3.566
  152   1HD2  ASN  29          1HD2      ASN  29 -13.953   3.437  -2.850
  153   2HD2  ASN  29          2HD2      ASN  29 -14.238   3.004  -1.202
  154    H    SER  30           H        SER  30 -11.196   5.128  -4.998
  155    HA   SER  30           HA       SER  30 -10.533   6.695  -6.561
  156   1HB   SER  30          1HB       SER  30  -9.254   7.659  -4.310
  157   2HB   SER  30          2HB       SER  30  -7.923   7.389  -5.435
  158    HG   SER  30           HG       SER  30 -10.280   8.745  -6.198
  159    H    GLN  31           H        GLN  31  -7.738   7.131  -7.345
  160    HA   GLN  31           HA       GLN  31  -6.864   4.418  -8.010
  161   1HB   GLN  31          1HB       GLN  31  -8.383   5.572  -9.804
  162   2HB   GLN  31          2HB       GLN  31  -6.921   6.485 -10.177
  163   1HG   GLN  31          1HG       GLN  31  -5.778   4.602 -10.901
  164   2HG   GLN  31          2HG       GLN  31  -6.862   3.497 -10.055
  165   1HE2  GLN  31          1HE2      GLN  31  -7.162   6.091 -12.467
  166   2HE2  GLN  31          2HE2      GLN  31  -8.176   5.200 -13.547
  167    H    HIS  32           H        HIS  32  -4.701   4.375  -9.013
  168    HA   HIS  32           HA       HIS  32  -2.504   4.933  -9.132
  169   1HB   HIS  32          1HB       HIS  32  -3.571   7.161  -9.962
  170   2HB   HIS  32          2HB       HIS  32  -3.098   7.771  -8.374
  171    HD1  HIS  32           HD1      HIS  32  -0.946   5.349 -10.272
  172    HD2  HIS  32           HD2      HIS  32  -1.081   9.404  -9.376
  173    HE1  HIS  32           HE1      HIS  32   1.283   6.269 -10.984
  174    HE2  HIS  32           HE2      HIS  32   1.144   8.740 -10.514
  175    H    CYS  33           H        CYS  33  -3.083   3.689  -6.913
  176    HA   CYS  33           HA       CYS  33  -1.698   5.209  -4.797
  177   1HB   CYS  33          1HB       CYS  33  -3.953   3.211  -4.566
  178   2HB   CYS  33          2HB       CYS  33  -2.944   3.667  -3.191
  179    H    VAL  34           H        VAL  34  -0.372   3.746  -6.774
  180    HA   VAL  34           HA       VAL  34   0.223   1.093  -6.146
  181    HB   VAL  34           HB       VAL  34   0.854   2.139  -8.272
  182   1HG1  VAL  34          1HG1      VAL  34   3.264   3.392  -7.084
  183   2HG1  VAL  34          2HG1      VAL  34   1.728   4.238  -6.897
  184   3HG1  VAL  34          3HG1      VAL  34   2.331   3.851  -8.508
  185   1HG2  VAL  34          1HG2      VAL  34   3.216   1.229  -8.369
  186   2HG2  VAL  34          2HG2      VAL  34   1.976   0.113  -7.798
  187   3HG2  VAL  34          3HG2      VAL  34   3.057   0.894  -6.645
  188    H    LYS  35           H        LYS  35   1.604   4.091  -4.908
  189    HA   LYS  35           HA       LYS  35   3.513   2.585  -3.296
  190   1HB   LYS  35          1HB       LYS  35   4.167   4.674  -4.561
  191   2HB   LYS  35          2HB       LYS  35   3.166   5.581  -3.437
  192   1HG   LYS  35          1HG       LYS  35   5.599   5.583  -2.908
  193   2HG   LYS  35          2HG       LYS  35   4.565   5.009  -1.601
  194   1HD   LYS  35          1HD       LYS  35   6.538   3.601  -1.818
  195   2HD   LYS  35          2HD       LYS  35   5.081   2.692  -2.222
  196   1HE   LYS  35          1HE       LYS  35   6.624   2.103  -3.883
  197   2HE   LYS  35          2HE       LYS  35   5.583   3.302  -4.648
  198   1HZ   LYS  35          1HZ       LYS  35   7.683   4.005  -5.229
  199   2HZ   LYS  35          2HZ       LYS  35   8.372   3.580  -3.744
  200   3HZ   LYS  35          3HZ       LYS  35   7.385   4.949  -3.856
  201    H    ALA  36           H        ALA  36   0.665   2.404  -2.740
  202    HA   ALA  36           HA       ALA  36   0.472   3.790  -0.159
  203   1HB   ALA  36          1HB       ALA  36  -1.883   3.471  -0.257
  204   2HB   ALA  36          2HB       ALA  36  -1.736   2.347  -1.609
  205   3HB   ALA  36          3HB       ALA  36  -1.372   4.057  -1.840
  206    H    ASN  37           H        ASN  37   0.723   2.687   1.672
  207    HA   ASN  37           HA       ASN  37   1.451  -0.033   1.703
  208   1HB   ASN  37          1HB       ASN  37   1.219   0.190   4.198
  209   2HB   ASN  37          2HB       ASN  37   2.255   1.400   3.447
  210   1HD2  ASN  37          1HD2      ASN  37   1.533   2.129   5.790
  211   2HD2  ASN  37          2HD2      ASN  37   0.231   3.264   5.791
  212    H    THR  38           H        THR  38  -1.615   1.589   2.118
  213    HA   THR  38           HA       THR  38  -2.966  -0.990   2.018
  214    HB   THR  38           HB       THR  38  -4.073   0.904   4.015
  215    HG1  THR  38           HG1      THR  38  -1.735  -0.629   4.465
  216   1HG2  THR  38          1HG2      THR  38  -4.764  -1.588   3.326
  217   2HG2  THR  38          2HG2      THR  38  -5.043  -0.905   4.927
  218   3HG2  THR  38          3HG2      THR  38  -3.642  -1.938   4.640
  219    H    CYS  39           H        CYS  39  -4.701  -0.926   0.723
  220    HA   CYS  39           HA       CYS  39  -6.057   1.625   0.272
  221   1HB   CYS  39          1HB       CYS  39  -6.087   1.009  -2.232
  222   2HB   CYS  39          2HB       CYS  39  -4.601   1.691  -1.568
  223    H    THR  40           H        THR  40  -8.174   1.420  -0.628
  224    HA   THR  40           HA       THR  40  -9.317  -1.276  -0.320
  225    HB   THR  40           HB       THR  40 -10.161   0.004   1.478
  226    HG1  THR  40           HG1      THR  40 -11.924  -0.942   0.716
  227   1HG2  THR  40          1HG2      THR  40 -10.501   2.231  -0.492
  228   2HG2  THR  40          2HG2      THR  40  -9.613   2.225   1.032
  229   3HG2  THR  40          3HG2      THR  40 -11.377   2.191   1.038
  230    H    GLY  41           H        GLY  41 -11.692   0.854  -1.348
  231   1HA   GLY  41          1HA       GLY  41 -11.931  -0.313  -3.901
  232   2HA   GLY  41          2HA       GLY  41 -12.758   1.133  -3.358
  233    H    SER  42           H        SER  42  -9.554   0.057  -4.448
  234    HA   SER  42           HA       SER  42  -9.440   2.433  -6.125
  235   1HB   SER  42          1HB       SER  42  -7.987   2.185  -3.678
  236   2HB   SER  42          2HB       SER  42  -6.824   2.014  -4.991
  237    HG   SER  42           HG       SER  42  -7.051   4.182  -4.474
  238    H    THR  43           H        THR  43  -6.745   1.988  -6.953
  239    HA   THR  43           HA       THR  43  -6.711  -0.809  -7.751
  240    HB   THR  43           HB       THR  43  -6.975  -0.513  -9.971
  241    HG1  THR  43           HG1      THR  43  -6.266   1.363 -11.091
  242   1HG2  THR  43          1HG2      THR  43  -9.020   0.405  -9.367
  243   2HG2  THR  43          2HG2      THR  43  -8.373   1.531 -10.561
  244   3HG2  THR  43          3HG2      THR  43  -8.296   1.927  -8.844
  245    H    ASP  44           H        ASP  44  -4.571   0.144  -9.821
  246    HA   ASP  44           HA       ASP  44  -2.262  -0.420  -9.471
  247   1HB   ASP  44          1HB       ASP  44  -3.007   2.065 -10.181
  248   2HB   ASP  44          2HB       ASP  44  -2.093   2.439  -8.724
  249    H    CYS  45           H        CYS  45  -2.288  -1.722  -7.480
  250    HA   CYS  45           HA       CYS  45  -1.074  -0.215  -5.262
  251   1HB   CYS  45          1HB       CYS  45  -3.504  -1.936  -5.188
  252   2HB   CYS  45          2HB       CYS  45  -2.387  -2.048  -3.824
  253    H    ASN  46           H        ASN  46   0.944  -1.014  -5.976
  254    HA   ASN  46           HA       ASN  46   1.340  -3.903  -5.933
  255   1HB   ASN  46          1HB       ASN  46   2.359  -2.708  -7.779
  256   2HB   ASN  46          2HB       ASN  46   3.204  -1.633  -6.659
  257   1HD2  ASN  46          1HD2      ASN  46   5.086  -2.280  -5.754
  258   2HD2  ASN  46          2HD2      ASN  46   5.869  -3.777  -6.113
  259    H    THR  47           H        THR  47   2.261  -1.016  -4.124
  260    HA   THR  47           HA       THR  47   3.956  -2.551  -2.342
  261    HB   THR  47           HB       THR  47   3.614   0.231  -3.024
  262    HG1  THR  47           HG1      THR  47   5.621  -0.476  -3.133
  263   1HG2  THR  47          1HG2      THR  47   3.830  -0.314  -0.073
  264   2HG2  THR  47          2HG2      THR  47   2.478   0.477  -0.881
  265   3HG2  THR  47          3HG2      THR  47   4.067   1.243  -0.866
  266    H    ALA  48           H        ALA  48   0.662  -1.675  -2.528
  267    HA   ALA  48           HA       ALA  48   0.082  -1.551   0.254
  268   1HB   ALA  48          1HB       ALA  48  -1.295  -0.878  -1.954
  269   2HB   ALA  48          2HB       ALA  48  -2.040  -1.126  -0.376
  270   3HB   ALA  48          3HB       ALA  48  -2.061  -2.420  -1.574
  271    H    GLN  49           H        GLN  49  -0.862  -3.088   1.599
  272    HA   GLN  49           HA       GLN  49  -0.243  -5.857   0.892
  273   1HB   GLN  49          1HB       GLN  49  -0.443  -6.326   3.269
  274   2HB   GLN  49          2HB       GLN  49   0.634  -4.958   3.013
  275   1HG   GLN  49          1HG       GLN  49  -1.672  -3.643   3.357
  276   2HG   GLN  49          2HG       GLN  49  -2.003  -5.079   4.325
  277   1HE2  GLN  49          1HE2      GLN  49  -1.653  -4.663   6.378
  278   2HE2  GLN  49          2HE2      GLN  49  -0.329  -3.764   7.027
  279    H    THR  50           H        THR  50  -2.699  -4.161   0.105
  280    HA   THR  50           HA       THR  50  -4.559  -6.237  -0.024
  281    HB   THR  50           HB       THR  50  -4.608  -5.620   2.471
  282    HG1  THR  50           HG1      THR  50  -6.254  -6.828   1.495
  283   1HG2  THR  50          1HG2      THR  50  -4.678  -3.164   2.115
  284   2HG2  THR  50          2HG2      THR  50  -5.945  -3.797   3.166
  285   3HG2  THR  50          3HG2      THR  50  -6.318  -3.361   1.498
  286    H    CYS  51           H        CYS  51  -6.704  -5.451  -0.872
  287    HA   CYS  51           HA       CYS  51  -7.142  -2.792  -1.625
  288   1HB   CYS  51          1HB       CYS  51  -6.615  -2.822  -4.001
  289   2HB   CYS  51          2HB       CYS  51  -5.157  -3.123  -3.048
  290    H    THR  52           H        THR  52  -9.266  -2.712  -1.794
  291    HA   THR  52           HA       THR  52 -10.711  -5.073  -2.765
  292    HB   THR  52           HB       THR  52 -11.132  -3.559  -0.524
  293    HG1  THR  52           HG1      THR  52 -12.649  -4.990  -0.257
  294   1HG2  THR  52          1HG2      THR  52 -13.119  -2.290  -0.714
  295   2HG2  THR  52          2HG2      THR  52 -13.309  -2.719  -2.413
  296   3HG2  THR  52          3HG2      THR  52 -11.986  -1.669  -1.912
  297    H    ASN  53           H        ASN  53 -12.248  -4.912  -4.435
  298    HA   ASN  53           HA       ASN  53 -12.928  -4.214  -6.506
  299   1HB   ASN  53          1HB       ASN  53 -13.307  -1.881  -4.692
  300   2HB   ASN  53          2HB       ASN  53 -13.478  -1.596  -6.426
  301   1HD2  ASN  53          1HD2      ASN  53 -14.313  -4.428  -4.477
  302   2HD2  ASN  53          2HD2      ASN  53 -15.998  -4.414  -4.864
  303    H    SER  54           H        SER  54 -10.038  -4.091  -5.867
  304    HA   SER  54           HA       SER  54  -9.102  -1.866  -7.524
  305   1HB   SER  54          1HB       SER  54  -7.800  -2.036  -5.576
  306   2HB   SER  54          2HB       SER  54  -7.768  -3.802  -5.639
  307    HG   SER  54           HG       SER  54  -5.786  -3.028  -6.317
  308    H    LYS  55           H        LYS  55  -7.083  -2.584  -8.921
  309    HA   LYS  55           HA       LYS  55  -7.580  -5.165 -10.208
  310   1HB   LYS  55          1HB       LYS  55  -7.399  -2.532 -11.686
  311   2HB   LYS  55          2HB       LYS  55  -7.398  -4.115 -12.451
  312   1HG   LYS  55          1HG       LYS  55  -9.603  -3.982 -12.570
  313   2HG   LYS  55          2HG       LYS  55  -9.653  -4.103 -10.810
  314   1HD   LYS  55          1HD       LYS  55 -10.900  -2.155 -11.593
  315   2HD   LYS  55          2HD       LYS  55  -9.501  -1.669 -10.635
  316   1HE   LYS  55          1HE       LYS  55  -9.953  -0.380 -12.791
  317   2HE   LYS  55          2HE       LYS  55  -8.310  -0.962 -12.522
  318   1HZ   LYS  55          1HZ       LYS  55  -9.502  -1.322 -14.801
  319   2HZ   LYS  55          2HZ       LYS  55 -10.174  -2.662 -14.018
  320   3HZ   LYS  55          3HZ       LYS  55  -8.494  -2.522 -14.160
  321    H    ASP  56           H        ASP  56  -5.504  -3.725  -8.491
  322    HA   ASP  56           HA       ASP  56  -3.213  -4.790  -9.895
  323   1HB   ASP  56          1HB       ASP  56  -3.555  -1.884  -9.278
  324   2HB   ASP  56          2HB       ASP  56  -1.945  -2.605  -9.210
  325    H    CYS  57           H        CYS  57  -2.618  -6.206  -8.402
  326    HA   CYS  57           HA       CYS  57  -1.690  -5.254  -5.851
  327   1HB   CYS  57          1HB       CYS  57  -4.262  -6.600  -6.102
  328   2HB   CYS  57          2HB       CYS  57  -3.166  -7.453  -5.009
  329    H    PHE  58           H        PHE  58   0.311  -5.996  -6.084
  330    HA   PHE  58           HA       PHE  58   0.690  -8.793  -6.901
  331   1HB   PHE  58          1HB       PHE  58   2.712  -6.543  -6.871
  332   2HB   PHE  58          2HB       PHE  58   2.960  -8.161  -7.518
  333    HD1  PHE  58           HD1      PHE  58   0.616  -5.302  -7.885
  334    HD2  PHE  58           HD2      PHE  58   2.825  -8.435  -9.727
  335    HE1  PHE  58           HE1      PHE  58  -0.121  -4.523 -10.090
  336    HE2  PHE  58           HE2      PHE  58   2.091  -7.658 -11.935
  337    HZ   PHE  58           HZ       PHE  58   0.637  -5.707 -12.084
  338    H    GLU  59           H        GLU  59   0.800  -6.736  -4.209
  339    HA   GLU  59           HA       GLU  59   2.140  -8.822  -2.657
  340   1HB   GLU  59          1HB       GLU  59   3.756  -6.960  -3.286
  341   2HB   GLU  59          2HB       GLU  59   2.790  -5.903  -2.255
  342   1HG   GLU  59          1HG       GLU  59   3.250  -7.370  -0.346
  343   2HG   GLU  59          2HG       GLU  59   4.241  -8.394  -1.384
  344    H    ALA  60           H        ALA  60  -0.613  -8.332  -2.837
  345    HA   ALA  60           HA       ALA  60  -1.263  -6.941  -0.340
  346   1HB   ALA  60          1HB       ALA  60  -2.768  -6.085  -1.800
  347   2HB   ALA  60          2HB       ALA  60  -3.680  -7.512  -1.306
  348   3HB   ALA  60          3HB       ALA  60  -2.767  -7.526  -2.817
  349    H    ASN  61           H        ASN  61  -3.138  -7.964   0.904
  350    HA   ASN  61           HA       ASN  61  -2.685 -10.870   1.076
  351   1HB   ASN  61          1HB       ASN  61  -2.234  -8.894   3.043
  352   2HB   ASN  61          2HB       ASN  61  -3.649  -9.804   3.562
  353   1HD2  ASN  61          1HD2      ASN  61  -0.619 -10.629   1.908
  354   2HD2  ASN  61          2HD2      ASN  61  -0.179 -11.904   2.988
  355    H    THR  62           H        THR  62  -5.057  -8.267   1.229
  356    HA   THR  62           HA       THR  62  -7.151 -10.319   0.976
  357    HB   THR  62           HB       THR  62  -7.347  -7.879   2.749
  358    HG1  THR  62           HG1      THR  62  -6.580  -9.131   4.223
  359   1HG2  THR  62          1HG2      THR  62  -9.377  -9.304   3.574
  360   2HG2  THR  62          2HG2      THR  62  -9.328  -9.934   1.928
  361   3HG2  THR  62          3HG2      THR  62  -9.537  -8.204   2.205
  362    H    CYS  63           H        CYS  63  -7.327  -9.909  -1.232
  363    HA   CYS  63           HA       CYS  63  -8.509  -7.292  -1.891
  364   1HB   CYS  63          1HB       CYS  63  -7.548  -7.672  -4.214
  365   2HB   CYS  63          2HB       CYS  63  -6.384  -7.292  -2.944
  366    H    THR  64           H        THR  64 -10.614  -7.596  -2.197
  367    HA   THR  64           HA       THR  64 -11.503 -10.045  -3.565
  368    HB   THR  64           HB       THR  64 -13.791  -9.169  -2.557
  369    HG1  THR  64           HG1      THR  64 -13.460  -8.118  -0.596
  370   1HG2  THR  64          1HG2      THR  64 -13.661 -10.890  -1.161
  371   2HG2  THR  64          2HG2      THR  64 -12.250 -10.228  -0.338
  372   3HG2  THR  64          3HG2      THR  64 -12.049 -11.153  -1.826
  373    H    ASP  65           H        ASP  65 -13.193  -9.888  -5.130
  374    HA   ASP  65           HA       ASP  65 -14.073  -9.045  -7.054
  375   1HB   ASP  65          1HB       ASP  65 -15.082  -7.592  -4.979
  376   2HB   ASP  65          2HB       ASP  65 -14.406  -6.314  -5.992
  377    H    SER  66           H        SER  66 -11.172  -8.752  -6.612
  378    HA   SER  66           HA       SER  66 -10.677  -6.468  -8.405
  379   1HB   SER  66          1HB       SER  66  -8.380  -6.400  -7.411
  380   2HB   SER  66          2HB       SER  66  -9.665  -6.030  -6.254
  381    HG   SER  66           HG       SER  66  -9.440  -8.046  -5.372
  382    H    THR  67           H        THR  67  -8.361  -6.815  -9.442
  383    HA   THR  67           HA       THR  67  -8.177  -9.558 -10.463
  384    HB   THR  67           HB       THR  67  -9.151  -8.550 -12.282
  385    HG1  THR  67           HG1      THR  67  -6.791  -9.155 -12.673
  386   1HG2  THR  67          1HG2      THR  67  -9.188  -6.274 -11.250
  387   2HG2  THR  67          2HG2      THR  67  -8.981  -6.324 -13.000
  388   3HG2  THR  67          3HG2      THR  67  -7.592  -6.019 -11.956
  389    H    ASN  68           H        ASN  68  -6.087 -10.244 -11.093
  390    HA   ASN  68           HA       ASN  68  -3.813 -10.364 -11.005
  391   1HB   ASN  68          1HB       ASN  68  -3.718  -7.374 -10.591
  392   2HB   ASN  68          2HB       ASN  68  -2.499  -8.417 -11.330
  393   1HD2  ASN  68          1HD2      ASN  68  -5.018  -6.313 -11.899
  394   2HD2  ASN  68          2HD2      ASN  68  -5.293  -6.670 -13.568
  395    H    CYS  69           H        CYS  69  -4.343 -11.416  -8.927
  396    HA   CYS  69           HA       CYS  69  -3.101  -9.948  -6.705
  397   1HB   CYS  69          1HB       CYS  69  -5.749 -11.306  -6.783
  398   2HB   CYS  69          2HB       CYS  69  -4.797 -11.456  -5.304
  399    H    TYR  70           H        TYR  70  -1.177 -11.093  -7.236
  400    HA   TYR  70           HA       TYR  70  -1.187 -13.984  -7.014
  401   1HB   TYR  70          1HB       TYR  70   1.300 -12.315  -7.248
  402   2HB   TYR  70          2HB       TYR  70   0.998 -13.950  -7.841
  403    HD1  TYR  70           HD1      TYR  70  -0.620 -14.224  -9.796
  404    HD2  TYR  70           HD2      TYR  70   1.016 -10.467  -8.655
  405    HE1  TYR  70           HE1      TYR  70  -1.157 -13.322 -12.019
  406    HE2  TYR  70           HE2      TYR  70   0.485  -9.554 -10.876
  407    HH   TYR  70           HH       TYR  70  -1.170 -10.065 -12.730
  408    H    LYS  71           H        LYS  71  -1.623 -14.482  -4.946
  409    HA   LYS  71           HA       LYS  71  -0.600 -15.302  -2.967
  410   1HB   LYS  71          1HB       LYS  71   1.133 -14.253  -1.827
  411   2HB   LYS  71          2HB       LYS  71   1.506 -13.905  -3.512
  412   1HG   LYS  71          1HG       LYS  71   0.073 -11.721  -2.931
  413   2HG   LYS  71          2HG       LYS  71   0.696 -12.092  -1.321
  414   1HD   LYS  71          1HD       LYS  71   2.707 -12.284  -3.435
  415   2HD   LYS  71          2HD       LYS  71   2.021 -10.668  -3.253
  416   1HE   LYS  71          1HE       LYS  71   2.752 -10.472  -1.052
  417   2HE   LYS  71          2HE       LYS  71   2.943 -12.213  -0.860
  418   1HZ   LYS  71          1HZ       LYS  71   5.099 -11.670  -1.145
  419   2HZ   LYS  71          2HZ       LYS  71   4.763 -10.264  -2.023
  420   3HZ   LYS  71          3HZ       LYS  71   4.697 -11.772  -2.786
  421    H    ALA  72           H        ALA  72  -3.064 -14.101  -3.570
  422    HA   ALA  72           HA       ALA  72  -3.648 -12.427  -1.234
  423   1HB   ALA  72          1HB       ALA  72  -5.820 -12.025  -2.326
  424   2HB   ALA  72          2HB       ALA  72  -5.331 -13.081  -3.651
  425   3HB   ALA  72          3HB       ALA  72  -4.459 -11.578  -3.354
  426    H    THR  73           H        THR  73  -4.592 -13.260   0.518
  427    HA   THR  73           HA       THR  73  -5.269 -16.042   0.612
  428    HB   THR  73           HB       THR  73  -4.219 -14.853   2.514
  429    HG1  THR  73           HG1      THR  73  -5.241 -16.079   3.923
  430   1HG2  THR  73          1HG2      THR  73  -6.516 -13.118   2.242
  431   2HG2  THR  73          2HG2      THR  73  -5.007 -12.876   3.122
  432   3HG2  THR  73          3HG2      THR  73  -6.340 -13.745   3.880
  433    H    ALA  74           H        ALA  74  -7.026 -13.091   0.151
  434    HA   ALA  74           HA       ALA  74  -9.562 -14.583   0.344
  435   1HB   ALA  74          1HB       ALA  74  -9.160 -12.604   1.911
  436   2HB   ALA  74          2HB       ALA  74 -10.673 -12.631   1.005
  437   3HB   ALA  74          3HB       ALA  74  -9.350 -11.592   0.479
  438    H    CYS  75           H        CYS  75 -10.008 -15.258  -1.677
  439    HA   CYS  75           HA       CYS  75 -10.103 -13.204  -3.781
  440   1HB   CYS  75          1HB       CYS  75  -8.250 -14.427  -4.480
  441   2HB   CYS  75          2HB       CYS  75  -8.899 -15.959  -3.898
  442    H    THR  76           H        THR  76 -12.154 -12.876  -4.270
  443    HA   THR  76           HA       THR  76 -13.937 -15.205  -4.536
  444    HB   THR  76           HB       THR  76 -15.063 -12.564  -3.712
  445    HG1  THR  76           HG1      THR  76 -13.708 -12.661  -2.073
  446   1HG2  THR  76          1HG2      THR  76 -15.956 -15.307  -3.812
  447   2HG2  THR  76          2HG2      THR  76 -16.885 -13.818  -3.643
  448   3HG2  THR  76          3HG2      THR  76 -16.194 -14.594  -2.217
  449    H    ASN  77           H        ASN  77 -13.978 -15.365  -6.721
  450    HA   ASN  77           HA       ASN  77 -14.470 -14.879  -8.887
  451   1HB   ASN  77          1HB       ASN  77 -16.520 -13.809  -7.405
  452   2HB   ASN  77          2HB       ASN  77 -15.989 -12.421  -8.360
  453   1HD2  ASN  77          1HD2      ASN  77 -15.162 -13.776 -10.659
  454   2HD2  ASN  77          2HD2      ASN  77 -16.557 -14.430 -11.441
  455    H    SER  78           H        SER  78 -12.179 -13.598  -7.493
  456    HA   SER  78           HA       SER  78 -11.878 -11.107  -8.998
  457   1HB   SER  78          1HB       SER  78 -11.077 -10.585  -6.927
  458   2HB   SER  78          2HB       SER  78 -10.661 -12.259  -6.552
  459    HG   SER  78           HG       SER  78  -9.078 -10.278  -7.449
  460    H    SER  79           H        SER  79  -9.762 -10.730 -10.099
  461    HA   SER  79           HA       SER  79  -9.022 -13.147 -11.574
  462   1HB   SER  79          1HB       SER  79  -7.983 -10.481 -12.370
  463   2HB   SER  79          2HB       SER  79  -8.545 -11.813 -13.375
  464    HG   SER  79           HG       SER  79 -10.000 -10.054 -13.410
  465    H    GLY  80           H        GLY  80  -6.818 -13.630 -12.051
  466   1HA   GLY  80          1HA       GLY  80  -4.625 -13.974 -11.486
  467   2HA   GLY  80          2HA       GLY  80  -4.616 -12.305 -10.925
  468    H    CYS  81           H        CYS  81  -6.900 -14.436  -9.460
  469    HA   CYS  81           HA       CYS  81  -5.125 -14.729  -7.124
  470   1HB   CYS  81          1HB       CYS  81  -7.070 -14.357  -5.672
  471   2HB   CYS  81          2HB       CYS  81  -6.763 -12.964  -6.703
  472    HA   PRO  82           HA       PRO  82  -5.953 -19.012  -6.640
  473   1HB   PRO  82          1HB       PRO  82  -7.541 -18.428  -4.175
  474   2HB   PRO  82          2HB       PRO  82  -6.234 -19.597  -4.426
  475   1HG   PRO  82          1HG       PRO  82  -5.762 -17.317  -3.155
  476   2HG   PRO  82          2HG       PRO  82  -4.581 -17.968  -4.307
  477   1HD   PRO  82          1HD       PRO  82  -6.487 -15.698  -4.624
  478   2HD   PRO  82          2HD       PRO  82  -4.846 -15.888  -5.268
  479    H    GLY  83           H        GLY  83  -8.932 -17.804  -5.108
  480   1HA   GLY  83          1HA       GLY  83 -11.090 -17.765  -6.059
  481   2HA   GLY  83          2HA       GLY  83 -10.483 -18.702  -7.416
  482    H    HIS  84           H        HIS  84  -9.188 -20.688  -5.689
  483    HA   HIS  84           HA       HIS  84 -11.276 -21.878  -4.106
  484   1HB   HIS  84          1HB       HIS  84 -11.324 -23.984  -5.488
  485   2HB   HIS  84          2HB       HIS  84 -12.106 -22.594  -6.230
  486    HD1  HIS  84           HD1      HIS  84  -8.485 -22.355  -6.485
  487    HD2  HIS  84           HD2      HIS  84 -11.542 -24.146  -8.654
  488    HE1  HIS  84           HE1      HIS  84  -7.497 -22.871  -8.739
  489    HE2  HIS  84           HE2      HIS  84  -9.338 -24.038 -10.001
  Start of MODEL   12
    1   1H    GLN   1          1H        GLN   1 -10.585  14.802   3.604
    2   2H    GLN   1          2H        GLN   1 -10.710  16.514   3.637
    3   3H    GLN   1          3H        GLN   1 -10.323  15.651   5.070
    4    HA   GLN   1           HA       GLN   1  -8.336  16.505   4.389
    5   1HB   GLN   1          1HB       GLN   1  -8.816  13.789   4.456
    6   2HB   GLN   1          2HB       GLN   1  -7.937  13.983   2.946
    7   1HG   GLN   1          1HG       GLN   1  -6.330  13.524   4.603
    8   2HG   GLN   1          2HG       GLN   1  -6.196  15.244   4.244
    9   1HE2  GLN   1          1HE2      GLN   1  -6.901  16.750   5.767
   10   2HE2  GLN   1          2HE2      GLN   1  -7.153  16.326   7.422
   11    H    CYS   2           H        CYS   2  -6.623  15.865   2.392
   12    HA   CYS   2           HA       CYS   2  -7.292  17.670   0.356
   13   1HB   CYS   2          1HB       CYS   2  -5.133  15.618   0.696
   14   2HB   CYS   2          2HB       CYS   2  -5.312  16.452  -0.845
   15    H    THR   3           H        THR   3  -8.831  17.408  -1.116
   16    HA   THR   3           HA       THR   3  -9.533  14.733  -2.038
   17    HB   THR   3           HB       THR   3 -10.829  17.402  -2.628
   18    HG1  THR   3           HG1      THR   3 -10.970  16.734  -0.428
   19   1HG2  THR   3          1HG2      THR   3 -11.938  14.638  -3.042
   20   2HG2  THR   3          2HG2      THR   3 -11.331  15.687  -4.323
   21   3HG2  THR   3          3HG2      THR   3 -12.743  16.169  -3.382
   22    H    GLY   4           H        GLY   4  -9.227  17.860  -3.732
   23   1HA   GLY   4          1HA       GLY   4  -8.061  18.405  -5.650
   24   2HA   GLY   4          2HA       GLY   4  -7.262  16.837  -5.558
   25    H    GLY   5           H        GLY   5  -7.712  15.462  -7.140
   26   1HA   GLY   5          1HA       GLY   5 -10.051  14.547  -8.088
   27   2HA   GLY   5          2HA       GLY   5  -9.888  16.060  -8.965
   28    H    ALA   6           H        ALA   6  -7.876  16.346 -10.229
   29    HA   ALA   6           HA       ALA   6  -7.367  13.971 -11.771
   30   1HB   ALA   6          1HB       ALA   6  -7.333  16.705 -12.283
   31   2HB   ALA   6          2HB       ALA   6  -6.890  15.412 -13.399
   32   3HB   ALA   6          3HB       ALA   6  -5.649  16.202 -12.426
   33    H    ASP   7           H        ASP   7  -5.132  16.307 -10.256
   34    HA   ASP   7           HA       ASP   7  -3.377  14.040  -9.579
   35   1HB   ASP   7          1HB       ASP   7  -2.410  16.788 -10.387
   36   2HB   ASP   7          2HB       ASP   7  -1.432  15.343 -10.119
   37    H    CYS   8           H        CYS   8  -2.015  14.350  -7.721
   38    HA   CYS   8           HA       CYS   8  -2.902  16.481  -5.901
   39   1HB   CYS   8          1HB       CYS   8  -2.882  13.525  -5.442
   40   2HB   CYS   8          2HB       CYS   8  -2.542  14.601  -4.084
   41    H    THR   9           H        THR   9  -0.812  17.305  -6.890
   42    HA   THR   9           HA       THR   9   1.554  16.143  -5.605
   43    HB   THR   9           HB       THR   9   2.867  17.462  -7.165
   44    HG1  THR   9           HG1      THR   9   0.380  18.491  -8.054
   45   1HG2  THR   9          1HG2      THR   9   2.600  16.018  -8.819
   46   2HG2  THR   9          2HG2      THR   9   0.992  16.642  -9.191
   47   3HG2  THR   9          3HG2      THR   9   1.193  15.400  -7.955
   48    H    SER  10           H        SER  10   0.777  17.002  -3.523
   49    HA   SER  10           HA       SER  10   2.157  19.330  -2.786
   50   1HB   SER  10          1HB       SER  10   0.269  20.417  -4.019
   51   2HB   SER  10          2HB       SER  10  -0.845  19.705  -2.851
   52    HG   SER  10           HG       SER  10   0.035  20.948  -1.256
   53    H    CYS  11           H        CYS  11  -0.596  17.235  -2.064
   54    HA   CYS  11           HA       CYS  11  -0.102  17.477   0.798
   55   1HB   CYS  11          1HB       CYS  11  -2.183  15.756  -0.547
   56   2HB   CYS  11          2HB       CYS  11  -2.165  16.324   1.119
   57    H    THR  12           H        THR  12   0.113  15.554   2.136
   58    HA   THR  12           HA       THR  12   1.127  13.175   0.778
   59    HB   THR  12           HB       THR  12   3.020  13.214   2.585
   60    HG1  THR  12           HG1      THR  12   2.465  15.980   2.300
   61   1HG2  THR  12          1HG2      THR  12   4.524  13.908   1.034
   62   2HG2  THR  12          2HG2      THR  12   3.526  15.263   0.505
   63   3HG2  THR  12          3HG2      THR  12   3.133  13.623  -0.013
   64    H    GLY  13           H        GLY  13  -1.286  13.781   2.287
   65   1HA   GLY  13          1HA       GLY  13  -0.879  12.236   4.753
   66   2HA   GLY  13          2HA       GLY  13  -2.283  13.227   4.385
   67    H    ALA  14           H        ALA  14  -3.773  12.441   2.737
   68    HA   ALA  14           HA       ALA  14  -3.631   9.541   2.294
   69   1HB   ALA  14          1HB       ALA  14  -6.270   9.789   2.674
   70   2HB   ALA  14          2HB       ALA  14  -5.700  11.041   3.778
   71   3HB   ALA  14          3HB       ALA  14  -5.145   9.378   3.968
   72    H    CYS  15           H        CYS  15  -4.401   8.836   0.361
   73    HA   CYS  15           HA       CYS  15  -5.031  10.883  -1.613
   74   1HB   CYS  15          1HB       CYS  15  -3.638   8.414  -1.651
   75   2HB   CYS  15          2HB       CYS  15  -5.034   8.227  -2.707
   76    H    THR  16           H        THR  16  -7.136  11.470  -1.429
   77    HA   THR  16           HA       THR  16  -9.144   9.326  -1.678
   78    HB   THR  16           HB       THR  16 -10.704  10.785  -0.423
   79    HG1  THR  16           HG1      THR  16 -10.170  12.753  -0.001
   80   1HG2  THR  16          1HG2      THR  16  -8.714  10.822   1.610
   81   2HG2  THR  16          2HG2      THR  16  -8.556   9.340   0.668
   82   3HG2  THR  16          3HG2      THR  16 -10.098   9.745   1.424
   83    H    GLY  17           H        GLY  17 -10.364   9.424  -3.446
   84   1HA   GLY  17          1HA       GLY  17 -11.147  10.172  -5.483
   85   2HA   GLY  17          2HA       GLY  17 -11.629  11.591  -4.553
   86    H    CYS  18           H        CYS  18  -8.552  10.239  -5.754
   87    HA   CYS  18           HA       CYS  18  -8.086  12.685  -7.270
   88   1HB   CYS  18          1HB       CYS  18  -7.133  12.856  -4.858
   89   2HB   CYS  18          2HB       CYS  18  -5.903  11.731  -5.438
   90    H    GLY  19           H        GLY  19  -7.138  12.268  -9.164
   91   1HA   GLY  19          1HA       GLY  19  -6.723   9.696 -10.115
   92   2HA   GLY  19          2HA       GLY  19  -6.041  11.149 -10.842
   93    H    ASN  20           H        ASN  20  -3.952  11.867 -10.123
   94    HA   ASN  20           HA       ASN  20  -2.208   9.639  -9.544
   95   1HB   ASN  20          1HB       ASN  20  -1.439  12.535  -9.921
   96   2HB   ASN  20          2HB       ASN  20  -0.400  11.122 -10.082
   97   1HD2  ASN  20          1HD2      ASN  20  -0.034  10.469 -12.064
   98   2HD2  ASN  20          2HD2      ASN  20  -1.046  10.750 -13.436
   99    H    CYS  21           H        CYS  21  -0.825   9.431  -7.807
  100    HA   CYS  21           HA       CYS  21  -1.534  11.026  -5.435
  101   1HB   CYS  21          1HB       CYS  21  -1.749   8.357  -5.680
  102   2HB   CYS  21          2HB       CYS  21  -0.069   8.452  -5.149
  103    HA   PRO  22           HA       PRO  22   2.664  12.474  -5.512
  104   1HB   PRO  22          1HB       PRO  22   2.767  13.707  -3.136
  105   2HB   PRO  22          2HB       PRO  22   1.774  14.321  -4.459
  106   1HG   PRO  22          1HG       PRO  22   0.964  12.799  -2.030
  107   2HG   PRO  22          2HG       PRO  22   0.121  14.115  -2.863
  108   1HD   PRO  22          1HD       PRO  22  -0.450  11.408  -3.128
  109   2HD   PRO  22          2HD       PRO  22  -0.942  12.674  -4.264
  110    H    ASN  23           H        ASN  23   1.637   9.949  -3.623
  111    HA   ASN  23           HA       ASN  23   3.166   8.172  -3.115
  112   1HB   ASN  23          1HB       ASN  23   5.326   8.480  -2.324
  113   2HB   ASN  23          2HB       ASN  23   5.144   9.846  -3.419
  114   1HD2  ASN  23          1HD2      ASN  23   3.414  11.305  -1.498
  115   2HD2  ASN  23          2HD2      ASN  23   4.483  11.891  -0.277
  116    H    ALA  24           H        ALA  24   0.885   9.489  -1.914
  117    HA   ALA  24           HA       ALA  24   1.068   9.892   0.819
  118   1HB   ALA  24          1HB       ALA  24  -1.336   9.257   0.882
  119   2HB   ALA  24          2HB       ALA  24  -1.196   8.740  -0.800
  120   3HB   ALA  24          3HB       ALA  24  -0.940  10.433  -0.375
  121    H    VAL  25           H        VAL  25   0.123   8.452   2.527
  122    HA   VAL  25           HA       VAL  25   1.493   5.897   2.449
  123    HB   VAL  25           HB       VAL  25  -0.098   7.156   4.690
  124   1HG1  VAL  25          1HG1      VAL  25   1.767   4.792   4.619
  125   2HG1  VAL  25          2HG1      VAL  25   0.051   4.799   5.028
  126   3HG1  VAL  25          3HG1      VAL  25   1.217   5.570   6.103
  127   1HG2  VAL  25          1HG2      VAL  25   2.075   7.781   5.630
  128   2HG2  VAL  25          2HG2      VAL  25   1.808   8.539   4.059
  129   3HG2  VAL  25          3HG2      VAL  25   2.878   7.144   4.194
  130    H    THR  26           H        THR  26  -1.802   7.029   3.181
  131    HA   THR  26           HA       THR  26  -2.799   4.363   2.419
  132    HB   THR  26           HB       THR  26  -4.864   5.537   3.806
  133    HG1  THR  26           HG1      THR  26  -3.395   7.228   4.430
  134   1HG2  THR  26          1HG2      THR  26  -4.545   3.947   5.437
  135   2HG2  THR  26          2HG2      THR  26  -2.787   4.024   5.319
  136   3HG2  THR  26          3HG2      THR  26  -3.723   3.232   4.050
  137    H    CYS  27           H        CYS  27  -4.532   4.208   1.021
  138    HA   CYS  27           HA       CYS  27  -5.351   6.727  -0.272
  139   1HB   CYS  27          1HB       CYS  27  -4.766   4.020  -1.455
  140   2HB   CYS  27          2HB       CYS  27  -5.775   5.195  -2.303
  141    H    THR  28           H        THR  28  -7.456   7.161  -0.366
  142    HA   THR  28           HA       THR  28  -9.336   5.041   0.440
  143    HB   THR  28           HB       THR  28 -10.176   7.889   0.528
  144    HG1  THR  28           HG1      THR  28  -9.133   8.137   2.562
  145   1HG2  THR  28          1HG2      THR  28 -11.522   5.853   1.310
  146   2HG2  THR  28          2HG2      THR  28 -11.453   7.269   2.358
  147   3HG2  THR  28          3HG2      THR  28 -10.447   5.864   2.708
  148    H    ASN  29           H        ASN  29  -9.383   4.317  -1.780
  149    HA   ASN  29           HA       ASN  29 -10.585   4.043  -3.666
  150   1HB   ASN  29          1HB       ASN  29 -12.124   5.994  -2.347
  151   2HB   ASN  29          2HB       ASN  29 -11.833   6.637  -3.964
  152   1HD2  ASN  29          1HD2      ASN  29 -13.181   3.986  -2.132
  153   2HD2  ASN  29          2HD2      ASN  29 -14.199   3.381  -3.391
  154    H    SER  30           H        SER  30 -10.990   5.639  -5.724
  155    HA   SER  30           HA       SER  30 -10.070   6.976  -7.369
  156   1HB   SER  30          1HB       SER  30  -8.825   8.012  -5.129
  157   2HB   SER  30          2HB       SER  30  -7.474   7.520  -6.150
  158    HG   SER  30           HG       SER  30  -8.555   8.697  -7.868
  159    H    GLN  31           H        GLN  31  -7.390   7.093  -8.212
  160    HA   GLN  31           HA       GLN  31  -6.567   4.287  -8.418
  161   1HB   GLN  31          1HB       GLN  31  -6.258   5.653 -10.964
  162   2HB   GLN  31          2HB       GLN  31  -6.986   4.088 -10.611
  163   1HG   GLN  31          1HG       GLN  31  -8.426   6.693 -10.199
  164   2HG   GLN  31          2HG       GLN  31  -8.472   5.795 -11.713
  165   1HE2  GLN  31          1HE2      GLN  31 -10.340   6.453  -9.285
  166   2HE2  GLN  31          2HE2      GLN  31 -11.161   4.952  -9.038
  167    H    HIS  32           H        HIS  32  -4.521   4.475 -10.161
  168    HA   HIS  32           HA       HIS  32  -2.300   4.942 -10.257
  169   1HB   HIS  32          1HB       HIS  32  -3.705   7.469 -10.298
  170   2HB   HIS  32          2HB       HIS  32  -2.109   7.653  -9.567
  171    HD1  HIS  32           HD1      HIS  32  -0.589   5.604 -11.356
  172    HD2  HIS  32           HD2      HIS  32  -3.182   8.530 -12.764
  173    HE1  HIS  32           HE1      HIS  32   0.084   6.005 -13.744
  174    HE2  HIS  32           HE2      HIS  32  -1.559   7.710 -14.603
  175    H    CYS  33           H        CYS  33  -3.556   4.258  -7.609
  176    HA   CYS  33           HA       CYS  33  -1.703   5.558  -5.756
  177   1HB   CYS  33          1HB       CYS  33  -4.278   4.118  -5.499
  178   2HB   CYS  33          2HB       CYS  33  -3.121   3.859  -4.191
  179    H    VAL  34           H        VAL  34  -0.353   4.051  -7.515
  180    HA   VAL  34           HA       VAL  34   0.006   1.341  -6.741
  181    HB   VAL  34           HB       VAL  34   0.573   2.130  -8.987
  182   1HG1  VAL  34          1HG1      VAL  34   2.601   3.770  -7.508
  183   2HG1  VAL  34          2HG1      VAL  34   1.421   4.287  -8.712
  184   3HG1  VAL  34          3HG1      VAL  34   2.823   3.337  -9.203
  185   1HG2  VAL  34          1HG2      VAL  34   1.678   0.124  -7.932
  186   2HG2  VAL  34          2HG2      VAL  34   3.075   1.155  -7.628
  187   3HG2  VAL  34          3HG2      VAL  34   2.547   0.851  -9.283
  188    H    LYS  35           H        LYS  35   0.901   4.161  -5.173
  189    HA   LYS  35           HA       LYS  35   3.097   2.765  -3.800
  190   1HB   LYS  35          1HB       LYS  35   3.773   4.781  -5.154
  191   2HB   LYS  35          2HB       LYS  35   2.797   5.760  -4.071
  192   1HG   LYS  35          1HG       LYS  35   5.041   5.935  -3.343
  193   2HG   LYS  35          2HG       LYS  35   4.201   4.907  -2.180
  194   1HD   LYS  35          1HD       LYS  35   6.195   3.767  -2.551
  195   2HD   LYS  35          2HD       LYS  35   5.060   2.952  -3.630
  196   1HE   LYS  35          1HE       LYS  35   6.506   5.267  -4.757
  197   2HE   LYS  35          2HE       LYS  35   7.479   3.840  -4.403
  198   1HZ   LYS  35          1HZ       LYS  35   6.524   2.677  -6.050
  199   2HZ   LYS  35          2HZ       LYS  35   6.137   4.198  -6.678
  200   3HZ   LYS  35          3HZ       LYS  35   4.987   3.332  -5.792
  201    H    ALA  36           H        ALA  36   0.544   2.303  -2.955
  202    HA   ALA  36           HA       ALA  36   0.475   3.767  -0.402
  203   1HB   ALA  36          1HB       ALA  36  -2.160   3.014  -0.901
  204   2HB   ALA  36          2HB       ALA  36  -1.573   3.669  -2.431
  205   3HB   ALA  36          3HB       ALA  36  -1.487   4.643  -0.963
  206    H    ASN  37           H        ASN  37   0.435   2.505   1.353
  207    HA   ASN  37           HA       ASN  37   0.759  -0.276   1.180
  208   1HB   ASN  37          1HB       ASN  37   0.348  -0.207   3.686
  209   2HB   ASN  37          2HB       ASN  37   1.651   0.816   3.090
  210   1HD2  ASN  37          1HD2      ASN  37  -1.777   0.866   3.938
  211   2HD2  ASN  37          2HD2      ASN  37  -1.791   2.492   4.522
  212    H    THR  38           H        THR  38  -2.077   1.720   1.649
  213    HA   THR  38           HA       THR  38  -3.751  -0.655   1.298
  214    HB   THR  38           HB       THR  38  -4.565   1.438   3.290
  215    HG1  THR  38           HG1      THR  38  -2.918  -0.817   3.761
  216   1HG2  THR  38          1HG2      THR  38  -6.381   0.140   3.218
  217   2HG2  THR  38          2HG2      THR  38  -5.429  -0.948   4.229
  218   3HG2  THR  38          3HG2      THR  38  -5.514  -1.211   2.488
  219    H    CYS  39           H        CYS  39  -5.398  -0.342  -0.094
  220    HA   CYS  39           HA       CYS  39  -6.342   2.363  -0.631
  221   1HB   CYS  39          1HB       CYS  39  -6.120   1.969  -3.108
  222   2HB   CYS  39          2HB       CYS  39  -4.594   2.191  -2.252
  223    H    THR  40           H        THR  40  -8.410   1.969  -0.002
  224    HA   THR  40           HA       THR  40  -9.791  -0.412  -0.946
  225    HB   THR  40           HB       THR  40 -10.066   0.460   1.398
  226    HG1  THR  40           HG1      THR  40 -12.474   0.417  -0.092
  227   1HG2  THR  40          1HG2      THR  40 -10.174   2.825   1.055
  228   2HG2  THR  40          2HG2      THR  40 -11.707   2.275   1.731
  229   3HG2  THR  40          3HG2      THR  40 -11.586   2.652   0.013
  230    H    GLY  41           H        GLY  41 -11.401  -0.435  -2.471
  231   1HA   GLY  41          1HA       GLY  41 -12.561   0.272  -4.334
  232   2HA   GLY  41          2HA       GLY  41 -12.846   1.749  -3.428
  233    H    SER  42           H        SER  42  -9.793   0.399  -4.599
  234    HA   SER  42           HA       SER  42  -9.610   2.630  -6.475
  235   1HB   SER  42          1HB       SER  42  -7.234   1.937  -4.754
  236   2HB   SER  42          2HB       SER  42  -7.535   3.412  -5.669
  237    HG   SER  42           HG       SER  42  -7.932   3.921  -3.572
  238    H    THR  43           H        THR  43  -7.048   2.141  -7.421
  239    HA   THR  43           HA       THR  43  -6.932  -0.730  -7.900
  240    HB   THR  43           HB       THR  43  -7.450  -0.704 -10.082
  241    HG1  THR  43           HG1      THR  43  -6.773   0.940 -11.518
  242   1HG2  THR  43          1HG2      THR  43  -8.822   1.302 -10.848
  243   2HG2  THR  43          2HG2      THR  43  -8.595   1.920  -9.212
  244   3HG2  THR  43          3HG2      THR  43  -9.408   0.375  -9.466
  245    H    ASP  44           H        ASP  44  -4.997   0.049 -10.222
  246    HA   ASP  44           HA       ASP  44  -2.655  -0.375 -10.046
  247   1HB   ASP  44          1HB       ASP  44  -3.583   2.111 -10.733
  248   2HB   ASP  44          2HB       ASP  44  -2.396   2.499  -9.493
  249    H    CYS  45           H        CYS  45  -2.642  -1.527  -7.938
  250    HA   CYS  45           HA       CYS  45  -1.178   0.041  -5.934
  251   1HB   CYS  45          1HB       CYS  45  -3.642  -1.607  -5.581
  252   2HB   CYS  45          2HB       CYS  45  -2.451  -1.574  -4.274
  253    H    ASN  46           H        ASN  46   0.794  -0.854  -6.441
  254    HA   ASN  46           HA       ASN  46   1.020  -3.771  -6.391
  255   1HB   ASN  46          1HB       ASN  46   2.042  -2.680  -8.307
  256   2HB   ASN  46          2HB       ASN  46   3.001  -1.648  -7.239
  257   1HD2  ASN  46          1HD2      ASN  46   4.968  -2.306  -6.738
  258   2HD2  ASN  46          2HD2      ASN  46   5.584  -3.907  -6.949
  259    H    THR  47           H        THR  47   1.932  -0.910  -4.587
  260    HA   THR  47           HA       THR  47   3.740  -2.405  -2.876
  261    HB   THR  47           HB       THR  47   4.143  -0.012  -3.529
  262    HG1  THR  47           HG1      THR  47   3.990  -0.756  -0.810
  263   1HG2  THR  47          1HG2      THR  47   1.991   0.983  -3.360
  264   2HG2  THR  47          2HG2      THR  47   3.019   1.708  -2.123
  265   3HG2  THR  47          3HG2      THR  47   1.830   0.485  -1.676
  266    H    ALA  48           H        ALA  48   0.431  -1.334  -2.879
  267    HA   ALA  48           HA       ALA  48  -0.183  -1.327  -0.181
  268   1HB   ALA  48          1HB       ALA  48  -2.332  -1.167  -0.838
  269   2HB   ALA  48          2HB       ALA  48  -2.212  -2.542  -1.937
  270   3HB   ALA  48          3HB       ALA  48  -1.607  -0.960  -2.433
  271    H    GLN  49           H        GLN  49  -0.850  -2.843   1.310
  272    HA   GLN  49           HA       GLN  49  -0.006  -5.583   0.750
  273   1HB   GLN  49          1HB       GLN  49   0.361  -3.959   2.933
  274   2HB   GLN  49          2HB       GLN  49  -0.972  -4.979   3.453
  275   1HG   GLN  49          1HG       GLN  49   0.717  -6.298   4.139
  276   2HG   GLN  49          2HG       GLN  49   0.631  -6.868   2.473
  277   1HE2  GLN  49          1HE2      GLN  49   1.826  -4.791   1.140
  278   2HE2  GLN  49          2HE2      GLN  49   3.487  -4.686   1.600
  279    H    THR  50           H        THR  50  -2.793  -3.893   0.459
  280    HA   THR  50           HA       THR  50  -4.442  -6.094   0.058
  281    HB   THR  50           HB       THR  50  -4.150  -6.024   2.658
  282    HG1  THR  50           HG1      THR  50  -6.670  -6.208   1.375
  283   1HG2  THR  50          1HG2      THR  50  -5.526  -4.635   3.889
  284   2HG2  THR  50          2HG2      THR  50  -6.465  -4.156   2.473
  285   3HG2  THR  50          3HG2      THR  50  -4.818  -3.558   2.683
  286    H    CYS  51           H        CYS  51  -6.672  -5.427  -0.478
  287    HA   CYS  51           HA       CYS  51  -7.550  -2.776  -0.355
  288   1HB   CYS  51          1HB       CYS  51  -7.272  -2.499  -3.018
  289   2HB   CYS  51          2HB       CYS  51  -6.118  -1.862  -1.845
  290    H    THR  52           H        THR  52  -9.637  -2.625  -0.865
  291    HA   THR  52           HA       THR  52 -11.060  -4.978  -1.641
  292    HB   THR  52           HB       THR  52 -12.674  -2.582  -1.723
  293    HG1  THR  52           HG1      THR  52 -11.497  -1.442  -0.397
  294   1HG2  THR  52          1HG2      THR  52 -13.778  -3.564   0.201
  295   2HG2  THR  52          2HG2      THR  52 -12.482  -4.753   0.344
  296   3HG2  THR  52          3HG2      THR  52 -13.534  -4.760  -1.072
  297    H    ASN  53           H        ASN  53 -13.125  -3.420  -3.193
  298    HA   ASN  53           HA       ASN  53 -12.788  -4.138  -5.715
  299   1HB   ASN  53          1HB       ASN  53 -13.907  -1.574  -4.631
  300   2HB   ASN  53          2HB       ASN  53 -13.859  -1.848  -6.376
  301   1HD2  ASN  53          1HD2      ASN  53 -15.623  -2.688  -7.189
  302   2HD2  ASN  53          2HD2      ASN  53 -16.748  -3.707  -6.364
  303    H    SER  54           H        SER  54 -10.761  -4.262  -6.534
  304    HA   SER  54           HA       SER  54  -9.571  -1.769  -7.500
  305   1HB   SER  54          1HB       SER  54  -8.130  -1.927  -5.713
  306   2HB   SER  54          2HB       SER  54  -8.370  -3.667  -5.543
  307    HG   SER  54           HG       SER  54  -6.885  -4.038  -7.079
  308    H    LYS  55           H        LYS  55  -7.407  -2.649  -8.812
  309    HA   LYS  55           HA       LYS  55  -8.043  -5.110 -10.230
  310   1HB   LYS  55          1HB       LYS  55  -8.289  -2.391 -11.402
  311   2HB   LYS  55          2HB       LYS  55  -7.553  -3.630 -12.408
  312   1HG   LYS  55          1HG       LYS  55  -9.686  -4.996 -11.622
  313   2HG   LYS  55          2HG       LYS  55 -10.343  -3.368 -11.447
  314   1HD   LYS  55          1HD       LYS  55 -10.830  -4.263 -13.661
  315   2HD   LYS  55          2HD       LYS  55  -9.741  -2.879 -13.772
  316   1HE   LYS  55          1HE       LYS  55  -8.190  -4.108 -14.786
  317   2HE   LYS  55          2HE       LYS  55  -8.237  -5.316 -13.504
  318   1HZ   LYS  55          1HZ       LYS  55 -10.479  -5.891 -14.820
  319   2HZ   LYS  55          2HZ       LYS  55  -8.987  -6.613 -15.160
  320   3HZ   LYS  55          3HZ       LYS  55  -9.532  -5.316 -16.100
  321    H    ASP  56           H        ASP  56  -5.838  -3.778  -8.539
  322    HA   ASP  56           HA       ASP  56  -3.664  -4.840 -10.125
  323   1HB   ASP  56          1HB       ASP  56  -3.896  -1.956  -9.390
  324   2HB   ASP  56          2HB       ASP  56  -2.299  -2.709  -9.452
  325    H    CYS  57           H        CYS  57  -5.137  -5.282  -7.487
  326    HA   CYS  57           HA       CYS  57  -3.268  -4.790  -5.401
  327   1HB   CYS  57          1HB       CYS  57  -5.590  -6.722  -5.593
  328   2HB   CYS  57          2HB       CYS  57  -4.667  -6.435  -4.119
  329    H    PHE  58           H        PHE  58  -1.464  -5.673  -6.929
  330    HA   PHE  58           HA       PHE  58  -1.183  -8.476  -7.221
  331   1HB   PHE  58          1HB       PHE  58   1.055  -6.457  -7.199
  332   2HB   PHE  58          2HB       PHE  58   1.033  -8.026  -7.989
  333    HD1  PHE  58           HD1      PHE  58  -1.233  -8.213  -9.511
  334    HD2  PHE  58           HD2      PHE  58   1.050  -4.744  -8.623
  335    HE1  PHE  58           HE1      PHE  58  -1.998  -7.188 -11.598
  336    HE2  PHE  58           HE2      PHE  58   0.284  -3.698 -10.705
  337    HZ   PHE  58           HZ       PHE  58  -1.222  -4.932 -12.169
  338    H    GLU  59           H        GLU  59   0.556  -6.228  -5.056
  339    HA   GLU  59           HA       GLU  59   1.413  -8.500  -3.441
  340   1HB   GLU  59          1HB       GLU  59   2.988  -6.647  -4.157
  341   2HB   GLU  59          2HB       GLU  59   2.122  -5.595  -3.036
  342   1HG   GLU  59          1HG       GLU  59   4.219  -6.546  -2.124
  343   2HG   GLU  59          2HG       GLU  59   2.787  -6.924  -1.169
  344    H    ALA  60           H        ALA  60  -1.337  -7.938  -3.362
  345    HA   ALA  60           HA       ALA  60  -1.683  -6.779  -0.685
  346   1HB   ALA  60          1HB       ALA  60  -4.194  -7.183  -1.932
  347   2HB   ALA  60          2HB       ALA  60  -3.119  -6.424  -3.106
  348   3HB   ALA  60          3HB       ALA  60  -3.392  -5.661  -1.542
  349    H    ASN  61           H        ASN  61  -2.106  -8.108   0.939
  350    HA   ASN  61           HA       ASN  61  -2.260 -10.886   0.663
  351   1HB   ASN  61          1HB       ASN  61  -2.950 -10.871   3.066
  352   2HB   ASN  61          2HB       ASN  61  -1.505  -9.922   2.735
  353   1HD2  ASN  61          1HD2      ASN  61  -1.499  -8.266   4.067
  354   2HD2  ASN  61          2HD2      ASN  61  -2.834  -7.218   4.390
  355    H    THR  62           H        THR  62  -4.781  -8.441   0.752
  356    HA   THR  62           HA       THR  62  -6.730 -10.579   0.219
  357    HB   THR  62           HB       THR  62  -7.514  -8.176   1.832
  358    HG1  THR  62           HG1      THR  62  -6.184  -8.892   3.297
  359   1HG2  THR  62          1HG2      THR  62  -8.706 -10.651   2.616
  360   2HG2  THR  62          2HG2      THR  62  -8.894 -10.417   0.877
  361   3HG2  THR  62          3HG2      THR  62  -9.469  -9.184   2.001
  362    H    CYS  63           H        CYS  63  -7.090 -10.233  -1.898
  363    HA   CYS  63           HA       CYS  63  -8.097  -7.574  -2.646
  364   1HB   CYS  63          1HB       CYS  63  -7.099  -7.806  -4.866
  365   2HB   CYS  63          2HB       CYS  63  -5.858  -7.890  -3.617
  366    H    THR  64           H        THR  64 -10.151  -8.557  -2.063
  367    HA   THR  64           HA       THR  64 -11.141 -10.607  -3.892
  368    HB   THR  64           HB       THR  64 -13.261 -10.103  -2.316
  369    HG1  THR  64           HG1      THR  64 -12.001  -8.442  -1.221
  370   1HG2  THR  64          1HG2      THR  64 -12.853 -12.074  -1.325
  371   2HG2  THR  64          2HG2      THR  64 -11.199 -11.640  -0.892
  372   3HG2  THR  64          3HG2      THR  64 -11.573 -12.174  -2.532
  373    H    ASP  65           H        ASP  65 -13.360 -10.293  -4.806
  374    HA   ASP  65           HA       ASP  65 -14.693  -9.182  -6.286
  375   1HB   ASP  65          1HB       ASP  65 -14.300  -6.791  -4.477
  376   2HB   ASP  65          2HB       ASP  65 -15.679  -7.133  -5.524
  377    H    SER  66           H        SER  66 -11.736  -9.062  -6.575
  378    HA   SER  66           HA       SER  66 -11.645  -6.819  -8.466
  379   1HB   SER  66          1HB       SER  66  -9.457  -7.568  -6.507
  380   2HB   SER  66          2HB       SER  66  -9.299  -6.369  -7.796
  381    HG   SER  66           HG       SER  66 -11.075  -6.275  -5.583
  382    H    THR  67           H        THR  67  -9.390  -7.106  -9.722
  383    HA   THR  67           HA       THR  67  -9.008  -9.926 -10.380
  384    HB   THR  67           HB       THR  67 -10.494  -9.357 -12.060
  385    HG1  THR  67           HG1      THR  67  -9.290  -9.621 -13.793
  386   1HG2  THR  67          1HG2      THR  67 -10.655  -6.977 -11.585
  387   2HG2  THR  67          2HG2      THR  67 -10.542  -7.314 -13.313
  388   3HG2  THR  67          3HG2      THR  67  -9.134  -6.718 -12.435
  389    H    ASN  68           H        ASN  68  -7.013 -10.432 -11.366
  390    HA   ASN  68           HA       ASN  68  -4.791 -10.149 -11.885
  391   1HB   ASN  68          1HB       ASN  68  -5.797  -7.615 -12.446
  392   2HB   ASN  68          2HB       ASN  68  -4.479  -7.304 -11.313
  393   1HD2  ASN  68          1HD2      ASN  68  -4.153  -6.307 -13.724
  394   2HD2  ASN  68          2HD2      ASN  68  -3.015  -7.217 -14.651
  395    H    CYS  69           H        CYS  69  -4.172 -11.283 -10.134
  396    HA   CYS  69           HA       CYS  69  -2.861  -9.840  -7.999
  397   1HB   CYS  69          1HB       CYS  69  -5.280 -11.581  -7.560
  398   2HB   CYS  69          2HB       CYS  69  -4.050 -11.420  -6.309
  399    H    TYR  70           H        TYR  70  -1.115 -11.002  -7.219
  400    HA   TYR  70           HA       TYR  70  -1.009 -13.863  -7.733
  401   1HB   TYR  70          1HB       TYR  70   1.489 -13.340  -8.541
  402   2HB   TYR  70          2HB       TYR  70   0.131 -13.487  -9.654
  403    HD1  TYR  70           HD1      TYR  70  -0.871 -11.443 -10.659
  404    HD2  TYR  70           HD2      TYR  70   2.609 -11.254  -8.209
  405    HE1  TYR  70           HE1      TYR  70  -0.362  -9.216 -11.554
  406    HE2  TYR  70           HE2      TYR  70   3.118  -9.022  -9.096
  407    HH   TYR  70           HH       TYR  70   2.024  -7.176 -10.174
  408    H    LYS  71           H        LYS  71  -1.100 -12.025  -5.392
  409    HA   LYS  71           HA       LYS  71   0.876 -13.409  -3.822
  410   1HB   LYS  71          1HB       LYS  71   0.998 -10.413  -3.640
  411   2HB   LYS  71          2HB       LYS  71   2.162 -11.606  -3.069
  412   1HG   LYS  71          1HG       LYS  71   2.819 -12.086  -5.358
  413   2HG   LYS  71          2HG       LYS  71   1.623 -10.937  -5.957
  414   1HD   LYS  71          1HD       LYS  71   2.789  -9.138  -4.725
  415   2HD   LYS  71          2HD       LYS  71   4.018 -10.307  -4.234
  416   1HE   LYS  71          1HE       LYS  71   4.155 -10.747  -6.826
  417   2HE   LYS  71          2HE       LYS  71   3.480  -9.120  -6.915
  418   1HZ   LYS  71          1HZ       LYS  71   6.068  -9.571  -6.805
  419   2HZ   LYS  71          2HZ       LYS  71   5.763  -9.519  -5.142
  420   3HZ   LYS  71          3HZ       LYS  71   5.367  -8.193  -6.114
  421    H    ALA  72           H        ALA  72  -2.001 -13.226  -3.953
  422    HA   ALA  72           HA       ALA  72  -2.684 -11.812  -1.477
  423   1HB   ALA  72          1HB       ALA  72  -4.950 -13.036  -2.739
  424   2HB   ALA  72          2HB       ALA  72  -4.021 -12.121  -3.926
  425   3HB   ALA  72          3HB       ALA  72  -4.610 -11.327  -2.466
  426    H    THR  73           H        THR  73  -3.833 -12.849   0.201
  427    HA   THR  73           HA       THR  73  -3.576 -15.784   0.213
  428    HB   THR  73           HB       THR  73  -1.953 -14.716   1.717
  429    HG1  THR  73           HG1      THR  73  -2.532 -16.615   2.541
  430   1HG2  THR  73          1HG2      THR  73  -2.437 -12.945   2.937
  431   2HG2  THR  73          2HG2      THR  73  -3.613 -13.894   3.845
  432   3HG2  THR  73          3HG2      THR  73  -4.117 -13.018   2.401
  433    H    ALA  74           H        ALA  74  -5.853 -13.796  -0.377
  434    HA   ALA  74           HA       ALA  74  -7.855 -15.252   1.169
  435   1HB   ALA  74          1HB       ALA  74  -8.100 -12.270   0.956
  436   2HB   ALA  74          2HB       ALA  74  -7.242 -13.025   2.299
  437   3HB   ALA  74          3HB       ALA  74  -8.949 -13.380   2.030
  438    H    CYS  75           H        CYS  75  -8.273 -16.269  -0.853
  439    HA   CYS  75           HA       CYS  75  -9.318 -14.573  -2.992
  440   1HB   CYS  75          1HB       CYS  75  -7.759 -16.250  -3.725
  441   2HB   CYS  75          2HB       CYS  75  -8.643 -17.515  -2.877
  442    H    THR  76           H        THR  76 -11.383 -14.745  -3.810
  443    HA   THR  76           HA       THR  76 -13.289 -16.582  -2.647
  444    HB   THR  76           HB       THR  76 -13.896 -13.645  -2.394
  445    HG1  THR  76           HG1      THR  76 -12.847 -15.300  -0.348
  446   1HG2  THR  76          1HG2      THR  76 -15.355 -16.030  -1.880
  447   2HG2  THR  76          2HG2      THR  76 -15.858 -14.351  -1.680
  448   3HG2  THR  76          3HG2      THR  76 -15.060 -15.197  -0.353
  449    H    ASN  77           H        ASN  77 -12.824 -13.677  -4.621
  450    HA   ASN  77           HA       ASN  77 -14.065 -14.893  -6.891
  451   1HB   ASN  77          1HB       ASN  77 -15.828 -13.054  -7.089
  452   2HB   ASN  77          2HB       ASN  77 -16.137 -14.315  -5.891
  453   1HD2  ASN  77          1HD2      ASN  77 -17.231 -13.337  -4.333
  454   2HD2  ASN  77          2HD2      ASN  77 -16.742 -11.897  -3.513
  455    H    SER  78           H        SER  78 -11.782 -14.289  -7.369
  456    HA   SER  78           HA       SER  78 -11.735 -11.676  -8.656
  457   1HB   SER  78          1HB       SER  78  -9.886 -12.553  -6.469
  458   2HB   SER  78          2HB       SER  78  -9.273 -11.499  -7.749
  459    HG   SER  78           HG       SER  78 -11.429 -10.999  -5.975
  460    H    SER  79           H        SER  79  -9.758 -11.449 -10.081
  461    HA   SER  79           HA       SER  79  -9.527 -13.829 -11.670
  462   1HB   SER  79          1HB       SER  79  -9.313 -11.078 -12.119
  463   2HB   SER  79          2HB       SER  79  -7.735 -11.755 -12.506
  464    HG   SER  79           HG       SER  79 -10.230 -12.648 -13.527
  465    H    GLY  80           H        GLY  80  -7.374 -11.986  -9.575
  466   1HA   GLY  80          1HA       GLY  80  -5.190 -13.834 -10.214
  467   2HA   GLY  80          2HA       GLY  80  -5.042 -12.318  -9.351
  468    H    CYS  81           H        CYS  81  -7.643 -13.747  -7.972
  469    HA   CYS  81           HA       CYS  81  -6.047 -14.512  -5.699
  470   1HB   CYS  81          1HB       CYS  81  -8.005 -14.519  -4.438
  471   2HB   CYS  81          2HB       CYS  81  -8.305 -13.281  -5.649
  472    HA   PRO  82           HA       PRO  82  -6.113 -18.794  -6.996
  473   1HB   PRO  82          1HB       PRO  82  -3.932 -19.562  -5.632
  474   2HB   PRO  82          2HB       PRO  82  -3.820 -18.567  -7.093
  475   1HG   PRO  82          1HG       PRO  82  -3.438 -17.809  -4.258
  476   2HG   PRO  82          2HG       PRO  82  -2.744 -17.093  -5.721
  477   1HD   PRO  82          1HD       PRO  82  -4.974 -16.153  -4.215
  478   2HD   PRO  82          2HD       PRO  82  -4.352 -15.506  -5.744
  479    H    GLY  83           H        GLY  83  -5.282 -18.098  -3.580
  480   1HA   GLY  83          1HA       GLY  83  -7.046 -18.755  -1.932
  481   2HA   GLY  83          2HA       GLY  83  -7.120 -20.277  -2.809
  482    H    HIS  84           H        HIS  84  -4.259 -18.402  -1.886
  483    HA   HIS  84           HA       HIS  84  -3.021 -20.759  -0.794
  484   1HB   HIS  84          1HB       HIS  84  -2.128 -17.880  -0.987
  485   2HB   HIS  84          2HB       HIS  84  -1.144 -19.147  -0.262
  486    HD1  HIS  84           HD1      HIS  84  -1.352 -17.403  -3.272
  487    HD2  HIS  84           HD2      HIS  84  -1.030 -21.444  -2.357
  488    HE1  HIS  84           HE1      HIS  84  -0.445 -18.492  -5.349
  489    HE2  HIS  84           HE2      HIS  84  -0.184 -20.925  -4.746
  Start of MODEL   13
    1   1H    GLN   1          1H        GLN   1 -11.371  19.727  -0.788
    2   2H    GLN   1          2H        GLN   1  -9.801  20.182  -0.268
    3   3H    GLN   1          3H        GLN   1 -11.006  19.779   0.886
    4    HA   GLN   1           HA       GLN   1  -9.384  18.036   0.570
    5   1HB   GLN   1          1HB       GLN   1 -12.128  17.917   0.787
    6   2HB   GLN   1          2HB       GLN   1 -11.807  16.818  -0.548
    7   1HG   GLN   1          1HG       GLN   1 -10.092  15.719   0.956
    8   2HG   GLN   1          2HG       GLN   1 -10.790  16.664   2.270
    9   1HE2  GLN   1          1HE2      GLN   1 -10.962  14.204   2.835
   10   2HE2  GLN   1          2HE2      GLN   1 -12.502  13.500   2.494
   11    H    CYS   2           H        CYS   2  -9.783  15.844  -1.025
   12    HA   CYS   2           HA       CYS   2  -9.351  16.749  -3.778
   13   1HB   CYS   2          1HB       CYS   2  -7.525  14.706  -2.531
   14   2HB   CYS   2          2HB       CYS   2  -7.314  15.584  -4.041
   15    H    THR   3           H        THR   3 -11.503  15.863  -4.029
   16    HA   THR   3           HA       THR   3 -11.401  13.010  -4.619
   17    HB   THR   3           HB       THR   3 -13.758  14.106  -3.101
   18    HG1  THR   3           HG1      THR   3 -11.895  14.312  -1.789
   19   1HG2  THR   3          1HG2      THR   3 -12.816  11.405  -3.896
   20   2HG2  THR   3          2HG2      THR   3 -14.442  12.089  -3.909
   21   3HG2  THR   3          3HG2      THR   3 -13.707  11.589  -2.386
   22    H    GLY   4           H        GLY   4 -12.179  12.675  -6.593
   23   1HA   GLY   4          1HA       GLY   4 -14.308  12.955  -7.931
   24   2HA   GLY   4          2HA       GLY   4 -14.040  14.682  -7.705
   25    H    GLY   5           H        GLY   5 -13.605  12.118  -9.776
   26   1HA   GLY   5          1HA       GLY   5 -12.758  12.276 -11.955
   27   2HA   GLY   5          2HA       GLY   5 -11.897  13.734 -11.491
   28    H    ALA   6           H        ALA   6 -10.072  12.850 -12.623
   29    HA   ALA   6           HA       ALA   6  -8.609  10.873 -11.002
   30   1HB   ALA   6          1HB       ALA   6  -7.913   9.688 -12.832
   31   2HB   ALA   6          2HB       ALA   6  -8.071  11.065 -13.921
   32   3HB   ALA   6          3HB       ALA   6  -9.508  10.198 -13.381
   33    H    ASP   7           H        ASP   7  -8.231  13.379 -10.272
   34    HA   ASP   7           HA       ASP   7  -5.492  13.880 -11.012
   35   1HB   ASP   7          1HB       ASP   7  -7.218  15.127 -12.629
   36   2HB   ASP   7          2HB       ASP   7  -7.207  16.295 -11.305
   37    H    CYS   8           H        CYS   8  -4.373  14.725  -9.353
   38    HA   CYS   8           HA       CYS   8  -5.914  15.702  -7.040
   39   1HB   CYS   8          1HB       CYS   8  -3.881  13.698  -7.254
   40   2HB   CYS   8          2HB       CYS   8  -3.265  15.016  -6.252
   41    H    THR   9           H        THR   9  -5.596  17.732  -6.376
   42    HA   THR   9           HA       THR   9  -3.368  19.231  -7.583
   43    HB   THR   9           HB       THR   9  -5.458  20.123  -8.311
   44    HG1  THR   9           HG1      THR   9  -5.353  22.212  -7.410
   45   1HG2  THR   9          1HG2      THR   9  -7.304  19.869  -7.129
   46   2HG2  THR   9          2HG2      THR   9  -6.725  21.127  -6.037
   47   3HG2  THR   9          3HG2      THR   9  -6.382  19.431  -5.690
   48    H    SER  10           H        SER  10  -1.739  19.492  -6.216
   49    HA   SER  10           HA       SER  10  -0.534  19.958  -4.346
   50   1HB   SER  10          1HB       SER  10  -1.658  22.117  -4.487
   51   2HB   SER  10          2HB       SER  10  -3.044  21.478  -3.604
   52    HG   SER  10           HG       SER  10  -0.932  22.616  -2.585
   53    H    CYS  11           H        CYS  11  -2.072  17.511  -4.381
   54    HA   CYS  11           HA       CYS  11  -2.570  17.176  -1.494
   55   1HB   CYS  11          1HB       CYS  11  -3.643  15.318  -3.596
   56   2HB   CYS  11          2HB       CYS  11  -4.204  15.548  -1.945
   57    H    THR  12           H        THR  12  -0.865  16.257  -0.565
   58    HA   THR  12           HA       THR  12   0.460  14.033  -1.974
   59    HB   THR  12           HB       THR  12   1.937  15.983  -1.779
   60    HG1  THR  12           HG1      THR  12   2.662  13.899   0.002
   61   1HG2  THR  12          1HG2      THR  12   2.255  15.756   1.126
   62   2HG2  THR  12          2HG2      THR  12   0.769  16.537   0.585
   63   3HG2  THR  12          3HG2      THR  12   2.335  17.169   0.075
   64    H    GLY  13           H        GLY  13  -0.919  15.232   0.991
   65   1HA   GLY  13          1HA       GLY  13  -0.017  13.338   2.809
   66   2HA   GLY  13          2HA       GLY  13  -1.565  14.160   2.910
   67    H    ALA  14           H        ALA  14  -3.418  13.169   2.047
   68    HA   ALA  14           HA       ALA  14  -3.113  10.380   1.185
   69   1HB   ALA  14          1HB       ALA  14  -5.403  10.924   2.961
   70   2HB   ALA  14          2HB       ALA  14  -3.813  10.918   3.726
   71   3HB   ALA  14          3HB       ALA  14  -4.371   9.499   2.841
   72    H    CYS  15           H        CYS  15  -4.176  10.036  -0.664
   73    HA   CYS  15           HA       CYS  15  -6.098  12.003  -1.592
   74   1HB   CYS  15          1HB       CYS  15  -5.396   9.487  -3.078
   75   2HB   CYS  15          2HB       CYS  15  -5.893  11.044  -3.719
   76    H    THR  16           H        THR  16  -8.213  11.833  -1.299
   77    HA   THR  16           HA       THR  16  -9.327   9.234  -0.524
   78    HB   THR  16           HB       THR  16  -9.886  10.882   1.073
   79    HG1  THR  16           HG1      THR  16 -11.825  10.120   0.977
   80   1HG2  THR  16          1HG2      THR  16 -11.323  12.908   0.028
   81   2HG2  THR  16          2HG2      THR  16 -10.115  12.674  -1.236
   82   3HG2  THR  16          3HG2      THR  16  -9.606  13.003   0.420
   83    H    GLY  17           H        GLY  17  -8.807   9.082  -3.078
   84   1HA   GLY  17          1HA       GLY  17  -9.938   8.362  -4.980
   85   2HA   GLY  17          2HA       GLY  17 -11.430   9.013  -4.304
   86    H    CYS  18           H        CYS  18  -8.286  10.188  -5.522
   87    HA   CYS  18           HA       CYS  18  -9.752  12.373  -6.848
   88   1HB   CYS  18          1HB       CYS  18  -7.861  13.795  -6.574
   89   2HB   CYS  18          2HB       CYS  18  -8.156  13.040  -5.007
   90    H    GLY  19           H        GLY  19  -7.046  10.107  -7.145
   91   1HA   GLY  19          1HA       GLY  19  -7.229   9.057  -9.511
   92   2HA   GLY  19          2HA       GLY  19  -6.893  10.711 -10.017
   93    H    ASN  20           H        ASN  20  -4.967  11.510  -8.250
   94    HA   ASN  20           HA       ASN  20  -2.808   9.542  -8.640
   95   1HB   ASN  20          1HB       ASN  20  -2.571  12.539  -8.972
   96   2HB   ASN  20          2HB       ASN  20  -1.277  11.364  -9.182
   97   1HD2  ASN  20          1HD2      ASN  20  -3.703  13.096 -10.693
   98   2HD2  ASN  20          2HD2      ASN  20  -3.721  12.259 -12.204
   99    H    CYS  21           H        CYS  21  -1.203   9.446  -7.084
  100    HA   CYS  21           HA       CYS  21  -1.591  11.067  -4.664
  101   1HB   CYS  21          1HB       CYS  21  -2.078   8.276  -4.929
  102   2HB   CYS  21          2HB       CYS  21  -0.622   8.465  -3.953
  103    HA   PRO  22           HA       PRO  22   2.817  11.263  -5.601
  104   1HB   PRO  22          1HB       PRO  22   3.170  13.836  -4.878
  105   2HB   PRO  22          2HB       PRO  22   2.479  13.360  -6.429
  106   1HG   PRO  22          1HG       PRO  22   1.171  14.558  -4.082
  107   2HG   PRO  22          2HG       PRO  22   0.645  14.537  -5.771
  108   1HD   PRO  22          1HD       PRO  22  -0.237  12.860  -3.610
  109   2HD   PRO  22          2HD       PRO  22  -0.785  12.853  -5.297
  110    H    ASN  23           H        ASN  23   3.720   9.990  -4.058
  111    HA   ASN  23           HA       ASN  23   4.912   9.465  -2.201
  112   1HB   ASN  23          1HB       ASN  23   4.908  12.209  -1.083
  113   2HB   ASN  23          2HB       ASN  23   6.244  11.083  -1.307
  114   1HD2  ASN  23          1HD2      ASN  23   5.473  10.751  -4.200
  115   2HD2  ASN  23          2HD2      ASN  23   6.077  12.173  -4.968
  116    H    ALA  24           H        ALA  24   1.971   9.637  -2.186
  117    HA   ALA  24           HA       ALA  24   1.264  10.401   0.511
  118   1HB   ALA  24          1HB       ALA  24  -0.847  10.388  -0.225
  119   2HB   ALA  24          2HB       ALA  24  -0.687   8.780  -0.928
  120   3HB   ALA  24          3HB       ALA  24  -0.147  10.195  -1.832
  121    H    VAL  25           H        VAL  25   0.576   9.003   2.160
  122    HA   VAL  25           HA       VAL  25   1.922   6.442   2.156
  123    HB   VAL  25           HB       VAL  25   2.035   7.884   4.142
  124   1HG1  VAL  25          1HG1      VAL  25  -0.924   7.350   4.387
  125   2HG1  VAL  25          2HG1      VAL  25  -0.179   8.899   3.994
  126   3HG1  VAL  25          3HG1      VAL  25   0.079   8.173   5.581
  127   1HG2  VAL  25          1HG2      VAL  25   2.472   5.835   4.955
  128   2HG2  VAL  25          2HG2      VAL  25   1.063   5.114   4.177
  129   3HG2  VAL  25          3HG2      VAL  25   0.881   5.983   5.701
  130    H    THR  26           H        THR  26  -1.392   7.650   2.211
  131    HA   THR  26           HA       THR  26  -2.344   5.075   1.299
  132    HB   THR  26           HB       THR  26  -3.873   6.104   3.623
  133    HG1  THR  26           HG1      THR  26  -1.468   4.645   3.962
  134   1HG2  THR  26          1HG2      THR  26  -4.173   3.909   2.163
  135   2HG2  THR  26          2HG2      THR  26  -4.583   3.976   3.877
  136   3HG2  THR  26          3HG2      THR  26  -3.045   3.281   3.364
  137    H    CYS  27           H        CYS  27  -4.424   5.155   0.375
  138    HA   CYS  27           HA       CYS  27  -5.667   7.805   0.187
  139   1HB   CYS  27          1HB       CYS  27  -6.045   6.748  -2.351
  140   2HB   CYS  27          2HB       CYS  27  -4.928   8.043  -1.930
  141    H    THR  28           H        THR  28  -7.875   7.809  -0.190
  142    HA   THR  28           HA       THR  28  -9.205   5.247   0.317
  143    HB   THR  28           HB       THR  28 -10.591   7.916   0.280
  144    HG1  THR  28           HG1      THR  28  -9.188   6.838   2.495
  145   1HG2  THR  28          1HG2      THR  28 -12.166   6.976   1.669
  146   2HG2  THR  28          2HG2      THR  28 -11.076   5.705   2.222
  147   3HG2  THR  28          3HG2      THR  28 -11.761   5.635   0.599
  148    H    ASN  29           H        ASN  29  -9.193   4.331  -1.704
  149    HA   ASN  29           HA       ASN  29 -10.146   3.776  -3.662
  150   1HB   ASN  29          1HB       ASN  29 -11.440   6.507  -3.774
  151   2HB   ASN  29          2HB       ASN  29 -11.921   5.047  -4.639
  152   1HD2  ASN  29          1HD2      ASN  29 -12.354   6.932  -1.876
  153   2HD2  ASN  29          2HD2      ASN  29 -13.385   5.857  -1.003
  154    H    SER  30           H        SER  30 -10.538   6.079  -5.607
  155    HA   SER  30           HA       SER  30  -9.329   7.436  -7.030
  156   1HB   SER  30          1HB       SER  30  -6.687   6.743  -5.828
  157   2HB   SER  30          2HB       SER  30  -7.273   8.296  -6.420
  158    HG   SER  30           HG       SER  30  -7.084   8.272  -4.148
  159    H    GLN  31           H        GLN  31  -7.041   7.014  -8.404
  160    HA   GLN  31           HA       GLN  31  -6.988   4.165  -9.085
  161   1HB   GLN  31          1HB       GLN  31  -8.651   5.521 -10.511
  162   2HB   GLN  31          2HB       GLN  31  -7.218   6.227 -11.260
  163   1HG   GLN  31          1HG       GLN  31  -6.569   4.219 -12.214
  164   2HG   GLN  31          2HG       GLN  31  -7.534   3.259 -11.094
  165   1HE2  GLN  31          1HE2      GLN  31  -9.983   4.233 -11.236
  166   2HE2  GLN  31          2HE2      GLN  31 -10.618   4.145 -12.840
  167    H    HIS  32           H        HIS  32  -4.931   5.129  -7.746
  168    HA   HIS  32           HA       HIS  32  -2.738   4.684  -9.406
  169   1HB   HIS  32          1HB       HIS  32  -3.475   7.046 -10.149
  170   2HB   HIS  32          2HB       HIS  32  -2.801   7.583  -8.610
  171    HD1  HIS  32           HD1      HIS  32  -0.391   8.158  -8.663
  172    HD2  HIS  32           HD2      HIS  32  -1.441   5.597 -11.763
  173    HE1  HIS  32           HE1      HIS  32   1.684   7.907 -10.060
  174    HE2  HIS  32           HE2      HIS  32   1.049   6.285 -11.881
  175    H    CYS  33           H        CYS  33  -3.576   3.774  -6.919
  176    HA   CYS  33           HA       CYS  33  -1.777   5.028  -4.980
  177   1HB   CYS  33          1HB       CYS  33  -3.870   2.865  -4.670
  178   2HB   CYS  33          2HB       CYS  33  -2.854   3.460  -3.355
  179    H    VAL  34           H        VAL  34  -0.513   3.786  -7.110
  180    HA   VAL  34           HA       VAL  34   0.204   1.112  -6.753
  181    HB   VAL  34           HB       VAL  34   0.704   2.440  -8.789
  182   1HG1  VAL  34          1HG1      VAL  34   2.674   3.876  -8.848
  183   2HG1  VAL  34          2HG1      VAL  34   2.922   3.627  -7.118
  184   3HG1  VAL  34          3HG1      VAL  34   1.489   4.483  -7.690
  185   1HG2  VAL  34          1HG2      VAL  34   3.356   1.447  -7.925
  186   2HG2  VAL  34          2HG2      VAL  34   2.426   1.083  -9.379
  187   3HG2  VAL  34          3HG2      VAL  34   2.010   0.311  -7.848
  188    H    LYS  35           H        LYS  35   1.598   4.064  -5.421
  189    HA   LYS  35           HA       LYS  35   3.472   2.448  -3.850
  190   1HB   LYS  35          1HB       LYS  35   4.816   4.380  -3.623
  191   2HB   LYS  35          2HB       LYS  35   4.290   4.365  -5.297
  192   1HG   LYS  35          1HG       LYS  35   2.372   5.847  -3.856
  193   2HG   LYS  35          2HG       LYS  35   3.961   6.400  -3.326
  194   1HD   LYS  35          1HD       LYS  35   3.061   6.185  -6.199
  195   2HD   LYS  35          2HD       LYS  35   3.109   7.676  -5.257
  196   1HE   LYS  35          1HE       LYS  35   5.381   7.813  -5.329
  197   2HE   LYS  35          2HE       LYS  35   5.593   6.063  -5.389
  198   1HZ   LYS  35          1HZ       LYS  35   6.206   7.177  -7.474
  199   2HZ   LYS  35          2HZ       LYS  35   4.615   7.724  -7.649
  200   3HZ   LYS  35          3HZ       LYS  35   4.948   6.066  -7.690
  201    H    ALA  36           H        ALA  36   0.739   2.475  -3.130
  202    HA   ALA  36           HA       ALA  36   0.749   4.085  -0.663
  203   1HB   ALA  36          1HB       ALA  36  -1.122   4.258  -2.485
  204   2HB   ALA  36          2HB       ALA  36  -1.543   4.270  -0.772
  205   3HB   ALA  36          3HB       ALA  36  -1.725   2.791  -1.714
  206    H    ASN  37           H        ASN  37   0.461   3.112   1.308
  207    HA   ASN  37           HA       ASN  37   1.227   0.427   1.610
  208   1HB   ASN  37          1HB       ASN  37   0.096   2.504   3.446
  209   2HB   ASN  37          2HB       ASN  37   0.201   0.836   4.001
  210   1HD2  ASN  37          1HD2      ASN  37   2.288   2.989   2.097
  211   2HD2  ASN  37          2HD2      ASN  37   3.708   2.727   3.046
  212    H    THR  38           H        THR  38  -1.927   1.966   1.480
  213    HA   THR  38           HA       THR  38  -3.164  -0.622   1.026
  214    HB   THR  38           HB       THR  38  -4.391   1.173   3.104
  215    HG1  THR  38           HG1      THR  38  -2.460  -0.856   3.477
  216   1HG2  THR  38          1HG2      THR  38  -5.043  -1.321   3.817
  217   2HG2  THR  38          2HG2      THR  38  -4.902  -1.534   2.073
  218   3HG2  THR  38          3HG2      THR  38  -6.014  -0.333   2.728
  219    H    CYS  39           H        CYS  39  -5.118  -0.494  -0.113
  220    HA   CYS  39           HA       CYS  39  -6.108   2.169  -0.779
  221   1HB   CYS  39          1HB       CYS  39  -6.229   1.289  -3.241
  222   2HB   CYS  39          2HB       CYS  39  -4.739   2.005  -2.627
  223    H    THR  40           H        THR  40  -8.194   2.154  -0.384
  224    HA   THR  40           HA       THR  40  -9.724  -0.324  -0.799
  225    HB   THR  40           HB       THR  40 -10.810   2.023   0.707
  226    HG1  THR  40           HG1      THR  40  -8.825   0.235   1.620
  227   1HG2  THR  40          1HG2      THR  40 -12.146  -0.066   0.278
  228   2HG2  THR  40          2HG2      THR  40 -12.004   0.435   1.963
  229   3HG2  THR  40          3HG2      THR  40 -11.023  -0.897   1.355
  230    H    GLY  41           H        GLY  41 -11.055  -0.398  -2.508
  231   1HA   GLY  41          1HA       GLY  41 -12.414   0.287  -4.243
  232   2HA   GLY  41          2HA       GLY  41 -12.730   1.736  -3.304
  233    H    SER  42           H        SER  42  -9.673   0.540  -4.573
  234    HA   SER  42           HA       SER  42  -9.584   2.838  -6.390
  235   1HB   SER  42          1HB       SER  42  -8.302   3.198  -4.150
  236   2HB   SER  42          2HB       SER  42  -7.163   2.011  -4.778
  237    HG   SER  42           HG       SER  42  -6.320   3.569  -5.873
  238    H    THR  43           H        THR  43  -6.992   2.312  -7.368
  239    HA   THR  43           HA       THR  43  -6.986  -0.526  -8.000
  240    HB   THR  43           HB       THR  43  -7.418  -0.379 -10.201
  241    HG1  THR  43           HG1      THR  43  -6.632   1.175 -11.535
  242   1HG2  THR  43          1HG2      THR  43  -8.860   1.624 -10.828
  243   2HG2  THR  43          2HG2      THR  43  -8.665   2.129  -9.148
  244   3HG2  THR  43          3HG2      THR  43  -9.416   0.576  -9.523
  245    H    ASP  44           H        ASP  44  -5.000   0.300 -10.268
  246    HA   ASP  44           HA       ASP  44  -2.675  -0.198 -10.100
  247   1HB   ASP  44          1HB       ASP  44  -3.356   2.699  -9.799
  248   2HB   ASP  44          2HB       ASP  44  -1.664   2.208  -9.768
  249    H    CYS  45           H        CYS  45  -2.430  -1.516  -8.226
  250    HA   CYS  45           HA       CYS  45  -1.056  -0.143  -6.037
  251   1HB   CYS  45          1HB       CYS  45  -3.509  -1.849  -5.776
  252   2HB   CYS  45          2HB       CYS  45  -2.310  -1.829  -4.477
  253    H    ASN  46           H        ASN  46   0.898  -0.995  -6.062
  254    HA   ASN  46           HA       ASN  46   1.170  -3.893  -6.505
  255   1HB   ASN  46          1HB       ASN  46   2.280  -2.305  -8.154
  256   2HB   ASN  46          2HB       ASN  46   3.360  -1.840  -6.837
  257   1HD2  ASN  46          1HD2      ASN  46   4.577  -3.596  -5.808
  258   2HD2  ASN  46          2HD2      ASN  46   5.117  -4.909  -6.792
  259    H    THR  47           H        THR  47   2.152  -1.165  -4.505
  260    HA   THR  47           HA       THR  47   3.708  -2.864  -2.746
  261    HB   THR  47           HB       THR  47   4.326  -0.476  -3.324
  262    HG1  THR  47           HG1      THR  47   5.241  -0.211  -1.372
  263   1HG2  THR  47          1HG2      THR  47   1.989   0.425  -2.947
  264   2HG2  THR  47          2HG2      THR  47   3.322   1.344  -2.247
  265   3HG2  THR  47          3HG2      THR  47   2.335   0.303  -1.223
  266    H    ALA  48           H        ALA  48   0.499  -1.557  -2.933
  267    HA   ALA  48           HA       ALA  48  -0.284  -1.524  -0.275
  268   1HB   ALA  48          1HB       ALA  48  -2.007  -2.455  -2.564
  269   2HB   ALA  48          2HB       ALA  48  -1.638  -0.764  -2.226
  270   3HB   ALA  48          3HB       ALA  48  -2.537  -1.724  -1.049
  271    H    GLN  49           H        GLN  49  -0.680  -3.014   1.244
  272    HA   GLN  49           HA       GLN  49  -0.140  -5.796   0.630
  273   1HB   GLN  49          1HB       GLN  49  -0.902  -4.661   3.315
  274   2HB   GLN  49          2HB       GLN  49  -0.026  -6.148   2.977
  275   1HG   GLN  49          1HG       GLN  49   1.916  -5.093   3.031
  276   2HG   GLN  49          2HG       GLN  49   1.365  -3.904   1.853
  277   1HE2  GLN  49          1HE2      GLN  49  -0.640  -2.654   3.207
  278   2HE2  GLN  49          2HE2      GLN  49   0.000  -1.829   4.582
  279    H    THR  50           H        THR  50  -2.833  -3.953   0.397
  280    HA   THR  50           HA       THR  50  -4.579  -6.133   0.148
  281    HB   THR  50           HB       THR  50  -4.285  -5.890   2.704
  282    HG1  THR  50           HG1      THR  50  -6.918  -5.799   1.666
  283   1HG2  THR  50          1HG2      THR  50  -5.625  -4.329   3.854
  284   2HG2  THR  50          2HG2      THR  50  -6.336  -3.730   2.354
  285   3HG2  THR  50          3HG2      THR  50  -4.639  -3.409   2.715
  286    H    CYS  51           H        CYS  51  -6.841  -5.410  -0.299
  287    HA   CYS  51           HA       CYS  51  -7.524  -2.698  -0.580
  288   1HB   CYS  51          1HB       CYS  51  -7.259  -2.334  -2.954
  289   2HB   CYS  51          2HB       CYS  51  -5.692  -2.787  -2.279
  290    H    THR  52           H        THR  52  -9.360  -2.459  -2.294
  291    HA   THR  52           HA       THR  52 -10.882  -4.884  -2.736
  292    HB   THR  52           HB       THR  52 -11.475  -4.144  -0.422
  293    HG1  THR  52           HG1      THR  52 -13.433  -4.112  -2.456
  294   1HG2  THR  52          1HG2      THR  52 -12.560  -1.726  -1.838
  295   2HG2  THR  52          2HG2      THR  52 -11.326  -1.764  -0.578
  296   3HG2  THR  52          3HG2      THR  52 -12.991  -2.206  -0.196
  297    H    ASN  53           H        ASN  53 -12.292  -4.712  -4.438
  298    HA   ASN  53           HA       ASN  53 -13.174  -3.890  -6.367
  299   1HB   ASN  53          1HB       ASN  53 -13.455  -1.643  -4.443
  300   2HB   ASN  53          2HB       ASN  53 -13.672  -1.261  -6.153
  301   1HD2  ASN  53          1HD2      ASN  53 -15.012  -2.720  -3.373
  302   2HD2  ASN  53          2HD2      ASN  53 -16.504  -3.230  -4.078
  303    H    SER  54           H        SER  54 -10.260  -3.843  -5.893
  304    HA   SER  54           HA       SER  54  -9.386  -1.571  -7.530
  305   1HB   SER  54          1HB       SER  54  -7.259  -1.897  -6.675
  306   2HB   SER  54          2HB       SER  54  -8.240  -2.488  -5.328
  307    HG   SER  54           HG       SER  54  -7.874  -4.591  -6.041
  308    H    LYS  55           H        LYS  55  -7.491  -2.257  -9.077
  309    HA   LYS  55           HA       LYS  55  -8.362  -4.638 -10.583
  310   1HB   LYS  55          1HB       LYS  55  -7.609  -1.894 -11.521
  311   2HB   LYS  55          2HB       LYS  55  -7.320  -3.276 -12.568
  312   1HG   LYS  55          1HG       LYS  55  -9.922  -3.642 -11.730
  313   2HG   LYS  55          2HG       LYS  55  -9.794  -1.895 -11.945
  314   1HD   LYS  55          1HD       LYS  55 -10.215  -2.332 -14.105
  315   2HD   LYS  55          2HD       LYS  55  -8.524  -2.829 -14.175
  316   1HE   LYS  55          1HE       LYS  55  -9.037  -5.062 -14.174
  317   2HE   LYS  55          2HE       LYS  55 -10.551  -4.824 -13.300
  318   1HZ   LYS  55          1HZ       LYS  55 -11.438  -5.174 -15.318
  319   2HZ   LYS  55          2HZ       LYS  55 -10.028  -4.752 -16.150
  320   3HZ   LYS  55          3HZ       LYS  55 -11.066  -3.544 -15.584
  321    H    ASP  56           H        ASP  56  -6.195  -4.075  -8.503
  322    HA   ASP  56           HA       ASP  56  -4.100  -5.499  -9.887
  323   1HB   ASP  56          1HB       ASP  56  -3.420  -3.017  -8.317
  324   2HB   ASP  56          2HB       ASP  56  -2.350  -3.983  -9.339
  325    H    CYS  57           H        CYS  57  -2.440  -4.579  -7.443
  326    HA   CYS  57           HA       CYS  57  -2.003  -5.226  -5.302
  327   1HB   CYS  57          1HB       CYS  57  -4.784  -6.418  -5.224
  328   2HB   CYS  57          2HB       CYS  57  -3.740  -6.063  -3.849
  329    H    PHE  58           H        PHE  58  -0.530  -6.617  -6.511
  330    HA   PHE  58           HA       PHE  58  -1.272  -9.349  -6.991
  331   1HB   PHE  58          1HB       PHE  58   1.533  -8.234  -6.921
  332   2HB   PHE  58          2HB       PHE  58   0.959  -9.655  -7.783
  333    HD1  PHE  58           HD1      PHE  58   2.607  -7.673  -9.028
  334    HD2  PHE  58           HD2      PHE  58  -1.617  -7.826  -8.573
  335    HE1  PHE  58           HE1      PHE  58   2.345  -6.327 -11.058
  336    HE2  PHE  58           HE2      PHE  58  -1.886  -6.480 -10.606
  337    HZ   PHE  58           HZ       PHE  58   0.105  -5.751 -11.822
  338    H    GLU  59           H        GLU  59   0.578  -7.612  -4.532
  339    HA   GLU  59           HA       GLU  59   0.838 -10.121  -3.019
  340   1HB   GLU  59          1HB       GLU  59   2.641  -9.039  -1.787
  341   2HB   GLU  59          2HB       GLU  59   2.952  -8.970  -3.522
  342   1HG   GLU  59          1HG       GLU  59   2.047  -6.645  -3.511
  343   2HG   GLU  59          2HG       GLU  59   1.972  -6.742  -1.752
  344    H    ALA  60           H        ALA  60  -1.658  -8.999  -2.974
  345    HA   ALA  60           HA       ALA  60  -1.838  -7.479  -0.476
  346   1HB   ALA  60          1HB       ALA  60  -3.617  -7.864  -2.816
  347   2HB   ALA  60          2HB       ALA  60  -3.242  -6.402  -1.903
  348   3HB   ALA  60          3HB       ALA  60  -4.376  -7.582  -1.250
  349    H    ASN  61           H        ASN  61  -2.503  -8.354   1.377
  350    HA   ASN  61           HA       ASN  61  -2.815 -11.152   1.642
  351   1HB   ASN  61          1HB       ASN  61  -3.679  -9.104   3.684
  352   2HB   ASN  61          2HB       ASN  61  -3.126 -10.752   3.968
  353   1HD2  ASN  61          1HD2      ASN  61  -2.215  -7.899   4.696
  354   2HD2  ASN  61          2HD2      ASN  61  -0.512  -7.950   4.411
  355    H    THR  62           H        THR  62  -5.107  -8.488   1.431
  356    HA   THR  62           HA       THR  62  -7.295 -10.465   1.428
  357    HB   THR  62           HB       THR  62  -7.939  -7.622   1.959
  358    HG1  THR  62           HG1      THR  62  -7.306  -7.802   4.121
  359   1HG2  THR  62          1HG2      THR  62  -9.841  -8.641   2.460
  360   2HG2  THR  62          2HG2      THR  62  -9.040  -9.190   3.932
  361   3HG2  THR  62          3HG2      THR  62  -9.074 -10.227   2.507
  362    H    CYS  63           H        CYS  63  -7.338 -10.834  -0.767
  363    HA   CYS  63           HA       CYS  63  -7.739  -8.524  -2.531
  364   1HB   CYS  63          1HB       CYS  63  -5.987 -10.061  -3.231
  365   2HB   CYS  63          2HB       CYS  63  -7.112 -11.418  -3.164
  366    H    THR  64           H        THR  64  -9.922  -8.279  -1.594
  367    HA   THR  64           HA       THR  64 -11.848 -10.263  -2.585
  368    HB   THR  64           HB       THR  64 -13.387  -8.660  -1.099
  369    HG1  THR  64           HG1      THR  64 -12.313  -7.659   0.469
  370   1HG2  THR  64          1HG2      THR  64 -12.254 -10.133   0.913
  371   2HG2  THR  64          2HG2      THR  64 -11.887 -11.079  -0.528
  372   3HG2  THR  64          3HG2      THR  64 -13.558 -10.659  -0.151
  373    H    ASP  65           H        ASP  65 -13.224  -9.803  -4.184
  374    HA   ASP  65           HA       ASP  65 -14.152  -8.713  -5.956
  375   1HB   ASP  65          1HB       ASP  65 -14.279  -6.544  -3.856
  376   2HB   ASP  65          2HB       ASP  65 -15.055  -6.411  -5.437
  377    H    SER  66           H        SER  66 -11.882  -8.896  -6.848
  378    HA   SER  66           HA       SER  66 -11.197  -6.442  -8.113
  379   1HB   SER  66          1HB       SER  66  -9.079  -5.976  -7.185
  380   2HB   SER  66          2HB       SER  66 -10.109  -6.289  -5.782
  381    HG   SER  66           HG       SER  66  -7.989  -7.380  -5.856
  382    H    THR  67           H        THR  67  -8.779  -6.874  -9.129
  383    HA   THR  67           HA       THR  67  -8.668  -9.631 -10.091
  384    HB   THR  67           HB       THR  67  -9.951  -8.633 -11.783
  385    HG1  THR  67           HG1      THR  67  -7.291  -8.328 -12.703
  386   1HG2  THR  67          1HG2      THR  67  -9.635  -6.295 -11.123
  387   2HG2  THR  67          2HG2      THR  67  -9.493  -6.551 -12.862
  388   3HG2  THR  67          3HG2      THR  67  -8.044  -6.321 -11.883
  389    H    ASN  68           H        ASN  68  -6.654 -10.119 -11.257
  390    HA   ASN  68           HA       ASN  68  -4.384 -10.165 -11.394
  391   1HB   ASN  68          1HB       ASN  68  -5.049  -7.655 -12.172
  392   2HB   ASN  68          2HB       ASN  68  -4.023  -7.286 -10.782
  393   1HD2  ASN  68          1HD2      ASN  68  -4.000  -7.645 -14.006
  394   2HD2  ASN  68          2HD2      ASN  68  -2.358  -8.123 -14.251
  395    H    CYS  69           H        CYS  69  -4.603 -11.326  -9.316
  396    HA   CYS  69           HA       CYS  69  -3.202  -9.867  -7.181
  397   1HB   CYS  69          1HB       CYS  69  -5.650 -11.590  -7.003
  398   2HB   CYS  69          2HB       CYS  69  -4.535 -11.516  -5.636
  399    H    TYR  70           H        TYR  70  -1.329 -10.844  -8.263
  400    HA   TYR  70           HA       TYR  70  -1.005 -13.698  -8.158
  401   1HB   TYR  70          1HB       TYR  70   1.156 -11.639  -8.622
  402   2HB   TYR  70          2HB       TYR  70   1.152 -13.334  -9.117
  403    HD1  TYR  70           HD1      TYR  70   1.315 -10.442 -10.614
  404    HD2  TYR  70           HD2      TYR  70  -1.530 -13.590 -10.313
  405    HE1  TYR  70           HE1      TYR  70   0.380  -9.796 -12.794
  406    HE2  TYR  70           HE2      TYR  70  -2.472 -12.955 -12.493
  407    HH   TYR  70           HH       TYR  70  -0.919 -10.722 -14.588
  408    H    LYS  71           H        LYS  71  -1.175 -14.320  -6.059
  409    HA   LYS  71           HA       LYS  71   0.075 -15.136  -4.227
  410   1HB   LYS  71          1HB       LYS  71   2.103 -13.817  -5.044
  411   2HB   LYS  71          2HB       LYS  71   1.489 -12.475  -4.076
  412   1HG   LYS  71          1HG       LYS  71   1.472 -14.655  -2.350
  413   2HG   LYS  71          2HG       LYS  71   2.974 -14.813  -3.262
  414   1HD   LYS  71          1HD       LYS  71   2.099 -12.263  -1.916
  415   2HD   LYS  71          2HD       LYS  71   3.147 -13.460  -1.152
  416   1HE   LYS  71          1HE       LYS  71   3.917 -12.518  -3.852
  417   2HE   LYS  71          2HE       LYS  71   4.089 -11.370  -2.526
  418   1HZ   LYS  71          1HZ       LYS  71   5.692 -12.622  -1.524
  419   2HZ   LYS  71          2HZ       LYS  71   6.013 -13.002  -3.141
  420   3HZ   LYS  71          3HZ       LYS  71   5.143 -14.084  -2.176
  421    H    ALA  72           H        ALA  72  -2.396 -14.457  -4.067
  422    HA   ALA  72           HA       ALA  72  -2.614 -12.581  -1.802
  423   1HB   ALA  72          1HB       ALA  72  -3.877 -11.569  -3.455
  424   2HB   ALA  72          2HB       ALA  72  -5.090 -12.504  -2.579
  425   3HB   ALA  72          3HB       ALA  72  -4.446 -13.106  -4.106
  426    H    THR  73           H        THR  73  -3.476 -13.310   0.058
  427    HA   THR  73           HA       THR  73  -4.067 -16.143   0.254
  428    HB   THR  73           HB       THR  73  -4.347 -15.436   2.754
  429    HG1  THR  73           HG1      THR  73  -4.401 -13.228   2.489
  430   1HG2  THR  73          1HG2      THR  73  -1.614 -15.093   1.565
  431   2HG2  THR  73          2HG2      THR  73  -2.391 -16.662   1.775
  432   3HG2  THR  73          3HG2      THR  73  -2.037 -15.657   3.181
  433    H    ALA  74           H        ALA  74  -5.906 -13.633  -0.663
  434    HA   ALA  74           HA       ALA  74  -8.335 -14.922   0.310
  435   1HB   ALA  74          1HB       ALA  74  -9.168 -13.188   1.482
  436   2HB   ALA  74          2HB       ALA  74  -8.458 -11.982   0.409
  437   3HB   ALA  74          3HB       ALA  74  -7.468 -12.748   1.652
  438    H    CYS  75           H        CYS  75  -8.741 -15.620  -1.782
  439    HA   CYS  75           HA       CYS  75  -9.427 -13.488  -3.697
  440   1HB   CYS  75          1HB       CYS  75  -7.436 -14.735  -4.437
  441   2HB   CYS  75          2HB       CYS  75  -8.347 -16.244  -4.342
  442    H    THR  76           H        THR  76 -11.522 -13.681  -2.514
  443    HA   THR  76           HA       THR  76 -13.116 -15.962  -2.535
  444    HB   THR  76           HB       THR  76 -13.595 -13.866  -1.270
  445    HG1  THR  76           HG1      THR  76 -15.600 -14.474  -1.171
  446   1HG2  THR  76          1HG2      THR  76 -13.239 -12.294  -3.181
  447   2HG2  THR  76          2HG2      THR  76 -14.713 -12.028  -2.249
  448   3HG2  THR  76          3HG2      THR  76 -14.794 -12.829  -3.818
  449    H    ASN  77           H        ASN  77 -12.989 -13.322  -4.924
  450    HA   ASN  77           HA       ASN  77 -13.666 -15.151  -7.046
  451   1HB   ASN  77          1HB       ASN  77 -15.557 -12.871  -6.412
  452   2HB   ASN  77          2HB       ASN  77 -15.674 -13.967  -7.790
  453   1HD2  ASN  77          1HD2      ASN  77 -16.607 -13.382  -4.628
  454   2HD2  ASN  77          2HD2      ASN  77 -17.300 -14.925  -4.274
  455    H    SER  78           H        SER  78 -11.511 -13.301  -6.282
  456    HA   SER  78           HA       SER  78 -11.681 -11.174  -8.256
  457   1HB   SER  78          1HB       SER  78  -9.646 -11.890  -6.146
  458   2HB   SER  78          2HB       SER  78  -9.351 -10.630  -7.351
  459    HG   SER  78           HG       SER  78 -11.117 -10.667  -5.195
  460    H    SER  79           H        SER  79  -9.998 -10.850  -9.858
  461    HA   SER  79           HA       SER  79  -9.232 -13.374 -11.081
  462   1HB   SER  79          1HB       SER  79  -8.391 -10.938 -12.463
  463   2HB   SER  79          2HB       SER  79  -9.365 -12.285 -13.048
  464    HG   SER  79           HG       SER  79 -11.163 -11.352 -12.024
  465    H    GLY  80           H        GLY  80  -7.064 -13.629 -12.024
  466   1HA   GLY  80          1HA       GLY  80  -4.768 -13.608 -11.912
  467   2HA   GLY  80          2HA       GLY  80  -4.880 -12.064 -11.075
  468    H    CYS  81           H        CYS  81  -6.697 -14.534  -9.590
  469    HA   CYS  81           HA       CYS  81  -4.483 -15.314  -7.842
  470   1HB   CYS  81          1HB       CYS  81  -6.088 -14.952  -5.865
  471   2HB   CYS  81          2HB       CYS  81  -5.324 -13.526  -6.572
  472    HA   PRO  82           HA       PRO  82  -6.477 -19.242  -7.903
  473   1HB   PRO  82          1HB       PRO  82  -5.660 -19.918  -5.210
  474   2HB   PRO  82          2HB       PRO  82  -4.966 -20.455  -6.744
  475   1HG   PRO  82          1HG       PRO  82  -3.682 -18.793  -4.986
  476   2HG   PRO  82          2HG       PRO  82  -3.360 -18.834  -6.727
  477   1HD   PRO  82          1HD       PRO  82  -5.014 -16.904  -5.147
  478   2HD   PRO  82          2HD       PRO  82  -3.916 -16.598  -6.510
  479    H    GLY  83           H        GLY  83  -6.722 -18.552  -4.424
  480   1HA   GLY  83          1HA       GLY  83  -8.531 -18.515  -3.013
  481   2HA   GLY  83          2HA       GLY  83  -9.441 -17.865  -4.368
  482    H    HIS  84           H        HIS  84  -7.931 -20.952  -4.747
  483    HA   HIS  84           HA       HIS  84 -10.235 -22.459  -3.886
  484   1HB   HIS  84          1HB       HIS  84  -9.970 -21.605  -6.643
  485   2HB   HIS  84          2HB       HIS  84  -9.966 -23.361  -6.525
  486    HD1  HIS  84           HD1      HIS  84 -11.993 -23.580  -4.140
  487    HD2  HIS  84           HD2      HIS  84 -12.537 -21.291  -7.565
  488    HE1  HIS  84           HE1      HIS  84 -14.481 -23.281  -4.361
  489    HE2  HIS  84           HE2      HIS  84 -14.783 -21.833  -6.400
  Start of MODEL   14
    1   1H    GLN   1          1H        GLN   1 -11.614  20.429  -3.428
    2   2H    GLN   1          2H        GLN   1 -10.099  21.107  -3.864
    3   3H    GLN   1          3H        GLN   1 -11.285  22.077  -3.093
    4    HA   GLN   1           HA       GLN   1  -9.766  21.578  -1.463
    5   1HB   GLN   1          1HB       GLN   1 -12.395  20.874  -1.316
    6   2HB   GLN   1          2HB       GLN   1 -11.621  19.365  -0.849
    7   1HG   GLN   1          1HG       GLN   1 -10.245  20.926   0.741
    8   2HG   GLN   1          2HG       GLN   1 -11.625  22.002   0.525
    9   1HE2  GLN   1          1HE2      GLN   1 -11.149  21.167   3.002
   10   2HE2  GLN   1          2HE2      GLN   1 -12.301  19.979   3.501
   11    H    CYS   2           H        CYS   2 -10.965  18.358  -2.413
   12    HA   CYS   2           HA       CYS   2  -8.488  17.300  -3.182
   13   1HB   CYS   2          1HB       CYS   2  -8.982  17.368  -0.296
   14   2HB   CYS   2          2HB       CYS   2  -8.625  15.753  -0.896
   15    H    THR   3           H        THR   3 -10.686  16.987  -4.482
   16    HA   THR   3           HA       THR   3 -11.390  14.180  -4.086
   17    HB   THR   3           HB       THR   3 -13.718  14.501  -4.124
   18    HG1  THR   3           HG1      THR   3 -13.290  17.238  -4.721
   19   1HG2  THR   3          1HG2      THR   3 -14.229  16.244  -2.404
   20   2HG2  THR   3          2HG2      THR   3 -12.519  16.677  -2.439
   21   3HG2  THR   3          3HG2      THR   3 -13.009  15.058  -1.938
   22    H    GLY   4           H        GLY   4  -9.802  15.842  -6.009
   23   1HA   GLY   4          1HA       GLY   4 -11.305  15.753  -8.478
   24   2HA   GLY   4          2HA       GLY   4  -9.612  16.207  -8.297
   25    H    GLY   5           H        GLY   5 -11.835  13.674  -9.018
   26   1HA   GLY   5          1HA       GLY   5 -10.054  11.474  -8.788
   27   2HA   GLY   5          2HA       GLY   5 -11.545  11.502  -9.715
   28    H    ALA   6           H        ALA   6  -8.206  12.731  -9.837
   29    HA   ALA   6           HA       ALA   6  -7.604  11.577 -12.314
   30   1HB   ALA   6          1HB       ALA   6  -7.489  14.002 -13.452
   31   2HB   ALA   6          2HB       ALA   6  -8.915  14.221 -12.438
   32   3HB   ALA   6          3HB       ALA   6  -8.868  12.917 -13.626
   33    H    ASP   7           H        ASP   7  -6.954  14.917 -11.297
   34    HA   ASP   7           HA       ASP   7  -4.139  14.149 -10.882
   35   1HB   ASP   7          1HB       ASP   7  -5.293  16.791 -11.806
   36   2HB   ASP   7          2HB       ASP   7  -3.586  16.510 -11.453
   37    H    CYS   8           H        CYS   8  -3.416  14.298  -8.868
   38    HA   CYS   8           HA       CYS   8  -4.957  15.883  -6.940
   39   1HB   CYS   8          1HB       CYS   8  -3.761  13.291  -6.842
   40   2HB   CYS   8          2HB       CYS   8  -2.978  14.307  -5.630
   41    H    THR   9           H        THR   9  -3.928  17.836  -7.826
   42    HA   THR   9           HA       THR   9  -1.121  18.184  -7.081
   43    HB   THR   9           HB       THR   9  -1.826  20.562  -8.179
   44    HG1  THR   9           HG1      THR   9  -3.479  20.387  -9.464
   45   1HG2  THR   9          1HG2      THR   9  -0.020  19.648  -9.206
   46   2HG2  THR   9          2HG2      THR   9  -1.239  19.363 -10.448
   47   3HG2  THR   9          3HG2      THR   9  -0.768  18.059  -9.359
   48    H    SER  10           H        SER  10  -3.780  18.253  -5.369
   49    HA   SER  10           HA       SER  10  -3.095  20.733  -3.935
   50   1HB   SER  10          1HB       SER  10  -5.563  20.213  -2.998
   51   2HB   SER  10          2HB       SER  10  -5.275  21.190  -4.437
   52    HG   SER  10           HG       SER  10  -5.851  19.520  -5.705
   53    H    CYS  11           H        CYS  11  -3.967  17.334  -3.638
   54    HA   CYS  11           HA       CYS  11  -3.634  17.341  -0.766
   55   1HB   CYS  11          1HB       CYS  11  -3.804  14.851  -2.436
   56   2HB   CYS  11          2HB       CYS  11  -4.380  15.125  -0.796
   57    H    THR  12           H        THR  12  -2.128  15.803   0.289
   58    HA   THR  12           HA       THR  12   0.281  15.196  -1.240
   59    HB   THR  12           HB       THR  12   1.565  16.146   0.852
   60    HG1  THR  12           HG1      THR  12   0.148  17.006   2.159
   61   1HG2  THR  12          1HG2      THR  12   1.574  18.456  -0.206
   62   2HG2  THR  12          2HG2      THR  12   0.474  17.781  -1.408
   63   3HG2  THR  12          3HG2      THR  12   2.090  17.102  -1.211
   64    H    GLY  13           H        GLY  13  -1.353  15.060   1.907
   65   1HA   GLY  13          1HA       GLY  13   0.177  12.831   2.832
   66   2HA   GLY  13          2HA       GLY  13  -1.277  13.473   3.577
   67    H    ALA  14           H        ALA  14  -3.312  12.695   2.912
   68    HA   ALA  14           HA       ALA  14  -3.174  10.056   1.628
   69   1HB   ALA  14          1HB       ALA  14  -4.153  10.486   4.007
   70   2HB   ALA  14          2HB       ALA  14  -4.969   9.377   2.905
   71   3HB   ALA  14          3HB       ALA  14  -5.578  11.019   3.116
   72    H    CYS  15           H        CYS  15  -4.322   9.590  -0.185
   73    HA   CYS  15           HA       CYS  15  -5.753  11.830  -1.433
   74   1HB   CYS  15          1HB       CYS  15  -5.252   9.553  -3.182
   75   2HB   CYS  15          2HB       CYS  15  -4.848  11.249  -3.406
   76    H    THR  16           H        THR  16  -7.875  11.736  -1.748
   77    HA   THR  16           HA       THR  16  -9.208   9.116  -1.681
   78    HB   THR  16           HB       THR  16  -9.473  10.207   0.517
   79    HG1  THR  16           HG1      THR  16 -11.185   8.936  -0.379
   80   1HG2  THR  16          1HG2      THR  16 -10.900  12.191   0.725
   81   2HG2  THR  16          2HG2      THR  16 -10.843  12.395  -1.026
   82   3HG2  THR  16          3HG2      THR  16  -9.367  12.538  -0.071
   83    H    GLY  17           H        GLY  17 -10.626   8.804  -3.296
   84   1HA   GLY  17          1HA       GLY  17 -11.885   9.212  -5.176
   85   2HA   GLY  17          2HA       GLY  17 -12.281  10.765  -4.437
   86    H    CYS  18           H        CYS  18  -8.989   9.879  -5.104
   87    HA   CYS  18           HA       CYS  18  -8.902  11.929  -7.213
   88   1HB   CYS  18          1HB       CYS  18  -7.421  11.698  -4.864
   89   2HB   CYS  18          2HB       CYS  18  -6.320  11.126  -6.119
   90    H    GLY  19           H        GLY  19  -6.311  11.254  -8.147
   91   1HA   GLY  19          1HA       GLY  19  -6.479   8.490  -9.072
   92   2HA   GLY  19          2HA       GLY  19  -6.602   9.742 -10.306
   93    H    ASN  20           H        ASN  20  -4.626  10.624  -7.677
   94    HA   ASN  20           HA       ASN  20  -2.191   9.463  -8.678
   95   1HB   ASN  20          1HB       ASN  20  -2.480  11.321 -10.253
   96   2HB   ASN  20          2HB       ASN  20  -2.622  12.450  -8.910
   97   1HD2  ASN  20          1HD2      ASN  20  -0.864  13.666  -9.012
   98   2HD2  ASN  20          2HD2      ASN  20   0.760  13.082  -9.084
   99    H    CYS  21           H        CYS  21  -0.522   9.564  -7.203
  100    HA   CYS  21           HA       CYS  21  -0.923  11.151  -4.778
  101   1HB   CYS  21          1HB       CYS  21  -0.414   8.169  -4.799
  102   2HB   CYS  21          2HB       CYS  21  -0.338   9.191  -3.361
  103    HA   PRO  22           HA       PRO  22   3.414  11.738  -5.681
  104   1HB   PRO  22          1HB       PRO  22   3.924  13.516  -3.686
  105   2HB   PRO  22          2HB       PRO  22   3.139  13.954  -5.203
  106   1HG   PRO  22          1HG       PRO  22   1.957  13.533  -2.510
  107   2HG   PRO  22          2HG       PRO  22   1.468  14.646  -3.795
  108   1HD   PRO  22          1HD       PRO  22   0.221  12.245  -3.200
  109   2HD   PRO  22          2HD       PRO  22   0.085  13.111  -4.740
  110    H    ASN  23           H        ASN  23   3.065  12.079  -2.160
  111    HA   ASN  23           HA       ASN  23   4.861   9.765  -1.846
  112   1HB   ASN  23          1HB       ASN  23   4.675  12.048   0.116
  113   2HB   ASN  23          2HB       ASN  23   5.928  10.810  -0.007
  114   1HD2  ASN  23          1HD2      ASN  23   4.474  13.504  -1.766
  115   2HD2  ASN  23          2HD2      ASN  23   5.930  14.007  -2.553
  116    H    ALA  24           H        ALA  24   1.776  10.389  -1.665
  117    HA   ALA  24           HA       ALA  24   0.843   9.979   0.898
  118   1HB   ALA  24          1HB       ALA  24  -0.439  10.413  -1.298
  119   2HB   ALA  24          2HB       ALA  24  -1.211   9.442  -0.045
  120   3HB   ALA  24          3HB       ALA  24  -0.476   8.656  -1.442
  121    H    VAL  25           H        VAL  25   0.754   8.322   2.279
  122    HA   VAL  25           HA       VAL  25   2.012   5.808   1.493
  123    HB   VAL  25           HB       VAL  25   2.799   6.883   3.550
  124   1HG1  VAL  25          1HG1      VAL  25   1.224   8.008   4.686
  125   2HG1  VAL  25          2HG1      VAL  25   0.946   6.463   5.489
  126   3HG1  VAL  25          3HG1      VAL  25  -0.075   6.950   4.136
  127   1HG2  VAL  25          1HG2      VAL  25   3.151   4.916   4.597
  128   2HG2  VAL  25          2HG2      VAL  25   2.335   4.251   3.182
  129   3HG2  VAL  25          3HG2      VAL  25   1.432   4.526   4.672
  130    H    THR  26           H        THR  26  -1.103   7.118   2.195
  131    HA   THR  26           HA       THR  26  -2.324   4.558   1.605
  132    HB   THR  26           HB       THR  26  -3.619   5.766   3.931
  133    HG1  THR  26           HG1      THR  26  -2.039   5.121   5.404
  134   1HG2  THR  26          1HG2      THR  26  -3.592   3.485   4.776
  135   2HG2  THR  26          2HG2      THR  26  -2.575   2.992   3.423
  136   3HG2  THR  26          3HG2      THR  26  -4.219   3.558   3.130
  137    H    CYS  27           H        CYS  27  -4.175   4.782   0.494
  138    HA   CYS  27           HA       CYS  27  -5.601   7.335   0.582
  139   1HB   CYS  27          1HB       CYS  27  -5.787   6.771  -2.082
  140   2HB   CYS  27          2HB       CYS  27  -4.657   7.930  -1.386
  141    H    THR  28           H        THR  28  -7.784   7.201   0.171
  142    HA   THR  28           HA       THR  28  -8.872   4.481   0.164
  143    HB   THR  28           HB       THR  28 -10.701   6.781   0.494
  144    HG1  THR  28           HG1      THR  28  -8.601   6.240   2.301
  145   1HG2  THR  28          1HG2      THR  28 -11.866   5.423   1.870
  146   2HG2  THR  28          2HG2      THR  28 -10.419   4.659   2.530
  147   3HG2  THR  28          3HG2      THR  28 -11.021   4.186   0.940
  148    H    ASN  29           H        ASN  29  -9.252   3.738  -1.837
  149    HA   ASN  29           HA       ASN  29 -10.310   3.496  -3.809
  150   1HB   ASN  29          1HB       ASN  29 -11.774   5.575  -2.650
  151   2HB   ASN  29          2HB       ASN  29 -11.280   6.212  -4.216
  152   1HD2  ASN  29          1HD2      ASN  29 -12.485   5.714  -5.901
  153   2HD2  ASN  29          2HD2      ASN  29 -13.648   4.438  -5.970
  154    H    SER  30           H        SER  30 -10.476   5.595  -5.753
  155    HA   SER  30           HA       SER  30  -9.242   6.878  -7.222
  156   1HB   SER  30          1HB       SER  30  -7.864   7.638  -5.249
  157   2HB   SER  30          2HB       SER  30  -6.798   6.268  -5.546
  158    HG   SER  30           HG       SER  30  -5.950   7.279  -7.182
  159    H    GLN  31           H        GLN  31  -7.419   6.526  -8.825
  160    HA   GLN  31           HA       GLN  31  -6.991   3.645  -9.250
  161   1HB   GLN  31          1HB       GLN  31  -7.086   4.424 -11.780
  162   2HB   GLN  31          2HB       GLN  31  -8.543   3.976 -10.898
  163   1HG   GLN  31          1HG       GLN  31  -9.237   5.915 -11.853
  164   2HG   GLN  31          2HG       GLN  31  -8.586   6.553 -10.347
  165   1HE2  GLN  31          1HE2      GLN  31  -7.167   5.527 -13.435
  166   2HE2  GLN  31          2HE2      GLN  31  -6.285   6.986 -13.711
  167    H    HIS  32           H        HIS  32  -4.975   4.624  -8.038
  168    HA   HIS  32           HA       HIS  32  -2.771   4.334  -9.635
  169   1HB   HIS  32          1HB       HIS  32  -3.937   6.896 -10.064
  170   2HB   HIS  32          2HB       HIS  32  -2.407   7.140  -9.217
  171    HD1  HIS  32           HD1      HIS  32  -0.487   5.312 -10.440
  172    HD2  HIS  32           HD2      HIS  32  -3.478   7.093 -12.709
  173    HE1  HIS  32           HE1      HIS  32   0.327   5.220 -12.817
  174    HE2  HIS  32           HE2      HIS  32  -1.544   6.211 -14.181
  175    H    CYS  33           H        CYS  33  -3.447   3.531  -7.139
  176    HA   CYS  33           HA       CYS  33  -1.664   5.062  -5.362
  177   1HB   CYS  33          1HB       CYS  33  -4.100   3.385  -4.835
  178   2HB   CYS  33          2HB       CYS  33  -2.900   3.629  -3.563
  179    H    VAL  34           H        VAL  34  -0.499   3.396  -7.214
  180    HA   VAL  34           HA       VAL  34  -0.058   0.759  -6.370
  181    HB   VAL  34           HB       VAL  34   2.090   0.960  -7.723
  182   1HG1  VAL  34          1HG1      VAL  34   0.819   1.157  -9.880
  183   2HG1  VAL  34          2HG1      VAL  34  -0.601   1.581  -8.924
  184   3HG1  VAL  34          3HG1      VAL  34   0.157   0.001  -8.724
  185   1HG2  VAL  34          1HG2      VAL  34   1.820   3.617  -7.342
  186   2HG2  VAL  34          2HG2      VAL  34   1.070   3.447  -8.929
  187   3HG2  VAL  34          3HG2      VAL  34   2.728   2.904  -8.674
  188    H    LYS  35           H        LYS  35   1.268   3.766  -5.270
  189    HA   LYS  35           HA       LYS  35   3.424   2.427  -3.829
  190   1HB   LYS  35          1HB       LYS  35   3.878   4.529  -5.058
  191   2HB   LYS  35          2HB       LYS  35   2.746   5.367  -4.005
  192   1HG   LYS  35          1HG       LYS  35   4.146   4.953  -2.092
  193   2HG   LYS  35          2HG       LYS  35   5.244   3.972  -3.066
  194   1HD   LYS  35          1HD       LYS  35   6.070   5.812  -4.214
  195   2HD   LYS  35          2HD       LYS  35   4.664   6.806  -3.830
  196   1HE   LYS  35          1HE       LYS  35   6.923   6.000  -2.014
  197   2HE   LYS  35          2HE       LYS  35   6.456   7.625  -2.511
  198   1HZ   LYS  35          1HZ       LYS  35   5.556   7.503  -0.423
  199   2HZ   LYS  35          2HZ       LYS  35   5.195   5.853  -0.536
  200   3HZ   LYS  35          3HZ       LYS  35   4.237   6.986  -1.349
  201    H    ALA  36           H        ALA  36   0.221   3.097  -3.275
  202    HA   ALA  36           HA       ALA  36   0.416   3.947  -0.533
  203   1HB   ALA  36          1HB       ALA  36  -1.844   4.206  -0.593
  204   2HB   ALA  36          2HB       ALA  36  -2.094   2.772  -1.590
  205   3HB   ALA  36          3HB       ALA  36  -1.508   4.265  -2.323
  206    H    ASN  37           H        ASN  37  -0.121   2.744   1.307
  207    HA   ASN  37           HA       ASN  37   0.598  -0.050   1.146
  208   1HB   ASN  37          1HB       ASN  37   0.228   1.947   3.321
  209   2HB   ASN  37          2HB       ASN  37   0.013   0.250   3.739
  210   1HD2  ASN  37          1HD2      ASN  37   1.776  -0.456   4.689
  211   2HD2  ASN  37          2HD2      ASN  37   3.399  -0.153   4.180
  212    H    THR  38           H        THR  38  -2.268   1.873   1.800
  213    HA   THR  38           HA       THR  38  -3.875  -0.583   1.630
  214    HB   THR  38           HB       THR  38  -4.757   1.657   3.412
  215    HG1  THR  38           HG1      THR  38  -2.672   1.122   4.134
  216   1HG2  THR  38          1HG2      THR  38  -5.156  -1.320   3.573
  217   2HG2  THR  38          2HG2      THR  38  -6.327  -0.153   2.959
  218   3HG2  THR  38          3HG2      THR  38  -5.846  -0.112   4.656
  219    H    CYS  39           H        CYS  39  -5.584  -0.462   0.283
  220    HA   CYS  39           HA       CYS  39  -6.624   2.146  -0.500
  221   1HB   CYS  39          1HB       CYS  39  -6.526   1.135  -2.963
  222   2HB   CYS  39          2HB       CYS  39  -5.201   2.087  -2.291
  223    H    THR  40           H        THR  40  -8.715   1.950  -0.079
  224    HA   THR  40           HA       THR  40 -10.071  -0.592  -0.640
  225    HB   THR  40           HB       THR  40 -11.215   1.777   0.839
  226    HG1  THR  40           HG1      THR  40  -9.775  -0.422   1.902
  227   1HG2  THR  40          1HG2      THR  40 -12.880   0.429   1.574
  228   2HG2  THR  40          2HG2      THR  40 -11.898  -1.032   1.474
  229   3HG2  THR  40          3HG2      THR  40 -12.578  -0.324   0.008
  230    H    GLY  41           H        GLY  41 -10.790  -0.662  -2.687
  231   1HA   GLY  41          1HA       GLY  41 -12.298  -0.129  -4.397
  232   2HA   GLY  41          2HA       GLY  41 -12.660   1.379  -3.566
  233    H    SER  42           H        SER  42  -9.446   0.223  -4.445
  234    HA   SER  42           HA       SER  42  -9.338   2.436  -6.380
  235   1HB   SER  42          1HB       SER  42  -6.827   1.729  -4.947
  236   2HB   SER  42          2HB       SER  42  -7.417   3.305  -5.466
  237    HG   SER  42           HG       SER  42  -8.363   1.816  -3.241
  238    H    THR  43           H        THR  43  -8.590   1.926  -8.297
  239    HA   THR  43           HA       THR  43  -7.580  -0.779  -8.656
  240    HB   THR  43           HB       THR  43  -8.611  -0.912 -10.588
  241    HG1  THR  43           HG1      THR  43  -8.782   0.705 -12.097
  242   1HG2  THR  43          1HG2      THR  43 -10.621  -0.531  -9.736
  243   2HG2  THR  43          2HG2      THR  43 -10.544   1.025 -10.562
  244   3HG2  THR  43          3HG2      THR  43 -10.072   0.903  -8.862
  245    H    ASP  44           H        ASP  44  -5.625  -0.398  -8.031
  246    HA   ASP  44           HA       ASP  44  -3.535  -0.301  -9.676
  247   1HB   ASP  44          1HB       ASP  44  -4.576   2.439  -9.396
  248   2HB   ASP  44          2HB       ASP  44  -2.840   2.289  -9.143
  249    H    CYS  45           H        CYS  45  -3.193  -1.670  -7.714
  250    HA   CYS  45           HA       CYS  45  -1.619  -0.181  -5.729
  251   1HB   CYS  45          1HB       CYS  45  -3.603  -2.367  -5.062
  252   2HB   CYS  45          2HB       CYS  45  -2.525  -1.567  -3.917
  253    H    ASN  46           H        ASN  46   0.382  -0.924  -5.750
  254    HA   ASN  46           HA       ASN  46   0.827  -3.767  -6.376
  255   1HB   ASN  46          1HB       ASN  46   1.724  -2.414  -8.159
  256   2HB   ASN  46          2HB       ASN  46   2.548  -1.357  -7.008
  257   1HD2  ASN  46          1HD2      ASN  46   4.525  -1.904  -6.282
  258   2HD2  ASN  46          2HD2      ASN  46   5.378  -3.331  -6.751
  259    H    THR  47           H        THR  47   1.746  -1.026  -4.382
  260    HA   THR  47           HA       THR  47   3.509  -2.684  -2.761
  261    HB   THR  47           HB       THR  47   4.021  -0.590  -1.568
  262    HG1  THR  47           HG1      THR  47   2.659   0.977  -1.677
  263   1HG2  THR  47          1HG2      THR  47   5.487   0.064  -3.098
  264   2HG2  THR  47          2HG2      THR  47   4.222   0.499  -4.247
  265   3HG2  THR  47          3HG2      THR  47   4.783  -1.170  -4.141
  266    H    ALA  48           H        ALA  48   0.268  -1.520  -2.776
  267    HA   ALA  48           HA       ALA  48  -0.285  -1.397  -0.038
  268   1HB   ALA  48          1HB       ALA  48  -2.550  -1.399  -0.614
  269   2HB   ALA  48          2HB       ALA  48  -2.276  -2.380  -2.056
  270   3HB   ALA  48          3HB       ALA  48  -1.745  -0.698  -2.019
  271    H    GLN  49           H        GLN  49  -1.077  -2.869   1.448
  272    HA   GLN  49           HA       GLN  49  -0.335  -5.640   0.956
  273   1HB   GLN  49          1HB       GLN  49  -1.323  -4.319   3.489
  274   2HB   GLN  49          2HB       GLN  49  -0.650  -5.939   3.361
  275   1HG   GLN  49          1HG       GLN  49   1.454  -5.197   3.388
  276   2HG   GLN  49          2HG       GLN  49   1.097  -3.854   2.304
  277   1HE2  GLN  49          1HE2      GLN  49   2.344  -4.434   5.165
  278   2HE2  GLN  49          2HE2      GLN  49   1.810  -3.056   6.059
  279    H    THR  50           H        THR  50  -2.969  -4.003   0.193
  280    HA   THR  50           HA       THR  50  -4.629  -6.246  -0.036
  281    HB   THR  50           HB       THR  50  -4.750  -5.796   2.450
  282    HG1  THR  50           HG1      THR  50  -7.258  -5.515   1.189
  283   1HG2  THR  50          1HG2      THR  50  -6.180  -4.061   3.259
  284   2HG2  THR  50          2HG2      THR  50  -6.450  -3.469   1.620
  285   3HG2  THR  50          3HG2      THR  50  -4.849  -3.343   2.351
  286    H    CYS  51           H        CYS  51  -6.908  -5.566  -0.731
  287    HA   CYS  51           HA       CYS  51  -7.386  -2.900  -1.541
  288   1HB   CYS  51          1HB       CYS  51  -7.159  -3.215  -3.993
  289   2HB   CYS  51          2HB       CYS  51  -5.613  -3.293  -3.141
  290    H    THR  52           H        THR  52  -9.475  -2.609  -2.060
  291    HA   THR  52           HA       THR  52 -11.105  -5.003  -2.600
  292    HB   THR  52           HB       THR  52 -11.356  -2.951  -0.535
  293    HG1  THR  52           HG1      THR  52 -12.236  -4.593   0.500
  294   1HG2  THR  52          1HG2      THR  52 -13.083  -2.036  -2.001
  295   2HG2  THR  52          2HG2      THR  52 -13.766  -2.755  -0.541
  296   3HG2  THR  52          3HG2      THR  52 -13.854  -3.621  -2.074
  297    H    ASN  53           H        ASN  53 -12.621  -4.850  -4.231
  298    HA   ASN  53           HA       ASN  53 -13.461  -4.118  -6.226
  299   1HB   ASN  53          1HB       ASN  53 -14.307  -2.382  -4.266
  300   2HB   ASN  53          2HB       ASN  53 -13.602  -1.285  -5.456
  301   1HD2  ASN  53          1HD2      ASN  53 -15.102  -0.486  -6.719
  302   2HD2  ASN  53          2HD2      ASN  53 -16.456  -1.340  -7.368
  303    H    SER  54           H        SER  54 -10.555  -3.982  -5.737
  304    HA   SER  54           HA       SER  54  -9.674  -1.729  -7.382
  305   1HB   SER  54          1HB       SER  54  -7.404  -2.514  -6.751
  306   2HB   SER  54          2HB       SER  54  -8.420  -2.209  -5.336
  307    HG   SER  54           HG       SER  54  -8.622  -4.349  -5.003
  308    H    LYS  55           H        LYS  55  -7.550  -2.625  -8.695
  309    HA   LYS  55           HA       LYS  55  -8.234  -5.045 -10.179
  310   1HB   LYS  55          1HB       LYS  55  -7.800  -2.359 -11.492
  311   2HB   LYS  55          2HB       LYS  55  -8.039  -3.886 -12.336
  312   1HG   LYS  55          1HG       LYS  55 -10.105  -2.766 -10.468
  313   2HG   LYS  55          2HG       LYS  55 -10.028  -2.308 -12.168
  314   1HD   LYS  55          1HD       LYS  55 -10.023  -4.868 -12.594
  315   2HD   LYS  55          2HD       LYS  55 -10.662  -4.966 -10.952
  316   1HE   LYS  55          1HE       LYS  55 -11.883  -3.156 -13.009
  317   2HE   LYS  55          2HE       LYS  55 -12.333  -4.858 -12.899
  318   1HZ   LYS  55          1HZ       LYS  55 -12.379  -3.380 -10.402
  319   2HZ   LYS  55          2HZ       LYS  55 -13.470  -4.522 -11.005
  320   3HZ   LYS  55          3HZ       LYS  55 -13.544  -2.919 -11.538
  321    H    ASP  56           H        ASP  56  -6.036  -3.727  -8.413
  322    HA   ASP  56           HA       ASP  56  -3.844  -4.886  -9.862
  323   1HB   ASP  56          1HB       ASP  56  -4.123  -1.962  -9.448
  324   2HB   ASP  56          2HB       ASP  56  -2.524  -2.660  -9.179
  325    H    CYS  57           H        CYS  57  -3.057  -6.209  -8.402
  326    HA   CYS  57           HA       CYS  57  -2.203  -5.225  -5.832
  327   1HB   CYS  57          1HB       CYS  57  -4.681  -6.679  -6.090
  328   2HB   CYS  57          2HB       CYS  57  -3.534  -7.591  -5.106
  329    H    PHE  58           H        PHE  58  -0.137  -5.757  -6.244
  330    HA   PHE  58           HA       PHE  58   0.481  -8.489  -7.089
  331   1HB   PHE  58          1HB       PHE  58   2.205  -6.009  -6.965
  332   2HB   PHE  58          2HB       PHE  58   2.766  -7.590  -7.499
  333    HD1  PHE  58           HD1      PHE  58  -0.184  -5.431  -8.196
  334    HD2  PHE  58           HD2      PHE  58   3.065  -7.729  -9.697
  335    HE1  PHE  58           HE1      PHE  58  -0.865  -4.888 -10.489
  336    HE2  PHE  58           HE2      PHE  58   2.392  -7.185 -11.992
  337    HZ   PHE  58           HZ       PHE  58   0.444  -5.766 -12.355
  338    H    GLU  59           H        GLU  59   0.529  -6.476  -4.313
  339    HA   GLU  59           HA       GLU  59   1.888  -8.600  -2.824
  340   1HB   GLU  59          1HB       GLU  59   3.525  -6.779  -3.374
  341   2HB   GLU  59          2HB       GLU  59   2.525  -5.671  -2.435
  342   1HG   GLU  59          1HG       GLU  59   3.006  -7.898  -0.790
  343   2HG   GLU  59          2HG       GLU  59   4.544  -7.492  -1.547
  344    H    ALA  60           H        ALA  60  -0.747  -8.522  -2.744
  345    HA   ALA  60           HA       ALA  60  -1.436  -7.039  -0.294
  346   1HB   ALA  60          1HB       ALA  60  -3.849  -7.637  -1.169
  347   2HB   ALA  60          2HB       ALA  60  -3.009  -7.717  -2.719
  348   3HB   ALA  60          3HB       ALA  60  -2.971  -6.230  -1.772
  349    H    ASN  61           H        ASN  61  -2.965  -8.081   1.163
  350    HA   ASN  61           HA       ASN  61  -2.536 -10.993   1.241
  351   1HB   ASN  61          1HB       ASN  61  -1.478  -9.823   3.100
  352   2HB   ASN  61          2HB       ASN  61  -3.010  -9.067   3.523
  353   1HD2  ASN  61          1HD2      ASN  61  -4.752 -10.482   4.198
  354   2HD2  ASN  61          2HD2      ASN  61  -4.373 -11.947   5.032
  355    H    THR  62           H        THR  62  -4.939  -8.430   1.491
  356    HA   THR  62           HA       THR  62  -7.012 -10.531   1.574
  357    HB   THR  62           HB       THR  62  -7.154  -7.744   2.739
  358    HG1  THR  62           HG1      THR  62  -7.316  -8.915   4.705
  359   1HG2  THR  62          1HG2      THR  62  -9.272  -9.419   1.916
  360   2HG2  THR  62          2HG2      THR  62  -9.351  -7.904   2.815
  361   3HG2  THR  62          3HG2      THR  62  -9.222  -9.436   3.678
  362    H    CYS  63           H        CYS  63  -7.639 -10.751  -0.478
  363    HA   CYS  63           HA       CYS  63  -8.221  -8.318  -2.030
  364   1HB   CYS  63          1HB       CYS  63  -7.406 -11.099  -2.835
  365   2HB   CYS  63          2HB       CYS  63  -8.214 -10.027  -3.982
  366    H    THR  64           H        THR  64 -10.308  -7.836  -1.609
  367    HA   THR  64           HA       THR  64 -12.294  -9.987  -1.936
  368    HB   THR  64           HB       THR  64 -13.738  -8.106  -0.705
  369    HG1  THR  64           HG1      THR  64 -12.414  -7.096   0.864
  370   1HG2  THR  64          1HG2      THR  64 -12.279  -9.252   1.421
  371   2HG2  THR  64          2HG2      THR  64 -12.409 -10.463   0.144
  372   3HG2  THR  64          3HG2      THR  64 -13.865  -9.712   0.800
  373    H    ASP  65           H        ASP  65 -13.256  -9.918  -3.847
  374    HA   ASP  65           HA       ASP  65 -14.303  -9.164  -5.718
  375   1HB   ASP  65          1HB       ASP  65 -14.662  -6.583  -4.176
  376   2HB   ASP  65          2HB       ASP  65 -15.587  -7.105  -5.588
  377    H    SER  66           H        SER  66 -11.624  -9.119  -5.907
  378    HA   SER  66           HA       SER  66 -11.136  -6.708  -7.513
  379   1HB   SER  66          1HB       SER  66  -8.953  -7.965  -5.853
  380   2HB   SER  66          2HB       SER  66  -8.961  -6.384  -6.645
  381    HG   SER  66           HG       SER  66  -9.325  -6.279  -4.361
  382    H    THR  67           H        THR  67  -8.975  -7.105  -8.813
  383    HA   THR  67           HA       THR  67  -8.821  -9.884  -9.727
  384    HB   THR  67           HB       THR  67 -10.410  -8.887 -11.232
  385    HG1  THR  67           HG1      THR  67  -9.334  -9.221 -13.144
  386   1HG2  THR  67          1HG2      THR  67  -8.517  -6.839 -12.220
  387   2HG2  THR  67          2HG2      THR  67  -9.432  -6.497 -10.752
  388   3HG2  THR  67          3HG2      THR  67 -10.279  -6.869 -12.253
  389    H    ASN  68           H        ASN  68  -6.895 -10.316 -11.058
  390    HA   ASN  68           HA       ASN  68  -4.649 -10.189 -11.445
  391   1HB   ASN  68          1HB       ASN  68  -4.702  -7.211 -11.058
  392   2HB   ASN  68          2HB       ASN  68  -3.752  -8.172 -12.195
  393   1HD2  ASN  68          1HD2      ASN  68  -5.829  -9.748 -13.232
  394   2HD2  ASN  68          2HD2      ASN  68  -6.859  -8.732 -14.175
  395    H    CYS  69           H        CYS  69  -5.539 -10.617  -8.777
  396    HA   CYS  69           HA       CYS  69  -3.822  -9.042  -7.061
  397   1HB   CYS  69          1HB       CYS  69  -5.940 -11.086  -6.657
  398   2HB   CYS  69          2HB       CYS  69  -4.709 -10.943  -5.396
  399    H    TYR  70           H        TYR  70  -1.930  -9.768  -8.381
  400    HA   TYR  70           HA       TYR  70  -0.966 -12.392  -8.346
  401   1HB   TYR  70          1HB       TYR  70   0.470  -9.746  -8.589
  402   2HB   TYR  70          2HB       TYR  70   1.272 -11.306  -8.782
  403    HD1  TYR  70           HD1      TYR  70   0.348  -8.729 -10.652
  404    HD2  TYR  70           HD2      TYR  70  -0.566 -12.873 -10.357
  405    HE1  TYR  70           HE1      TYR  70  -0.285  -8.752 -13.029
  406    HE2  TYR  70           HE2      TYR  70  -1.202 -12.909 -12.733
  407    HH   TYR  70           HH       TYR  70  -0.494 -11.363 -14.849
  408    H    LYS  71           H        LYS  71  -1.165 -13.274  -6.323
  409    HA   LYS  71           HA       LYS  71   0.016 -14.105  -4.492
  410   1HB   LYS  71          1HB       LYS  71   1.957 -12.569  -5.238
  411   2HB   LYS  71          2HB       LYS  71   1.322 -11.437  -4.044
  412   1HG   LYS  71          1HG       LYS  71   1.446 -13.654  -2.539
  413   2HG   LYS  71          2HG       LYS  71   2.757 -13.986  -3.673
  414   1HD   LYS  71          1HD       LYS  71   4.052 -12.304  -2.877
  415   2HD   LYS  71          2HD       LYS  71   2.670 -11.261  -2.533
  416   1HE   LYS  71          1HE       LYS  71   3.665 -13.587  -0.895
  417   2HE   LYS  71          2HE       LYS  71   3.686 -11.880  -0.453
  418   1HZ   LYS  71          1HZ       LYS  71   1.505 -13.792  -0.364
  419   2HZ   LYS  71          2HZ       LYS  71   1.091 -12.249  -0.919
  420   3HZ   LYS  71          3HZ       LYS  71   1.798 -12.436   0.606
  421    H    ALA  72           H        ALA  72  -2.295 -13.940  -3.905
  422    HA   ALA  72           HA       ALA  72  -2.579 -12.186  -1.566
  423   1HB   ALA  72          1HB       ALA  72  -5.152 -12.322  -2.437
  424   2HB   ALA  72          2HB       ALA  72  -4.271 -12.229  -3.962
  425   3HB   ALA  72          3HB       ALA  72  -4.058 -10.972  -2.743
  426    H    THR  73           H        THR  73  -3.168 -13.285   0.216
  427    HA   THR  73           HA       THR  73  -3.643 -16.106   0.033
  428    HB   THR  73           HB       THR  73  -2.362 -14.908   1.876
  429    HG1  THR  73           HG1      THR  73  -4.373 -16.813   2.404
  430   1HG2  THR  73          1HG2      THR  73  -3.348 -13.464   3.218
  431   2HG2  THR  73          2HG2      THR  73  -4.520 -14.691   3.697
  432   3HG2  THR  73          3HG2      THR  73  -4.851 -13.647   2.315
  433    H    ALA  74           H        ALA  74  -5.647 -13.296   0.305
  434    HA   ALA  74           HA       ALA  74  -8.002 -15.037   0.652
  435   1HB   ALA  74          1HB       ALA  74  -7.285 -13.100   2.373
  436   2HB   ALA  74          2HB       ALA  74  -8.959 -13.576   2.083
  437   3HB   ALA  74          3HB       ALA  74  -8.289 -12.166   1.264
  438    H    CYS  75           H        CYS  75  -8.689 -15.368  -1.395
  439    HA   CYS  75           HA       CYS  75  -9.374 -12.977  -2.957
  440   1HB   CYS  75          1HB       CYS  75  -7.591 -15.185  -3.711
  441   2HB   CYS  75          2HB       CYS  75  -8.828 -14.821  -4.916
  442    H    THR  76           H        THR  76 -11.514 -12.936  -2.999
  443    HA   THR  76           HA       THR  76 -12.975 -15.467  -3.345
  444    HB   THR  76           HB       THR  76 -13.522 -14.223  -1.295
  445    HG1  THR  76           HG1      THR  76 -15.656 -14.062  -3.149
  446   1HG2  THR  76          1HG2      THR  76 -14.070 -12.065  -1.166
  447   2HG2  THR  76          2HG2      THR  76 -14.993 -12.102  -2.669
  448   3HG2  THR  76          3HG2      THR  76 -13.238 -11.937  -2.716
  449    H    ASN  77           H        ASN  77 -13.319 -15.780  -5.458
  450    HA   ASN  77           HA       ASN  77 -14.041 -15.467  -7.593
  451   1HB   ASN  77          1HB       ASN  77 -15.708 -13.425  -6.130
  452   2HB   ASN  77          2HB       ASN  77 -15.859 -13.675  -7.872
  453   1HD2  ASN  77          1HD2      ASN  77 -16.691 -14.791  -4.771
  454   2HD2  ASN  77          2HD2      ASN  77 -17.578 -16.193  -5.254
  455    H    SER  78           H        SER  78 -11.649 -14.109  -6.694
  456    HA   SER  78           HA       SER  78 -11.672 -11.622  -8.240
  457   1HB   SER  78          1HB       SER  78  -9.650 -12.799  -6.320
  458   2HB   SER  78          2HB       SER  78  -9.372 -11.320  -7.249
  459    HG   SER  78           HG       SER  78 -10.247 -10.508  -5.479
  460    H    SER  79           H        SER  79 -10.253 -11.254  -9.962
  461    HA   SER  79           HA       SER  79  -9.416 -13.672 -11.340
  462   1HB   SER  79          1HB       SER  79  -8.777 -11.367 -12.871
  463   2HB   SER  79          2HB       SER  79 -10.057 -12.544 -13.158
  464    HG   SER  79           HG       SER  79 -10.902 -10.444 -12.933
  465    H    GLY  80           H        GLY  80  -7.310 -13.599 -12.553
  466   1HA   GLY  80          1HA       GLY  80  -5.021 -13.657 -12.406
  467   2HA   GLY  80          2HA       GLY  80  -5.166 -11.984 -11.887
  468    H    CYS  81           H        CYS  81  -6.666 -14.439  -9.963
  469    HA   CYS  81           HA       CYS  81  -4.413 -14.826  -8.216
  470   1HB   CYS  81          1HB       CYS  81  -4.992 -12.664  -7.410
  471   2HB   CYS  81          2HB       CYS  81  -6.714 -13.043  -7.427
  472    HA   PRO  82           HA       PRO  82  -6.635 -18.585  -7.480
  473   1HB   PRO  82          1HB       PRO  82  -5.396 -18.585  -4.791
  474   2HB   PRO  82          2HB       PRO  82  -5.282 -19.789  -6.084
  475   1HG   PRO  82          1HG       PRO  82  -3.222 -18.185  -5.488
  476   2HG   PRO  82          2HG       PRO  82  -3.572 -18.665  -7.159
  477   1HD   PRO  82          1HD       PRO  82  -4.137 -16.080  -5.768
  478   2HD   PRO  82          2HD       PRO  82  -3.592 -16.371  -7.433
  479    H    GLY  83           H        GLY  83  -7.392 -19.500  -4.909
  480   1HA   GLY  83          1HA       GLY  83  -9.110 -17.425  -3.791
  481   2HA   GLY  83          2HA       GLY  83  -9.921 -18.787  -4.548
  482    H    HIS  84           H        HIS  84  -6.897 -19.191  -2.865
  483    HA   HIS  84           HA       HIS  84  -6.329 -20.370  -1.005
  484   1HB   HIS  84          1HB       HIS  84  -7.731 -18.479   0.004
  485   2HB   HIS  84          2HB       HIS  84  -9.032 -19.659   0.125
  486    HD1  HIS  84           HD1      HIS  84  -5.484 -20.646   0.805
  487    HD2  HIS  84           HD2      HIS  84  -8.936 -19.700   2.915
  488    HE1  HIS  84           HE1      HIS  84  -5.018 -21.303   3.187
  489    HE2  HIS  84           HE2      HIS  84  -7.157 -20.816   4.424
  Start of MODEL   15
    1   1H    GLN   1          1H        GLN   1 -10.582  22.161  -1.882
    2   2H    GLN   1          2H        GLN   1 -12.078  22.236  -2.719
    3   3H    GLN   1          3H        GLN   1 -10.670  21.673  -3.523
    4    HA   GLN   1           HA       GLN   1 -11.822  20.363  -1.158
    5   1HB   GLN   1          1HB       GLN   1 -12.889  18.814  -2.716
    6   2HB   GLN   1          2HB       GLN   1 -13.466  20.453  -2.988
    7   1HG   GLN   1          1HG       GLN   1 -11.201  19.375  -4.606
    8   2HG   GLN   1          2HG       GLN   1 -12.863  18.943  -5.003
    9   1HE2  GLN   1          1HE2      GLN   1 -10.566  20.819  -6.040
   10   2HE2  GLN   1          2HE2      GLN   1 -11.439  22.234  -6.510
   11    H    CYS   2           H        CYS   2 -10.855  18.394  -0.691
   12    HA   CYS   2           HA       CYS   2  -8.225  18.004  -1.922
   13   1HB   CYS   2          1HB       CYS   2  -8.438  18.256   0.572
   14   2HB   CYS   2          2HB       CYS   2  -9.311  16.727   0.593
   15    H    THR   3           H        THR   3 -10.520  17.200  -3.377
   16    HA   THR   3           HA       THR   3  -9.933  14.348  -3.627
   17    HB   THR   3           HB       THR   3 -12.407  13.906  -3.935
   18    HG1  THR   3           HG1      THR   3 -13.818  15.415  -3.063
   19   1HG2  THR   3          1HG2      THR   3 -12.277  14.839  -1.167
   20   2HG2  THR   3          2HG2      THR   3 -10.948  13.788  -1.657
   21   3HG2  THR   3          3HG2      THR   3 -12.615  13.235  -1.816
   22    H    GLY   4           H        GLY   4 -11.769  17.089  -4.963
   23   1HA   GLY   4          1HA       GLY   4 -12.063  16.076  -7.563
   24   2HA   GLY   4          2HA       GLY   4 -12.097  17.783  -7.126
   25    H    GLY   5           H        GLY   5 -11.084  17.891  -9.328
   26   1HA   GLY   5          1HA       GLY   5  -9.182  18.632 -10.427
   27   2HA   GLY   5          2HA       GLY   5  -8.239  18.226  -9.000
   28    H    ALA   6           H        ALA   6  -6.771  17.539 -10.841
   29    HA   ALA   6           HA       ALA   6  -7.379  14.753 -11.596
   30   1HB   ALA   6          1HB       ALA   6  -7.060  16.700 -13.376
   31   2HB   ALA   6          2HB       ALA   6  -6.504  15.053 -13.674
   32   3HB   ALA   6          3HB       ALA   6  -5.363  16.285 -13.138
   33    H    ASP   7           H        ASP   7  -4.602  16.940 -11.104
   34    HA   ASP   7           HA       ASP   7  -3.077  14.660 -10.055
   35   1HB   ASP   7          1HB       ASP   7  -2.143  16.045 -11.957
   36   2HB   ASP   7          2HB       ASP   7  -2.002  17.382 -10.811
   37    H    CYS   8           H        CYS   8  -3.027  14.455  -7.925
   38    HA   CYS   8           HA       CYS   8  -3.758  16.619  -6.184
   39   1HB   CYS   8          1HB       CYS   8  -3.102  13.728  -5.854
   40   2HB   CYS   8          2HB       CYS   8  -2.966  14.776  -4.438
   41    H    THR   9           H        THR   9  -2.243  18.220  -6.247
   42    HA   THR   9           HA       THR   9   0.488  17.492  -5.410
   43    HB   THR   9           HB       THR   9  -0.005  20.140  -6.650
   44    HG1  THR   9           HG1      THR   9  -0.107  17.708  -8.097
   45   1HG2  THR   9          1HG2      THR   9   2.085  18.324  -7.643
   46   2HG2  THR   9          2HG2      THR   9   2.247  18.862  -5.972
   47   3HG2  THR   9          3HG2      THR   9   2.150  20.048  -7.274
   48    H    SER  10           H        SER  10  -2.346  19.243  -4.596
   49    HA   SER  10           HA       SER  10  -1.030  21.082  -2.802
   50   1HB   SER  10          1HB       SER  10  -3.591  21.360  -2.111
   51   2HB   SER  10          2HB       SER  10  -2.937  22.096  -3.574
   52    HG   SER  10           HG       SER  10  -3.866  20.537  -4.788
   53    H    CYS  11           H        CYS  11  -3.165  18.254  -2.473
   54    HA   CYS  11           HA       CYS  11  -2.964  18.228   0.385
   55   1HB   CYS  11          1HB       CYS  11  -3.999  16.154  -1.557
   56   2HB   CYS  11          2HB       CYS  11  -4.136  16.037   0.194
   57    H    THR  12           H        THR  12  -2.268  16.128   1.498
   58    HA   THR  12           HA       THR  12   0.048  14.886   0.221
   59    HB   THR  12           HB       THR  12   1.503  15.312   2.110
   60    HG1  THR  12           HG1      THR  12   0.482  15.599   3.921
   61   1HG2  THR  12          1HG2      THR  12   2.123  17.378   1.532
   62   2HG2  THR  12          2HG2      THR  12   0.525  18.057   1.840
   63   3HG2  THR  12          3HG2      THR  12   0.852  17.228   0.319
   64    H    GLY  13           H        GLY  13  -2.158  14.995   2.987
   65   1HA   GLY  13          1HA       GLY  13  -1.487  12.518   4.113
   66   2HA   GLY  13          2HA       GLY  13  -3.031  13.331   4.300
   67    H    ALA  14           H        ALA  14  -4.249  11.456   4.170
   68    HA   ALA  14           HA       ALA  14  -3.956   9.557   2.069
   69   1HB   ALA  14          1HB       ALA  14  -6.288   8.843   2.885
   70   2HB   ALA  14          2HB       ALA  14  -6.058  10.052   4.148
   71   3HB   ALA  14          3HB       ALA  14  -4.933   8.702   4.005
   72    H    CYS  15           H        CYS  15  -4.975   9.383   0.137
   73    HA   CYS  15           HA       CYS  15  -6.372  11.744  -0.824
   74   1HB   CYS  15          1HB       CYS  15  -5.727   9.279  -2.433
   75   2HB   CYS  15          2HB       CYS  15  -6.001  10.916  -3.014
   76    H    THR  16           H        THR  16  -8.395  11.676  -1.881
   77    HA   THR  16           HA       THR  16 -10.033   9.285  -1.461
   78    HB   THR  16           HB       THR  16 -11.121  12.006  -0.778
   79    HG1  THR  16           HG1      THR  16  -9.959  10.169   1.042
   80   1HG2  THR  16          1HG2      THR  16 -12.274  10.112   0.853
   81   2HG2  THR  16          2HG2      THR  16 -12.131   9.295  -0.702
   82   3HG2  THR  16          3HG2      THR  16 -12.991  10.830  -0.589
   83    H    GLY  17           H        GLY  17 -10.081   8.903  -3.661
   84   1HA   GLY  17          1HA       GLY  17 -11.236   9.034  -5.684
   85   2HA   GLY  17          2HA       GLY  17 -11.912  10.580  -5.165
   86    H    CYS  18           H        CYS  18  -8.506   9.762  -5.159
   87    HA   CYS  18           HA       CYS  18  -8.062  11.587  -7.423
   88   1HB   CYS  18          1HB       CYS  18  -7.613  12.599  -5.110
   89   2HB   CYS  18          2HB       CYS  18  -6.250  11.480  -5.013
   90    H    GLY  19           H        GLY  19  -7.124  10.482  -9.007
   91   1HA   GLY  19          1HA       GLY  19  -6.092   7.930  -8.875
   92   2HA   GLY  19          2HA       GLY  19  -5.668   9.096 -10.125
   93    H    ASN  20           H        ASN  20  -3.852  10.543  -9.686
   94    HA   ASN  20           HA       ASN  20  -1.708   9.091  -8.411
   95   1HB   ASN  20          1HB       ASN  20  -1.597  11.798  -9.749
   96   2HB   ASN  20          2HB       ASN  20  -0.241  10.732  -9.397
   97   1HD2  ASN  20          1HD2      ASN  20   0.319   9.228 -10.843
   98   2HD2  ASN  20          2HD2      ASN  20  -0.541   8.891 -12.303
   99    H    CYS  21           H        CYS  21  -0.556   9.667  -6.628
  100    HA   CYS  21           HA       CYS  21  -1.499  12.011  -5.114
  101   1HB   CYS  21          1HB       CYS  21  -0.839   9.257  -4.048
  102   2HB   CYS  21          2HB       CYS  21  -1.103  10.674  -3.031
  103    HA   PRO  22           HA       PRO  22   2.759  13.067  -4.739
  104   1HB   PRO  22          1HB       PRO  22   2.814  14.421  -2.394
  105   2HB   PRO  22          2HB       PRO  22   2.056  15.061  -3.854
  106   1HG   PRO  22          1HG       PRO  22   0.801  13.840  -1.447
  107   2HG   PRO  22          2HG       PRO  22   0.223  15.163  -2.469
  108   1HD   PRO  22          1HD       PRO  22  -0.669  12.546  -2.597
  109   2HD   PRO  22          2HD       PRO  22  -0.830  13.741  -3.896
  110    H    ASN  23           H        ASN  23   2.387  12.846  -1.254
  111    HA   ASN  23           HA       ASN  23   4.137  10.478  -1.266
  112   1HB   ASN  23          1HB       ASN  23   4.184  12.485   0.968
  113   2HB   ASN  23          2HB       ASN  23   5.429  11.330   0.482
  114   1HD2  ASN  23          1HD2      ASN  23   3.707  14.206  -0.635
  115   2HD2  ASN  23          2HD2      ASN  23   5.041  14.889  -1.494
  116    H    ALA  24           H        ALA  24   1.116  11.024  -0.929
  117    HA   ALA  24           HA       ALA  24   0.251  10.526   1.641
  118   1HB   ALA  24          1HB       ALA  24  -1.804   9.803   0.700
  119   2HB   ALA  24          2HB       ALA  24  -1.024   9.328  -0.809
  120   3HB   ALA  24          3HB       ALA  24  -1.156  11.035  -0.384
  121    H    VAL  25           H        VAL  25   0.178   8.808   2.973
  122    HA   VAL  25           HA       VAL  25   1.657   6.439   2.225
  123    HB   VAL  25           HB       VAL  25   1.973   7.421   4.452
  124   1HG1  VAL  25          1HG1      VAL  25   0.203   7.194   6.155
  125   2HG1  VAL  25          2HG1      VAL  25  -0.910   6.659   4.897
  126   3HG1  VAL  25          3HG1      VAL  25  -0.246   8.292   4.850
  127   1HG2  VAL  25          1HG2      VAL  25   0.653   4.760   4.859
  128   2HG2  VAL  25          2HG2      VAL  25   2.097   5.411   5.630
  129   3HG2  VAL  25          3HG2      VAL  25   2.152   4.909   3.941
  130    H    THR  26           H        THR  26  -1.666   7.368   2.800
  131    HA   THR  26           HA       THR  26  -2.505   4.665   1.988
  132    HB   THR  26           HB       THR  26  -4.653   5.619   3.411
  133    HG1  THR  26           HG1      THR  26  -3.235   7.340   4.160
  134   1HG2  THR  26          1HG2      THR  26  -3.729   4.196   5.322
  135   2HG2  THR  26          2HG2      THR  26  -2.393   3.839   4.227
  136   3HG2  THR  26          3HG2      THR  26  -4.042   3.410   3.775
  137    H    CYS  27           H        CYS  27  -4.345   4.533   0.660
  138    HA   CYS  27           HA       CYS  27  -5.263   7.095  -0.465
  139   1HB   CYS  27          1HB       CYS  27  -4.570   4.571  -1.983
  140   2HB   CYS  27          2HB       CYS  27  -5.374   5.974  -2.693
  141    H    THR  28           H        THR  28  -7.394   7.343  -0.533
  142    HA   THR  28           HA       THR  28  -9.087   5.035   0.093
  143    HB   THR  28           HB       THR  28  -9.955   7.921  -0.021
  144    HG1  THR  28           HG1      THR  28  -8.709   6.510   2.084
  145   1HG2  THR  28          1HG2      THR  28 -11.143   5.414   0.973
  146   2HG2  THR  28          2HG2      THR  28 -11.909   6.848   0.289
  147   3HG2  THR  28          3HG2      THR  28 -11.368   6.853   1.968
  148    H    ASN  29           H        ASN  29  -9.129   4.065  -1.948
  149    HA   ASN  29           HA       ASN  29 -10.185   3.556  -3.862
  150   1HB   ASN  29          1HB       ASN  29 -11.293   6.359  -4.020
  151   2HB   ASN  29          2HB       ASN  29 -11.930   4.887  -4.758
  152   1HD2  ASN  29          1HD2      ASN  29 -12.178   7.006  -2.190
  153   2HD2  ASN  29          2HD2      ASN  29 -13.172   6.048  -1.152
  154    H    SER  30           H        SER  30 -10.516   5.587  -5.948
  155    HA   SER  30           HA       SER  30  -9.357   6.801  -7.522
  156   1HB   SER  30          1HB       SER  30  -6.873   6.377  -5.847
  157   2HB   SER  30          2HB       SER  30  -7.084   7.531  -7.158
  158    HG   SER  30           HG       SER  30  -8.733   7.582  -4.867
  159    H    GLN  31           H        GLN  31  -7.317   6.417  -9.011
  160    HA   GLN  31           HA       GLN  31  -6.787   3.549  -9.270
  161   1HB   GLN  31          1HB       GLN  31  -7.134   4.070 -11.858
  162   2HB   GLN  31          2HB       GLN  31  -8.456   3.527 -10.825
  163   1HG   GLN  31          1HG       GLN  31  -8.059   6.438 -10.933
  164   2HG   GLN  31          2HG       GLN  31  -8.556   5.685 -12.447
  165   1HE2  GLN  31          1HE2      GLN  31  -9.596   6.965  -9.556
  166   2HE2  GLN  31          2HE2      GLN  31 -11.212   6.354  -9.556
  167    H    HIS  32           H        HIS  32  -4.827   4.946  -8.316
  168    HA   HIS  32           HA       HIS  32  -2.772   4.751 -10.211
  169   1HB   HIS  32          1HB       HIS  32  -4.185   7.238 -10.298
  170   2HB   HIS  32          2HB       HIS  32  -2.549   7.536  -9.700
  171    HD1  HIS  32           HD1      HIS  32  -3.362   8.614 -12.433
  172    HD2  HIS  32           HD2      HIS  32  -1.578   4.905 -11.864
  173    HE1  HIS  32           HE1      HIS  32  -2.291   8.038 -14.634
  174    HE2  HIS  32           HE2      HIS  32  -1.299   5.747 -14.294
  175    H    CYS  33           H        CYS  33  -3.381   4.064  -7.447
  176    HA   CYS  33           HA       CYS  33  -1.192   5.485  -6.080
  177   1HB   CYS  33          1HB       CYS  33  -3.792   4.404  -5.137
  178   2HB   CYS  33          2HB       CYS  33  -2.418   4.233  -4.042
  179    H    VAL  34           H        VAL  34   0.136   3.973  -7.429
  180    HA   VAL  34           HA       VAL  34   0.165   1.186  -6.838
  181    HB   VAL  34           HB       VAL  34   1.052   2.149  -8.950
  182   1HG1  VAL  34          1HG1      VAL  34   3.350   3.100  -8.911
  183   2HG1  VAL  34          2HG1      VAL  34   3.262   3.149  -7.149
  184   3HG1  VAL  34          3HG1      VAL  34   2.152   4.122  -8.117
  185   1HG2  VAL  34          1HG2      VAL  34   1.687  -0.106  -8.147
  186   2HG2  VAL  34          2HG2      VAL  34   3.114   0.599  -7.389
  187   3HG2  VAL  34          3HG2      VAL  34   2.931   0.651  -9.143
  188    H    LYS  35           H        LYS  35   1.855   3.985  -5.587
  189    HA   LYS  35           HA       LYS  35   3.508   2.289  -3.881
  190   1HB   LYS  35          1HB       LYS  35   4.924   4.132  -3.593
  191   2HB   LYS  35          2HB       LYS  35   4.420   4.233  -5.268
  192   1HG   LYS  35          1HG       LYS  35   2.558   5.728  -3.762
  193   2HG   LYS  35          2HG       LYS  35   4.170   6.177  -3.199
  194   1HD   LYS  35          1HD       LYS  35   4.811   6.487  -5.610
  195   2HD   LYS  35          2HD       LYS  35   3.107   6.278  -6.017
  196   1HE   LYS  35          1HE       LYS  35   3.372   8.591  -5.888
  197   2HE   LYS  35          2HE       LYS  35   2.677   8.158  -4.327
  198   1HZ   LYS  35          1HZ       LYS  35   5.557   8.643  -4.864
  199   2HZ   LYS  35          2HZ       LYS  35   4.895   8.221  -3.366
  200   3HZ   LYS  35          3HZ       LYS  35   4.507   9.708  -4.074
  201    H    ALA  36           H        ALA  36   0.690   2.480  -3.370
  202    HA   ALA  36           HA       ALA  36   0.599   4.047  -0.885
  203   1HB   ALA  36          1HB       ALA  36  -1.665   2.793  -2.434
  204   2HB   ALA  36          2HB       ALA  36  -1.186   4.489  -2.500
  205   3HB   ALA  36          3HB       ALA  36  -1.823   3.810  -1.001
  206    H    ASN  37           H        ASN  37   0.503   3.090   1.059
  207    HA   ASN  37           HA       ASN  37   1.103   0.366   1.373
  208   1HB   ASN  37          1HB       ASN  37  -0.107   2.224   3.432
  209   2HB   ASN  37          2HB       ASN  37   0.773   0.734   3.755
  210   1HD2  ASN  37          1HD2      ASN  37   2.207   1.946   5.057
  211   2HD2  ASN  37          2HD2      ASN  37   3.457   2.904   4.346
  212    H    THR  38           H        THR  38  -1.946   2.136   1.700
  213    HA   THR  38           HA       THR  38  -3.374  -0.410   1.410
  214    HB   THR  38           HB       THR  38  -4.630   1.604   3.184
  215    HG1  THR  38           HG1      THR  38  -2.507   1.588   3.975
  216   1HG2  THR  38          1HG2      THR  38  -4.330  -1.225   3.961
  217   2HG2  THR  38          2HG2      THR  38  -5.330  -0.884   2.548
  218   3HG2  THR  38          3HG2      THR  38  -5.716  -0.144   4.101
  219    H    CYS  39           H        CYS  39  -4.886  -0.336  -0.131
  220    HA   CYS  39           HA       CYS  39  -6.060   2.256  -0.834
  221   1HB   CYS  39          1HB       CYS  39  -5.871   1.392  -3.296
  222   2HB   CYS  39          2HB       CYS  39  -4.491   2.184  -2.533
  223    H    THR  40           H        THR  40  -8.097   1.852  -0.174
  224    HA   THR  40           HA       THR  40  -9.397  -0.652  -0.935
  225    HB   THR  40           HB       THR  40 -10.863   1.483   0.535
  226    HG1  THR  40           HG1      THR  40  -9.727   1.279   2.332
  227   1HG2  THR  40          1HG2      THR  40 -11.712  -0.882   0.018
  228   2HG2  THR  40          2HG2      THR  40 -11.918  -0.248   1.650
  229   3HG2  THR  40          3HG2      THR  40 -10.622  -1.393   1.306
  230    H    GLY  41           H        GLY  41 -10.925  -0.800  -2.503
  231   1HA   GLY  41          1HA       GLY  41 -12.206  -0.183  -4.318
  232   2HA   GLY  41          2HA       GLY  41 -12.571   1.275  -3.413
  233    H    SER  42           H        SER  42  -9.466   0.130  -4.649
  234    HA   SER  42           HA       SER  42  -9.448   2.401  -6.498
  235   1HB   SER  42          1HB       SER  42  -6.888   1.748  -5.107
  236   2HB   SER  42          2HB       SER  42  -7.482   3.305  -5.676
  237    HG   SER  42           HG       SER  42  -8.197   1.908  -3.319
  238    H    THR  43           H        THR  43  -6.815   1.928  -7.443
  239    HA   THR  43           HA       THR  43  -6.771  -0.902  -8.108
  240    HB   THR  43           HB       THR  43  -7.154  -0.730 -10.325
  241    HG1  THR  43           HG1      THR  43  -6.581   1.093 -11.575
  242   1HG2  THR  43          1HG2      THR  43  -8.499   1.732  -9.267
  243   2HG2  THR  43          2HG2      THR  43  -9.191   0.138  -9.568
  244   3HG2  THR  43          3HG2      THR  43  -8.708   1.160 -10.924
  245    H    ASP  44           H        ASP  44  -4.778  -0.019 -10.353
  246    HA   ASP  44           HA       ASP  44  -2.438  -0.504 -10.134
  247   1HB   ASP  44          1HB       ASP  44  -3.365   2.176 -10.466
  248   2HB   ASP  44          2HB       ASP  44  -1.854   2.218  -9.564
  249    H    CYS  45           H        CYS  45  -2.314  -1.744  -8.133
  250    HA   CYS  45           HA       CYS  45  -0.933  -0.247  -6.028
  251   1HB   CYS  45          1HB       CYS  45  -3.398  -1.924  -5.754
  252   2HB   CYS  45          2HB       CYS  45  -2.246  -1.838  -4.411
  253    H    ASN  46           H        ASN  46   1.050  -1.132  -6.357
  254    HA   ASN  46           HA       ASN  46   1.258  -4.059  -6.458
  255   1HB   ASN  46          1HB       ASN  46   2.336  -2.757  -8.281
  256   2HB   ASN  46          2HB       ASN  46   3.377  -1.990  -7.078
  257   1HD2  ASN  46          1HD2      ASN  46   5.107  -3.074  -6.292
  258   2HD2  ASN  46          2HD2      ASN  46   5.604  -4.633  -6.850
  259    H    THR  47           H        THR  47   2.103  -1.269  -4.542
  260    HA   THR  47           HA       THR  47   3.811  -2.868  -2.800
  261    HB   THR  47           HB       THR  47   4.315  -0.455  -3.558
  262    HG1  THR  47           HG1      THR  47   5.316  -0.050  -1.555
  263   1HG2  THR  47          1HG2      THR  47   3.502   1.322  -2.169
  264   2HG2  THR  47          2HG2      THR  47   2.504   0.198  -1.246
  265   3HG2  THR  47          3HG2      THR  47   2.134   0.521  -2.939
  266    H    ALA  48           H        ALA  48   0.624  -1.458  -2.875
  267    HA   ALA  48           HA       ALA  48  -0.026  -1.373  -0.187
  268   1HB   ALA  48          1HB       ALA  48  -1.398  -0.726  -2.297
  269   2HB   ALA  48          2HB       ALA  48  -2.237  -1.236  -0.831
  270   3HB   ALA  48          3HB       ALA  48  -2.029  -2.368  -2.167
  271    H    GLN  49           H        GLN  49  -0.656  -2.820   1.341
  272    HA   GLN  49           HA       GLN  49  -0.032  -5.598   0.855
  273   1HB   GLN  49          1HB       GLN  49  -0.350  -5.893   3.245
  274   2HB   GLN  49          2HB       GLN  49   0.664  -4.489   2.940
  275   1HG   GLN  49          1HG       GLN  49  -0.788  -3.084   3.884
  276   2HG   GLN  49          2HG       GLN  49  -2.181  -3.862   3.133
  277   1HE2  GLN  49          1HE2      GLN  49  -0.234  -3.593   5.939
  278   2HE2  GLN  49          2HE2      GLN  49  -1.131  -4.677   6.941
  279    H    THR  50           H        THR  50  -2.714  -3.831   0.248
  280    HA   THR  50           HA       THR  50  -4.376  -6.055  -0.160
  281    HB   THR  50           HB       THR  50  -4.418  -5.738   2.404
  282    HG1  THR  50           HG1      THR  50  -6.886  -5.732   1.016
  283   1HG2  THR  50          1HG2      THR  50  -4.804  -3.273   2.316
  284   2HG2  THR  50          2HG2      THR  50  -5.943  -4.177   3.315
  285   3HG2  THR  50          3HG2      THR  50  -6.424  -3.619   1.712
  286    H    CYS  51           H        CYS  51  -6.572  -5.385  -0.928
  287    HA   CYS  51           HA       CYS  51  -7.264  -2.700  -1.331
  288   1HB   CYS  51          1HB       CYS  51  -6.817  -2.945  -3.970
  289   2HB   CYS  51          2HB       CYS  51  -5.679  -2.176  -2.866
  290    H    THR  52           H        THR  52  -9.374  -2.759  -1.558
  291    HA   THR  52           HA       THR  52 -10.639  -5.107  -2.749
  292    HB   THR  52           HB       THR  52 -12.629  -3.417  -1.777
  293    HG1  THR  52           HG1      THR  52 -11.870  -2.923   0.325
  294   1HG2  THR  52          1HG2      THR  52 -11.982  -5.993  -1.416
  295   2HG2  THR  52          2HG2      THR  52 -13.181  -5.137  -0.447
  296   3HG2  THR  52          3HG2      THR  52 -11.537  -5.336   0.158
  297    H    ASN  53           H        ASN  53 -12.020  -4.959  -4.511
  298    HA   ASN  53           HA       ASN  53 -12.843  -4.146  -6.472
  299   1HB   ASN  53          1HB       ASN  53 -13.441  -2.194  -4.499
  300   2HB   ASN  53          2HB       ASN  53 -12.935  -1.327  -5.952
  301   1HD2  ASN  53          1HD2      ASN  53 -15.577  -1.871  -4.522
  302   2HD2  ASN  53          2HD2      ASN  53 -16.634  -2.359  -5.797
  303    H    SER  54           H        SER  54  -9.932  -4.180  -5.905
  304    HA   SER  54           HA       SER  54  -8.926  -1.981  -7.553
  305   1HB   SER  54          1HB       SER  54  -7.826  -3.727  -5.486
  306   2HB   SER  54          2HB       SER  54  -6.769  -3.611  -6.898
  307    HG   SER  54           HG       SER  54  -7.796  -1.469  -5.344
  308    H    LYS  55           H        LYS  55  -7.047  -2.730  -9.061
  309    HA   LYS  55           HA       LYS  55  -7.693  -5.232 -10.428
  310   1HB   LYS  55          1HB       LYS  55  -7.476  -2.584 -11.873
  311   2HB   LYS  55          2HB       LYS  55  -7.750  -4.156 -12.614
  312   1HG   LYS  55          1HG       LYS  55  -9.922  -3.756 -12.474
  313   2HG   LYS  55          2HG       LYS  55  -9.777  -3.890 -10.721
  314   1HD   LYS  55          1HD       LYS  55 -10.784  -1.812 -11.024
  315   2HD   LYS  55          2HD       LYS  55  -9.079  -1.412 -10.805
  316   1HE   LYS  55          1HE       LYS  55 -10.351  -1.778 -13.509
  317   2HE   LYS  55          2HE       LYS  55 -10.268  -0.219 -12.690
  318   1HZ   LYS  55          1HZ       LYS  55  -7.775  -0.706 -12.547
  319   2HZ   LYS  55          2HZ       LYS  55  -8.405  -0.240 -14.046
  320   3HZ   LYS  55          3HZ       LYS  55  -8.059  -1.868 -13.745
  321    H    ASP  56           H        ASP  56  -5.443  -3.956  -8.795
  322    HA   ASP  56           HA       ASP  56  -3.320  -4.908 -10.520
  323   1HB   ASP  56          1HB       ASP  56  -3.565  -2.084  -9.597
  324   2HB   ASP  56          2HB       ASP  56  -1.958  -2.806  -9.744
  325    H    CYS  57           H        CYS  57  -4.688  -5.588  -7.918
  326    HA   CYS  57           HA       CYS  57  -2.831  -5.216  -5.812
  327   1HB   CYS  57          1HB       CYS  57  -4.960  -7.338  -6.187
  328   2HB   CYS  57          2HB       CYS  57  -4.102  -7.022  -4.679
  329    H    PHE  58           H        PHE  58  -0.902  -5.746  -7.186
  330    HA   PHE  58           HA       PHE  58  -0.434  -8.479  -7.895
  331   1HB   PHE  58          1HB       PHE  58   1.609  -6.268  -7.652
  332   2HB   PHE  58          2HB       PHE  58   1.747  -7.749  -8.594
  333    HD1  PHE  58           HD1      PHE  58  -0.514  -7.993 -10.156
  334    HD2  PHE  58           HD2      PHE  58   1.456  -4.441  -8.901
  335    HE1  PHE  58           HE1      PHE  58  -1.379  -6.817 -12.131
  336    HE2  PHE  58           HE2      PHE  58   0.592  -3.259 -10.869
  337    HZ   PHE  58           HZ       PHE  58  -0.807  -4.464 -12.460
  338    H    GLU  59           H        GLU  59   0.138  -6.541  -5.064
  339    HA   GLU  59           HA       GLU  59   1.264  -8.903  -3.749
  340   1HB   GLU  59          1HB       GLU  59   3.015  -7.105  -4.530
  341   2HB   GLU  59          2HB       GLU  59   2.445  -6.227  -3.110
  342   1HG   GLU  59          1HG       GLU  59   2.900  -8.478  -1.883
  343   2HG   GLU  59          2HG       GLU  59   3.927  -8.810  -3.276
  344    H    ALA  60           H        ALA  60  -1.194  -8.612  -3.252
  345    HA   ALA  60           HA       ALA  60  -1.394  -7.084  -0.739
  346   1HB   ALA  60          1HB       ALA  60  -3.063  -6.974  -3.094
  347   2HB   ALA  60          2HB       ALA  60  -3.033  -5.917  -1.684
  348   3HB   ALA  60          3HB       ALA  60  -3.997  -7.394  -1.658
  349    H    ASN  61           H        ASN  61  -2.558  -8.028   0.952
  350    HA   ASN  61           HA       ASN  61  -2.535 -10.910   0.941
  351   1HB   ASN  61          1HB       ASN  61  -3.289  -8.923   3.092
  352   2HB   ASN  61          2HB       ASN  61  -3.195 -10.666   3.330
  353   1HD2  ASN  61          1HD2      ASN  61  -1.694  -9.490   4.999
  354   2HD2  ASN  61          2HD2      ASN  61  -0.027  -9.451   4.547
  355    H    THR  62           H        THR  62  -4.957  -8.345   1.005
  356    HA   THR  62           HA       THR  62  -7.056 -10.407   0.887
  357    HB   THR  62           HB       THR  62  -7.884  -7.615   1.331
  358    HG1  THR  62           HG1      THR  62  -7.063  -7.431   3.334
  359   1HG2  THR  62          1HG2      THR  62  -9.286  -9.753   1.544
  360   2HG2  THR  62          2HG2      THR  62  -9.442  -8.512   2.787
  361   3HG2  THR  62          3HG2      THR  62  -8.472  -9.953   3.095
  362    H    CYS  63           H        CYS  63  -8.002 -10.731  -0.997
  363    HA   CYS  63           HA       CYS  63  -8.053  -8.528  -2.952
  364   1HB   CYS  63          1HB       CYS  63  -6.580 -10.783  -3.274
  365   2HB   CYS  63          2HB       CYS  63  -8.104 -11.298  -4.001
  366    H    THR  64           H        THR  64 -10.149  -8.226  -1.718
  367    HA   THR  64           HA       THR  64 -12.249 -10.088  -2.528
  368    HB   THR  64           HB       THR  64 -13.514  -8.124  -1.096
  369    HG1  THR  64           HG1      THR  64 -10.964  -8.469   0.089
  370   1HG2  THR  64          1HG2      THR  64 -13.017  -9.651   0.933
  371   2HG2  THR  64          2HG2      THR  64 -12.261 -10.699  -0.268
  372   3HG2  THR  64          3HG2      THR  64 -13.965 -10.273  -0.417
  373    H    ASP  65           H        ASP  65 -13.640  -9.686  -4.125
  374    HA   ASP  65           HA       ASP  65 -14.594  -8.686  -5.932
  375   1HB   ASP  65          1HB       ASP  65 -14.693  -6.637  -3.777
  376   2HB   ASP  65          2HB       ASP  65 -15.071  -6.102  -5.417
  377    H    SER  66           H        SER  66 -11.612  -8.616  -5.626
  378    HA   SER  66           HA       SER  66 -11.081  -6.383  -7.476
  379   1HB   SER  66          1HB       SER  66  -9.962  -6.082  -5.291
  380   2HB   SER  66          2HB       SER  66  -9.151  -7.640  -5.505
  381    HG   SER  66           HG       SER  66  -7.709  -6.616  -6.618
  382    H    THR  67           H        THR  67  -9.565  -6.766  -9.161
  383    HA   THR  67           HA       THR  67  -9.312  -9.614  -9.858
  384    HB   THR  67           HB       THR  67 -10.583  -8.799 -11.582
  385    HG1  THR  67           HG1      THR  67  -9.200  -8.346 -13.356
  386   1HG2  THR  67          1HG2      THR  67  -9.122  -6.176 -11.458
  387   2HG2  THR  67          2HG2      THR  67 -10.745  -6.502 -10.850
  388   3HG2  THR  67          3HG2      THR  67 -10.417  -6.588 -12.582
  389    H    ASN  68           H        ASN  68  -7.416 -10.212 -11.150
  390    HA   ASN  68           HA       ASN  68  -5.165 -10.364 -11.452
  391   1HB   ASN  68          1HB       ASN  68  -5.296  -7.356 -11.134
  392   2HB   ASN  68          2HB       ASN  68  -3.874  -8.248 -11.681
  393   1HD2  ASN  68          1HD2      ASN  68  -4.005  -6.963 -13.597
  394   2HD2  ASN  68          2HD2      ASN  68  -5.107  -7.394 -14.856
  395    H    CYS  69           H        CYS  69  -4.695 -11.536  -9.619
  396    HA   CYS  69           HA       CYS  69  -3.311 -10.061  -7.519
  397   1HB   CYS  69          1HB       CYS  69  -5.876 -11.322  -7.169
  398   2HB   CYS  69          2HB       CYS  69  -4.670 -12.143  -6.177
  399    H    TYR  70           H        TYR  70  -1.347 -10.864  -8.153
  400    HA   TYR  70           HA       TYR  70  -1.035 -13.768  -8.351
  401   1HB   TYR  70          1HB       TYR  70   1.108 -11.726  -8.913
  402   2HB   TYR  70          2HB       TYR  70   0.988 -13.383  -9.508
  403    HD1  TYR  70           HD1      TYR  70  -1.496 -13.703 -10.741
  404    HD2  TYR  70           HD2      TYR  70   0.858 -10.162 -10.577
  405    HE1  TYR  70           HE1      TYR  70  -2.587 -12.889 -12.789
  406    HE2  TYR  70           HE2      TYR  70  -0.228  -9.339 -12.624
  407    HH   TYR  70           HH       TYR  70  -1.421 -10.237 -14.566
  408    H    LYS  71           H        LYS  71  -1.408 -12.341  -5.788
  409    HA   LYS  71           HA       LYS  71   0.449 -13.749  -4.237
  410   1HB   LYS  71          1HB       LYS  71   2.038 -12.063  -5.096
  411   2HB   LYS  71          2HB       LYS  71   1.024 -10.784  -4.429
  412   1HG   LYS  71          1HG       LYS  71   2.987 -11.290  -3.036
  413   2HG   LYS  71          2HG       LYS  71   1.461 -11.541  -2.188
  414   1HD   LYS  71          1HD       LYS  71   2.922 -13.370  -1.670
  415   2HD   LYS  71          2HD       LYS  71   1.639 -13.969  -2.720
  416   1HE   LYS  71          1HE       LYS  71   3.499 -13.255  -4.552
  417   2HE   LYS  71          2HE       LYS  71   4.533 -13.726  -3.204
  418   1HZ   LYS  71          1HZ       LYS  71   3.884 -15.882  -3.335
  419   2HZ   LYS  71          2HZ       LYS  71   3.667 -15.464  -4.960
  420   3HZ   LYS  71          3HZ       LYS  71   2.337 -15.517  -3.916
  421    H    ALA  72           H        ALA  72  -2.002 -13.949  -3.768
  422    HA   ALA  72           HA       ALA  72  -2.543 -12.291  -1.413
  423   1HB   ALA  72          1HB       ALA  72  -4.220 -12.503  -3.846
  424   2HB   ALA  72          2HB       ALA  72  -3.998 -11.151  -2.734
  425   3HB   ALA  72          3HB       ALA  72  -5.048 -12.496  -2.289
  426    H    THR  73           H        THR  73  -3.365 -13.393   0.283
  427    HA   THR  73           HA       THR  73  -3.621 -16.273   0.003
  428    HB   THR  73           HB       THR  73  -2.316 -15.565   1.868
  429    HG1  THR  73           HG1      THR  73  -3.397 -17.215   2.665
  430   1HG2  THR  73          1HG2      THR  73  -2.754 -13.434   2.492
  431   2HG2  THR  73          2HG2      THR  73  -3.678 -14.281   3.734
  432   3HG2  THR  73          3HG2      THR  73  -4.499 -13.621   2.320
  433    H    ALA  74           H        ALA  74  -5.628 -13.478   0.561
  434    HA   ALA  74           HA       ALA  74  -7.958 -15.177   1.084
  435   1HB   ALA  74          1HB       ALA  74  -7.256 -12.370   1.675
  436   2HB   ALA  74          2HB       ALA  74  -8.169 -13.540   2.629
  437   3HB   ALA  74          3HB       ALA  74  -8.948 -12.691   1.294
  438    H    CYS  75           H        CYS  75  -8.602 -15.970  -0.863
  439    HA   CYS  75           HA       CYS  75  -9.231 -13.999  -2.962
  440   1HB   CYS  75          1HB       CYS  75  -7.539 -15.454  -3.806
  441   2HB   CYS  75          2HB       CYS  75  -8.358 -16.881  -3.182
  442    H    THR  76           H        THR  76 -11.329 -13.545  -2.476
  443    HA   THR  76           HA       THR  76 -13.217 -15.797  -2.648
  444    HB   THR  76           HB       THR  76 -13.504 -13.373  -0.862
  445    HG1  THR  76           HG1      THR  76 -12.820 -14.595   0.730
  446   1HG2  THR  76          1HG2      THR  76 -15.676 -13.872  -0.972
  447   2HG2  THR  76          2HG2      THR  76 -15.247 -15.225   0.073
  448   3HG2  THR  76          3HG2      THR  76 -15.379 -15.465  -1.668
  449    H    ASN  77           H        ASN  77 -13.928 -15.524  -4.698
  450    HA   ASN  77           HA       ASN  77 -15.039 -14.631  -6.470
  451   1HB   ASN  77          1HB       ASN  77 -16.061 -12.560  -4.515
  452   2HB   ASN  77          2HB       ASN  77 -16.806 -13.050  -6.039
  453   1HD2  ASN  77          1HD2      ASN  77 -18.479 -13.153  -4.101
  454   2HD2  ASN  77          2HD2      ASN  77 -18.729 -14.749  -3.490
  455    H    SER  78           H        SER  78 -12.577 -14.022  -6.741
  456    HA   SER  78           HA       SER  78 -12.566 -11.252  -7.658
  457   1HB   SER  78          1HB       SER  78 -10.898 -12.327  -5.474
  458   2HB   SER  78          2HB       SER  78 -10.013 -11.424  -6.710
  459    HG   SER  78           HG       SER  78 -12.350 -10.453  -5.432
  460    H    SER  79           H        SER  79 -10.874 -10.814  -9.238
  461    HA   SER  79           HA       SER  79 -10.295 -13.199 -10.811
  462   1HB   SER  79          1HB       SER  79 -11.141 -10.671 -11.515
  463   2HB   SER  79          2HB       SER  79  -9.428 -10.645 -11.935
  464    HG   SER  79           HG       SER  79  -9.816 -12.609 -13.111
  465    H    GLY  80           H        GLY  80  -8.273 -13.862 -11.424
  466   1HA   GLY  80          1HA       GLY  80  -5.963 -13.931 -11.494
  467   2HA   GLY  80          2HA       GLY  80  -5.928 -12.338 -10.749
  468    H    CYS  81           H        CYS  81  -7.733 -13.534  -8.541
  469    HA   CYS  81           HA       CYS  81  -5.530 -14.304  -6.855
  470   1HB   CYS  81          1HB       CYS  81  -7.094 -14.184  -5.031
  471   2HB   CYS  81          2HB       CYS  81  -7.368 -12.799  -6.086
  472    HA   PRO  82           HA       PRO  82  -5.793 -18.674  -7.136
  473   1HB   PRO  82          1HB       PRO  82  -5.534 -18.824  -4.191
  474   2HB   PRO  82          2HB       PRO  82  -4.489 -19.487  -5.455
  475   1HG   PRO  82          1HG       PRO  82  -3.749 -17.358  -4.009
  476   2HG   PRO  82          2HG       PRO  82  -3.337 -17.504  -5.727
  477   1HD   PRO  82          1HD       PRO  82  -5.469 -15.862  -4.421
  478   2HD   PRO  82          2HD       PRO  82  -4.408 -15.456  -5.785
  479    H    GLY  83           H        GLY  83  -7.182 -18.239  -3.896
  480   1HA   GLY  83          1HA       GLY  83  -9.570 -18.324  -3.482
  481   2HA   GLY  83          2HA       GLY  83  -9.731 -19.294  -4.938
  482    H    HIS  84           H        HIS  84  -7.312 -20.876  -4.171
  483    HA   HIS  84           HA       HIS  84  -8.593 -22.534  -2.099
  484   1HB   HIS  84          1HB       HIS  84  -7.211 -24.408  -3.220
  485   2HB   HIS  84          2HB       HIS  84  -8.657 -23.836  -4.044
  486    HD1  HIS  84           HD1      HIS  84  -4.917 -23.799  -4.279
  487    HD2  HIS  84           HD2      HIS  84  -8.214 -22.553  -6.480
  488    HE1  HIS  84           HE1      HIS  84  -4.017 -23.169  -6.541
  489    HE2  HIS  84           HE2      HIS  84  -6.037 -22.474  -7.875
  Start of MODEL   16
    1   1H    GLN   1          1H        GLN   1  -1.151  15.893   4.440
    2   2H    GLN   1          2H        GLN   1  -1.798  16.598   3.015
    3   3H    GLN   1          3H        GLN   1  -1.928  14.905   3.275
    4    HA   GLN   1           HA       GLN   1  -3.460  15.143   4.942
    5   1HB   GLN   1          1HB       GLN   1  -3.983  17.344   5.929
    6   2HB   GLN   1          2HB       GLN   1  -2.297  16.903   6.155
    7   1HG   GLN   1          1HG       GLN   1  -1.687  18.823   5.255
    8   2HG   GLN   1          2HG       GLN   1  -2.451  18.348   3.740
    9   1HE2  GLN   1          1HE2      GLN   1  -3.259  19.678   6.925
   10   2HE2  GLN   1          2HE2      GLN   1  -4.466  20.774   6.353
   11    H    CYS   2           H        CYS   2  -3.467  15.207   2.042
   12    HA   CYS   2           HA       CYS   2  -5.561  17.058   1.284
   13   1HB   CYS   2          1HB       CYS   2  -4.199  14.849  -0.271
   14   2HB   CYS   2          2HB       CYS   2  -5.356  15.990  -0.948
   15    H    THR   3           H        THR   3  -7.557  16.311   0.256
   16    HA   THR   3           HA       THR   3  -8.473  13.639   0.633
   17    HB   THR   3           HB       THR   3  -8.618  14.343   2.957
   18    HG1  THR   3           HG1      THR   3 -10.315  13.043   2.134
   19   1HG2  THR   3          1HG2      THR   3  -9.544  16.819   1.850
   20   2HG2  THR   3          2HG2      THR   3  -9.040  16.442   3.497
   21   3HG2  THR   3          3HG2      THR   3 -10.714  16.180   3.005
   22    H    GLY   4           H        GLY   4  -8.933  13.978  -1.590
   23   1HA   GLY   4          1HA       GLY   4 -11.127  14.088  -2.767
   24   2HA   GLY   4          2HA       GLY   4 -11.297  15.693  -2.060
   25    H    GLY   5           H        GLY   5 -11.650  15.823  -4.592
   26   1HA   GLY   5          1HA       GLY   5 -10.890  17.093  -6.377
   27   2HA   GLY   5          2HA       GLY   5  -9.330  17.223  -5.580
   28    H    ALA   6           H        ALA   6  -9.922  16.674  -8.386
   29    HA   ALA   6           HA       ALA   6  -9.074  13.894  -8.703
   30   1HB   ALA   6          1HB       ALA   6 -10.087  15.956 -10.641
   31   2HB   ALA   6          2HB       ALA   6 -10.852  14.446 -10.148
   32   3HB   ALA   6          3HB       ALA   6  -9.409  14.413 -11.162
   33    H    ASP   7           H        ASP   7  -7.301  16.041  -7.663
   34    HA   ASP   7           HA       ASP   7  -5.009  15.410  -9.283
   35   1HB   ASP   7          1HB       ASP   7  -6.308  17.640 -10.094
   36   2HB   ASP   7          2HB       ASP   7  -5.251  18.333  -8.861
   37    H    CYS   8           H        CYS   8  -3.581  14.816  -7.795
   38    HA   CYS   8           HA       CYS   8  -3.252  16.505  -5.411
   39   1HB   CYS   8          1HB       CYS   8  -3.204  13.481  -5.379
   40   2HB   CYS   8          2HB       CYS   8  -3.037  14.557  -3.989
   41    H    THR   9           H        THR   9  -1.302  17.373  -5.644
   42    HA   THR   9           HA       THR   9   0.963  15.578  -6.134
   43    HB   THR   9           HB       THR   9   0.634  18.276  -7.459
   44    HG1  THR   9           HG1      THR   9   0.340  15.642  -8.443
   45   1HG2  THR   9          1HG2      THR   9   2.797  18.204  -7.881
   46   2HG2  THR   9          2HG2      THR   9   2.555  16.693  -8.760
   47   3HG2  THR   9          3HG2      THR   9   2.942  16.660  -7.040
   48    H    SER  10           H        SER  10   2.792  16.044  -4.996
   49    HA   SER  10           HA       SER  10   4.228  17.117  -3.572
   50   1HB   SER  10          1HB       SER  10   3.008  19.266  -4.677
   51   2HB   SER  10          2HB       SER  10   2.491  19.441  -3.001
   52    HG   SER  10           HG       SER  10   4.747  19.253  -2.436
   53    H    CYS  11           H        CYS  11   1.097  16.158  -2.934
   54    HA   CYS  11           HA       CYS  11   1.014  16.818  -0.138
   55   1HB   CYS  11          1HB       CYS  11  -0.906  16.170  -1.923
   56   2HB   CYS  11          2HB       CYS  11  -0.662  14.600  -1.165
   57    H    THR  12           H        THR  12   0.424  14.737   1.317
   58    HA   THR  12           HA       THR  12   2.293  12.569   0.775
   59    HB   THR  12           HB       THR  12   2.697  14.675   2.758
   60    HG1  THR  12           HG1      THR  12   4.302  12.565   1.760
   61   1HG2  THR  12          1HG2      THR  12   3.582  13.280   4.529
   62   2HG2  THR  12          2HG2      THR  12   3.004  11.834   3.698
   63   3HG2  THR  12          3HG2      THR  12   1.850  13.014   4.324
   64    H    GLY  13           H        GLY  13  -0.206  13.920   2.891
   65   1HA   GLY  13          1HA       GLY  13  -0.830  11.599   4.317
   66   2HA   GLY  13          2HA       GLY  13  -1.941  12.925   4.011
   67    H    ALA  14           H        ALA  14  -3.421  10.970   4.035
   68    HA   ALA  14           HA       ALA  14  -3.383   9.253   1.737
   69   1HB   ALA  14          1HB       ALA  14  -5.885   9.507   3.273
   70   2HB   ALA  14          2HB       ALA  14  -4.463   9.009   4.190
   71   3HB   ALA  14          3HB       ALA  14  -4.986   8.067   2.794
   72    H    CYS  15           H        CYS  15  -4.688   9.310  -0.072
   73    HA   CYS  15           HA       CYS  15  -6.228  11.792  -0.452
   74   1HB   CYS  15          1HB       CYS  15  -5.713  11.336  -2.955
   75   2HB   CYS  15          2HB       CYS  15  -4.459  12.041  -1.942
   76    H    THR  16           H        THR  16  -8.257  11.666  -1.208
   77    HA   THR  16           HA       THR  16  -9.289   9.021  -1.986
   78    HB   THR  16           HB       THR  16 -10.116   9.460   0.230
   79    HG1  THR  16           HG1      THR  16 -11.672   8.653  -1.206
   80   1HG2  THR  16          1HG2      THR  16  -9.777  11.857   0.369
   81   2HG2  THR  16          2HG2      THR  16 -11.435  11.429   0.793
   82   3HG2  THR  16          3HG2      THR  16 -11.079  12.121  -0.790
   83    H    GLY  17           H        GLY  17 -10.899   9.017  -3.616
   84   1HA   GLY  17          1HA       GLY  17 -11.760   9.767  -5.628
   85   2HA   GLY  17          2HA       GLY  17 -12.194  11.214  -4.713
   86    H    CYS  18           H        CYS  18  -9.038   9.873  -5.518
   87    HA   CYS  18           HA       CYS  18  -8.441  12.094  -7.317
   88   1HB   CYS  18          1HB       CYS  18  -7.845  12.732  -4.919
   89   2HB   CYS  18          2HB       CYS  18  -6.627  11.457  -4.983
   90    H    GLY  19           H        GLY  19  -7.880  10.940  -9.087
   91   1HA   GLY  19          1HA       GLY  19  -6.496   8.412  -8.817
   92   2HA   GLY  19          2HA       GLY  19  -7.056   9.138 -10.317
   93    H    ASN  20           H        ASN  20  -5.031  10.912  -8.066
   94    HA   ASN  20           HA       ASN  20  -2.594  10.242  -9.438
   95   1HB   ASN  20          1HB       ASN  20  -2.272  12.829  -9.886
   96   2HB   ASN  20          2HB       ASN  20  -3.039  11.785 -11.076
   97   1HD2  ASN  20          1HD2      ASN  20  -4.064  13.637 -11.934
   98   2HD2  ASN  20          2HD2      ASN  20  -5.455  14.318 -11.168
   99    H    CYS  21           H        CYS  21  -1.854   9.698  -7.391
  100    HA   CYS  21           HA       CYS  21  -1.523  11.935  -5.507
  101   1HB   CYS  21          1HB       CYS  21  -2.528   9.384  -5.043
  102   2HB   CYS  21          2HB       CYS  21  -0.872   9.300  -4.436
  103    HA   PRO  22           HA       PRO  22   2.828  11.593  -6.158
  104   1HB   PRO  22          1HB       PRO  22   3.726  12.931  -3.980
  105   2HB   PRO  22          2HB       PRO  22   2.906  13.718  -5.329
  106   1HG   PRO  22          1HG       PRO  22   1.941  13.201  -2.608
  107   2HG   PRO  22          2HG       PRO  22   1.351  14.357  -3.808
  108   1HD   PRO  22          1HD       PRO  22   0.268  11.782  -3.117
  109   2HD   PRO  22          2HD       PRO  22  -0.359  12.962  -4.282
  110    H    ASN  23           H        ASN  23   2.749  11.416  -2.608
  111    HA   ASN  23           HA       ASN  23   4.037   8.776  -2.776
  112   1HB   ASN  23          1HB       ASN  23   5.562   9.397  -0.974
  113   2HB   ASN  23          2HB       ASN  23   5.743  10.502  -2.339
  114   1HD2  ASN  23          1HD2      ASN  23   4.287  12.484  -2.163
  115   2HD2  ASN  23          2HD2      ASN  23   4.239  13.252  -0.618
  116    H    ALA  24           H        ALA  24   1.257   9.688  -2.148
  117    HA   ALA  24           HA       ALA  24   0.580   9.624   0.505
  118   1HB   ALA  24          1HB       ALA  24  -0.774   8.755  -1.981
  119   2HB   ALA  24          2HB       ALA  24  -1.259   9.958  -0.787
  120   3HB   ALA  24          3HB       ALA  24  -1.477   8.241  -0.447
  121    H    VAL  25           H        VAL  25   0.543   8.156   2.111
  122    HA   VAL  25           HA       VAL  25   1.773   5.580   1.645
  123    HB   VAL  25           HB       VAL  25   2.402   6.851   3.633
  124   1HG1  VAL  25          1HG1      VAL  25  -0.492   7.012   3.977
  125   2HG1  VAL  25          2HG1      VAL  25   0.786   8.062   4.590
  126   3HG1  VAL  25          3HG1      VAL  25   0.372   6.579   5.453
  127   1HG2  VAL  25          1HG2      VAL  25   2.238   4.269   3.548
  128   2HG2  VAL  25          2HG2      VAL  25   0.888   4.484   4.664
  129   3HG2  VAL  25          3HG2      VAL  25   2.496   5.062   5.104
  130    H    THR  26           H        THR  26  -1.397   6.880   2.193
  131    HA   THR  26           HA       THR  26  -2.538   4.209   1.816
  132    HB   THR  26           HB       THR  26  -4.304   5.596   3.539
  133    HG1  THR  26           HG1      THR  26  -1.680   5.497   4.604
  134   1HG2  THR  26          1HG2      THR  26  -2.501   3.479   4.587
  135   2HG2  THR  26          2HG2      THR  26  -3.654   3.080   3.313
  136   3HG2  THR  26          3HG2      THR  26  -4.227   3.728   4.850
  137    H    CYS  27           H        CYS  27  -4.234   4.186   0.413
  138    HA   CYS  27           HA       CYS  27  -5.288   6.806  -0.427
  139   1HB   CYS  27          1HB       CYS  27  -4.478   4.433  -2.090
  140   2HB   CYS  27          2HB       CYS  27  -5.599   5.653  -2.704
  141    H    THR  28           H        THR  28  -7.344   7.029   0.035
  142    HA   THR  28           HA       THR  28  -9.047   4.658   0.292
  143    HB   THR  28           HB       THR  28  -9.727   7.512   1.020
  144    HG1  THR  28           HG1      THR  28  -7.875   6.695   2.174
  145   1HG2  THR  28          1HG2      THR  28 -11.006   5.857   2.778
  146   2HG2  THR  28          2HG2      THR  28 -11.121   4.970   1.258
  147   3HG2  THR  28          3HG2      THR  28 -11.733   6.621   1.364
  148    H    ASN  29           H        ASN  29  -9.483   4.185  -1.854
  149    HA   ASN  29           HA       ASN  29 -10.852   4.221  -3.667
  150   1HB   ASN  29          1HB       ASN  29 -11.664   7.057  -3.052
  151   2HB   ASN  29          2HB       ASN  29 -12.539   5.842  -3.987
  152   1HD2  ASN  29          1HD2      ASN  29 -13.503   4.083  -2.859
  153   2HD2  ASN  29          2HD2      ASN  29 -13.965   4.255  -1.202
  154    H    SER  30           H        SER  30 -10.936   5.306  -5.772
  155    HA   SER  30           HA       SER  30 -10.049   6.515  -7.517
  156   1HB   SER  30          1HB       SER  30  -9.134   8.025  -5.344
  157   2HB   SER  30          2HB       SER  30  -7.719   7.716  -6.353
  158    HG   SER  30           HG       SER  30 -10.197   8.670  -7.347
  159    H    GLN  31           H        GLN  31  -8.356   6.152  -9.012
  160    HA   GLN  31           HA       GLN  31  -6.698   3.842  -8.309
  161   1HB   GLN  31          1HB       GLN  31  -6.389   3.676 -10.808
  162   2HB   GLN  31          2HB       GLN  31  -8.039   3.443 -10.232
  163   1HG   GLN  31          1HG       GLN  31  -7.618   6.209 -10.806
  164   2HG   GLN  31          2HG       GLN  31  -7.102   5.240 -12.184
  165   1HE2  GLN  31          1HE2      GLN  31  -8.708   3.400 -12.682
  166   2HE2  GLN  31          2HE2      GLN  31 -10.371   3.866 -12.734
  167    H    HIS  32           H        HIS  32  -4.651   3.858  -9.955
  168    HA   HIS  32           HA       HIS  32  -2.582   4.686 -10.389
  169   1HB   HIS  32          1HB       HIS  32  -4.318   7.026 -10.574
  170   2HB   HIS  32          2HB       HIS  32  -2.674   7.441 -10.084
  171    HD1  HIS  32           HD1      HIS  32  -0.845   5.969 -11.747
  172    HD2  HIS  32           HD2      HIS  32  -4.531   7.158 -13.252
  173    HE1  HIS  32           HE1      HIS  32  -0.585   5.954 -14.248
  174    HE2  HIS  32           HE2      HIS  32  -2.857   6.581 -15.137
  175    H    CYS  33           H        CYS  33  -3.400   3.981  -7.698
  176    HA   CYS  33           HA       CYS  33  -1.590   5.720  -6.155
  177   1HB   CYS  33          1HB       CYS  33  -4.215   4.556  -5.528
  178   2HB   CYS  33          2HB       CYS  33  -3.010   4.335  -4.256
  179    H    VAL  34           H        VAL  34  -0.235   3.995  -7.550
  180    HA   VAL  34           HA       VAL  34   0.031   1.375  -6.565
  181    HB   VAL  34           HB       VAL  34   2.233   1.363  -7.682
  182   1HG1  VAL  34          1HG1      VAL  34   0.083   1.012  -8.912
  183   2HG1  VAL  34          2HG1      VAL  34   1.415   1.592  -9.912
  184   3HG1  VAL  34          3HG1      VAL  34   0.150   2.707  -9.394
  185   1HG2  VAL  34          1HG2      VAL  34   3.173   3.458  -7.364
  186   2HG2  VAL  34          2HG2      VAL  34   1.701   4.304  -7.838
  187   3HG2  VAL  34          3HG2      VAL  34   2.694   3.510  -9.060
  188    H    LYS  35           H        LYS  35   1.109   4.389  -5.299
  189    HA   LYS  35           HA       LYS  35   3.114   3.123  -3.594
  190   1HB   LYS  35          1HB       LYS  35   2.856   5.674  -4.762
  191   2HB   LYS  35          2HB       LYS  35   2.689   5.921  -3.030
  192   1HG   LYS  35          1HG       LYS  35   4.994   4.632  -4.469
  193   2HG   LYS  35          2HG       LYS  35   4.984   6.184  -3.629
  194   1HD   LYS  35          1HD       LYS  35   4.089   4.234  -1.788
  195   2HD   LYS  35          2HD       LYS  35   5.520   3.577  -2.584
  196   1HE   LYS  35          1HE       LYS  35   6.423   4.739  -0.795
  197   2HE   LYS  35          2HE       LYS  35   6.554   5.901  -2.116
  198   1HZ   LYS  35          1HZ       LYS  35   5.647   7.189  -0.482
  199   2HZ   LYS  35          2HZ       LYS  35   4.764   5.921   0.207
  200   3HZ   LYS  35          3HZ       LYS  35   4.230   6.640  -1.228
  201    H    ALA  36           H        ALA  36   0.073   2.845  -3.340
  202    HA   ALA  36           HA       ALA  36  -0.295   3.960  -0.657
  203   1HB   ALA  36          1HB       ALA  36  -2.399   2.508  -2.228
  204   2HB   ALA  36          2HB       ALA  36  -2.025   4.206  -2.527
  205   3HB   ALA  36          3HB       ALA  36  -2.600   3.695  -0.939
  206    H    ASN  37           H        ASN  37  -0.137   2.742   1.110
  207    HA   ASN  37           HA       ASN  37   0.628   0.014   0.966
  208   1HB   ASN  37          1HB       ASN  37   0.155   2.001   3.109
  209   2HB   ASN  37          2HB       ASN  37  -0.033   0.313   3.575
  210   1HD2  ASN  37          1HD2      ASN  37   1.743  -0.072   4.730
  211   2HD2  ASN  37          2HD2      ASN  37   3.361   0.146   4.166
  212    H    THR  38           H        THR  38  -2.400   1.666   1.602
  213    HA   THR  38           HA       THR  38  -3.786  -0.908   1.374
  214    HB   THR  38           HB       THR  38  -4.945   1.054   3.279
  215    HG1  THR  38           HG1      THR  38  -2.630  -0.477   3.824
  216   1HG2  THR  38          1HG2      THR  38  -6.011  -0.709   4.161
  217   2HG2  THR  38          2HG2      THR  38  -4.614  -1.773   4.001
  218   3HG2  THR  38          3HG2      THR  38  -5.642  -1.450   2.605
  219    H    CYS  39           H        CYS  39  -5.262  -0.814  -0.187
  220    HA   CYS  39           HA       CYS  39  -6.480   1.798  -0.788
  221   1HB   CYS  39          1HB       CYS  39  -6.668   0.480  -3.172
  222   2HB   CYS  39          2HB       CYS  39  -5.416   1.652  -2.766
  223    H    THR  40           H        THR  40  -8.464   1.644   0.056
  224    HA   THR  40           HA       THR  40 -10.005  -0.815  -0.295
  225    HB   THR  40           HB       THR  40 -11.294   1.471   1.045
  226    HG1  THR  40           HG1      THR  40  -9.967   1.546   2.762
  227   1HG2  THR  40          1HG2      THR  40 -11.012  -1.446   1.475
  228   2HG2  THR  40          2HG2      THR  40 -12.451  -0.426   1.497
  229   3HG2  THR  40          3HG2      THR  40 -11.347  -0.424   2.873
  230    H    GLY  41           H        GLY  41 -10.564  -0.792  -2.451
  231   1HA   GLY  41          1HA       GLY  41 -12.207  -0.350  -4.067
  232   2HA   GLY  41          2HA       GLY  41 -12.665   1.090  -3.178
  233    H    SER  42           H        SER  42  -9.687  -0.100  -4.711
  234    HA   SER  42           HA       SER  42  -9.698   2.217  -6.446
  235   1HB   SER  42          1HB       SER  42  -7.580   1.702  -4.345
  236   2HB   SER  42          2HB       SER  42  -7.277   2.712  -5.756
  237    HG   SER  42           HG       SER  42  -8.052   3.748  -3.719
  238    H    THR  43           H        THR  43  -7.000   1.881  -7.324
  239    HA   THR  43           HA       THR  43  -6.809  -0.945  -7.993
  240    HB   THR  43           HB       THR  43  -6.959  -0.720 -10.275
  241    HG1  THR  43           HG1      THR  43  -6.212   1.959  -9.849
  242   1HG2  THR  43          1HG2      THR  43  -8.796   1.378  -9.155
  243   2HG2  THR  43          2HG2      THR  43  -9.158  -0.310  -9.526
  244   3HG2  THR  43          3HG2      THR  43  -8.842   0.831 -10.836
  245    H    ASP  44           H        ASP  44  -4.815   0.036 -10.178
  246    HA   ASP  44           HA       ASP  44  -2.462  -0.358  -9.921
  247   1HB   ASP  44          1HB       ASP  44  -2.852   2.580  -9.353
  248   2HB   ASP  44          2HB       ASP  44  -1.513   1.819 -10.207
  249    H    CYS  45           H        CYS  45  -2.317  -1.593  -7.926
  250    HA   CYS  45           HA       CYS  45  -1.131   0.002  -5.765
  251   1HB   CYS  45          1HB       CYS  45  -3.398  -1.935  -5.604
  252   2HB   CYS  45          2HB       CYS  45  -2.259  -1.859  -4.253
  253    H    ASN  46           H        ASN  46   0.942  -0.605  -6.261
  254    HA   ASN  46           HA       ASN  46   1.576  -3.454  -6.402
  255   1HB   ASN  46          1HB       ASN  46   2.550  -1.987  -8.111
  256   2HB   ASN  46          2HB       ASN  46   3.324  -1.022  -6.849
  257   1HD2  ASN  46          1HD2      ASN  46   3.198  -4.228  -8.296
  258   2HD2  ASN  46          2HD2      ASN  46   4.816  -4.675  -7.889
  259    H    THR  47           H        THR  47   2.246  -0.582  -4.454
  260    HA   THR  47           HA       THR  47   3.934  -2.064  -2.627
  261    HB   THR  47           HB       THR  47   4.197   0.038  -1.454
  262    HG1  THR  47           HG1      THR  47   2.845   1.652  -1.663
  263   1HG2  THR  47          1HG2      THR  47   4.389   1.496  -3.809
  264   2HG2  THR  47          2HG2      THR  47   4.684  -0.178  -4.280
  265   3HG2  THR  47          3HG2      THR  47   5.665   0.570  -3.019
  266    H    ALA  48           H        ALA  48   0.599  -1.344  -2.950
  267    HA   ALA  48           HA       ALA  48  -0.253  -1.241  -0.300
  268   1HB   ALA  48          1HB       ALA  48  -1.934  -2.671  -2.291
  269   2HB   ALA  48          2HB       ALA  48  -1.528  -0.981  -2.594
  270   3HB   ALA  48          3HB       ALA  48  -2.378  -1.432  -1.116
  271    H    GLN  49           H        GLN  49  -1.304  -2.873   1.001
  272    HA   GLN  49           HA       GLN  49  -0.124  -5.539   0.603
  273   1HB   GLN  49          1HB       GLN  49   0.580  -5.535   2.726
  274   2HB   GLN  49          2HB       GLN  49   0.205  -3.821   2.746
  275   1HG   GLN  49          1HG       GLN  49  -1.635  -6.037   3.627
  276   2HG   GLN  49          2HG       GLN  49  -0.709  -4.975   4.685
  277   1HE2  GLN  49          1HE2      GLN  49  -3.185  -4.919   5.305
  278   2HE2  GLN  49          2HE2      GLN  49  -4.031  -3.548   4.679
  279    H    THR  50           H        THR  50  -2.967  -3.966   0.285
  280    HA   THR  50           HA       THR  50  -4.502  -6.303   0.086
  281    HB   THR  50           HB       THR  50  -4.285  -6.045   2.601
  282    HG1  THR  50           HG1      THR  50  -6.054  -7.128   1.383
  283   1HG2  THR  50          1HG2      THR  50  -6.291  -3.845   2.219
  284   2HG2  THR  50          2HG2      THR  50  -4.611  -3.599   2.699
  285   3HG2  THR  50          3HG2      THR  50  -5.704  -4.507   3.744
  286    H    CYS  51           H        CYS  51  -6.884  -5.767  -0.234
  287    HA   CYS  51           HA       CYS  51  -7.632  -3.071  -0.767
  288   1HB   CYS  51          1HB       CYS  51  -7.924  -3.477  -3.281
  289   2HB   CYS  51          2HB       CYS  51  -6.286  -3.159  -2.702
  290    H    THR  52           H        THR  52  -9.727  -3.073  -2.189
  291    HA   THR  52           HA       THR  52 -11.305  -5.489  -1.658
  292    HB   THR  52           HB       THR  52 -11.703  -3.843   0.159
  293    HG1  THR  52           HG1      THR  52 -13.810  -4.452  -1.620
  294   1HG2  THR  52          1HG2      THR  52 -11.762  -1.689  -0.377
  295   2HG2  THR  52          2HG2      THR  52 -13.413  -1.999  -0.914
  296   3HG2  THR  52          3HG2      THR  52 -12.088  -2.026  -2.077
  297    H    ASN  53           H        ASN  53 -10.131  -3.779  -4.009
  298    HA   ASN  53           HA       ASN  53 -11.830  -4.584  -6.010
  299   1HB   ASN  53          1HB       ASN  53 -13.463  -2.996  -4.958
  300   2HB   ASN  53          2HB       ASN  53 -12.355  -1.681  -5.344
  301   1HD2  ASN  53          1HD2      ASN  53 -14.208  -4.312  -6.793
  302   2HD2  ASN  53          2HD2      ASN  53 -14.486  -3.520  -8.303
  303    H    SER  54           H        SER  54  -9.026  -4.151  -5.428
  304    HA   SER  54           HA       SER  54  -8.225  -2.095  -7.344
  305   1HB   SER  54          1HB       SER  54  -7.067  -2.240  -5.145
  306   2HB   SER  54          2HB       SER  54  -6.491  -3.851  -5.588
  307    HG   SER  54           HG       SER  54  -5.042  -2.987  -6.853
  308    H    LYS  55           H        LYS  55  -7.526  -2.536  -9.348
  309    HA   LYS  55           HA       LYS  55  -7.453  -5.331 -10.187
  310   1HB   LYS  55          1HB       LYS  55  -7.238  -2.876 -11.931
  311   2HB   LYS  55          2HB       LYS  55  -7.610  -4.517 -12.438
  312   1HG   LYS  55          1HG       LYS  55  -9.781  -4.315 -11.933
  313   2HG   LYS  55          2HG       LYS  55  -9.457  -3.425 -10.445
  314   1HD   LYS  55          1HD       LYS  55 -10.670  -2.044 -12.059
  315   2HD   LYS  55          2HD       LYS  55  -9.062  -1.391 -11.740
  316   1HE   LYS  55          1HE       LYS  55  -9.752  -1.395 -14.153
  317   2HE   LYS  55          2HE       LYS  55  -8.228  -2.211 -13.809
  318   1HZ   LYS  55          1HZ       LYS  55  -9.072  -4.214 -14.355
  319   2HZ   LYS  55          2HZ       LYS  55 -10.142  -3.289 -15.283
  320   3HZ   LYS  55          3HZ       LYS  55 -10.621  -3.867 -13.767
  321    H    ASP  56           H        ASP  56  -5.253  -3.880  -8.653
  322    HA   ASP  56           HA       ASP  56  -3.086  -4.883 -10.304
  323   1HB   ASP  56          1HB       ASP  56  -3.476  -2.019  -9.614
  324   2HB   ASP  56          2HB       ASP  56  -1.831  -2.659  -9.558
  325    H    CYS  57           H        CYS  57  -4.412  -5.580  -7.746
  326    HA   CYS  57           HA       CYS  57  -2.517  -4.979  -5.672
  327   1HB   CYS  57          1HB       CYS  57  -5.113  -6.283  -5.884
  328   2HB   CYS  57          2HB       CYS  57  -4.019  -7.158  -4.810
  329    H    PHE  58           H        PHE  58  -0.635  -5.734  -6.919
  330    HA   PHE  58           HA       PHE  58  -0.348  -8.578  -7.339
  331   1HB   PHE  58          1HB       PHE  58   1.931  -6.628  -7.471
  332   2HB   PHE  58          2HB       PHE  58   1.664  -8.086  -8.420
  333    HD1  PHE  58           HD1      PHE  58  -0.052  -8.084 -10.182
  334    HD2  PHE  58           HD2      PHE  58   1.222  -4.563  -8.172
  335    HE1  PHE  58           HE1      PHE  58  -0.930  -6.719 -12.024
  336    HE2  PHE  58           HE2      PHE  58   0.342  -3.191 -10.006
  337    HZ   PHE  58           HZ       PHE  58  -0.716  -4.291 -11.910
  338    H    GLU  59           H        GLU  59   0.523  -6.239  -4.907
  339    HA   GLU  59           HA       GLU  59   1.929  -8.366  -3.426
  340   1HB   GLU  59          1HB       GLU  59   3.076  -6.071  -4.217
  341   2HB   GLU  59          2HB       GLU  59   2.385  -5.526  -2.689
  342   1HG   GLU  59          1HG       GLU  59   4.604  -6.215  -2.250
  343   2HG   GLU  59          2HG       GLU  59   3.537  -7.451  -1.584
  344    H    ALA  60           H        ALA  60  -0.879  -8.078  -3.347
  345    HA   ALA  60           HA       ALA  60  -1.346  -6.884  -0.701
  346   1HB   ALA  60          1HB       ALA  60  -3.823  -7.334  -1.449
  347   2HB   ALA  60          2HB       ALA  60  -3.101  -7.352  -3.059
  348   3HB   ALA  60          3HB       ALA  60  -2.940  -5.924  -2.037
  349    H    ASN  61           H        ASN  61  -2.647  -8.038   0.834
  350    HA   ASN  61           HA       ASN  61  -2.189 -10.927   0.693
  351   1HB   ASN  61          1HB       ASN  61  -2.320  -8.937   2.858
  352   2HB   ASN  61          2HB       ASN  61  -3.135 -10.456   3.221
  353   1HD2  ASN  61          1HD2      ASN  61  -1.630 -12.325   2.063
  354   2HD2  ASN  61          2HD2      ASN  61  -0.029 -12.328   2.712
  355    H    THR  62           H        THR  62  -4.739  -8.533   1.111
  356    HA   THR  62           HA       THR  62  -6.707 -10.671   0.641
  357    HB   THR  62           HB       THR  62  -7.252  -8.305   2.427
  358    HG1  THR  62           HG1      THR  62  -5.750  -9.377   3.566
  359   1HG2  THR  62          1HG2      THR  62  -8.652 -10.767   2.989
  360   2HG2  THR  62          2HG2      THR  62  -8.959 -10.187   1.351
  361   3HG2  THR  62          3HG2      THR  62  -9.280  -9.139   2.733
  362    H    CYS  63           H        CYS  63  -7.416 -10.306  -1.362
  363    HA   CYS  63           HA       CYS  63  -8.209  -7.555  -2.053
  364   1HB   CYS  63          1HB       CYS  63  -7.638  -8.104  -4.419
  365   2HB   CYS  63          2HB       CYS  63  -6.242  -8.085  -3.339
  366    H    THR  64           H        THR  64 -10.352  -7.910  -1.452
  367    HA   THR  64           HA       THR  64 -11.827 -10.021  -2.834
  368    HB   THR  64           HB       THR  64 -13.482  -8.309  -1.201
  369    HG1  THR  64           HG1      THR  64 -12.413  -8.241   0.626
  370   1HG2  THR  64          1HG2      THR  64 -14.174 -10.532  -1.583
  371   2HG2  THR  64          2HG2      THR  64 -13.756 -10.417   0.127
  372   3HG2  THR  64          3HG2      THR  64 -12.639 -11.182  -1.005
  373    H    ASP  65           H        ASP  65 -13.118  -9.638  -4.542
  374    HA   ASP  65           HA       ASP  65 -14.346  -8.529  -6.124
  375   1HB   ASP  65          1HB       ASP  65 -14.020  -5.977  -4.545
  376   2HB   ASP  65          2HB       ASP  65 -15.306  -6.405  -5.677
  377    H    SER  66           H        SER  66 -11.351  -8.609  -5.922
  378    HA   SER  66           HA       SER  66 -10.774  -6.380  -7.757
  379   1HB   SER  66          1HB       SER  66  -9.074  -5.805  -6.424
  380   2HB   SER  66          2HB       SER  66  -9.490  -7.118  -5.319
  381    HG   SER  66           HG       SER  66  -8.075  -8.443  -6.360
  382    H    THR  67           H        THR  67  -8.745  -6.906  -9.119
  383    HA   THR  67           HA       THR  67  -8.744  -9.710  -9.965
  384    HB   THR  67           HB       THR  67 -10.247  -8.711 -11.502
  385    HG1  THR  67           HG1      THR  67  -9.039  -8.814 -13.452
  386   1HG2  THR  67          1HG2      THR  67  -8.269  -6.567 -12.179
  387   2HG2  THR  67          2HG2      THR  67  -9.552  -6.340 -10.991
  388   3HG2  THR  67          3HG2      THR  67  -9.959  -6.704 -12.668
  389    H    ASN  68           H        ASN  68  -6.888 -10.264 -11.334
  390    HA   ASN  68           HA       ASN  68  -4.665 -10.320 -11.797
  391   1HB   ASN  68          1HB       ASN  68  -5.254  -7.411 -11.770
  392   2HB   ASN  68          2HB       ASN  68  -3.555  -7.872 -11.639
  393   1HD2  ASN  68          1HD2      ASN  68  -3.160  -6.944 -13.668
  394   2HD2  ASN  68          2HD2      ASN  68  -3.615  -7.745 -15.129
  395    H    CYS  69           H        CYS  69  -5.468 -10.875  -9.161
  396    HA   CYS  69           HA       CYS  69  -3.607  -9.546  -7.381
  397   1HB   CYS  69          1HB       CYS  69  -6.038 -10.770  -6.981
  398   2HB   CYS  69          2HB       CYS  69  -4.904 -11.987  -6.385
  399    H    TYR  70           H        TYR  70  -1.720 -10.360  -6.605
  400    HA   TYR  70           HA       TYR  70  -0.926 -13.043  -7.513
  401   1HB   TYR  70          1HB       TYR  70   0.716 -10.507  -7.591
  402   2HB   TYR  70          2HB       TYR  70   1.406 -12.120  -7.783
  403    HD1  TYR  70           HD1      TYR  70  -0.981 -13.230  -9.420
  404    HD2  TYR  70           HD2      TYR  70   1.358  -9.689  -9.743
  405    HE1  TYR  70           HE1      TYR  70  -1.452 -13.144 -11.831
  406    HE2  TYR  70           HE2      TYR  70   0.889  -9.593 -12.154
  407    HH   TYR  70           HH       TYR  70  -0.132 -12.044 -13.928
  408    H    LYS  71           H        LYS  71  -0.810 -14.234  -5.737
  409    HA   LYS  71           HA       LYS  71   0.020 -15.038  -3.765
  410   1HB   LYS  71          1HB       LYS  71   2.040 -13.481  -4.488
  411   2HB   LYS  71          2HB       LYS  71   1.475 -12.510  -3.129
  412   1HG   LYS  71          1HG       LYS  71   2.370 -13.902  -1.647
  413   2HG   LYS  71          2HG       LYS  71   1.676 -15.317  -2.441
  414   1HD   LYS  71          1HD       LYS  71   3.894 -14.091  -3.907
  415   2HD   LYS  71          2HD       LYS  71   4.342 -14.721  -2.321
  416   1HE   LYS  71          1HE       LYS  71   4.231 -16.825  -3.043
  417   2HE   LYS  71          2HE       LYS  71   2.628 -16.569  -3.732
  418   1HZ   LYS  71          1HZ       LYS  71   4.842 -15.413  -5.213
  419   2HZ   LYS  71          2HZ       LYS  71   3.467 -16.223  -5.775
  420   3HZ   LYS  71          3HZ       LYS  71   4.785 -17.105  -5.187
  421    H    ALA  72           H        ALA  72  -2.471 -14.036  -3.787
  422    HA   ALA  72           HA       ALA  72  -2.672 -12.432  -1.324
  423   1HB   ALA  72          1HB       ALA  72  -5.175 -12.346  -2.344
  424   2HB   ALA  72          2HB       ALA  72  -4.224 -12.471  -3.823
  425   3HB   ALA  72          3HB       ALA  72  -3.923 -11.154  -2.691
  426    H    THR  73           H        THR  73  -3.858 -13.167   0.389
  427    HA   THR  73           HA       THR  73  -4.332 -15.989   0.524
  428    HB   THR  73           HB       THR  73  -5.154 -15.444   2.842
  429    HG1  THR  73           HG1      THR  73  -5.430 -13.445   3.411
  430   1HG2  THR  73          1HG2      THR  73  -2.694 -15.821   2.199
  431   2HG2  THR  73          2HG2      THR  73  -3.064 -15.094   3.763
  432   3HG2  THR  73          3HG2      THR  73  -2.531 -14.079   2.422
  433    H    ALA  74           H        ALA  74  -6.354 -13.100   0.363
  434    HA   ALA  74           HA       ALA  74  -8.772 -14.741   0.398
  435   1HB   ALA  74          1HB       ALA  74  -9.580 -12.128   0.047
  436   2HB   ALA  74          2HB       ALA  74  -8.134 -11.982   1.048
  437   3HB   ALA  74          3HB       ALA  74  -9.479 -12.989   1.582
  438    H    CYS  75           H        CYS  75  -9.505 -15.525  -1.458
  439    HA   CYS  75           HA       CYS  75  -9.208 -13.887  -3.889
  440   1HB   CYS  75          1HB       CYS  75  -9.152 -16.908  -3.805
  441   2HB   CYS  75          2HB       CYS  75  -8.845 -15.872  -5.202
  442    H    THR  76           H        THR  76 -11.421 -13.464  -2.486
  443    HA   THR  76           HA       THR  76 -13.536 -15.246  -3.387
  444    HB   THR  76           HB       THR  76 -13.698 -12.702  -1.757
  445    HG1  THR  76           HG1      THR  76 -13.498 -15.423  -1.023
  446   1HG2  THR  76          1HG2      THR  76 -15.785 -14.576  -1.234
  447   2HG2  THR  76          2HG2      THR  76 -15.763 -14.176  -2.950
  448   3HG2  THR  76          3HG2      THR  76 -15.896 -12.893  -1.747
  449    H    ASN  77           H        ASN  77 -14.442 -14.994  -5.308
  450    HA   ASN  77           HA       ASN  77 -14.976 -14.084  -7.339
  451   1HB   ASN  77          1HB       ASN  77 -16.520 -12.169  -7.179
  452   2HB   ASN  77          2HB       ASN  77 -16.884 -13.407  -5.974
  453   1HD2  ASN  77          1HD2      ASN  77 -15.742 -10.189  -6.529
  454   2HD2  ASN  77          2HD2      ASN  77 -15.761  -9.674  -4.880
  455    H    SER  78           H        SER  78 -12.337 -13.648  -6.914
  456    HA   SER  78           HA       SER  78 -11.953 -10.982  -8.091
  457   1HB   SER  78          1HB       SER  78  -9.643 -11.117  -6.839
  458   2HB   SER  78          2HB       SER  78 -11.084 -10.557  -5.981
  459    HG   SER  78           HG       SER  78 -11.115 -12.352  -4.831
  460    H    SER  79           H        SER  79 -10.329 -10.816  -9.648
  461    HA   SER  79           HA       SER  79  -9.587 -13.351 -10.870
  462   1HB   SER  79          1HB       SER  79 -10.110 -10.675 -11.813
  463   2HB   SER  79          2HB       SER  79  -8.546 -11.235 -12.403
  464    HG   SER  79           HG       SER  79 -10.439 -11.785 -13.717
  465    H    GLY  80           H        GLY  80  -7.471 -13.970 -11.355
  466   1HA   GLY  80          1HA       GLY  80  -5.142 -13.874 -11.271
  467   2HA   GLY  80          2HA       GLY  80  -5.260 -12.337 -10.420
  468    H    CYS  81           H        CYS  81  -7.063 -13.352  -8.365
  469    HA   CYS  81           HA       CYS  81  -5.060 -14.472  -6.627
  470   1HB   CYS  81          1HB       CYS  81  -6.857 -12.717  -6.030
  471   2HB   CYS  81          2HB       CYS  81  -7.959 -14.091  -5.909
  472    HA   PRO  82           HA       PRO  82  -6.120 -18.705  -7.774
  473   1HB   PRO  82          1HB       PRO  82  -4.602 -19.183  -5.252
  474   2HB   PRO  82          2HB       PRO  82  -4.421 -19.945  -6.840
  475   1HG   PRO  82          1HG       PRO  82  -2.674 -18.117  -6.003
  476   2HG   PRO  82          2HG       PRO  82  -3.198 -18.171  -7.697
  477   1HD   PRO  82          1HD       PRO  82  -3.986 -16.284  -5.524
  478   2HD   PRO  82          2HD       PRO  82  -3.758 -15.979  -7.258
  479    H    GLY  83           H        GLY  83  -8.263 -18.990  -7.368
  480   1HA   GLY  83          1HA       GLY  83  -9.634 -18.528  -5.004
  481   2HA   GLY  83          2HA       GLY  83 -10.140 -19.675  -6.235
  482    H    HIS  84           H        HIS  84  -8.099 -21.540  -6.086
  483    HA   HIS  84           HA       HIS  84  -7.418 -22.388  -3.506
  484   1HB   HIS  84          1HB       HIS  84 -10.126 -23.117  -4.411
  485   2HB   HIS  84          2HB       HIS  84  -9.162 -24.466  -3.816
  486    HD1  HIS  84           HD1      HIS  84  -7.675 -22.802  -1.569
  487    HD2  HIS  84           HD2      HIS  84 -11.779 -22.921  -2.212
  488    HE1  HIS  84           HE1      HIS  84  -8.719 -22.177   0.632
  489    HE2  HIS  84           HE2      HIS  84 -11.200 -22.174   0.196
  Start of MODEL   17
    1   1H    GLN   1          1H        GLN   1 -10.118  17.007   3.816
    2   2H    GLN   1          2H        GLN   1 -10.616  18.603   4.206
    3   3H    GLN   1          3H        GLN   1  -8.975  18.140   4.404
    4    HA   GLN   1           HA       GLN   1 -10.493  18.625   1.951
    5   1HB   GLN   1          1HB       GLN   1  -8.738  20.181   1.514
    6   2HB   GLN   1          2HB       GLN   1  -9.224  20.422   3.185
    7   1HG   GLN   1          1HG       GLN   1  -7.275  18.834   3.749
    8   2HG   GLN   1          2HG       GLN   1  -6.727  19.180   2.110
    9   1HE2  GLN   1          1HE2      GLN   1  -7.547  21.857   1.961
   10   2HE2  GLN   1          2HE2      GLN   1  -6.558  22.788   3.028
   11    H    CYS   2           H        CYS   2  -8.242  18.688   0.295
   12    HA   CYS   2           HA       CYS   2  -6.998  17.369  -1.077
   13   1HB   CYS   2          1HB       CYS   2  -6.567  16.158   1.601
   14   2HB   CYS   2          2HB       CYS   2  -6.106  15.186   0.208
   15    H    THR   3           H        THR   3  -9.862  16.995  -0.880
   16    HA   THR   3           HA       THR   3 -10.011  14.248  -1.917
   17    HB   THR   3           HB       THR   3 -11.001  14.320   0.342
   18    HG1  THR   3           HG1      THR   3 -12.010  12.848  -0.869
   19   1HG2  THR   3          1HG2      THR   3 -13.442  15.629  -0.147
   20   2HG2  THR   3          2HG2      THR   3 -12.153  16.760  -0.562
   21   3HG2  THR   3          3HG2      THR   3 -12.203  16.032   1.043
   22    H    GLY   4           H        GLY   4  -9.631  16.650  -3.392
   23   1HA   GLY   4          1HA       GLY   4 -12.026  16.509  -5.068
   24   2HA   GLY   4          2HA       GLY   4 -11.539  18.097  -4.480
   25    H    GLY   5           H        GLY   5 -11.717  17.638  -7.173
   26   1HA   GLY   5          1HA       GLY   5 -10.415  18.297  -8.986
   27   2HA   GLY   5          2HA       GLY   5  -8.984  18.157  -7.978
   28    H    ALA   6           H        ALA   6  -9.120  17.258 -10.635
   29    HA   ALA   6           HA       ALA   6  -9.600  14.440 -10.719
   30   1HB   ALA   6          1HB       ALA   6  -9.458  16.319 -12.626
   31   2HB   ALA   6          2HB       ALA   6  -9.230  14.600 -12.946
   32   3HB   ALA   6          3HB       ALA   6  -7.829  15.653 -12.749
   33    H    ASP   7           H        ASP   7  -6.824  16.482 -10.107
   34    HA   ASP   7           HA       ASP   7  -5.183  14.061  -9.742
   35   1HB   ASP   7          1HB       ASP   7  -4.655  16.102 -11.475
   36   2HB   ASP   7          2HB       ASP   7  -3.759  16.624 -10.045
   37    H    CYS   8           H        CYS   8  -3.744  14.006  -7.968
   38    HA   CYS   8           HA       CYS   8  -4.457  15.873  -5.802
   39   1HB   CYS   8          1HB       CYS   8  -4.522  13.011  -5.908
   40   2HB   CYS   8          2HB       CYS   8  -3.318  13.506  -4.714
   41    H    THR   9           H        THR   9  -2.399  16.398  -7.684
   42    HA   THR   9           HA       THR   9   0.165  15.656  -6.861
   43    HB   THR   9           HB       THR   9  -0.242  18.408  -7.914
   44    HG1  THR   9           HG1      THR   9  -0.986  16.049  -9.281
   45   1HG2  THR   9          1HG2      THR   9   1.915  16.744  -7.780
   46   2HG2  THR   9          2HG2      THR   9   1.752  18.129  -8.860
   47   3HG2  THR   9          3HG2      THR   9   1.357  16.510  -9.436
   48    H    SER  10           H        SER  10  -1.859  18.391  -5.865
   49    HA   SER  10           HA       SER  10   0.004  19.706  -4.258
   50   1HB   SER  10          1HB       SER  10  -2.423  20.380  -4.987
   51   2HB   SER  10          2HB       SER  10  -2.888  19.609  -3.470
   52    HG   SER  10           HG       SER  10  -1.606  21.058  -2.363
   53    H    CYS  11           H        CYS  11  -2.015  16.918  -3.610
   54    HA   CYS  11           HA       CYS  11  -1.143  16.854  -0.820
   55   1HB   CYS  11          1HB       CYS  11  -3.551  16.233  -1.975
   56   2HB   CYS  11          2HB       CYS  11  -2.819  14.642  -1.793
   57    H    THR  12           H        THR  12   0.303  15.428  -0.034
   58    HA   THR  12           HA       THR  12   1.288  13.328  -1.847
   59    HB   THR  12           HB       THR  12   3.549  13.765  -1.215
   60    HG1  THR  12           HG1      THR  12   2.459  15.602   0.645
   61   1HG2  THR  12          1HG2      THR  12   2.183  16.395  -1.730
   62   2HG2  THR  12          2HG2      THR  12   2.819  15.277  -2.938
   63   3HG2  THR  12          3HG2      THR  12   3.920  16.111  -1.841
   64    H    GLY  13           H        GLY  13   0.612  14.363   1.429
   65   1HA   GLY  13          1HA       GLY  13   1.686  12.236   2.864
   66   2HA   GLY  13          2HA       GLY  13   0.288  13.175   3.361
   67    H    ALA  14           H        ALA  14  -1.820  12.505   2.560
   68    HA   ALA  14           HA       ALA  14  -1.920   9.670   1.775
   69   1HB   ALA  14          1HB       ALA  14  -3.892  10.840   3.711
   70   2HB   ALA  14          2HB       ALA  14  -2.374  10.127   4.255
   71   3HB   ALA  14          3HB       ALA  14  -3.543   9.145   3.373
   72    H    CYS  15           H        CYS  15  -3.242   9.237   0.121
   73    HA   CYS  15           HA       CYS  15  -4.742  11.417  -1.066
   74   1HB   CYS  15          1HB       CYS  15  -3.716   8.793  -1.949
   75   2HB   CYS  15          2HB       CYS  15  -5.242   9.281  -2.675
   76    H    THR  16           H        THR  16  -6.915  11.615  -1.136
   77    HA   THR  16           HA       THR  16  -8.579   9.388  -0.226
   78    HB   THR  16           HB       THR  16  -8.153  10.774   1.760
   79    HG1  THR  16           HG1      THR  16 -10.140   9.873   1.795
   80   1HG2  THR  16          1HG2      THR  16  -7.790  12.938   0.678
   81   2HG2  THR  16          2HG2      THR  16  -9.013  13.022   1.946
   82   3HG2  THR  16          3HG2      THR  16  -9.500  13.001   0.252
   83    H    GLY  17           H        GLY  17 -10.227   9.084  -1.576
   84   1HA   GLY  17          1HA       GLY  17 -11.663   9.429  -3.345
   85   2HA   GLY  17          2HA       GLY  17 -12.022  10.944  -2.519
   86    H    CYS  18           H        CYS  18  -8.995   9.930  -4.038
   87    HA   CYS  18           HA       CYS  18  -9.286  12.168  -5.935
   88   1HB   CYS  18          1HB       CYS  18  -7.230  11.602  -4.013
   89   2HB   CYS  18          2HB       CYS  18  -6.540  11.509  -5.633
   90    H    GLY  19           H        GLY  19  -7.068  11.617  -7.509
   91   1HA   GLY  19          1HA       GLY  19  -7.718   8.964  -8.639
   92   2HA   GLY  19          2HA       GLY  19  -7.462  10.382  -9.654
   93    H    ASN  20           H        ASN  20  -5.296  11.441  -9.438
   94    HA   ASN  20           HA       ASN  20  -3.245   9.374  -9.431
   95   1HB   ASN  20          1HB       ASN  20  -3.362  10.948 -11.332
   96   2HB   ASN  20          2HB       ASN  20  -3.055  12.287 -10.230
   97   1HD2  ASN  20          1HD2      ASN  20  -1.015  12.216  -9.024
   98   2HD2  ASN  20          2HD2      ASN  20   0.376  11.543  -9.796
   99    H    CYS  21           H        CYS  21  -1.353   9.477  -8.197
  100    HA   CYS  21           HA       CYS  21  -1.238  11.493  -6.079
  101   1HB   CYS  21          1HB       CYS  21  -1.023   8.522  -5.537
  102   2HB   CYS  21          2HB       CYS  21  -0.879   9.819  -4.347
  103    HA   PRO  22           HA       PRO  22   3.064  11.190  -6.993
  104   1HB   PRO  22          1HB       PRO  22   4.072  12.584  -4.902
  105   2HB   PRO  22          2HB       PRO  22   3.175  13.336  -6.220
  106   1HG   PRO  22          1HG       PRO  22   2.354  12.845  -3.440
  107   2HG   PRO  22          2HG       PRO  22   1.732  14.020  -4.606
  108   1HD   PRO  22          1HD       PRO  22   0.593  11.502  -3.863
  109   2HD   PRO  22          2HD       PRO  22  -0.012  12.660  -5.064
  110    H    ASN  23           H        ASN  23   3.268  11.133  -3.447
  111    HA   ASN  23           HA       ASN  23   4.462   8.448  -3.637
  112   1HB   ASN  23          1HB       ASN  23   5.544  10.115  -1.476
  113   2HB   ASN  23          2HB       ASN  23   6.381   9.066  -2.623
  114   1HD2  ASN  23          1HD2      ASN  23   4.671  12.167  -2.481
  115   2HD2  ASN  23          2HD2      ASN  23   5.729  12.997  -3.566
  116    H    ALA  24           H        ALA  24   1.759   9.284  -2.901
  117    HA   ALA  24           HA       ALA  24   1.212   9.376  -0.205
  118   1HB   ALA  24          1HB       ALA  24  -0.397   9.473  -2.186
  119   2HB   ALA  24          2HB       ALA  24  -0.968   8.678  -0.719
  120   3HB   ALA  24          3HB       ALA  24  -0.427   7.712  -2.093
  121    H    VAL  25           H        VAL  25   0.899   7.868   1.435
  122    HA   VAL  25           HA       VAL  25   2.085   5.224   0.913
  123    HB   VAL  25           HB       VAL  25   2.903   5.123   3.089
  124   1HG1  VAL  25          1HG1      VAL  25   4.116   7.220   3.464
  125   2HG1  VAL  25          2HG1      VAL  25   3.060   8.030   2.309
  126   3HG1  VAL  25          3HG1      VAL  25   4.137   6.742   1.767
  127   1HG2  VAL  25          1HG2      VAL  25   2.220   6.937   4.799
  128   2HG2  VAL  25          2HG2      VAL  25   1.106   5.607   4.475
  129   3HG2  VAL  25          3HG2      VAL  25   0.831   7.185   3.739
  130    H    THR  26           H        THR  26  -0.869   6.679   1.414
  131    HA   THR  26           HA       THR  26  -2.212   4.201   1.724
  132    HB   THR  26           HB       THR  26  -3.097   5.746   4.010
  133    HG1  THR  26           HG1      THR  26  -1.228   5.351   5.281
  134   1HG2  THR  26          1HG2      THR  26  -3.217   3.738   5.079
  135   2HG2  THR  26          2HG2      THR  26  -1.795   3.088   4.260
  136   3HG2  THR  26          3HG2      THR  26  -3.329   3.215   3.398
  137    H    CYS  27           H        CYS  27  -4.197   4.364   0.867
  138    HA   CYS  27           HA       CYS  27  -5.689   6.835   1.012
  139   1HB   CYS  27          1HB       CYS  27  -5.965   6.516  -1.651
  140   2HB   CYS  27          2HB       CYS  27  -4.789   7.607  -0.925
  141    H    THR  28           H        THR  28  -7.862   6.600   0.590
  142    HA   THR  28           HA       THR  28  -8.781   3.820   0.365
  143    HB   THR  28           HB       THR  28 -10.995   5.236   1.096
  144    HG1  THR  28           HG1      THR  28 -10.397   6.800   2.544
  145   1HG2  THR  28          1HG2      THR  28  -9.515   4.713   3.484
  146   2HG2  THR  28          2HG2      THR  28  -9.288   3.397   2.332
  147   3HG2  THR  28          3HG2      THR  28 -10.915   3.867   2.825
  148    H    ASN  29           H        ASN  29  -9.364   3.288  -1.653
  149    HA   ASN  29           HA       ASN  29 -10.568   3.274  -3.560
  150   1HB   ASN  29          1HB       ASN  29 -12.012   5.046  -2.099
  151   2HB   ASN  29          2HB       ASN  29 -11.438   6.099  -3.386
  152   1HD2  ASN  29          1HD2      ASN  29 -13.627   3.662  -2.488
  153   2HD2  ASN  29          2HD2      ASN  29 -14.405   3.472  -4.018
  154    H    SER  30           H        SER  30 -10.821   5.651  -5.195
  155    HA   SER  30           HA       SER  30  -9.662   7.084  -6.577
  156   1HB   SER  30          1HB       SER  30  -8.132   7.590  -4.670
  157   2HB   SER  30          2HB       SER  30  -7.140   6.213  -5.142
  158    HG   SER  30           HG       SER  30  -6.551   8.397  -5.966
  159    H    GLN  31           H        GLN  31  -7.532   6.827  -8.120
  160    HA   GLN  31           HA       GLN  31  -7.417   4.047  -9.035
  161   1HB   GLN  31          1HB       GLN  31  -7.618   5.146 -11.432
  162   2HB   GLN  31          2HB       GLN  31  -9.046   4.662 -10.519
  163   1HG   GLN  31          1HG       GLN  31  -9.456   6.916  -9.845
  164   2HG   GLN  31          2HG       GLN  31  -7.918   7.452 -10.520
  165   1HE2  GLN  31          1HE2      GLN  31  -7.717   6.712 -12.938
  166   2HE2  GLN  31          2HE2      GLN  31  -9.076   7.123 -13.922
  167    H    HIS  32           H        HIS  32  -5.318   5.044  -7.754
  168    HA   HIS  32           HA       HIS  32  -3.198   4.763  -9.515
  169   1HB   HIS  32          1HB       HIS  32  -4.272   7.255  -9.914
  170   2HB   HIS  32          2HB       HIS  32  -2.991   7.591  -8.744
  171    HD1  HIS  32           HD1      HIS  32  -0.542   7.112  -9.513
  172    HD2  HIS  32           HD2      HIS  32  -3.417   6.607 -12.470
  173    HE1  HIS  32           HE1      HIS  32   0.733   7.003 -11.676
  174    HE2  HIS  32           HE2      HIS  32  -1.020   6.596 -13.441
  175    H    CYS  33           H        CYS  33  -3.906   3.872  -6.978
  176    HA   CYS  33           HA       CYS  33  -2.029   5.189  -5.152
  177   1HB   CYS  33          1HB       CYS  33  -4.300   3.257  -4.772
  178   2HB   CYS  33          2HB       CYS  33  -3.091   3.484  -3.509
  179    H    VAL  34           H        VAL  34  -0.679   4.019  -7.113
  180    HA   VAL  34           HA       VAL  34  -0.063   1.275  -6.631
  181    HB   VAL  34           HB       VAL  34   1.867   1.709  -8.191
  182   1HG1  VAL  34          1HG1      VAL  34  -0.991   1.838  -8.745
  183   2HG1  VAL  34          2HG1      VAL  34   0.271   0.870  -9.507
  184   3HG1  VAL  34          3HG1      VAL  34   0.000   2.533 -10.027
  185   1HG2  VAL  34          1HG2      VAL  34   2.506   3.794  -8.608
  186   2HG2  VAL  34          2HG2      VAL  34   1.202   4.409  -7.594
  187   3HG2  VAL  34          3HG2      VAL  34   0.929   4.139  -9.315
  188    H    LYS  35           H        LYS  35   0.689   3.915  -4.806
  189    HA   LYS  35           HA       LYS  35   3.138   2.607  -3.845
  190   1HB   LYS  35          1HB       LYS  35   2.728   5.399  -4.700
  191   2HB   LYS  35          2HB       LYS  35   3.573   5.214  -3.169
  192   1HG   LYS  35          1HG       LYS  35   5.108   5.372  -5.060
  193   2HG   LYS  35          2HG       LYS  35   5.246   3.823  -4.225
  194   1HD   LYS  35          1HD       LYS  35   4.484   2.650  -6.000
  195   2HD   LYS  35          2HD       LYS  35   3.331   3.903  -6.464
  196   1HE   LYS  35          1HE       LYS  35   4.990   5.156  -7.579
  197   2HE   LYS  35          2HE       LYS  35   6.295   4.226  -6.842
  198   1HZ   LYS  35          1HZ       LYS  35   4.373   2.770  -8.490
  199   2HZ   LYS  35          2HZ       LYS  35   6.037   2.530  -8.302
  200   3HZ   LYS  35          3HZ       LYS  35   5.469   3.779  -9.292
  201    H    ALA  36           H        ALA  36   0.160   2.827  -3.008
  202    HA   ALA  36           HA       ALA  36   0.505   3.949  -0.329
  203   1HB   ALA  36          1HB       ALA  36  -1.731   3.586  -2.129
  204   2HB   ALA  36          2HB       ALA  36  -1.573   4.644  -0.728
  205   3HB   ALA  36          3HB       ALA  36  -2.085   2.971  -0.515
  206    H    ASN  37           H        ASN  37   0.414   2.745   1.525
  207    HA   ASN  37           HA       ASN  37   1.104  -0.008   1.328
  208   1HB   ASN  37          1HB       ASN  37   0.290   1.539   3.796
  209   2HB   ASN  37          2HB       ASN  37   1.190   0.026   3.751
  210   1HD2  ASN  37          1HD2      ASN  37   1.949   2.540   4.945
  211   2HD2  ASN  37          2HD2      ASN  37   3.422   3.024   4.181
  212    H    THR  38           H        THR  38  -1.886   1.564   1.274
  213    HA   THR  38           HA       THR  38  -3.280  -0.961   1.491
  214    HB   THR  38           HB       THR  38  -4.164   1.305   3.276
  215    HG1  THR  38           HG1      THR  38  -2.257   0.650   4.149
  216   1HG2  THR  38          1HG2      THR  38  -5.782  -0.535   2.579
  217   2HG2  THR  38          2HG2      THR  38  -5.604  -0.208   4.303
  218   3HG2  THR  38          3HG2      THR  38  -4.800  -1.603   3.582
  219    H    CYS  39           H        CYS  39  -5.321  -0.950   0.518
  220    HA   CYS  39           HA       CYS  39  -6.202   1.569  -0.701
  221   1HB   CYS  39          1HB       CYS  39  -5.442  -0.962  -2.107
  222   2HB   CYS  39          2HB       CYS  39  -6.766   0.008  -2.759
  223    H    THR  40           H        THR  40  -8.435   1.603  -1.306
  224    HA   THR  40           HA       THR  40 -10.116  -0.632  -0.533
  225    HB   THR  40           HB       THR  40 -10.870   1.977   0.699
  226    HG1  THR  40           HG1      THR  40  -8.725   1.717   1.363
  227   1HG2  THR  40          1HG2      THR  40 -12.332   0.761   1.827
  228   2HG2  THR  40          2HG2      THR  40 -11.081  -0.362   2.360
  229   3HG2  THR  40          3HG2      THR  40 -11.882  -0.606   0.808
  230    H    GLY  41           H        GLY  41 -10.973  -0.760  -2.580
  231   1HA   GLY  41          1HA       GLY  41 -12.589  -0.236  -4.172
  232   2HA   GLY  41          2HA       GLY  41 -12.937   1.234  -3.270
  233    H    SER  42           H        SER  42  -9.870   0.133  -4.706
  234    HA   SER  42           HA       SER  42 -10.018   2.527  -6.423
  235   1HB   SER  42          1HB       SER  42  -7.302   1.708  -5.632
  236   2HB   SER  42          2HB       SER  42  -8.025   3.314  -5.657
  237    HG   SER  42           HG       SER  42  -8.335   1.341  -3.642
  238    H    THR  43           H        THR  43  -7.394   1.833  -7.605
  239    HA   THR  43           HA       THR  43  -7.895  -0.810  -8.680
  240    HB   THR  43           HB       THR  43  -8.090  -0.235 -10.896
  241    HG1  THR  43           HG1      THR  43  -7.318   1.562 -11.781
  242   1HG2  THR  43          1HG2      THR  43 -10.152   0.320  -9.958
  243   2HG2  THR  43          2HG2      THR  43  -9.745   1.666 -11.025
  244   3HG2  THR  43          3HG2      THR  43  -9.539   1.828  -9.277
  245    H    ASP  44           H        ASP  44  -5.805   1.820  -9.760
  246    HA   ASP  44           HA       ASP  44  -3.531   0.225 -10.071
  247   1HB   ASP  44          1HB       ASP  44  -4.139   3.121 -10.119
  248   2HB   ASP  44          2HB       ASP  44  -2.469   2.703  -9.752
  249    H    CYS  45           H        CYS  45  -3.551  -0.943  -8.111
  250    HA   CYS  45           HA       CYS  45  -2.177   0.440  -5.901
  251   1HB   CYS  45          1HB       CYS  45  -4.478  -1.510  -5.730
  252   2HB   CYS  45          2HB       CYS  45  -3.477  -1.068  -4.345
  253    H    ASN  46           H        ASN  46  -0.276  -0.481  -6.951
  254    HA   ASN  46           HA       ASN  46   0.037  -3.337  -7.008
  255   1HB   ASN  46          1HB       ASN  46   1.140  -1.973  -8.691
  256   2HB   ASN  46          2HB       ASN  46   2.031  -1.105  -7.438
  257   1HD2  ASN  46          1HD2      ASN  46   2.361  -3.353  -9.730
  258   2HD2  ASN  46          2HD2      ASN  46   3.631  -4.310  -9.055
  259    H    THR  47           H        THR  47   1.267  -0.681  -4.955
  260    HA   THR  47           HA       THR  47   2.626  -2.640  -3.278
  261    HB   THR  47           HB       THR  47   3.476  -0.253  -4.006
  262    HG1  THR  47           HG1      THR  47   4.966  -0.977  -2.752
  263   1HG2  THR  47          1HG2      THR  47   2.103   0.383  -1.406
  264   2HG2  THR  47          2HG2      THR  47   1.650   1.022  -2.986
  265   3HG2  THR  47          3HG2      THR  47   3.220   1.424  -2.289
  266    H    ALA  48           H        ALA  48  -0.475  -1.773  -3.455
  267    HA   ALA  48           HA       ALA  48  -1.132  -1.027  -0.802
  268   1HB   ALA  48          1HB       ALA  48  -2.802  -2.362  -2.924
  269   2HB   ALA  48          2HB       ALA  48  -2.688  -0.634  -2.592
  270   3HB   ALA  48          3HB       ALA  48  -3.428  -1.711  -1.409
  271    H    GLN  49           H        GLN  49  -1.649  -2.202   0.975
  272    HA   GLN  49           HA       GLN  49  -0.853  -5.001   0.954
  273   1HB   GLN  49          1HB       GLN  49  -0.163  -3.248   2.717
  274   2HB   GLN  49          2HB       GLN  49  -1.781  -3.465   3.368
  275   1HG   GLN  49          1HG       GLN  49  -0.836  -5.059   4.610
  276   2HG   GLN  49          2HG       GLN  49  -0.953  -6.038   3.149
  277   1HE2  GLN  49          1HE2      GLN  49   0.982  -5.454   1.584
  278   2HE2  GLN  49          2HE2      GLN  49   2.536  -5.550   2.333
  279    H    THR  50           H        THR  50  -3.666  -3.430   0.319
  280    HA   THR  50           HA       THR  50  -5.245  -5.728   0.443
  281    HB   THR  50           HB       THR  50  -4.940  -4.948   2.947
  282    HG1  THR  50           HG1      THR  50  -6.271  -6.592   2.744
  283   1HG2  THR  50          1HG2      THR  50  -5.880  -2.643   2.251
  284   2HG2  THR  50          2HG2      THR  50  -6.384  -3.380   3.776
  285   3HG2  THR  50          3HG2      THR  50  -7.442  -3.457   2.364
  286    H    CYS  51           H        CYS  51  -7.444  -5.350  -0.252
  287    HA   CYS  51           HA       CYS  51  -8.453  -2.771  -0.829
  288   1HB   CYS  51          1HB       CYS  51  -8.354  -3.555  -3.472
  289   2HB   CYS  51          2HB       CYS  51  -7.331  -2.329  -2.727
  290    H    THR  52           H        THR  52 -10.379  -3.061  -2.544
  291    HA   THR  52           HA       THR  52 -11.549  -5.720  -2.290
  292    HB   THR  52           HB       THR  52 -12.181  -4.433  -0.249
  293    HG1  THR  52           HG1      THR  52 -13.729  -5.828  -0.500
  294   1HG2  THR  52          1HG2      THR  52 -12.759  -2.369  -2.078
  295   2HG2  THR  52          2HG2      THR  52 -12.944  -2.369  -0.324
  296   3HG2  THR  52          3HG2      THR  52 -14.283  -2.880  -1.353
  297    H    ASN  53           H        ASN  53 -10.707  -3.668  -4.448
  298    HA   ASN  53           HA       ASN  53 -12.463  -4.436  -6.427
  299   1HB   ASN  53          1HB       ASN  53 -13.541  -2.292  -4.774
  300   2HB   ASN  53          2HB       ASN  53 -13.440  -1.827  -6.474
  301   1HD2  ASN  53          1HD2      ASN  53 -14.128  -3.801  -7.940
  302   2HD2  ASN  53          2HD2      ASN  53 -15.657  -4.483  -7.516
  303    H    SER  54           H        SER  54  -9.713  -3.955  -6.156
  304    HA   SER  54           HA       SER  54  -9.245  -1.608  -7.855
  305   1HB   SER  54          1HB       SER  54  -6.897  -3.111  -6.912
  306   2HB   SER  54          2HB       SER  54  -7.216  -1.374  -6.894
  307    HG   SER  54           HG       SER  54  -8.690  -1.861  -5.108
  308    H    LYS  55           H        LYS  55  -6.977  -2.228  -9.166
  309    HA   LYS  55           HA       LYS  55  -7.520  -4.702 -10.647
  310   1HB   LYS  55          1HB       LYS  55  -7.338  -1.905 -11.719
  311   2HB   LYS  55          2HB       LYS  55  -6.862  -3.269 -12.727
  312   1HG   LYS  55          1HG       LYS  55  -8.978  -3.904 -13.087
  313   2HG   LYS  55          2HG       LYS  55  -9.462  -3.593 -11.419
  314   1HD   LYS  55          1HD       LYS  55  -8.977  -1.070 -12.462
  315   2HD   LYS  55          2HD       LYS  55  -9.761  -1.935 -13.784
  316   1HE   LYS  55          1HE       LYS  55 -10.794  -1.413 -11.013
  317   2HE   LYS  55          2HE       LYS  55 -11.509  -0.949 -12.556
  318   1HZ   LYS  55          1HZ       LYS  55 -11.534  -3.537 -12.886
  319   2HZ   LYS  55          2HZ       LYS  55 -12.775  -2.751 -12.047
  320   3HZ   LYS  55          3HZ       LYS  55 -11.546  -3.538 -11.194
  321    H    ASP  56           H        ASP  56  -5.427  -3.570  -8.697
  322    HA   ASP  56           HA       ASP  56  -3.158  -4.667 -10.116
  323   1HB   ASP  56          1HB       ASP  56  -3.490  -1.854  -9.853
  324   2HB   ASP  56          2HB       ASP  56  -2.163  -2.340  -8.795
  325    H    CYS  57           H        CYS  57  -4.934  -5.154  -7.691
  326    HA   CYS  57           HA       CYS  57  -3.413  -4.816  -5.349
  327   1HB   CYS  57          1HB       CYS  57  -5.538  -6.862  -6.015
  328   2HB   CYS  57          2HB       CYS  57  -4.893  -6.577  -4.399
  329    H    PHE  58           H        PHE  58  -1.324  -5.467  -6.501
  330    HA   PHE  58           HA       PHE  58  -0.838  -8.261  -6.892
  331   1HB   PHE  58          1HB       PHE  58   1.027  -5.889  -6.731
  332   2HB   PHE  58          2HB       PHE  58   1.554  -7.526  -7.101
  333    HD1  PHE  58           HD1      PHE  58   0.110  -8.642  -9.041
  334    HD2  PHE  58           HD2      PHE  58   0.756  -4.486  -8.432
  335    HE1  PHE  58           HE1      PHE  58  -0.292  -8.231 -11.427
  336    HE2  PHE  58           HE2      PHE  58   0.350  -4.066 -10.812
  337    HZ   PHE  58           HZ       PHE  58  -0.162  -5.944 -12.279
  338    H    GLU  59           H        GLU  59   0.360  -5.906  -4.493
  339    HA   GLU  59           HA       GLU  59   1.127  -8.140  -2.761
  340   1HB   GLU  59          1HB       GLU  59   1.890  -5.231  -2.833
  341   2HB   GLU  59          2HB       GLU  59   2.225  -6.234  -1.422
  342   1HG   GLU  59          1HG       GLU  59   3.853  -7.411  -2.471
  343   2HG   GLU  59          2HG       GLU  59   3.089  -7.272  -4.054
  344    H    ALA  60           H        ALA  60  -1.647  -7.541  -3.034
  345    HA   ALA  60           HA       ALA  60  -2.395  -6.097  -0.624
  346   1HB   ALA  60          1HB       ALA  60  -4.745  -6.855  -1.408
  347   2HB   ALA  60          2HB       ALA  60  -3.916  -7.279  -2.909
  348   3HB   ALA  60          3HB       ALA  60  -3.886  -5.614  -2.326
  349    H    ASN  61           H        ASN  61  -3.815  -7.037   0.965
  350    HA   ASN  61           HA       ASN  61  -3.032  -9.771   1.597
  351   1HB   ASN  61          1HB       ASN  61  -2.808  -7.980   3.309
  352   2HB   ASN  61          2HB       ASN  61  -4.557  -7.780   3.286
  353   1HD2  ASN  61          1HD2      ASN  61  -1.934  -9.531   4.535
  354   2HD2  ASN  61          2HD2      ASN  61  -2.833 -10.684   5.454
  355    H    THR  62           H        THR  62  -5.976  -7.826   1.140
  356    HA   THR  62           HA       THR  62  -7.457 -10.368   0.904
  357    HB   THR  62           HB       THR  62  -8.082  -8.988   2.902
  358    HG1  THR  62           HG1      THR  62 -10.026  -9.456   0.901
  359   1HG2  THR  62          1HG2      THR  62  -9.815  -7.173   1.504
  360   2HG2  THR  62          2HG2      THR  62  -8.123  -6.848   1.127
  361   3HG2  THR  62          3HG2      THR  62  -8.667  -6.860   2.805
  362    H    CYS  63           H        CYS  63  -6.860 -10.352  -1.338
  363    HA   CYS  63           HA       CYS  63  -7.670  -8.253  -3.077
  364   1HB   CYS  63          1HB       CYS  63  -6.497 -10.950  -3.348
  365   2HB   CYS  63          2HB       CYS  63  -7.461 -10.412  -4.725
  366    H    THR  64           H        THR  64  -9.887  -8.103  -2.125
  367    HA   THR  64           HA       THR  64 -11.744 -10.138  -3.067
  368    HB   THR  64           HB       THR  64 -11.965  -7.791  -1.196
  369    HG1  THR  64           HG1      THR  64 -12.248 -10.590  -0.957
  370   1HG2  THR  64          1HG2      THR  64 -14.115  -9.044  -2.696
  371   2HG2  THR  64          2HG2      THR  64 -14.086  -7.536  -1.784
  372   3HG2  THR  64          3HG2      THR  64 -14.351  -9.067  -0.949
  373    H    ASP  65           H        ASP  65 -12.669  -9.919  -4.995
  374    HA   ASP  65           HA       ASP  65 -13.540  -9.016  -6.891
  375   1HB   ASP  65          1HB       ASP  65 -14.067  -6.874  -4.868
  376   2HB   ASP  65          2HB       ASP  65 -14.338  -6.513  -6.574
  377    H    SER  66           H        SER  66 -10.742  -8.972  -6.524
  378    HA   SER  66           HA       SER  66 -10.053  -6.653  -8.192
  379   1HB   SER  66          1HB       SER  66  -7.856  -6.517  -7.018
  380   2HB   SER  66          2HB       SER  66  -9.227  -6.144  -5.966
  381    HG   SER  66           HG       SER  66  -8.697  -7.777  -4.766
  382    H    THR  67           H        THR  67  -8.726  -7.069  -9.888
  383    HA   THR  67           HA       THR  67  -7.945  -9.871 -10.269
  384    HB   THR  67           HB       THR  67  -9.243  -9.519 -12.101
  385    HG1  THR  67           HG1      THR  67  -7.929  -9.410 -13.754
  386   1HG2  THR  67          1HG2      THR  67  -9.627  -7.417 -13.235
  387   2HG2  THR  67          2HG2      THR  67  -8.471  -6.618 -12.170
  388   3HG2  THR  67          3HG2      THR  67  -9.967  -7.277 -11.511
  389    H    ASN  68           H        ASN  68  -5.913 -10.380 -11.210
  390    HA   ASN  68           HA       ASN  68  -3.703 -10.076 -11.743
  391   1HB   ASN  68          1HB       ASN  68  -4.706  -7.552 -12.267
  392   2HB   ASN  68          2HB       ASN  68  -3.433  -7.232 -11.085
  393   1HD2  ASN  68          1HD2      ASN  68  -3.792  -9.545 -13.760
  394   2HD2  ASN  68          2HD2      ASN  68  -2.320  -9.113 -14.555
  395    H    CYS  69           H        CYS  69  -4.618 -10.824  -9.190
  396    HA   CYS  69           HA       CYS  69  -3.028  -9.402  -7.237
  397   1HB   CYS  69          1HB       CYS  69  -5.335 -10.586  -6.885
  398   2HB   CYS  69          2HB       CYS  69  -4.348 -12.038  -6.692
  399    H    TYR  70           H        TYR  70  -1.307 -10.306  -6.037
  400    HA   TYR  70           HA       TYR  70   0.066 -12.510  -7.428
  401   1HB   TYR  70          1HB       TYR  70   1.003  -9.880  -6.469
  402   2HB   TYR  70          2HB       TYR  70   2.082 -11.234  -6.121
  403    HD1  TYR  70           HD1      TYR  70   0.015 -11.451  -9.106
  404    HD2  TYR  70           HD2      TYR  70   3.769 -10.153  -7.579
  405    HE1  TYR  70           HE1      TYR  70   0.898 -11.332 -11.396
  406    HE2  TYR  70           HE2      TYR  70   4.661 -10.029  -9.867
  407    HH   TYR  70           HH       TYR  70   3.509  -9.690 -12.278
  408    H    LYS  71           H        LYS  71  -1.428 -13.683  -5.790
  409    HA   LYS  71           HA       LYS  71  -1.471 -15.157  -4.062
  410   1HB   LYS  71          1HB       LYS  71   1.321 -14.579  -4.393
  411   2HB   LYS  71          2HB       LYS  71   0.962 -14.759  -2.677
  412   1HG   LYS  71          1HG       LYS  71  -0.314 -16.823  -4.246
  413   2HG   LYS  71          2HG       LYS  71   1.430 -16.785  -4.513
  414   1HD   LYS  71          1HD       LYS  71   0.965 -18.270  -2.682
  415   2HD   LYS  71          2HD       LYS  71   1.752 -16.823  -2.049
  416   1HE   LYS  71          1HE       LYS  71  -0.078 -17.436  -0.604
  417   2HE   LYS  71          2HE       LYS  71  -0.464 -15.927  -1.430
  418   1HZ   LYS  71          1HZ       LYS  71  -2.357 -17.412  -1.415
  419   2HZ   LYS  71          2HZ       LYS  71  -1.459 -18.625  -2.179
  420   3HZ   LYS  71          3HZ       LYS  71  -1.812 -17.190  -3.001
  421    H    ALA  72           H        ALA  72  -3.099 -13.747  -3.175
  422    HA   ALA  72           HA       ALA  72  -2.198 -12.106  -0.909
  423   1HB   ALA  72          1HB       ALA  72  -4.509 -11.996  -2.727
  424   2HB   ALA  72          2HB       ALA  72  -3.628 -10.694  -1.931
  425   3HB   ALA  72          3HB       ALA  72  -4.846 -11.609  -1.042
  426    H    THR  73           H        THR  73  -4.236 -12.116   0.805
  427    HA   THR  73           HA       THR  73  -4.210 -14.862   1.789
  428    HB   THR  73           HB       THR  73  -4.648 -14.016   3.914
  429    HG1  THR  73           HG1      THR  73  -6.465 -12.810   3.552
  430   1HG2  THR  73          1HG2      THR  73  -3.334 -11.586   2.761
  431   2HG2  THR  73          2HG2      THR  73  -2.485 -13.122   2.935
  432   3HG2  THR  73          3HG2      THR  73  -3.129 -12.304   4.358
  433    H    ALA  74           H        ALA  74  -6.388 -12.629   0.313
  434    HA   ALA  74           HA       ALA  74  -8.556 -14.583   0.667
  435   1HB   ALA  74          1HB       ALA  74 -10.167 -12.930   1.138
  436   2HB   ALA  74          2HB       ALA  74  -9.062 -11.621   0.716
  437   3HB   ALA  74          3HB       ALA  74  -8.793 -12.565   2.182
  438    H    CYS  75           H        CYS  75  -9.753 -15.006  -1.120
  439    HA   CYS  75           HA       CYS  75  -9.487 -13.265  -3.455
  440   1HB   CYS  75          1HB       CYS  75  -9.196 -16.232  -3.810
  441   2HB   CYS  75          2HB       CYS  75  -8.758 -14.937  -4.921
  442    H    THR  76           H        THR  76 -11.607 -12.691  -3.568
  443    HA   THR  76           HA       THR  76 -13.585 -14.871  -3.675
  444    HB   THR  76           HB       THR  76 -14.009 -13.239  -1.893
  445    HG1  THR  76           HG1      THR  76 -15.823 -13.070  -4.064
  446   1HG2  THR  76          1HG2      THR  76 -13.793 -11.055  -2.115
  447   2HG2  THR  76          2HG2      THR  76 -14.908 -11.035  -3.482
  448   3HG2  THR  76          3HG2      THR  76 -13.189 -11.323  -3.749
  449    H    ASN  77           H        ASN  77 -12.714 -15.143  -5.898
  450    HA   ASN  77           HA       ASN  77 -13.233 -15.126  -8.124
  451   1HB   ASN  77          1HB       ASN  77 -14.992 -12.712  -7.685
  452   2HB   ASN  77          2HB       ASN  77 -15.065 -13.892  -8.997
  453   1HD2  ASN  77          1HD2      ASN  77 -17.358 -13.411  -7.820
  454   2HD2  ASN  77          2HD2      ASN  77 -17.826 -14.689  -6.756
  455    H    SER  78           H        SER  78 -10.908 -14.359  -7.801
  456    HA   SER  78           HA       SER  78 -10.589 -11.678  -8.987
  457   1HB   SER  78          1HB       SER  78  -9.501 -11.437  -6.965
  458   2HB   SER  78          2HB       SER  78  -9.029 -13.139  -6.898
  459    HG   SER  78           HG       SER  78  -7.386 -11.382  -7.424
  460    H    SER  79           H        SER  79  -8.389 -11.520 -10.176
  461    HA   SER  79           HA       SER  79  -8.322 -13.697 -12.103
  462   1HB   SER  79          1HB       SER  79  -8.464 -11.661 -13.224
  463   2HB   SER  79          2HB       SER  79  -7.351 -10.870 -12.113
  464    HG   SER  79           HG       SER  79  -5.653 -11.929 -13.067
  465    H    GLY  80           H        GLY  80  -6.050 -11.898 -10.044
  466   1HA   GLY  80          1HA       GLY  80  -3.983 -13.881 -10.656
  467   2HA   GLY  80          2HA       GLY  80  -3.725 -12.342  -9.848
  468    H    CYS  81           H        CYS  81  -6.229 -13.117  -8.182
  469    HA   CYS  81           HA       CYS  81  -4.701 -14.344  -6.056
  470   1HB   CYS  81          1HB       CYS  81  -6.514 -12.422  -5.953
  471   2HB   CYS  81          2HB       CYS  81  -7.622 -13.786  -5.808
  472    HA   PRO  82           HA       PRO  82  -6.046 -18.463  -7.224
  473   1HB   PRO  82          1HB       PRO  82  -5.017 -19.188  -4.550
  474   2HB   PRO  82          2HB       PRO  82  -4.556 -19.806  -6.142
  475   1HG   PRO  82          1HG       PRO  82  -2.943 -18.179  -4.750
  476   2HG   PRO  82          2HG       PRO  82  -3.053 -18.093  -6.519
  477   1HD   PRO  82          1HD       PRO  82  -4.281 -16.312  -4.451
  478   2HD   PRO  82          2HD       PRO  82  -3.547 -15.889  -6.013
  479    H    GLY  83           H        GLY  83  -6.285 -17.984  -3.694
  480   1HA   GLY  83          1HA       GLY  83  -8.404 -17.611  -2.592
  481   2HA   GLY  83          2HA       GLY  83  -9.184 -18.478  -3.907
  482    H    HIS  84           H        HIS  84 -10.205 -19.670  -2.134
  483    HA   HIS  84           HA       HIS  84  -8.616 -21.386  -0.484
  484   1HB   HIS  84          1HB       HIS  84 -11.356 -20.598  -0.644
  485   2HB   HIS  84          2HB       HIS  84 -11.290 -22.356  -0.660
  486    HD1  HIS  84           HD1      HIS  84 -11.274 -23.383   1.587
  487    HD2  HIS  84           HD2      HIS  84  -9.706 -19.534   1.638
  488    HE1  HIS  84           HE1      HIS  84 -10.763 -22.896   4.001
  489    HE2  HIS  84           HE2      HIS  84  -9.853 -20.547   4.014
  Start of MODEL   18
    1   1H    GLN   1          1H        GLN   1  -7.640  18.649   6.534
    2   2H    GLN   1          2H        GLN   1  -6.294  18.777   5.477
    3   3H    GLN   1          3H        GLN   1  -7.253  17.354   5.481
    4    HA   GLN   1           HA       GLN   1  -9.048  18.414   4.530
    5   1HB   GLN   1          1HB       GLN   1  -9.114  20.840   4.217
    6   2HB   GLN   1          2HB       GLN   1  -8.902  20.437   5.916
    7   1HG   GLN   1          1HG       GLN   1  -6.955  21.502   6.036
    8   2HG   GLN   1          2HG       GLN   1  -6.376  20.793   4.529
    9   1HE2  GLN   1          1HE2      GLN   1  -6.270  22.038   2.779
   10   2HE2  GLN   1          2HE2      GLN   1  -6.917  23.635   2.648
   11    H    CYS   2           H        CYS   2  -7.502  16.919   3.220
   12    HA   CYS   2           HA       CYS   2  -6.441  18.484   0.960
   13   1HB   CYS   2          1HB       CYS   2  -5.104  16.579   2.603
   14   2HB   CYS   2          2HB       CYS   2  -5.275  15.878   0.998
   15    H    THR   3           H        THR   3  -8.057  18.371  -0.496
   16    HA   THR   3           HA       THR   3  -8.739  15.728  -1.526
   17    HB   THR   3           HB       THR   3 -11.190  16.777  -1.696
   18    HG1  THR   3           HG1      THR   3 -10.404  18.663  -0.490
   19   1HG2  THR   3          1HG2      THR   3 -10.563  14.629  -0.600
   20   2HG2  THR   3          2HG2      THR   3 -11.886  15.498   0.177
   21   3HG2  THR   3          3HG2      THR   3 -10.270  15.540   0.882
   22    H    GLY   4           H        GLY   4  -9.179  15.693  -3.705
   23   1HA   GLY   4          1HA       GLY   4  -9.197  18.296  -5.096
   24   2HA   GLY   4          2HA       GLY   4  -8.106  17.011  -5.607
   25    H    GLY   5           H        GLY   5  -9.827  14.812  -5.357
   26   1HA   GLY   5          1HA       GLY   5 -11.888  13.962  -6.194
   27   2HA   GLY   5          2HA       GLY   5 -12.100  15.453  -7.100
   28    H    ALA   6           H        ALA   6  -9.367  15.429  -8.138
   29    HA   ALA   6           HA       ALA   6  -9.183  13.001  -9.714
   30   1HB   ALA   6          1HB       ALA   6  -9.192  15.414 -11.404
   31   2HB   ALA   6          2HB       ALA   6 -10.758  14.926 -10.755
   32   3HB   ALA   6          3HB       ALA   6  -9.816  13.796 -11.728
   33    H    ASP   7           H        ASP   7  -8.015  16.353  -9.435
   34    HA   ASP   7           HA       ASP   7  -5.299  15.398 -10.004
   35   1HB   ASP   7          1HB       ASP   7  -6.308  17.317 -11.334
   36   2HB   ASP   7          2HB       ASP   7  -6.203  18.276  -9.855
   37    H    CYS   8           H        CYS   8  -3.735  15.437  -8.500
   38    HA   CYS   8           HA       CYS   8  -4.366  16.694  -5.908
   39   1HB   CYS   8          1HB       CYS   8  -3.233  14.014  -6.572
   40   2HB   CYS   8          2HB       CYS   8  -2.688  14.811  -5.094
   41    H    THR   9           H        THR   9  -2.816  17.890  -4.921
   42    HA   THR   9           HA       THR   9  -0.075  17.858  -5.789
   43    HB   THR   9           HB       THR   9  -1.003  19.238  -7.556
   44    HG1  THR   9           HG1      THR   9   0.947  20.005  -6.973
   45   1HG2  THR   9          1HG2      THR   9  -2.319  21.105  -7.297
   46   2HG2  THR   9          2HG2      THR   9  -1.887  21.306  -5.599
   47   3HG2  THR   9          3HG2      THR   9  -2.983  20.012  -6.083
   48    H    SER  10           H        SER  10   1.187  18.344  -4.120
   49    HA   SER  10           HA       SER  10   1.966  19.382  -2.226
   50   1HB   SER  10          1HB       SER  10  -0.682  20.632  -1.605
   51   2HB   SER  10          2HB       SER  10   0.944  21.240  -1.294
   52    HG   SER  10           HG       SER  10  -0.652  21.551  -3.494
   53    H    CYS  11           H        CYS  11  -0.810  17.417  -2.448
   54    HA   CYS  11           HA       CYS  11  -1.074  16.971   0.396
   55   1HB   CYS  11          1HB       CYS  11  -2.322  15.588  -1.987
   56   2HB   CYS  11          2HB       CYS  11  -2.697  15.202  -0.311
   57    H    THR  12           H        THR  12   0.028  15.527   1.560
   58    HA   THR  12           HA       THR  12   1.271  13.249   0.190
   59    HB   THR  12           HB       THR  12   3.361  13.567   1.368
   60    HG1  THR  12           HG1      THR  12   2.640  14.529   3.256
   61   1HG2  THR  12          1HG2      THR  12   4.203  15.059  -0.048
   62   2HG2  THR  12          2HG2      THR  12   3.138  16.342   0.528
   63   3HG2  THR  12          3HG2      THR  12   2.560  15.191  -0.678
   64    H    GLY  13           H        GLY  13  -1.102  13.560   1.907
   65   1HA   GLY  13          1HA       GLY  13  -0.242  11.838   4.150
   66   2HA   GLY  13          2HA       GLY  13  -1.560  12.994   4.277
   67    H    ALA  14           H        ALA  14  -3.456  12.007   4.344
   68    HA   ALA  14           HA       ALA  14  -3.816   9.359   3.271
   69   1HB   ALA  14          1HB       ALA  14  -5.934  11.163   4.425
   70   2HB   ALA  14          2HB       ALA  14  -4.851  10.176   5.407
   71   3HB   ALA  14          3HB       ALA  14  -5.970   9.406   4.282
   72    H    CYS  15           H        CYS  15  -4.122   9.060   1.164
   73    HA   CYS  15           HA       CYS  15  -5.294  11.141  -0.478
   74   1HB   CYS  15          1HB       CYS  15  -3.810   8.615  -0.964
   75   2HB   CYS  15          2HB       CYS  15  -4.938   9.122  -2.216
   76    H    THR  16           H        THR  16  -7.186  10.971  -1.663
   77    HA   THR  16           HA       THR  16  -8.929   8.674  -1.127
   78    HB   THR  16           HB       THR  16 -10.776  10.027  -0.488
   79    HG1  THR  16           HG1      THR  16  -9.175  12.211  -1.302
   80   1HG2  THR  16          1HG2      THR  16  -8.926   9.766   1.247
   81   2HG2  THR  16          2HG2      THR  16 -10.142  11.014   1.520
   82   3HG2  THR  16          3HG2      THR  16  -8.547  11.454   0.907
   83    H    GLY  17           H        GLY  17 -11.209   9.982  -2.430
   84   1HA   GLY  17          1HA       GLY  17 -10.883   9.170  -5.047
   85   2HA   GLY  17          2HA       GLY  17 -12.063  10.377  -4.534
   86    H    CYS  18           H        CYS  18  -8.895   9.842  -5.887
   87    HA   CYS  18           HA       CYS  18  -8.934  12.532  -7.005
   88   1HB   CYS  18          1HB       CYS  18  -7.698  12.659  -4.842
   89   2HB   CYS  18          2HB       CYS  18  -6.545  11.485  -5.471
   90    H    GLY  19           H        GLY  19  -6.259  10.222  -6.728
   91   1HA   GLY  19          1HA       GLY  19  -6.316   8.621  -8.815
   92   2HA   GLY  19          2HA       GLY  19  -6.080  10.158  -9.644
   93    H    ASN  20           H        ASN  20  -4.086  11.199  -9.517
   94    HA   ASN  20           HA       ASN  20  -1.881   9.448  -8.877
   95   1HB   ASN  20          1HB       ASN  20  -1.483  10.588 -10.856
   96   2HB   ASN  20          2HB       ASN  20  -2.154  12.098 -10.250
   97   1HD2  ASN  20          1HD2      ASN  20   0.550   9.862  -9.783
   98   2HD2  ASN  20          2HD2      ASN  20   1.716  11.077  -9.398
   99    H    CYS  21           H        CYS  21  -0.813   9.409  -7.050
  100    HA   CYS  21           HA       CYS  21  -0.922  11.761  -5.276
  101   1HB   CYS  21          1HB       CYS  21  -1.049   8.826  -4.573
  102   2HB   CYS  21          2HB       CYS  21  -0.668  10.073  -3.384
  103    HA   PRO  22           HA       PRO  22   3.476  11.500  -5.361
  104   1HB   PRO  22          1HB       PRO  22   4.098  13.006  -3.200
  105   2HB   PRO  22          2HB       PRO  22   3.454  13.686  -4.693
  106   1HG   PRO  22          1HG       PRO  22   2.124  13.257  -2.089
  107   2HG   PRO  22          2HG       PRO  22   1.784  14.457  -3.343
  108   1HD   PRO  22          1HD       PRO  22   0.369  12.060  -2.852
  109   2HD   PRO  22          2HD       PRO  22   0.175  13.144  -4.240
  110    H    ASN  23           H        ASN  23   3.345  11.771  -1.870
  111    HA   ASN  23           HA       ASN  23   4.538   9.090  -1.685
  112   1HB   ASN  23          1HB       ASN  23   5.042  11.651  -0.235
  113   2HB   ASN  23          2HB       ASN  23   5.281  10.136   0.640
  114   1HD2  ASN  23          1HD2      ASN  23   5.776  10.301  -2.790
  115   2HD2  ASN  23          2HD2      ASN  23   7.500  10.192  -2.752
  116    H    ALA  24           H        ALA  24   1.815   9.327  -1.835
  117    HA   ALA  24           HA       ALA  24   0.570   9.395   0.729
  118   1HB   ALA  24          1HB       ALA  24  -0.600   9.865  -1.412
  119   2HB   ALA  24          2HB       ALA  24  -1.424   8.684  -0.395
  120   3HB   ALA  24          3HB       ALA  24  -0.498   8.147  -1.796
  121    H    VAL  25           H        VAL  25   0.290   7.839   2.194
  122    HA   VAL  25           HA       VAL  25   1.461   5.219   1.672
  123    HB   VAL  25           HB       VAL  25   2.094   6.398   3.738
  124   1HG1  VAL  25          1HG1      VAL  25  -0.449   5.888   5.104
  125   2HG1  VAL  25          2HG1      VAL  25  -0.513   7.163   3.887
  126   3HG1  VAL  25          3HG1      VAL  25   0.643   7.268   5.213
  127   1HG2  VAL  25          1HG2      VAL  25   2.277   4.022   3.783
  128   2HG2  VAL  25          2HG2      VAL  25   0.549   3.835   4.077
  129   3HG2  VAL  25          3HG2      VAL  25   1.584   4.524   5.327
  130    H    THR  26           H        THR  26  -1.628   6.730   2.177
  131    HA   THR  26           HA       THR  26  -2.921   4.124   1.777
  132    HB   THR  26           HB       THR  26  -4.405   6.040   3.463
  133    HG1  THR  26           HG1      THR  26  -2.148   4.660   4.484
  134   1HG2  THR  26          1HG2      THR  26  -5.301   4.196   4.452
  135   2HG2  THR  26          2HG2      THR  26  -3.840   3.232   4.238
  136   3HG2  THR  26          3HG2      THR  26  -4.906   3.535   2.865
  137    H    CYS  27           H        CYS  27  -4.640   4.125   0.409
  138    HA   CYS  27           HA       CYS  27  -5.520   6.732  -0.638
  139   1HB   CYS  27          1HB       CYS  27  -4.576   4.307  -2.101
  140   2HB   CYS  27          2HB       CYS  27  -5.877   5.261  -2.821
  141    H    THR  28           H        THR  28  -7.606   7.047  -0.333
  142    HA   THR  28           HA       THR  28  -9.351   4.746   0.142
  143    HB   THR  28           HB       THR  28 -10.364   7.524   0.437
  144    HG1  THR  28           HG1      THR  28  -8.403   7.830   1.386
  145   1HG2  THR  28          1HG2      THR  28 -11.680   5.495   1.069
  146   2HG2  THR  28          2HG2      THR  28 -11.474   6.686   2.354
  147   3HG2  THR  28          3HG2      THR  28 -10.503   5.214   2.351
  148    H    ASN  29           H        ASN  29  -9.546   4.095  -2.044
  149    HA   ASN  29           HA       ASN  29 -10.821   3.881  -3.893
  150   1HB   ASN  29          1HB       ASN  29 -12.318   5.726  -2.469
  151   2HB   ASN  29          2HB       ASN  29 -11.997   6.556  -3.993
  152   1HD2  ASN  29          1HD2      ASN  29 -13.518   3.827  -2.472
  153   2HD2  ASN  29          2HD2      ASN  29 -14.494   3.364  -3.820
  154    H    SER  30           H        SER  30 -11.231   5.354  -5.951
  155    HA   SER  30           HA       SER  30 -10.383   6.669  -7.648
  156   1HB   SER  30          1HB       SER  30  -9.221   7.883  -5.482
  157   2HB   SER  30          2HB       SER  30  -7.812   7.356  -6.401
  158    HG   SER  30           HG       SER  30  -9.979   8.874  -7.432
  159    H    GLN  31           H        GLN  31  -7.801   6.874  -8.591
  160    HA   GLN  31           HA       GLN  31  -6.790   4.120  -8.676
  161   1HB   GLN  31          1HB       GLN  31  -6.427   4.902 -11.267
  162   2HB   GLN  31          2HB       GLN  31  -7.761   3.898 -10.702
  163   1HG   GLN  31          1HG       GLN  31  -8.120   6.834 -10.573
  164   2HG   GLN  31          2HG       GLN  31  -8.114   6.084 -12.168
  165   1HE2  GLN  31          1HE2      GLN  31 -10.258   6.436 -12.585
  166   2HE2  GLN  31          2HE2      GLN  31 -11.533   5.634 -11.737
  167    H    HIS  32           H        HIS  32  -4.776   4.390 -10.475
  168    HA   HIS  32           HA       HIS  32  -2.597   5.019 -10.627
  169   1HB   HIS  32          1HB       HIS  32  -4.023   7.631 -10.257
  170   2HB   HIS  32          2HB       HIS  32  -2.259   7.593 -10.332
  171    HD1  HIS  32           HD1      HIS  32  -5.099   6.134 -12.423
  172    HD2  HIS  32           HD2      HIS  32  -1.405   7.985 -12.857
  173    HE1  HIS  32           HE1      HIS  32  -4.736   6.337 -14.902
  174    HE2  HIS  32           HE2      HIS  32  -2.457   7.385 -15.142
  175    H    CYS  33           H        CYS  33  -3.709   4.257  -7.968
  176    HA   CYS  33           HA       CYS  33  -1.850   5.697  -6.205
  177   1HB   CYS  33          1HB       CYS  33  -4.415   4.235  -5.758
  178   2HB   CYS  33          2HB       CYS  33  -3.227   4.248  -4.452
  179    H    VAL  34           H        VAL  34  -0.810   3.857  -8.044
  180    HA   VAL  34           HA       VAL  34  -0.469   1.253  -7.121
  181    HB   VAL  34           HB       VAL  34   1.738   1.352  -8.402
  182   1HG1  VAL  34          1HG1      VAL  34  -0.798   0.934  -9.214
  183   2HG1  VAL  34          2HG1      VAL  34   0.607   0.793 -10.270
  184   3HG1  VAL  34          3HG1      VAL  34  -0.347   2.277 -10.264
  185   1HG2  VAL  34          1HG2      VAL  34   1.534   4.027  -8.090
  186   2HG2  VAL  34          2HG2      VAL  34   0.842   3.838  -9.701
  187   3HG2  VAL  34          3HG2      VAL  34   2.472   3.254  -9.367
  188    H    LYS  35           H        LYS  35   0.923   4.206  -5.971
  189    HA   LYS  35           HA       LYS  35   2.924   2.727  -4.421
  190   1HB   LYS  35          1HB       LYS  35   3.588   4.755  -5.764
  191   2HB   LYS  35          2HB       LYS  35   2.625   5.722  -4.655
  192   1HG   LYS  35          1HG       LYS  35   4.486   5.934  -3.457
  193   2HG   LYS  35          2HG       LYS  35   4.227   4.259  -2.965
  194   1HD   LYS  35          1HD       LYS  35   5.932   3.497  -4.226
  195   2HD   LYS  35          2HD       LYS  35   5.565   4.592  -5.561
  196   1HE   LYS  35          1HE       LYS  35   7.772   4.979  -4.416
  197   2HE   LYS  35          2HE       LYS  35   6.713   6.386  -4.522
  198   1HZ   LYS  35          1HZ       LYS  35   6.550   4.721  -2.121
  199   2HZ   LYS  35          2HZ       LYS  35   6.342   6.391  -2.293
  200   3HZ   LYS  35          3HZ       LYS  35   7.898   5.729  -2.293
  201    H    ALA  36           H        ALA  36   0.098   2.599  -3.775
  202    HA   ALA  36           HA       ALA  36   0.040   4.027  -1.200
  203   1HB   ALA  36          1HB       ALA  36  -1.858   4.622  -2.489
  204   2HB   ALA  36          2HB       ALA  36  -2.423   3.492  -1.258
  205   3HB   ALA  36          3HB       ALA  36  -2.181   2.942  -2.917
  206    H    ASN  37           H        ASN  37   0.274   2.893   0.612
  207    HA   ASN  37           HA       ASN  37   0.819   0.134   0.611
  208   1HB   ASN  37          1HB       ASN  37   0.013   1.822   2.987
  209   2HB   ASN  37          2HB       ASN  37   0.918   0.312   3.022
  210   1HD2  ASN  37          1HD2      ASN  37   2.853   0.873   3.762
  211   2HD2  ASN  37          2HD2      ASN  37   3.864   2.102   3.090
  212    H    THR  38           H        THR  38  -2.109   1.951   1.378
  213    HA   THR  38           HA       THR  38  -3.588  -0.591   1.359
  214    HB   THR  38           HB       THR  38  -4.663   1.564   3.081
  215    HG1  THR  38           HG1      THR  38  -2.389   0.041   3.818
  216   1HG2  THR  38          1HG2      THR  38  -5.699  -0.094   4.168
  217   2HG2  THR  38          2HG2      THR  38  -4.286  -1.147   4.127
  218   3HG2  THR  38          3HG2      THR  38  -5.334  -1.022   2.715
  219    H    CYS  39           H        CYS  39  -5.430  -0.605   0.181
  220    HA   CYS  39           HA       CYS  39  -6.344   1.970  -0.920
  221   1HB   CYS  39          1HB       CYS  39  -6.307  -0.662  -2.407
  222   2HB   CYS  39          2HB       CYS  39  -6.769   0.914  -3.053
  223    H    THR  40           H        THR  40  -8.546   2.182  -1.357
  224    HA   THR  40           HA       THR  40 -10.335   0.050  -0.456
  225    HB   THR  40           HB       THR  40 -10.585   2.904   0.517
  226    HG1  THR  40           HG1      THR  40  -9.424   2.354   2.163
  227   1HG2  THR  40          1HG2      THR  40 -12.267   0.500   0.798
  228   2HG2  THR  40          2HG2      THR  40 -12.709   2.207   0.790
  229   3HG2  THR  40          3HG2      THR  40 -12.028   1.479   2.245
  230    H    GLY  41           H        GLY  41 -11.087  -0.268  -2.526
  231   1HA   GLY  41          1HA       GLY  41 -12.647   0.099  -4.210
  232   2HA   GLY  41          2HA       GLY  41 -12.986   1.672  -3.505
  233    H    SER  42           H        SER  42  -9.984   0.230  -4.730
  234    HA   SER  42           HA       SER  42  -9.910   2.352  -6.748
  235   1HB   SER  42          1HB       SER  42  -7.530   1.498  -5.064
  236   2HB   SER  42          2HB       SER  42  -7.548   2.767  -6.286
  237    HG   SER  42           HG       SER  42  -9.122   2.787  -3.926
  238    H    THR  43           H        THR  43  -7.349   1.515  -7.771
  239    HA   THR  43           HA       THR  43  -7.737  -1.306  -8.335
  240    HB   THR  43           HB       THR  43  -8.034  -1.146 -10.598
  241    HG1  THR  43           HG1      THR  43  -7.073   0.285 -11.809
  242   1HG2  THR  43          1HG2      THR  43  -9.651   0.684 -11.100
  243   2HG2  THR  43          2HG2      THR  43  -9.349   1.307  -9.475
  244   3HG2  THR  43          3HG2      THR  43 -10.043  -0.302  -9.689
  245    H    ASP  44           H        ASP  44  -5.769   1.133  -9.941
  246    HA   ASP  44           HA       ASP  44  -3.439  -0.309 -10.116
  247   1HB   ASP  44          1HB       ASP  44  -3.939   2.660 -10.041
  248   2HB   ASP  44          2HB       ASP  44  -2.328   1.992 -10.281
  249    H    CYS  45           H        CYS  45  -3.308  -1.344  -8.094
  250    HA   CYS  45           HA       CYS  45  -1.843   0.219  -6.076
  251   1HB   CYS  45          1HB       CYS  45  -4.097  -1.740  -5.631
  252   2HB   CYS  45          2HB       CYS  45  -2.984  -1.257  -4.344
  253    H    ASN  46           H        ASN  46   0.055  -0.719  -7.123
  254    HA   ASN  46           HA       ASN  46   0.363  -3.599  -6.950
  255   1HB   ASN  46          1HB       ASN  46   2.541  -3.225  -8.045
  256   2HB   ASN  46          2HB       ASN  46   1.208  -2.492  -8.939
  257   1HD2  ASN  46          1HD2      ASN  46   2.543  -1.048  -9.986
  258   2HD2  ASN  46          2HD2      ASN  46   3.267   0.300  -9.185
  259    H    THR  47           H        THR  47   1.384  -0.766  -5.176
  260    HA   THR  47           HA       THR  47   3.334  -2.312  -3.659
  261    HB   THR  47           HB       THR  47   3.560   0.174  -4.440
  262    HG1  THR  47           HG1      THR  47   5.149  -0.717  -3.214
  263   1HG2  THR  47          1HG2      THR  47   1.562   1.086  -3.429
  264   2HG2  THR  47          2HG2      THR  47   3.000   1.794  -2.695
  265   3HG2  THR  47          3HG2      THR  47   2.097   0.548  -1.836
  266    H    ALA  48           H        ALA  48   0.062  -1.288  -3.418
  267    HA   ALA  48           HA       ALA  48  -0.311  -1.132  -0.671
  268   1HB   ALA  48          1HB       ALA  48  -1.931  -0.743  -2.709
  269   2HB   ALA  48          2HB       ALA  48  -2.555  -1.135  -1.106
  270   3HB   ALA  48          3HB       ALA  48  -2.428  -2.394  -2.334
  271    H    GLN  49           H        GLN  49  -0.536  -2.552   0.950
  272    HA   GLN  49           HA       GLN  49   0.167  -5.318   0.444
  273   1HB   GLN  49          1HB       GLN  49   0.236  -5.524   2.885
  274   2HB   GLN  49          2HB       GLN  49   1.179  -4.144   2.338
  275   1HG   GLN  49          1HG       GLN  49  -0.287  -2.616   3.217
  276   2HG   GLN  49          2HG       GLN  49  -1.652  -3.728   3.154
  277   1HE2  GLN  49          1HE2      GLN  49  -2.004  -2.951   5.350
  278   2HE2  GLN  49          2HE2      GLN  49  -1.155  -3.706   6.650
  279    H    THR  50           H        THR  50  -2.639  -3.672   0.251
  280    HA   THR  50           HA       THR  50  -4.277  -5.934   0.169
  281    HB   THR  50           HB       THR  50  -3.868  -5.640   2.691
  282    HG1  THR  50           HG1      THR  50  -5.706  -6.746   1.548
  283   1HG2  THR  50          1HG2      THR  50  -4.251  -3.187   2.725
  284   2HG2  THR  50          2HG2      THR  50  -5.219  -4.099   3.884
  285   3HG2  THR  50          3HG2      THR  50  -5.954  -3.507   2.394
  286    H    CYS  51           H        CYS  51  -6.601  -5.329  -0.143
  287    HA   CYS  51           HA       CYS  51  -7.429  -2.656  -0.424
  288   1HB   CYS  51          1HB       CYS  51  -7.375  -2.353  -2.831
  289   2HB   CYS  51          2HB       CYS  51  -5.739  -2.662  -2.243
  290    H    THR  52           H        THR  52  -9.249  -2.654  -2.338
  291    HA   THR  52           HA       THR  52 -10.752  -5.114  -2.426
  292    HB   THR  52           HB       THR  52 -11.307  -4.022  -0.199
  293    HG1  THR  52           HG1      THR  52 -13.476  -4.266  -2.002
  294   1HG2  THR  52          1HG2      THR  52 -12.956  -2.209  -0.247
  295   2HG2  THR  52          2HG2      THR  52 -12.676  -2.022  -1.978
  296   3HG2  THR  52          3HG2      THR  52 -11.374  -1.697  -0.834
  297    H    ASN  53           H        ASN  53 -11.957  -5.206  -4.240
  298    HA   ASN  53           HA       ASN  53 -12.844  -4.621  -6.254
  299   1HB   ASN  53          1HB       ASN  53 -13.173  -1.924  -4.919
  300   2HB   ASN  53          2HB       ASN  53 -13.935  -2.410  -6.435
  301   1HD2  ASN  53          1HD2      ASN  53 -14.943  -1.662  -3.689
  302   2HD2  ASN  53          2HD2      ASN  53 -16.046  -2.928  -3.286
  303    H    SER  54           H        SER  54  -9.954  -4.287  -5.697
  304    HA   SER  54           HA       SER  54  -9.230  -2.062  -7.449
  305   1HB   SER  54          1HB       SER  54  -7.325  -3.953  -6.066
  306   2HB   SER  54          2HB       SER  54  -6.997  -2.329  -6.683
  307    HG   SER  54           HG       SER  54  -7.861  -1.478  -4.941
  308    H    LYS  55           H        LYS  55  -6.999  -2.890  -8.719
  309    HA   LYS  55           HA       LYS  55  -7.579  -5.399 -10.084
  310   1HB   LYS  55          1HB       LYS  55  -7.513  -2.709 -11.455
  311   2HB   LYS  55          2HB       LYS  55  -7.375  -4.239 -12.313
  312   1HG   LYS  55          1HG       LYS  55  -9.574  -4.846 -11.842
  313   2HG   LYS  55          2HG       LYS  55  -9.710  -3.684 -10.523
  314   1HD   LYS  55          1HD       LYS  55 -10.824  -2.476 -12.073
  315   2HD   LYS  55          2HD       LYS  55  -9.195  -2.010 -12.566
  316   1HE   LYS  55          1HE       LYS  55  -9.925  -2.692 -14.593
  317   2HE   LYS  55          2HE       LYS  55  -9.462  -4.277 -13.976
  318   1HZ   LYS  55          1HZ       LYS  55 -11.587  -4.937 -13.844
  319   2HZ   LYS  55          2HZ       LYS  55 -11.878  -3.697 -14.957
  320   3HZ   LYS  55          3HZ       LYS  55 -12.151  -3.434 -13.309
  321    H    ASP  56           H        ASP  56  -5.376  -3.981  -8.433
  322    HA   ASP  56           HA       ASP  56  -3.217  -5.025 -10.051
  323   1HB   ASP  56          1HB       ASP  56  -3.687  -2.188  -9.782
  324   2HB   ASP  56          2HB       ASP  56  -2.102  -2.636  -9.142
  325    H    CYS  57           H        CYS  57  -4.595  -5.440  -7.352
  326    HA   CYS  57           HA       CYS  57  -2.636  -4.854  -5.376
  327   1HB   CYS  57          1HB       CYS  57  -5.237  -6.105  -5.471
  328   2HB   CYS  57          2HB       CYS  57  -4.132  -7.058  -4.475
  329    H    PHE  58           H        PHE  58  -0.798  -5.582  -6.653
  330    HA   PHE  58           HA       PHE  58  -0.364  -8.300  -7.283
  331   1HB   PHE  58          1HB       PHE  58   1.513  -5.963  -6.945
  332   2HB   PHE  58          2HB       PHE  58   2.063  -7.559  -7.434
  333    HD1  PHE  58           HD1      PHE  58   3.014  -6.531  -9.368
  334    HD2  PHE  58           HD2      PHE  58  -1.174  -6.457  -8.628
  335    HE1  PHE  58           HE1      PHE  58   2.616  -5.935 -11.711
  336    HE2  PHE  58           HE2      PHE  58  -1.577  -5.865 -10.975
  337    HZ   PHE  58           HZ       PHE  58   0.329  -5.609 -12.482
  338    H    GLU  59           H        GLU  59   1.258  -6.343  -4.771
  339    HA   GLU  59           HA       GLU  59   1.894  -8.811  -3.341
  340   1HB   GLU  59          1HB       GLU  59   2.873  -6.023  -2.728
  341   2HB   GLU  59          2HB       GLU  59   3.544  -7.548  -2.150
  342   1HG   GLU  59          1HG       GLU  59   4.483  -8.059  -4.213
  343   2HG   GLU  59          2HG       GLU  59   3.446  -6.921  -5.074
  344    H    ALA  60           H        ALA  60  -0.798  -8.017  -3.232
  345    HA   ALA  60           HA       ALA  60  -1.119  -6.824  -0.583
  346   1HB   ALA  60          1HB       ALA  60  -3.632  -7.134  -1.278
  347   2HB   ALA  60          2HB       ALA  60  -2.937  -7.265  -2.896
  348   3HB   ALA  60          3HB       ALA  60  -2.662  -5.814  -1.932
  349    H    ASN  61           H        ASN  61  -2.263  -7.845   1.086
  350    HA   ASN  61           HA       ASN  61  -2.054 -10.751   1.015
  351   1HB   ASN  61          1HB       ASN  61  -2.757  -9.016   3.385
  352   2HB   ASN  61          2HB       ASN  61  -2.186 -10.681   3.405
  353   1HD2  ASN  61          1HD2      ASN  61  -0.138 -10.439   1.508
  354   2HD2  ASN  61          2HD2      ASN  61   1.118  -9.466   2.187
  355    H    THR  62           H        THR  62  -4.468  -8.214   1.358
  356    HA   THR  62           HA       THR  62  -6.544 -10.285   1.107
  357    HB   THR  62           HB       THR  62  -7.787  -8.244   2.510
  358    HG1  THR  62           HG1      THR  62  -6.295  -7.262   3.581
  359   1HG2  THR  62          1HG2      THR  62  -8.435 -10.250   3.298
  360   2HG2  THR  62          2HG2      THR  62  -7.218  -9.896   4.524
  361   3HG2  THR  62          3HG2      THR  62  -6.823 -10.950   3.166
  362    H    CYS  63           H        CYS  63  -7.233  -9.996  -0.925
  363    HA   CYS  63           HA       CYS  63  -8.112  -7.292  -1.680
  364   1HB   CYS  63          1HB       CYS  63  -7.451  -7.771  -4.011
  365   2HB   CYS  63          2HB       CYS  63  -6.071  -7.780  -2.912
  366    H    THR  64           H        THR  64 -10.262  -7.451  -1.500
  367    HA   THR  64           HA       THR  64 -11.624  -9.849  -2.463
  368    HB   THR  64           HB       THR  64 -13.638  -8.341  -1.534
  369    HG1  THR  64           HG1      THR  64 -11.451  -7.532   0.068
  370   1HG2  THR  64          1HG2      THR  64 -12.356  -9.311   0.809
  371   2HG2  THR  64          2HG2      THR  64 -12.106 -10.466  -0.500
  372   3HG2  THR  64          3HG2      THR  64 -13.742  -9.975  -0.057
  373    H    ASP  65           H        ASP  65 -12.808  -9.923  -4.281
  374    HA   ASP  65           HA       ASP  65 -13.630  -9.329  -6.318
  375   1HB   ASP  65          1HB       ASP  65 -14.291  -6.849  -4.726
  376   2HB   ASP  65          2HB       ASP  65 -14.824  -7.089  -6.393
  377    H    SER  66           H        SER  66 -10.871  -9.025  -6.018
  378    HA   SER  66           HA       SER  66 -10.349  -6.746  -7.809
  379   1HB   SER  66          1HB       SER  66  -9.426  -6.302  -5.558
  380   2HB   SER  66          2HB       SER  66  -8.493  -7.801  -5.659
  381    HG   SER  66           HG       SER  66  -7.210  -6.921  -7.169
  382    H    THR  67           H        THR  67  -9.086  -7.150  -9.585
  383    HA   THR  67           HA       THR  67  -8.421  -9.971 -10.036
  384    HB   THR  67           HB       THR  67  -9.807  -9.168 -11.766
  385    HG1  THR  67           HG1      THR  67  -8.409  -9.195 -13.576
  386   1HG2  THR  67          1HG2      THR  67  -9.187  -7.165 -13.133
  387   2HG2  THR  67          2HG2      THR  67  -8.046  -6.741 -11.856
  388   3HG2  THR  67          3HG2      THR  67  -9.773  -6.824 -11.505
  389    H    ASN  68           H        ASN  68  -6.438 -10.512 -11.161
  390    HA   ASN  68           HA       ASN  68  -4.179 -10.482 -11.421
  391   1HB   ASN  68          1HB       ASN  68  -4.659  -7.500 -11.379
  392   2HB   ASN  68          2HB       ASN  68  -3.068  -8.215 -11.651
  393   1HD2  ASN  68          1HD2      ASN  68  -6.391  -8.240 -12.853
  394   2HD2  ASN  68          2HD2      ASN  68  -5.977  -8.523 -14.507
  395    H    CYS  69           H        CYS  69  -5.006 -11.072  -8.905
  396    HA   CYS  69           HA       CYS  69  -3.318  -9.499  -7.095
  397   1HB   CYS  69          1HB       CYS  69  -5.851 -10.485  -6.730
  398   2HB   CYS  69          2HB       CYS  69  -4.864 -11.715  -5.935
  399    H    TYR  70           H        TYR  70  -1.331 -10.296  -7.860
  400    HA   TYR  70           HA       TYR  70  -0.656 -13.009  -8.063
  401   1HB   TYR  70          1HB       TYR  70   1.153 -10.644  -7.526
  402   2HB   TYR  70          2HB       TYR  70   1.674 -12.235  -8.089
  403    HD1  TYR  70           HD1      TYR  70   0.023 -12.980 -10.228
  404    HD2  TYR  70           HD2      TYR  70   1.280  -9.051  -9.178
  405    HE1  TYR  70           HE1      TYR  70  -0.296 -12.261 -12.557
  406    HE2  TYR  70           HE2      TYR  70   0.962  -8.324 -11.505
  407    HH   TYR  70           HH       TYR  70   0.835  -9.231 -13.719
  408    H    LYS  71           H        LYS  71  -1.331 -14.115  -6.267
  409    HA   LYS  71           HA       LYS  71  -0.849 -15.253  -4.333
  410   1HB   LYS  71          1HB       LYS  71   1.538 -13.992  -4.767
  411   2HB   LYS  71          2HB       LYS  71   1.072 -13.335  -3.198
  412   1HG   LYS  71          1HG       LYS  71   1.359 -16.248  -3.910
  413   2HG   LYS  71          2HG       LYS  71   2.452 -15.291  -2.905
  414   1HD   LYS  71          1HD       LYS  71  -0.448 -15.551  -2.196
  415   2HD   LYS  71          2HD       LYS  71   0.703 -16.814  -1.758
  416   1HE   LYS  71          1HE       LYS  71   2.081 -14.757  -0.847
  417   2HE   LYS  71          2HE       LYS  71   0.485 -14.011  -0.780
  418   1HZ   LYS  71          1HZ       LYS  71   1.279 -16.551   0.539
  419   2HZ   LYS  71          2HZ       LYS  71  -0.271 -15.877   0.577
  420   3HZ   LYS  71          3HZ       LYS  71   1.019 -15.068   1.310
  421    H    ALA  72           H        ALA  72  -3.005 -14.554  -3.823
  422    HA   ALA  72           HA       ALA  72  -3.075 -12.484  -1.723
  423   1HB   ALA  72          1HB       ALA  72  -5.515 -13.311  -3.244
  424   2HB   ALA  72          2HB       ALA  72  -4.389 -12.141  -3.933
  425   3HB   ALA  72          3HB       ALA  72  -5.183 -11.801  -2.395
  426    H    THR  73           H        THR  73  -3.889 -13.020   0.237
  427    HA   THR  73           HA       THR  73  -4.323 -15.813   0.792
  428    HB   THR  73           HB       THR  73  -4.291 -15.219   3.085
  429    HG1  THR  73           HG1      THR  73  -5.613 -13.573   3.397
  430   1HG2  THR  73          1HG2      THR  73  -2.408 -13.603   3.327
  431   2HG2  THR  73          2HG2      THR  73  -2.478 -13.353   1.583
  432   3HG2  THR  73          3HG2      THR  73  -2.096 -14.948   2.231
  433    H    ALA  74           H        ALA  74  -6.267 -12.856   1.229
  434    HA   ALA  74           HA       ALA  74  -8.673 -14.526   1.426
  435   1HB   ALA  74          1HB       ALA  74  -7.971 -12.580   3.070
  436   2HB   ALA  74          2HB       ALA  74  -9.660 -12.875   2.661
  437   3HB   ALA  74          3HB       ALA  74  -8.770 -11.584   1.854
  438    H    CYS  75           H        CYS  75  -9.007 -15.016  -0.741
  439    HA   CYS  75           HA       CYS  75  -9.710 -12.717  -2.445
  440   1HB   CYS  75          1HB       CYS  75  -7.858 -14.847  -2.919
  441   2HB   CYS  75          2HB       CYS  75  -9.182 -14.982  -4.079
  442    H    THR  76           H        THR  76 -11.676 -12.682  -3.340
  443    HA   THR  76           HA       THR  76 -13.292 -15.130  -3.344
  444    HB   THR  76           HB       THR  76 -13.840 -13.819  -1.306
  445    HG1  THR  76           HG1      THR  76 -15.446 -15.058  -2.469
  446   1HG2  THR  76          1HG2      THR  76 -14.485 -11.671  -1.262
  447   2HG2  THR  76          2HG2      THR  76 -15.277 -11.762  -2.836
  448   3HG2  THR  76          3HG2      THR  76 -13.525 -11.576  -2.739
  449    H    ASN  77           H        ASN  77 -13.747 -15.452  -5.428
  450    HA   ASN  77           HA       ASN  77 -14.304 -15.077  -7.609
  451   1HB   ASN  77          1HB       ASN  77 -15.872 -12.716  -6.556
  452   2HB   ASN  77          2HB       ASN  77 -16.210 -13.682  -7.996
  453   1HD2  ASN  77          1HD2      ASN  77 -15.807 -16.224  -6.898
  454   2HD2  ASN  77          2HD2      ASN  77 -17.076 -16.537  -5.768
  455    H    SER  78           H        SER  78 -11.855 -14.148  -7.102
  456    HA   SER  78           HA       SER  78 -11.736 -11.563  -8.514
  457   1HB   SER  78          1HB       SER  78  -9.302 -11.834  -7.201
  458   2HB   SER  78          2HB       SER  78 -10.650 -10.807  -6.701
  459    HG   SER  78           HG       SER  78 -10.442 -13.529  -5.950
  460    H    SER  79           H        SER  79  -9.855 -11.246  -9.892
  461    HA   SER  79           HA       SER  79  -9.079 -13.741 -11.200
  462   1HB   SER  79          1HB       SER  79  -9.665 -11.073 -12.110
  463   2HB   SER  79          2HB       SER  79  -8.064 -11.563 -12.662
  464    HG   SER  79           HG       SER  79 -10.566 -12.584 -13.311
  465    H    GLY  80           H        GLY  80  -6.821 -13.771 -12.161
  466   1HA   GLY  80          1HA       GLY  80  -4.582 -14.032 -11.696
  467   2HA   GLY  80          2HA       GLY  80  -4.665 -12.331 -11.250
  468    H    CYS  81           H        CYS  81  -6.490 -14.741  -9.529
  469    HA   CYS  81           HA       CYS  81  -4.519 -15.038  -7.440
  470   1HB   CYS  81          1HB       CYS  81  -5.489 -13.753  -5.791
  471   2HB   CYS  81          2HB       CYS  81  -5.880 -12.782  -7.209
  472    HA   PRO  82           HA       PRO  82  -6.524 -18.750  -6.076
  473   1HB   PRO  82          1HB       PRO  82  -7.976 -17.326  -3.882
  474   2HB   PRO  82          2HB       PRO  82  -7.051 -18.836  -3.825
  475   1HG   PRO  82          1HG       PRO  82  -5.990 -16.586  -2.902
  476   2HG   PRO  82          2HG       PRO  82  -5.004 -17.734  -3.826
  477   1HD   PRO  82          1HD       PRO  82  -6.143 -15.113  -4.660
  478   2HD   PRO  82          2HD       PRO  82  -4.621 -15.887  -5.144
  479    H    GLY  83           H        GLY  83  -7.848 -18.915  -7.913
  480   1HA   GLY  83          1HA       GLY  83 -10.344 -19.605  -7.905
  481   2HA   GLY  83          2HA       GLY  83 -10.590 -17.882  -7.664
  482    H    HIS  84           H        HIS  84  -8.231 -19.535  -9.730
  483    HA   HIS  84           HA       HIS  84  -9.157 -17.932 -11.984
  484   1HB   HIS  84          1HB       HIS  84  -7.103 -18.831 -13.108
  485   2HB   HIS  84          2HB       HIS  84  -6.778 -17.917 -11.639
  486    HD1  HIS  84           HD1      HIS  84  -5.068 -18.993 -10.228
  487    HD2  HIS  84           HD2      HIS  84  -7.275 -21.790 -12.365
  488    HE1  HIS  84           HE1      HIS  84  -4.101 -21.230  -9.606
  489    HE2  HIS  84           HE2      HIS  84  -5.501 -22.912 -10.854
  Start of MODEL   19
    1   1H    GLN   1          1H        GLN   1 -12.360  15.996   2.042
    2   2H    GLN   1          2H        GLN   1 -10.733  15.533   1.748
    3   3H    GLN   1          3H        GLN   1 -11.567  16.516   0.614
    4    HA   GLN   1           HA       GLN   1 -11.821  18.151   2.480
    5   1HB   GLN   1          1HB       GLN   1  -9.464  16.579   3.529
    6   2HB   GLN   1          2HB       GLN   1 -10.248  17.961   4.281
    7   1HG   GLN   1          1HG       GLN   1 -11.324  16.440   5.499
    8   2HG   GLN   1          2HG       GLN   1 -12.319  16.211   4.061
    9   1HE2  GLN   1          1HE2      GLN   1 -11.982  14.232   5.965
   10   2HE2  GLN   1          2HE2      GLN   1 -11.089  12.926   5.271
   11    H    CYS   2           H        CYS   2  -9.101  16.485   0.960
   12    HA   CYS   2           HA       CYS   2  -8.182  19.083  -0.069
   13   1HB   CYS   2          1HB       CYS   2  -5.826  18.095   0.084
   14   2HB   CYS   2          2HB       CYS   2  -6.576  18.606   1.593
   15    H    THR   3           H        THR   3  -9.877  17.583  -1.536
   16    HA   THR   3           HA       THR   3  -8.154  16.228  -3.503
   17    HB   THR   3           HB       THR   3  -9.804  14.725  -2.530
   18    HG1  THR   3           HG1      THR   3 -10.577  13.960  -4.423
   19   1HG2  THR   3          1HG2      THR   3 -11.493  16.480  -1.956
   20   2HG2  THR   3          2HG2      THR   3 -12.144  15.015  -2.692
   21   3HG2  THR   3          3HG2      THR   3 -11.963  16.481  -3.656
   22    H    GLY   4           H        GLY   4  -8.144  16.905  -5.583
   23   1HA   GLY   4          1HA       GLY   4  -9.817  19.261  -6.198
   24   2HA   GLY   4          2HA       GLY   4  -8.220  18.961  -6.883
   25    H    GLY   5           H        GLY   5  -8.046  17.818  -8.744
   26   1HA   GLY   5          1HA       GLY   5 -10.218  16.144  -9.673
   27   2HA   GLY   5          2HA       GLY   5 -10.006  17.630 -10.588
   28    H    ALA   6           H        ALA   6  -8.956  14.433 -10.120
   29    HA   ALA   6           HA       ALA   6  -7.569  13.100 -11.343
   30   1HB   ALA   6          1HB       ALA   6  -6.820  15.431 -13.074
   31   2HB   ALA   6          2HB       ALA   6  -8.384  14.629 -13.230
   32   3HB   ALA   6          3HB       ALA   6  -6.895  13.719 -13.488
   33    H    ASP   7           H        ASP   7  -6.634  15.471  -9.360
   34    HA   ASP   7           HA       ASP   7  -3.939  14.481  -9.199
   35   1HB   ASP   7          1HB       ASP   7  -4.247  16.616 -10.868
   36   2HB   ASP   7          2HB       ASP   7  -3.924  17.426  -9.333
   37    H    CYS   8           H        CYS   8  -2.943  14.945  -7.216
   38    HA   CYS   8           HA       CYS   8  -4.438  16.557  -5.291
   39   1HB   CYS   8          1HB       CYS   8  -4.307  13.650  -5.285
   40   2HB   CYS   8          2HB       CYS   8  -3.667  14.338  -3.790
   41    H    THR   9           H        THR   9  -2.785  18.042  -5.196
   42    HA   THR   9           HA       THR   9  -0.229  17.053  -4.112
   43    HB   THR   9           HB       THR   9   0.495  19.435  -5.125
   44    HG1  THR   9           HG1      THR   9  -1.497  18.487  -6.904
   45   1HG2  THR   9          1HG2      THR   9   1.574  17.305  -5.661
   46   2HG2  THR   9          2HG2      THR   9   1.353  18.320  -7.086
   47   3HG2  THR   9          3HG2      THR   9   0.279  16.949  -6.804
   48    H    SER  10           H        SER  10  -2.629  17.836  -2.644
   49    HA   SER  10           HA       SER  10  -1.658  20.264  -1.290
   50   1HB   SER  10          1HB       SER  10  -4.400  19.133  -0.839
   51   2HB   SER  10          2HB       SER  10  -3.846  20.802  -0.708
   52    HG   SER  10           HG       SER  10  -4.744  20.930  -2.618
   53    H    CYS  11           H        CYS  11  -2.680  16.938  -0.839
   54    HA   CYS  11           HA       CYS  11  -1.914  17.099   1.996
   55   1HB   CYS  11          1HB       CYS  11  -3.845  15.404   0.481
   56   2HB   CYS  11          2HB       CYS  11  -3.063  14.703   1.893
   57    H    THR  12           H        THR  12  -0.763  15.214   2.889
   58    HA   THR  12           HA       THR  12   0.993  13.945   0.894
   59    HB   THR  12           HB       THR  12   2.165  15.729   2.153
   60    HG1  THR  12           HG1      THR  12   3.079  13.158   2.906
   61   1HG2  THR  12          1HG2      THR  12   2.078  15.983   4.346
   62   2HG2  THR  12          2HG2      THR  12   2.496  14.292   4.620
   63   3HG2  THR  12          3HG2      THR  12   0.812  14.757   4.374
   64    H    GLY  13           H        GLY  13  -0.879  13.642   3.809
   65   1HA   GLY  13          1HA       GLY  13   0.084  11.092   4.599
   66   2HA   GLY  13          2HA       GLY  13  -1.418  11.836   5.120
   67    H    ALA  14           H        ALA  14  -3.193  11.822   3.425
   68    HA   ALA  14           HA       ALA  14  -3.061   9.415   1.747
   69   1HB   ALA  14          1HB       ALA  14  -5.317   8.766   2.479
   70   2HB   ALA  14          2HB       ALA  14  -5.301  10.080   3.655
   71   3HB   ALA  14          3HB       ALA  14  -4.156   8.747   3.805
   72    H    CYS  15           H        CYS  15  -4.561   9.374  -0.008
   73    HA   CYS  15           HA       CYS  15  -5.671  12.020  -0.679
   74   1HB   CYS  15          1HB       CYS  15  -5.284  11.060  -3.128
   75   2HB   CYS  15          2HB       CYS  15  -4.019  11.922  -2.262
   76    H    THR  16           H        THR  16  -7.662  12.096  -1.697
   77    HA   THR  16           HA       THR  16  -9.059   9.569  -2.174
   78    HB   THR  16           HB       THR  16 -11.023  10.309  -0.932
   79    HG1  THR  16           HG1      THR  16 -11.129  12.404  -0.753
   80   1HG2  THR  16          1HG2      THR  16  -8.583  10.558   0.809
   81   2HG2  THR  16          2HG2      THR  16  -9.349   9.043   0.331
   82   3HG2  THR  16          3HG2      THR  16 -10.224  10.193   1.341
   83    H    GLY  17           H        GLY  17 -10.391   9.620  -3.911
   84   1HA   GLY  17          1HA       GLY  17 -11.372  10.410  -5.834
   85   2HA   GLY  17          2HA       GLY  17 -11.776  11.842  -4.888
   86    H    CYS  18           H        CYS  18  -8.695  10.468  -6.011
   87    HA   CYS  18           HA       CYS  18  -8.251  12.833  -7.667
   88   1HB   CYS  18          1HB       CYS  18  -6.709  12.112  -5.224
   89   2HB   CYS  18          2HB       CYS  18  -5.800  12.714  -6.613
   90    H    GLY  19           H        GLY  19  -7.463  12.253  -9.577
   91   1HA   GLY  19          1HA       GLY  19  -6.886   9.584 -10.243
   92   2HA   GLY  19          2HA       GLY  19  -6.524  10.987 -11.245
   93    H    ASN  20           H        ASN  20  -4.901  11.941  -8.749
   94    HA   ASN  20           HA       ASN  20  -2.606  10.145  -9.020
   95   1HB   ASN  20          1HB       ASN  20  -2.753  12.503 -10.457
   96   2HB   ASN  20          2HB       ASN  20  -1.814  12.959  -9.039
   97   1HD2  ASN  20          1HD2      ASN  20  -0.832  12.899 -11.670
   98   2HD2  ASN  20          2HD2      ASN  20   0.404  11.694 -11.754
   99    H    CYS  21           H        CYS  21  -0.880  10.654  -7.428
  100    HA   CYS  21           HA       CYS  21  -1.833  12.074  -5.052
  101   1HB   CYS  21          1HB       CYS  21  -0.889   9.201  -5.097
  102   2HB   CYS  21          2HB       CYS  21  -1.026  10.163  -3.623
  103    HA   PRO  22           HA       PRO  22   2.405  13.294  -4.891
  104   1HB   PRO  22          1HB       PRO  22   2.521  14.232  -2.345
  105   2HB   PRO  22          2HB       PRO  22   1.687  15.070  -3.652
  106   1HG   PRO  22          1HG       PRO  22   0.577  13.608  -1.359
  107   2HG   PRO  22          2HG       PRO  22  -0.173  14.848  -2.373
  108   1HD   PRO  22          1HD       PRO  22  -0.545  12.018  -2.494
  109   2HD   PRO  22          2HD       PRO  22  -1.254  13.254  -3.547
  110    H    ASN  23           H        ASN  23   1.798  12.098  -1.594
  111    HA   ASN  23           HA       ASN  23   3.615   9.885  -1.936
  112   1HB   ASN  23          1HB       ASN  23   4.821  10.932   0.270
  113   2HB   ASN  23          2HB       ASN  23   5.440  11.104  -1.373
  114   1HD2  ASN  23          1HD2      ASN  23   2.642  12.698   0.073
  115   2HD2  ASN  23          2HD2      ASN  23   3.264  14.303  -0.061
  116    H    ALA  24           H        ALA  24   0.963   9.817  -1.356
  117    HA   ALA  24           HA       ALA  24   0.640   9.555   1.523
  118   1HB   ALA  24          1HB       ALA  24  -1.340  10.369   0.827
  119   2HB   ALA  24          2HB       ALA  24  -1.703   8.673   0.506
  120   3HB   ALA  24          3HB       ALA  24  -1.154   9.720  -0.803
  121    H    VAL  25           H        VAL  25   0.607   7.681   2.624
  122    HA   VAL  25           HA       VAL  25   1.385   5.268   1.221
  123    HB   VAL  25           HB       VAL  25   1.641   4.273   3.446
  124   1HG1  VAL  25          1HG1      VAL  25   3.508   5.500   2.508
  125   2HG1  VAL  25          2HG1      VAL  25   3.448   5.735   4.255
  126   3HG1  VAL  25          3HG1      VAL  25   2.882   7.008   3.174
  127   1HG2  VAL  25          1HG2      VAL  25   1.458   6.229   5.300
  128   2HG2  VAL  25          2HG2      VAL  25   0.177   5.061   4.970
  129   3HG2  VAL  25          3HG2      VAL  25   0.117   6.665   4.240
  130    H    THR  26           H        THR  26  -1.515   6.642   1.643
  131    HA   THR  26           HA       THR  26  -2.943   4.218   1.210
  132    HB   THR  26           HB       THR  26  -4.132   5.460   3.579
  133    HG1  THR  26           HG1      THR  26  -2.472   5.404   4.828
  134   1HG2  THR  26          1HG2      THR  26  -3.321   2.626   2.987
  135   2HG2  THR  26          2HG2      THR  26  -4.914   3.332   2.716
  136   3HG2  THR  26          3HG2      THR  26  -4.291   3.162   4.357
  137    H    CYS  27           H        CYS  27  -4.813   4.618   0.148
  138    HA   CYS  27           HA       CYS  27  -5.897   7.345   0.236
  139   1HB   CYS  27          1HB       CYS  27  -6.310   6.368  -2.395
  140   2HB   CYS  27          2HB       CYS  27  -5.351   7.758  -1.894
  141    H    THR  28           H        THR  28  -8.087   7.525   0.050
  142    HA   THR  28           HA       THR  28  -9.587   5.017   0.239
  143    HB   THR  28           HB       THR  28 -10.920   7.645   0.646
  144    HG1  THR  28           HG1      THR  28  -9.055   6.564   2.489
  145   1HG2  THR  28          1HG2      THR  28 -12.322   6.528   1.994
  146   2HG2  THR  28          2HG2      THR  28 -11.042   5.528   2.681
  147   3HG2  THR  28          3HG2      THR  28 -11.727   5.127   1.105
  148    H    ASN  29           H        ASN  29  -9.731   4.437  -1.928
  149    HA   ASN  29           HA       ASN  29 -10.850   4.273  -3.871
  150   1HB   ASN  29          1HB       ASN  29 -12.848   5.286  -4.037
  151   2HB   ASN  29          2HB       ASN  29 -12.485   6.051  -2.493
  152   1HD2  ASN  29          1HD2      ASN  29 -12.257   8.205  -2.413
  153   2HD2  ASN  29          2HD2      ASN  29 -12.318   9.253  -3.785
  154    H    SER  30           H        SER  30 -11.043   5.729  -5.951
  155    HA   SER  30           HA       SER  30 -10.042   7.087  -7.536
  156   1HB   SER  30          1HB       SER  30  -9.089   8.273  -5.234
  157   2HB   SER  30          2HB       SER  30  -7.614   7.796  -6.074
  158    HG   SER  30           HG       SER  30  -8.665   8.813  -7.978
  159    H    GLN  31           H        GLN  31  -7.348   7.329  -8.168
  160    HA   GLN  31           HA       GLN  31  -6.382   4.551  -8.247
  161   1HB   GLN  31          1HB       GLN  31  -7.629   5.662 -10.369
  162   2HB   GLN  31          2HB       GLN  31  -5.978   6.197 -10.678
  163   1HG   GLN  31          1HG       GLN  31  -5.270   4.137 -11.210
  164   2HG   GLN  31          2HG       GLN  31  -6.268   3.357  -9.986
  165   1HE2  GLN  31          1HE2      GLN  31  -8.766   4.037 -10.623
  166   2HE2  GLN  31          2HE2      GLN  31  -9.187   3.467 -12.199
  167    H    HIS  32           H        HIS  32  -4.147   4.840  -9.731
  168    HA   HIS  32           HA       HIS  32  -1.970   5.472  -9.690
  169   1HB   HIS  32          1HB       HIS  32  -3.431   7.977  -9.134
  170   2HB   HIS  32          2HB       HIS  32  -1.727   7.973  -8.672
  171    HD1  HIS  32           HD1      HIS  32  -3.887   7.326 -11.727
  172    HD2  HIS  32           HD2      HIS  32  -0.008   8.435 -10.732
  173    HE1  HIS  32           HE1      HIS  32  -2.772   7.896 -13.906
  174    HE2  HIS  32           HE2      HIS  32  -0.400   8.478 -13.289
  175    H    CYS  33           H        CYS  33  -3.293   4.241  -7.320
  176    HA   CYS  33           HA       CYS  33  -1.659   5.288  -5.131
  177   1HB   CYS  33          1HB       CYS  33  -3.913   3.280  -5.220
  178   2HB   CYS  33          2HB       CYS  33  -2.971   3.608  -3.763
  179    H    VAL  34           H        VAL  34  -0.244   4.074  -7.211
  180    HA   VAL  34           HA       VAL  34   0.316   1.354  -6.869
  181    HB   VAL  34           HB       VAL  34   2.386   1.756  -8.078
  182   1HG1  VAL  34          1HG1      VAL  34   0.221   3.511  -9.220
  183   2HG1  VAL  34          2HG1      VAL  34   0.184   1.747  -9.259
  184   3HG1  VAL  34          3HG1      VAL  34   1.463   2.622 -10.102
  185   1HG2  VAL  34          1HG2      VAL  34   3.123   4.000  -8.663
  186   2HG2  VAL  34          2HG2      VAL  34   3.073   3.808  -6.910
  187   3HG2  VAL  34          3HG2      VAL  34   1.792   4.697  -7.738
  188    H    LYS  35           H        LYS  35   1.621   4.205  -5.284
  189    HA   LYS  35           HA       LYS  35   3.417   2.513  -3.710
  190   1HB   LYS  35          1HB       LYS  35   4.765   4.348  -3.397
  191   2HB   LYS  35          2HB       LYS  35   4.063   4.736  -4.955
  192   1HG   LYS  35          1HG       LYS  35   2.280   5.990  -3.502
  193   2HG   LYS  35          2HG       LYS  35   3.568   5.973  -2.296
  194   1HD   LYS  35          1HD       LYS  35   3.808   7.052  -5.104
  195   2HD   LYS  35          2HD       LYS  35   3.602   8.024  -3.646
  196   1HE   LYS  35          1HE       LYS  35   5.828   8.097  -3.540
  197   2HE   LYS  35          2HE       LYS  35   5.757   6.406  -3.046
  198   1HZ   LYS  35          1HZ       LYS  35   5.805   5.881  -5.501
  199   2HZ   LYS  35          2HZ       LYS  35   7.239   6.485  -4.840
  200   3HZ   LYS  35          3HZ       LYS  35   6.239   7.496  -5.755
  201    H    ALA  36           H        ALA  36   0.496   2.637  -3.300
  202    HA   ALA  36           HA       ALA  36   0.363   3.859  -0.631
  203   1HB   ALA  36          1HB       ALA  36  -1.921   2.811  -2.294
  204   2HB   ALA  36          2HB       ALA  36  -1.369   4.486  -2.309
  205   3HB   ALA  36          3HB       ALA  36  -2.024   3.786  -0.829
  206    H    ASN  37           H        ASN  37   0.081   2.652   1.173
  207    HA   ASN  37           HA       ASN  37   0.723  -0.079   1.152
  208   1HB   ASN  37          1HB       ASN  37   1.069   1.404   3.100
  209   2HB   ASN  37          2HB       ASN  37  -0.675   1.494   3.328
  210   1HD2  ASN  37          1HD2      ASN  37  -1.217   0.355   5.034
  211   2HD2  ASN  37          2HD2      ASN  37  -0.626  -1.218   5.440
  212    H    THR  38           H        THR  38  -2.402   1.554   1.594
  213    HA   THR  38           HA       THR  38  -3.728  -0.943   0.791
  214    HB   THR  38           HB       THR  38  -4.727   0.884   2.982
  215    HG1  THR  38           HG1      THR  38  -4.033  -0.666   4.401
  216   1HG2  THR  38          1HG2      THR  38  -6.633  -0.162   2.283
  217   2HG2  THR  38          2HG2      THR  38  -6.036  -1.321   3.472
  218   3HG2  THR  38          3HG2      THR  38  -5.778  -1.610   1.751
  219    H    CYS  39           H        CYS  39  -5.506  -0.708  -0.528
  220    HA   CYS  39           HA       CYS  39  -6.321   2.042  -1.174
  221   1HB   CYS  39          1HB       CYS  39  -6.452   0.298  -3.496
  222   2HB   CYS  39          2HB       CYS  39  -5.727   1.896  -3.329
  223    H    THR  40           H        THR  40  -8.334   2.087  -0.367
  224    HA   THR  40           HA       THR  40 -10.125  -0.180  -0.732
  225    HB   THR  40           HB       THR  40 -11.196   2.320   0.418
  226    HG1  THR  40           HG1      THR  40  -9.146   0.877   1.741
  227   1HG2  THR  40          1HG2      THR  40 -12.403   0.184   0.541
  228   2HG2  THR  40          2HG2      THR  40 -12.055   0.868   2.129
  229   3HG2  THR  40          3HG2      THR  40 -11.090  -0.476   1.517
  230    H    GLY  41           H        GLY  41 -11.211  -0.352  -2.595
  231   1HA   GLY  41          1HA       GLY  41 -12.427   0.228  -4.467
  232   2HA   GLY  41          2HA       GLY  41 -12.865   1.699  -3.614
  233    H    SER  42           H        SER  42  -9.669   0.564  -4.549
  234    HA   SER  42           HA       SER  42  -9.503   2.748  -6.483
  235   1HB   SER  42          1HB       SER  42  -7.295   2.207  -4.481
  236   2HB   SER  42          2HB       SER  42  -7.426   3.569  -5.591
  237    HG   SER  42           HG       SER  42  -8.963   3.029  -3.277
  238    H    THR  43           H        THR  43  -7.505   2.448  -7.883
  239    HA   THR  43           HA       THR  43  -6.864  -0.417  -8.049
  240    HB   THR  43           HB       THR  43  -7.432  -0.512 -10.219
  241    HG1  THR  43           HG1      THR  43  -6.961   1.158 -11.714
  242   1HG2  THR  43          1HG2      THR  43  -8.950   1.482 -10.978
  243   2HG2  THR  43          2HG2      THR  43  -8.873   1.907  -9.267
  244   3HG2  THR  43          3HG2      THR  43  -9.492   0.330  -9.757
  245    H    ASP  44           H        ASP  44  -5.063   0.457 -10.434
  246    HA   ASP  44           HA       ASP  44  -2.727   0.427 -10.456
  247   1HB   ASP  44          1HB       ASP  44  -3.838   2.813 -10.855
  248   2HB   ASP  44          2HB       ASP  44  -2.914   3.209  -9.408
  249    H    CYS  45           H        CYS  45  -2.743  -1.039  -8.453
  250    HA   CYS  45           HA       CYS  45  -1.122   0.262  -6.376
  251   1HB   CYS  45          1HB       CYS  45  -3.562  -1.451  -5.995
  252   2HB   CYS  45          2HB       CYS  45  -2.309  -1.376  -4.752
  253    H    ASN  46           H        ASN  46   0.817  -0.621  -6.703
  254    HA   ASN  46           HA       ASN  46   0.981  -3.527  -7.132
  255   1HB   ASN  46          1HB       ASN  46   2.010  -2.121  -8.889
  256   2HB   ASN  46          2HB       ASN  46   3.071  -1.403  -7.673
  257   1HD2  ASN  46          1HD2      ASN  46   5.038  -2.160  -7.900
  258   2HD2  ASN  46          2HD2      ASN  46   5.473  -3.802  -8.213
  259    H    THR  47           H        THR  47   2.111  -0.867  -5.134
  260    HA   THR  47           HA       THR  47   3.797  -2.610  -3.539
  261    HB   THR  47           HB       THR  47   4.496  -0.653  -2.388
  262    HG1  THR  47           HG1      THR  47   2.546   0.332  -1.970
  263   1HG2  THR  47          1HG2      THR  47   5.624  -0.379  -4.334
  264   2HG2  THR  47          2HG2      THR  47   4.653   1.092  -4.362
  265   3HG2  THR  47          3HG2      THR  47   4.157  -0.310  -5.310
  266    H    ALA  48           H        ALA  48   0.580  -1.322  -3.464
  267    HA   ALA  48           HA       ALA  48   0.014  -1.377  -0.741
  268   1HB   ALA  48          1HB       ALA  48  -2.200  -1.188  -1.319
  269   2HB   ALA  48          2HB       ALA  48  -2.049  -2.290  -2.688
  270   3HB   ALA  48          3HB       ALA  48  -1.420  -0.647  -2.806
  271    H    GLN  49           H        GLN  49  -0.389  -2.930   0.723
  272    HA   GLN  49           HA       GLN  49   0.143  -5.670  -0.016
  273   1HB   GLN  49          1HB       GLN  49   0.054  -6.129   2.369
  274   2HB   GLN  49          2HB       GLN  49   1.057  -4.717   2.062
  275   1HG   GLN  49          1HG       GLN  49  -0.561  -3.247   2.897
  276   2HG   GLN  49          2HG       GLN  49  -1.833  -4.465   2.815
  277   1HE2  GLN  49          1HE2      GLN  49  -0.899  -6.582   4.066
  278   2HE2  GLN  49          2HE2      GLN  49  -0.472  -6.231   5.703
  279    H    THR  50           H        THR  50  -2.562  -3.832  -0.213
  280    HA   THR  50           HA       THR  50  -4.288  -5.982  -0.666
  281    HB   THR  50           HB       THR  50  -4.015  -5.932   1.929
  282    HG1  THR  50           HG1      THR  50  -5.642  -7.072   0.643
  283   1HG2  THR  50          1HG2      THR  50  -4.539  -3.461   2.034
  284   2HG2  THR  50          2HG2      THR  50  -5.408  -4.514   3.154
  285   3HG2  THR  50          3HG2      THR  50  -6.211  -3.915   1.700
  286    H    CYS  51           H        CYS  51  -6.471  -5.275  -1.202
  287    HA   CYS  51           HA       CYS  51  -7.334  -2.619  -1.127
  288   1HB   CYS  51          1HB       CYS  51  -7.041  -2.543  -3.862
  289   2HB   CYS  51          2HB       CYS  51  -6.048  -1.660  -2.704
  290    H    THR  52           H        THR  52  -9.440  -2.478  -1.697
  291    HA   THR  52           HA       THR  52 -10.648  -4.892  -2.864
  292    HB   THR  52           HB       THR  52 -11.438  -4.326  -0.616
  293    HG1  THR  52           HG1      THR  52 -13.671  -4.215  -1.134
  294   1HG2  THR  52          1HG2      THR  52 -11.100  -1.912  -0.646
  295   2HG2  THR  52          2HG2      THR  52 -12.747  -2.338  -0.183
  296   3HG2  THR  52          3HG2      THR  52 -12.415  -1.745  -1.809
  297    H    ASN  53           H        ASN  53 -12.377  -4.656  -4.398
  298    HA   ASN  53           HA       ASN  53 -13.124  -3.889  -6.417
  299   1HB   ASN  53          1HB       ASN  53 -13.967  -2.169  -4.413
  300   2HB   ASN  53          2HB       ASN  53 -13.306  -1.078  -5.635
  301   1HD2  ASN  53          1HD2      ASN  53 -15.036  -4.164  -5.888
  302   2HD2  ASN  53          2HD2      ASN  53 -16.317  -3.560  -6.876
  303    H    SER  54           H        SER  54 -10.255  -3.841  -5.968
  304    HA   SER  54           HA       SER  54  -9.329  -1.503  -7.464
  305   1HB   SER  54          1HB       SER  54  -8.058  -2.150  -5.475
  306   2HB   SER  54          2HB       SER  54  -7.819  -3.772  -6.132
  307    HG   SER  54           HG       SER  54  -6.071  -2.919  -6.935
  308    H    LYS  55           H        LYS  55  -7.464  -2.100  -9.042
  309    HA   LYS  55           HA       LYS  55  -8.318  -4.354 -10.738
  310   1HB   LYS  55          1HB       LYS  55  -7.106  -1.766 -11.723
  311   2HB   LYS  55          2HB       LYS  55  -7.762  -3.072 -12.702
  312   1HG   LYS  55          1HG       LYS  55  -9.992  -2.599 -11.913
  313   2HG   LYS  55          2HG       LYS  55  -9.372  -1.367 -10.813
  314   1HD   LYS  55          1HD       LYS  55  -9.144   0.164 -12.456
  315   2HD   LYS  55          2HD       LYS  55  -8.599  -1.034 -13.632
  316   1HE   LYS  55          1HE       LYS  55 -10.702  -0.175 -14.374
  317   2HE   LYS  55          2HE       LYS  55 -10.956  -1.826 -13.812
  318   1HZ   LYS  55          1HZ       LYS  55 -11.948   0.678 -12.725
  319   2HZ   LYS  55          2HZ       LYS  55 -11.446  -0.464 -11.582
  320   3HZ   LYS  55          3HZ       LYS  55 -12.645  -0.865 -12.707
  321    H    ASP  56           H        ASP  56  -6.247  -3.969  -8.583
  322    HA   ASP  56           HA       ASP  56  -4.056  -5.233  -9.974
  323   1HB   ASP  56          1HB       ASP  56  -3.586  -2.836  -8.184
  324   2HB   ASP  56          2HB       ASP  56  -2.374  -3.740  -9.095
  325    H    CYS  57           H        CYS  57  -2.587  -4.526  -7.312
  326    HA   CYS  57           HA       CYS  57  -2.441  -5.289  -5.150
  327   1HB   CYS  57          1HB       CYS  57  -4.898  -6.995  -5.536
  328   2HB   CYS  57          2HB       CYS  57  -4.206  -6.392  -4.031
  329    H    PHE  58           H        PHE  58  -1.003  -6.322  -7.184
  330    HA   PHE  58           HA       PHE  58  -1.159  -9.100  -7.554
  331   1HB   PHE  58          1HB       PHE  58   1.398  -7.498  -7.612
  332   2HB   PHE  58          2HB       PHE  58   1.008  -8.949  -8.529
  333    HD1  PHE  58           HD1      PHE  58  -0.717  -8.820 -10.302
  334    HD2  PHE  58           HD2      PHE  58   0.962  -5.403  -8.412
  335    HE1  PHE  58           HE1      PHE  58  -1.419  -7.430 -12.199
  336    HE2  PHE  58           HE2      PHE  58   0.259  -4.006 -10.302
  337    HZ   PHE  58           HZ       PHE  58  -0.915  -5.042 -12.174
  338    H    GLU  59           H        GLU  59   1.014  -7.240  -5.420
  339    HA   GLU  59           HA       GLU  59   1.616  -9.687  -3.943
  340   1HB   GLU  59          1HB       GLU  59   2.826  -6.921  -3.866
  341   2HB   GLU  59          2HB       GLU  59   3.306  -8.225  -2.781
  342   1HG   GLU  59          1HG       GLU  59   3.433  -8.446  -5.776
  343   2HG   GLU  59          2HG       GLU  59   4.771  -7.859  -4.788
  344    H    ALA  60           H        ALA  60  -1.002  -8.717  -3.656
  345    HA   ALA  60           HA       ALA  60  -1.051  -7.414  -1.035
  346   1HB   ALA  60          1HB       ALA  60  -3.012  -7.750  -3.238
  347   2HB   ALA  60          2HB       ALA  60  -2.625  -6.326  -2.273
  348   3HB   ALA  60          3HB       ALA  60  -3.634  -7.605  -1.592
  349    H    ASN  61           H        ASN  61  -2.135  -8.302   0.741
  350    HA   ASN  61           HA       ASN  61  -2.017 -11.178   0.880
  351   1HB   ASN  61          1HB       ASN  61  -2.577 -10.856   3.260
  352   2HB   ASN  61          2HB       ASN  61  -1.223  -9.844   2.765
  353   1HD2  ASN  61          1HD2      ASN  61  -4.654  -9.868   3.489
  354   2HD2  ASN  61          2HD2      ASN  61  -4.775  -8.188   3.875
  355    H    THR  62           H        THR  62  -4.531  -8.683   1.019
  356    HA   THR  62           HA       THR  62  -6.526 -10.814   0.613
  357    HB   THR  62           HB       THR  62  -6.889  -8.304   2.261
  358    HG1  THR  62           HG1      THR  62  -6.934  -9.706   4.001
  359   1HG2  THR  62          1HG2      THR  62  -8.926  -9.915   2.964
  360   2HG2  THR  62          2HG2      THR  62  -8.791 -10.295   1.248
  361   3HG2  THR  62          3HG2      THR  62  -9.049  -8.629   1.764
  362    H    CYS  63           H        CYS  63  -8.213 -10.372  -0.795
  363    HA   CYS  63           HA       CYS  63  -8.538  -7.774  -1.978
  364   1HB   CYS  63          1HB       CYS  63  -8.008  -8.479  -4.285
  365   2HB   CYS  63          2HB       CYS  63  -6.590  -8.522  -3.236
  366    H    THR  64           H        THR  64 -10.677  -7.640  -1.982
  367    HA   THR  64           HA       THR  64 -12.232  -9.991  -2.846
  368    HB   THR  64           HB       THR  64 -14.090  -8.516  -1.589
  369    HG1  THR  64           HG1      THR  64 -11.690  -7.968  -0.183
  370   1HG2  THR  64          1HG2      THR  64 -13.365 -10.876  -1.079
  371   2HG2  THR  64          2HG2      THR  64 -13.924  -9.915   0.291
  372   3HG2  THR  64          3HG2      THR  64 -12.197 -10.175   0.041
  373    H    ASP  65           H        ASP  65 -13.552  -9.796  -4.560
  374    HA   ASP  65           HA       ASP  65 -14.566  -8.922  -6.398
  375   1HB   ASP  65          1HB       ASP  65 -14.713  -6.412  -4.709
  376   2HB   ASP  65          2HB       ASP  65 -15.636  -6.717  -6.184
  377    H    SER  66           H        SER  66 -11.643  -8.716  -6.029
  378    HA   SER  66           HA       SER  66 -11.130  -6.503  -7.905
  379   1HB   SER  66          1HB       SER  66 -10.046  -6.801  -5.362
  380   2HB   SER  66          2HB       SER  66  -8.775  -7.401  -6.434
  381    HG   SER  66           HG       SER  66  -8.504  -5.449  -7.222
  382    H    THR  67           H        THR  67  -8.871  -6.952  -9.018
  383    HA   THR  67           HA       THR  67  -8.775  -9.762  -9.837
  384    HB   THR  67           HB       THR  67  -9.797  -8.913 -11.687
  385    HG1  THR  67           HG1      THR  67  -7.410  -9.456 -12.126
  386   1HG2  THR  67          1HG2      THR  67  -9.565  -6.705 -12.598
  387   2HG2  THR  67          2HG2      THR  67  -8.329  -6.322 -11.399
  388   3HG2  THR  67          3HG2      THR  67  -9.988  -6.633 -10.888
  389    H    ASN  68           H        ASN  68  -6.796 -10.627 -10.267
  390    HA   ASN  68           HA       ASN  68  -4.517 -10.793 -10.431
  391   1HB   ASN  68          1HB       ASN  68  -4.281  -7.798 -10.132
  392   2HB   ASN  68          2HB       ASN  68  -3.130  -8.917 -10.867
  393   1HD2  ASN  68          1HD2      ASN  68  -3.999  -6.641 -12.154
  394   2HD2  ASN  68          2HD2      ASN  68  -4.959  -7.092 -13.518
  395    H    CYS  69           H        CYS  69  -4.429 -11.859  -8.489
  396    HA   CYS  69           HA       CYS  69  -3.449 -10.264  -6.226
  397   1HB   CYS  69          1HB       CYS  69  -5.307 -12.645  -6.026
  398   2HB   CYS  69          2HB       CYS  69  -4.653 -11.717  -4.676
  399    H    TYR  70           H        TYR  70  -1.670 -11.278  -7.918
  400    HA   TYR  70           HA       TYR  70  -0.842 -13.900  -7.690
  401   1HB   TYR  70          1HB       TYR  70   0.876 -11.428  -7.988
  402   2HB   TYR  70          2HB       TYR  70   1.405 -13.081  -8.311
  403    HD1  TYR  70           HD1      TYR  70  -0.784 -14.248  -9.791
  404    HD2  TYR  70           HD2      TYR  70   0.791 -10.301 -10.007
  405    HE1  TYR  70           HE1      TYR  70  -1.597 -14.056 -12.103
  406    HE2  TYR  70           HE2      TYR  70  -0.018 -10.100 -12.320
  407    HH   TYR  70           HH       TYR  70  -2.141 -11.475 -13.655
  408    H    LYS  71           H        LYS  71  -1.101 -14.661  -5.629
  409    HA   LYS  71           HA       LYS  71   0.083 -15.505  -3.784
  410   1HB   LYS  71          1HB       LYS  71   2.084 -14.061  -4.483
  411   2HB   LYS  71          2HB       LYS  71   1.410 -12.822  -3.427
  412   1HG   LYS  71          1HG       LYS  71   1.557 -14.368  -1.533
  413   2HG   LYS  71          2HG       LYS  71   2.257 -15.592  -2.596
  414   1HD   LYS  71          1HD       LYS  71   4.286 -14.648  -2.521
  415   2HD   LYS  71          2HD       LYS  71   3.633 -13.023  -2.744
  416   1HE   LYS  71          1HE       LYS  71   3.742 -14.572  -0.158
  417   2HE   LYS  71          2HE       LYS  71   4.762 -13.203  -0.599
  418   1HZ   LYS  71          1HZ       LYS  71   2.337 -12.153  -0.926
  419   2HZ   LYS  71          2HZ       LYS  71   3.207 -12.057   0.521
  420   3HZ   LYS  71          3HZ       LYS  71   2.015 -13.242   0.329
  421    H    ALA  72           H        ALA  72  -2.442 -14.786  -3.745
  422    HA   ALA  72           HA       ALA  72  -2.865 -12.862  -1.586
  423   1HB   ALA  72          1HB       ALA  72  -4.324 -13.519  -3.869
  424   2HB   ALA  72          2HB       ALA  72  -4.822 -12.449  -2.559
  425   3HB   ALA  72          3HB       ALA  72  -5.269 -14.156  -2.523
  426    H    THR  73           H        THR  73  -3.657 -13.398   0.413
  427    HA   THR  73           HA       THR  73  -3.388 -16.187   1.172
  428    HB   THR  73           HB       THR  73  -2.378 -14.370   2.538
  429    HG1  THR  73           HG1      THR  73  -4.385 -15.793   3.939
  430   1HG2  THR  73          1HG2      THR  73  -3.567 -12.560   2.991
  431   2HG2  THR  73          2HG2      THR  73  -4.457 -13.542   4.155
  432   3HG2  THR  73          3HG2      THR  73  -5.075 -13.340   2.515
  433    H    ALA  74           H        ALA  74  -5.905 -13.873   0.596
  434    HA   ALA  74           HA       ALA  74  -7.887 -15.948   1.170
  435   1HB   ALA  74          1HB       ALA  74  -7.907 -14.667   3.186
  436   2HB   ALA  74          2HB       ALA  74  -9.353 -14.248   2.267
  437   3HB   ALA  74          3HB       ALA  74  -7.972 -13.151   2.286
  438    H    CYS  75           H        CYS  75  -8.502 -16.253  -0.912
  439    HA   CYS  75           HA       CYS  75  -9.420 -13.889  -2.406
  440   1HB   CYS  75          1HB       CYS  75  -8.089 -14.658  -4.039
  441   2HB   CYS  75          2HB       CYS  75  -7.796 -16.172  -3.184
  442    H    THR  76           H        THR  76 -11.406 -13.996  -3.522
  443    HA   THR  76           HA       THR  76 -13.148 -16.258  -2.828
  444    HB   THR  76           HB       THR  76 -13.849 -13.329  -2.538
  445    HG1  THR  76           HG1      THR  76 -12.850 -13.899  -0.714
  446   1HG2  THR  76          1HG2      THR  76 -15.822 -14.404  -3.304
  447   2HG2  THR  76          2HG2      THR  76 -15.975 -14.184  -1.561
  448   3HG2  THR  76          3HG2      THR  76 -15.571 -15.769  -2.217
  449    H    ASN  77           H        ASN  77 -13.791 -13.171  -4.465
  450    HA   ASN  77           HA       ASN  77 -14.317 -14.683  -6.937
  451   1HB   ASN  77          1HB       ASN  77 -16.164 -13.144  -7.427
  452   2HB   ASN  77          2HB       ASN  77 -16.430 -13.977  -5.893
  453   1HD2  ASN  77          1HD2      ASN  77 -16.484 -11.048  -7.428
  454   2HD2  ASN  77          2HD2      ASN  77 -16.444 -10.009  -6.048
  455    H    SER  78           H        SER  78 -11.876 -13.870  -6.812
  456    HA   SER  78           HA       SER  78 -11.761 -11.305  -8.260
  457   1HB   SER  78          1HB       SER  78 -10.562 -10.871  -6.306
  458   2HB   SER  78          2HB       SER  78  -9.927 -12.518  -6.214
  459    HG   SER  78           HG       SER  78  -8.348 -11.995  -7.535
  460    H    SER  79           H        SER  79  -9.661 -11.189  -9.637
  461    HA   SER  79           HA       SER  79  -9.742 -13.429 -11.435
  462   1HB   SER  79          1HB       SER  79  -8.340 -10.787 -11.464
  463   2HB   SER  79          2HB       SER  79  -7.942 -12.034 -12.644
  464    HG   SER  79           HG       SER  79 -10.253 -12.058 -13.124
  465    H    GLY  80           H        GLY  80  -6.611 -12.056 -11.212
  466   1HA   GLY  80          1HA       GLY  80  -5.216 -14.372 -10.993
  467   2HA   GLY  80          2HA       GLY  80  -4.601 -12.829 -10.426
  468    H    CYS  81           H        CYS  81  -6.743 -15.477  -9.418
  469    HA   CYS  81           HA       CYS  81  -6.390 -14.858  -6.627
  470   1HB   CYS  81          1HB       CYS  81  -8.013 -16.733  -8.234
  471   2HB   CYS  81          2HB       CYS  81  -7.584 -17.295  -6.618
  472    HA   PRO  82           HA       PRO  82  -3.184 -17.385  -5.034
  473   1HB   PRO  82          1HB       PRO  82  -5.257 -19.363  -4.158
  474   2HB   PRO  82          2HB       PRO  82  -3.863 -18.727  -3.266
  475   1HG   PRO  82          1HG       PRO  82  -6.294 -17.762  -2.811
  476   2HG   PRO  82          2HG       PRO  82  -4.888 -16.682  -2.863
  477   1HD   PRO  82          1HD       PRO  82  -7.061 -17.053  -4.846
  478   2HD   PRO  82          2HD       PRO  82  -6.096 -15.611  -4.490
  479    H    GLY  83           H        GLY  83  -2.111 -19.526  -5.221
  480   1HA   GLY  83          1HA       GLY  83  -2.647 -20.663  -7.851
  481   2HA   GLY  83          2HA       GLY  83  -1.216 -20.935  -6.871
  482    H    HIS  84           H        HIS  84  -4.129 -22.228  -7.934
  483    HA   HIS  84           HA       HIS  84  -4.913 -23.875  -5.817
  484   1HB   HIS  84          1HB       HIS  84  -5.402 -23.732  -8.702
  485   2HB   HIS  84          2HB       HIS  84  -5.491 -25.369  -8.062
  486    HD1  HIS  84           HD1      HIS  84  -7.049 -25.380  -5.684
  487    HD2  HIS  84           HD2      HIS  84  -7.803 -22.521  -8.603
  488    HE1  HIS  84           HE1      HIS  84  -9.393 -24.578  -5.250
  489    HE2  HIS  84           HE2      HIS  84  -9.798 -22.792  -6.980
  Start of MODEL   20
    1   1H    GLN   1          1H        GLN   1  -9.503  22.728  -0.126
    2   2H    GLN   1          2H        GLN   1  -7.908  22.138  -0.351
    3   3H    GLN   1          3H        GLN   1  -8.942  21.403   0.805
    4    HA   GLN   1           HA       GLN   1 -10.437  20.777  -0.988
    5   1HB   GLN   1          1HB       GLN   1  -9.734  22.524  -2.555
    6   2HB   GLN   1          2HB       GLN   1  -8.135  21.802  -2.664
    7   1HG   GLN   1          1HG       GLN   1  -9.915  19.748  -3.296
    8   2HG   GLN   1          2HG       GLN   1 -10.529  21.179  -4.123
    9   1HE2  GLN   1          1HE2      GLN   1  -8.005  18.843  -3.933
   10   2HE2  GLN   1          2HE2      GLN   1  -7.149  19.332  -5.352
   11    H    CYS   2           H        CYS   2 -10.374  18.633  -0.878
   12    HA   CYS   2           HA       CYS   2  -7.987  17.160  -1.550
   13   1HB   CYS   2          1HB       CYS   2  -8.266  17.852   1.102
   14   2HB   CYS   2          2HB       CYS   2  -8.980  16.243   1.050
   15    H    THR   3           H        THR   3 -10.666  17.387  -2.585
   16    HA   THR   3           HA       THR   3 -11.313  14.570  -2.672
   17    HB   THR   3           HB       THR   3 -13.849  15.672  -2.332
   18    HG1  THR   3           HG1      THR   3 -12.167  16.582  -0.244
   19   1HG2  THR   3          1HG2      THR   3 -14.000  13.842  -1.116
   20   2HG2  THR   3          2HG2      THR   3 -13.060  14.619   0.157
   21   3HG2  THR   3          3HG2      THR   3 -12.244  13.682  -1.094
   22    H    GLY   4           H        GLY   4 -10.653  14.839  -4.852
   23   1HA   GLY   4          1HA       GLY   4 -11.768  14.728  -7.005
   24   2HA   GLY   4          2HA       GLY   4 -12.725  16.126  -6.516
   25    H    GLY   5           H        GLY   5 -11.573  16.265  -8.920
   26   1HA   GLY   5          1HA       GLY   5 -10.525  18.256  -9.813
   27   2HA   GLY   5          2HA       GLY   5  -9.386  18.194  -8.475
   28    H    ALA   6           H        ALA   6 -10.308  15.335 -10.254
   29    HA   ALA   6           HA       ALA   6  -9.142  13.908 -11.587
   30   1HB   ALA   6          1HB       ALA   6  -7.784  16.476 -12.381
   31   2HB   ALA   6          2HB       ALA   6  -9.081  15.631 -13.226
   32   3HB   ALA   6          3HB       ALA   6  -7.467  14.924 -13.157
   33    H    ASP   7           H        ASP   7  -6.430  16.101 -10.969
   34    HA   ASP   7           HA       ASP   7  -5.085  13.899  -9.548
   35   1HB   ASP   7          1HB       ASP   7  -3.759  16.236 -10.937
   36   2HB   ASP   7          2HB       ASP   7  -2.982  14.779 -10.314
   37    H    CYS   8           H        CYS   8  -4.077  14.292  -7.598
   38    HA   CYS   8           HA       CYS   8  -5.154  16.281  -5.947
   39   1HB   CYS   8          1HB       CYS   8  -2.868  14.362  -5.692
   40   2HB   CYS   8          2HB       CYS   8  -3.078  15.622  -4.475
   41    H    THR   9           H        THR   9  -4.786  18.381  -5.966
   42    HA   THR   9           HA       THR   9  -2.070  19.341  -6.581
   43    HB   THR   9           HB       THR   9  -3.407  19.785  -8.528
   44    HG1  THR   9           HG1      THR   9  -2.049  21.509  -7.662
   45   1HG2  THR   9          1HG2      THR   9  -5.605  19.776  -7.078
   46   2HG2  THR   9          2HG2      THR   9  -5.505  20.649  -8.607
   47   3HG2  THR   9          3HG2      THR   9  -5.329  21.517  -7.082
   48    H    SER  10           H        SER  10  -3.775  18.918  -4.052
   49    HA   SER  10           HA       SER  10  -2.942  21.380  -2.787
   50   1HB   SER  10          1HB       SER  10  -5.292  21.764  -3.720
   51   2HB   SER  10          2HB       SER  10  -5.843  20.601  -2.515
   52    HG   SER  10           HG       SER  10  -6.002  22.611  -1.602
   53    H    CYS  11           H        CYS  11  -2.549  18.374  -2.666
   54    HA   CYS  11           HA       CYS  11  -2.561  18.208   0.226
   55   1HB   CYS  11          1HB       CYS  11  -3.940  16.078  -1.423
   56   2HB   CYS  11          2HB       CYS  11  -3.724  16.070   0.324
   57    H    THR  12           H        THR  12  -1.479  16.104   0.938
   58    HA   THR  12           HA       THR  12   0.369  15.033  -1.049
   59    HB   THR  12           HB       THR  12   1.441  17.035   0.059
   60    HG1  THR  12           HG1      THR  12   3.141  15.968  -0.482
   61   1HG2  THR  12          1HG2      THR  12   2.186  16.990   2.264
   62   2HG2  THR  12          2HG2      THR  12   1.793  15.281   2.457
   63   3HG2  THR  12          3HG2      THR  12   0.501  16.478   2.361
   64    H    GLY  13           H        GLY  13  -0.789  14.966   2.298
   65   1HA   GLY  13          1HA       GLY  13   0.238  12.449   2.991
   66   2HA   GLY  13          2HA       GLY  13  -1.144  13.225   3.746
   67    H    ALA  14           H        ALA  14  -2.973  12.119   3.629
   68    HA   ALA  14           HA       ALA  14  -3.204   9.868   1.840
   69   1HB   ALA  14          1HB       ALA  14  -4.850  10.962   4.081
   70   2HB   ALA  14          2HB       ALA  14  -4.105   9.373   3.907
   71   3HB   ALA  14          3HB       ALA  14  -5.546   9.778   2.974
   72    H    CYS  15           H        CYS  15  -4.392   9.718   0.016
   73    HA   CYS  15           HA       CYS  15  -5.650  12.180  -0.948
   74   1HB   CYS  15          1HB       CYS  15  -5.484   9.885  -2.790
   75   2HB   CYS  15          2HB       CYS  15  -5.078  11.575  -3.056
   76    H    THR  16           H        THR  16  -7.748  12.242  -1.742
   77    HA   THR  16           HA       THR  16  -9.418   9.868  -1.372
   78    HB   THR  16           HB       THR  16 -10.205  12.579  -0.295
   79    HG1  THR  16           HG1      THR  16  -9.840  11.596   1.757
   80   1HG2  THR  16          1HG2      THR  16 -12.225  11.722  -0.075
   81   2HG2  THR  16          2HG2      THR  16 -11.561  10.487   0.995
   82   3HG2  THR  16          3HG2      THR  16 -11.680  10.182  -0.738
   83    H    GLY  17           H        GLY  17 -10.549   9.533  -3.171
   84   1HA   GLY  17          1HA       GLY  17 -11.668   9.911  -5.141
   85   2HA   GLY  17          2HA       GLY  17 -12.115  11.477  -4.465
   86    H    CYS  18           H        CYS  18  -8.792  10.516  -4.911
   87    HA   CYS  18           HA       CYS  18  -8.474  12.666  -6.880
   88   1HB   CYS  18          1HB       CYS  18  -6.951  11.791  -4.629
   89   2HB   CYS  18          2HB       CYS  18  -5.963  11.564  -6.073
   90    H    GLY  19           H        GLY  19  -6.420  12.128  -8.352
   91   1HA   GLY  19          1HA       GLY  19  -7.028   9.531  -9.625
   92   2HA   GLY  19          2HA       GLY  19  -6.481  10.962 -10.497
   93    H    ASN  20           H        ASN  20  -4.532  11.537  -8.291
   94    HA   ASN  20           HA       ASN  20  -2.637   9.336  -8.601
   95   1HB   ASN  20          1HB       ASN  20  -2.124  10.855 -10.445
   96   2HB   ASN  20          2HB       ASN  20  -2.015  12.209  -9.325
   97   1HD2  ASN  20          1HD2      ASN  20  -0.498   9.299 -10.472
   98   2HD2  ASN  20          2HD2      ASN  20   1.055   9.593  -9.775
   99    H    CYS  21           H        CYS  21  -1.167   9.149  -6.930
  100    HA   CYS  21           HA       CYS  21  -1.647  10.952  -4.652
  101   1HB   CYS  21          1HB       CYS  21  -1.124   8.011  -4.825
  102   2HB   CYS  21          2HB       CYS  21  -0.648   8.893  -3.371
  103    HA   PRO  22           HA       PRO  22   2.695  11.917  -5.299
  104   1HB   PRO  22          1HB       PRO  22   2.765  14.156  -3.844
  105   2HB   PRO  22          2HB       PRO  22   1.933  14.106  -5.403
  106   1HG   PRO  22          1HG       PRO  22   0.795  13.971  -2.641
  107   2HG   PRO  22          2HG       PRO  22   0.191  14.847  -4.059
  108   1HD   PRO  22          1HD       PRO  22  -0.763  12.401  -3.196
  109   2HD   PRO  22          2HD       PRO  22  -0.918  13.018  -4.853
  110    H    ASN  23           H        ASN  23   3.478  10.089  -4.129
  111    HA   ASN  23           HA       ASN  23   4.667   9.078  -2.475
  112   1HB   ASN  23          1HB       ASN  23   4.782  11.913  -1.428
  113   2HB   ASN  23          2HB       ASN  23   5.653  10.564  -0.692
  114   1HD2  ASN  23          1HD2      ASN  23   5.083  11.259  -4.108
  115   2HD2  ASN  23          2HD2      ASN  23   6.749  11.415  -4.536
  116    H    ALA  24           H        ALA  24   1.672   9.680  -2.272
  117    HA   ALA  24           HA       ALA  24   1.008   9.864   0.471
  118   1HB   ALA  24          1HB       ALA  24  -0.752   8.419  -1.459
  119   2HB   ALA  24          2HB       ALA  24  -0.472  10.149  -1.659
  120   3HB   ALA  24          3HB       ALA  24  -1.183   9.537  -0.165
  121    H    VAL  25           H        VAL  25   0.792   8.362   2.041
  122    HA   VAL  25           HA       VAL  25   1.917   5.739   1.549
  123    HB   VAL  25           HB       VAL  25   2.545   6.975   3.579
  124   1HG1  VAL  25          1HG1      VAL  25  -0.052   7.722   3.738
  125   2HG1  VAL  25          2HG1      VAL  25   1.095   7.827   5.074
  126   3HG1  VAL  25          3HG1      VAL  25   0.002   6.448   4.956
  127   1HG2  VAL  25          1HG2      VAL  25   2.793   5.083   4.774
  128   2HG2  VAL  25          2HG2      VAL  25   2.058   4.320   3.364
  129   3HG2  VAL  25          3HG2      VAL  25   1.067   4.726   4.765
  130    H    THR  26           H        THR  26  -1.207   7.174   2.129
  131    HA   THR  26           HA       THR  26  -2.499   4.682   1.425
  132    HB   THR  26           HB       THR  26  -3.730   5.853   3.822
  133    HG1  THR  26           HG1      THR  26  -1.287   4.444   4.082
  134   1HG2  THR  26          1HG2      THR  26  -3.223   3.212   4.329
  135   2HG2  THR  26          2HG2      THR  26  -3.437   3.247   2.578
  136   3HG2  THR  26          3HG2      THR  26  -4.704   3.870   3.635
  137    H    CYS  27           H        CYS  27  -4.389   5.017   0.364
  138    HA   CYS  27           HA       CYS  27  -5.595   7.687   0.498
  139   1HB   CYS  27          1HB       CYS  27  -5.734   7.895  -1.877
  140   2HB   CYS  27          2HB       CYS  27  -4.060   7.490  -1.497
  141    H    THR  28           H        THR  28  -7.788   7.788  -0.243
  142    HA   THR  28           HA       THR  28  -9.193   5.245   0.151
  143    HB   THR  28           HB       THR  28 -10.472   7.972   0.112
  144    HG1  THR  28           HG1      THR  28  -9.849   8.337   2.105
  145   1HG2  THR  28          1HG2      THR  28 -12.290   6.742   0.444
  146   2HG2  THR  28          2HG2      THR  28 -11.656   6.445   2.064
  147   3HG2  THR  28          3HG2      THR  28 -11.348   5.287   0.770
  148    H    ASN  29           H        ASN  29  -9.244   4.303  -1.844
  149    HA   ASN  29           HA       ASN  29 -10.158   3.821  -3.838
  150   1HB   ASN  29          1HB       ASN  29 -11.216   6.648  -4.001
  151   2HB   ASN  29          2HB       ASN  29 -11.783   5.230  -4.884
  152   1HD2  ASN  29          1HD2      ASN  29 -13.152   3.795  -3.898
  153   2HD2  ASN  29          2HD2      ASN  29 -13.909   4.107  -2.378
  154    H    SER  30           H        SER  30 -10.316   6.167  -5.778
  155    HA   SER  30           HA       SER  30  -8.983   7.397  -7.192
  156   1HB   SER  30          1HB       SER  30  -7.497   7.770  -5.134
  157   2HB   SER  30          2HB       SER  30  -6.531   6.419  -5.727
  158    HG   SER  30           HG       SER  30  -5.721   7.669  -7.211
  159    H    GLN  31           H        GLN  31  -7.123   6.936  -8.806
  160    HA   GLN  31           HA       GLN  31  -7.091   4.064  -9.452
  161   1HB   GLN  31          1HB       GLN  31  -7.046   5.640 -11.858
  162   2HB   GLN  31          2HB       GLN  31  -8.188   4.388 -11.371
  163   1HG   GLN  31          1HG       GLN  31  -9.425   6.120 -10.082
  164   2HG   GLN  31          2HG       GLN  31  -8.336   7.331 -10.760
  165   1HE2  GLN  31          1HE2      GLN  31 -11.304   6.124 -11.056
  166   2HE2  GLN  31          2HE2      GLN  31 -11.585   6.366 -12.744
  167    H    HIS  32           H        HIS  32  -4.982   5.240  -8.129
  168    HA   HIS  32           HA       HIS  32  -2.821   4.594  -9.788
  169   1HB   HIS  32          1HB       HIS  32  -3.703   6.999 -10.560
  170   2HB   HIS  32          2HB       HIS  32  -2.636   7.508  -9.247
  171    HD1  HIS  32           HD1      HIS  32  -2.400   7.552 -12.605
  172    HD2  HIS  32           HD2      HIS  32  -0.105   5.554  -9.775
  173    HE1  HIS  32           HE1      HIS  32  -0.196   7.095 -13.728
  174    HE2  HIS  32           HE2      HIS  32   1.196   5.932 -11.978
  175    H    CYS  33           H        CYS  33  -3.625   3.956  -7.197
  176    HA   CYS  33           HA       CYS  33  -1.703   5.323  -5.455
  177   1HB   CYS  33          1HB       CYS  33  -4.299   4.321  -5.023
  178   2HB   CYS  33          2HB       CYS  33  -3.218   3.242  -4.138
  179    H    VAL  34           H        VAL  34  -0.699   3.705  -7.499
  180    HA   VAL  34           HA       VAL  34  -0.156   1.060  -6.920
  181    HB   VAL  34           HB       VAL  34   0.422   2.202  -9.046
  182   1HG1  VAL  34          1HG1      VAL  34   2.666   3.347  -9.125
  183   2HG1  VAL  34          2HG1      VAL  34   2.618   3.399  -7.361
  184   3HG1  VAL  34          3HG1      VAL  34   1.387   4.242  -8.305
  185   1HG2  VAL  34          1HG2      VAL  34   2.305   0.858  -9.537
  186   2HG2  VAL  34          2HG2      VAL  34   1.400  -0.009  -8.296
  187   3HG2  VAL  34          3HG2      VAL  34   2.855   0.888  -7.861
  188    H    LYS  35           H        LYS  35   1.202   3.936  -5.512
  189    HA   LYS  35           HA       LYS  35   3.152   2.293  -4.056
  190   1HB   LYS  35          1HB       LYS  35   4.554   4.150  -3.897
  191   2HB   LYS  35          2HB       LYS  35   3.887   4.275  -5.512
  192   1HG   LYS  35          1HG       LYS  35   2.099   5.768  -4.208
  193   2HG   LYS  35          2HG       LYS  35   3.496   6.016  -3.158
  194   1HD   LYS  35          1HD       LYS  35   3.441   6.462  -6.143
  195   2HD   LYS  35          2HD       LYS  35   3.347   7.727  -4.916
  196   1HE   LYS  35          1HE       LYS  35   5.555   7.656  -4.499
  197   2HE   LYS  35          2HE       LYS  35   5.619   5.897  -4.609
  198   1HZ   LYS  35          1HZ       LYS  35   5.212   6.531  -7.156
  199   2HZ   LYS  35          2HZ       LYS  35   6.754   6.365  -6.478
  200   3HZ   LYS  35          3HZ       LYS  35   6.073   7.902  -6.661
  201    H    ALA  36           H        ALA  36   0.465   2.273  -3.240
  202    HA   ALA  36           HA       ALA  36   0.558   3.846  -0.749
  203   1HB   ALA  36          1HB       ALA  36  -2.025   2.942  -0.941
  204   2HB   ALA  36          2HB       ALA  36  -1.596   3.250  -2.624
  205   3HB   ALA  36          3HB       ALA  36  -1.456   4.539  -1.428
  206    H    ASN  37           H        ASN  37   0.226   2.841   1.207
  207    HA   ASN  37           HA       ASN  37   1.013   0.141   1.428
  208   1HB   ASN  37          1HB       ASN  37   1.091   2.160   3.143
  209   2HB   ASN  37          2HB       ASN  37  -0.446   1.478   3.664
  210   1HD2  ASN  37          1HD2      ASN  37   0.079   0.601   5.565
  211   2HD2  ASN  37          2HD2      ASN  37   1.284  -0.615   5.793
  212    H    THR  38           H        THR  38  -2.137   1.734   1.687
  213    HA   THR  38           HA       THR  38  -3.425  -0.842   1.197
  214    HB   THR  38           HB       THR  38  -4.250   0.999   3.451
  215    HG1  THR  38           HG1      THR  38  -3.535  -0.674   4.782
  216   1HG2  THR  38          1HG2      THR  38  -5.465  -1.457   2.301
  217   2HG2  THR  38          2HG2      THR  38  -6.234   0.003   2.924
  218   3HG2  THR  38          3HG2      THR  38  -5.559  -1.182   4.042
  219    H    CYS  39           H        CYS  39  -5.598  -0.658   0.389
  220    HA   CYS  39           HA       CYS  39  -6.333   2.037  -0.527
  221   1HB   CYS  39          1HB       CYS  39  -6.603  -0.404  -2.279
  222   2HB   CYS  39          2HB       CYS  39  -6.791   1.289  -2.737
  223    H    THR  40           H        THR  40  -8.581   2.214  -1.227
  224    HA   THR  40           HA       THR  40 -10.420   0.168  -0.279
  225    HB   THR  40           HB       THR  40 -10.489   3.005   0.778
  226    HG1  THR  40           HG1      THR  40  -9.634   2.236   2.547
  227   1HG2  THR  40          1HG2      THR  40 -12.667   2.633   1.042
  228   2HG2  THR  40          2HG2      THR  40 -12.180   1.534   2.332
  229   3HG2  THR  40          3HG2      THR  40 -12.508   0.907   0.716
  230    H    GLY  41           H        GLY  41 -11.063  -0.063  -2.426
  231   1HA   GLY  41          1HA       GLY  41 -12.594   0.368  -4.124
  232   2HA   GLY  41          2HA       GLY  41 -12.978   1.892  -3.343
  233    H    SER  42           H        SER  42  -9.971   0.534  -4.644
  234    HA   SER  42           HA       SER  42  -9.831   2.845  -6.450
  235   1HB   SER  42          1HB       SER  42  -7.255   1.795  -5.402
  236   2HB   SER  42          2HB       SER  42  -7.735   3.455  -5.736
  237    HG   SER  42           HG       SER  42  -8.518   1.910  -3.488
  238    H    THR  43           H        THR  43  -7.267   1.906  -7.540
  239    HA   THR  43           HA       THR  43  -7.911  -0.789  -8.403
  240    HB   THR  43           HB       THR  43  -8.147  -0.381 -10.639
  241    HG1  THR  43           HG1      THR  43  -7.194   1.213 -11.718
  242   1HG2  THR  43          1HG2      THR  43  -9.278   2.029  -9.258
  243   2HG2  THR  43          2HG2      THR  43 -10.095   0.526  -9.693
  244   3HG2  THR  43          3HG2      THR  43  -9.583   1.648 -10.956
  245    H    ASP  44           H        ASP  44  -5.657   1.694  -9.553
  246    HA   ASP  44           HA       ASP  44  -3.495  -0.036  -9.888
  247   1HB   ASP  44          1HB       ASP  44  -4.038   2.741 -10.288
  248   2HB   ASP  44          2HB       ASP  44  -2.513   2.595  -9.418
  249    H    CYS  45           H        CYS  45  -3.514  -1.193  -7.937
  250    HA   CYS  45           HA       CYS  45  -1.971   0.107  -5.791
  251   1HB   CYS  45          1HB       CYS  45  -4.416  -1.644  -5.519
  252   2HB   CYS  45          2HB       CYS  45  -3.296  -1.362  -4.181
  253    H    ASN  46           H        ASN  46  -0.098  -0.918  -6.694
  254    HA   ASN  46           HA       ASN  46  -0.071  -3.837  -6.659
  255   1HB   ASN  46          1HB       ASN  46   1.471  -3.718  -8.286
  256   2HB   ASN  46          2HB       ASN  46   1.068  -2.003  -8.379
  257   1HD2  ASN  46          1HD2      ASN  46   3.233  -4.321  -6.841
  258   2HD2  ASN  46          2HD2      ASN  46   4.558  -3.230  -6.648
  259    H    THR  47           H        THR  47   1.497  -1.088  -5.070
  260    HA   THR  47           HA       THR  47   3.223  -2.771  -3.503
  261    HB   THR  47           HB       THR  47   3.892  -0.715  -2.377
  262    HG1  THR  47           HG1      THR  47   1.671   0.372  -3.745
  263   1HG2  THR  47          1HG2      THR  47   4.065   0.713  -4.695
  264   2HG2  THR  47          2HG2      THR  47   3.888  -0.941  -5.279
  265   3HG2  THR  47          3HG2      THR  47   5.196  -0.532  -4.169
  266    H    ALA  48           H        ALA  48   0.043  -1.425  -3.127
  267    HA   ALA  48           HA       ALA  48  -0.226  -1.427  -0.359
  268   1HB   ALA  48          1HB       ALA  48  -2.082  -1.611  -2.649
  269   2HB   ALA  48          2HB       ALA  48  -2.068  -0.495  -1.284
  270   3HB   ALA  48          3HB       ALA  48  -2.708  -2.126  -1.083
  271    H    GLN  49           H        GLN  49  -0.660  -2.946   1.169
  272    HA   GLN  49           HA       GLN  49  -0.106  -5.691   0.480
  273   1HB   GLN  49          1HB       GLN  49   0.661  -4.434   2.589
  274   2HB   GLN  49          2HB       GLN  49  -0.969  -4.706   3.189
  275   1HG   GLN  49          1HG       GLN  49  -0.601  -6.882   3.590
  276   2HG   GLN  49          2HG       GLN  49   0.392  -7.090   2.149
  277   1HE2  GLN  49          1HE2      GLN  49   2.582  -6.111   2.261
  278   2HE2  GLN  49          2HE2      GLN  49   3.430  -6.208   3.764
  279    H    THR  50           H        THR  50  -2.850  -3.909   0.271
  280    HA   THR  50           HA       THR  50  -4.546  -6.079  -0.144
  281    HB   THR  50           HB       THR  50  -4.242  -6.084   2.425
  282    HG1  THR  50           HG1      THR  50  -6.459  -6.660   2.660
  283   1HG2  THR  50          1HG2      THR  50  -5.484  -4.653   3.745
  284   2HG2  THR  50          2HG2      THR  50  -6.438  -4.064   2.383
  285   3HG2  THR  50          3HG2      THR  50  -4.750  -3.576   2.557
  286    H    CYS  51           H        CYS  51  -6.827  -5.385  -0.496
  287    HA   CYS  51           HA       CYS  51  -7.607  -2.689  -0.467
  288   1HB   CYS  51          1HB       CYS  51  -7.450  -2.121  -2.845
  289   2HB   CYS  51          2HB       CYS  51  -5.851  -2.412  -2.156
  290    H    THR  52           H        THR  52  -9.434  -2.359  -2.263
  291    HA   THR  52           HA       THR  52 -10.908  -4.816  -2.763
  292    HB   THR  52           HB       THR  52 -11.563  -4.095  -0.473
  293    HG1  THR  52           HG1      THR  52 -13.629  -4.541  -0.842
  294   1HG2  THR  52          1HG2      THR  52 -11.371  -1.707  -0.619
  295   2HG2  THR  52          2HG2      THR  52 -13.036  -2.140  -0.232
  296   3HG2  THR  52          3HG2      THR  52 -12.611  -1.648  -1.871
  297    H    ASN  53           H        ASN  53 -12.396  -4.646  -4.435
  298    HA   ASN  53           HA       ASN  53 -13.224  -3.853  -6.402
  299   1HB   ASN  53          1HB       ASN  53 -13.589  -1.630  -4.467
  300   2HB   ASN  53          2HB       ASN  53 -13.776  -1.227  -6.176
  301   1HD2  ASN  53          1HD2      ASN  53 -14.825  -3.557  -3.730
  302   2HD2  ASN  53          2HD2      ASN  53 -16.417  -3.774  -4.367
  303    H    SER  54           H        SER  54 -10.368  -3.865  -6.060
  304    HA   SER  54           HA       SER  54  -9.525  -1.522  -7.622
  305   1HB   SER  54          1HB       SER  54  -7.403  -1.759  -6.741
  306   2HB   SER  54          2HB       SER  54  -8.374  -2.393  -5.407
  307    HG   SER  54           HG       SER  54  -6.439  -3.636  -6.422
  308    H    LYS  55           H        LYS  55  -7.333  -2.407  -8.888
  309    HA   LYS  55           HA       LYS  55  -8.162  -4.696 -10.531
  310   1HB   LYS  55          1HB       LYS  55  -7.370  -1.941 -11.448
  311   2HB   LYS  55          2HB       LYS  55  -7.143  -3.340 -12.488
  312   1HG   LYS  55          1HG       LYS  55  -9.603  -3.822 -12.162
  313   2HG   LYS  55          2HG       LYS  55  -9.720  -2.223 -11.427
  314   1HD   LYS  55          1HD       LYS  55  -8.317  -1.803 -13.793
  315   2HD   LYS  55          2HD       LYS  55  -9.569  -2.970 -14.222
  316   1HE   LYS  55          1HE       LYS  55 -10.286  -0.623 -14.518
  317   2HE   LYS  55          2HE       LYS  55 -11.286  -1.512 -13.370
  318   1HZ   LYS  55          1HZ       LYS  55  -9.009   0.101 -12.420
  319   2HZ   LYS  55          2HZ       LYS  55 -10.406  -0.364 -11.588
  320   3HZ   LYS  55          3HZ       LYS  55 -10.490   0.843 -12.769
  321    H    ASP  56           H        ASP  56  -6.126  -4.063  -8.354
  322    HA   ASP  56           HA       ASP  56  -3.891  -5.353  -9.651
  323   1HB   ASP  56          1HB       ASP  56  -3.925  -2.577  -9.121
  324   2HB   ASP  56          2HB       ASP  56  -2.854  -3.295  -7.917
  325    H    CYS  57           H        CYS  57  -2.451  -4.496  -7.032
  326    HA   CYS  57           HA       CYS  57  -2.235  -5.163  -4.862
  327   1HB   CYS  57          1HB       CYS  57  -5.048  -5.909  -5.358
  328   2HB   CYS  57          2HB       CYS  57  -4.232  -6.878  -4.137
  329    H    PHE  58           H        PHE  58  -0.896  -6.369  -6.847
  330    HA   PHE  58           HA       PHE  58  -1.103  -9.113  -7.163
  331   1HB   PHE  58          1HB       PHE  58   1.399  -7.414  -7.084
  332   2HB   PHE  58          2HB       PHE  58   1.309  -9.052  -7.721
  333    HD1  PHE  58           HD1      PHE  58   0.364  -9.511  -9.816
  334    HD2  PHE  58           HD2      PHE  58   0.381  -5.568  -8.226
  335    HE1  PHE  58           HE1      PHE  58  -0.162  -8.616 -12.039
  336    HE2  PHE  58           HE2      PHE  58  -0.145  -4.670 -10.447
  337    HZ   PHE  58           HZ       PHE  58  -0.404  -6.205 -12.324
  338    H    GLU  59           H        GLU  59   0.927  -7.362  -4.809
  339    HA   GLU  59           HA       GLU  59   1.306  -9.856  -3.328
  340   1HB   GLU  59          1HB       GLU  59   3.058  -8.662  -2.116
  341   2HB   GLU  59          2HB       GLU  59   3.304  -8.529  -3.857
  342   1HG   GLU  59          1HG       GLU  59   1.822  -6.304  -3.330
  343   2HG   GLU  59          2HG       GLU  59   2.783  -6.459  -1.861
  344    H    ALA  60           H        ALA  60  -1.269  -8.785  -3.225
  345    HA   ALA  60           HA       ALA  60  -1.487  -7.428  -0.646
  346   1HB   ALA  60          1HB       ALA  60  -3.987  -7.508  -1.287
  347   2HB   ALA  60          2HB       ALA  60  -3.397  -7.970  -2.883
  348   3HB   ALA  60          3HB       ALA  60  -2.914  -6.427  -2.177
  349    H    ASN  61           H        ASN  61  -2.428  -8.306   1.150
  350    HA   ASN  61           HA       ASN  61  -2.375 -11.137   1.413
  351   1HB   ASN  61          1HB       ASN  61  -2.563  -8.857   3.153
  352   2HB   ASN  61          2HB       ASN  61  -3.804 -10.026   3.593
  353   1HD2  ASN  61          1HD2      ASN  61  -3.206 -11.479   5.012
  354   2HD2  ASN  61          2HD2      ASN  61  -1.597 -12.046   5.282
  355    H    THR  62           H        THR  62  -4.971  -8.728   1.230
  356    HA   THR  62           HA       THR  62  -6.873 -10.943   0.807
  357    HB   THR  62           HB       THR  62  -7.905  -8.308   1.698
  358    HG1  THR  62           HG1      THR  62  -6.131  -8.589   3.081
  359   1HG2  THR  62          1HG2      THR  62  -9.469  -9.592   2.939
  360   2HG2  THR  62          2HG2      THR  62  -8.541 -11.071   2.689
  361   3HG2  THR  62          3HG2      THR  62  -9.355 -10.300   1.328
  362    H    CYS  63           H        CYS  63  -8.448 -10.691  -0.795
  363    HA   CYS  63           HA       CYS  63  -8.332  -8.315  -2.480
  364   1HB   CYS  63          1HB       CYS  63  -7.890 -11.101  -3.577
  365   2HB   CYS  63          2HB       CYS  63  -8.027  -9.623  -4.532
  366    H    THR  64           H        THR  64 -10.393  -7.697  -2.476
  367    HA   THR  64           HA       THR  64 -12.446  -9.729  -3.052
  368    HB   THR  64           HB       THR  64 -13.875  -7.836  -1.742
  369    HG1  THR  64           HG1      THR  64 -11.361  -7.930  -0.435
  370   1HG2  THR  64          1HG2      THR  64 -12.717 -10.400  -0.987
  371   2HG2  THR  64          2HG2      THR  64 -14.350  -9.773  -0.757
  372   3HG2  THR  64          3HG2      THR  64 -13.073  -9.344   0.380
  373    H    ASP  65           H        ASP  65 -13.551  -9.357  -4.857
  374    HA   ASP  65           HA       ASP  65 -14.381  -8.338  -6.713
  375   1HB   ASP  65          1HB       ASP  65 -15.455  -7.000  -4.707
  376   2HB   ASP  65          2HB       ASP  65 -14.436  -5.693  -5.319
  377    H    SER  66           H        SER  66 -11.479  -8.346  -6.224
  378    HA   SER  66           HA       SER  66 -10.747  -6.063  -7.938
  379   1HB   SER  66          1HB       SER  66  -9.751  -5.724  -5.762
  380   2HB   SER  66          2HB       SER  66  -9.131  -7.378  -5.741
  381    HG   SER  66           HG       SER  66  -8.181  -5.134  -7.068
  382    H    THR  67           H        THR  67  -8.396  -6.631  -8.894
  383    HA   THR  67           HA       THR  67  -8.357  -9.409  -9.798
  384    HB   THR  67           HB       THR  67  -9.479  -7.446 -11.360
  385    HG1  THR  67           HG1      THR  67  -9.540  -9.019 -12.860
  386   1HG2  THR  67          1HG2      THR  67  -8.092  -6.873 -13.145
  387   2HG2  THR  67          2HG2      THR  67  -6.820  -7.976 -12.621
  388   3HG2  THR  67          3HG2      THR  67  -7.151  -6.509 -11.699
  389    H    ASN  68           H        ASN  68  -6.307  -9.989 -10.888
  390    HA   ASN  68           HA       ASN  68  -4.029 -10.086 -10.913
  391   1HB   ASN  68          1HB       ASN  68  -4.712  -7.318 -11.442
  392   2HB   ASN  68          2HB       ASN  68  -3.158  -7.438 -10.612
  393   1HD2  ASN  68          1HD2      ASN  68  -2.181  -9.786 -11.602
  394   2HD2  ASN  68          2HD2      ASN  68  -1.900  -9.633 -13.300
  395    H    CYS  69           H        CYS  69  -4.179 -11.102  -8.779
  396    HA   CYS  69           HA       CYS  69  -2.976  -9.400  -6.705
  397   1HB   CYS  69          1HB       CYS  69  -5.285 -11.257  -6.552
  398   2HB   CYS  69          2HB       CYS  69  -4.165 -11.270  -5.188
  399    H    TYR  70           H        TYR  70  -1.931 -11.367  -8.787
  400    HA   TYR  70           HA       TYR  70  -0.415 -13.048  -8.984
  401   1HB   TYR  70          1HB       TYR  70   0.485 -11.172  -6.999
  402   2HB   TYR  70          2HB       TYR  70   1.085 -12.783  -6.604
  403    HD1  TYR  70           HD1      TYR  70   0.474 -11.618 -10.055
  404    HD2  TYR  70           HD2      TYR  70   3.388 -12.333  -7.037
  405    HE1  TYR  70           HE1      TYR  70   2.261 -11.359 -11.725
  406    HE2  TYR  70           HE2      TYR  70   5.181 -12.075  -8.699
  407    HH   TYR  70           HH       TYR  70   5.473 -10.916 -10.928
  408    H    LYS  71           H        LYS  71  -0.411 -13.167  -5.448
  409    HA   LYS  71           HA       LYS  71  -1.946 -15.621  -5.417
  410   1HB   LYS  71          1HB       LYS  71   0.677 -15.970  -5.862
  411   2HB   LYS  71          2HB       LYS  71   0.707 -15.870  -4.101
  412   1HG   LYS  71          1HG       LYS  71  -1.404 -17.618  -4.998
  413   2HG   LYS  71          2HG       LYS  71   0.155 -18.110  -5.662
  414   1HD   LYS  71          1HD       LYS  71  -0.454 -17.620  -2.746
  415   2HD   LYS  71          2HD       LYS  71  -0.285 -19.198  -3.515
  416   1HE   LYS  71          1HE       LYS  71   1.900 -19.126  -3.130
  417   2HE   LYS  71          2HE       LYS  71   2.022 -17.711  -4.173
  418   1HZ   LYS  71          1HZ       LYS  71   1.510 -17.709  -1.248
  419   2HZ   LYS  71          2HZ       LYS  71   1.494 -16.328  -2.225
  420   3HZ   LYS  71          3HZ       LYS  71   2.926 -17.206  -2.026
  421    H    ALA  72           H        ALA  72  -3.153 -13.877  -4.227
  422    HA   ALA  72           HA       ALA  72  -2.218 -12.968  -1.702
  423   1HB   ALA  72          1HB       ALA  72  -3.855 -11.592  -2.530
  424   2HB   ALA  72          2HB       ALA  72  -4.795 -12.573  -1.405
  425   3HB   ALA  72          3HB       ALA  72  -4.832 -12.933  -3.130
  426    H    THR  73           H        THR  73  -3.377 -13.458   0.366
  427    HA   THR  73           HA       THR  73  -3.413 -16.327   0.752
  428    HB   THR  73           HB       THR  73  -2.251 -14.857   2.355
  429    HG1  THR  73           HG1      THR  73  -2.709 -16.421   3.649
  430   1HG2  THR  73          1HG2      THR  73  -3.325 -12.895   2.694
  431   2HG2  THR  73          2HG2      THR  73  -3.962 -13.799   4.067
  432   3HG2  THR  73          3HG2      THR  73  -4.928 -13.623   2.603
  433    H    ALA  74           H        ALA  74  -5.691 -13.714   0.525
  434    HA   ALA  74           HA       ALA  74  -7.870 -15.637   0.998
  435   1HB   ALA  74          1HB       ALA  74  -8.358 -14.422   2.819
  436   2HB   ALA  74          2HB       ALA  74  -9.017 -13.257   1.671
  437   3HB   ALA  74          3HB       ALA  74  -7.377 -13.055   2.288
  438    H    CYS  75           H        CYS  75  -7.708 -15.873  -1.360
  439    HA   CYS  75           HA       CYS  75  -8.800 -13.599  -2.862
  440   1HB   CYS  75          1HB       CYS  75  -6.746 -14.568  -3.770
  441   2HB   CYS  75          2HB       CYS  75  -7.509 -16.160  -3.838
  442    H    THR  76           H        THR  76 -10.969 -13.605  -2.790
  443    HA   THR  76           HA       THR  76 -12.406 -16.147  -2.924
  444    HB   THR  76           HB       THR  76 -13.412 -13.338  -2.423
  445    HG1  THR  76           HG1      THR  76 -12.282 -14.018  -0.663
  446   1HG2  THR  76          1HG2      THR  76 -14.948 -15.404  -3.304
  447   2HG2  THR  76          2HG2      THR  76 -15.518 -14.056  -2.319
  448   3HG2  THR  76          3HG2      THR  76 -15.063 -15.578  -1.553
  449    H    ASN  77           H        ASN  77 -13.134 -12.959  -4.328
  450    HA   ASN  77           HA       ASN  77 -13.569 -14.295  -6.917
  451   1HB   ASN  77          1HB       ASN  77 -15.714 -13.677  -5.858
  452   2HB   ASN  77          2HB       ASN  77 -15.173 -11.999  -5.765
  453   1HD2  ASN  77          1HD2      ASN  77 -14.977 -14.453  -8.320
  454   2HD2  ASN  77          2HD2      ASN  77 -15.777 -13.508  -9.524
  455    H    SER  78           H        SER  78 -11.295 -13.660  -7.239
  456    HA   SER  78           HA       SER  78 -11.170 -11.082  -8.557
  457   1HB   SER  78          1HB       SER  78 -10.429 -10.284  -6.474
  458   2HB   SER  78          2HB       SER  78  -9.530 -11.767  -6.125
  459    HG   SER  78           HG       SER  78  -7.995 -11.164  -7.619
  460    H    SER  79           H        SER  79  -9.524 -10.948 -10.121
  461    HA   SER  79           HA       SER  79  -8.513 -13.528 -10.970
  462   1HB   SER  79          1HB       SER  79  -9.450 -11.396 -12.375
  463   2HB   SER  79          2HB       SER  79  -7.708 -11.139 -12.492
  464    HG   SER  79           HG       SER  79  -7.484 -13.033 -13.538
  465    H    GLY  80           H        GLY  80  -6.226 -13.655 -11.783
  466   1HA   GLY  80          1HA       GLY  80  -3.947 -13.220 -11.548
  467   2HA   GLY  80          2HA       GLY  80  -4.337 -11.911 -10.442
  468    H    CYS  81           H        CYS  81  -6.021 -13.543  -8.727
  469    HA   CYS  81           HA       CYS  81  -3.901 -15.060  -7.366
  470   1HB   CYS  81          1HB       CYS  81  -5.351 -14.722  -5.318
  471   2HB   CYS  81          2HB       CYS  81  -4.633 -13.256  -5.989
  472    HA   PRO  82           HA       PRO  82  -5.864 -18.988  -7.584
  473   1HB   PRO  82          1HB       PRO  82  -6.153 -18.947  -4.614
  474   2HB   PRO  82          2HB       PRO  82  -5.441 -20.186  -5.662
  475   1HG   PRO  82          1HG       PRO  82  -3.888 -18.561  -4.236
  476   2HG   PRO  82          2HG       PRO  82  -3.440 -19.033  -5.885
  477   1HD   PRO  82          1HD       PRO  82  -4.542 -16.450  -4.884
  478   2HD   PRO  82          2HD       PRO  82  -3.377 -16.752  -6.189
  479    H    GLY  83           H        GLY  83  -7.846 -18.659  -8.509
  480   1HA   GLY  83          1HA       GLY  83 -10.018 -17.316  -7.363
  481   2HA   GLY  83          2HA       GLY  83 -10.131 -18.501  -8.655
  482    H    HIS  84           H        HIS  84 -10.871 -20.522  -8.217
  483    HA   HIS  84           HA       HIS  84 -12.096 -20.911  -5.625
  484   1HB   HIS  84          1HB       HIS  84 -13.140 -22.875  -6.638
  485   2HB   HIS  84          2HB       HIS  84 -13.329 -21.471  -7.683
  486    HD1  HIS  84           HD1      HIS  84 -10.009 -22.318  -8.294
  487    HD2  HIS  84           HD2      HIS  84 -13.617 -24.103  -9.323
  488    HE1  HIS  84           HE1      HIS  84  -9.493 -23.787 -10.269
  489    HE2  HIS  84           HE2      HIS  84 -11.673 -24.925 -10.817