USER MOD reduce.3.24.130724 H: found=0, std=0, add=984, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 980 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 20 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 55 THR OG1 : rot 120:sc= 0.745 USER MOD Set 1.3: A 57 SER OG : rot 180:sc= 0.678 USER MOD Set 2.1: A 7 THR OG1 : rot -78:sc= 1.9 USER MOD Set 2.2: A 9 THR OG1 : rot 59:sc= 0.648 USER MOD Single : A 1 MET CE :methyl -168:sc= -0.0338 (180deg=-0.168) USER MOD Single : A 1 MET N :NH3+ 172:sc= 1.05 (180deg=0.993) USER MOD Single : A 2 GLN : amide:sc= -0.881 K(o=-0.88,f=0.049) USER MOD Single : A 6 LYS NZ :NH3+ -165:sc= 1.24 (180deg=1.18) USER MOD Single : A 11 LYS NZ :NH3+ -174:sc= 1.24 (180deg=1.18) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0326 USER MOD Single : A 25 ASN : amide:sc= -0.445 K(o=-0.44,f=-2!) USER MOD Single : A 27 LYS NZ :NH3+ -123:sc= 0.738 (180deg=0.388) USER MOD Single : A 29 LYS NZ :NH3+ 172:sc= 1.04 (180deg=0.992) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.0084) USER MOD Single : A 33 LYS NZ :NH3+ -163:sc= 0.754 (180deg=0.599) USER MOD Single : A 40 GLN : amide:sc= 0.524 K(o=0.52,f=-4.9!) USER MOD Single : A 41 GLN : amide:sc= 1.1 K(o=1.1,f=-5.2!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.622 K(o=-0.62,f=-1.3) USER MOD Single : A 59 TYR OH : rot 50:sc= 0.013 USER MOD Single : A 60 ASN : amide:sc= -0.0735 X(o=-0.074,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.866 K(o=0.87,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 48:sc= 0.112 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.0513 X(o=-0.051,f=-0.53) USER MOD Single : B -1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B -2 HIS : no HD1:sc= 0.393 K(o=0.39,f=-3.6!) USER MOD Single : B -3 GLY N :NH3+ 167:sc= 0.972 (180deg=0.86) USER MOD Single : B 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 678 THR OG1 : rot 180:sc= 0 USER MOD Single : B 681 SER OG : rot 180:sc= 0.00172 USER MOD Single : B 686 GLN : amide:sc= -0.0267 K(o=-0.027,f=-11!) USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= 0.485 K(o=0.49,f=-0.39) USER MOD Single : B 697 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 704 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 706 THR OG1 : rot -88:sc= 0.762 USER MOD Single : B 708 SER OG : rot 180:sc= 0 USER MOD Single : B 711 HIS : no HD1:sc= -0.847 K(o=-0.85,f=-0.34) USER MOD Single : B 714 HIS : no HD1:sc= -0.152 K(o=-0.15,f=-1.6) USER MOD Single : B 715 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.443 1.490 0.149 1.00 0.00 N ATOM 2 CA MET A 1 2.274 1.490 -1.102 1.00 0.00 C ATOM 3 C MET A 1 1.966 2.716 -1.964 1.00 0.00 C ATOM 4 O MET A 1 1.102 3.500 -1.610 1.00 0.00 O ATOM 5 CB MET A 1 2.142 0.182 -1.934 1.00 0.00 C ATOM 6 CG MET A 1 0.782 -0.082 -2.608 1.00 0.00 C ATOM 7 SD MET A 1 0.721 -1.672 -3.464 1.00 0.00 S ATOM 8 CE MET A 1 -0.510 -1.335 -4.748 1.00 0.00 C ATOM 0 H1 MET A 1 1.569 0.587 0.649 1.00 0.00 H new ATOM 0 H2 MET A 1 1.744 2.272 0.765 1.00 0.00 H new ATOM 0 H3 MET A 1 0.441 1.611 -0.100 1.00 0.00 H new ATOM 0 HA MET A 1 3.312 1.539 -0.774 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.908 0.195 -2.709 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.365 -0.660 -1.279 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.004 -0.050 -1.854 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.573 0.717 -3.320 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.811 -2.271 -5.218 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.381 -0.857 -4.300 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.080 -0.674 -5.500 1.00 0.00 H new ATOM 20 N GLN A 2 2.585 2.866 -3.145 1.00 0.00 N ATOM 21 CA GLN A 2 2.243 3.899 -4.115 1.00 0.00 C ATOM 22 C GLN A 2 2.230 3.325 -5.509 1.00 0.00 C ATOM 23 O GLN A 2 2.911 2.331 -5.758 1.00 0.00 O ATOM 24 CB GLN A 2 3.212 5.099 -3.999 1.00 0.00 C ATOM 25 CG GLN A 2 4.547 5.037 -4.765 1.00 0.00 C ATOM 26 CD GLN A 2 5.513 4.119 -4.044 1.00 0.00 C ATOM 27 OE1 GLN A 2 6.318 4.519 -3.209 1.00 0.00 O ATOM 28 NE2 GLN A 2 5.370 2.839 -4.327 1.00 0.00 N ATOM 0 H GLN A 2 3.347 2.261 -3.450 1.00 0.00 H new ATOM 0 HA GLN A 2 1.240 4.268 -3.898 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.679 5.990 -4.332 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.441 5.240 -2.943 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.378 4.676 -5.780 1.00 0.00 H new ATOM 0 HG3 GLN A 2 4.975 6.036 -4.849 1.00 0.00 H new ATOM 0 HE21 GLN A 2 4.690 2.545 -5.028 1.00 0.00 H new ATOM 0 HE22 GLN A 2 5.940 2.143 -3.845 1.00 0.00 H new ATOM 37 N ILE A 3 1.548 4.003 -6.416 1.00 0.00 N ATOM 38 CA ILE A 3 1.494 3.632 -7.830 1.00 0.00 C ATOM 39 C ILE A 3 1.563 4.910 -8.653 1.00 0.00 C ATOM 40 O ILE A 3 1.236 5.993 -8.172 1.00 0.00 O ATOM 41 CB ILE A 3 0.256 2.756 -8.117 1.00 0.00 C ATOM 42 CG1 ILE A 3 -1.033 3.279 -7.453 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.526 1.329 -7.595 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.237 3.266 -8.388 1.00 0.00 C ATOM 0 H ILE A 3 1.007 4.839 -6.194 1.00 0.00 H new ATOM 0 HA ILE A 3 2.344 3.011 -8.113 1.00 0.00 H new ATOM 0 HB ILE A 3 0.097 2.776 -9.195 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.255 2.671 -6.576 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.866 4.297 -7.101 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.342 0.699 -7.792 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.397 0.915 -8.102 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.713 1.364 -6.522 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.112 3.646 -7.860 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.033 3.897 -9.253 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.429 2.246 -8.720 1.00 0.00 H new ATOM 56 N PHE A 4 2.043 4.764 -9.875 1.00 0.00 N ATOM 57 CA PHE A 4 2.416 5.825 -10.788 1.00 0.00 C ATOM 58 C PHE A 4 1.372 5.922 -11.886 1.00 0.00 C ATOM 59 O PHE A 4 1.392 5.173 -12.852 1.00 0.00 O ATOM 60 CB PHE A 4 3.803 5.506 -11.367 1.00 0.00 C ATOM 61 CG PHE A 4 4.852 4.982 -10.414 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.111 5.678 -9.227 1.00 0.00 C ATOM 63 CD2 PHE A 4 5.598 3.828 -10.715 1.00 0.00 C ATOM 64 CE1 PHE A 4 6.087 5.224 -8.329 1.00 0.00 C ATOM 65 CE2 PHE A 4 6.616 3.406 -9.837 1.00 0.00 C ATOM 66 CZ PHE A 4 6.873 4.112 -8.653 1.00 0.00 C ATOM 0 H PHE A 4 2.192 3.840 -10.281 1.00 0.00 H new ATOM 0 HA PHE A 4 2.462 6.785 -10.273 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.675 4.772 -12.163 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.192 6.413 -11.829 1.00 0.00 H new ATOM 0 HD1 PHE A 4 4.553 6.574 -9.001 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.391 3.268 -11.615 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.232 5.732 -7.387 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.203 2.532 -10.078 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.671 3.800 -7.996 1.00 0.00 H new ATOM 76 N VAL A 5 0.423 6.828 -11.770 1.00 0.00 N ATOM 77 CA VAL A 5 -0.593 6.993 -12.802 1.00 0.00 C ATOM 78 C VAL A 5 0.002 7.939 -13.830 1.00 0.00 C ATOM 79 O VAL A 5 0.092 9.137 -13.592 1.00 0.00 O ATOM 80 CB VAL A 5 -1.934 7.418 -12.187 1.00 0.00 C ATOM 81 CG1 VAL A 5 -3.050 7.439 -13.245 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.294 6.442 -11.053 1.00 0.00 C ATOM 0 H VAL A 5 0.330 7.462 -10.976 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.847 6.064 -13.312 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.837 8.429 -11.791 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.987 7.744 -12.779 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.790 8.145 -14.034 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.164 6.443 -13.673 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.245 6.735 -10.609 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.377 5.432 -11.455 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.515 6.467 -10.291 1.00 0.00 H new ATOM 92 N LYS A 6 0.478 7.410 -14.955 1.00 0.00 N ATOM 93 CA LYS A 6 0.944 8.234 -16.054 1.00 0.00 C ATOM 94 C LYS A 6 -0.300 8.842 -16.674 1.00 0.00 C ATOM 95 O LYS A 6 -1.194 8.101 -17.090 1.00 0.00 O ATOM 96 CB LYS A 6 1.756 7.372 -17.035 1.00 0.00 C ATOM 97 CG LYS A 6 2.523 8.274 -18.018 1.00 0.00 C ATOM 98 CD LYS A 6 3.370 7.484 -19.033 1.00 0.00 C ATOM 99 CE LYS A 6 4.374 8.376 -19.788 1.00 0.00 C ATOM 100 NZ LYS A 6 5.376 7.563 -20.539 1.00 0.00 N ATOM 0 H LYS A 6 0.549 6.407 -15.124 1.00 0.00 H new ATOM 0 HA LYS A 6 1.616 9.032 -15.737 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.455 6.742 -16.485 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.090 6.706 -17.584 1.00 0.00 H new ATOM 0 HG2 LYS A 6 1.812 8.900 -18.557 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.173 8.943 -17.455 1.00 0.00 H new ATOM 0 HD2 LYS A 6 3.911 6.694 -18.512 1.00 0.00 H new ATOM 0 HD3 LYS A 6 2.710 6.998 -19.751 1.00 0.00 H new ATOM 0 HE2 LYS A 6 3.837 9.023 -20.481 1.00 0.00 H new ATOM 0 HE3 LYS A 6 4.889 9.025 -19.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.173 8.168 -20.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 5.724 6.793 -19.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 4.930 7.160 -21.388 1.00 0.00 H new ATOM 114 N THR A 7 -0.410 10.166 -16.718 1.00 0.00 N ATOM 115 CA THR A 7 -1.478 10.738 -17.507 1.00 0.00 C ATOM 116 C THR A 7 -1.181 10.484 -18.962 1.00 0.00 C ATOM 117 O THR A 7 -0.047 10.226 -19.345 1.00 0.00 O ATOM 118 CB THR A 7 -1.696 12.220 -17.218 1.00 0.00 C ATOM 119 OG1 THR A 7 -0.464 12.876 -17.329 1.00 0.00 O ATOM 120 CG2 THR A 7 -2.257 12.388 -15.820 1.00 0.00 C ATOM 0 H THR A 7 0.198 10.830 -16.239 1.00 0.00 H new ATOM 0 HA THR A 7 -2.417 10.256 -17.234 1.00 0.00 H new ATOM 0 HB THR A 7 -2.405 12.646 -17.928 1.00 0.00 H new ATOM 0 HG1 THR A 7 0.066 12.715 -16.521 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.412 13.447 -15.615 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.208 11.861 -15.744 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.555 11.977 -15.094 1.00 0.00 H new ATOM 128 N LEU A 8 -2.192 10.618 -19.793 1.00 0.00 N ATOM 129 CA LEU A 8 -2.010 10.634 -21.230 1.00 0.00 C ATOM 130 C LEU A 8 -1.128 11.835 -21.639 1.00 0.00 C ATOM 131 O LEU A 8 -0.637 11.796 -22.754 1.00 0.00 O ATOM 132 CB LEU A 8 -3.401 10.662 -21.878 1.00 0.00 C ATOM 133 CG LEU A 8 -4.070 9.388 -22.423 1.00 0.00 C ATOM 134 CD1 LEU A 8 -5.539 9.628 -22.796 1.00 0.00 C ATOM 135 CD2 LEU A 8 -3.443 8.920 -23.731 1.00 0.00 C ATOM 0 H LEU A 8 -3.162 10.719 -19.493 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.486 9.743 -21.577 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -4.083 11.085 -21.141 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.348 11.369 -22.706 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.951 8.660 -21.620 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.974 8.704 -23.176 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.090 9.952 -21.913 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.598 10.399 -23.564 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.949 8.018 -24.075 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.544 9.702 -24.483 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.387 8.704 -23.571 1.00 0.00 H new ATOM 147 N THR A 9 -0.878 12.882 -20.824 1.00 0.00 N ATOM 148 CA THR A 9 0.147 13.888 -21.157 1.00 0.00 C ATOM 149 C THR A 9 1.534 13.319 -20.934 1.00 0.00 C ATOM 150 O THR A 9 2.520 13.805 -21.480 1.00 0.00 O ATOM 151 CB THR A 9 0.077 15.142 -20.275 1.00 0.00 C ATOM 152 OG1 THR A 9 -0.807 14.980 -19.187 1.00 0.00 O ATOM 153 CG2 THR A 9 -0.315 16.332 -21.122 1.00 0.00 C ATOM 0 H THR A 9 -1.365 13.050 -19.944 1.00 0.00 H new ATOM 0 HA THR A 9 -0.044 14.152 -22.197 1.00 0.00 H new ATOM 0 HB THR A 9 1.065 15.313 -19.847 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.515 14.222 -18.638 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.365 17.223 -20.496 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.427 16.480 -21.906 1.00 0.00 H new ATOM 0 HG23 THR A 9 -1.290 16.151 -21.574 1.00 0.00 H new ATOM 161 N GLY A 10 1.605 12.322 -20.065 1.00 0.00 N ATOM 162 CA GLY A 10 2.812 11.754 -19.556 1.00 0.00 C ATOM 163 C GLY A 10 3.293 12.439 -18.290 1.00 0.00 C ATOM 164 O GLY A 10 4.492 12.419 -18.018 1.00 0.00 O ATOM 0 H GLY A 10 0.770 11.875 -19.686 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.653 10.695 -19.353 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.589 11.820 -20.318 1.00 0.00 H new ATOM 168 N LYS A 11 2.373 13.043 -17.529 1.00 0.00 N ATOM 169 CA LYS A 11 2.703 13.527 -16.198 1.00 0.00 C ATOM 170 C LYS A 11 2.384 12.369 -15.289 1.00 0.00 C ATOM 171 O LYS A 11 1.218 12.046 -15.078 1.00 0.00 O ATOM 172 CB LYS A 11 1.919 14.794 -15.844 1.00 0.00 C ATOM 173 CG LYS A 11 2.245 15.262 -14.407 1.00 0.00 C ATOM 174 CD LYS A 11 1.354 14.751 -13.263 1.00 0.00 C ATOM 175 CE LYS A 11 -0.155 14.806 -13.536 1.00 0.00 C ATOM 176 NZ LYS A 11 -0.686 16.192 -13.665 1.00 0.00 N ATOM 0 H LYS A 11 1.407 13.204 -17.814 1.00 0.00 H new ATOM 0 HA LYS A 11 3.747 13.828 -16.109 1.00 0.00 H new ATOM 0 HB2 LYS A 11 2.161 15.586 -16.552 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.850 14.602 -15.934 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.272 14.971 -14.186 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.212 16.351 -14.395 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.630 13.720 -13.042 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.567 15.337 -12.369 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.371 14.256 -14.452 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.681 14.298 -12.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.722 16.161 -13.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -0.421 16.745 -12.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -0.285 16.640 -14.514 1.00 0.00 H new ATOM 190 N THR A 12 3.400 11.711 -14.785 1.00 0.00 N ATOM 191 CA THR A 12 3.203 10.612 -13.875 1.00 0.00 C ATOM 192 C THR A 12 2.879 11.186 -12.506 1.00 0.00 C ATOM 193 O THR A 12 3.716 11.827 -11.869 1.00 0.00 O ATOM 194 CB THR A 12 4.432 9.706 -13.933 1.00 0.00 C ATOM 195 OG1 THR A 12 4.921 9.613 -15.265 1.00 0.00 O ATOM 196 CG2 THR A 12 4.020 8.308 -13.507 1.00 0.00 C ATOM 0 H THR A 12 4.377 11.920 -14.992 1.00 0.00 H new ATOM 0 HA THR A 12 2.359 9.977 -14.143 1.00 0.00 H new ATOM 0 HB THR A 12 5.202 10.120 -13.282 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.709 9.031 -15.284 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.886 7.647 -13.542 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.628 8.338 -12.490 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.250 7.934 -14.182 1.00 0.00 H new ATOM 204 N ILE A 13 1.624 10.998 -12.091 1.00 0.00 N ATOM 205 CA ILE A 13 1.158 11.359 -10.769 1.00 0.00 C ATOM 206 C ILE A 13 1.319 10.109 -9.931 1.00 0.00 C ATOM 207 O ILE A 13 0.692 9.088 -10.201 1.00 0.00 O ATOM 208 CB ILE A 13 -0.272 11.955 -10.792 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.087 11.779 -9.480 1.00 0.00 C ATOM 210 CG2 ILE A 13 -1.160 11.632 -12.002 1.00 0.00 C ATOM 211 CD1 ILE A 13 -2.348 10.897 -9.527 1.00 0.00 C ATOM 0 H ILE A 13 0.900 10.584 -12.679 1.00 0.00 H new ATOM 0 HA ILE A 13 1.739 12.170 -10.329 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.005 13.007 -10.897 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.419 11.367 -8.724 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.385 12.770 -9.136 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.130 12.115 -11.881 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.683 11.998 -12.911 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -1.299 10.553 -12.074 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.809 10.869 -8.540 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.055 11.311 -10.246 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.074 9.886 -9.828 1.00 0.00 H new ATOM 223 N THR A 14 2.172 10.187 -8.923 1.00 0.00 N ATOM 224 CA THR A 14 2.375 9.088 -7.996 1.00 0.00 C ATOM 225 C THR A 14 1.390 9.291 -6.851 1.00 0.00 C ATOM 226 O THR A 14 1.170 10.425 -6.417 1.00 0.00 O ATOM 227 CB THR A 14 3.847 9.068 -7.565 1.00 0.00 C ATOM 228 OG1 THR A 14 4.655 9.035 -8.734 1.00 0.00 O ATOM 229 CG2 THR A 14 4.176 7.836 -6.700 1.00 0.00 C ATOM 0 H THR A 14 2.741 11.010 -8.725 1.00 0.00 H new ATOM 0 HA THR A 14 2.181 8.109 -8.435 1.00 0.00 H new ATOM 0 HB THR A 14 4.043 9.959 -6.969 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.601 9.023 -8.478 1.00 0.00 H new ATOM 0 HG21 THR A 14 5.228 7.861 -6.417 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.558 7.846 -5.802 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.975 6.928 -7.269 1.00 0.00 H new ATOM 237 N LEU A 15 0.771 8.207 -6.384 1.00 0.00 N ATOM 238 CA LEU A 15 -0.254 8.268 -5.350 1.00 0.00 C ATOM 239 C LEU A 15 -0.104 7.090 -4.431 1.00 0.00 C ATOM 240 O LEU A 15 0.208 6.011 -4.921 1.00 0.00 O ATOM 241 CB LEU A 15 -1.649 8.334 -6.000 1.00 0.00 C ATOM 242 CG LEU A 15 -2.131 7.086 -6.758 1.00 0.00 C ATOM 243 CD1 LEU A 15 -2.935 6.152 -5.853 1.00 0.00 C ATOM 244 CD2 LEU A 15 -3.105 7.512 -7.843 1.00 0.00 C ATOM 0 H LEU A 15 0.968 7.262 -6.714 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.136 9.171 -4.751 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.376 8.556 -5.218 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.659 9.175 -6.693 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.243 6.585 -7.144 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.258 5.282 -6.424 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.312 5.828 -5.019 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.808 6.680 -5.470 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.452 6.633 -8.386 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.957 8.018 -7.389 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.606 8.191 -8.534 1.00 0.00 H new ATOM 256 N GLU A 16 -0.371 7.264 -3.142 1.00 0.00 N ATOM 257 CA GLU A 16 -0.221 6.206 -2.161 1.00 0.00 C ATOM 258 C GLU A 16 -1.585 5.591 -1.855 1.00 0.00 C ATOM 259 O GLU A 16 -2.558 6.295 -1.574 1.00 0.00 O ATOM 260 CB GLU A 16 0.517 6.700 -0.905 1.00 0.00 C ATOM 261 CG GLU A 16 2.039 6.629 -1.096 1.00 0.00 C ATOM 262 CD GLU A 16 2.779 7.270 0.090 1.00 0.00 C ATOM 263 OE1 GLU A 16 3.053 8.494 0.046 1.00 0.00 O ATOM 264 OE2 GLU A 16 3.103 6.557 1.072 1.00 0.00 O ATOM 0 H GLU A 16 -0.698 8.147 -2.751 1.00 0.00 H new ATOM 0 HA GLU A 16 0.408 5.418 -2.575 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.222 7.726 -0.686 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.226 6.095 -0.047 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.347 5.589 -1.201 1.00 0.00 H new ATOM 0 HG3 GLU A 16 2.316 7.138 -2.019 1.00 0.00 H new ATOM 271 N VAL A 17 -1.632 4.268 -1.974 1.00 0.00 N ATOM 272 CA VAL A 17 -2.782 3.368 -1.857 1.00 0.00 C ATOM 273 C VAL A 17 -2.286 2.018 -1.341 1.00 0.00 C ATOM 274 O VAL A 17 -1.105 1.848 -1.053 1.00 0.00 O ATOM 275 CB VAL A 17 -3.485 3.215 -3.225 1.00 0.00 C ATOM 276 CG1 VAL A 17 -4.430 4.382 -3.497 1.00 0.00 C ATOM 277 CG2 VAL A 17 -2.480 3.022 -4.368 1.00 0.00 C ATOM 0 H VAL A 17 -0.781 3.743 -2.175 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.511 3.778 -1.158 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.088 2.308 -3.178 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.909 4.244 -4.467 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.192 4.422 -2.719 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.865 5.314 -3.500 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.017 2.919 -5.311 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.818 3.886 -4.420 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.890 2.124 -4.186 1.00 0.00 H new ATOM 287 N GLU A 18 -3.169 1.028 -1.299 1.00 0.00 N ATOM 288 CA GLU A 18 -2.885 -0.359 -0.927 1.00 0.00 C ATOM 289 C GLU A 18 -3.172 -1.226 -2.151 1.00 0.00 C ATOM 290 O GLU A 18 -3.947 -0.787 -3.001 1.00 0.00 O ATOM 291 CB GLU A 18 -3.819 -0.779 0.225 1.00 0.00 C ATOM 292 CG GLU A 18 -3.632 0.025 1.514 1.00 0.00 C ATOM 293 CD GLU A 18 -2.292 -0.291 2.215 1.00 0.00 C ATOM 294 OE1 GLU A 18 -1.239 0.281 1.840 1.00 0.00 O ATOM 295 OE2 GLU A 18 -2.290 -1.127 3.147 1.00 0.00 O ATOM 0 H GLU A 18 -4.151 1.174 -1.534 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.850 -0.471 -0.604 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.853 -0.677 -0.106 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.656 -1.835 0.442 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.677 1.090 1.285 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.455 -0.189 2.196 1.00 0.00 H new ATOM 302 N PRO A 19 -2.660 -2.468 -2.260 1.00 0.00 N ATOM 303 CA PRO A 19 -3.080 -3.372 -3.331 1.00 0.00 C ATOM 304 C PRO A 19 -4.600 -3.566 -3.341 1.00 0.00 C ATOM 305 O PRO A 19 -5.215 -3.614 -4.396 1.00 0.00 O ATOM 306 CB PRO A 19 -2.338 -4.699 -3.105 1.00 0.00 C ATOM 307 CG PRO A 19 -1.230 -4.371 -2.107 1.00 0.00 C ATOM 308 CD PRO A 19 -1.729 -3.137 -1.357 1.00 0.00 C ATOM 0 HA PRO A 19 -2.831 -2.956 -4.307 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -3.008 -5.463 -2.712 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -1.927 -5.084 -4.038 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.053 -5.203 -1.425 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.287 -4.170 -2.616 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.222 -3.419 -0.426 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -0.901 -2.479 -1.093 1.00 0.00 H new ATOM 316 N SER A 20 -5.242 -3.574 -2.180 1.00 0.00 N ATOM 317 CA SER A 20 -6.658 -3.883 -2.045 1.00 0.00 C ATOM 318 C SER A 20 -7.456 -2.592 -1.961 1.00 0.00 C ATOM 319 O SER A 20 -8.631 -2.619 -1.587 1.00 0.00 O ATOM 320 CB SER A 20 -6.872 -4.802 -0.836 1.00 0.00 C ATOM 321 OG SER A 20 -5.997 -5.922 -0.889 1.00 0.00 O ATOM 0 H SER A 20 -4.786 -3.363 -1.293 1.00 0.00 H new ATOM 0 HA SER A 20 -7.018 -4.423 -2.921 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.700 -4.244 0.085 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.907 -5.144 -0.813 1.00 0.00 H new ATOM 0 HG SER A 20 -6.149 -6.494 -0.108 1.00 0.00 H new ATOM 327 N ASP A 21 -6.839 -1.456 -2.299 1.00 0.00 N ATOM 328 CA ASP A 21 -7.579 -0.234 -2.448 1.00 0.00 C ATOM 329 C ASP A 21 -8.251 -0.289 -3.820 1.00 0.00 C ATOM 330 O ASP A 21 -7.685 -0.813 -4.796 1.00 0.00 O ATOM 331 CB ASP A 21 -6.645 0.969 -2.273 1.00 0.00 C ATOM 332 CG ASP A 21 -7.116 1.974 -1.208 1.00 0.00 C ATOM 333 OD1 ASP A 21 -8.310 1.989 -0.824 1.00 0.00 O ATOM 334 OD2 ASP A 21 -6.253 2.767 -0.761 1.00 0.00 O ATOM 0 H ASP A 21 -5.837 -1.373 -2.470 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.348 -0.119 -1.684 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.652 0.609 -2.005 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.550 1.485 -3.228 1.00 0.00 H new ATOM 339 N THR A 22 -9.496 0.181 -3.878 1.00 0.00 N ATOM 340 CA THR A 22 -10.321 0.080 -5.066 1.00 0.00 C ATOM 341 C THR A 22 -9.976 1.130 -6.091 1.00 0.00 C ATOM 342 O THR A 22 -9.504 2.219 -5.766 1.00 0.00 O ATOM 343 CB THR A 22 -11.811 0.216 -4.736 1.00 0.00 C ATOM 344 OG1 THR A 22 -12.002 1.250 -3.789 1.00 0.00 O ATOM 345 CG2 THR A 22 -12.362 -1.099 -4.221 1.00 0.00 C ATOM 0 H THR A 22 -9.957 0.644 -3.095 1.00 0.00 H new ATOM 0 HA THR A 22 -10.119 -0.909 -5.476 1.00 0.00 H new ATOM 0 HB THR A 22 -12.354 0.474 -5.645 1.00 0.00 H new ATOM 0 HG1 THR A 22 -12.957 1.333 -3.583 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.421 -0.985 -3.991 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.237 -1.869 -4.982 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.825 -1.390 -3.319 1.00 0.00 H new ATOM 353 N ILE A 23 -10.327 0.821 -7.334 1.00 0.00 N ATOM 354 CA ILE A 23 -10.296 1.765 -8.432 1.00 0.00 C ATOM 355 C ILE A 23 -11.184 2.967 -8.114 1.00 0.00 C ATOM 356 O ILE A 23 -10.781 4.068 -8.456 1.00 0.00 O ATOM 357 CB ILE A 23 -10.713 1.056 -9.727 1.00 0.00 C ATOM 358 CG1 ILE A 23 -9.852 -0.174 -10.065 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.727 2.007 -10.938 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.401 -0.190 -9.588 1.00 0.00 C ATOM 0 H ILE A 23 -10.645 -0.109 -7.606 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.284 2.144 -8.573 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.727 0.710 -9.527 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.348 -1.052 -9.652 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -9.848 -0.290 -11.149 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -11.028 1.457 -11.829 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.433 2.818 -10.756 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.730 2.421 -11.087 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.925 -1.119 -9.902 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.866 0.656 -10.021 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.375 -0.118 -8.501 1.00 0.00 H new ATOM 372 N GLU A 24 -12.329 2.810 -7.441 1.00 0.00 N ATOM 373 CA GLU A 24 -13.148 3.961 -7.043 1.00 0.00 C ATOM 374 C GLU A 24 -12.311 4.942 -6.219 1.00 0.00 C ATOM 375 O GLU A 24 -12.234 6.132 -6.529 1.00 0.00 O ATOM 376 CB GLU A 24 -14.366 3.472 -6.237 1.00 0.00 C ATOM 377 CG GLU A 24 -15.330 4.586 -5.795 1.00 0.00 C ATOM 378 CD GLU A 24 -16.172 5.192 -6.939 1.00 0.00 C ATOM 379 OE1 GLU A 24 -15.598 5.735 -7.911 1.00 0.00 O ATOM 380 OE2 GLU A 24 -17.424 5.180 -6.836 1.00 0.00 O ATOM 0 H GLU A 24 -12.708 1.905 -7.162 1.00 0.00 H new ATOM 0 HA GLU A 24 -13.502 4.480 -7.934 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -14.918 2.750 -6.839 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -14.011 2.944 -5.352 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -16.004 4.187 -5.036 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -14.754 5.382 -5.323 1.00 0.00 H new ATOM 387 N ASN A 25 -11.616 4.425 -5.200 1.00 0.00 N ATOM 388 CA ASN A 25 -10.776 5.251 -4.337 1.00 0.00 C ATOM 389 C ASN A 25 -9.602 5.839 -5.124 1.00 0.00 C ATOM 390 O ASN A 25 -9.269 7.006 -4.955 1.00 0.00 O ATOM 391 CB ASN A 25 -10.336 4.456 -3.093 1.00 0.00 C ATOM 392 CG ASN A 25 -8.826 4.420 -2.918 1.00 0.00 C ATOM 393 OD1 ASN A 25 -8.235 5.274 -2.270 1.00 0.00 O ATOM 394 ND2 ASN A 25 -8.175 3.466 -3.558 1.00 0.00 N ATOM 0 H ASN A 25 -11.621 3.435 -4.955 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.357 6.100 -3.975 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -10.789 4.899 -2.206 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.713 3.436 -3.168 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.156 3.429 -3.519 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -8.691 2.766 -4.091 1.00 0.00 H new ATOM 401 N VAL A 26 -8.998 5.070 -6.026 1.00 0.00 N ATOM 402 CA VAL A 26 -7.884 5.529 -6.846 1.00 0.00 C ATOM 403 C VAL A 26 -8.368 6.692 -7.701 1.00 0.00 C ATOM 404 O VAL A 26 -7.765 7.757 -7.675 1.00 0.00 O ATOM 405 CB VAL A 26 -7.380 4.349 -7.689 1.00 0.00 C ATOM 406 CG1 VAL A 26 -6.424 4.797 -8.791 1.00 0.00 C ATOM 407 CG2 VAL A 26 -6.689 3.262 -6.856 1.00 0.00 C ATOM 0 H VAL A 26 -9.271 4.104 -6.209 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.050 5.883 -6.240 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.280 3.924 -8.134 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.094 3.929 -9.361 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.935 5.494 -9.455 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.559 5.289 -8.345 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.357 2.457 -7.512 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -5.828 3.690 -6.342 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.390 2.865 -6.122 1.00 0.00 H new ATOM 417 N LYS A 27 -9.475 6.542 -8.429 1.00 0.00 N ATOM 418 CA LYS A 27 -10.047 7.632 -9.207 1.00 0.00 C ATOM 419 C LYS A 27 -10.340 8.863 -8.365 1.00 0.00 C ATOM 420 O LYS A 27 -10.128 9.972 -8.852 1.00 0.00 O ATOM 421 CB LYS A 27 -11.352 7.178 -9.866 1.00 0.00 C ATOM 422 CG LYS A 27 -11.237 6.149 -10.994 1.00 0.00 C ATOM 423 CD LYS A 27 -12.670 5.830 -11.456 1.00 0.00 C ATOM 424 CE LYS A 27 -12.690 5.115 -12.816 1.00 0.00 C ATOM 425 NZ LYS A 27 -14.022 5.262 -13.496 1.00 0.00 N ATOM 0 H LYS A 27 -9.994 5.667 -8.494 1.00 0.00 H new ATOM 0 HA LYS A 27 -9.303 7.900 -9.957 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.996 6.762 -9.092 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -11.857 8.059 -10.261 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.644 6.545 -11.819 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.734 5.247 -10.644 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.161 5.205 -10.710 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.243 6.754 -11.524 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.907 5.524 -13.455 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.467 4.057 -12.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.413 4.320 -13.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.674 5.780 -12.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.902 5.787 -14.386 1.00 0.00 H new ATOM 439 N ALA A 28 -10.794 8.699 -7.124 1.00 0.00 N ATOM 440 CA ALA A 28 -11.008 9.838 -6.234 1.00 0.00 C ATOM 441 C ALA A 28 -9.675 10.537 -5.942 1.00 0.00 C ATOM 442 O ALA A 28 -9.613 11.764 -5.954 1.00 0.00 O ATOM 443 CB ALA A 28 -11.697 9.389 -4.940 1.00 0.00 C ATOM 0 H ALA A 28 -11.020 7.793 -6.713 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.666 10.554 -6.728 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.848 10.251 -4.290 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.662 8.941 -5.178 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.072 8.656 -4.431 1.00 0.00 H new ATOM 449 N LYS A 29 -8.590 9.772 -5.770 1.00 0.00 N ATOM 450 CA LYS A 29 -7.248 10.341 -5.614 1.00 0.00 C ATOM 451 C LYS A 29 -6.832 11.036 -6.905 1.00 0.00 C ATOM 452 O LYS A 29 -6.253 12.109 -6.857 1.00 0.00 O ATOM 453 CB LYS A 29 -6.234 9.266 -5.185 1.00 0.00 C ATOM 454 CG LYS A 29 -6.539 8.747 -3.771 1.00 0.00 C ATOM 455 CD LYS A 29 -5.639 7.586 -3.320 1.00 0.00 C ATOM 456 CE LYS A 29 -5.890 7.311 -1.823 1.00 0.00 C ATOM 457 NZ LYS A 29 -4.843 7.892 -0.931 1.00 0.00 N ATOM 0 H LYS A 29 -8.617 8.753 -5.735 1.00 0.00 H new ATOM 0 HA LYS A 29 -7.267 11.085 -4.818 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.258 8.437 -5.892 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.226 9.681 -5.214 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.434 9.570 -3.063 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -7.579 8.423 -3.731 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.852 6.693 -3.908 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.591 7.835 -3.487 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.862 7.718 -1.544 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.938 6.234 -1.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.137 7.791 0.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -3.944 7.390 -1.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.717 8.900 -1.154 1.00 0.00 H new ATOM 471 N ILE A 30 -7.177 10.498 -8.074 1.00 0.00 N ATOM 472 CA ILE A 30 -6.814 11.129 -9.348 1.00 0.00 C ATOM 473 C ILE A 30 -7.531 12.458 -9.442 1.00 0.00 C ATOM 474 O ILE A 30 -6.920 13.432 -9.818 1.00 0.00 O ATOM 475 CB ILE A 30 -7.153 10.263 -10.582 1.00 0.00 C ATOM 476 CG1 ILE A 30 -6.562 8.846 -10.605 1.00 0.00 C ATOM 477 CG2 ILE A 30 -6.713 10.978 -11.877 1.00 0.00 C ATOM 478 CD1 ILE A 30 -5.320 8.667 -9.747 1.00 0.00 C ATOM 0 H ILE A 30 -7.705 9.630 -8.168 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.732 11.258 -9.357 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.234 10.140 -10.515 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.324 8.143 -10.270 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.318 8.585 -11.635 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.958 10.356 -12.738 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -7.232 11.933 -11.960 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.637 11.151 -11.849 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -4.971 7.637 -9.823 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.538 9.342 -10.094 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -5.560 8.893 -8.708 1.00 0.00 H new ATOM 490 N GLN A 31 -8.800 12.541 -9.085 1.00 0.00 N ATOM 491 CA GLN A 31 -9.551 13.778 -9.088 1.00 0.00 C ATOM 492 C GLN A 31 -8.921 14.778 -8.127 1.00 0.00 C ATOM 493 O GLN A 31 -8.885 15.961 -8.448 1.00 0.00 O ATOM 494 CB GLN A 31 -11.008 13.517 -8.720 1.00 0.00 C ATOM 495 CG GLN A 31 -11.893 14.746 -9.000 1.00 0.00 C ATOM 496 CD GLN A 31 -12.541 15.250 -7.720 1.00 0.00 C ATOM 497 OE1 GLN A 31 -11.917 15.910 -6.891 1.00 0.00 O ATOM 498 NE2 GLN A 31 -13.800 14.905 -7.533 1.00 0.00 N ATOM 0 H GLN A 31 -9.345 11.735 -8.780 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.525 14.202 -10.092 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -11.380 12.664 -9.287 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -11.075 13.252 -7.665 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.291 15.539 -9.445 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -12.664 14.486 -9.725 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -14.289 14.357 -8.241 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -14.285 15.186 -6.681 1.00 0.00 H new ATOM 507 N ASP A 32 -8.362 14.314 -7.007 1.00 0.00 N ATOM 508 CA ASP A 32 -7.657 15.219 -6.123 1.00 0.00 C ATOM 509 C ASP A 32 -6.413 15.774 -6.830 1.00 0.00 C ATOM 510 O ASP A 32 -6.085 16.952 -6.651 1.00 0.00 O ATOM 511 CB ASP A 32 -7.258 14.534 -4.810 1.00 0.00 C ATOM 512 CG ASP A 32 -6.289 15.415 -3.998 1.00 0.00 C ATOM 513 OD1 ASP A 32 -6.768 16.280 -3.227 1.00 0.00 O ATOM 514 OD2 ASP A 32 -5.051 15.232 -4.115 1.00 0.00 O ATOM 0 H ASP A 32 -8.386 13.341 -6.703 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.331 16.039 -5.875 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.150 14.328 -4.218 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.789 13.574 -5.025 1.00 0.00 H new ATOM 519 N LYS A 33 -5.724 14.964 -7.656 1.00 0.00 N ATOM 520 CA LYS A 33 -4.426 15.354 -8.192 1.00 0.00 C ATOM 521 C LYS A 33 -4.556 16.082 -9.537 1.00 0.00 C ATOM 522 O LYS A 33 -3.757 16.966 -9.851 1.00 0.00 O ATOM 523 CB LYS A 33 -3.542 14.104 -8.283 1.00 0.00 C ATOM 524 CG LYS A 33 -3.466 13.267 -6.976 1.00 0.00 C ATOM 525 CD LYS A 33 -2.105 13.223 -6.261 1.00 0.00 C ATOM 526 CE LYS A 33 -1.547 14.604 -5.892 1.00 0.00 C ATOM 527 NZ LYS A 33 -2.225 15.201 -4.697 1.00 0.00 N ATOM 0 H LYS A 33 -6.049 14.046 -7.959 1.00 0.00 H new ATOM 0 HA LYS A 33 -3.955 16.073 -7.521 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.917 13.468 -9.085 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.533 14.408 -8.563 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.205 13.660 -6.277 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.761 12.244 -7.210 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.203 12.628 -5.353 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.386 12.712 -6.902 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.479 14.518 -5.693 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.660 15.276 -6.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.028 16.222 -4.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -3.251 15.048 -4.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.867 14.748 -3.832 1.00 0.00 H new ATOM 541 N GLU A 34 -5.606 15.748 -10.290 1.00 0.00 N ATOM 542 CA GLU A 34 -5.824 16.126 -11.682 1.00 0.00 C ATOM 543 C GLU A 34 -7.041 17.028 -11.874 1.00 0.00 C ATOM 544 O GLU A 34 -7.025 17.920 -12.719 1.00 0.00 O ATOM 545 CB GLU A 34 -6.017 14.829 -12.492 1.00 0.00 C ATOM 546 CG GLU A 34 -4.794 13.906 -12.470 1.00 0.00 C ATOM 547 CD GLU A 34 -3.483 14.678 -12.671 1.00 0.00 C ATOM 548 OE1 GLU A 34 -3.287 15.299 -13.740 1.00 0.00 O ATOM 549 OE2 GLU A 34 -2.647 14.688 -11.745 1.00 0.00 O ATOM 0 H GLU A 34 -6.366 15.176 -9.922 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.959 16.697 -12.021 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.877 14.288 -12.097 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.249 15.087 -13.525 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.759 13.375 -11.519 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.894 13.154 -13.252 1.00 0.00 H new ATOM 556 N GLY A 35 -8.097 16.807 -11.090 1.00 0.00 N ATOM 557 CA GLY A 35 -9.327 17.588 -11.140 1.00 0.00 C ATOM 558 C GLY A 35 -10.345 16.979 -12.096 1.00 0.00 C ATOM 559 O GLY A 35 -11.221 17.694 -12.584 1.00 0.00 O ATOM 0 H GLY A 35 -8.119 16.065 -10.390 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -9.759 17.651 -10.141 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.098 18.607 -11.453 1.00 0.00 H new ATOM 563 N ILE A 36 -10.237 15.674 -12.385 1.00 0.00 N ATOM 564 CA ILE A 36 -11.095 14.997 -13.344 1.00 0.00 C ATOM 565 C ILE A 36 -12.047 14.181 -12.496 1.00 0.00 C ATOM 566 O ILE A 36 -11.552 13.387 -11.700 1.00 0.00 O ATOM 567 CB ILE A 36 -10.277 14.065 -14.245 1.00 0.00 C ATOM 568 CG1 ILE A 36 -9.177 14.820 -15.010 1.00 0.00 C ATOM 569 CG2 ILE A 36 -11.211 13.356 -15.244 1.00 0.00 C ATOM 570 CD1 ILE A 36 -8.152 13.816 -15.497 1.00 0.00 C ATOM 0 H ILE A 36 -9.545 15.063 -11.952 1.00 0.00 H new ATOM 0 HA ILE A 36 -11.607 15.702 -13.998 1.00 0.00 H new ATOM 0 HB ILE A 36 -9.789 13.331 -13.604 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.606 15.362 -15.853 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.705 15.559 -14.363 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -10.626 12.694 -15.883 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -11.952 12.772 -14.698 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -11.718 14.100 -15.859 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.364 14.336 -16.042 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.719 13.295 -14.643 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.634 13.094 -16.156 1.00 0.00 H new ATOM 582 N PRO A 37 -13.366 14.290 -12.660 1.00 0.00 N ATOM 583 CA PRO A 37 -14.303 13.490 -11.891 1.00 0.00 C ATOM 584 C PRO A 37 -14.082 11.990 -12.129 1.00 0.00 C ATOM 585 O PRO A 37 -13.782 11.603 -13.258 1.00 0.00 O ATOM 586 CB PRO A 37 -15.697 13.979 -12.274 1.00 0.00 C ATOM 587 CG PRO A 37 -15.484 15.189 -13.191 1.00 0.00 C ATOM 588 CD PRO A 37 -14.033 15.098 -13.661 1.00 0.00 C ATOM 0 HA PRO A 37 -14.160 13.612 -10.817 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.258 13.197 -12.785 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.270 14.256 -11.389 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.172 15.166 -14.036 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.665 16.122 -12.657 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -13.965 14.640 -14.648 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.580 16.086 -13.737 1.00 0.00 H new ATOM 596 N PRO A 38 -14.232 11.124 -11.108 1.00 0.00 N ATOM 597 CA PRO A 38 -14.057 9.680 -11.254 1.00 0.00 C ATOM 598 C PRO A 38 -14.878 9.102 -12.380 1.00 0.00 C ATOM 599 O PRO A 38 -14.399 8.255 -13.126 1.00 0.00 O ATOM 600 CB PRO A 38 -14.533 9.067 -9.936 1.00 0.00 C ATOM 601 CG PRO A 38 -14.433 10.188 -8.919 1.00 0.00 C ATOM 602 CD PRO A 38 -14.586 11.467 -9.732 1.00 0.00 C ATOM 0 HA PRO A 38 -13.014 9.462 -11.484 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -15.556 8.700 -10.019 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -13.912 8.218 -9.649 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -15.212 10.105 -8.162 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -13.477 10.164 -8.396 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -15.607 11.843 -9.676 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -13.935 12.252 -9.347 1.00 0.00 H new ATOM 610 N ASP A 39 -16.110 9.582 -12.515 1.00 0.00 N ATOM 611 CA ASP A 39 -17.024 9.010 -13.505 1.00 0.00 C ATOM 612 C ASP A 39 -16.567 9.313 -14.939 1.00 0.00 C ATOM 613 O ASP A 39 -16.802 8.521 -15.852 1.00 0.00 O ATOM 614 CB ASP A 39 -18.450 9.508 -13.249 1.00 0.00 C ATOM 615 CG ASP A 39 -19.457 8.916 -14.249 1.00 0.00 C ATOM 616 OD1 ASP A 39 -19.684 7.683 -14.228 1.00 0.00 O ATOM 617 OD2 ASP A 39 -20.024 9.698 -15.046 1.00 0.00 O ATOM 0 H ASP A 39 -16.496 10.350 -11.965 1.00 0.00 H new ATOM 0 HA ASP A 39 -17.014 7.925 -13.397 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -18.749 9.244 -12.235 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -18.471 10.596 -13.315 1.00 0.00 H new ATOM 622 N GLN A 40 -15.839 10.417 -15.132 1.00 0.00 N ATOM 623 CA GLN A 40 -15.246 10.776 -16.421 1.00 0.00 C ATOM 624 C GLN A 40 -13.912 10.050 -16.629 1.00 0.00 C ATOM 625 O GLN A 40 -13.451 9.971 -17.763 1.00 0.00 O ATOM 626 CB GLN A 40 -15.073 12.305 -16.487 1.00 0.00 C ATOM 627 CG GLN A 40 -14.551 12.832 -17.838 1.00 0.00 C ATOM 628 CD GLN A 40 -15.518 12.709 -19.013 1.00 0.00 C ATOM 629 OE1 GLN A 40 -15.572 11.685 -19.692 1.00 0.00 O ATOM 630 NE2 GLN A 40 -16.278 13.753 -19.285 1.00 0.00 N ATOM 0 H GLN A 40 -15.644 11.091 -14.392 1.00 0.00 H new ATOM 0 HA GLN A 40 -15.909 10.462 -17.227 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -16.033 12.776 -16.274 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -14.385 12.614 -15.700 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -14.284 13.882 -17.719 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -13.635 12.296 -18.087 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -16.217 14.592 -18.709 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -16.927 13.721 -20.072 1.00 0.00 H new ATOM 639 N GLN A 41 -13.256 9.517 -15.594 1.00 0.00 N ATOM 640 CA GLN A 41 -12.012 8.778 -15.790 1.00 0.00 C ATOM 641 C GLN A 41 -12.335 7.408 -16.343 1.00 0.00 C ATOM 642 O GLN A 41 -13.286 6.748 -15.932 1.00 0.00 O ATOM 643 CB GLN A 41 -11.261 8.626 -14.454 1.00 0.00 C ATOM 644 CG GLN A 41 -10.625 9.927 -13.951 1.00 0.00 C ATOM 645 CD GLN A 41 -10.229 9.800 -12.493 1.00 0.00 C ATOM 646 OE1 GLN A 41 -9.619 8.815 -12.117 1.00 0.00 O ATOM 647 NE2 GLN A 41 -10.602 10.725 -11.625 1.00 0.00 N ATOM 0 H GLN A 41 -13.564 9.584 -14.624 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.378 9.325 -16.488 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.954 8.255 -13.699 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.482 7.872 -14.569 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.747 10.165 -14.552 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.327 10.752 -14.072 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.113 11.548 -11.945 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.379 10.616 -10.636 1.00 0.00 H new ATOM 656 N ARG A 42 -11.438 6.941 -17.200 1.00 0.00 N ATOM 657 CA ARG A 42 -11.391 5.587 -17.721 1.00 0.00 C ATOM 658 C ARG A 42 -9.981 5.136 -17.401 1.00 0.00 C ATOM 659 O ARG A 42 -9.041 5.578 -18.042 1.00 0.00 O ATOM 660 CB ARG A 42 -11.726 5.676 -19.212 1.00 0.00 C ATOM 661 CG ARG A 42 -11.911 4.314 -19.880 1.00 0.00 C ATOM 662 CD ARG A 42 -12.377 4.471 -21.340 1.00 0.00 C ATOM 663 NE ARG A 42 -13.017 3.232 -21.840 1.00 0.00 N ATOM 664 CZ ARG A 42 -12.758 2.578 -22.983 1.00 0.00 C ATOM 665 NH1 ARG A 42 -11.763 2.925 -23.786 1.00 0.00 N ATOM 666 NH2 ARG A 42 -13.495 1.540 -23.353 1.00 0.00 N ATOM 0 H ARG A 42 -10.688 7.527 -17.567 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.096 4.868 -17.302 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.638 6.259 -19.337 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -10.930 6.217 -19.723 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.972 3.761 -19.852 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.642 3.728 -19.323 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.081 5.300 -21.412 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.524 4.722 -21.971 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.740 2.828 -21.245 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -11.163 3.713 -23.543 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -11.597 2.404 -24.647 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -14.270 1.230 -22.767 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.287 1.052 -24.224 1.00 0.00 H new ATOM 680 N LEU A 43 -9.808 4.398 -16.315 1.00 0.00 N ATOM 681 CA LEU A 43 -8.476 4.060 -15.829 1.00 0.00 C ATOM 682 C LEU A 43 -8.053 2.851 -16.620 1.00 0.00 C ATOM 683 O LEU A 43 -8.836 1.922 -16.758 1.00 0.00 O ATOM 684 CB LEU A 43 -8.534 3.759 -14.314 1.00 0.00 C ATOM 685 CG LEU A 43 -7.411 4.419 -13.503 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.468 5.960 -13.565 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.605 3.996 -12.047 1.00 0.00 C ATOM 0 H LEU A 43 -10.571 4.021 -15.753 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.763 4.874 -15.958 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.495 4.094 -13.924 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.489 2.680 -14.166 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.451 4.106 -13.914 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.652 6.378 -12.975 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.371 6.286 -14.601 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.421 6.305 -13.163 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.825 4.444 -11.431 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.581 4.332 -11.698 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.547 2.910 -11.973 1.00 0.00 H new ATOM 699 N ILE A 44 -6.834 2.856 -17.131 1.00 0.00 N ATOM 700 CA ILE A 44 -6.294 1.752 -17.913 1.00 0.00 C ATOM 701 C ILE A 44 -5.063 1.255 -17.178 1.00 0.00 C ATOM 702 O ILE A 44 -4.389 2.021 -16.490 1.00 0.00 O ATOM 703 CB ILE A 44 -6.055 2.193 -19.383 1.00 0.00 C ATOM 704 CG1 ILE A 44 -7.407 2.637 -19.995 1.00 0.00 C ATOM 705 CG2 ILE A 44 -5.396 1.096 -20.243 1.00 0.00 C ATOM 706 CD1 ILE A 44 -7.447 2.831 -21.515 1.00 0.00 C ATOM 0 H ILE A 44 -6.183 3.633 -17.015 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.989 0.917 -18.000 1.00 0.00 H new ATOM 0 HB ILE A 44 -5.351 3.025 -19.375 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.161 1.897 -19.727 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.701 3.575 -19.525 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -5.256 1.465 -21.259 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.429 0.831 -19.816 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.037 0.215 -20.263 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -8.448 3.141 -21.816 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.727 3.597 -21.803 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -7.194 1.892 -22.008 1.00 0.00 H new ATOM 718 N PHE A 45 -4.767 -0.025 -17.344 1.00 0.00 N ATOM 719 CA PHE A 45 -3.557 -0.647 -16.858 1.00 0.00 C ATOM 720 C PHE A 45 -3.106 -1.622 -17.928 1.00 0.00 C ATOM 721 O PHE A 45 -3.873 -2.500 -18.303 1.00 0.00 O ATOM 722 CB PHE A 45 -3.855 -1.393 -15.553 1.00 0.00 C ATOM 723 CG PHE A 45 -2.686 -2.209 -15.052 1.00 0.00 C ATOM 724 CD1 PHE A 45 -1.464 -1.566 -14.795 1.00 0.00 C ATOM 725 CD2 PHE A 45 -2.800 -3.601 -14.871 1.00 0.00 C ATOM 726 CE1 PHE A 45 -0.357 -2.309 -14.346 1.00 0.00 C ATOM 727 CE2 PHE A 45 -1.700 -4.340 -14.408 1.00 0.00 C ATOM 728 CZ PHE A 45 -0.481 -3.694 -14.135 1.00 0.00 C ATOM 0 H PHE A 45 -5.383 -0.673 -17.835 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.781 0.092 -16.657 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -4.141 -0.672 -14.787 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.710 -2.051 -15.706 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.374 -0.500 -14.942 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.733 -4.100 -15.088 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.587 -1.817 -14.164 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.790 -5.406 -14.261 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.360 -4.261 -13.763 1.00 0.00 H new ATOM 738 N ALA A 46 -1.889 -1.454 -18.441 1.00 0.00 N ATOM 739 CA ALA A 46 -1.210 -2.407 -19.324 1.00 0.00 C ATOM 740 C ALA A 46 -2.046 -2.898 -20.519 1.00 0.00 C ATOM 741 O ALA A 46 -1.869 -4.011 -21.018 1.00 0.00 O ATOM 742 CB ALA A 46 -0.664 -3.547 -18.465 1.00 0.00 C ATOM 0 H ALA A 46 -1.328 -0.624 -18.249 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.390 -1.883 -19.814 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.154 -4.270 -19.101 1.00 0.00 H new ATOM 0 HB2 ALA A 46 0.039 -3.147 -17.734 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.487 -4.038 -17.946 1.00 0.00 H new ATOM 748 N GLY A 47 -2.956 -2.039 -20.981 1.00 0.00 N ATOM 749 CA GLY A 47 -3.774 -2.251 -22.167 1.00 0.00 C ATOM 750 C GLY A 47 -5.209 -2.664 -21.863 1.00 0.00 C ATOM 751 O GLY A 47 -5.960 -2.907 -22.805 1.00 0.00 O ATOM 0 H GLY A 47 -3.147 -1.148 -20.522 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -3.787 -1.334 -22.756 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.309 -3.019 -22.785 1.00 0.00 H new ATOM 755 N LYS A 48 -5.613 -2.718 -20.586 1.00 0.00 N ATOM 756 CA LYS A 48 -6.995 -3.021 -20.211 1.00 0.00 C ATOM 757 C LYS A 48 -7.548 -1.980 -19.254 1.00 0.00 C ATOM 758 O LYS A 48 -6.848 -1.513 -18.368 1.00 0.00 O ATOM 759 CB LYS A 48 -7.104 -4.462 -19.688 1.00 0.00 C ATOM 760 CG LYS A 48 -6.508 -4.723 -18.288 1.00 0.00 C ATOM 761 CD LYS A 48 -6.615 -6.197 -17.856 1.00 0.00 C ATOM 762 CE LYS A 48 -5.745 -7.124 -18.727 1.00 0.00 C ATOM 763 NZ LYS A 48 -5.818 -8.546 -18.283 1.00 0.00 N ATOM 0 H LYS A 48 -4.994 -2.554 -19.792 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.627 -2.965 -21.098 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -8.157 -4.742 -19.670 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.610 -5.124 -20.400 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.460 -4.424 -18.283 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.021 -4.098 -17.558 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.312 -6.291 -16.813 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.655 -6.517 -17.915 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.068 -7.052 -19.766 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -4.709 -6.787 -18.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.218 -9.133 -18.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.485 -8.620 -17.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -6.802 -8.878 -18.341 1.00 0.00 H new ATOM 777 N GLN A 49 -8.799 -1.592 -19.444 1.00 0.00 N ATOM 778 CA GLN A 49 -9.524 -0.703 -18.543 1.00 0.00 C ATOM 779 C GLN A 49 -9.727 -1.422 -17.204 1.00 0.00 C ATOM 780 O GLN A 49 -9.852 -2.651 -17.170 1.00 0.00 O ATOM 781 CB GLN A 49 -10.899 -0.326 -19.138 1.00 0.00 C ATOM 782 CG GLN A 49 -10.895 0.572 -20.388 1.00 0.00 C ATOM 783 CD GLN A 49 -10.365 -0.113 -21.649 1.00 0.00 C ATOM 784 OE1 GLN A 49 -9.193 -0.002 -21.982 1.00 0.00 O ATOM 785 NE2 GLN A 49 -11.202 -0.849 -22.362 1.00 0.00 N ATOM 0 H GLN A 49 -9.353 -1.892 -20.246 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.948 0.212 -18.401 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -11.426 -1.248 -19.384 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -11.478 0.175 -18.362 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -11.911 0.919 -20.576 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -10.289 1.455 -20.186 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -12.177 -0.935 -22.075 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -10.872 -1.331 -23.198 1.00 0.00 H new ATOM 794 N LEU A 50 -9.844 -0.645 -16.125 1.00 0.00 N ATOM 795 CA LEU A 50 -10.250 -1.134 -14.809 1.00 0.00 C ATOM 796 C LEU A 50 -11.645 -0.586 -14.497 1.00 0.00 C ATOM 797 O LEU A 50 -12.041 0.418 -15.091 1.00 0.00 O ATOM 798 CB LEU A 50 -9.238 -0.722 -13.719 1.00 0.00 C ATOM 799 CG LEU A 50 -7.741 -0.756 -14.079 1.00 0.00 C ATOM 800 CD1 LEU A 50 -6.899 -0.459 -12.835 1.00 0.00 C ATOM 801 CD2 LEU A 50 -7.287 -2.074 -14.705 1.00 0.00 C ATOM 0 H LEU A 50 -9.656 0.357 -16.143 1.00 0.00 H new ATOM 0 HA LEU A 50 -10.275 -2.224 -14.820 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.483 0.291 -13.400 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -9.390 -1.372 -12.858 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.592 0.013 -14.837 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.841 -0.485 -13.097 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.154 0.529 -12.451 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.102 -1.209 -12.071 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.222 -2.022 -14.931 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.470 -2.891 -14.007 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.845 -2.251 -15.625 1.00 0.00 H new ATOM 813 N GLU A 51 -12.370 -1.178 -13.541 1.00 0.00 N ATOM 814 CA GLU A 51 -13.693 -0.698 -13.136 1.00 0.00 C ATOM 815 C GLU A 51 -13.684 -0.377 -11.644 1.00 0.00 C ATOM 816 O GLU A 51 -12.898 -0.944 -10.887 1.00 0.00 O ATOM 817 CB GLU A 51 -14.797 -1.680 -13.567 1.00 0.00 C ATOM 818 CG GLU A 51 -14.818 -2.996 -12.786 1.00 0.00 C ATOM 819 CD GLU A 51 -15.941 -3.927 -13.288 1.00 0.00 C ATOM 820 OE1 GLU A 51 -15.707 -4.724 -14.230 1.00 0.00 O ATOM 821 OE2 GLU A 51 -17.065 -3.874 -12.733 1.00 0.00 O ATOM 0 H GLU A 51 -12.055 -2.002 -13.028 1.00 0.00 H new ATOM 0 HA GLU A 51 -13.929 0.231 -13.654 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.765 -1.191 -13.455 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -14.673 -1.903 -14.627 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.855 -3.497 -12.887 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -14.960 -2.790 -11.725 1.00 0.00 H new ATOM 828 N ASP A 52 -14.556 0.543 -11.224 1.00 0.00 N ATOM 829 CA ASP A 52 -14.551 1.150 -9.891 1.00 0.00 C ATOM 830 C ASP A 52 -14.653 0.130 -8.760 1.00 0.00 C ATOM 831 O ASP A 52 -14.038 0.317 -7.710 1.00 0.00 O ATOM 832 CB ASP A 52 -15.657 2.202 -9.761 1.00 0.00 C ATOM 833 CG ASP A 52 -17.030 1.598 -9.425 1.00 0.00 C ATOM 834 OD1 ASP A 52 -17.697 1.087 -10.354 1.00 0.00 O ATOM 835 OD2 ASP A 52 -17.440 1.624 -8.240 1.00 0.00 O ATOM 0 H ASP A 52 -15.306 0.896 -11.819 1.00 0.00 H new ATOM 0 HA ASP A 52 -13.580 1.635 -9.788 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.381 2.916 -8.985 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -15.731 2.759 -10.695 1.00 0.00 H new ATOM 840 N GLY A 53 -15.367 -0.968 -9.012 1.00 0.00 N ATOM 841 CA GLY A 53 -15.666 -1.994 -8.025 1.00 0.00 C ATOM 842 C GLY A 53 -14.546 -3.019 -7.860 1.00 0.00 C ATOM 843 O GLY A 53 -14.782 -4.076 -7.269 1.00 0.00 O ATOM 0 H GLY A 53 -15.761 -1.169 -9.931 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -15.858 -1.518 -7.063 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -16.582 -2.510 -8.314 1.00 0.00 H new ATOM 847 N ARG A 54 -13.354 -2.772 -8.410 1.00 0.00 N ATOM 848 CA ARG A 54 -12.211 -3.678 -8.382 1.00 0.00 C ATOM 849 C ARG A 54 -11.041 -3.005 -7.698 1.00 0.00 C ATOM 850 O ARG A 54 -11.132 -1.831 -7.362 1.00 0.00 O ATOM 851 CB ARG A 54 -11.892 -4.088 -9.824 1.00 0.00 C ATOM 852 CG ARG A 54 -12.992 -4.930 -10.494 1.00 0.00 C ATOM 853 CD ARG A 54 -13.130 -6.341 -9.923 1.00 0.00 C ATOM 854 NE ARG A 54 -13.888 -6.402 -8.659 1.00 0.00 N ATOM 855 CZ ARG A 54 -13.860 -7.383 -7.748 1.00 0.00 C ATOM 856 NH1 ARG A 54 -13.043 -8.425 -7.868 1.00 0.00 N ATOM 857 NH2 ARG A 54 -14.669 -7.301 -6.694 1.00 0.00 N ATOM 0 H ARG A 54 -13.155 -1.902 -8.904 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.434 -4.578 -7.809 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.725 -3.189 -10.418 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -10.960 -4.654 -9.832 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -13.946 -4.412 -10.390 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -12.782 -5.000 -11.561 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.622 -6.975 -10.661 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -12.135 -6.755 -9.759 1.00 0.00 H new ATOM 0 HE ARG A 54 -14.500 -5.611 -8.457 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -12.416 -8.492 -8.670 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -13.043 -9.158 -7.158 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -15.294 -6.502 -6.592 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -14.663 -8.038 -5.988 1.00 0.00 H new ATOM 871 N THR A 55 -9.946 -3.714 -7.483 1.00 0.00 N ATOM 872 CA THR A 55 -8.824 -3.255 -6.684 1.00 0.00 C ATOM 873 C THR A 55 -7.554 -3.453 -7.472 1.00 0.00 C ATOM 874 O THR A 55 -7.533 -4.181 -8.463 1.00 0.00 O ATOM 875 CB THR A 55 -8.764 -4.057 -5.378 1.00 0.00 C ATOM 876 OG1 THR A 55 -8.869 -5.439 -5.659 1.00 0.00 O ATOM 877 CG2 THR A 55 -9.879 -3.682 -4.406 1.00 0.00 C ATOM 0 H THR A 55 -9.810 -4.648 -7.869 1.00 0.00 H new ATOM 0 HA THR A 55 -8.942 -2.199 -6.443 1.00 0.00 H new ATOM 0 HB THR A 55 -7.808 -3.821 -4.910 1.00 0.00 H new ATOM 0 HG1 THR A 55 -8.062 -5.899 -5.346 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.788 -4.280 -3.499 1.00 0.00 H new ATOM 0 HG22 THR A 55 -9.800 -2.625 -4.153 1.00 0.00 H new ATOM 0 HG23 THR A 55 -10.846 -3.873 -4.871 1.00 0.00 H new ATOM 885 N LEU A 56 -6.476 -2.836 -7.008 1.00 0.00 N ATOM 886 CA LEU A 56 -5.196 -2.961 -7.709 1.00 0.00 C ATOM 887 C LEU A 56 -4.761 -4.432 -7.766 1.00 0.00 C ATOM 888 O LEU A 56 -4.335 -4.941 -8.801 1.00 0.00 O ATOM 889 CB LEU A 56 -4.154 -2.029 -7.051 1.00 0.00 C ATOM 890 CG LEU A 56 -4.644 -0.581 -6.923 1.00 0.00 C ATOM 891 CD1 LEU A 56 -3.563 0.297 -6.315 1.00 0.00 C ATOM 892 CD2 LEU A 56 -5.042 -0.023 -8.297 1.00 0.00 C ATOM 0 H LEU A 56 -6.455 -2.256 -6.169 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.296 -2.639 -8.745 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.905 -2.412 -6.061 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.236 -2.046 -7.639 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.516 -0.578 -6.269 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.929 1.320 -6.232 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.305 -0.077 -5.324 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.678 0.279 -6.952 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.387 1.005 -8.186 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.179 -0.047 -8.963 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.843 -0.631 -8.719 1.00 0.00 H new ATOM 904 N SER A 57 -4.987 -5.141 -6.671 1.00 0.00 N ATOM 905 CA SER A 57 -4.767 -6.565 -6.508 1.00 0.00 C ATOM 906 C SER A 57 -5.607 -7.416 -7.456 1.00 0.00 C ATOM 907 O SER A 57 -5.101 -8.429 -7.939 1.00 0.00 O ATOM 908 CB SER A 57 -5.097 -6.939 -5.068 1.00 0.00 C ATOM 909 OG SER A 57 -6.337 -6.384 -4.643 1.00 0.00 O ATOM 0 H SER A 57 -5.351 -4.709 -5.822 1.00 0.00 H new ATOM 0 HA SER A 57 -3.723 -6.768 -6.748 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.135 -8.024 -4.975 1.00 0.00 H new ATOM 0 HB3 SER A 57 -4.300 -6.591 -4.411 1.00 0.00 H new ATOM 0 HG SER A 57 -6.513 -6.648 -3.716 1.00 0.00 H new ATOM 915 N ASP A 58 -6.837 -7.004 -7.786 1.00 0.00 N ATOM 916 CA ASP A 58 -7.666 -7.734 -8.749 1.00 0.00 C ATOM 917 C ASP A 58 -6.958 -7.807 -10.105 1.00 0.00 C ATOM 918 O ASP A 58 -7.084 -8.789 -10.843 1.00 0.00 O ATOM 919 CB ASP A 58 -9.021 -7.057 -8.924 1.00 0.00 C ATOM 920 CG ASP A 58 -9.936 -7.936 -9.792 1.00 0.00 C ATOM 921 OD1 ASP A 58 -10.639 -8.807 -9.221 1.00 0.00 O ATOM 922 OD2 ASP A 58 -10.023 -7.728 -11.023 1.00 0.00 O ATOM 0 H ASP A 58 -7.279 -6.170 -7.400 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.823 -8.741 -8.363 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.481 -6.888 -7.951 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.892 -6.080 -9.390 1.00 0.00 H new ATOM 927 N TYR A 59 -6.132 -6.793 -10.375 1.00 0.00 N ATOM 928 CA TYR A 59 -5.410 -6.600 -11.625 1.00 0.00 C ATOM 929 C TYR A 59 -3.927 -6.981 -11.490 1.00 0.00 C ATOM 930 O TYR A 59 -3.161 -6.821 -12.437 1.00 0.00 O ATOM 931 CB TYR A 59 -5.627 -5.154 -12.091 1.00 0.00 C ATOM 932 CG TYR A 59 -7.078 -4.850 -12.425 1.00 0.00 C ATOM 933 CD1 TYR A 59 -7.673 -5.451 -13.551 1.00 0.00 C ATOM 934 CD2 TYR A 59 -7.842 -3.996 -11.605 1.00 0.00 C ATOM 935 CE1 TYR A 59 -9.024 -5.208 -13.861 1.00 0.00 C ATOM 936 CE2 TYR A 59 -9.196 -3.770 -11.894 1.00 0.00 C ATOM 937 CZ TYR A 59 -9.795 -4.371 -13.023 1.00 0.00 C ATOM 938 OH TYR A 59 -11.096 -4.085 -13.314 1.00 0.00 O ATOM 0 H TYR A 59 -5.943 -6.055 -9.696 1.00 0.00 H new ATOM 0 HA TYR A 59 -5.801 -7.270 -12.391 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.289 -4.472 -11.311 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -5.010 -4.965 -12.969 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.088 -6.104 -14.182 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.385 -3.515 -10.753 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.470 -5.659 -14.735 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.784 -3.133 -11.250 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.580 -4.917 -13.500 1.00 0.00 H new ATOM 948 N ASN A 60 -3.527 -7.525 -10.328 1.00 0.00 N ATOM 949 CA ASN A 60 -2.157 -7.929 -9.969 1.00 0.00 C ATOM 950 C ASN A 60 -1.170 -6.756 -10.049 1.00 0.00 C ATOM 951 O ASN A 60 0.040 -6.947 -10.185 1.00 0.00 O ATOM 952 CB ASN A 60 -1.699 -9.192 -10.729 1.00 0.00 C ATOM 953 CG ASN A 60 -2.329 -10.471 -10.181 1.00 0.00 C ATOM 954 OD1 ASN A 60 -1.638 -11.346 -9.662 1.00 0.00 O ATOM 955 ND2 ASN A 60 -3.646 -10.600 -10.257 1.00 0.00 N ATOM 0 H ASN A 60 -4.188 -7.705 -9.572 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.170 -8.222 -8.919 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -1.955 -9.089 -11.784 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -0.614 -9.273 -10.670 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -4.099 -11.433 -9.882 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -4.206 -9.866 -10.690 1.00 0.00 H new ATOM 962 N ILE A 61 -1.688 -5.532 -9.957 1.00 0.00 N ATOM 963 CA ILE A 61 -0.905 -4.318 -9.788 1.00 0.00 C ATOM 964 C ILE A 61 -0.314 -4.417 -8.381 1.00 0.00 C ATOM 965 O ILE A 61 -0.958 -4.945 -7.467 1.00 0.00 O ATOM 966 CB ILE A 61 -1.843 -3.101 -9.950 1.00 0.00 C ATOM 967 CG1 ILE A 61 -2.470 -3.040 -11.356 1.00 0.00 C ATOM 968 CG2 ILE A 61 -1.158 -1.751 -9.646 1.00 0.00 C ATOM 969 CD1 ILE A 61 -3.744 -2.201 -11.388 1.00 0.00 C ATOM 0 H ILE A 61 -2.692 -5.357 -10.000 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.108 -4.201 -10.522 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.626 -3.254 -9.207 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.746 -2.623 -12.056 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.695 -4.051 -11.695 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -1.875 -0.941 -9.780 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.797 -1.750 -8.618 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.318 -1.608 -10.326 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.147 -2.190 -12.401 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.480 -2.632 -10.709 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.516 -1.182 -11.077 1.00 0.00 H new ATOM 981 N GLN A 62 0.902 -3.917 -8.184 1.00 0.00 N ATOM 982 CA GLN A 62 1.614 -3.956 -6.914 1.00 0.00 C ATOM 983 C GLN A 62 2.123 -2.546 -6.608 1.00 0.00 C ATOM 984 O GLN A 62 1.715 -1.571 -7.233 1.00 0.00 O ATOM 985 CB GLN A 62 2.763 -4.985 -7.014 1.00 0.00 C ATOM 986 CG GLN A 62 2.282 -6.409 -7.322 1.00 0.00 C ATOM 987 CD GLN A 62 1.637 -7.108 -6.116 1.00 0.00 C ATOM 988 OE1 GLN A 62 2.316 -7.761 -5.324 1.00 0.00 O ATOM 989 NE2 GLN A 62 0.327 -6.989 -5.933 1.00 0.00 N ATOM 0 H GLN A 62 1.433 -3.461 -8.926 1.00 0.00 H new ATOM 0 HA GLN A 62 0.963 -4.269 -6.098 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.458 -4.668 -7.792 1.00 0.00 H new ATOM 0 HB3 GLN A 62 3.317 -4.992 -6.075 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.562 -6.373 -8.140 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.128 -7.004 -7.668 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -0.233 -6.447 -6.591 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -0.119 -7.440 -5.134 1.00 0.00 H new ATOM 998 N LYS A 63 2.972 -2.411 -5.592 1.00 0.00 N ATOM 999 CA LYS A 63 3.708 -1.190 -5.324 1.00 0.00 C ATOM 1000 C LYS A 63 4.595 -0.850 -6.513 1.00 0.00 C ATOM 1001 O LYS A 63 5.120 -1.725 -7.202 1.00 0.00 O ATOM 1002 CB LYS A 63 4.553 -1.347 -4.048 1.00 0.00 C ATOM 1003 CG LYS A 63 5.744 -2.310 -4.207 1.00 0.00 C ATOM 1004 CD LYS A 63 6.504 -2.557 -2.896 1.00 0.00 C ATOM 1005 CE LYS A 63 5.765 -3.508 -1.934 1.00 0.00 C ATOM 1006 NZ LYS A 63 6.572 -3.819 -0.720 1.00 0.00 N ATOM 0 H LYS A 63 3.167 -3.159 -4.927 1.00 0.00 H new ATOM 0 HA LYS A 63 3.001 -0.375 -5.169 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.927 -0.368 -3.748 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.913 -1.705 -3.241 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.383 -3.263 -4.595 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.433 -1.905 -4.948 1.00 0.00 H new ATOM 0 HD2 LYS A 63 7.485 -2.973 -3.125 1.00 0.00 H new ATOM 0 HD3 LYS A 63 6.672 -1.603 -2.396 1.00 0.00 H new ATOM 0 HE2 LYS A 63 4.820 -3.056 -1.634 1.00 0.00 H new ATOM 0 HE3 LYS A 63 5.524 -4.434 -2.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.036 -4.461 -0.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.463 -4.274 -1.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.781 -2.939 -0.207 1.00 0.00 H new ATOM 1020 N GLU A 64 4.834 0.454 -6.611 1.00 0.00 N ATOM 1021 CA GLU A 64 5.681 1.082 -7.609 1.00 0.00 C ATOM 1022 C GLU A 64 5.289 0.554 -8.996 1.00 0.00 C ATOM 1023 O GLU A 64 6.129 0.108 -9.783 1.00 0.00 O ATOM 1024 CB GLU A 64 7.179 0.919 -7.285 1.00 0.00 C ATOM 1025 CG GLU A 64 7.650 1.493 -5.951 1.00 0.00 C ATOM 1026 CD GLU A 64 9.166 1.302 -5.768 1.00 0.00 C ATOM 1027 OE1 GLU A 64 9.944 2.186 -6.203 1.00 0.00 O ATOM 1028 OE2 GLU A 64 9.589 0.284 -5.168 1.00 0.00 O ATOM 0 H GLU A 64 4.422 1.129 -5.966 1.00 0.00 H new ATOM 0 HA GLU A 64 5.518 2.160 -7.602 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.419 -0.144 -7.304 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.754 1.390 -8.082 1.00 0.00 H new ATOM 0 HG2 GLU A 64 7.406 2.554 -5.902 1.00 0.00 H new ATOM 0 HG3 GLU A 64 7.118 1.006 -5.134 1.00 0.00 H new ATOM 1035 N SER A 65 3.978 0.581 -9.255 1.00 0.00 N ATOM 1036 CA SER A 65 3.423 0.056 -10.512 1.00 0.00 C ATOM 1037 C SER A 65 2.714 1.182 -11.242 1.00 0.00 C ATOM 1038 O SER A 65 2.181 2.091 -10.607 1.00 0.00 O ATOM 1039 CB SER A 65 2.473 -1.134 -10.279 1.00 0.00 C ATOM 1040 OG SER A 65 3.135 -2.284 -9.766 1.00 0.00 O ATOM 0 H SER A 65 3.280 0.959 -8.614 1.00 0.00 H new ATOM 0 HA SER A 65 4.243 -0.323 -11.121 1.00 0.00 H new ATOM 0 HB2 SER A 65 1.688 -0.834 -9.585 1.00 0.00 H new ATOM 0 HB3 SER A 65 1.986 -1.392 -11.219 1.00 0.00 H new ATOM 0 HG SER A 65 3.715 -2.022 -9.021 1.00 0.00 H new ATOM 1046 N THR A 66 2.707 1.121 -12.568 1.00 0.00 N ATOM 1047 CA THR A 66 2.263 2.220 -13.414 1.00 0.00 C ATOM 1048 C THR A 66 0.856 1.947 -13.944 1.00 0.00 C ATOM 1049 O THR A 66 0.530 0.830 -14.325 1.00 0.00 O ATOM 1050 CB THR A 66 3.280 2.468 -14.549 1.00 0.00 C ATOM 1051 OG1 THR A 66 4.583 2.551 -13.992 1.00 0.00 O ATOM 1052 CG2 THR A 66 3.003 3.758 -15.344 1.00 0.00 C ATOM 0 H THR A 66 3.012 0.300 -13.090 1.00 0.00 H new ATOM 0 HA THR A 66 2.212 3.134 -12.822 1.00 0.00 H new ATOM 0 HB THR A 66 3.190 1.633 -15.243 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.235 2.707 -14.707 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.754 3.872 -16.126 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.013 3.701 -15.797 1.00 0.00 H new ATOM 0 HG23 THR A 66 3.045 4.615 -14.672 1.00 0.00 H new ATOM 1060 N LEU A 67 0.042 2.997 -13.981 1.00 0.00 N ATOM 1061 CA LEU A 67 -1.345 3.052 -14.425 1.00 0.00 C ATOM 1062 C LEU A 67 -1.503 4.123 -15.504 1.00 0.00 C ATOM 1063 O LEU A 67 -0.590 4.922 -15.697 1.00 0.00 O ATOM 1064 CB LEU A 67 -2.188 3.435 -13.194 1.00 0.00 C ATOM 1065 CG LEU A 67 -3.398 2.550 -12.955 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -2.936 1.169 -12.506 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.250 3.164 -11.848 1.00 0.00 C ATOM 0 H LEU A 67 0.367 3.914 -13.673 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.661 2.096 -14.842 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.551 3.403 -12.310 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.525 4.465 -13.307 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.976 2.466 -13.875 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.804 0.533 -12.334 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.309 0.726 -13.280 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.364 1.259 -11.583 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.122 2.535 -11.669 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.661 3.237 -10.934 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.576 4.159 -12.150 1.00 0.00 H new ATOM 1079 N HIS A 68 -2.680 4.231 -16.127 1.00 0.00 N ATOM 1080 CA HIS A 68 -2.925 5.217 -17.189 1.00 0.00 C ATOM 1081 C HIS A 68 -4.249 5.943 -16.980 1.00 0.00 C ATOM 1082 O HIS A 68 -5.269 5.300 -16.736 1.00 0.00 O ATOM 1083 CB HIS A 68 -2.944 4.518 -18.567 1.00 0.00 C ATOM 1084 CG HIS A 68 -1.613 4.420 -19.268 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -1.137 3.277 -19.907 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -0.764 5.462 -19.516 1.00 0.00 C ATOM 1087 CE1 HIS A 68 0.007 3.647 -20.506 1.00 0.00 C ATOM 1088 NE2 HIS A 68 0.262 4.944 -20.275 1.00 0.00 N ATOM 0 H HIS A 68 -3.486 3.643 -15.913 1.00 0.00 H new ATOM 0 HA HIS A 68 -2.118 5.948 -17.153 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.341 3.511 -18.438 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.637 5.053 -19.216 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -1.567 2.352 -19.918 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.875 6.484 -19.184 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.634 2.992 -21.092 1.00 0.00 H new ATOM 1096 N LEU A 69 -4.243 7.273 -17.105 1.00 0.00 N ATOM 1097 CA LEU A 69 -5.473 8.077 -17.169 1.00 0.00 C ATOM 1098 C LEU A 69 -5.870 8.101 -18.628 1.00 0.00 C ATOM 1099 O LEU A 69 -5.099 8.558 -19.461 1.00 0.00 O ATOM 1100 CB LEU A 69 -5.253 9.541 -16.688 1.00 0.00 C ATOM 1101 CG LEU A 69 -6.066 10.693 -17.371 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -7.557 10.578 -17.044 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -5.582 12.067 -16.937 1.00 0.00 C ATOM 0 H LEU A 69 -3.387 7.825 -17.165 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.232 7.642 -16.519 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.470 9.573 -15.620 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.194 9.771 -16.805 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.909 10.586 -18.444 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.100 11.389 -17.530 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.936 9.621 -17.404 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.699 10.642 -15.965 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.174 12.835 -17.435 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.692 12.167 -15.857 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.533 12.185 -17.207 1.00 0.00 H new ATOM 1115 N VAL A 70 -7.099 7.701 -18.903 1.00 0.00 N ATOM 1116 CA VAL A 70 -7.774 7.845 -20.182 1.00 0.00 C ATOM 1117 C VAL A 70 -9.160 8.380 -19.826 1.00 0.00 C ATOM 1118 O VAL A 70 -9.567 8.361 -18.669 1.00 0.00 O ATOM 1119 CB VAL A 70 -7.703 6.483 -20.894 1.00 0.00 C ATOM 1120 CG1 VAL A 70 -8.556 6.417 -22.150 1.00 0.00 C ATOM 1121 CG2 VAL A 70 -6.243 6.159 -21.258 1.00 0.00 C ATOM 0 H VAL A 70 -7.684 7.243 -18.204 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.338 8.542 -20.897 1.00 0.00 H new ATOM 0 HB VAL A 70 -8.100 5.747 -20.195 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.461 5.430 -22.603 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.599 6.598 -21.891 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -8.221 7.175 -22.858 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -6.199 5.193 -21.762 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.853 6.932 -21.920 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.641 6.122 -20.350 1.00 0.00 H new ATOM 1131 N LEU A 71 -9.887 8.916 -20.794 1.00 0.00 N ATOM 1132 CA LEU A 71 -11.175 9.547 -20.562 1.00 0.00 C ATOM 1133 C LEU A 71 -12.279 8.543 -20.891 1.00 0.00 C ATOM 1134 O LEU A 71 -12.111 7.710 -21.769 1.00 0.00 O ATOM 1135 CB LEU A 71 -11.229 10.783 -21.474 1.00 0.00 C ATOM 1136 CG LEU A 71 -12.379 11.739 -21.113 1.00 0.00 C ATOM 1137 CD1 LEU A 71 -11.863 12.893 -20.262 1.00 0.00 C ATOM 1138 CD2 LEU A 71 -13.073 12.258 -22.361 1.00 0.00 C ATOM 0 H LEU A 71 -9.596 8.925 -21.772 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.313 9.854 -19.525 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.282 11.319 -21.408 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.342 10.461 -22.509 1.00 0.00 H new ATOM 0 HG LEU A 71 -13.114 11.182 -20.532 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.689 13.560 -20.015 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.426 12.501 -19.344 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.105 13.444 -20.818 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.881 12.931 -22.075 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.355 12.796 -22.980 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.482 11.420 -22.925 1.00 0.00 H new ATOM 1150 N ARG A 72 -13.417 8.640 -20.206 1.00 0.00 N ATOM 1151 CA ARG A 72 -14.651 7.877 -20.474 1.00 0.00 C ATOM 1152 C ARG A 72 -15.369 8.382 -21.737 1.00 0.00 C ATOM 1153 O ARG A 72 -16.236 7.687 -22.250 1.00 0.00 O ATOM 1154 CB ARG A 72 -15.544 8.029 -19.213 1.00 0.00 C ATOM 1155 CG ARG A 72 -16.759 7.094 -19.089 1.00 0.00 C ATOM 1156 CD ARG A 72 -16.446 5.806 -18.316 1.00 0.00 C ATOM 1157 NE ARG A 72 -17.674 5.030 -18.043 1.00 0.00 N ATOM 1158 CZ ARG A 72 -18.553 5.239 -17.049 1.00 0.00 C ATOM 1159 NH1 ARG A 72 -18.407 6.269 -16.220 1.00 0.00 N ATOM 1160 NH2 ARG A 72 -19.582 4.416 -16.894 1.00 0.00 N ATOM 0 H ARG A 72 -13.516 9.276 -19.415 1.00 0.00 H new ATOM 0 HA ARG A 72 -14.423 6.829 -20.666 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -14.915 7.882 -18.335 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -15.905 9.057 -19.178 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.569 7.624 -18.588 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -17.115 6.836 -20.086 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -15.748 5.196 -18.889 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -15.954 6.054 -17.376 1.00 0.00 H new ATOM 0 HE ARG A 72 -17.875 4.255 -18.675 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -17.622 6.909 -16.336 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -19.080 6.418 -15.469 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -19.704 3.627 -17.529 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -20.251 4.572 -16.140 1.00 0.00 H new ATOM 1174 N LEU A 73 -15.057 9.603 -22.199 1.00 0.00 N ATOM 1175 CA LEU A 73 -15.801 10.323 -23.249 1.00 0.00 C ATOM 1176 C LEU A 73 -17.283 10.378 -22.820 1.00 0.00 C ATOM 1177 O LEU A 73 -18.190 10.253 -23.637 1.00 0.00 O ATOM 1178 CB LEU A 73 -15.563 9.764 -24.680 1.00 0.00 C ATOM 1179 CG LEU A 73 -14.140 9.757 -25.298 1.00 0.00 C ATOM 1180 CD1 LEU A 73 -13.453 11.103 -25.526 1.00 0.00 C ATOM 1181 CD2 LEU A 73 -13.177 8.768 -24.643 1.00 0.00 C ATOM 0 H LEU A 73 -14.260 10.132 -21.845 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.422 11.341 -23.336 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.921 8.735 -24.687 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -16.204 10.329 -25.356 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.381 9.405 -26.301 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.468 10.939 -25.962 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.054 11.708 -26.205 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -13.346 11.623 -24.574 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -12.206 8.827 -25.134 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.065 9.014 -23.587 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.572 7.757 -24.740 1.00 0.00 H new ATOM 1193 N ARG A 74 -17.496 10.508 -21.498 1.00 0.00 N ATOM 1194 CA ARG A 74 -18.773 10.433 -20.782 1.00 0.00 C ATOM 1195 C ARG A 74 -19.747 9.382 -21.350 1.00 0.00 C ATOM 1196 O ARG A 74 -20.952 9.620 -21.451 1.00 0.00 O ATOM 1197 CB ARG A 74 -19.341 11.857 -20.651 1.00 0.00 C ATOM 1198 CG ARG A 74 -20.247 12.038 -19.415 1.00 0.00 C ATOM 1199 CD ARG A 74 -19.433 12.229 -18.120 1.00 0.00 C ATOM 1200 NE ARG A 74 -20.192 11.831 -16.922 1.00 0.00 N ATOM 1201 CZ ARG A 74 -21.164 12.495 -16.289 1.00 0.00 C ATOM 1202 NH1 ARG A 74 -21.596 13.685 -16.711 1.00 0.00 N ATOM 1203 NH2 ARG A 74 -21.688 11.931 -15.209 1.00 0.00 N ATOM 0 H ARG A 74 -16.720 10.681 -20.859 1.00 0.00 H new ATOM 0 HA ARG A 74 -18.604 10.049 -19.776 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -18.516 12.567 -20.596 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -19.910 12.099 -21.549 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -20.896 12.901 -19.565 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -20.894 11.167 -19.310 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -18.517 11.642 -18.179 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -19.137 13.274 -18.030 1.00 0.00 H new ATOM 0 HE ARG A 74 -19.942 10.927 -16.522 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -21.182 14.113 -17.539 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -22.340 14.166 -16.205 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -21.347 11.024 -14.891 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -22.432 12.404 -14.696 1.00 0.00 H new ATOM 1217 N GLY A 75 -19.229 8.196 -21.689 1.00 0.00 N ATOM 1218 CA GLY A 75 -20.023 7.023 -22.037 1.00 0.00 C ATOM 1219 C GLY A 75 -20.553 6.356 -20.765 1.00 0.00 C ATOM 1220 O GLY A 75 -20.214 5.203 -20.486 1.00 0.00 O ATOM 0 H GLY A 75 -18.224 8.026 -21.728 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -20.854 7.313 -22.679 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -19.415 6.316 -22.602 1.00 0.00 H new ATOM 1224 N GLY A 76 -21.303 7.100 -19.946 1.00 0.00 N ATOM 1225 CA GLY A 76 -21.775 6.690 -18.635 1.00 0.00 C ATOM 1226 C GLY A 76 -22.802 7.697 -18.125 1.00 0.00 C ATOM 1227 O GLY A 76 -22.682 8.899 -18.457 1.00 0.00 O ATOM 1228 OXT GLY A 76 -23.740 7.269 -17.415 1.00 0.00 O ATOM 0 H GLY A 76 -21.606 8.041 -20.196 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -22.221 5.697 -18.692 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -20.938 6.624 -17.940 1.00 0.00 H new TER 1232 GLY A 76 ATOM 1233 N GLY B -3 -6.392 16.965 -37.807 1.00 0.00 N ATOM 1234 CA GLY B -3 -6.986 18.278 -37.463 1.00 0.00 C ATOM 1235 C GLY B -3 -7.979 18.756 -38.520 1.00 0.00 C ATOM 1236 O GLY B -3 -7.579 19.082 -39.642 1.00 0.00 O ATOM 0 H1 GLY B -3 -5.575 16.781 -37.191 1.00 0.00 H new ATOM 0 H2 GLY B -3 -7.102 16.217 -37.673 1.00 0.00 H new ATOM 0 H3 GLY B -3 -6.082 16.974 -38.800 1.00 0.00 H new ATOM 0 HA2 GLY B -3 -7.490 18.206 -36.499 1.00 0.00 H new ATOM 0 HA3 GLY B -3 -6.192 19.016 -37.352 1.00 0.00 H new ATOM 1242 N HIS B -2 -9.270 18.835 -38.175 1.00 0.00 N ATOM 1243 CA HIS B -2 -10.320 19.413 -39.021 1.00 0.00 C ATOM 1244 C HIS B -2 -11.429 19.953 -38.119 1.00 0.00 C ATOM 1245 O HIS B -2 -11.581 19.486 -36.987 1.00 0.00 O ATOM 1246 CB HIS B -2 -10.853 18.345 -39.991 1.00 0.00 C ATOM 1247 CG HIS B -2 -11.819 18.903 -41.008 1.00 0.00 C ATOM 1248 ND1 HIS B -2 -13.205 18.970 -40.852 1.00 0.00 N ATOM 1249 CD2 HIS B -2 -11.477 19.482 -42.194 1.00 0.00 C ATOM 1250 CE1 HIS B -2 -13.667 19.584 -41.956 1.00 0.00 C ATOM 1251 NE2 HIS B -2 -12.650 19.904 -42.780 1.00 0.00 N ATOM 0 H HIS B -2 -9.621 18.491 -37.281 1.00 0.00 H new ATOM 0 HA HIS B -2 -9.922 20.233 -39.619 1.00 0.00 H new ATOM 0 HB2 HIS B -2 -10.014 17.882 -40.510 1.00 0.00 H new ATOM 0 HB3 HIS B -2 -11.348 17.559 -39.421 1.00 0.00 H new ATOM 0 HD2 HIS B -2 -10.480 19.589 -42.596 1.00 0.00 H new ATOM 0 HE1 HIS B -2 -14.708 19.792 -42.154 1.00 0.00 H new ATOM 0 HE2 HIS B -2 -12.734 20.376 -43.680 1.00 0.00 H new ATOM 1259 N MET B -1 -12.218 20.916 -38.603 1.00 0.00 N ATOM 1260 CA MET B -1 -13.274 21.586 -37.834 1.00 0.00 C ATOM 1261 C MET B -1 -14.445 20.651 -37.479 1.00 0.00 C ATOM 1262 O MET B -1 -15.273 21.004 -36.637 1.00 0.00 O ATOM 1263 CB MET B -1 -13.792 22.806 -38.612 1.00 0.00 C ATOM 1264 CG MET B -1 -12.711 23.876 -38.808 1.00 0.00 C ATOM 1265 SD MET B -1 -13.296 25.375 -39.651 1.00 0.00 S ATOM 1266 CE MET B -1 -11.752 26.326 -39.686 1.00 0.00 C ATOM 0 H MET B -1 -12.140 21.260 -39.560 1.00 0.00 H new ATOM 0 HA MET B -1 -12.828 21.904 -36.892 1.00 0.00 H new ATOM 0 HB2 MET B -1 -14.161 22.483 -39.586 1.00 0.00 H new ATOM 0 HB3 MET B -1 -14.638 23.241 -38.079 1.00 0.00 H new ATOM 0 HG2 MET B -1 -12.309 24.154 -37.834 1.00 0.00 H new ATOM 0 HG3 MET B -1 -11.890 23.447 -39.382 1.00 0.00 H new ATOM 0 HE1 MET B -1 -11.926 27.285 -40.173 1.00 0.00 H new ATOM 0 HE2 MET B -1 -11.405 26.495 -38.666 1.00 0.00 H new ATOM 0 HE3 MET B -1 -10.995 25.770 -40.239 1.00 0.00 H new ATOM 1276 N ASP B 674 -14.514 19.463 -38.081 1.00 0.00 N ATOM 1277 CA ASP B 674 -15.540 18.444 -37.838 1.00 0.00 C ATOM 1278 C ASP B 674 -14.979 17.281 -37.009 1.00 0.00 C ATOM 1279 O ASP B 674 -15.575 16.202 -36.934 1.00 0.00 O ATOM 1280 CB ASP B 674 -16.059 17.946 -39.189 1.00 0.00 C ATOM 1281 CG ASP B 674 -17.325 17.079 -39.064 1.00 0.00 C ATOM 1282 OD1 ASP B 674 -18.306 17.511 -38.407 1.00 0.00 O ATOM 1283 OD2 ASP B 674 -17.386 15.995 -39.697 1.00 0.00 O ATOM 0 H ASP B 674 -13.830 19.171 -38.779 1.00 0.00 H new ATOM 0 HA ASP B 674 -16.358 18.881 -37.266 1.00 0.00 H new ATOM 0 HB2 ASP B 674 -16.274 18.803 -39.828 1.00 0.00 H new ATOM 0 HB3 ASP B 674 -15.277 17.369 -39.682 1.00 0.00 H new ATOM 1288 N GLU B 675 -13.802 17.475 -36.410 1.00 0.00 N ATOM 1289 CA GLU B 675 -13.038 16.419 -35.758 1.00 0.00 C ATOM 1290 C GLU B 675 -12.471 16.934 -34.434 1.00 0.00 C ATOM 1291 O GLU B 675 -12.718 16.342 -33.385 1.00 0.00 O ATOM 1292 CB GLU B 675 -11.931 15.962 -36.728 1.00 0.00 C ATOM 1293 CG GLU B 675 -10.823 15.137 -36.067 1.00 0.00 C ATOM 1294 CD GLU B 675 -9.741 14.746 -37.088 1.00 0.00 C ATOM 1295 OE1 GLU B 675 -8.776 15.530 -37.262 1.00 0.00 O ATOM 1296 OE2 GLU B 675 -9.841 13.660 -37.711 1.00 0.00 O ATOM 0 H GLU B 675 -13.349 18.388 -36.366 1.00 0.00 H new ATOM 0 HA GLU B 675 -13.670 15.563 -35.522 1.00 0.00 H new ATOM 0 HB2 GLU B 675 -12.382 15.372 -37.525 1.00 0.00 H new ATOM 0 HB3 GLU B 675 -11.486 16.841 -37.195 1.00 0.00 H new ATOM 0 HG2 GLU B 675 -10.373 15.710 -35.256 1.00 0.00 H new ATOM 0 HG3 GLU B 675 -11.250 14.238 -35.623 1.00 0.00 H new ATOM 1303 N LYS B 676 -11.735 18.048 -34.504 1.00 0.00 N ATOM 1304 CA LYS B 676 -11.257 18.849 -33.382 1.00 0.00 C ATOM 1305 C LYS B 676 -10.732 18.060 -32.177 1.00 0.00 C ATOM 1306 O LYS B 676 -10.964 18.458 -31.032 1.00 0.00 O ATOM 1307 CB LYS B 676 -12.341 19.861 -32.995 1.00 0.00 C ATOM 1308 CG LYS B 676 -12.811 20.694 -34.197 1.00 0.00 C ATOM 1309 CD LYS B 676 -13.632 21.914 -33.763 1.00 0.00 C ATOM 1310 CE LYS B 676 -12.740 22.901 -32.995 1.00 0.00 C ATOM 1311 NZ LYS B 676 -13.432 24.179 -32.676 1.00 0.00 N ATOM 0 H LYS B 676 -11.442 18.434 -35.401 1.00 0.00 H new ATOM 0 HA LYS B 676 -10.364 19.369 -33.730 1.00 0.00 H new ATOM 0 HB2 LYS B 676 -13.192 19.333 -32.566 1.00 0.00 H new ATOM 0 HB3 LYS B 676 -11.956 20.526 -32.222 1.00 0.00 H new ATOM 0 HG2 LYS B 676 -11.945 21.025 -34.770 1.00 0.00 H new ATOM 0 HG3 LYS B 676 -13.411 20.070 -34.859 1.00 0.00 H new ATOM 0 HD2 LYS B 676 -14.061 22.403 -34.637 1.00 0.00 H new ATOM 0 HD3 LYS B 676 -14.464 21.598 -33.134 1.00 0.00 H new ATOM 0 HE2 LYS B 676 -12.404 22.435 -32.069 1.00 0.00 H new ATOM 0 HE3 LYS B 676 -11.849 23.114 -33.586 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 -12.783 24.805 -32.158 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 -13.730 24.642 -33.558 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 -14.267 23.984 -32.088 1.00 0.00 H new ATOM 1325 N ILE B 677 -10.011 16.966 -32.420 1.00 0.00 N ATOM 1326 CA ILE B 677 -9.287 16.294 -31.352 1.00 0.00 C ATOM 1327 C ILE B 677 -8.246 17.297 -30.864 1.00 0.00 C ATOM 1328 O ILE B 677 -7.559 17.915 -31.687 1.00 0.00 O ATOM 1329 CB ILE B 677 -8.628 14.992 -31.849 1.00 0.00 C ATOM 1330 CG1 ILE B 677 -9.723 14.021 -32.343 1.00 0.00 C ATOM 1331 CG2 ILE B 677 -7.767 14.361 -30.732 1.00 0.00 C ATOM 1332 CD1 ILE B 677 -9.155 12.776 -33.025 1.00 0.00 C ATOM 0 H ILE B 677 -9.915 16.533 -33.339 1.00 0.00 H new ATOM 0 HA ILE B 677 -9.957 15.993 -30.546 1.00 0.00 H new ATOM 0 HB ILE B 677 -7.962 15.213 -32.683 1.00 0.00 H new ATOM 0 HG12 ILE B 677 -10.339 13.716 -31.497 1.00 0.00 H new ATOM 0 HG13 ILE B 677 -10.377 14.544 -33.041 1.00 0.00 H new ATOM 0 HG21 ILE B 677 -7.309 13.443 -31.100 1.00 0.00 H new ATOM 0 HG22 ILE B 677 -6.987 15.061 -30.435 1.00 0.00 H new ATOM 0 HG23 ILE B 677 -8.397 14.133 -29.872 1.00 0.00 H new ATOM 0 HD11 ILE B 677 -9.974 12.134 -33.350 1.00 0.00 H new ATOM 0 HD12 ILE B 677 -8.562 13.073 -33.890 1.00 0.00 H new ATOM 0 HD13 ILE B 677 -8.524 12.232 -32.322 1.00 0.00 H new ATOM 1344 N THR B 678 -8.087 17.435 -29.556 1.00 0.00 N ATOM 1345 CA THR B 678 -7.085 18.284 -28.962 1.00 0.00 C ATOM 1346 C THR B 678 -6.369 17.542 -27.828 1.00 0.00 C ATOM 1347 O THR B 678 -6.897 16.617 -27.203 1.00 0.00 O ATOM 1348 CB THR B 678 -7.756 19.621 -28.607 1.00 0.00 C ATOM 1349 OG1 THR B 678 -6.789 20.634 -28.369 1.00 0.00 O ATOM 1350 CG2 THR B 678 -8.717 19.576 -27.417 1.00 0.00 C ATOM 0 H THR B 678 -8.665 16.948 -28.872 1.00 0.00 H new ATOM 0 HA THR B 678 -6.273 18.533 -29.645 1.00 0.00 H new ATOM 0 HB THR B 678 -8.358 19.850 -29.486 1.00 0.00 H new ATOM 0 HG1 THR B 678 -7.243 21.474 -28.147 1.00 0.00 H new ATOM 0 HG21 THR B 678 -9.136 20.568 -27.250 1.00 0.00 H new ATOM 0 HG22 THR B 678 -9.523 18.872 -27.626 1.00 0.00 H new ATOM 0 HG23 THR B 678 -8.178 19.255 -26.526 1.00 0.00 H new ATOM 1358 N PHE B 679 -5.126 17.958 -27.596 1.00 0.00 N ATOM 1359 CA PHE B 679 -4.159 17.332 -26.706 1.00 0.00 C ATOM 1360 C PHE B 679 -3.737 18.397 -25.671 1.00 0.00 C ATOM 1361 O PHE B 679 -2.760 19.120 -25.890 1.00 0.00 O ATOM 1362 CB PHE B 679 -2.990 16.756 -27.524 1.00 0.00 C ATOM 1363 CG PHE B 679 -3.303 15.448 -28.237 1.00 0.00 C ATOM 1364 CD1 PHE B 679 -3.232 14.212 -27.559 1.00 0.00 C ATOM 1365 CD2 PHE B 679 -3.650 15.460 -29.603 1.00 0.00 C ATOM 1366 CE1 PHE B 679 -3.512 13.011 -28.226 1.00 0.00 C ATOM 1367 CE2 PHE B 679 -3.913 14.256 -30.278 1.00 0.00 C ATOM 1368 CZ PHE B 679 -3.838 13.030 -29.594 1.00 0.00 C ATOM 0 H PHE B 679 -4.748 18.789 -28.052 1.00 0.00 H new ATOM 0 HA PHE B 679 -4.579 16.483 -26.167 1.00 0.00 H new ATOM 0 HB2 PHE B 679 -2.683 17.494 -28.265 1.00 0.00 H new ATOM 0 HB3 PHE B 679 -2.141 16.599 -26.859 1.00 0.00 H new ATOM 0 HD1 PHE B 679 -2.959 14.191 -26.514 1.00 0.00 H new ATOM 0 HD2 PHE B 679 -3.714 16.399 -30.133 1.00 0.00 H new ATOM 0 HE1 PHE B 679 -3.477 12.074 -27.691 1.00 0.00 H new ATOM 0 HE2 PHE B 679 -4.174 14.272 -31.326 1.00 0.00 H new ATOM 0 HZ PHE B 679 -4.030 12.105 -30.118 1.00 0.00 H new ATOM 1378 N PRO B 680 -4.537 18.589 -24.601 1.00 0.00 N ATOM 1379 CA PRO B 680 -4.322 19.596 -23.558 1.00 0.00 C ATOM 1380 C PRO B 680 -3.153 19.211 -22.639 1.00 0.00 C ATOM 1381 O PRO B 680 -2.550 18.147 -22.783 1.00 0.00 O ATOM 1382 CB PRO B 680 -5.643 19.608 -22.772 1.00 0.00 C ATOM 1383 CG PRO B 680 -6.033 18.132 -22.830 1.00 0.00 C ATOM 1384 CD PRO B 680 -5.719 17.801 -24.282 1.00 0.00 C ATOM 0 HA PRO B 680 -4.065 20.570 -23.975 1.00 0.00 H new ATOM 0 HB2 PRO B 680 -5.510 19.959 -21.749 1.00 0.00 H new ATOM 0 HB3 PRO B 680 -6.392 20.251 -23.235 1.00 0.00 H new ATOM 0 HG2 PRO B 680 -5.453 17.525 -22.135 1.00 0.00 H new ATOM 0 HG3 PRO B 680 -7.084 17.974 -22.590 1.00 0.00 H new ATOM 0 HD2 PRO B 680 -5.530 16.735 -24.412 1.00 0.00 H new ATOM 0 HD3 PRO B 680 -6.553 18.059 -24.935 1.00 0.00 H new ATOM 1392 N SER B 681 -2.936 19.997 -21.581 1.00 0.00 N ATOM 1393 CA SER B 681 -2.029 19.726 -20.461 1.00 0.00 C ATOM 1394 C SER B 681 -2.427 18.493 -19.613 1.00 0.00 C ATOM 1395 O SER B 681 -2.007 18.379 -18.458 1.00 0.00 O ATOM 1396 CB SER B 681 -1.944 21.000 -19.597 1.00 0.00 C ATOM 1397 OG SER B 681 -1.745 22.155 -20.409 1.00 0.00 O ATOM 0 H SER B 681 -3.416 20.891 -21.477 1.00 0.00 H new ATOM 0 HA SER B 681 -1.052 19.470 -20.871 1.00 0.00 H new ATOM 0 HB2 SER B 681 -2.860 21.112 -19.017 1.00 0.00 H new ATOM 0 HB3 SER B 681 -1.125 20.906 -18.884 1.00 0.00 H new ATOM 0 HG SER B 681 -1.696 22.951 -19.839 1.00 0.00 H new ATOM 1403 N ASP B 682 -3.207 17.559 -20.170 1.00 0.00 N ATOM 1404 CA ASP B 682 -3.603 16.303 -19.533 1.00 0.00 C ATOM 1405 C ASP B 682 -3.491 15.098 -20.465 1.00 0.00 C ATOM 1406 O ASP B 682 -3.363 13.969 -19.985 1.00 0.00 O ATOM 1407 CB ASP B 682 -5.041 16.381 -19.029 1.00 0.00 C ATOM 1408 CG ASP B 682 -5.220 17.351 -17.851 1.00 0.00 C ATOM 1409 OD1 ASP B 682 -5.050 16.918 -16.687 1.00 0.00 O ATOM 1410 OD2 ASP B 682 -5.563 18.532 -18.091 1.00 0.00 O ATOM 0 H ASP B 682 -3.592 17.663 -21.109 1.00 0.00 H new ATOM 0 HA ASP B 682 -2.909 16.163 -18.704 1.00 0.00 H new ATOM 0 HB2 ASP B 682 -5.689 16.692 -19.848 1.00 0.00 H new ATOM 0 HB3 ASP B 682 -5.366 15.386 -18.724 1.00 0.00 H new ATOM 1415 N ILE B 683 -3.536 15.291 -21.791 1.00 0.00 N ATOM 1416 CA ILE B 683 -3.442 14.230 -22.781 1.00 0.00 C ATOM 1417 C ILE B 683 -2.518 14.750 -23.893 1.00 0.00 C ATOM 1418 O ILE B 683 -2.801 15.807 -24.443 1.00 0.00 O ATOM 1419 CB ILE B 683 -4.850 13.847 -23.314 1.00 0.00 C ATOM 1420 CG1 ILE B 683 -5.795 13.108 -22.338 1.00 0.00 C ATOM 1421 CG2 ILE B 683 -4.713 12.946 -24.554 1.00 0.00 C ATOM 1422 CD1 ILE B 683 -6.284 13.830 -21.089 1.00 0.00 C ATOM 0 H ILE B 683 -3.642 16.217 -22.206 1.00 0.00 H new ATOM 0 HA ILE B 683 -3.031 13.316 -22.352 1.00 0.00 H new ATOM 0 HB ILE B 683 -5.306 14.817 -23.514 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -6.674 12.798 -22.903 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -5.287 12.199 -22.014 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -5.704 12.681 -24.923 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -4.167 13.479 -25.332 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -4.171 12.039 -24.287 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -6.936 13.169 -20.518 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -5.429 14.115 -20.476 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -6.837 14.723 -21.378 1.00 0.00 H new ATOM 1434 N ASP B 684 -1.454 14.027 -24.258 1.00 0.00 N ATOM 1435 CA ASP B 684 -0.490 14.386 -25.307 1.00 0.00 C ATOM 1436 C ASP B 684 -0.215 13.145 -26.182 1.00 0.00 C ATOM 1437 O ASP B 684 -0.365 12.020 -25.684 1.00 0.00 O ATOM 1438 CB ASP B 684 0.792 14.934 -24.671 1.00 0.00 C ATOM 1439 CG ASP B 684 1.773 15.483 -25.715 1.00 0.00 C ATOM 1440 OD1 ASP B 684 1.603 16.655 -26.124 1.00 0.00 O ATOM 1441 OD2 ASP B 684 2.727 14.772 -26.108 1.00 0.00 O ATOM 0 H ASP B 684 -1.230 13.137 -23.812 1.00 0.00 H new ATOM 0 HA ASP B 684 -0.897 15.170 -25.945 1.00 0.00 H new ATOM 0 HB2 ASP B 684 0.536 15.725 -23.966 1.00 0.00 H new ATOM 0 HB3 ASP B 684 1.278 14.143 -24.100 1.00 0.00 H new ATOM 1446 N PRO B 685 0.098 13.280 -27.491 1.00 0.00 N ATOM 1447 CA PRO B 685 0.165 12.131 -28.384 1.00 0.00 C ATOM 1448 C PRO B 685 1.142 11.025 -27.974 1.00 0.00 C ATOM 1449 O PRO B 685 0.909 9.883 -28.356 1.00 0.00 O ATOM 1450 CB PRO B 685 0.518 12.678 -29.769 1.00 0.00 C ATOM 1451 CG PRO B 685 -0.040 14.094 -29.731 1.00 0.00 C ATOM 1452 CD PRO B 685 0.187 14.503 -28.277 1.00 0.00 C ATOM 0 HA PRO B 685 -0.803 11.632 -28.355 1.00 0.00 H new ATOM 0 HB2 PRO B 685 1.594 12.673 -29.943 1.00 0.00 H new ATOM 0 HB3 PRO B 685 0.064 12.087 -30.564 1.00 0.00 H new ATOM 0 HG2 PRO B 685 0.482 14.754 -30.424 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -1.096 14.121 -29.999 1.00 0.00 H new ATOM 0 HD2 PRO B 685 1.162 14.975 -28.153 1.00 0.00 H new ATOM 0 HD3 PRO B 685 -0.561 15.228 -27.955 1.00 0.00 H new ATOM 1460 N GLN B 686 2.221 11.293 -27.229 1.00 0.00 N ATOM 1461 CA GLN B 686 3.236 10.275 -26.978 1.00 0.00 C ATOM 1462 C GLN B 686 2.662 9.111 -26.159 1.00 0.00 C ATOM 1463 O GLN B 686 2.770 7.967 -26.605 1.00 0.00 O ATOM 1464 CB GLN B 686 4.557 10.875 -26.443 1.00 0.00 C ATOM 1465 CG GLN B 686 4.799 10.861 -24.923 1.00 0.00 C ATOM 1466 CD GLN B 686 3.861 11.746 -24.103 1.00 0.00 C ATOM 1467 OE1 GLN B 686 2.758 12.077 -24.511 1.00 0.00 O ATOM 1468 NE2 GLN B 686 4.224 12.078 -22.878 1.00 0.00 N ATOM 0 H GLN B 686 2.409 12.197 -26.796 1.00 0.00 H new ATOM 0 HA GLN B 686 3.526 9.834 -27.932 1.00 0.00 H new ATOM 0 HB2 GLN B 686 5.381 10.341 -26.916 1.00 0.00 H new ATOM 0 HB3 GLN B 686 4.613 11.910 -26.780 1.00 0.00 H new ATOM 0 HG2 GLN B 686 4.707 9.835 -24.567 1.00 0.00 H new ATOM 0 HG3 GLN B 686 5.826 11.174 -24.732 1.00 0.00 H new ATOM 0 HE21 GLN B 686 5.143 11.807 -22.527 1.00 0.00 H new ATOM 0 HE22 GLN B 686 3.586 12.606 -22.282 1.00 0.00 H new ATOM 1477 N VAL B 687 2.006 9.351 -25.008 1.00 0.00 N ATOM 1478 CA VAL B 687 1.378 8.283 -24.255 1.00 0.00 C ATOM 1479 C VAL B 687 0.309 7.639 -25.130 1.00 0.00 C ATOM 1480 O VAL B 687 0.126 6.429 -25.051 1.00 0.00 O ATOM 1481 CB VAL B 687 0.785 8.834 -22.955 1.00 0.00 C ATOM 1482 CG1 VAL B 687 0.431 7.683 -22.007 1.00 0.00 C ATOM 1483 CG2 VAL B 687 1.739 9.792 -22.224 1.00 0.00 C ATOM 0 H VAL B 687 1.905 10.277 -24.592 1.00 0.00 H new ATOM 0 HA VAL B 687 2.113 7.527 -23.981 1.00 0.00 H new ATOM 0 HB VAL B 687 -0.107 9.394 -23.237 1.00 0.00 H new ATOM 0 HG11 VAL B 687 0.010 8.087 -21.086 1.00 0.00 H new ATOM 0 HG12 VAL B 687 -0.300 7.030 -22.484 1.00 0.00 H new ATOM 0 HG13 VAL B 687 1.330 7.113 -21.776 1.00 0.00 H new ATOM 0 HG21 VAL B 687 1.265 10.151 -21.310 1.00 0.00 H new ATOM 0 HG22 VAL B 687 2.660 9.267 -21.973 1.00 0.00 H new ATOM 0 HG23 VAL B 687 1.969 10.639 -22.870 1.00 0.00 H new ATOM 1493 N PHE B 688 -0.362 8.413 -25.986 1.00 0.00 N ATOM 1494 CA PHE B 688 -1.382 7.880 -26.863 1.00 0.00 C ATOM 1495 C PHE B 688 -0.821 6.889 -27.884 1.00 0.00 C ATOM 1496 O PHE B 688 -1.495 5.915 -28.206 1.00 0.00 O ATOM 1497 CB PHE B 688 -2.147 9.004 -27.555 1.00 0.00 C ATOM 1498 CG PHE B 688 -3.477 8.538 -28.095 1.00 0.00 C ATOM 1499 CD1 PHE B 688 -4.436 8.030 -27.206 1.00 0.00 C ATOM 1500 CD2 PHE B 688 -3.774 8.639 -29.463 1.00 0.00 C ATOM 1501 CE1 PHE B 688 -5.721 7.704 -27.654 1.00 0.00 C ATOM 1502 CE2 PHE B 688 -5.057 8.289 -29.923 1.00 0.00 C ATOM 1503 CZ PHE B 688 -6.033 7.847 -29.016 1.00 0.00 C ATOM 0 H PHE B 688 -0.209 9.417 -26.083 1.00 0.00 H new ATOM 0 HA PHE B 688 -2.077 7.323 -26.235 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -2.308 9.819 -26.850 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -1.545 9.403 -28.371 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -4.180 7.889 -26.166 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -3.023 8.983 -30.158 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -6.466 7.346 -26.959 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -5.291 8.361 -30.975 1.00 0.00 H new ATOM 0 HZ PHE B 688 -7.028 7.616 -29.367 1.00 0.00 H new ATOM 1513 N TYR B 689 0.397 7.097 -28.380 1.00 0.00 N ATOM 1514 CA TYR B 689 1.052 6.129 -29.244 1.00 0.00 C ATOM 1515 C TYR B 689 1.546 4.925 -28.442 1.00 0.00 C ATOM 1516 O TYR B 689 1.655 3.829 -28.999 1.00 0.00 O ATOM 1517 CB TYR B 689 2.256 6.781 -29.934 1.00 0.00 C ATOM 1518 CG TYR B 689 1.967 8.014 -30.776 1.00 0.00 C ATOM 1519 CD1 TYR B 689 0.799 8.102 -31.558 1.00 0.00 C ATOM 1520 CD2 TYR B 689 2.900 9.069 -30.797 1.00 0.00 C ATOM 1521 CE1 TYR B 689 0.561 9.236 -32.354 1.00 0.00 C ATOM 1522 CE2 TYR B 689 2.671 10.208 -31.592 1.00 0.00 C ATOM 1523 CZ TYR B 689 1.496 10.299 -32.376 1.00 0.00 C ATOM 1524 OH TYR B 689 1.256 11.395 -33.157 1.00 0.00 O ATOM 0 H TYR B 689 0.950 7.934 -28.194 1.00 0.00 H new ATOM 0 HA TYR B 689 0.325 5.793 -29.984 1.00 0.00 H new ATOM 0 HB2 TYR B 689 2.983 7.053 -29.168 1.00 0.00 H new ATOM 0 HB3 TYR B 689 2.729 6.035 -30.572 1.00 0.00 H new ATOM 0 HD1 TYR B 689 0.082 7.294 -31.546 1.00 0.00 H new ATOM 0 HD2 TYR B 689 3.797 9.004 -30.199 1.00 0.00 H new ATOM 0 HE1 TYR B 689 -0.337 9.297 -32.950 1.00 0.00 H new ATOM 0 HE2 TYR B 689 3.392 11.012 -31.604 1.00 0.00 H new ATOM 0 HH TYR B 689 1.992 12.034 -33.059 1.00 0.00 H new ATOM 1534 N GLU B 690 1.851 5.116 -27.158 1.00 0.00 N ATOM 1535 CA GLU B 690 2.550 4.134 -26.345 1.00 0.00 C ATOM 1536 C GLU B 690 1.604 3.168 -25.626 1.00 0.00 C ATOM 1537 O GLU B 690 1.908 1.972 -25.567 1.00 0.00 O ATOM 1538 CB GLU B 690 3.462 4.924 -25.374 1.00 0.00 C ATOM 1539 CG GLU B 690 3.629 4.331 -23.975 1.00 0.00 C ATOM 1540 CD GLU B 690 4.502 5.230 -23.084 1.00 0.00 C ATOM 1541 OE1 GLU B 690 3.942 6.127 -22.408 1.00 0.00 O ATOM 1542 OE2 GLU B 690 5.739 5.042 -23.027 1.00 0.00 O ATOM 0 H GLU B 690 1.614 5.969 -26.652 1.00 0.00 H new ATOM 0 HA GLU B 690 3.150 3.481 -26.978 1.00 0.00 H new ATOM 0 HB2 GLU B 690 4.449 5.015 -25.828 1.00 0.00 H new ATOM 0 HB3 GLU B 690 3.063 5.933 -25.273 1.00 0.00 H new ATOM 0 HG2 GLU B 690 2.650 4.201 -23.514 1.00 0.00 H new ATOM 0 HG3 GLU B 690 4.080 3.342 -24.049 1.00 0.00 H new ATOM 1549 N LEU B 691 0.480 3.648 -25.077 1.00 0.00 N ATOM 1550 CA LEU B 691 -0.513 2.757 -24.494 1.00 0.00 C ATOM 1551 C LEU B 691 -1.105 1.901 -25.612 1.00 0.00 C ATOM 1552 O LEU B 691 -1.088 2.304 -26.775 1.00 0.00 O ATOM 1553 CB LEU B 691 -1.543 3.507 -23.619 1.00 0.00 C ATOM 1554 CG LEU B 691 -2.869 3.947 -24.260 1.00 0.00 C ATOM 1555 CD1 LEU B 691 -3.815 4.435 -23.159 1.00 0.00 C ATOM 1556 CD2 LEU B 691 -2.693 5.095 -25.230 1.00 0.00 C ATOM 0 H LEU B 691 0.244 4.639 -25.028 1.00 0.00 H new ATOM 0 HA LEU B 691 -0.044 2.080 -23.780 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -1.782 2.869 -22.768 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -1.055 4.397 -23.223 1.00 0.00 H new ATOM 0 HG LEU B 691 -3.263 3.085 -24.799 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -4.759 4.750 -23.604 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -3.999 3.626 -22.452 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -3.361 5.277 -22.637 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -3.660 5.365 -25.653 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -2.274 5.954 -24.705 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -2.018 4.794 -26.031 1.00 0.00 H new ATOM 1568 N ALA B 692 -1.612 0.727 -25.226 1.00 0.00 N ATOM 1569 CA ALA B 692 -2.027 -0.352 -26.125 1.00 0.00 C ATOM 1570 C ALA B 692 -2.639 0.134 -27.429 1.00 0.00 C ATOM 1571 O ALA B 692 -3.537 0.974 -27.419 1.00 0.00 O ATOM 1572 CB ALA B 692 -3.004 -1.266 -25.382 1.00 0.00 C ATOM 0 H ALA B 692 -1.750 0.494 -24.243 1.00 0.00 H new ATOM 0 HA ALA B 692 -1.128 -0.897 -26.412 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -3.320 -2.074 -26.042 1.00 0.00 H new ATOM 0 HB2 ALA B 692 -2.513 -1.686 -24.504 1.00 0.00 H new ATOM 0 HB3 ALA B 692 -3.875 -0.690 -25.070 1.00 0.00 H new ATOM 1578 N GLU B 693 -2.203 -0.440 -28.548 1.00 0.00 N ATOM 1579 CA GLU B 693 -2.707 -0.076 -29.869 1.00 0.00 C ATOM 1580 C GLU B 693 -4.213 -0.228 -29.909 1.00 0.00 C ATOM 1581 O GLU B 693 -4.920 0.684 -30.320 1.00 0.00 O ATOM 1582 CB GLU B 693 -2.076 -0.951 -30.945 1.00 0.00 C ATOM 1583 CG GLU B 693 -0.609 -0.543 -31.171 1.00 0.00 C ATOM 1584 CD GLU B 693 0.064 -1.433 -32.234 1.00 0.00 C ATOM 1585 OE1 GLU B 693 0.646 -2.484 -31.868 1.00 0.00 O ATOM 1586 OE2 GLU B 693 0.027 -1.085 -33.439 1.00 0.00 O ATOM 0 H GLU B 693 -1.491 -1.170 -28.564 1.00 0.00 H new ATOM 0 HA GLU B 693 -2.442 0.963 -30.063 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -2.128 -1.999 -30.648 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -2.635 -0.855 -31.876 1.00 0.00 H new ATOM 0 HG2 GLU B 693 -0.564 0.500 -31.486 1.00 0.00 H new ATOM 0 HG3 GLU B 693 -0.060 -0.617 -30.232 1.00 0.00 H new ATOM 1593 N ALA B 694 -4.722 -1.340 -29.384 1.00 0.00 N ATOM 1594 CA ALA B 694 -6.149 -1.580 -29.429 1.00 0.00 C ATOM 1595 C ALA B 694 -6.920 -0.493 -28.650 1.00 0.00 C ATOM 1596 O ALA B 694 -8.034 -0.133 -29.033 1.00 0.00 O ATOM 1597 CB ALA B 694 -6.433 -2.978 -28.882 1.00 0.00 C ATOM 0 H ALA B 694 -4.174 -2.072 -28.932 1.00 0.00 H new ATOM 0 HA ALA B 694 -6.496 -1.528 -30.461 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -7.506 -3.169 -28.911 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -5.915 -3.719 -29.491 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -6.081 -3.044 -27.853 1.00 0.00 H new ATOM 1603 N VAL B 695 -6.310 0.073 -27.599 1.00 0.00 N ATOM 1604 CA VAL B 695 -6.907 1.151 -26.812 1.00 0.00 C ATOM 1605 C VAL B 695 -6.809 2.446 -27.603 1.00 0.00 C ATOM 1606 O VAL B 695 -7.801 3.164 -27.687 1.00 0.00 O ATOM 1607 CB VAL B 695 -6.208 1.239 -25.432 1.00 0.00 C ATOM 1608 CG1 VAL B 695 -6.350 2.595 -24.734 1.00 0.00 C ATOM 1609 CG2 VAL B 695 -6.760 0.175 -24.482 1.00 0.00 C ATOM 0 H VAL B 695 -5.385 -0.208 -27.273 1.00 0.00 H new ATOM 0 HA VAL B 695 -7.962 0.956 -26.620 1.00 0.00 H new ATOM 0 HB VAL B 695 -5.151 1.084 -25.649 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -5.831 2.567 -23.776 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -5.915 3.374 -25.360 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -7.406 2.810 -24.569 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -6.257 0.252 -23.518 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -7.831 0.329 -24.346 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -6.586 -0.815 -24.904 1.00 0.00 H new ATOM 1619 N GLN B 696 -5.649 2.768 -28.182 1.00 0.00 N ATOM 1620 CA GLN B 696 -5.484 4.038 -28.873 1.00 0.00 C ATOM 1621 C GLN B 696 -6.385 4.089 -30.111 1.00 0.00 C ATOM 1622 O GLN B 696 -6.967 5.130 -30.378 1.00 0.00 O ATOM 1623 CB GLN B 696 -3.996 4.333 -29.130 1.00 0.00 C ATOM 1624 CG GLN B 696 -3.396 3.744 -30.413 1.00 0.00 C ATOM 1625 CD GLN B 696 -1.863 3.794 -30.440 1.00 0.00 C ATOM 1626 OE1 GLN B 696 -1.272 4.382 -31.342 1.00 0.00 O ATOM 1627 NE2 GLN B 696 -1.183 3.135 -29.513 1.00 0.00 N ATOM 0 H GLN B 696 -4.822 2.171 -28.184 1.00 0.00 H new ATOM 0 HA GLN B 696 -5.820 4.859 -28.239 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -3.861 5.414 -29.155 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -3.422 3.960 -28.282 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -3.721 2.709 -30.517 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -3.786 4.289 -31.273 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -1.679 2.648 -28.766 1.00 0.00 H new ATOM 0 HE22 GLN B 696 -0.164 3.114 -29.546 1.00 0.00 H new ATOM 1636 N LYS B 697 -6.597 2.969 -30.817 1.00 0.00 N ATOM 1637 CA LYS B 697 -7.541 2.905 -31.938 1.00 0.00 C ATOM 1638 C LYS B 697 -8.966 3.128 -31.447 1.00 0.00 C ATOM 1639 O LYS B 697 -9.683 3.952 -32.014 1.00 0.00 O ATOM 1640 CB LYS B 697 -7.447 1.540 -32.641 1.00 0.00 C ATOM 1641 CG LYS B 697 -6.101 1.293 -33.333 1.00 0.00 C ATOM 1642 CD LYS B 697 -5.750 2.263 -34.477 1.00 0.00 C ATOM 1643 CE LYS B 697 -6.778 2.335 -35.625 1.00 0.00 C ATOM 1644 NZ LYS B 697 -6.881 1.069 -36.402 1.00 0.00 N ATOM 0 H LYS B 697 -6.121 2.087 -30.627 1.00 0.00 H new ATOM 0 HA LYS B 697 -7.281 3.691 -32.647 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -7.619 0.752 -31.908 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -8.244 1.467 -33.381 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -5.312 1.345 -32.582 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -6.098 0.277 -33.729 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -5.628 3.262 -34.058 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -4.786 1.972 -34.894 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -7.757 2.581 -35.213 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -6.503 3.146 -36.299 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -7.587 1.182 -37.157 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -5.957 0.844 -36.823 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -7.171 0.296 -35.770 1.00 0.00 H new ATOM 1658 N GLU B 698 -9.365 2.417 -30.393 1.00 0.00 N ATOM 1659 CA GLU B 698 -10.720 2.526 -29.843 1.00 0.00 C ATOM 1660 C GLU B 698 -10.994 3.969 -29.390 1.00 0.00 C ATOM 1661 O GLU B 698 -12.040 4.544 -29.696 1.00 0.00 O ATOM 1662 CB GLU B 698 -10.886 1.528 -28.686 1.00 0.00 C ATOM 1663 CG GLU B 698 -12.309 1.525 -28.108 1.00 0.00 C ATOM 1664 CD GLU B 698 -12.414 0.580 -26.901 1.00 0.00 C ATOM 1665 OE1 GLU B 698 -12.167 1.043 -25.761 1.00 0.00 O ATOM 1666 OE2 GLU B 698 -12.774 -0.609 -27.077 1.00 0.00 O ATOM 0 H GLU B 698 -8.767 1.755 -29.899 1.00 0.00 H new ATOM 0 HA GLU B 698 -11.451 2.280 -30.613 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -10.638 0.526 -29.037 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -10.177 1.773 -27.895 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -12.585 2.536 -27.807 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -13.017 1.217 -28.878 1.00 0.00 H new ATOM 1673 N LEU B 699 -10.021 4.571 -28.700 1.00 0.00 N ATOM 1674 CA LEU B 699 -10.095 5.943 -28.212 1.00 0.00 C ATOM 1675 C LEU B 699 -10.171 6.899 -29.374 1.00 0.00 C ATOM 1676 O LEU B 699 -11.032 7.752 -29.372 1.00 0.00 O ATOM 1677 CB LEU B 699 -8.853 6.299 -27.388 1.00 0.00 C ATOM 1678 CG LEU B 699 -8.955 5.832 -25.941 1.00 0.00 C ATOM 1679 CD1 LEU B 699 -7.561 5.720 -25.308 1.00 0.00 C ATOM 1680 CD2 LEU B 699 -9.802 6.821 -25.122 1.00 0.00 C ATOM 0 H LEU B 699 -9.145 4.106 -28.463 1.00 0.00 H new ATOM 0 HA LEU B 699 -10.985 6.024 -27.588 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -7.974 5.849 -27.850 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -8.706 7.379 -27.408 1.00 0.00 H new ATOM 0 HG LEU B 699 -9.430 4.851 -25.936 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -7.656 5.385 -24.275 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -6.963 5.001 -25.869 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -7.072 6.694 -25.330 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -9.867 6.476 -24.090 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -9.336 7.806 -25.147 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -10.803 6.882 -25.548 1.00 0.00 H new ATOM 1692 N LEU B 700 -9.292 6.763 -30.362 1.00 0.00 N ATOM 1693 CA LEU B 700 -9.223 7.661 -31.502 1.00 0.00 C ATOM 1694 C LEU B 700 -10.544 7.686 -32.256 1.00 0.00 C ATOM 1695 O LEU B 700 -11.005 8.754 -32.650 1.00 0.00 O ATOM 1696 CB LEU B 700 -8.084 7.171 -32.399 1.00 0.00 C ATOM 1697 CG LEU B 700 -7.875 7.958 -33.702 1.00 0.00 C ATOM 1698 CD1 LEU B 700 -7.620 9.444 -33.425 1.00 0.00 C ATOM 1699 CD2 LEU B 700 -6.678 7.352 -34.437 1.00 0.00 C ATOM 0 H LEU B 700 -8.600 6.015 -30.390 1.00 0.00 H new ATOM 0 HA LEU B 700 -9.033 8.683 -31.173 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -7.157 7.200 -31.826 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -8.269 6.127 -32.653 1.00 0.00 H new ATOM 0 HG LEU B 700 -8.777 7.890 -34.310 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -7.476 9.971 -34.369 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -8.475 9.868 -32.899 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -6.726 9.551 -32.810 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -6.509 7.895 -35.367 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -5.790 7.424 -33.808 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -6.880 6.304 -34.660 1.00 0.00 H new ATOM 1711 N ALA B 701 -11.165 6.517 -32.425 1.00 0.00 N ATOM 1712 CA ALA B 701 -12.498 6.427 -32.997 1.00 0.00 C ATOM 1713 C ALA B 701 -13.477 7.237 -32.151 1.00 0.00 C ATOM 1714 O ALA B 701 -14.218 8.041 -32.706 1.00 0.00 O ATOM 1715 CB ALA B 701 -12.932 4.963 -33.127 1.00 0.00 C ATOM 0 H ALA B 701 -10.758 5.617 -32.170 1.00 0.00 H new ATOM 0 HA ALA B 701 -12.489 6.849 -34.002 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -13.932 4.917 -33.557 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -12.234 4.433 -33.775 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -12.939 4.497 -32.142 1.00 0.00 H new ATOM 1721 N GLU B 702 -13.446 7.104 -30.822 1.00 0.00 N ATOM 1722 CA GLU B 702 -14.256 7.917 -29.922 1.00 0.00 C ATOM 1723 C GLU B 702 -13.973 9.400 -30.157 1.00 0.00 C ATOM 1724 O GLU B 702 -14.876 10.186 -30.436 1.00 0.00 O ATOM 1725 CB GLU B 702 -13.991 7.522 -28.454 1.00 0.00 C ATOM 1726 CG GLU B 702 -15.269 7.550 -27.600 1.00 0.00 C ATOM 1727 CD GLU B 702 -16.324 6.520 -28.048 1.00 0.00 C ATOM 1728 OE1 GLU B 702 -16.195 5.320 -27.713 1.00 0.00 O ATOM 1729 OE2 GLU B 702 -17.297 6.918 -28.736 1.00 0.00 O ATOM 0 H GLU B 702 -12.855 6.425 -30.342 1.00 0.00 H new ATOM 0 HA GLU B 702 -15.310 7.735 -30.130 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -13.558 6.522 -28.422 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -13.255 8.202 -28.025 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -15.006 7.361 -26.559 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -15.705 8.548 -27.643 1.00 0.00 H new ATOM 1736 N TRP B 703 -12.707 9.801 -30.119 1.00 0.00 N ATOM 1737 CA TRP B 703 -12.304 11.189 -30.140 1.00 0.00 C ATOM 1738 C TRP B 703 -12.704 11.867 -31.463 1.00 0.00 C ATOM 1739 O TRP B 703 -13.032 13.051 -31.471 1.00 0.00 O ATOM 1740 CB TRP B 703 -10.789 11.233 -29.878 1.00 0.00 C ATOM 1741 CG TRP B 703 -10.222 10.600 -28.622 1.00 0.00 C ATOM 1742 CD1 TRP B 703 -10.877 10.098 -27.547 1.00 0.00 C ATOM 1743 CD2 TRP B 703 -8.820 10.538 -28.243 1.00 0.00 C ATOM 1744 NE1 TRP B 703 -9.993 9.763 -26.541 1.00 0.00 N ATOM 1745 CE2 TRP B 703 -8.717 10.094 -26.897 1.00 0.00 C ATOM 1746 CE3 TRP B 703 -7.634 10.901 -28.889 1.00 0.00 C ATOM 1747 CZ2 TRP B 703 -7.531 10.134 -26.169 1.00 0.00 C ATOM 1748 CZ3 TRP B 703 -6.417 10.925 -28.180 1.00 0.00 C ATOM 1749 CH2 TRP B 703 -6.370 10.578 -26.815 1.00 0.00 C ATOM 0 H TRP B 703 -11.922 9.152 -30.072 1.00 0.00 H new ATOM 0 HA TRP B 703 -12.818 11.755 -29.363 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -10.298 10.762 -30.729 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -10.490 12.281 -29.877 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -11.948 9.976 -27.486 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -10.256 9.329 -25.656 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -7.651 11.164 -29.936 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -7.507 9.831 -25.133 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -5.509 11.213 -28.689 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -5.442 10.654 -26.269 1.00 0.00 H new ATOM 1760 N LYS B 704 -12.753 11.117 -32.572 1.00 0.00 N ATOM 1761 CA LYS B 704 -13.120 11.634 -33.889 1.00 0.00 C ATOM 1762 C LYS B 704 -14.617 11.504 -34.168 1.00 0.00 C ATOM 1763 O LYS B 704 -15.148 12.305 -34.936 1.00 0.00 O ATOM 1764 CB LYS B 704 -12.274 10.965 -34.997 1.00 0.00 C ATOM 1765 CG LYS B 704 -12.827 9.642 -35.558 1.00 0.00 C ATOM 1766 CD LYS B 704 -11.898 9.052 -36.630 1.00 0.00 C ATOM 1767 CE LYS B 704 -12.549 7.816 -37.279 1.00 0.00 C ATOM 1768 NZ LYS B 704 -11.740 7.276 -38.410 1.00 0.00 N ATOM 0 H LYS B 704 -12.535 10.121 -32.575 1.00 0.00 H new ATOM 0 HA LYS B 704 -12.898 12.701 -33.891 1.00 0.00 H new ATOM 0 HB2 LYS B 704 -12.167 11.670 -35.821 1.00 0.00 H new ATOM 0 HB3 LYS B 704 -11.275 10.781 -34.603 1.00 0.00 H new ATOM 0 HG2 LYS B 704 -12.949 8.925 -34.747 1.00 0.00 H new ATOM 0 HG3 LYS B 704 -13.815 9.812 -35.985 1.00 0.00 H new ATOM 0 HD2 LYS B 704 -11.687 9.803 -37.392 1.00 0.00 H new ATOM 0 HD3 LYS B 704 -10.943 8.776 -36.182 1.00 0.00 H new ATOM 0 HE2 LYS B 704 -12.679 7.039 -36.525 1.00 0.00 H new ATOM 0 HE3 LYS B 704 -13.543 8.080 -37.640 1.00 0.00 H new ATOM 0 HZ1 LYS B 704 -12.219 6.446 -38.814 1.00 0.00 H new ATOM 0 HZ2 LYS B 704 -11.637 8.007 -39.143 1.00 0.00 H new ATOM 0 HZ3 LYS B 704 -10.800 6.999 -38.063 1.00 0.00 H new ATOM 1782 N ARG B 705 -15.309 10.518 -33.582 1.00 0.00 N ATOM 1783 CA ARG B 705 -16.719 10.244 -33.933 1.00 0.00 C ATOM 1784 C ARG B 705 -17.637 11.190 -33.174 1.00 0.00 C ATOM 1785 O ARG B 705 -18.687 11.578 -33.682 1.00 0.00 O ATOM 1786 CB ARG B 705 -17.098 8.762 -33.741 1.00 0.00 C ATOM 1787 CG ARG B 705 -17.231 8.311 -32.277 1.00 0.00 C ATOM 1788 CD ARG B 705 -17.117 6.787 -32.137 1.00 0.00 C ATOM 1789 NE ARG B 705 -18.362 6.104 -32.528 1.00 0.00 N ATOM 1790 CZ ARG B 705 -19.378 5.772 -31.715 1.00 0.00 C ATOM 1791 NH1 ARG B 705 -19.329 6.012 -30.407 1.00 0.00 N ATOM 1792 NH2 ARG B 705 -20.458 5.196 -32.234 1.00 0.00 N ATOM 0 H ARG B 705 -14.925 9.899 -32.868 1.00 0.00 H new ATOM 0 HA ARG B 705 -16.848 10.435 -34.998 1.00 0.00 H new ATOM 0 HB2 ARG B 705 -18.043 8.575 -34.251 1.00 0.00 H new ATOM 0 HB3 ARG B 705 -16.345 8.143 -34.229 1.00 0.00 H new ATOM 0 HG2 ARG B 705 -16.457 8.790 -31.677 1.00 0.00 H new ATOM 0 HG3 ARG B 705 -18.191 8.642 -31.881 1.00 0.00 H new ATOM 0 HD2 ARG B 705 -16.295 6.426 -32.756 1.00 0.00 H new ATOM 0 HD3 ARG B 705 -16.873 6.535 -31.105 1.00 0.00 H new ATOM 0 HE ARG B 705 -18.462 5.859 -33.513 1.00 0.00 H new ATOM 0 HH11 ARG B 705 -18.506 6.458 -30.001 1.00 0.00 H new ATOM 0 HH12 ARG B 705 -20.114 5.750 -29.811 1.00 0.00 H new ATOM 0 HH21 ARG B 705 -20.506 5.012 -33.236 1.00 0.00 H new ATOM 0 HH22 ARG B 705 -21.238 4.938 -31.630 1.00 0.00 H new ATOM 1806 N THR B 706 -17.212 11.582 -31.973 1.00 0.00 N ATOM 1807 CA THR B 706 -17.838 12.651 -31.215 1.00 0.00 C ATOM 1808 C THR B 706 -17.713 13.950 -32.013 1.00 0.00 C ATOM 1809 O THR B 706 -18.609 14.796 -31.985 1.00 0.00 O ATOM 1810 CB THR B 706 -17.143 12.764 -29.857 1.00 0.00 C ATOM 1811 OG1 THR B 706 -15.747 12.906 -30.050 1.00 0.00 O ATOM 1812 CG2 THR B 706 -17.400 11.503 -29.042 1.00 0.00 C ATOM 0 H THR B 706 -16.414 11.158 -31.499 1.00 0.00 H new ATOM 0 HA THR B 706 -18.895 12.447 -31.045 1.00 0.00 H new ATOM 0 HB THR B 706 -17.536 13.632 -29.327 1.00 0.00 H new ATOM 0 HG1 THR B 706 -15.331 12.020 -30.096 1.00 0.00 H new ATOM 0 HG21 THR B 706 -16.903 11.587 -28.075 1.00 0.00 H new ATOM 0 HG22 THR B 706 -18.472 11.380 -28.890 1.00 0.00 H new ATOM 0 HG23 THR B 706 -17.008 10.638 -29.577 1.00 0.00 H new ATOM 1820 N GLY B 707 -16.612 14.079 -32.763 1.00 0.00 N ATOM 1821 CA GLY B 707 -16.379 15.191 -33.663 1.00 0.00 C ATOM 1822 C GLY B 707 -15.779 16.399 -32.940 1.00 0.00 C ATOM 1823 O GLY B 707 -15.650 17.471 -33.538 1.00 0.00 O ATOM 0 H GLY B 707 -15.853 13.398 -32.754 1.00 0.00 H new ATOM 0 HA2 GLY B 707 -15.707 14.876 -34.462 1.00 0.00 H new ATOM 0 HA3 GLY B 707 -17.319 15.480 -34.133 1.00 0.00 H new ATOM 1827 N SER B 708 -15.430 16.234 -31.660 1.00 0.00 N ATOM 1828 CA SER B 708 -14.812 17.256 -30.835 1.00 0.00 C ATOM 1829 C SER B 708 -14.076 16.661 -29.627 1.00 0.00 C ATOM 1830 O SER B 708 -13.623 17.426 -28.776 1.00 0.00 O ATOM 1831 CB SER B 708 -15.906 18.230 -30.374 1.00 0.00 C ATOM 1832 OG SER B 708 -16.943 17.524 -29.693 1.00 0.00 O ATOM 0 H SER B 708 -15.578 15.356 -31.162 1.00 0.00 H new ATOM 0 HA SER B 708 -14.060 17.778 -31.427 1.00 0.00 H new ATOM 0 HB2 SER B 708 -15.477 18.984 -29.715 1.00 0.00 H new ATOM 0 HB3 SER B 708 -16.319 18.757 -31.234 1.00 0.00 H new ATOM 0 HG SER B 708 -17.633 18.156 -29.403 1.00 0.00 H new ATOM 1838 N ASP B 709 -13.983 15.324 -29.527 1.00 0.00 N ATOM 1839 CA ASP B 709 -13.518 14.574 -28.352 1.00 0.00 C ATOM 1840 C ASP B 709 -14.282 14.880 -27.043 1.00 0.00 C ATOM 1841 O ASP B 709 -13.934 14.363 -25.979 1.00 0.00 O ATOM 1842 CB ASP B 709 -11.988 14.621 -28.205 1.00 0.00 C ATOM 1843 CG ASP B 709 -11.368 15.892 -27.550 1.00 0.00 C ATOM 1844 OD1 ASP B 709 -11.864 16.431 -26.524 1.00 0.00 O ATOM 1845 OD2 ASP B 709 -10.290 16.306 -28.047 1.00 0.00 O ATOM 0 H ASP B 709 -14.242 14.710 -30.299 1.00 0.00 H new ATOM 0 HA ASP B 709 -13.777 13.535 -28.553 1.00 0.00 H new ATOM 0 HB2 ASP B 709 -11.679 13.756 -27.619 1.00 0.00 H new ATOM 0 HB3 ASP B 709 -11.551 14.506 -29.197 1.00 0.00 H new ATOM 1850 N PHE B 710 -15.391 15.620 -27.141 1.00 0.00 N ATOM 1851 CA PHE B 710 -16.180 16.224 -26.083 1.00 0.00 C ATOM 1852 C PHE B 710 -15.362 17.084 -25.108 1.00 0.00 C ATOM 1853 O PHE B 710 -15.456 18.315 -25.173 1.00 0.00 O ATOM 1854 CB PHE B 710 -16.983 15.173 -25.312 1.00 0.00 C ATOM 1855 CG PHE B 710 -17.972 14.291 -26.043 1.00 0.00 C ATOM 1856 CD1 PHE B 710 -18.959 14.828 -26.892 1.00 0.00 C ATOM 1857 CD2 PHE B 710 -17.979 12.916 -25.746 1.00 0.00 C ATOM 1858 CE1 PHE B 710 -19.953 13.990 -27.432 1.00 0.00 C ATOM 1859 CE2 PHE B 710 -18.970 12.081 -26.280 1.00 0.00 C ATOM 1860 CZ PHE B 710 -19.967 12.619 -27.113 1.00 0.00 C ATOM 0 H PHE B 710 -15.791 15.826 -28.057 1.00 0.00 H new ATOM 0 HA PHE B 710 -16.867 16.900 -26.593 1.00 0.00 H new ATOM 0 HB2 PHE B 710 -16.267 14.517 -24.817 1.00 0.00 H new ATOM 0 HB3 PHE B 710 -17.532 15.695 -24.528 1.00 0.00 H new ATOM 0 HD1 PHE B 710 -18.953 15.882 -27.129 1.00 0.00 H new ATOM 0 HD2 PHE B 710 -17.217 12.502 -25.103 1.00 0.00 H new ATOM 0 HE1 PHE B 710 -20.705 14.399 -28.091 1.00 0.00 H new ATOM 0 HE2 PHE B 710 -18.968 11.025 -26.052 1.00 0.00 H new ATOM 0 HZ PHE B 710 -20.743 11.980 -27.508 1.00 0.00 H new ATOM 1870 N HIS B 711 -14.587 16.465 -24.207 1.00 0.00 N ATOM 1871 CA HIS B 711 -13.946 17.135 -23.074 1.00 0.00 C ATOM 1872 C HIS B 711 -12.654 16.423 -22.657 1.00 0.00 C ATOM 1873 O HIS B 711 -12.485 16.103 -21.480 1.00 0.00 O ATOM 1874 CB HIS B 711 -14.897 17.194 -21.856 1.00 0.00 C ATOM 1875 CG HIS B 711 -16.274 17.760 -22.083 1.00 0.00 C ATOM 1876 ND1 HIS B 711 -16.621 19.117 -22.086 1.00 0.00 N ATOM 1877 CD2 HIS B 711 -17.397 17.009 -22.266 1.00 0.00 C ATOM 1878 CE1 HIS B 711 -17.951 19.143 -22.287 1.00 0.00 C ATOM 1879 NE2 HIS B 711 -18.442 17.894 -22.401 1.00 0.00 N ATOM 0 H HIS B 711 -14.386 15.466 -24.249 1.00 0.00 H new ATOM 0 HA HIS B 711 -13.706 18.147 -23.401 1.00 0.00 H new ATOM 0 HB2 HIS B 711 -15.008 16.183 -21.465 1.00 0.00 H new ATOM 0 HB3 HIS B 711 -14.413 17.785 -21.078 1.00 0.00 H new ATOM 0 HD2 HIS B 711 -17.455 15.931 -22.299 1.00 0.00 H new ATOM 0 HE1 HIS B 711 -18.544 20.043 -22.349 1.00 0.00 H new ATOM 0 HE2 HIS B 711 -19.419 17.647 -22.560 1.00 0.00 H new ATOM 1887 N ILE B 712 -11.755 16.078 -23.576 1.00 0.00 N ATOM 1888 CA ILE B 712 -10.484 15.505 -23.158 1.00 0.00 C ATOM 1889 C ILE B 712 -9.747 16.506 -22.250 1.00 0.00 C ATOM 1890 O ILE B 712 -9.736 17.713 -22.495 1.00 0.00 O ATOM 1891 CB ILE B 712 -9.674 14.978 -24.356 1.00 0.00 C ATOM 1892 CG1 ILE B 712 -10.442 13.781 -24.946 1.00 0.00 C ATOM 1893 CG2 ILE B 712 -8.309 14.470 -23.901 1.00 0.00 C ATOM 1894 CD1 ILE B 712 -9.683 12.960 -25.980 1.00 0.00 C ATOM 0 H ILE B 712 -11.878 16.182 -24.583 1.00 0.00 H new ATOM 0 HA ILE B 712 -10.651 14.614 -22.554 1.00 0.00 H new ATOM 0 HB ILE B 712 -9.538 15.781 -25.081 1.00 0.00 H new ATOM 0 HG12 ILE B 712 -10.736 13.122 -24.129 1.00 0.00 H new ATOM 0 HG13 ILE B 712 -11.360 14.150 -25.404 1.00 0.00 H new ATOM 0 HG21 ILE B 712 -7.752 14.102 -24.763 1.00 0.00 H new ATOM 0 HG22 ILE B 712 -7.756 15.284 -23.432 1.00 0.00 H new ATOM 0 HG23 ILE B 712 -8.443 13.661 -23.183 1.00 0.00 H new ATOM 0 HD11 ILE B 712 -10.314 12.143 -26.330 1.00 0.00 H new ATOM 0 HD12 ILE B 712 -9.412 13.596 -26.822 1.00 0.00 H new ATOM 0 HD13 ILE B 712 -8.779 12.552 -25.528 1.00 0.00 H new ATOM 1906 N GLY B 713 -9.146 15.961 -21.185 1.00 0.00 N ATOM 1907 CA GLY B 713 -8.558 16.724 -20.087 1.00 0.00 C ATOM 1908 C GLY B 713 -9.644 17.489 -19.314 1.00 0.00 C ATOM 1909 O GLY B 713 -9.504 18.687 -19.066 1.00 0.00 O ATOM 0 H GLY B 713 -9.055 14.952 -21.064 1.00 0.00 H new ATOM 0 HA2 GLY B 713 -8.030 16.051 -19.412 1.00 0.00 H new ATOM 0 HA3 GLY B 713 -7.821 17.425 -20.479 1.00 0.00 H new ATOM 1913 N HIS B 714 -10.761 16.808 -19.020 1.00 0.00 N ATOM 1914 CA HIS B 714 -11.951 17.395 -18.404 1.00 0.00 C ATOM 1915 C HIS B 714 -11.622 18.043 -17.050 1.00 0.00 C ATOM 1916 O HIS B 714 -10.854 17.477 -16.268 1.00 0.00 O ATOM 1917 CB HIS B 714 -12.999 16.289 -18.209 1.00 0.00 C ATOM 1918 CG HIS B 714 -14.334 16.768 -17.689 1.00 0.00 C ATOM 1919 ND1 HIS B 714 -15.080 16.129 -16.697 1.00 0.00 N ATOM 1920 CD2 HIS B 714 -15.033 17.855 -18.131 1.00 0.00 C ATOM 1921 CE1 HIS B 714 -16.198 16.858 -16.545 1.00 0.00 C ATOM 1922 NE2 HIS B 714 -16.196 17.900 -17.396 1.00 0.00 N ATOM 0 H HIS B 714 -10.860 15.811 -19.210 1.00 0.00 H new ATOM 0 HA HIS B 714 -12.336 18.176 -19.059 1.00 0.00 H new ATOM 0 HB2 HIS B 714 -13.156 15.784 -19.162 1.00 0.00 H new ATOM 0 HB3 HIS B 714 -12.600 15.547 -17.517 1.00 0.00 H new ATOM 0 HD2 HIS B 714 -14.732 18.545 -18.906 1.00 0.00 H new ATOM 0 HE1 HIS B 714 -16.986 16.639 -15.840 1.00 0.00 H new ATOM 0 HE2 HIS B 714 -16.930 18.603 -17.482 1.00 0.00 H new ATOM 1930 N LYS B 715 -12.231 19.195 -16.758 1.00 0.00 N ATOM 1931 CA LYS B 715 -12.143 19.888 -15.478 1.00 0.00 C ATOM 1932 C LYS B 715 -13.417 20.714 -15.344 1.00 0.00 C ATOM 1933 O LYS B 715 -14.040 20.690 -14.259 1.00 0.00 O ATOM 1934 CB LYS B 715 -10.882 20.770 -15.427 1.00 0.00 C ATOM 1935 CG LYS B 715 -10.667 21.374 -14.028 1.00 0.00 C ATOM 1936 CD LYS B 715 -9.412 22.258 -13.938 1.00 0.00 C ATOM 1937 CE LYS B 715 -8.111 21.453 -14.114 1.00 0.00 C ATOM 1938 NZ LYS B 715 -6.899 22.298 -13.950 1.00 0.00 N ATOM 1939 OXT LYS B 715 -13.813 21.360 -16.344 1.00 0.00 O ATOM 0 H LYS B 715 -12.819 19.685 -17.433 1.00 0.00 H new ATOM 0 HA LYS B 715 -12.058 19.187 -14.648 1.00 0.00 H new ATOM 0 HB2 LYS B 715 -10.011 20.176 -15.705 1.00 0.00 H new ATOM 0 HB3 LYS B 715 -10.969 21.572 -16.160 1.00 0.00 H new ATOM 0 HG2 LYS B 715 -11.541 21.966 -13.756 1.00 0.00 H new ATOM 0 HG3 LYS B 715 -10.589 20.568 -13.299 1.00 0.00 H new ATOM 0 HD2 LYS B 715 -9.462 23.034 -14.702 1.00 0.00 H new ATOM 0 HD3 LYS B 715 -9.395 22.763 -12.972 1.00 0.00 H new ATOM 0 HE2 LYS B 715 -8.087 20.642 -13.386 1.00 0.00 H new ATOM 0 HE3 LYS B 715 -8.101 20.995 -15.103 1.00 0.00 H new ATOM 0 HZ1 LYS B 715 -6.048 21.713 -14.077 1.00 0.00 H new ATOM 0 HZ2 LYS B 715 -6.906 23.057 -14.661 1.00 0.00 H new ATOM 0 HZ3 LYS B 715 -6.893 22.715 -12.997 1.00 0.00 H new TER 1953 LYS B 715