USER MOD reduce.3.24.130724 H: found=0, std=0, add=492, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 492 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 777 TYR OH : rot 165:sc= 0.182 USER MOD Set 1.2: A 802 LYS NZ :NH3+ -171:sc= 0.141 (180deg=-0.998!) USER MOD Single : A 739 SER OG : rot 180:sc= 0 USER MOD Single : A 740 SER OG : rot 180:sc= 0 USER MOD Single : A 742 SER OG : rot -98:sc= 0.00783 USER MOD Single : A 743 SER OG : rot 180:sc= 0 USER MOD Single : A 746 SER OG : rot 180:sc= 0 USER MOD Single : A 752 GLN : amide:sc= -0.0393 X(o=-0.039,f=-0.039) USER MOD Single : A 753 ASN : amide:sc= -0.165 K(o=-0.17,f=-3.2) USER MOD Single : A 756 LYS NZ :NH3+ 163:sc= 0.47 (180deg=0.287) USER MOD Single : A 757 THR OG1 : rot 180:sc=-0.00687 USER MOD Single : A 758 THR OG1 : rot 34:sc= 0.681 USER MOD Single : A 759 SER OG : rot 180:sc= 0 USER MOD Single : A 760 HIS : no HD1:sc= -0.133 X(o=-0.13,f=-0.048) USER MOD Single : A 761 THR OG1 : rot 180:sc= -0.0455 USER MOD Single : A 770 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 TYR OH : rot 30:sc= -2.35! USER MOD Single : A 772 GLN : amide:sc= -0.334 X(o=-0.33,f=-0.11) USER MOD Single : A 782 SER OG : rot 180:sc= 0 USER MOD Single : A 784 THR OG1 : rot 66:sc= 1.33 USER MOD Single : A 786 THR OG1 : rot 180:sc= 0 USER MOD Single : A 788 GLN : amide:sc= -0.179 K(o=-0.18,f=-1.7!) USER MOD Single : A 792 SER OG : rot 180:sc= -0.0384 USER MOD Single : A 794 SER OG : rot 180:sc= 0 USER MOD Single : A 795 SER OG : rot 180:sc= -0.0216 USER MOD Single : A 803 THR OG1 : rot 180:sc= 0.0123 USER MOD Single : A 806 SER OG : rot 180:sc= 0 USER MOD Single : A 809 SER OG : rot 180:sc= 0 USER MOD Single : A 810 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 738 -20.333 -1.670 9.184 1.00 0.00 N ATOM 2 CA GLY A 738 -21.582 -1.013 8.847 1.00 0.00 C ATOM 3 C GLY A 738 -22.763 -1.593 9.600 1.00 0.00 C ATOM 4 O GLY A 738 -23.296 -2.637 9.222 1.00 0.00 O ATOM 0 HA2 GLY A 738 -21.501 0.051 9.069 1.00 0.00 H new ATOM 0 HA3 GLY A 738 -21.759 -1.103 7.775 1.00 0.00 H new ATOM 8 N SER A 739 -23.172 -0.917 10.669 1.00 0.00 N ATOM 9 CA SER A 739 -24.294 -1.375 11.480 1.00 0.00 C ATOM 10 C SER A 739 -25.584 -1.385 10.666 1.00 0.00 C ATOM 11 O SER A 739 -26.291 -2.391 10.613 1.00 0.00 O ATOM 12 CB SER A 739 -24.460 -0.481 12.710 1.00 0.00 C ATOM 13 OG SER A 739 -25.239 -1.122 13.705 1.00 0.00 O ATOM 0 H SER A 739 -22.743 -0.050 10.994 1.00 0.00 H new ATOM 0 HA SER A 739 -24.083 -2.393 11.806 1.00 0.00 H new ATOM 0 HB2 SER A 739 -23.480 -0.231 13.116 1.00 0.00 H new ATOM 0 HB3 SER A 739 -24.934 0.457 12.421 1.00 0.00 H new ATOM 0 HG SER A 739 -25.329 -0.531 14.481 1.00 0.00 H new ATOM 19 N SER A 740 -25.885 -0.255 10.032 1.00 0.00 N ATOM 20 CA SER A 740 -27.092 -0.131 9.224 1.00 0.00 C ATOM 21 C SER A 740 -26.863 -0.675 7.817 1.00 0.00 C ATOM 22 O SER A 740 -27.306 -0.087 6.832 1.00 0.00 O ATOM 23 CB SER A 740 -27.534 1.332 9.151 1.00 0.00 C ATOM 24 OG SER A 740 -26.550 2.131 8.520 1.00 0.00 O ATOM 0 H SER A 740 -25.310 0.587 10.063 1.00 0.00 H new ATOM 0 HA SER A 740 -27.878 -0.718 9.698 1.00 0.00 H new ATOM 0 HB2 SER A 740 -28.473 1.405 8.602 1.00 0.00 H new ATOM 0 HB3 SER A 740 -27.723 1.709 10.156 1.00 0.00 H new ATOM 0 HG SER A 740 -26.857 3.061 8.484 1.00 0.00 H new ATOM 30 N GLY A 741 -26.165 -1.804 7.732 1.00 0.00 N ATOM 31 CA GLY A 741 -25.887 -2.409 6.443 1.00 0.00 C ATOM 32 C GLY A 741 -24.467 -2.158 5.978 1.00 0.00 C ATOM 33 O GLY A 741 -24.101 -1.026 5.662 1.00 0.00 O ATOM 0 H GLY A 741 -25.787 -2.310 8.533 1.00 0.00 H new ATOM 0 HA2 GLY A 741 -26.061 -3.483 6.504 1.00 0.00 H new ATOM 0 HA3 GLY A 741 -26.583 -2.015 5.703 1.00 0.00 H new ATOM 37 N SER A 742 -23.663 -3.216 5.939 1.00 0.00 N ATOM 38 CA SER A 742 -22.272 -3.103 5.515 1.00 0.00 C ATOM 39 C SER A 742 -22.183 -2.748 4.034 1.00 0.00 C ATOM 40 O SER A 742 -21.502 -1.796 3.652 1.00 0.00 O ATOM 41 CB SER A 742 -21.528 -4.413 5.783 1.00 0.00 C ATOM 42 OG SER A 742 -20.126 -4.233 5.676 1.00 0.00 O ATOM 0 H SER A 742 -23.951 -4.160 6.196 1.00 0.00 H new ATOM 0 HA SER A 742 -21.805 -2.304 6.091 1.00 0.00 H new ATOM 0 HB2 SER A 742 -21.776 -4.779 6.779 1.00 0.00 H new ATOM 0 HB3 SER A 742 -21.856 -5.173 5.074 1.00 0.00 H new ATOM 0 HG SER A 742 -19.825 -4.529 4.792 1.00 0.00 H new ATOM 48 N SER A 743 -22.876 -3.521 3.203 1.00 0.00 N ATOM 49 CA SER A 743 -22.873 -3.292 1.763 1.00 0.00 C ATOM 50 C SER A 743 -21.474 -2.929 1.274 1.00 0.00 C ATOM 51 O SER A 743 -21.301 -2.005 0.481 1.00 0.00 O ATOM 52 CB SER A 743 -23.857 -2.178 1.401 1.00 0.00 C ATOM 53 OG SER A 743 -25.152 -2.699 1.162 1.00 0.00 O ATOM 0 H SER A 743 -23.447 -4.311 3.503 1.00 0.00 H new ATOM 0 HA SER A 743 -23.183 -4.215 1.272 1.00 0.00 H new ATOM 0 HB2 SER A 743 -23.899 -1.449 2.210 1.00 0.00 H new ATOM 0 HB3 SER A 743 -23.504 -1.651 0.514 1.00 0.00 H new ATOM 0 HG SER A 743 -25.762 -1.967 0.934 1.00 0.00 H new ATOM 59 N GLY A 744 -20.476 -3.665 1.755 1.00 0.00 N ATOM 60 CA GLY A 744 -19.105 -3.407 1.356 1.00 0.00 C ATOM 61 C GLY A 744 -18.132 -4.411 1.941 1.00 0.00 C ATOM 62 O GLY A 744 -18.391 -4.998 2.992 1.00 0.00 O ATOM 0 H GLY A 744 -20.593 -4.435 2.414 1.00 0.00 H new ATOM 0 HA2 GLY A 744 -19.036 -3.430 0.268 1.00 0.00 H new ATOM 0 HA3 GLY A 744 -18.821 -2.403 1.672 1.00 0.00 H new ATOM 66 N CYS A 745 -17.009 -4.612 1.260 1.00 0.00 N ATOM 67 CA CYS A 745 -15.994 -5.554 1.716 1.00 0.00 C ATOM 68 C CYS A 745 -15.738 -5.394 3.212 1.00 0.00 C ATOM 69 O CYS A 745 -15.887 -4.304 3.765 1.00 0.00 O ATOM 70 CB CYS A 745 -14.692 -5.349 0.939 1.00 0.00 C ATOM 71 SG CYS A 745 -14.631 -6.229 -0.654 1.00 0.00 S ATOM 0 H CYS A 745 -16.779 -4.134 0.389 1.00 0.00 H new ATOM 0 HA CYS A 745 -16.362 -6.564 1.534 1.00 0.00 H new ATOM 0 HB2 CYS A 745 -14.553 -4.283 0.759 1.00 0.00 H new ATOM 0 HB3 CYS A 745 -13.857 -5.679 1.557 1.00 0.00 H new ATOM 76 N SER A 746 -15.350 -6.487 3.861 1.00 0.00 N ATOM 77 CA SER A 746 -15.076 -6.470 5.293 1.00 0.00 C ATOM 78 C SER A 746 -13.784 -5.715 5.589 1.00 0.00 C ATOM 79 O SER A 746 -12.849 -5.724 4.787 1.00 0.00 O ATOM 80 CB SER A 746 -14.981 -7.898 5.832 1.00 0.00 C ATOM 81 OG SER A 746 -16.121 -8.658 5.469 1.00 0.00 O ATOM 0 H SER A 746 -15.218 -7.396 3.418 1.00 0.00 H new ATOM 0 HA SER A 746 -15.899 -5.956 5.790 1.00 0.00 H new ATOM 0 HB2 SER A 746 -14.082 -8.377 5.444 1.00 0.00 H new ATOM 0 HB3 SER A 746 -14.886 -7.875 6.918 1.00 0.00 H new ATOM 0 HG SER A 746 -16.035 -9.567 5.824 1.00 0.00 H new ATOM 87 N ASP A 747 -13.739 -5.064 6.746 1.00 0.00 N ATOM 88 CA ASP A 747 -12.561 -4.305 7.150 1.00 0.00 C ATOM 89 C ASP A 747 -11.340 -5.212 7.258 1.00 0.00 C ATOM 90 O ASP A 747 -11.424 -6.324 7.781 1.00 0.00 O ATOM 91 CB ASP A 747 -12.813 -3.606 8.488 1.00 0.00 C ATOM 92 CG ASP A 747 -13.985 -2.646 8.428 1.00 0.00 C ATOM 93 OD1 ASP A 747 -14.111 -1.927 7.415 1.00 0.00 O ATOM 94 OD2 ASP A 747 -14.776 -2.614 9.394 1.00 0.00 O ATOM 0 H ASP A 747 -14.504 -5.046 7.420 1.00 0.00 H new ATOM 0 HA ASP A 747 -12.365 -3.552 6.386 1.00 0.00 H new ATOM 0 HB2 ASP A 747 -13.000 -4.356 9.257 1.00 0.00 H new ATOM 0 HB3 ASP A 747 -11.916 -3.062 8.785 1.00 0.00 H new ATOM 99 N LEU A 748 -10.206 -4.731 6.760 1.00 0.00 N ATOM 100 CA LEU A 748 -8.967 -5.500 6.799 1.00 0.00 C ATOM 101 C LEU A 748 -8.110 -5.090 7.992 1.00 0.00 C ATOM 102 O LEU A 748 -8.062 -3.923 8.382 1.00 0.00 O ATOM 103 CB LEU A 748 -8.181 -5.303 5.501 1.00 0.00 C ATOM 104 CG LEU A 748 -8.898 -5.711 4.214 1.00 0.00 C ATOM 105 CD1 LEU A 748 -8.344 -4.939 3.026 1.00 0.00 C ATOM 106 CD2 LEU A 748 -8.770 -7.210 3.984 1.00 0.00 C ATOM 0 H LEU A 748 -10.119 -3.813 6.325 1.00 0.00 H new ATOM 0 HA LEU A 748 -9.225 -6.554 6.905 1.00 0.00 H new ATOM 0 HB2 LEU A 748 -7.906 -4.251 5.422 1.00 0.00 H new ATOM 0 HB3 LEU A 748 -7.253 -5.871 5.572 1.00 0.00 H new ATOM 0 HG LEU A 748 -9.956 -5.468 4.318 1.00 0.00 H new ATOM 0 HD11 LEU A 748 -8.867 -5.243 2.119 1.00 0.00 H new ATOM 0 HD12 LEU A 748 -8.488 -3.871 3.187 1.00 0.00 H new ATOM 0 HD13 LEU A 748 -7.280 -5.150 2.919 1.00 0.00 H new ATOM 0 HD21 LEU A 748 -9.286 -7.482 3.063 1.00 0.00 H new ATOM 0 HD22 LEU A 748 -7.716 -7.477 3.902 1.00 0.00 H new ATOM 0 HD23 LEU A 748 -9.215 -7.746 4.822 1.00 0.00 H new ATOM 118 N PRO A 749 -7.414 -6.071 8.586 1.00 0.00 N ATOM 119 CA PRO A 749 -6.544 -5.837 9.742 1.00 0.00 C ATOM 120 C PRO A 749 -5.296 -5.041 9.377 1.00 0.00 C ATOM 121 O PRO A 749 -4.946 -4.925 8.203 1.00 0.00 O ATOM 122 CB PRO A 749 -6.164 -7.250 10.192 1.00 0.00 C ATOM 123 CG PRO A 749 -6.296 -8.086 8.967 1.00 0.00 C ATOM 124 CD PRO A 749 -7.424 -7.485 8.175 1.00 0.00 C ATOM 0 HA PRO A 749 -7.041 -5.248 10.513 1.00 0.00 H new ATOM 0 HB2 PRO A 749 -5.148 -7.281 10.584 1.00 0.00 H new ATOM 0 HB3 PRO A 749 -6.823 -7.603 10.985 1.00 0.00 H new ATOM 0 HG2 PRO A 749 -5.370 -8.084 8.391 1.00 0.00 H new ATOM 0 HG3 PRO A 749 -6.509 -9.124 9.224 1.00 0.00 H new ATOM 0 HD2 PRO A 749 -7.264 -7.593 7.102 1.00 0.00 H new ATOM 0 HD3 PRO A 749 -8.376 -7.964 8.405 1.00 0.00 H new ATOM 132 N GLU A 750 -4.630 -4.495 10.389 1.00 0.00 N ATOM 133 CA GLU A 750 -3.421 -3.709 10.172 1.00 0.00 C ATOM 134 C GLU A 750 -2.323 -4.562 9.543 1.00 0.00 C ATOM 135 O GLU A 750 -2.248 -5.768 9.780 1.00 0.00 O ATOM 136 CB GLU A 750 -2.927 -3.116 11.493 1.00 0.00 C ATOM 137 CG GLU A 750 -3.780 -1.966 12.001 1.00 0.00 C ATOM 138 CD GLU A 750 -5.212 -2.380 12.279 1.00 0.00 C ATOM 139 OE1 GLU A 750 -5.411 -3.442 12.904 1.00 0.00 O ATOM 140 OE2 GLU A 750 -6.133 -1.642 11.871 1.00 0.00 O ATOM 0 H GLU A 750 -4.907 -4.582 11.367 1.00 0.00 H new ATOM 0 HA GLU A 750 -3.665 -2.897 9.486 1.00 0.00 H new ATOM 0 HB2 GLU A 750 -2.904 -3.902 12.248 1.00 0.00 H new ATOM 0 HB3 GLU A 750 -1.902 -2.768 11.364 1.00 0.00 H new ATOM 0 HG2 GLU A 750 -3.338 -1.566 12.913 1.00 0.00 H new ATOM 0 HG3 GLU A 750 -3.775 -1.162 11.265 1.00 0.00 H new ATOM 147 N ILE A 751 -1.476 -3.927 8.740 1.00 0.00 N ATOM 148 CA ILE A 751 -0.383 -4.627 8.077 1.00 0.00 C ATOM 149 C ILE A 751 0.947 -4.350 8.769 1.00 0.00 C ATOM 150 O ILE A 751 1.156 -3.271 9.324 1.00 0.00 O ATOM 151 CB ILE A 751 -0.272 -4.222 6.595 1.00 0.00 C ATOM 152 CG1 ILE A 751 1.064 -4.690 6.015 1.00 0.00 C ATOM 153 CG2 ILE A 751 -0.422 -2.716 6.445 1.00 0.00 C ATOM 154 CD1 ILE A 751 1.065 -4.793 4.506 1.00 0.00 C ATOM 0 H ILE A 751 -1.526 -2.929 8.533 1.00 0.00 H new ATOM 0 HA ILE A 751 -0.607 -5.692 8.138 1.00 0.00 H new ATOM 0 HB ILE A 751 -1.077 -4.705 6.040 1.00 0.00 H new ATOM 0 HG12 ILE A 751 1.847 -3.998 6.324 1.00 0.00 H new ATOM 0 HG13 ILE A 751 1.313 -5.663 6.438 1.00 0.00 H new ATOM 0 HG21 ILE A 751 -0.341 -2.445 5.392 1.00 0.00 H new ATOM 0 HG22 ILE A 751 -1.396 -2.408 6.825 1.00 0.00 H new ATOM 0 HG23 ILE A 751 0.364 -2.214 7.010 1.00 0.00 H new ATOM 0 HD11 ILE A 751 2.044 -5.130 4.165 1.00 0.00 H new ATOM 0 HD12 ILE A 751 0.305 -5.507 4.190 1.00 0.00 H new ATOM 0 HD13 ILE A 751 0.847 -3.816 4.074 1.00 0.00 H new ATOM 166 N GLN A 752 1.844 -5.330 8.730 1.00 0.00 N ATOM 167 CA GLN A 752 3.155 -5.190 9.353 1.00 0.00 C ATOM 168 C GLN A 752 4.136 -4.504 8.409 1.00 0.00 C ATOM 169 O GLN A 752 4.203 -4.829 7.224 1.00 0.00 O ATOM 170 CB GLN A 752 3.697 -6.561 9.763 1.00 0.00 C ATOM 171 CG GLN A 752 2.905 -7.220 10.880 1.00 0.00 C ATOM 172 CD GLN A 752 3.039 -6.487 12.201 1.00 0.00 C ATOM 173 OE1 GLN A 752 4.075 -6.560 12.862 1.00 0.00 O ATOM 174 NE2 GLN A 752 1.989 -5.774 12.592 1.00 0.00 N ATOM 0 H GLN A 752 1.687 -6.229 8.274 1.00 0.00 H new ATOM 0 HA GLN A 752 3.042 -4.571 10.243 1.00 0.00 H new ATOM 0 HB2 GLN A 752 3.697 -7.217 8.893 1.00 0.00 H new ATOM 0 HB3 GLN A 752 4.734 -6.452 10.080 1.00 0.00 H new ATOM 0 HG2 GLN A 752 1.853 -7.263 10.598 1.00 0.00 H new ATOM 0 HG3 GLN A 752 3.245 -8.248 11.003 1.00 0.00 H new ATOM 0 HE21 GLN A 752 1.150 -5.742 12.013 1.00 0.00 H new ATOM 0 HE22 GLN A 752 2.021 -5.259 13.472 1.00 0.00 H new ATOM 183 N ASN A 753 4.895 -3.551 8.942 1.00 0.00 N ATOM 184 CA ASN A 753 5.872 -2.818 8.146 1.00 0.00 C ATOM 185 C ASN A 753 5.218 -2.206 6.910 1.00 0.00 C ATOM 186 O ASN A 753 5.742 -2.311 5.802 1.00 0.00 O ATOM 187 CB ASN A 753 7.017 -3.742 7.726 1.00 0.00 C ATOM 188 CG ASN A 753 7.645 -4.457 8.907 1.00 0.00 C ATOM 189 OD1 ASN A 753 7.003 -5.278 9.563 1.00 0.00 O ATOM 190 ND2 ASN A 753 8.906 -4.148 9.183 1.00 0.00 N ATOM 0 H ASN A 753 4.852 -3.269 9.921 1.00 0.00 H new ATOM 0 HA ASN A 753 6.272 -2.012 8.761 1.00 0.00 H new ATOM 0 HB2 ASN A 753 6.644 -4.479 7.015 1.00 0.00 H new ATOM 0 HB3 ASN A 753 7.780 -3.159 7.210 1.00 0.00 H new ATOM 0 HD21 ASN A 753 9.382 -4.597 9.966 1.00 0.00 H new ATOM 0 HD22 ASN A 753 9.400 -3.462 8.612 1.00 0.00 H new ATOM 197 N GLY A 754 4.070 -1.566 7.110 1.00 0.00 N ATOM 198 CA GLY A 754 3.364 -0.947 6.004 1.00 0.00 C ATOM 199 C GLY A 754 2.033 -0.355 6.425 1.00 0.00 C ATOM 200 O GLY A 754 1.742 -0.249 7.616 1.00 0.00 O ATOM 0 H GLY A 754 3.617 -1.465 8.018 1.00 0.00 H new ATOM 0 HA2 GLY A 754 3.987 -0.163 5.572 1.00 0.00 H new ATOM 0 HA3 GLY A 754 3.198 -1.688 5.223 1.00 0.00 H new ATOM 204 N TRP A 755 1.224 0.031 5.445 1.00 0.00 N ATOM 205 CA TRP A 755 -0.083 0.617 5.720 1.00 0.00 C ATOM 206 C TRP A 755 -1.020 0.443 4.530 1.00 0.00 C ATOM 207 O TRP A 755 -0.602 0.008 3.456 1.00 0.00 O ATOM 208 CB TRP A 755 0.061 2.102 6.058 1.00 0.00 C ATOM 209 CG TRP A 755 0.371 2.955 4.866 1.00 0.00 C ATOM 210 CD1 TRP A 755 -0.522 3.455 3.962 1.00 0.00 C ATOM 211 CD2 TRP A 755 1.664 3.406 4.448 1.00 0.00 C ATOM 212 NE1 TRP A 755 0.138 4.190 3.006 1.00 0.00 N ATOM 213 CE2 TRP A 755 1.479 4.176 3.282 1.00 0.00 C ATOM 214 CE3 TRP A 755 2.959 3.237 4.945 1.00 0.00 C ATOM 215 CZ2 TRP A 755 2.542 4.773 2.609 1.00 0.00 C ATOM 216 CZ3 TRP A 755 4.012 3.829 4.275 1.00 0.00 C ATOM 217 CH2 TRP A 755 3.799 4.590 3.118 1.00 0.00 C ATOM 0 H TRP A 755 1.450 -0.051 4.454 1.00 0.00 H new ATOM 0 HA TRP A 755 -0.513 0.097 6.576 1.00 0.00 H new ATOM 0 HB2 TRP A 755 -0.863 2.454 6.517 1.00 0.00 H new ATOM 0 HB3 TRP A 755 0.852 2.224 6.798 1.00 0.00 H new ATOM 0 HD1 TRP A 755 -1.590 3.296 3.993 1.00 0.00 H new ATOM 0 HE1 TRP A 755 -0.300 4.668 2.219 1.00 0.00 H new ATOM 0 HE3 TRP A 755 3.134 2.654 5.837 1.00 0.00 H new ATOM 0 HZ2 TRP A 755 2.380 5.360 1.717 1.00 0.00 H new ATOM 0 HZ3 TRP A 755 5.017 3.703 4.650 1.00 0.00 H new ATOM 0 HH2 TRP A 755 4.643 5.041 2.618 1.00 0.00 H new ATOM 228 N LYS A 756 -2.289 0.786 4.725 1.00 0.00 N ATOM 229 CA LYS A 756 -3.285 0.669 3.667 1.00 0.00 C ATOM 230 C LYS A 756 -4.150 1.923 3.594 1.00 0.00 C ATOM 231 O LYS A 756 -4.232 2.691 4.553 1.00 0.00 O ATOM 232 CB LYS A 756 -4.167 -0.559 3.901 1.00 0.00 C ATOM 233 CG LYS A 756 -5.107 -0.416 5.085 1.00 0.00 C ATOM 234 CD LYS A 756 -5.912 -1.684 5.315 1.00 0.00 C ATOM 235 CE LYS A 756 -6.522 -1.712 6.708 1.00 0.00 C ATOM 236 NZ LYS A 756 -5.507 -2.020 7.753 1.00 0.00 N ATOM 0 H LYS A 756 -2.652 1.148 5.607 1.00 0.00 H new ATOM 0 HA LYS A 756 -2.760 0.555 2.719 1.00 0.00 H new ATOM 0 HB2 LYS A 756 -4.754 -0.751 3.003 1.00 0.00 H new ATOM 0 HB3 LYS A 756 -3.530 -1.429 4.057 1.00 0.00 H new ATOM 0 HG2 LYS A 756 -4.532 -0.182 5.981 1.00 0.00 H new ATOM 0 HG3 LYS A 756 -5.785 0.420 4.914 1.00 0.00 H new ATOM 0 HD2 LYS A 756 -6.703 -1.754 4.569 1.00 0.00 H new ATOM 0 HD3 LYS A 756 -5.269 -2.554 5.181 1.00 0.00 H new ATOM 0 HE2 LYS A 756 -6.982 -0.747 6.922 1.00 0.00 H new ATOM 0 HE3 LYS A 756 -7.316 -2.458 6.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 756 -5.878 -1.753 8.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 756 -5.296 -3.038 7.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 756 -4.637 -1.484 7.560 1.00 0.00 H new ATOM 250 N THR A 757 -4.797 2.125 2.450 1.00 0.00 N ATOM 251 CA THR A 757 -5.656 3.285 2.252 1.00 0.00 C ATOM 252 C THR A 757 -6.989 2.882 1.631 1.00 0.00 C ATOM 253 O THR A 757 -7.197 1.720 1.280 1.00 0.00 O ATOM 254 CB THR A 757 -4.981 4.337 1.353 1.00 0.00 C ATOM 255 OG1 THR A 757 -4.657 3.761 0.082 1.00 0.00 O ATOM 256 CG2 THR A 757 -3.719 4.879 2.007 1.00 0.00 C ATOM 0 H THR A 757 -4.742 1.499 1.646 1.00 0.00 H new ATOM 0 HA THR A 757 -5.833 3.719 3.236 1.00 0.00 H new ATOM 0 HB THR A 757 -5.679 5.162 1.210 1.00 0.00 H new ATOM 0 HG1 THR A 757 -4.230 4.437 -0.484 1.00 0.00 H new ATOM 0 HG21 THR A 757 -3.260 5.620 1.353 1.00 0.00 H new ATOM 0 HG22 THR A 757 -3.974 5.343 2.960 1.00 0.00 H new ATOM 0 HG23 THR A 757 -3.018 4.062 2.178 1.00 0.00 H new ATOM 264 N THR A 758 -7.891 3.850 1.497 1.00 0.00 N ATOM 265 CA THR A 758 -9.204 3.596 0.918 1.00 0.00 C ATOM 266 C THR A 758 -9.611 4.714 -0.034 1.00 0.00 C ATOM 267 O THR A 758 -9.822 5.852 0.384 1.00 0.00 O ATOM 268 CB THR A 758 -10.281 3.450 2.011 1.00 0.00 C ATOM 269 OG1 THR A 758 -10.353 4.650 2.789 1.00 0.00 O ATOM 270 CG2 THR A 758 -9.974 2.268 2.918 1.00 0.00 C ATOM 0 H THR A 758 -7.736 4.817 1.782 1.00 0.00 H new ATOM 0 HA THR A 758 -9.129 2.660 0.364 1.00 0.00 H new ATOM 0 HB THR A 758 -11.241 3.274 1.525 1.00 0.00 H new ATOM 0 HG1 THR A 758 -10.162 5.423 2.217 1.00 0.00 H new ATOM 0 HG21 THR A 758 -10.747 2.185 3.682 1.00 0.00 H new ATOM 0 HG22 THR A 758 -9.948 1.353 2.327 1.00 0.00 H new ATOM 0 HG23 THR A 758 -9.006 2.418 3.397 1.00 0.00 H new ATOM 278 N SER A 759 -9.720 4.382 -1.317 1.00 0.00 N ATOM 279 CA SER A 759 -10.099 5.360 -2.330 1.00 0.00 C ATOM 280 C SER A 759 -11.509 5.884 -2.078 1.00 0.00 C ATOM 281 O SER A 759 -11.717 7.087 -1.912 1.00 0.00 O ATOM 282 CB SER A 759 -10.015 4.739 -3.725 1.00 0.00 C ATOM 283 OG SER A 759 -10.128 5.730 -4.732 1.00 0.00 O ATOM 0 H SER A 759 -9.551 3.443 -1.679 1.00 0.00 H new ATOM 0 HA SER A 759 -9.403 6.197 -2.270 1.00 0.00 H new ATOM 0 HB2 SER A 759 -9.068 4.211 -3.835 1.00 0.00 H new ATOM 0 HB3 SER A 759 -10.808 4.001 -3.846 1.00 0.00 H new ATOM 0 HG SER A 759 -10.070 5.308 -5.614 1.00 0.00 H new ATOM 289 N HIS A 760 -12.477 4.973 -2.051 1.00 0.00 N ATOM 290 CA HIS A 760 -13.869 5.342 -1.820 1.00 0.00 C ATOM 291 C HIS A 760 -14.183 5.366 -0.327 1.00 0.00 C ATOM 292 O HIS A 760 -13.523 4.697 0.469 1.00 0.00 O ATOM 293 CB HIS A 760 -14.803 4.365 -2.533 1.00 0.00 C ATOM 294 CG HIS A 760 -16.205 4.871 -2.674 1.00 0.00 C ATOM 295 ND1 HIS A 760 -16.527 6.006 -3.389 1.00 0.00 N ATOM 296 CD2 HIS A 760 -17.374 4.390 -2.189 1.00 0.00 C ATOM 297 CE1 HIS A 760 -17.832 6.202 -3.335 1.00 0.00 C ATOM 298 NE2 HIS A 760 -18.370 5.235 -2.614 1.00 0.00 N ATOM 0 H HIS A 760 -12.323 3.974 -2.186 1.00 0.00 H new ATOM 0 HA HIS A 760 -14.026 6.342 -2.223 1.00 0.00 H new ATOM 0 HB2 HIS A 760 -14.402 4.149 -3.523 1.00 0.00 H new ATOM 0 HB3 HIS A 760 -14.819 3.424 -1.984 1.00 0.00 H new ATOM 0 HD2 HIS A 760 -17.500 3.506 -1.581 1.00 0.00 H new ATOM 0 HE1 HIS A 760 -18.368 7.015 -3.801 1.00 0.00 H new ATOM 0 HE2 HIS A 760 -19.363 5.132 -2.407 1.00 0.00 H new ATOM 306 N THR A 761 -15.194 6.143 0.048 1.00 0.00 N ATOM 307 CA THR A 761 -15.595 6.257 1.445 1.00 0.00 C ATOM 308 C THR A 761 -15.894 4.887 2.044 1.00 0.00 C ATOM 309 O THR A 761 -15.380 4.539 3.106 1.00 0.00 O ATOM 310 CB THR A 761 -16.836 7.156 1.602 1.00 0.00 C ATOM 311 OG1 THR A 761 -17.895 6.679 0.766 1.00 0.00 O ATOM 312 CG2 THR A 761 -16.509 8.597 1.243 1.00 0.00 C ATOM 0 H THR A 761 -15.751 6.703 -0.597 1.00 0.00 H new ATOM 0 HA THR A 761 -14.759 6.709 1.978 1.00 0.00 H new ATOM 0 HB THR A 761 -17.153 7.121 2.644 1.00 0.00 H new ATOM 0 HG1 THR A 761 -18.681 7.255 0.873 1.00 0.00 H new ATOM 0 HG21 THR A 761 -17.401 9.213 1.361 1.00 0.00 H new ATOM 0 HG22 THR A 761 -15.723 8.967 1.901 1.00 0.00 H new ATOM 0 HG23 THR A 761 -16.169 8.646 0.209 1.00 0.00 H new ATOM 320 N GLU A 762 -16.728 4.114 1.355 1.00 0.00 N ATOM 321 CA GLU A 762 -17.095 2.782 1.821 1.00 0.00 C ATOM 322 C GLU A 762 -16.518 1.707 0.904 1.00 0.00 C ATOM 323 O GLU A 762 -16.490 1.866 -0.317 1.00 0.00 O ATOM 324 CB GLU A 762 -18.618 2.644 1.892 1.00 0.00 C ATOM 325 CG GLU A 762 -19.091 1.678 2.965 1.00 0.00 C ATOM 326 CD GLU A 762 -19.141 2.313 4.341 1.00 0.00 C ATOM 327 OE1 GLU A 762 -18.143 2.952 4.736 1.00 0.00 O ATOM 328 OE2 GLU A 762 -20.177 2.169 5.023 1.00 0.00 O ATOM 0 H GLU A 762 -17.162 4.387 0.473 1.00 0.00 H new ATOM 0 HA GLU A 762 -16.678 2.646 2.819 1.00 0.00 H new ATOM 0 HB2 GLU A 762 -19.055 3.625 2.079 1.00 0.00 H new ATOM 0 HB3 GLU A 762 -18.990 2.309 0.924 1.00 0.00 H new ATOM 0 HG2 GLU A 762 -20.082 1.308 2.704 1.00 0.00 H new ATOM 0 HG3 GLU A 762 -18.425 0.815 2.991 1.00 0.00 H new ATOM 335 N LEU A 763 -16.059 0.613 1.502 1.00 0.00 N ATOM 336 CA LEU A 763 -15.482 -0.489 0.740 1.00 0.00 C ATOM 337 C LEU A 763 -16.553 -1.211 -0.070 1.00 0.00 C ATOM 338 O LEU A 763 -16.987 -2.305 0.291 1.00 0.00 O ATOM 339 CB LEU A 763 -14.786 -1.475 1.681 1.00 0.00 C ATOM 340 CG LEU A 763 -13.795 -0.869 2.675 1.00 0.00 C ATOM 341 CD1 LEU A 763 -13.412 -1.888 3.736 1.00 0.00 C ATOM 342 CD2 LEU A 763 -12.556 -0.361 1.950 1.00 0.00 C ATOM 0 H LEU A 763 -16.075 0.465 2.511 1.00 0.00 H new ATOM 0 HA LEU A 763 -14.748 -0.075 0.048 1.00 0.00 H new ATOM 0 HB2 LEU A 763 -15.551 -2.012 2.243 1.00 0.00 H new ATOM 0 HB3 LEU A 763 -14.258 -2.212 1.076 1.00 0.00 H new ATOM 0 HG LEU A 763 -14.276 -0.024 3.168 1.00 0.00 H new ATOM 0 HD11 LEU A 763 -12.706 -1.438 4.434 1.00 0.00 H new ATOM 0 HD12 LEU A 763 -14.305 -2.204 4.276 1.00 0.00 H new ATOM 0 HD13 LEU A 763 -12.950 -2.753 3.260 1.00 0.00 H new ATOM 0 HD21 LEU A 763 -11.861 0.067 2.673 1.00 0.00 H new ATOM 0 HD22 LEU A 763 -12.074 -1.189 1.430 1.00 0.00 H new ATOM 0 HD23 LEU A 763 -12.845 0.403 1.228 1.00 0.00 H new ATOM 354 N VAL A 764 -16.975 -0.593 -1.168 1.00 0.00 N ATOM 355 CA VAL A 764 -17.993 -1.178 -2.032 1.00 0.00 C ATOM 356 C VAL A 764 -17.389 -1.659 -3.346 1.00 0.00 C ATOM 357 O VAL A 764 -16.203 -1.455 -3.607 1.00 0.00 O ATOM 358 CB VAL A 764 -19.118 -0.170 -2.336 1.00 0.00 C ATOM 359 CG1 VAL A 764 -19.768 0.310 -1.047 1.00 0.00 C ATOM 360 CG2 VAL A 764 -18.579 1.003 -3.140 1.00 0.00 C ATOM 0 H VAL A 764 -16.627 0.314 -1.481 1.00 0.00 H new ATOM 0 HA VAL A 764 -18.412 -2.029 -1.495 1.00 0.00 H new ATOM 0 HB VAL A 764 -19.879 -0.671 -2.934 1.00 0.00 H new ATOM 0 HG11 VAL A 764 -20.560 1.021 -1.282 1.00 0.00 H new ATOM 0 HG12 VAL A 764 -20.191 -0.541 -0.514 1.00 0.00 H new ATOM 0 HG13 VAL A 764 -19.019 0.795 -0.420 1.00 0.00 H new ATOM 0 HG21 VAL A 764 -19.387 1.705 -3.346 1.00 0.00 H new ATOM 0 HG22 VAL A 764 -17.798 1.506 -2.570 1.00 0.00 H new ATOM 0 HG23 VAL A 764 -18.166 0.640 -4.081 1.00 0.00 H new ATOM 370 N ARG A 765 -18.212 -2.299 -4.170 1.00 0.00 N ATOM 371 CA ARG A 765 -17.758 -2.811 -5.458 1.00 0.00 C ATOM 372 C ARG A 765 -16.846 -1.804 -6.152 1.00 0.00 C ATOM 373 O ARG A 765 -17.126 -0.606 -6.169 1.00 0.00 O ATOM 374 CB ARG A 765 -18.956 -3.133 -6.354 1.00 0.00 C ATOM 375 CG ARG A 765 -19.781 -4.313 -5.867 1.00 0.00 C ATOM 376 CD ARG A 765 -21.051 -4.481 -6.686 1.00 0.00 C ATOM 377 NE ARG A 765 -21.799 -5.673 -6.298 1.00 0.00 N ATOM 378 CZ ARG A 765 -23.006 -5.968 -6.767 1.00 0.00 C ATOM 379 NH1 ARG A 765 -23.598 -5.163 -7.638 1.00 0.00 N ATOM 380 NH2 ARG A 765 -23.624 -7.072 -6.366 1.00 0.00 N ATOM 0 H ARG A 765 -19.196 -2.475 -3.969 1.00 0.00 H new ATOM 0 HA ARG A 765 -17.192 -3.725 -5.278 1.00 0.00 H new ATOM 0 HB2 ARG A 765 -19.597 -2.254 -6.418 1.00 0.00 H new ATOM 0 HB3 ARG A 765 -18.599 -3.342 -7.363 1.00 0.00 H new ATOM 0 HG2 ARG A 765 -19.185 -5.224 -5.926 1.00 0.00 H new ATOM 0 HG3 ARG A 765 -20.040 -4.169 -4.818 1.00 0.00 H new ATOM 0 HD2 ARG A 765 -21.682 -3.601 -6.561 1.00 0.00 H new ATOM 0 HD3 ARG A 765 -20.795 -4.542 -7.744 1.00 0.00 H new ATOM 0 HE ARG A 765 -21.371 -6.314 -5.630 1.00 0.00 H new ATOM 0 HH11 ARG A 765 -23.126 -4.314 -7.950 1.00 0.00 H new ATOM 0 HH12 ARG A 765 -24.525 -5.393 -7.996 1.00 0.00 H new ATOM 0 HH21 ARG A 765 -23.172 -7.695 -5.697 1.00 0.00 H new ATOM 0 HH22 ARG A 765 -24.551 -7.297 -6.727 1.00 0.00 H new ATOM 394 N GLY A 766 -15.753 -2.299 -6.724 1.00 0.00 N ATOM 395 CA GLY A 766 -14.816 -1.430 -7.412 1.00 0.00 C ATOM 396 C GLY A 766 -13.761 -0.864 -6.482 1.00 0.00 C ATOM 397 O GLY A 766 -12.638 -0.589 -6.901 1.00 0.00 O ATOM 0 H GLY A 766 -15.499 -3.287 -6.723 1.00 0.00 H new ATOM 0 HA2 GLY A 766 -14.329 -1.987 -8.213 1.00 0.00 H new ATOM 0 HA3 GLY A 766 -15.361 -0.610 -7.880 1.00 0.00 H new ATOM 401 N ALA A 767 -14.124 -0.687 -5.215 1.00 0.00 N ATOM 402 CA ALA A 767 -13.200 -0.151 -4.224 1.00 0.00 C ATOM 403 C ALA A 767 -11.908 -0.958 -4.184 1.00 0.00 C ATOM 404 O ALA A 767 -11.934 -2.187 -4.111 1.00 0.00 O ATOM 405 CB ALA A 767 -13.855 -0.130 -2.850 1.00 0.00 C ATOM 0 H ALA A 767 -15.051 -0.907 -4.852 1.00 0.00 H new ATOM 0 HA ALA A 767 -12.950 0.870 -4.511 1.00 0.00 H new ATOM 0 HB1 ALA A 767 -13.154 0.273 -2.119 1.00 0.00 H new ATOM 0 HB2 ALA A 767 -14.746 0.497 -2.881 1.00 0.00 H new ATOM 0 HB3 ALA A 767 -14.134 -1.144 -2.565 1.00 0.00 H new ATOM 411 N ARG A 768 -10.778 -0.260 -4.233 1.00 0.00 N ATOM 412 CA ARG A 768 -9.474 -0.913 -4.205 1.00 0.00 C ATOM 413 C ARG A 768 -8.645 -0.421 -3.022 1.00 0.00 C ATOM 414 O ARG A 768 -8.792 0.720 -2.581 1.00 0.00 O ATOM 415 CB ARG A 768 -8.722 -0.655 -5.511 1.00 0.00 C ATOM 416 CG ARG A 768 -7.908 0.629 -5.502 1.00 0.00 C ATOM 417 CD ARG A 768 -7.620 1.116 -6.913 1.00 0.00 C ATOM 418 NE ARG A 768 -6.364 1.858 -6.990 1.00 0.00 N ATOM 419 CZ ARG A 768 -5.866 2.345 -8.121 1.00 0.00 C ATOM 420 NH1 ARG A 768 -6.514 2.170 -9.264 1.00 0.00 N ATOM 421 NH2 ARG A 768 -4.717 3.009 -8.110 1.00 0.00 N ATOM 0 H ARG A 768 -10.739 0.758 -4.292 1.00 0.00 H new ATOM 0 HA ARG A 768 -9.635 -1.985 -4.093 1.00 0.00 H new ATOM 0 HB2 ARG A 768 -8.057 -1.495 -5.709 1.00 0.00 H new ATOM 0 HB3 ARG A 768 -9.439 -0.615 -6.331 1.00 0.00 H new ATOM 0 HG2 ARG A 768 -8.449 1.400 -4.953 1.00 0.00 H new ATOM 0 HG3 ARG A 768 -6.969 0.462 -4.975 1.00 0.00 H new ATOM 0 HD2 ARG A 768 -7.579 0.263 -7.590 1.00 0.00 H new ATOM 0 HD3 ARG A 768 -8.438 1.752 -7.251 1.00 0.00 H new ATOM 0 HE ARG A 768 -5.841 2.010 -6.128 1.00 0.00 H new ATOM 0 HH11 ARG A 768 -7.397 1.660 -9.277 1.00 0.00 H new ATOM 0 HH12 ARG A 768 -6.129 2.545 -10.131 1.00 0.00 H new ATOM 0 HH21 ARG A 768 -4.215 3.146 -7.232 1.00 0.00 H new ATOM 0 HH22 ARG A 768 -4.335 3.383 -8.979 1.00 0.00 H new ATOM 435 N ILE A 769 -7.777 -1.288 -2.513 1.00 0.00 N ATOM 436 CA ILE A 769 -6.924 -0.941 -1.383 1.00 0.00 C ATOM 437 C ILE A 769 -5.453 -0.945 -1.782 1.00 0.00 C ATOM 438 O ILE A 769 -4.972 -1.885 -2.417 1.00 0.00 O ATOM 439 CB ILE A 769 -7.128 -1.912 -0.205 1.00 0.00 C ATOM 440 CG1 ILE A 769 -8.618 -2.053 0.116 1.00 0.00 C ATOM 441 CG2 ILE A 769 -6.361 -1.431 1.017 1.00 0.00 C ATOM 442 CD1 ILE A 769 -9.176 -0.897 0.916 1.00 0.00 C ATOM 0 H ILE A 769 -7.646 -2.236 -2.865 1.00 0.00 H new ATOM 0 HA ILE A 769 -7.209 0.063 -1.069 1.00 0.00 H new ATOM 0 HB ILE A 769 -6.742 -2.891 -0.490 1.00 0.00 H new ATOM 0 HG12 ILE A 769 -9.175 -2.141 -0.816 1.00 0.00 H new ATOM 0 HG13 ILE A 769 -8.776 -2.978 0.671 1.00 0.00 H new ATOM 0 HG21 ILE A 769 -6.515 -2.128 1.841 1.00 0.00 H new ATOM 0 HG22 ILE A 769 -5.298 -1.377 0.781 1.00 0.00 H new ATOM 0 HG23 ILE A 769 -6.719 -0.443 1.306 1.00 0.00 H new ATOM 0 HD11 ILE A 769 -10.236 -1.065 1.107 1.00 0.00 H new ATOM 0 HD12 ILE A 769 -8.644 -0.821 1.865 1.00 0.00 H new ATOM 0 HD13 ILE A 769 -9.050 0.029 0.354 1.00 0.00 H new ATOM 454 N THR A 770 -4.739 0.111 -1.404 1.00 0.00 N ATOM 455 CA THR A 770 -3.322 0.229 -1.721 1.00 0.00 C ATOM 456 C THR A 770 -2.458 -0.073 -0.502 1.00 0.00 C ATOM 457 O THR A 770 -2.509 0.642 0.500 1.00 0.00 O ATOM 458 CB THR A 770 -2.979 1.638 -2.242 1.00 0.00 C ATOM 459 OG1 THR A 770 -3.779 1.944 -3.390 1.00 0.00 O ATOM 460 CG2 THR A 770 -1.504 1.736 -2.605 1.00 0.00 C ATOM 0 H THR A 770 -5.120 0.897 -0.877 1.00 0.00 H new ATOM 0 HA THR A 770 -3.111 -0.502 -2.502 1.00 0.00 H new ATOM 0 HB THR A 770 -3.191 2.356 -1.450 1.00 0.00 H new ATOM 0 HG1 THR A 770 -3.556 2.842 -3.714 1.00 0.00 H new ATOM 0 HG21 THR A 770 -1.285 2.739 -2.970 1.00 0.00 H new ATOM 0 HG22 THR A 770 -0.898 1.531 -1.723 1.00 0.00 H new ATOM 0 HG23 THR A 770 -1.271 1.008 -3.382 1.00 0.00 H new ATOM 468 N TYR A 771 -1.667 -1.136 -0.592 1.00 0.00 N ATOM 469 CA TYR A 771 -0.793 -1.534 0.505 1.00 0.00 C ATOM 470 C TYR A 771 0.631 -1.037 0.275 1.00 0.00 C ATOM 471 O TYR A 771 1.221 -1.278 -0.778 1.00 0.00 O ATOM 472 CB TYR A 771 -0.796 -3.055 0.661 1.00 0.00 C ATOM 473 CG TYR A 771 -2.001 -3.586 1.403 1.00 0.00 C ATOM 474 CD1 TYR A 771 -2.112 -3.441 2.781 1.00 0.00 C ATOM 475 CD2 TYR A 771 -3.029 -4.233 0.728 1.00 0.00 C ATOM 476 CE1 TYR A 771 -3.212 -3.925 3.464 1.00 0.00 C ATOM 477 CE2 TYR A 771 -4.132 -4.718 1.402 1.00 0.00 C ATOM 478 CZ TYR A 771 -4.219 -4.562 2.770 1.00 0.00 C ATOM 479 OH TYR A 771 -5.316 -5.045 3.445 1.00 0.00 O ATOM 0 H TYR A 771 -1.613 -1.738 -1.414 1.00 0.00 H new ATOM 0 HA TYR A 771 -1.173 -1.081 1.421 1.00 0.00 H new ATOM 0 HB2 TYR A 771 -0.758 -3.513 -0.327 1.00 0.00 H new ATOM 0 HB3 TYR A 771 0.108 -3.359 1.189 1.00 0.00 H new ATOM 0 HD1 TYR A 771 -1.325 -2.942 3.327 1.00 0.00 H new ATOM 0 HD2 TYR A 771 -2.964 -4.359 -0.343 1.00 0.00 H new ATOM 0 HE1 TYR A 771 -3.282 -3.805 4.535 1.00 0.00 H new ATOM 0 HE2 TYR A 771 -4.923 -5.217 0.861 1.00 0.00 H new ATOM 0 HH TYR A 771 -5.484 -4.491 4.236 1.00 0.00 H new ATOM 489 N GLN A 772 1.177 -0.343 1.269 1.00 0.00 N ATOM 490 CA GLN A 772 2.532 0.187 1.175 1.00 0.00 C ATOM 491 C GLN A 772 3.400 -0.334 2.315 1.00 0.00 C ATOM 492 O GLN A 772 2.961 -0.400 3.464 1.00 0.00 O ATOM 493 CB GLN A 772 2.506 1.717 1.196 1.00 0.00 C ATOM 494 CG GLN A 772 3.776 2.354 0.657 1.00 0.00 C ATOM 495 CD GLN A 772 3.956 2.131 -0.831 1.00 0.00 C ATOM 496 OE1 GLN A 772 3.429 2.883 -1.652 1.00 0.00 O ATOM 497 NE2 GLN A 772 4.702 1.093 -1.189 1.00 0.00 N ATOM 0 H GLN A 772 0.702 -0.135 2.147 1.00 0.00 H new ATOM 0 HA GLN A 772 2.963 -0.149 0.232 1.00 0.00 H new ATOM 0 HB2 GLN A 772 1.657 2.066 0.608 1.00 0.00 H new ATOM 0 HB3 GLN A 772 2.346 2.055 2.220 1.00 0.00 H new ATOM 0 HG2 GLN A 772 3.755 3.425 0.860 1.00 0.00 H new ATOM 0 HG3 GLN A 772 4.636 1.946 1.188 1.00 0.00 H new ATOM 0 HE21 GLN A 772 5.120 0.495 -0.476 1.00 0.00 H new ATOM 0 HE22 GLN A 772 4.857 0.893 -2.177 1.00 0.00 H new ATOM 506 N CYS A 773 4.635 -0.702 1.991 1.00 0.00 N ATOM 507 CA CYS A 773 5.566 -1.218 2.987 1.00 0.00 C ATOM 508 C CYS A 773 6.762 -0.285 3.148 1.00 0.00 C ATOM 509 O CYS A 773 6.926 0.669 2.387 1.00 0.00 O ATOM 510 CB CYS A 773 6.046 -2.616 2.591 1.00 0.00 C ATOM 511 SG CYS A 773 4.703 -3.828 2.370 1.00 0.00 S ATOM 0 H CYS A 773 5.014 -0.652 1.045 1.00 0.00 H new ATOM 0 HA CYS A 773 5.042 -1.277 3.941 1.00 0.00 H new ATOM 0 HB2 CYS A 773 6.613 -2.545 1.663 1.00 0.00 H new ATOM 0 HB3 CYS A 773 6.731 -2.984 3.355 1.00 0.00 H new ATOM 516 N ASP A 774 7.595 -0.567 4.144 1.00 0.00 N ATOM 517 CA ASP A 774 8.778 0.246 4.406 1.00 0.00 C ATOM 518 C ASP A 774 9.717 0.241 3.203 1.00 0.00 C ATOM 519 O ASP A 774 9.694 -0.665 2.370 1.00 0.00 O ATOM 520 CB ASP A 774 9.513 -0.269 5.644 1.00 0.00 C ATOM 521 CG ASP A 774 8.835 0.149 6.935 1.00 0.00 C ATOM 522 OD1 ASP A 774 8.424 1.324 7.035 1.00 0.00 O ATOM 523 OD2 ASP A 774 8.716 -0.699 7.844 1.00 0.00 O ATOM 0 H ASP A 774 7.473 -1.352 4.783 1.00 0.00 H new ATOM 0 HA ASP A 774 8.452 1.270 4.587 1.00 0.00 H new ATOM 0 HB2 ASP A 774 9.570 -1.357 5.603 1.00 0.00 H new ATOM 0 HB3 ASP A 774 10.537 0.105 5.637 1.00 0.00 H new ATOM 528 N PRO A 775 10.563 1.278 3.109 1.00 0.00 N ATOM 529 CA PRO A 775 11.525 1.417 2.012 1.00 0.00 C ATOM 530 C PRO A 775 12.644 0.384 2.089 1.00 0.00 C ATOM 531 O PRO A 775 13.399 0.342 3.059 1.00 0.00 O ATOM 532 CB PRO A 775 12.086 2.827 2.209 1.00 0.00 C ATOM 533 CG PRO A 775 11.904 3.108 3.660 1.00 0.00 C ATOM 534 CD PRO A 775 10.645 2.393 4.067 1.00 0.00 C ATOM 0 HA PRO A 775 11.059 1.261 1.039 1.00 0.00 H new ATOM 0 HB2 PRO A 775 13.137 2.878 1.925 1.00 0.00 H new ATOM 0 HB3 PRO A 775 11.554 3.554 1.595 1.00 0.00 H new ATOM 0 HG2 PRO A 775 12.758 2.752 4.236 1.00 0.00 H new ATOM 0 HG3 PRO A 775 11.820 4.179 3.842 1.00 0.00 H new ATOM 0 HD2 PRO A 775 10.700 2.036 5.096 1.00 0.00 H new ATOM 0 HD3 PRO A 775 9.774 3.044 4.001 1.00 0.00 H new ATOM 542 N GLY A 776 12.746 -0.450 1.057 1.00 0.00 N ATOM 543 CA GLY A 776 13.777 -1.471 1.028 1.00 0.00 C ATOM 544 C GLY A 776 13.202 -2.874 0.995 1.00 0.00 C ATOM 545 O GLY A 776 13.910 -3.835 0.695 1.00 0.00 O ATOM 0 H GLY A 776 12.133 -0.436 0.242 1.00 0.00 H new ATOM 0 HA2 GLY A 776 14.409 -1.320 0.153 1.00 0.00 H new ATOM 0 HA3 GLY A 776 14.415 -1.364 1.905 1.00 0.00 H new ATOM 549 N TYR A 777 11.916 -2.991 1.306 1.00 0.00 N ATOM 550 CA TYR A 777 11.247 -4.287 1.315 1.00 0.00 C ATOM 551 C TYR A 777 10.442 -4.493 0.037 1.00 0.00 C ATOM 552 O TYR A 777 10.360 -3.603 -0.810 1.00 0.00 O ATOM 553 CB TYR A 777 10.330 -4.403 2.534 1.00 0.00 C ATOM 554 CG TYR A 777 11.072 -4.627 3.832 1.00 0.00 C ATOM 555 CD1 TYR A 777 11.759 -3.590 4.451 1.00 0.00 C ATOM 556 CD2 TYR A 777 11.086 -5.877 4.439 1.00 0.00 C ATOM 557 CE1 TYR A 777 12.439 -3.792 5.637 1.00 0.00 C ATOM 558 CE2 TYR A 777 11.762 -6.087 5.625 1.00 0.00 C ATOM 559 CZ TYR A 777 12.438 -5.042 6.220 1.00 0.00 C ATOM 560 OH TYR A 777 13.113 -5.246 7.401 1.00 0.00 O ATOM 0 H TYR A 777 11.316 -2.205 1.555 1.00 0.00 H new ATOM 0 HA TYR A 777 12.012 -5.062 1.370 1.00 0.00 H new ATOM 0 HB2 TYR A 777 9.735 -3.494 2.618 1.00 0.00 H new ATOM 0 HB3 TYR A 777 9.633 -5.227 2.377 1.00 0.00 H new ATOM 0 HD1 TYR A 777 11.762 -2.610 3.998 1.00 0.00 H new ATOM 0 HD2 TYR A 777 10.559 -6.698 3.976 1.00 0.00 H new ATOM 0 HE1 TYR A 777 12.968 -2.975 6.105 1.00 0.00 H new ATOM 0 HE2 TYR A 777 11.761 -7.064 6.084 1.00 0.00 H new ATOM 0 HH TYR A 777 12.824 -6.093 7.801 1.00 0.00 H new ATOM 570 N ASP A 778 9.847 -5.674 -0.096 1.00 0.00 N ATOM 571 CA ASP A 778 9.045 -5.998 -1.270 1.00 0.00 C ATOM 572 C ASP A 778 7.722 -6.639 -0.865 1.00 0.00 C ATOM 573 O ASP A 778 7.597 -7.189 0.231 1.00 0.00 O ATOM 574 CB ASP A 778 9.818 -6.938 -2.198 1.00 0.00 C ATOM 575 CG ASP A 778 8.933 -7.557 -3.262 1.00 0.00 C ATOM 576 OD1 ASP A 778 8.353 -6.799 -4.067 1.00 0.00 O ATOM 577 OD2 ASP A 778 8.821 -8.801 -3.289 1.00 0.00 O ATOM 0 H ASP A 778 9.905 -6.422 0.595 1.00 0.00 H new ATOM 0 HA ASP A 778 8.831 -5.070 -1.800 1.00 0.00 H new ATOM 0 HB2 ASP A 778 10.627 -6.386 -2.678 1.00 0.00 H new ATOM 0 HB3 ASP A 778 10.279 -7.730 -1.607 1.00 0.00 H new ATOM 582 N ILE A 779 6.737 -6.564 -1.753 1.00 0.00 N ATOM 583 CA ILE A 779 5.423 -7.137 -1.487 1.00 0.00 C ATOM 584 C ILE A 779 5.283 -8.513 -2.130 1.00 0.00 C ATOM 585 O ILE A 779 5.724 -8.730 -3.259 1.00 0.00 O ATOM 586 CB ILE A 779 4.296 -6.224 -2.003 1.00 0.00 C ATOM 587 CG1 ILE A 779 4.256 -4.922 -1.200 1.00 0.00 C ATOM 588 CG2 ILE A 779 2.956 -6.941 -1.926 1.00 0.00 C ATOM 589 CD1 ILE A 779 2.931 -4.198 -1.287 1.00 0.00 C ATOM 0 H ILE A 779 6.824 -6.112 -2.663 1.00 0.00 H new ATOM 0 HA ILE A 779 5.334 -7.234 -0.405 1.00 0.00 H new ATOM 0 HB ILE A 779 4.496 -5.980 -3.046 1.00 0.00 H new ATOM 0 HG12 ILE A 779 4.472 -5.143 -0.155 1.00 0.00 H new ATOM 0 HG13 ILE A 779 5.046 -4.261 -1.556 1.00 0.00 H new ATOM 0 HG21 ILE A 779 2.169 -6.283 -2.294 1.00 0.00 H new ATOM 0 HG22 ILE A 779 2.990 -7.843 -2.537 1.00 0.00 H new ATOM 0 HG23 ILE A 779 2.747 -7.212 -0.891 1.00 0.00 H new ATOM 0 HD11 ILE A 779 2.976 -3.285 -0.694 1.00 0.00 H new ATOM 0 HD12 ILE A 779 2.722 -3.946 -2.327 1.00 0.00 H new ATOM 0 HD13 ILE A 779 2.139 -4.841 -0.903 1.00 0.00 H new ATOM 601 N VAL A 780 4.663 -9.439 -1.405 1.00 0.00 N ATOM 602 CA VAL A 780 4.461 -10.793 -1.906 1.00 0.00 C ATOM 603 C VAL A 780 2.978 -11.101 -2.075 1.00 0.00 C ATOM 604 O VAL A 780 2.232 -11.170 -1.099 1.00 0.00 O ATOM 605 CB VAL A 780 5.087 -11.839 -0.964 1.00 0.00 C ATOM 606 CG1 VAL A 780 4.861 -13.244 -1.500 1.00 0.00 C ATOM 607 CG2 VAL A 780 6.571 -11.564 -0.774 1.00 0.00 C ATOM 0 H VAL A 780 4.292 -9.276 -0.469 1.00 0.00 H new ATOM 0 HA VAL A 780 4.953 -10.848 -2.877 1.00 0.00 H new ATOM 0 HB VAL A 780 4.600 -11.765 0.008 1.00 0.00 H new ATOM 0 HG11 VAL A 780 5.310 -13.969 -0.821 1.00 0.00 H new ATOM 0 HG12 VAL A 780 3.791 -13.436 -1.579 1.00 0.00 H new ATOM 0 HG13 VAL A 780 5.320 -13.336 -2.484 1.00 0.00 H new ATOM 0 HG21 VAL A 780 6.997 -12.312 -0.106 1.00 0.00 H new ATOM 0 HG22 VAL A 780 7.076 -11.610 -1.739 1.00 0.00 H new ATOM 0 HG23 VAL A 780 6.705 -10.573 -0.341 1.00 0.00 H new ATOM 617 N GLY A 781 2.556 -11.285 -3.323 1.00 0.00 N ATOM 618 CA GLY A 781 1.163 -11.583 -3.598 1.00 0.00 C ATOM 619 C GLY A 781 0.486 -10.497 -4.411 1.00 0.00 C ATOM 620 O GLY A 781 1.098 -9.906 -5.300 1.00 0.00 O ATOM 0 H GLY A 781 3.154 -11.233 -4.148 1.00 0.00 H new ATOM 0 HA2 GLY A 781 1.096 -12.529 -4.135 1.00 0.00 H new ATOM 0 HA3 GLY A 781 0.630 -11.713 -2.656 1.00 0.00 H new ATOM 624 N SER A 782 -0.781 -10.235 -4.106 1.00 0.00 N ATOM 625 CA SER A 782 -1.543 -9.216 -4.819 1.00 0.00 C ATOM 626 C SER A 782 -1.559 -7.905 -4.038 1.00 0.00 C ATOM 627 O SER A 782 -2.289 -7.763 -3.057 1.00 0.00 O ATOM 628 CB SER A 782 -2.975 -9.696 -5.061 1.00 0.00 C ATOM 629 OG SER A 782 -3.029 -10.614 -6.139 1.00 0.00 O ATOM 0 H SER A 782 -1.301 -10.714 -3.371 1.00 0.00 H new ATOM 0 HA SER A 782 -1.059 -9.041 -5.780 1.00 0.00 H new ATOM 0 HB2 SER A 782 -3.361 -10.168 -4.158 1.00 0.00 H new ATOM 0 HB3 SER A 782 -3.617 -8.842 -5.274 1.00 0.00 H new ATOM 0 HG SER A 782 -3.954 -10.907 -6.273 1.00 0.00 H new ATOM 635 N ASP A 783 -0.749 -6.950 -4.482 1.00 0.00 N ATOM 636 CA ASP A 783 -0.670 -5.649 -3.827 1.00 0.00 C ATOM 637 C ASP A 783 -2.038 -4.975 -3.790 1.00 0.00 C ATOM 638 O ASP A 783 -2.510 -4.560 -2.731 1.00 0.00 O ATOM 639 CB ASP A 783 0.335 -4.751 -4.549 1.00 0.00 C ATOM 640 CG ASP A 783 0.026 -4.606 -6.026 1.00 0.00 C ATOM 641 OD1 ASP A 783 0.491 -5.455 -6.815 1.00 0.00 O ATOM 642 OD2 ASP A 783 -0.680 -3.644 -6.393 1.00 0.00 O ATOM 0 H ASP A 783 -0.138 -7.052 -5.292 1.00 0.00 H new ATOM 0 HA ASP A 783 -0.334 -5.806 -2.802 1.00 0.00 H new ATOM 0 HB2 ASP A 783 0.337 -3.766 -4.083 1.00 0.00 H new ATOM 0 HB3 ASP A 783 1.337 -5.163 -4.429 1.00 0.00 H new ATOM 647 N THR A 784 -2.672 -4.868 -4.954 1.00 0.00 N ATOM 648 CA THR A 784 -3.984 -4.243 -5.056 1.00 0.00 C ATOM 649 C THR A 784 -5.095 -5.249 -4.778 1.00 0.00 C ATOM 650 O THR A 784 -5.009 -6.411 -5.177 1.00 0.00 O ATOM 651 CB THR A 784 -4.205 -3.623 -6.448 1.00 0.00 C ATOM 652 OG1 THR A 784 -3.142 -2.713 -6.753 1.00 0.00 O ATOM 653 CG2 THR A 784 -5.538 -2.893 -6.511 1.00 0.00 C ATOM 0 H THR A 784 -2.297 -5.207 -5.840 1.00 0.00 H new ATOM 0 HA THR A 784 -4.016 -3.453 -4.306 1.00 0.00 H new ATOM 0 HB THR A 784 -4.216 -4.428 -7.182 1.00 0.00 H new ATOM 0 HG1 THR A 784 -2.301 -3.209 -6.836 1.00 0.00 H new ATOM 0 HG21 THR A 784 -5.671 -2.464 -7.504 1.00 0.00 H new ATOM 0 HG22 THR A 784 -6.347 -3.595 -6.308 1.00 0.00 H new ATOM 0 HG23 THR A 784 -5.552 -2.097 -5.767 1.00 0.00 H new ATOM 661 N LEU A 785 -6.139 -4.796 -4.093 1.00 0.00 N ATOM 662 CA LEU A 785 -7.270 -5.657 -3.762 1.00 0.00 C ATOM 663 C LEU A 785 -8.591 -4.974 -4.099 1.00 0.00 C ATOM 664 O LEU A 785 -8.964 -3.977 -3.478 1.00 0.00 O ATOM 665 CB LEU A 785 -7.237 -6.028 -2.278 1.00 0.00 C ATOM 666 CG LEU A 785 -6.173 -7.045 -1.864 1.00 0.00 C ATOM 667 CD1 LEU A 785 -4.782 -6.529 -2.197 1.00 0.00 C ATOM 668 CD2 LEU A 785 -6.286 -7.359 -0.379 1.00 0.00 C ATOM 0 H LEU A 785 -6.226 -3.837 -3.756 1.00 0.00 H new ATOM 0 HA LEU A 785 -7.190 -6.566 -4.359 1.00 0.00 H new ATOM 0 HB2 LEU A 785 -7.085 -5.117 -1.700 1.00 0.00 H new ATOM 0 HB3 LEU A 785 -8.215 -6.422 -2.001 1.00 0.00 H new ATOM 0 HG LEU A 785 -6.340 -7.965 -2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 785 -4.038 -7.267 -1.895 1.00 0.00 H new ATOM 0 HD12 LEU A 785 -4.706 -6.355 -3.270 1.00 0.00 H new ATOM 0 HD13 LEU A 785 -4.603 -5.595 -1.665 1.00 0.00 H new ATOM 0 HD21 LEU A 785 -5.521 -8.084 -0.101 1.00 0.00 H new ATOM 0 HD22 LEU A 785 -6.146 -6.445 0.198 1.00 0.00 H new ATOM 0 HD23 LEU A 785 -7.272 -7.773 -0.169 1.00 0.00 H new ATOM 680 N THR A 786 -9.299 -5.518 -5.084 1.00 0.00 N ATOM 681 CA THR A 786 -10.579 -4.962 -5.503 1.00 0.00 C ATOM 682 C THR A 786 -11.740 -5.696 -4.840 1.00 0.00 C ATOM 683 O THR A 786 -11.613 -6.858 -4.454 1.00 0.00 O ATOM 684 CB THR A 786 -10.749 -5.031 -7.032 1.00 0.00 C ATOM 685 OG1 THR A 786 -9.610 -4.451 -7.678 1.00 0.00 O ATOM 686 CG2 THR A 786 -12.012 -4.304 -7.470 1.00 0.00 C ATOM 0 H THR A 786 -9.007 -6.344 -5.607 1.00 0.00 H new ATOM 0 HA THR A 786 -10.587 -3.917 -5.192 1.00 0.00 H new ATOM 0 HB THR A 786 -10.835 -6.079 -7.319 1.00 0.00 H new ATOM 0 HG1 THR A 786 -9.725 -4.500 -8.650 1.00 0.00 H new ATOM 0 HG21 THR A 786 -12.110 -4.366 -8.554 1.00 0.00 H new ATOM 0 HG22 THR A 786 -12.880 -4.766 -7.000 1.00 0.00 H new ATOM 0 HG23 THR A 786 -11.952 -3.258 -7.171 1.00 0.00 H new ATOM 694 N CYS A 787 -12.871 -5.010 -4.712 1.00 0.00 N ATOM 695 CA CYS A 787 -14.055 -5.597 -4.097 1.00 0.00 C ATOM 696 C CYS A 787 -14.995 -6.164 -5.157 1.00 0.00 C ATOM 697 O CYS A 787 -15.624 -5.417 -5.905 1.00 0.00 O ATOM 698 CB CYS A 787 -14.790 -4.551 -3.256 1.00 0.00 C ATOM 699 SG CYS A 787 -15.828 -5.254 -1.935 1.00 0.00 S ATOM 0 H CYS A 787 -12.992 -4.047 -5.026 1.00 0.00 H new ATOM 0 HA CYS A 787 -13.731 -6.412 -3.450 1.00 0.00 H new ATOM 0 HB2 CYS A 787 -14.057 -3.880 -2.809 1.00 0.00 H new ATOM 0 HB3 CYS A 787 -15.416 -3.947 -3.913 1.00 0.00 H new ATOM 704 N GLN A 788 -15.084 -7.489 -5.213 1.00 0.00 N ATOM 705 CA GLN A 788 -15.946 -8.156 -6.181 1.00 0.00 C ATOM 706 C GLN A 788 -17.406 -7.772 -5.965 1.00 0.00 C ATOM 707 O GLN A 788 -17.721 -6.949 -5.106 1.00 0.00 O ATOM 708 CB GLN A 788 -15.784 -9.674 -6.079 1.00 0.00 C ATOM 709 CG GLN A 788 -14.652 -10.224 -6.932 1.00 0.00 C ATOM 710 CD GLN A 788 -14.903 -11.647 -7.388 1.00 0.00 C ATOM 711 OE1 GLN A 788 -16.050 -12.070 -7.538 1.00 0.00 O ATOM 712 NE2 GLN A 788 -13.829 -12.396 -7.611 1.00 0.00 N ATOM 0 H GLN A 788 -14.570 -8.121 -4.600 1.00 0.00 H new ATOM 0 HA GLN A 788 -15.649 -7.833 -7.179 1.00 0.00 H new ATOM 0 HB2 GLN A 788 -15.607 -9.943 -5.038 1.00 0.00 H new ATOM 0 HB3 GLN A 788 -16.717 -10.151 -6.377 1.00 0.00 H new ATOM 0 HG2 GLN A 788 -14.517 -9.585 -7.805 1.00 0.00 H new ATOM 0 HG3 GLN A 788 -13.723 -10.187 -6.363 1.00 0.00 H new ATOM 0 HE21 GLN A 788 -12.897 -12.005 -7.474 1.00 0.00 H new ATOM 0 HE22 GLN A 788 -13.936 -13.362 -7.919 1.00 0.00 H new ATOM 721 N TRP A 789 -18.293 -8.374 -6.750 1.00 0.00 N ATOM 722 CA TRP A 789 -19.720 -8.095 -6.644 1.00 0.00 C ATOM 723 C TRP A 789 -20.291 -8.659 -5.347 1.00 0.00 C ATOM 724 O TRP A 789 -21.284 -8.154 -4.823 1.00 0.00 O ATOM 725 CB TRP A 789 -20.466 -8.683 -7.842 1.00 0.00 C ATOM 726 CG TRP A 789 -20.362 -7.841 -9.078 1.00 0.00 C ATOM 727 CD1 TRP A 789 -19.216 -7.459 -9.715 1.00 0.00 C ATOM 728 CD2 TRP A 789 -21.445 -7.277 -9.825 1.00 0.00 C ATOM 729 NE1 TRP A 789 -19.522 -6.691 -10.812 1.00 0.00 N ATOM 730 CE2 TRP A 789 -20.883 -6.565 -10.902 1.00 0.00 C ATOM 731 CE3 TRP A 789 -22.836 -7.306 -9.690 1.00 0.00 C ATOM 732 CZ2 TRP A 789 -21.663 -5.889 -11.836 1.00 0.00 C ATOM 733 CZ3 TRP A 789 -23.609 -6.634 -10.617 1.00 0.00 C ATOM 734 CH2 TRP A 789 -23.022 -5.933 -11.679 1.00 0.00 C ATOM 0 H TRP A 789 -18.049 -9.058 -7.466 1.00 0.00 H new ATOM 0 HA TRP A 789 -19.853 -7.013 -6.637 1.00 0.00 H new ATOM 0 HB2 TRP A 789 -20.072 -9.677 -8.054 1.00 0.00 H new ATOM 0 HB3 TRP A 789 -21.517 -8.805 -7.582 1.00 0.00 H new ATOM 0 HD1 TRP A 789 -18.216 -7.722 -9.402 1.00 0.00 H new ATOM 0 HE1 TRP A 789 -18.845 -6.281 -11.456 1.00 0.00 H new ATOM 0 HE3 TRP A 789 -23.298 -7.844 -8.876 1.00 0.00 H new ATOM 0 HZ2 TRP A 789 -21.212 -5.349 -12.655 1.00 0.00 H new ATOM 0 HZ3 TRP A 789 -24.685 -6.649 -10.522 1.00 0.00 H new ATOM 0 HH2 TRP A 789 -23.654 -5.418 -12.387 1.00 0.00 H new ATOM 745 N ASP A 790 -19.657 -9.708 -4.834 1.00 0.00 N ATOM 746 CA ASP A 790 -20.101 -10.340 -3.598 1.00 0.00 C ATOM 747 C ASP A 790 -19.486 -9.651 -2.384 1.00 0.00 C ATOM 748 O ASP A 790 -19.412 -10.230 -1.299 1.00 0.00 O ATOM 749 CB ASP A 790 -19.733 -11.825 -3.598 1.00 0.00 C ATOM 750 CG ASP A 790 -18.370 -12.083 -4.208 1.00 0.00 C ATOM 751 OD1 ASP A 790 -17.559 -11.135 -4.271 1.00 0.00 O ATOM 752 OD2 ASP A 790 -18.113 -13.233 -4.621 1.00 0.00 O ATOM 0 H ASP A 790 -18.834 -10.138 -5.256 1.00 0.00 H new ATOM 0 HA ASP A 790 -21.185 -10.242 -3.538 1.00 0.00 H new ATOM 0 HB2 ASP A 790 -19.747 -12.200 -2.575 1.00 0.00 H new ATOM 0 HB3 ASP A 790 -20.488 -12.383 -4.152 1.00 0.00 H new ATOM 757 N LEU A 791 -19.046 -8.412 -2.573 1.00 0.00 N ATOM 758 CA LEU A 791 -18.436 -7.643 -1.494 1.00 0.00 C ATOM 759 C LEU A 791 -17.315 -8.435 -0.827 1.00 0.00 C ATOM 760 O LEU A 791 -17.214 -8.475 0.399 1.00 0.00 O ATOM 761 CB LEU A 791 -19.491 -7.259 -0.455 1.00 0.00 C ATOM 762 CG LEU A 791 -20.740 -6.561 -0.995 1.00 0.00 C ATOM 763 CD1 LEU A 791 -21.733 -6.302 0.127 1.00 0.00 C ATOM 764 CD2 LEU A 791 -20.367 -5.260 -1.690 1.00 0.00 C ATOM 0 H LEU A 791 -19.100 -7.918 -3.464 1.00 0.00 H new ATOM 0 HA LEU A 791 -18.010 -6.736 -1.923 1.00 0.00 H new ATOM 0 HB2 LEU A 791 -19.802 -8.163 0.069 1.00 0.00 H new ATOM 0 HB3 LEU A 791 -19.025 -6.607 0.283 1.00 0.00 H new ATOM 0 HG LEU A 791 -21.212 -7.217 -1.726 1.00 0.00 H new ATOM 0 HD11 LEU A 791 -22.615 -5.805 -0.276 1.00 0.00 H new ATOM 0 HD12 LEU A 791 -22.025 -7.249 0.580 1.00 0.00 H new ATOM 0 HD13 LEU A 791 -21.271 -5.666 0.882 1.00 0.00 H new ATOM 0 HD21 LEU A 791 -21.269 -4.778 -2.068 1.00 0.00 H new ATOM 0 HD22 LEU A 791 -19.871 -4.598 -0.980 1.00 0.00 H new ATOM 0 HD23 LEU A 791 -19.694 -5.471 -2.521 1.00 0.00 H new ATOM 776 N SER A 792 -16.475 -9.063 -1.644 1.00 0.00 N ATOM 777 CA SER A 792 -15.362 -9.855 -1.133 1.00 0.00 C ATOM 778 C SER A 792 -14.060 -9.476 -1.832 1.00 0.00 C ATOM 779 O SER A 792 -14.070 -8.964 -2.952 1.00 0.00 O ATOM 780 CB SER A 792 -15.641 -11.347 -1.324 1.00 0.00 C ATOM 781 OG SER A 792 -14.507 -12.126 -0.984 1.00 0.00 O ATOM 0 H SER A 792 -16.544 -9.039 -2.661 1.00 0.00 H new ATOM 0 HA SER A 792 -15.257 -9.645 -0.069 1.00 0.00 H new ATOM 0 HB2 SER A 792 -16.488 -11.644 -0.706 1.00 0.00 H new ATOM 0 HB3 SER A 792 -15.920 -11.538 -2.360 1.00 0.00 H new ATOM 0 HG SER A 792 -14.712 -13.076 -1.113 1.00 0.00 H new ATOM 787 N TRP A 793 -12.941 -9.732 -1.164 1.00 0.00 N ATOM 788 CA TRP A 793 -11.630 -9.418 -1.720 1.00 0.00 C ATOM 789 C TRP A 793 -11.142 -10.540 -2.630 1.00 0.00 C ATOM 790 O TRP A 793 -11.209 -11.716 -2.272 1.00 0.00 O ATOM 791 CB TRP A 793 -10.620 -9.181 -0.597 1.00 0.00 C ATOM 792 CG TRP A 793 -10.957 -8.002 0.265 1.00 0.00 C ATOM 793 CD1 TRP A 793 -11.240 -8.017 1.601 1.00 0.00 C ATOM 794 CD2 TRP A 793 -11.047 -6.635 -0.150 1.00 0.00 C ATOM 795 NE1 TRP A 793 -11.501 -6.742 2.041 1.00 0.00 N ATOM 796 CE2 TRP A 793 -11.389 -5.875 0.986 1.00 0.00 C ATOM 797 CE3 TRP A 793 -10.872 -5.977 -1.371 1.00 0.00 C ATOM 798 CZ2 TRP A 793 -11.558 -4.494 0.935 1.00 0.00 C ATOM 799 CZ3 TRP A 793 -11.040 -4.607 -1.420 1.00 0.00 C ATOM 800 CH2 TRP A 793 -11.380 -3.877 -0.273 1.00 0.00 C ATOM 0 H TRP A 793 -12.915 -10.156 -0.237 1.00 0.00 H new ATOM 0 HA TRP A 793 -11.723 -8.508 -2.313 1.00 0.00 H new ATOM 0 HB2 TRP A 793 -10.564 -10.074 0.026 1.00 0.00 H new ATOM 0 HB3 TRP A 793 -9.632 -9.033 -1.032 1.00 0.00 H new ATOM 0 HD1 TRP A 793 -11.256 -8.901 2.221 1.00 0.00 H new ATOM 0 HE1 TRP A 793 -11.740 -6.483 2.998 1.00 0.00 H new ATOM 0 HE3 TRP A 793 -10.610 -6.530 -2.261 1.00 0.00 H new ATOM 0 HZ2 TRP A 793 -11.820 -3.930 1.818 1.00 0.00 H new ATOM 0 HZ3 TRP A 793 -10.907 -4.089 -2.358 1.00 0.00 H new ATOM 0 HH2 TRP A 793 -11.504 -2.806 -0.344 1.00 0.00 H new ATOM 811 N SER A 794 -10.651 -10.170 -3.809 1.00 0.00 N ATOM 812 CA SER A 794 -10.155 -11.146 -4.771 1.00 0.00 C ATOM 813 C SER A 794 -9.436 -12.290 -4.063 1.00 0.00 C ATOM 814 O SER A 794 -9.696 -13.463 -4.333 1.00 0.00 O ATOM 815 CB SER A 794 -9.210 -10.475 -5.769 1.00 0.00 C ATOM 816 OG SER A 794 -8.659 -11.423 -6.668 1.00 0.00 O ATOM 0 H SER A 794 -10.586 -9.201 -4.120 1.00 0.00 H new ATOM 0 HA SER A 794 -11.010 -11.555 -5.309 1.00 0.00 H new ATOM 0 HB2 SER A 794 -9.750 -9.710 -6.328 1.00 0.00 H new ATOM 0 HB3 SER A 794 -8.407 -9.970 -5.231 1.00 0.00 H new ATOM 0 HG SER A 794 -8.060 -10.968 -7.296 1.00 0.00 H new ATOM 822 N SER A 795 -8.530 -11.940 -3.155 1.00 0.00 N ATOM 823 CA SER A 795 -7.770 -12.937 -2.410 1.00 0.00 C ATOM 824 C SER A 795 -7.233 -12.348 -1.109 1.00 0.00 C ATOM 825 O SER A 795 -7.373 -11.153 -0.851 1.00 0.00 O ATOM 826 CB SER A 795 -6.613 -13.466 -3.260 1.00 0.00 C ATOM 827 OG SER A 795 -6.061 -14.642 -2.693 1.00 0.00 O ATOM 0 H SER A 795 -8.305 -10.974 -2.918 1.00 0.00 H new ATOM 0 HA SER A 795 -8.439 -13.762 -2.166 1.00 0.00 H new ATOM 0 HB2 SER A 795 -6.966 -13.676 -4.270 1.00 0.00 H new ATOM 0 HB3 SER A 795 -5.840 -12.702 -3.345 1.00 0.00 H new ATOM 0 HG SER A 795 -5.325 -14.962 -3.255 1.00 0.00 H new ATOM 833 N ASP A 796 -6.617 -13.197 -0.293 1.00 0.00 N ATOM 834 CA ASP A 796 -6.057 -12.763 0.981 1.00 0.00 C ATOM 835 C ASP A 796 -5.122 -11.574 0.787 1.00 0.00 C ATOM 836 O ASP A 796 -4.576 -11.352 -0.294 1.00 0.00 O ATOM 837 CB ASP A 796 -5.306 -13.915 1.651 1.00 0.00 C ATOM 838 CG ASP A 796 -6.228 -14.836 2.425 1.00 0.00 C ATOM 839 OD1 ASP A 796 -6.853 -15.716 1.796 1.00 0.00 O ATOM 840 OD2 ASP A 796 -6.325 -14.677 3.659 1.00 0.00 O ATOM 0 H ASP A 796 -6.493 -14.190 -0.492 1.00 0.00 H new ATOM 0 HA ASP A 796 -6.880 -12.453 1.625 1.00 0.00 H new ATOM 0 HB2 ASP A 796 -4.777 -14.490 0.891 1.00 0.00 H new ATOM 0 HB3 ASP A 796 -4.552 -13.509 2.326 1.00 0.00 H new ATOM 845 N PRO A 797 -4.933 -10.789 1.858 1.00 0.00 N ATOM 846 CA PRO A 797 -4.064 -9.608 1.830 1.00 0.00 C ATOM 847 C PRO A 797 -2.589 -9.976 1.716 1.00 0.00 C ATOM 848 O PRO A 797 -2.133 -10.985 2.255 1.00 0.00 O ATOM 849 CB PRO A 797 -4.344 -8.930 3.173 1.00 0.00 C ATOM 850 CG PRO A 797 -4.809 -10.030 4.063 1.00 0.00 C ATOM 851 CD PRO A 797 -5.551 -10.993 3.178 1.00 0.00 C ATOM 0 HA PRO A 797 -4.266 -8.974 0.967 1.00 0.00 H new ATOM 0 HB2 PRO A 797 -3.448 -8.452 3.569 1.00 0.00 H new ATOM 0 HB3 PRO A 797 -5.102 -8.153 3.074 1.00 0.00 H new ATOM 0 HG2 PRO A 797 -3.966 -10.519 4.552 1.00 0.00 H new ATOM 0 HG3 PRO A 797 -5.456 -9.647 4.852 1.00 0.00 H new ATOM 0 HD2 PRO A 797 -5.438 -12.022 3.520 1.00 0.00 H new ATOM 0 HD3 PRO A 797 -6.620 -10.779 3.159 1.00 0.00 H new ATOM 859 N PRO A 798 -1.823 -9.140 1.000 1.00 0.00 N ATOM 860 CA PRO A 798 -0.387 -9.357 0.800 1.00 0.00 C ATOM 861 C PRO A 798 0.415 -9.150 2.081 1.00 0.00 C ATOM 862 O PRO A 798 -0.150 -9.063 3.171 1.00 0.00 O ATOM 863 CB PRO A 798 -0.010 -8.302 -0.242 1.00 0.00 C ATOM 864 CG PRO A 798 -1.028 -7.226 -0.078 1.00 0.00 C ATOM 865 CD PRO A 798 -2.299 -7.919 0.330 1.00 0.00 C ATOM 0 HA PRO A 798 -0.169 -10.379 0.490 1.00 0.00 H new ATOM 0 HB2 PRO A 798 0.998 -7.922 -0.074 1.00 0.00 H new ATOM 0 HB3 PRO A 798 -0.031 -8.716 -1.250 1.00 0.00 H new ATOM 0 HG2 PRO A 798 -0.716 -6.505 0.678 1.00 0.00 H new ATOM 0 HG3 PRO A 798 -1.165 -6.674 -1.008 1.00 0.00 H new ATOM 0 HD2 PRO A 798 -2.897 -7.300 1.000 1.00 0.00 H new ATOM 0 HD3 PRO A 798 -2.924 -8.152 -0.532 1.00 0.00 H new ATOM 873 N PHE A 799 1.734 -9.072 1.942 1.00 0.00 N ATOM 874 CA PHE A 799 2.613 -8.876 3.089 1.00 0.00 C ATOM 875 C PHE A 799 3.970 -8.333 2.648 1.00 0.00 C ATOM 876 O PHE A 799 4.318 -8.386 1.468 1.00 0.00 O ATOM 877 CB PHE A 799 2.799 -10.192 3.847 1.00 0.00 C ATOM 878 CG PHE A 799 2.864 -11.395 2.951 1.00 0.00 C ATOM 879 CD1 PHE A 799 1.713 -11.912 2.378 1.00 0.00 C ATOM 880 CD2 PHE A 799 4.076 -12.011 2.682 1.00 0.00 C ATOM 881 CE1 PHE A 799 1.769 -13.019 1.553 1.00 0.00 C ATOM 882 CE2 PHE A 799 4.138 -13.118 1.857 1.00 0.00 C ATOM 883 CZ PHE A 799 2.983 -13.624 1.293 1.00 0.00 C ATOM 0 H PHE A 799 2.218 -9.141 1.047 1.00 0.00 H new ATOM 0 HA PHE A 799 2.147 -8.146 3.751 1.00 0.00 H new ATOM 0 HB2 PHE A 799 3.715 -10.137 4.435 1.00 0.00 H new ATOM 0 HB3 PHE A 799 1.976 -10.317 4.550 1.00 0.00 H new ATOM 0 HD1 PHE A 799 0.761 -11.444 2.579 1.00 0.00 H new ATOM 0 HD2 PHE A 799 4.982 -11.622 3.122 1.00 0.00 H new ATOM 0 HE1 PHE A 799 0.864 -13.411 1.112 1.00 0.00 H new ATOM 0 HE2 PHE A 799 5.089 -13.587 1.653 1.00 0.00 H new ATOM 0 HZ PHE A 799 3.029 -14.491 0.650 1.00 0.00 H new ATOM 893 N CYS A 800 4.731 -7.812 3.604 1.00 0.00 N ATOM 894 CA CYS A 800 6.048 -7.258 3.316 1.00 0.00 C ATOM 895 C CYS A 800 7.148 -8.238 3.714 1.00 0.00 C ATOM 896 O CYS A 800 7.125 -8.802 4.807 1.00 0.00 O ATOM 897 CB CYS A 800 6.240 -5.932 4.055 1.00 0.00 C ATOM 898 SG CYS A 800 4.746 -4.892 4.115 1.00 0.00 S ATOM 0 H CYS A 800 4.458 -7.762 4.586 1.00 0.00 H new ATOM 0 HA CYS A 800 6.113 -7.080 2.243 1.00 0.00 H new ATOM 0 HB2 CYS A 800 6.566 -6.140 5.074 1.00 0.00 H new ATOM 0 HB3 CYS A 800 7.041 -5.372 3.572 1.00 0.00 H new ATOM 903 N GLU A 801 8.110 -8.435 2.817 1.00 0.00 N ATOM 904 CA GLU A 801 9.219 -9.347 3.075 1.00 0.00 C ATOM 905 C GLU A 801 10.504 -8.837 2.430 1.00 0.00 C ATOM 906 O GLU A 801 10.488 -8.315 1.315 1.00 0.00 O ATOM 907 CB GLU A 801 8.890 -10.745 2.548 1.00 0.00 C ATOM 908 CG GLU A 801 10.072 -11.700 2.578 1.00 0.00 C ATOM 909 CD GLU A 801 10.389 -12.193 3.976 1.00 0.00 C ATOM 910 OE1 GLU A 801 10.712 -11.352 4.842 1.00 0.00 O ATOM 911 OE2 GLU A 801 10.314 -13.418 4.206 1.00 0.00 O ATOM 0 H GLU A 801 8.144 -7.976 1.907 1.00 0.00 H new ATOM 0 HA GLU A 801 9.371 -9.399 4.153 1.00 0.00 H new ATOM 0 HB2 GLU A 801 8.078 -11.166 3.141 1.00 0.00 H new ATOM 0 HB3 GLU A 801 8.527 -10.662 1.524 1.00 0.00 H new ATOM 0 HG2 GLU A 801 9.860 -12.554 1.935 1.00 0.00 H new ATOM 0 HG3 GLU A 801 10.949 -11.200 2.166 1.00 0.00 H new ATOM 918 N LYS A 802 11.617 -8.991 3.139 1.00 0.00 N ATOM 919 CA LYS A 802 12.912 -8.548 2.638 1.00 0.00 C ATOM 920 C LYS A 802 13.258 -9.249 1.328 1.00 0.00 C ATOM 921 O LYS A 802 13.129 -10.469 1.212 1.00 0.00 O ATOM 922 CB LYS A 802 14.003 -8.817 3.677 1.00 0.00 C ATOM 923 CG LYS A 802 15.321 -8.127 3.368 1.00 0.00 C ATOM 924 CD LYS A 802 15.380 -6.739 3.983 1.00 0.00 C ATOM 925 CE LYS A 802 15.909 -6.782 5.408 1.00 0.00 C ATOM 926 NZ LYS A 802 14.877 -7.261 6.369 1.00 0.00 N ATOM 0 H LYS A 802 11.648 -9.420 4.064 1.00 0.00 H new ATOM 0 HA LYS A 802 12.854 -7.476 2.451 1.00 0.00 H new ATOM 0 HB2 LYS A 802 13.651 -8.488 4.655 1.00 0.00 H new ATOM 0 HB3 LYS A 802 14.172 -9.892 3.744 1.00 0.00 H new ATOM 0 HG2 LYS A 802 16.146 -8.730 3.747 1.00 0.00 H new ATOM 0 HG3 LYS A 802 15.450 -8.054 2.288 1.00 0.00 H new ATOM 0 HD2 LYS A 802 16.019 -6.098 3.376 1.00 0.00 H new ATOM 0 HD3 LYS A 802 14.385 -6.295 3.977 1.00 0.00 H new ATOM 0 HE2 LYS A 802 16.779 -7.437 5.453 1.00 0.00 H new ATOM 0 HE3 LYS A 802 16.244 -5.787 5.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 802 15.222 -7.133 7.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 802 14.001 -6.716 6.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 802 14.686 -8.269 6.200 1.00 0.00 H new ATOM 940 N THR A 803 13.698 -8.472 0.344 1.00 0.00 N ATOM 941 CA THR A 803 14.063 -9.019 -0.957 1.00 0.00 C ATOM 942 C THR A 803 15.067 -10.157 -0.813 1.00 0.00 C ATOM 943 O THR A 803 15.936 -10.123 0.057 1.00 0.00 O ATOM 944 CB THR A 803 14.660 -7.935 -1.874 1.00 0.00 C ATOM 945 OG1 THR A 803 13.900 -6.727 -1.764 1.00 0.00 O ATOM 946 CG2 THR A 803 14.675 -8.401 -3.323 1.00 0.00 C ATOM 0 H THR A 803 13.810 -7.461 0.423 1.00 0.00 H new ATOM 0 HA THR A 803 13.147 -9.402 -1.408 1.00 0.00 H new ATOM 0 HB THR A 803 15.686 -7.748 -1.558 1.00 0.00 H new ATOM 0 HG1 THR A 803 14.287 -6.043 -2.349 1.00 0.00 H new ATOM 0 HG21 THR A 803 15.101 -7.619 -3.952 1.00 0.00 H new ATOM 0 HG22 THR A 803 15.279 -9.305 -3.408 1.00 0.00 H new ATOM 0 HG23 THR A 803 13.656 -8.613 -3.647 1.00 0.00 H new ATOM 954 N GLU A 804 14.940 -11.163 -1.672 1.00 0.00 N ATOM 955 CA GLU A 804 15.838 -12.312 -1.640 1.00 0.00 C ATOM 956 C GLU A 804 16.855 -12.241 -2.775 1.00 0.00 C ATOM 957 O GLU A 804 17.221 -13.260 -3.358 1.00 0.00 O ATOM 958 CB GLU A 804 15.040 -13.614 -1.737 1.00 0.00 C ATOM 959 CG GLU A 804 14.251 -13.750 -3.028 1.00 0.00 C ATOM 960 CD GLU A 804 15.060 -14.385 -4.142 1.00 0.00 C ATOM 961 OE1 GLU A 804 15.662 -15.453 -3.904 1.00 0.00 O ATOM 962 OE2 GLU A 804 15.092 -13.813 -5.252 1.00 0.00 O ATOM 0 H GLU A 804 14.225 -11.206 -2.398 1.00 0.00 H new ATOM 0 HA GLU A 804 16.376 -12.293 -0.692 1.00 0.00 H new ATOM 0 HB2 GLU A 804 15.725 -14.457 -1.649 1.00 0.00 H new ATOM 0 HB3 GLU A 804 14.353 -13.673 -0.893 1.00 0.00 H new ATOM 0 HG2 GLU A 804 13.360 -14.350 -2.843 1.00 0.00 H new ATOM 0 HG3 GLU A 804 13.911 -12.765 -3.347 1.00 0.00 H new ATOM 969 N GLU A 805 17.305 -11.028 -3.083 1.00 0.00 N ATOM 970 CA GLU A 805 18.278 -10.824 -4.149 1.00 0.00 C ATOM 971 C GLU A 805 19.672 -11.259 -3.705 1.00 0.00 C ATOM 972 O GLU A 805 19.954 -11.349 -2.511 1.00 0.00 O ATOM 973 CB GLU A 805 18.302 -9.354 -4.573 1.00 0.00 C ATOM 974 CG GLU A 805 19.221 -9.074 -5.751 1.00 0.00 C ATOM 975 CD GLU A 805 19.040 -7.678 -6.313 1.00 0.00 C ATOM 976 OE1 GLU A 805 18.149 -7.493 -7.168 1.00 0.00 O ATOM 977 OE2 GLU A 805 19.791 -6.770 -5.898 1.00 0.00 O ATOM 0 H GLU A 805 17.011 -10.173 -2.610 1.00 0.00 H new ATOM 0 HA GLU A 805 17.979 -11.436 -5.000 1.00 0.00 H new ATOM 0 HB2 GLU A 805 17.290 -9.043 -4.831 1.00 0.00 H new ATOM 0 HB3 GLU A 805 18.616 -8.745 -3.725 1.00 0.00 H new ATOM 0 HG2 GLU A 805 20.257 -9.204 -5.438 1.00 0.00 H new ATOM 0 HG3 GLU A 805 19.031 -9.805 -6.537 1.00 0.00 H new ATOM 984 N SER A 806 20.539 -11.528 -4.676 1.00 0.00 N ATOM 985 CA SER A 806 21.901 -11.958 -4.386 1.00 0.00 C ATOM 986 C SER A 806 22.902 -10.858 -4.726 1.00 0.00 C ATOM 987 O SER A 806 23.020 -10.444 -5.878 1.00 0.00 O ATOM 988 CB SER A 806 22.236 -13.228 -5.172 1.00 0.00 C ATOM 989 OG SER A 806 23.496 -13.749 -4.787 1.00 0.00 O ATOM 0 H SER A 806 20.322 -11.456 -5.670 1.00 0.00 H new ATOM 0 HA SER A 806 21.969 -12.171 -3.319 1.00 0.00 H new ATOM 0 HB2 SER A 806 21.463 -13.978 -5.005 1.00 0.00 H new ATOM 0 HB3 SER A 806 22.241 -13.008 -6.240 1.00 0.00 H new ATOM 0 HG SER A 806 23.686 -14.561 -5.302 1.00 0.00 H new ATOM 995 N GLY A 807 23.622 -10.388 -3.711 1.00 0.00 N ATOM 996 CA GLY A 807 24.604 -9.340 -3.921 1.00 0.00 C ATOM 997 C GLY A 807 25.962 -9.695 -3.351 1.00 0.00 C ATOM 998 O GLY A 807 26.271 -10.862 -3.108 1.00 0.00 O ATOM 0 H GLY A 807 23.543 -10.714 -2.748 1.00 0.00 H new ATOM 0 HA2 GLY A 807 24.701 -9.146 -4.989 1.00 0.00 H new ATOM 0 HA3 GLY A 807 24.250 -8.417 -3.461 1.00 0.00 H new ATOM 1002 N PRO A 808 26.802 -8.673 -3.131 1.00 0.00 N ATOM 1003 CA PRO A 808 28.150 -8.858 -2.585 1.00 0.00 C ATOM 1004 C PRO A 808 28.128 -9.284 -1.121 1.00 0.00 C ATOM 1005 O PRO A 808 29.176 -9.503 -0.513 1.00 0.00 O ATOM 1006 CB PRO A 808 28.785 -7.473 -2.730 1.00 0.00 C ATOM 1007 CG PRO A 808 27.635 -6.527 -2.733 1.00 0.00 C ATOM 1008 CD PRO A 808 26.500 -7.256 -3.398 1.00 0.00 C ATOM 0 HA PRO A 808 28.695 -9.647 -3.103 1.00 0.00 H new ATOM 0 HB2 PRO A 808 29.468 -7.263 -1.907 1.00 0.00 H new ATOM 0 HB3 PRO A 808 29.363 -7.397 -3.651 1.00 0.00 H new ATOM 0 HG2 PRO A 808 27.369 -6.234 -1.718 1.00 0.00 H new ATOM 0 HG3 PRO A 808 27.882 -5.614 -3.274 1.00 0.00 H new ATOM 0 HD2 PRO A 808 25.536 -6.965 -2.981 1.00 0.00 H new ATOM 0 HD3 PRO A 808 26.460 -7.048 -4.467 1.00 0.00 H new ATOM 1016 N SER A 809 26.928 -9.399 -0.560 1.00 0.00 N ATOM 1017 CA SER A 809 26.771 -9.795 0.834 1.00 0.00 C ATOM 1018 C SER A 809 25.832 -10.991 0.956 1.00 0.00 C ATOM 1019 O SER A 809 24.644 -10.895 0.649 1.00 0.00 O ATOM 1020 CB SER A 809 26.235 -8.625 1.662 1.00 0.00 C ATOM 1021 OG SER A 809 27.266 -7.699 1.962 1.00 0.00 O ATOM 0 H SER A 809 26.051 -9.223 -1.050 1.00 0.00 H new ATOM 0 HA SER A 809 27.750 -10.083 1.217 1.00 0.00 H new ATOM 0 HB2 SER A 809 25.438 -8.122 1.114 1.00 0.00 H new ATOM 0 HB3 SER A 809 25.798 -9.000 2.587 1.00 0.00 H new ATOM 0 HG SER A 809 26.898 -6.960 2.490 1.00 0.00 H new ATOM 1027 N SER A 810 26.374 -12.117 1.408 1.00 0.00 N ATOM 1028 CA SER A 810 25.586 -13.334 1.568 1.00 0.00 C ATOM 1029 C SER A 810 24.426 -13.108 2.532 1.00 0.00 C ATOM 1030 O SER A 810 24.630 -12.872 3.722 1.00 0.00 O ATOM 1031 CB SER A 810 26.470 -14.476 2.075 1.00 0.00 C ATOM 1032 OG SER A 810 25.799 -15.720 1.981 1.00 0.00 O ATOM 0 H SER A 810 27.355 -12.212 1.670 1.00 0.00 H new ATOM 0 HA SER A 810 25.178 -13.604 0.594 1.00 0.00 H new ATOM 0 HB2 SER A 810 27.392 -14.512 1.495 1.00 0.00 H new ATOM 0 HB3 SER A 810 26.753 -14.289 3.111 1.00 0.00 H new ATOM 0 HG SER A 810 26.385 -16.433 2.309 1.00 0.00 H new ATOM 1038 N GLY A 811 23.206 -13.182 2.008 1.00 0.00 N ATOM 1039 CA GLY A 811 22.030 -12.982 2.835 1.00 0.00 C ATOM 1040 C GLY A 811 20.906 -12.294 2.088 1.00 0.00 C ATOM 1041 O GLY A 811 20.711 -11.086 2.221 1.00 0.00 O ATOM 0 H GLY A 811 23.011 -13.377 1.026 1.00 0.00 H new ATOM 0 HA2 GLY A 811 21.680 -13.947 3.203 1.00 0.00 H new ATOM 0 HA3 GLY A 811 22.300 -12.387 3.707 1.00 0.00 H new TER 1045 GLY A 811