USER MOD reduce.3.24.130724 H: found=0, std=0, add=555, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 553 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 Single : A 740 SER OG : rot 180:sc= 0 USER MOD Single : A 741 SER OG : rot 28:sc= 0.108 USER MOD Single : A 743 SER OG : rot 180:sc= 0 USER MOD Single : A 744 SER OG : rot 180:sc= 0 USER MOD Single : A 754 CYS SG : rot -103:sc= 0.113 USER MOD Single : A 757 TYR OH : rot 152:sc= 1.32 USER MOD Single : A 758 THR OG1 : rot 180:sc= 0 USER MOD Single : A 761 THR OG1 : rot 180:sc= -0.245 USER MOD Single : A 763 GLN : amide:sc= -0.0463 K(o=-0.046,f=-1.6!) USER MOD Single : A 766 SER OG : rot 72:sc= -0.177 USER MOD Single : A 776 HIS : no HE2:sc= -3.2 K(o=-3.2,f=-1.3) USER MOD Single : A 780 SER OG : rot 180:sc= 0.00616 USER MOD Single : A 781 SER OG : rot 180:sc= 0 USER MOD Single : A 788 HIS : no HE2:sc= -4.69! C(o=-4.7!,f=-4.7!) USER MOD Single : A 789 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 791 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 797 HIS : no HD1:sc= -1.86! C(o=-1.9!,f=-7.1!) USER MOD Single : A 798 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0213) USER MOD Single : A 799 TYR OH : rot 180:sc= 0 USER MOD Single : A 801 THR OG1 : rot 180:sc= 0 USER MOD Single : A 806 THR OG1 : rot -54:sc= 0.967 USER MOD Single : A 808 LYS NZ :NH3+ 160:sc= -0.0594 (180deg=-0.38) USER MOD Single : A 809 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 739 -13.923 -15.150 -3.860 1.00 0.00 N ATOM 2 CA GLY A 739 -14.862 -14.566 -2.919 1.00 0.00 C ATOM 3 C GLY A 739 -14.596 -13.094 -2.674 1.00 0.00 C ATOM 4 O GLY A 739 -13.523 -12.720 -2.201 1.00 0.00 O ATOM 0 HA2 GLY A 739 -15.876 -14.691 -3.298 1.00 0.00 H new ATOM 0 HA3 GLY A 739 -14.806 -15.105 -1.973 1.00 0.00 H new ATOM 8 N SER A 740 -15.575 -12.256 -2.998 1.00 0.00 N ATOM 9 CA SER A 740 -15.440 -10.815 -2.815 1.00 0.00 C ATOM 10 C SER A 740 -16.094 -10.370 -1.510 1.00 0.00 C ATOM 11 O SER A 740 -17.299 -10.530 -1.321 1.00 0.00 O ATOM 12 CB SER A 740 -16.067 -10.069 -3.994 1.00 0.00 C ATOM 13 OG SER A 740 -15.940 -8.667 -3.836 1.00 0.00 O ATOM 0 H SER A 740 -16.470 -12.549 -3.389 1.00 0.00 H new ATOM 0 HA SER A 740 -14.377 -10.577 -2.768 1.00 0.00 H new ATOM 0 HB2 SER A 740 -15.586 -10.379 -4.922 1.00 0.00 H new ATOM 0 HB3 SER A 740 -17.121 -10.335 -4.078 1.00 0.00 H new ATOM 0 HG SER A 740 -16.347 -8.213 -4.603 1.00 0.00 H new ATOM 19 N SER A 741 -15.288 -9.809 -0.614 1.00 0.00 N ATOM 20 CA SER A 741 -15.787 -9.343 0.675 1.00 0.00 C ATOM 21 C SER A 741 -15.971 -7.828 0.671 1.00 0.00 C ATOM 22 O SER A 741 -15.039 -7.079 0.382 1.00 0.00 O ATOM 23 CB SER A 741 -14.825 -9.748 1.794 1.00 0.00 C ATOM 24 OG SER A 741 -13.498 -9.349 1.495 1.00 0.00 O ATOM 0 H SER A 741 -14.288 -9.666 -0.756 1.00 0.00 H new ATOM 0 HA SER A 741 -16.756 -9.809 0.852 1.00 0.00 H new ATOM 0 HB2 SER A 741 -15.142 -9.293 2.733 1.00 0.00 H new ATOM 0 HB3 SER A 741 -14.860 -10.828 1.935 1.00 0.00 H new ATOM 0 HG SER A 741 -13.517 -8.563 0.910 1.00 0.00 H new ATOM 30 N GLY A 742 -17.182 -7.385 0.994 1.00 0.00 N ATOM 31 CA GLY A 742 -17.469 -5.963 1.022 1.00 0.00 C ATOM 32 C GLY A 742 -18.874 -5.664 1.504 1.00 0.00 C ATOM 33 O GLY A 742 -19.831 -5.738 0.734 1.00 0.00 O ATOM 0 H GLY A 742 -17.970 -7.986 1.237 1.00 0.00 H new ATOM 0 HA2 GLY A 742 -16.751 -5.464 1.673 1.00 0.00 H new ATOM 0 HA3 GLY A 742 -17.335 -5.549 0.023 1.00 0.00 H new ATOM 37 N SER A 743 -19.000 -5.326 2.784 1.00 0.00 N ATOM 38 CA SER A 743 -20.299 -5.020 3.370 1.00 0.00 C ATOM 39 C SER A 743 -20.491 -3.513 3.511 1.00 0.00 C ATOM 40 O SER A 743 -20.290 -2.948 4.586 1.00 0.00 O ATOM 41 CB SER A 743 -20.437 -5.693 4.737 1.00 0.00 C ATOM 42 OG SER A 743 -20.466 -7.104 4.610 1.00 0.00 O ATOM 0 H SER A 743 -18.217 -5.257 3.435 1.00 0.00 H new ATOM 0 HA SER A 743 -21.070 -5.406 2.703 1.00 0.00 H new ATOM 0 HB2 SER A 743 -19.604 -5.399 5.376 1.00 0.00 H new ATOM 0 HB3 SER A 743 -21.350 -5.350 5.224 1.00 0.00 H new ATOM 0 HG SER A 743 -20.553 -7.511 5.497 1.00 0.00 H new ATOM 48 N SER A 744 -20.880 -2.867 2.416 1.00 0.00 N ATOM 49 CA SER A 744 -21.095 -1.425 2.415 1.00 0.00 C ATOM 50 C SER A 744 -19.984 -0.710 3.179 1.00 0.00 C ATOM 51 O SER A 744 -20.241 0.218 3.944 1.00 0.00 O ATOM 52 CB SER A 744 -22.453 -1.090 3.034 1.00 0.00 C ATOM 53 OG SER A 744 -22.931 0.160 2.568 1.00 0.00 O ATOM 0 H SER A 744 -21.053 -3.320 1.518 1.00 0.00 H new ATOM 0 HA SER A 744 -21.081 -1.081 1.381 1.00 0.00 H new ATOM 0 HB2 SER A 744 -23.171 -1.872 2.788 1.00 0.00 H new ATOM 0 HB3 SER A 744 -22.366 -1.068 4.120 1.00 0.00 H new ATOM 0 HG SER A 744 -23.801 0.351 2.977 1.00 0.00 H new ATOM 59 N GLY A 745 -18.748 -1.150 2.964 1.00 0.00 N ATOM 60 CA GLY A 745 -17.617 -0.541 3.639 1.00 0.00 C ATOM 61 C GLY A 745 -16.289 -1.081 3.146 1.00 0.00 C ATOM 62 O GLY A 745 -15.379 -1.326 3.937 1.00 0.00 O ATOM 0 H GLY A 745 -18.510 -1.917 2.335 1.00 0.00 H new ATOM 0 HA2 GLY A 745 -17.646 0.538 3.488 1.00 0.00 H new ATOM 0 HA3 GLY A 745 -17.701 -0.715 4.712 1.00 0.00 H new ATOM 66 N GLU A 746 -16.178 -1.269 1.834 1.00 0.00 N ATOM 67 CA GLU A 746 -14.952 -1.785 1.238 1.00 0.00 C ATOM 68 C GLU A 746 -14.721 -1.178 -0.143 1.00 0.00 C ATOM 69 O GLU A 746 -15.626 -1.137 -0.975 1.00 0.00 O ATOM 70 CB GLU A 746 -15.014 -3.311 1.133 1.00 0.00 C ATOM 71 CG GLU A 746 -14.536 -4.027 2.385 1.00 0.00 C ATOM 72 CD GLU A 746 -15.482 -3.848 3.556 1.00 0.00 C ATOM 73 OE1 GLU A 746 -16.687 -3.625 3.317 1.00 0.00 O ATOM 74 OE2 GLU A 746 -15.017 -3.930 4.712 1.00 0.00 O ATOM 0 H GLU A 746 -16.922 -1.072 1.165 1.00 0.00 H new ATOM 0 HA GLU A 746 -14.119 -1.505 1.882 1.00 0.00 H new ATOM 0 HB2 GLU A 746 -16.041 -3.611 0.923 1.00 0.00 H new ATOM 0 HB3 GLU A 746 -14.408 -3.633 0.286 1.00 0.00 H new ATOM 0 HG2 GLU A 746 -14.425 -5.090 2.171 1.00 0.00 H new ATOM 0 HG3 GLU A 746 -13.550 -3.653 2.659 1.00 0.00 H new ATOM 81 N GLY A 747 -13.500 -0.706 -0.378 1.00 0.00 N ATOM 82 CA GLY A 747 -13.170 -0.107 -1.658 1.00 0.00 C ATOM 83 C GLY A 747 -11.701 -0.245 -2.002 1.00 0.00 C ATOM 84 O GLY A 747 -10.873 -0.504 -1.129 1.00 0.00 O ATOM 0 H GLY A 747 -12.734 -0.728 0.295 1.00 0.00 H new ATOM 0 HA2 GLY A 747 -13.768 -0.575 -2.440 1.00 0.00 H new ATOM 0 HA3 GLY A 747 -13.438 0.949 -1.641 1.00 0.00 H new ATOM 88 N VAL A 748 -11.375 -0.075 -3.280 1.00 0.00 N ATOM 89 CA VAL A 748 -9.995 -0.183 -3.738 1.00 0.00 C ATOM 90 C VAL A 748 -9.649 0.939 -4.710 1.00 0.00 C ATOM 91 O VAL A 748 -10.485 1.363 -5.509 1.00 0.00 O ATOM 92 CB VAL A 748 -9.736 -1.538 -4.422 1.00 0.00 C ATOM 93 CG1 VAL A 748 -8.306 -1.613 -4.934 1.00 0.00 C ATOM 94 CG2 VAL A 748 -10.029 -2.683 -3.464 1.00 0.00 C ATOM 0 H VAL A 748 -12.048 0.138 -4.016 1.00 0.00 H new ATOM 0 HA VAL A 748 -9.361 -0.103 -2.855 1.00 0.00 H new ATOM 0 HB VAL A 748 -10.407 -1.628 -5.276 1.00 0.00 H new ATOM 0 HG11 VAL A 748 -8.142 -2.578 -5.414 1.00 0.00 H new ATOM 0 HG12 VAL A 748 -8.136 -0.814 -5.656 1.00 0.00 H new ATOM 0 HG13 VAL A 748 -7.614 -1.501 -4.099 1.00 0.00 H new ATOM 0 HG21 VAL A 748 -9.841 -3.633 -3.964 1.00 0.00 H new ATOM 0 HG22 VAL A 748 -9.384 -2.599 -2.589 1.00 0.00 H new ATOM 0 HG23 VAL A 748 -11.072 -2.638 -3.152 1.00 0.00 H new ATOM 104 N VAL A 749 -8.411 1.417 -4.637 1.00 0.00 N ATOM 105 CA VAL A 749 -7.953 2.490 -5.511 1.00 0.00 C ATOM 106 C VAL A 749 -6.578 2.176 -6.092 1.00 0.00 C ATOM 107 O VAL A 749 -5.656 1.808 -5.365 1.00 0.00 O ATOM 108 CB VAL A 749 -7.887 3.834 -4.763 1.00 0.00 C ATOM 109 CG1 VAL A 749 -7.374 4.933 -5.682 1.00 0.00 C ATOM 110 CG2 VAL A 749 -9.252 4.196 -4.197 1.00 0.00 C ATOM 0 H VAL A 749 -7.707 1.078 -3.981 1.00 0.00 H new ATOM 0 HA VAL A 749 -8.678 2.569 -6.321 1.00 0.00 H new ATOM 0 HB VAL A 749 -7.189 3.733 -3.932 1.00 0.00 H new ATOM 0 HG11 VAL A 749 -7.334 5.875 -5.136 1.00 0.00 H new ATOM 0 HG12 VAL A 749 -6.375 4.676 -6.035 1.00 0.00 H new ATOM 0 HG13 VAL A 749 -8.044 5.036 -6.535 1.00 0.00 H new ATOM 0 HG21 VAL A 749 -9.187 5.149 -3.672 1.00 0.00 H new ATOM 0 HG22 VAL A 749 -9.973 4.279 -5.010 1.00 0.00 H new ATOM 0 HG23 VAL A 749 -9.575 3.420 -3.503 1.00 0.00 H new ATOM 120 N GLU A 750 -6.449 2.325 -7.407 1.00 0.00 N ATOM 121 CA GLU A 750 -5.187 2.057 -8.085 1.00 0.00 C ATOM 122 C GLU A 750 -4.366 3.335 -8.232 1.00 0.00 C ATOM 123 O GLU A 750 -4.904 4.400 -8.536 1.00 0.00 O ATOM 124 CB GLU A 750 -5.443 1.442 -9.463 1.00 0.00 C ATOM 125 CG GLU A 750 -5.661 -0.061 -9.426 1.00 0.00 C ATOM 126 CD GLU A 750 -6.177 -0.608 -10.743 1.00 0.00 C ATOM 127 OE1 GLU A 750 -5.430 -0.549 -11.743 1.00 0.00 O ATOM 128 OE2 GLU A 750 -7.326 -1.094 -10.775 1.00 0.00 O ATOM 0 H GLU A 750 -7.203 2.630 -8.023 1.00 0.00 H new ATOM 0 HA GLU A 750 -4.622 1.350 -7.478 1.00 0.00 H new ATOM 0 HB2 GLU A 750 -6.318 1.917 -9.907 1.00 0.00 H new ATOM 0 HB3 GLU A 750 -4.596 1.662 -10.113 1.00 0.00 H new ATOM 0 HG2 GLU A 750 -4.722 -0.554 -9.175 1.00 0.00 H new ATOM 0 HG3 GLU A 750 -6.370 -0.302 -8.634 1.00 0.00 H new ATOM 135 N ALA A 751 -3.060 3.221 -8.012 1.00 0.00 N ATOM 136 CA ALA A 751 -2.164 4.366 -8.121 1.00 0.00 C ATOM 137 C ALA A 751 -0.931 4.021 -8.949 1.00 0.00 C ATOM 138 O ALA A 751 -0.569 2.852 -9.085 1.00 0.00 O ATOM 139 CB ALA A 751 -1.756 4.850 -6.737 1.00 0.00 C ATOM 0 H ALA A 751 -2.599 2.347 -7.757 1.00 0.00 H new ATOM 0 HA ALA A 751 -2.698 5.168 -8.631 1.00 0.00 H new ATOM 0 HB1 ALA A 751 -1.087 5.705 -6.833 1.00 0.00 H new ATOM 0 HB2 ALA A 751 -2.644 5.145 -6.178 1.00 0.00 H new ATOM 0 HB3 ALA A 751 -1.244 4.047 -6.207 1.00 0.00 H new ATOM 145 N VAL A 752 -0.289 5.046 -9.501 1.00 0.00 N ATOM 146 CA VAL A 752 0.905 4.851 -10.315 1.00 0.00 C ATOM 147 C VAL A 752 2.149 5.362 -9.598 1.00 0.00 C ATOM 148 O VAL A 752 2.117 6.405 -8.945 1.00 0.00 O ATOM 149 CB VAL A 752 0.779 5.565 -11.674 1.00 0.00 C ATOM 150 CG1 VAL A 752 2.048 5.382 -12.493 1.00 0.00 C ATOM 151 CG2 VAL A 752 -0.434 5.052 -12.435 1.00 0.00 C ATOM 0 H VAL A 752 -0.576 6.020 -9.399 1.00 0.00 H new ATOM 0 HA VAL A 752 1.002 3.778 -10.483 1.00 0.00 H new ATOM 0 HB VAL A 752 0.642 6.631 -11.493 1.00 0.00 H new ATOM 0 HG11 VAL A 752 1.940 5.893 -13.450 1.00 0.00 H new ATOM 0 HG12 VAL A 752 2.895 5.802 -11.950 1.00 0.00 H new ATOM 0 HG13 VAL A 752 2.219 4.320 -12.667 1.00 0.00 H new ATOM 0 HG21 VAL A 752 -0.507 5.567 -13.393 1.00 0.00 H new ATOM 0 HG22 VAL A 752 -0.330 3.981 -12.607 1.00 0.00 H new ATOM 0 HG23 VAL A 752 -1.336 5.240 -11.852 1.00 0.00 H new ATOM 161 N ALA A 753 3.245 4.621 -9.724 1.00 0.00 N ATOM 162 CA ALA A 753 4.501 5.001 -9.090 1.00 0.00 C ATOM 163 C ALA A 753 5.201 6.105 -9.876 1.00 0.00 C ATOM 164 O ALA A 753 5.557 5.920 -11.040 1.00 0.00 O ATOM 165 CB ALA A 753 5.411 3.789 -8.954 1.00 0.00 C ATOM 0 H ALA A 753 3.288 3.754 -10.260 1.00 0.00 H new ATOM 0 HA ALA A 753 4.276 5.386 -8.096 1.00 0.00 H new ATOM 0 HB1 ALA A 753 6.346 4.087 -8.479 1.00 0.00 H new ATOM 0 HB2 ALA A 753 4.919 3.031 -8.344 1.00 0.00 H new ATOM 0 HB3 ALA A 753 5.621 3.379 -9.942 1.00 0.00 H new ATOM 171 N CYS A 754 5.394 7.251 -9.233 1.00 0.00 N ATOM 172 CA CYS A 754 6.051 8.385 -9.872 1.00 0.00 C ATOM 173 C CYS A 754 7.551 8.145 -9.999 1.00 0.00 C ATOM 174 O CYS A 754 8.146 8.401 -11.046 1.00 0.00 O ATOM 175 CB CYS A 754 5.792 9.666 -9.077 1.00 0.00 C ATOM 176 SG CYS A 754 6.137 11.186 -9.993 1.00 0.00 S ATOM 0 H CYS A 754 5.105 7.419 -8.269 1.00 0.00 H new ATOM 0 HA CYS A 754 5.634 8.497 -10.873 1.00 0.00 H new ATOM 0 HB2 CYS A 754 4.751 9.677 -8.755 1.00 0.00 H new ATOM 0 HB3 CYS A 754 6.404 9.651 -8.175 1.00 0.00 H new ATOM 0 HG CYS A 754 7.267 11.688 -9.591 1.00 0.00 H new ATOM 182 N PHE A 755 8.159 7.653 -8.924 1.00 0.00 N ATOM 183 CA PHE A 755 9.591 7.380 -8.913 1.00 0.00 C ATOM 184 C PHE A 755 9.873 5.973 -8.395 1.00 0.00 C ATOM 185 O PHE A 755 9.175 5.473 -7.514 1.00 0.00 O ATOM 186 CB PHE A 755 10.322 8.410 -8.049 1.00 0.00 C ATOM 187 CG PHE A 755 10.235 9.811 -8.584 1.00 0.00 C ATOM 188 CD1 PHE A 755 10.814 10.140 -9.799 1.00 0.00 C ATOM 189 CD2 PHE A 755 9.574 10.799 -7.871 1.00 0.00 C ATOM 190 CE1 PHE A 755 10.736 11.428 -10.293 1.00 0.00 C ATOM 191 CE2 PHE A 755 9.493 12.089 -8.360 1.00 0.00 C ATOM 192 CZ PHE A 755 10.073 12.404 -9.573 1.00 0.00 C ATOM 0 H PHE A 755 7.682 7.435 -8.049 1.00 0.00 H new ATOM 0 HA PHE A 755 9.956 7.451 -9.938 1.00 0.00 H new ATOM 0 HB2 PHE A 755 9.906 8.388 -7.042 1.00 0.00 H new ATOM 0 HB3 PHE A 755 11.371 8.125 -7.967 1.00 0.00 H new ATOM 0 HD1 PHE A 755 11.332 9.381 -10.366 1.00 0.00 H new ATOM 0 HD2 PHE A 755 9.117 10.558 -6.923 1.00 0.00 H new ATOM 0 HE1 PHE A 755 11.193 11.672 -11.241 1.00 0.00 H new ATOM 0 HE2 PHE A 755 8.977 12.850 -7.794 1.00 0.00 H new ATOM 0 HZ PHE A 755 10.009 13.411 -9.958 1.00 0.00 H new ATOM 202 N ALA A 756 10.902 5.339 -8.950 1.00 0.00 N ATOM 203 CA ALA A 756 11.278 3.991 -8.544 1.00 0.00 C ATOM 204 C ALA A 756 11.688 3.954 -7.076 1.00 0.00 C ATOM 205 O ALA A 756 12.650 4.609 -6.674 1.00 0.00 O ATOM 206 CB ALA A 756 12.405 3.470 -9.422 1.00 0.00 C ATOM 0 H ALA A 756 11.490 5.738 -9.682 1.00 0.00 H new ATOM 0 HA ALA A 756 10.408 3.346 -8.668 1.00 0.00 H new ATOM 0 HB1 ALA A 756 12.675 2.462 -9.107 1.00 0.00 H new ATOM 0 HB2 ALA A 756 12.077 3.450 -10.461 1.00 0.00 H new ATOM 0 HB3 ALA A 756 13.272 4.124 -9.328 1.00 0.00 H new ATOM 212 N TYR A 757 10.953 3.186 -6.280 1.00 0.00 N ATOM 213 CA TYR A 757 11.239 3.067 -4.855 1.00 0.00 C ATOM 214 C TYR A 757 11.690 1.652 -4.506 1.00 0.00 C ATOM 215 O TYR A 757 11.313 0.685 -5.170 1.00 0.00 O ATOM 216 CB TYR A 757 10.004 3.438 -4.032 1.00 0.00 C ATOM 217 CG TYR A 757 10.291 3.623 -2.559 1.00 0.00 C ATOM 218 CD1 TYR A 757 10.669 4.862 -2.056 1.00 0.00 C ATOM 219 CD2 TYR A 757 10.184 2.560 -1.672 1.00 0.00 C ATOM 220 CE1 TYR A 757 10.932 5.036 -0.711 1.00 0.00 C ATOM 221 CE2 TYR A 757 10.445 2.725 -0.325 1.00 0.00 C ATOM 222 CZ TYR A 757 10.818 3.964 0.151 1.00 0.00 C ATOM 223 OH TYR A 757 11.080 4.133 1.491 1.00 0.00 O ATOM 0 H TYR A 757 10.154 2.636 -6.597 1.00 0.00 H new ATOM 0 HA TYR A 757 12.048 3.757 -4.614 1.00 0.00 H new ATOM 0 HB2 TYR A 757 9.577 4.359 -4.429 1.00 0.00 H new ATOM 0 HB3 TYR A 757 9.251 2.659 -4.152 1.00 0.00 H new ATOM 0 HD1 TYR A 757 10.759 5.703 -2.728 1.00 0.00 H new ATOM 0 HD2 TYR A 757 9.892 1.588 -2.041 1.00 0.00 H new ATOM 0 HE1 TYR A 757 11.225 6.005 -0.336 1.00 0.00 H new ATOM 0 HE2 TYR A 757 10.357 1.888 0.351 1.00 0.00 H new ATOM 0 HH TYR A 757 10.560 3.485 2.010 1.00 0.00 H new ATOM 233 N THR A 758 12.499 1.537 -3.457 1.00 0.00 N ATOM 234 CA THR A 758 13.002 0.241 -3.019 1.00 0.00 C ATOM 235 C THR A 758 12.818 0.060 -1.517 1.00 0.00 C ATOM 236 O THR A 758 13.616 0.552 -0.720 1.00 0.00 O ATOM 237 CB THR A 758 14.493 0.071 -3.366 1.00 0.00 C ATOM 238 OG1 THR A 758 14.676 0.135 -4.785 1.00 0.00 O ATOM 239 CG2 THR A 758 15.024 -1.254 -2.841 1.00 0.00 C ATOM 0 H THR A 758 12.820 2.326 -2.895 1.00 0.00 H new ATOM 0 HA THR A 758 12.425 -0.518 -3.547 1.00 0.00 H new ATOM 0 HB THR A 758 15.048 0.880 -2.891 1.00 0.00 H new ATOM 0 HG1 THR A 758 15.627 0.028 -4.997 1.00 0.00 H new ATOM 0 HG21 THR A 758 16.079 -1.351 -3.098 1.00 0.00 H new ATOM 0 HG22 THR A 758 14.910 -1.288 -1.757 1.00 0.00 H new ATOM 0 HG23 THR A 758 14.464 -2.074 -3.290 1.00 0.00 H new ATOM 247 N GLY A 759 11.761 -0.652 -1.136 1.00 0.00 N ATOM 248 CA GLY A 759 11.492 -0.886 0.271 1.00 0.00 C ATOM 249 C GLY A 759 12.730 -1.313 1.034 1.00 0.00 C ATOM 250 O GLY A 759 13.461 -2.202 0.598 1.00 0.00 O ATOM 0 H GLY A 759 11.087 -1.071 -1.777 1.00 0.00 H new ATOM 0 HA2 GLY A 759 11.090 0.023 0.717 1.00 0.00 H new ATOM 0 HA3 GLY A 759 10.726 -1.655 0.368 1.00 0.00 H new ATOM 254 N ARG A 760 12.967 -0.676 2.177 1.00 0.00 N ATOM 255 CA ARG A 760 14.127 -0.993 3.001 1.00 0.00 C ATOM 256 C ARG A 760 13.978 -2.369 3.644 1.00 0.00 C ATOM 257 O ARG A 760 14.940 -3.133 3.731 1.00 0.00 O ATOM 258 CB ARG A 760 14.314 0.071 4.085 1.00 0.00 C ATOM 259 CG ARG A 760 14.902 1.373 3.566 1.00 0.00 C ATOM 260 CD ARG A 760 16.422 1.334 3.558 1.00 0.00 C ATOM 261 NE ARG A 760 17.003 2.673 3.513 1.00 0.00 N ATOM 262 CZ ARG A 760 18.309 2.905 3.438 1.00 0.00 C ATOM 263 NH1 ARG A 760 19.165 1.893 3.401 1.00 0.00 N ATOM 264 NH2 ARG A 760 18.762 4.152 3.401 1.00 0.00 N ATOM 0 H ARG A 760 12.371 0.062 2.553 1.00 0.00 H new ATOM 0 HA ARG A 760 15.007 -1.006 2.357 1.00 0.00 H new ATOM 0 HB2 ARG A 760 13.350 0.277 4.550 1.00 0.00 H new ATOM 0 HB3 ARG A 760 14.965 -0.327 4.864 1.00 0.00 H new ATOM 0 HG2 ARG A 760 14.537 1.562 2.557 1.00 0.00 H new ATOM 0 HG3 ARG A 760 14.562 2.201 4.188 1.00 0.00 H new ATOM 0 HD2 ARG A 760 16.776 0.815 4.449 1.00 0.00 H new ATOM 0 HD3 ARG A 760 16.765 0.761 2.697 1.00 0.00 H new ATOM 0 HE ARG A 760 16.372 3.474 3.541 1.00 0.00 H new ATOM 0 HH11 ARG A 760 18.821 0.933 3.430 1.00 0.00 H new ATOM 0 HH12 ARG A 760 20.167 2.074 3.343 1.00 0.00 H new ATOM 0 HH21 ARG A 760 18.107 4.934 3.430 1.00 0.00 H new ATOM 0 HH22 ARG A 760 19.765 4.329 3.343 1.00 0.00 H new ATOM 278 N THR A 761 12.766 -2.678 4.093 1.00 0.00 N ATOM 279 CA THR A 761 12.491 -3.960 4.729 1.00 0.00 C ATOM 280 C THR A 761 11.147 -4.521 4.279 1.00 0.00 C ATOM 281 O THR A 761 10.453 -3.914 3.464 1.00 0.00 O ATOM 282 CB THR A 761 12.495 -3.838 6.265 1.00 0.00 C ATOM 283 OG1 THR A 761 11.461 -2.942 6.687 1.00 0.00 O ATOM 284 CG2 THR A 761 13.842 -3.338 6.765 1.00 0.00 C ATOM 0 H THR A 761 11.959 -2.058 4.028 1.00 0.00 H new ATOM 0 HA THR A 761 13.286 -4.640 4.424 1.00 0.00 H new ATOM 0 HB THR A 761 12.314 -4.827 6.687 1.00 0.00 H new ATOM 0 HG1 THR A 761 11.469 -2.871 7.664 1.00 0.00 H new ATOM 0 HG21 THR A 761 13.820 -3.260 7.852 1.00 0.00 H new ATOM 0 HG22 THR A 761 14.623 -4.037 6.467 1.00 0.00 H new ATOM 0 HG23 THR A 761 14.049 -2.358 6.335 1.00 0.00 H new ATOM 292 N ALA A 762 10.786 -5.683 4.814 1.00 0.00 N ATOM 293 CA ALA A 762 9.524 -6.323 4.468 1.00 0.00 C ATOM 294 C ALA A 762 8.364 -5.338 4.565 1.00 0.00 C ATOM 295 O ALA A 762 7.527 -5.261 3.666 1.00 0.00 O ATOM 296 CB ALA A 762 9.276 -7.523 5.370 1.00 0.00 C ATOM 0 H ALA A 762 11.350 -6.200 5.489 1.00 0.00 H new ATOM 0 HA ALA A 762 9.590 -6.666 3.435 1.00 0.00 H new ATOM 0 HB1 ALA A 762 8.330 -7.992 5.100 1.00 0.00 H new ATOM 0 HB2 ALA A 762 10.085 -8.243 5.248 1.00 0.00 H new ATOM 0 HB3 ALA A 762 9.235 -7.195 6.409 1.00 0.00 H new ATOM 302 N GLN A 763 8.320 -4.588 5.662 1.00 0.00 N ATOM 303 CA GLN A 763 7.261 -3.609 5.876 1.00 0.00 C ATOM 304 C GLN A 763 7.077 -2.729 4.645 1.00 0.00 C ATOM 305 O GLN A 763 5.956 -2.359 4.297 1.00 0.00 O ATOM 306 CB GLN A 763 7.578 -2.742 7.095 1.00 0.00 C ATOM 307 CG GLN A 763 8.537 -1.601 6.797 1.00 0.00 C ATOM 308 CD GLN A 763 9.149 -1.010 8.052 1.00 0.00 C ATOM 309 OE1 GLN A 763 9.012 -1.563 9.143 1.00 0.00 O ATOM 310 NE2 GLN A 763 9.830 0.120 7.903 1.00 0.00 N ATOM 0 H GLN A 763 9.005 -4.640 6.416 1.00 0.00 H new ATOM 0 HA GLN A 763 6.332 -4.150 6.056 1.00 0.00 H new ATOM 0 HB2 GLN A 763 6.649 -2.331 7.490 1.00 0.00 H new ATOM 0 HB3 GLN A 763 8.006 -3.370 7.876 1.00 0.00 H new ATOM 0 HG2 GLN A 763 9.332 -1.961 6.144 1.00 0.00 H new ATOM 0 HG3 GLN A 763 8.007 -0.819 6.253 1.00 0.00 H new ATOM 0 HE21 GLN A 763 9.918 0.544 6.980 1.00 0.00 H new ATOM 0 HE22 GLN A 763 10.265 0.564 8.712 1.00 0.00 H new ATOM 319 N GLU A 764 8.185 -2.397 3.989 1.00 0.00 N ATOM 320 CA GLU A 764 8.144 -1.559 2.797 1.00 0.00 C ATOM 321 C GLU A 764 8.203 -2.409 1.531 1.00 0.00 C ATOM 322 O GLU A 764 8.875 -3.441 1.493 1.00 0.00 O ATOM 323 CB GLU A 764 9.304 -0.560 2.808 1.00 0.00 C ATOM 324 CG GLU A 764 9.202 0.478 3.913 1.00 0.00 C ATOM 325 CD GLU A 764 10.177 1.624 3.728 1.00 0.00 C ATOM 326 OE1 GLU A 764 10.472 1.969 2.564 1.00 0.00 O ATOM 327 OE2 GLU A 764 10.645 2.176 4.745 1.00 0.00 O ATOM 0 H GLU A 764 9.121 -2.696 4.263 1.00 0.00 H new ATOM 0 HA GLU A 764 7.202 -1.011 2.802 1.00 0.00 H new ATOM 0 HB2 GLU A 764 10.241 -1.105 2.919 1.00 0.00 H new ATOM 0 HB3 GLU A 764 9.343 -0.051 1.845 1.00 0.00 H new ATOM 0 HG2 GLU A 764 8.186 0.872 3.944 1.00 0.00 H new ATOM 0 HG3 GLU A 764 9.388 -0.001 4.874 1.00 0.00 H new ATOM 334 N LEU A 765 7.495 -1.970 0.497 1.00 0.00 N ATOM 335 CA LEU A 765 7.465 -2.690 -0.771 1.00 0.00 C ATOM 336 C LEU A 765 8.506 -2.134 -1.738 1.00 0.00 C ATOM 337 O LEU A 765 9.235 -1.198 -1.409 1.00 0.00 O ATOM 338 CB LEU A 765 6.072 -2.601 -1.398 1.00 0.00 C ATOM 339 CG LEU A 765 5.029 -3.578 -0.855 1.00 0.00 C ATOM 340 CD1 LEU A 765 3.640 -3.206 -1.352 1.00 0.00 C ATOM 341 CD2 LEU A 765 5.375 -5.005 -1.255 1.00 0.00 C ATOM 0 H LEU A 765 6.934 -1.119 0.512 1.00 0.00 H new ATOM 0 HA LEU A 765 7.702 -3.735 -0.572 1.00 0.00 H new ATOM 0 HB2 LEU A 765 5.697 -1.587 -1.260 1.00 0.00 H new ATOM 0 HB3 LEU A 765 6.168 -2.762 -2.472 1.00 0.00 H new ATOM 0 HG LEU A 765 5.033 -3.516 0.233 1.00 0.00 H new ATOM 0 HD11 LEU A 765 2.910 -3.912 -0.956 1.00 0.00 H new ATOM 0 HD12 LEU A 765 3.391 -2.200 -1.016 1.00 0.00 H new ATOM 0 HD13 LEU A 765 3.622 -3.239 -2.441 1.00 0.00 H new ATOM 0 HD21 LEU A 765 4.622 -5.686 -0.860 1.00 0.00 H new ATOM 0 HD22 LEU A 765 5.400 -5.082 -2.342 1.00 0.00 H new ATOM 0 HD23 LEU A 765 6.352 -5.270 -0.850 1.00 0.00 H new ATOM 353 N SER A 766 8.569 -2.716 -2.931 1.00 0.00 N ATOM 354 CA SER A 766 9.522 -2.280 -3.945 1.00 0.00 C ATOM 355 C SER A 766 8.894 -2.322 -5.335 1.00 0.00 C ATOM 356 O SER A 766 8.363 -3.349 -5.758 1.00 0.00 O ATOM 357 CB SER A 766 10.773 -3.160 -3.911 1.00 0.00 C ATOM 358 OG SER A 766 11.643 -2.770 -2.863 1.00 0.00 O ATOM 0 H SER A 766 7.971 -3.491 -3.219 1.00 0.00 H new ATOM 0 HA SER A 766 9.804 -1.251 -3.724 1.00 0.00 H new ATOM 0 HB2 SER A 766 10.484 -4.203 -3.779 1.00 0.00 H new ATOM 0 HB3 SER A 766 11.295 -3.092 -4.865 1.00 0.00 H new ATOM 0 HG SER A 766 11.254 -3.029 -2.002 1.00 0.00 H new ATOM 364 N PHE A 767 8.958 -1.198 -6.040 1.00 0.00 N ATOM 365 CA PHE A 767 8.396 -1.104 -7.382 1.00 0.00 C ATOM 366 C PHE A 767 9.158 -0.083 -8.222 1.00 0.00 C ATOM 367 O PHE A 767 9.829 0.799 -7.687 1.00 0.00 O ATOM 368 CB PHE A 767 6.916 -0.721 -7.312 1.00 0.00 C ATOM 369 CG PHE A 767 6.632 0.398 -6.351 1.00 0.00 C ATOM 370 CD1 PHE A 767 6.945 1.707 -6.679 1.00 0.00 C ATOM 371 CD2 PHE A 767 6.051 0.140 -5.119 1.00 0.00 C ATOM 372 CE1 PHE A 767 6.684 2.739 -5.797 1.00 0.00 C ATOM 373 CE2 PHE A 767 5.788 1.168 -4.234 1.00 0.00 C ATOM 374 CZ PHE A 767 6.106 2.469 -4.572 1.00 0.00 C ATOM 0 H PHE A 767 9.394 -0.339 -5.704 1.00 0.00 H new ATOM 0 HA PHE A 767 8.490 -2.081 -7.857 1.00 0.00 H new ATOM 0 HB2 PHE A 767 6.577 -0.431 -8.306 1.00 0.00 H new ATOM 0 HB3 PHE A 767 6.336 -1.596 -7.020 1.00 0.00 H new ATOM 0 HD1 PHE A 767 7.398 1.924 -7.635 1.00 0.00 H new ATOM 0 HD2 PHE A 767 5.801 -0.875 -4.848 1.00 0.00 H new ATOM 0 HE1 PHE A 767 6.932 3.755 -6.066 1.00 0.00 H new ATOM 0 HE2 PHE A 767 5.334 0.954 -3.278 1.00 0.00 H new ATOM 0 HZ PHE A 767 5.903 3.273 -3.880 1.00 0.00 H new ATOM 384 N ARG A 768 9.049 -0.211 -9.540 1.00 0.00 N ATOM 385 CA ARG A 768 9.729 0.699 -10.455 1.00 0.00 C ATOM 386 C ARG A 768 8.748 1.702 -11.053 1.00 0.00 C ATOM 387 O ARG A 768 7.578 1.388 -11.270 1.00 0.00 O ATOM 388 CB ARG A 768 10.417 -0.087 -11.573 1.00 0.00 C ATOM 389 CG ARG A 768 11.573 -0.948 -11.091 1.00 0.00 C ATOM 390 CD ARG A 768 12.879 -0.169 -11.077 1.00 0.00 C ATOM 391 NE ARG A 768 13.900 -0.826 -10.266 1.00 0.00 N ATOM 392 CZ ARG A 768 14.521 -1.943 -10.629 1.00 0.00 C ATOM 393 NH1 ARG A 768 14.227 -2.523 -11.785 1.00 0.00 N ATOM 394 NH2 ARG A 768 15.439 -2.481 -9.837 1.00 0.00 N ATOM 0 H ARG A 768 8.497 -0.936 -9.999 1.00 0.00 H new ATOM 0 HA ARG A 768 10.482 1.247 -9.889 1.00 0.00 H new ATOM 0 HB2 ARG A 768 9.681 -0.724 -12.064 1.00 0.00 H new ATOM 0 HB3 ARG A 768 10.785 0.612 -12.324 1.00 0.00 H new ATOM 0 HG2 ARG A 768 11.359 -1.319 -10.089 1.00 0.00 H new ATOM 0 HG3 ARG A 768 11.674 -1.819 -11.739 1.00 0.00 H new ATOM 0 HD2 ARG A 768 13.244 -0.056 -12.098 1.00 0.00 H new ATOM 0 HD3 ARG A 768 12.699 0.834 -10.690 1.00 0.00 H new ATOM 0 HE ARG A 768 14.150 -0.404 -9.372 1.00 0.00 H new ATOM 0 HH11 ARG A 768 13.523 -2.112 -12.398 1.00 0.00 H new ATOM 0 HH12 ARG A 768 14.705 -3.381 -12.062 1.00 0.00 H new ATOM 0 HH21 ARG A 768 15.669 -2.037 -8.948 1.00 0.00 H new ATOM 0 HH22 ARG A 768 15.915 -3.339 -10.117 1.00 0.00 H new ATOM 408 N ARG A 769 9.233 2.911 -11.316 1.00 0.00 N ATOM 409 CA ARG A 769 8.399 3.962 -11.887 1.00 0.00 C ATOM 410 C ARG A 769 7.460 3.394 -12.948 1.00 0.00 C ATOM 411 O ARG A 769 7.894 2.710 -13.874 1.00 0.00 O ATOM 412 CB ARG A 769 9.271 5.060 -12.498 1.00 0.00 C ATOM 413 CG ARG A 769 8.499 6.314 -12.872 1.00 0.00 C ATOM 414 CD ARG A 769 7.921 6.216 -14.275 1.00 0.00 C ATOM 415 NE ARG A 769 8.963 6.232 -15.298 1.00 0.00 N ATOM 416 CZ ARG A 769 8.727 6.476 -16.583 1.00 0.00 C ATOM 417 NH1 ARG A 769 7.493 6.722 -16.999 1.00 0.00 N ATOM 418 NH2 ARG A 769 9.728 6.473 -17.454 1.00 0.00 N ATOM 0 H ARG A 769 10.199 3.187 -11.143 1.00 0.00 H new ATOM 0 HA ARG A 769 7.798 4.390 -11.085 1.00 0.00 H new ATOM 0 HB2 ARG A 769 10.056 5.325 -11.790 1.00 0.00 H new ATOM 0 HB3 ARG A 769 9.763 4.668 -13.388 1.00 0.00 H new ATOM 0 HG2 ARG A 769 7.693 6.473 -12.156 1.00 0.00 H new ATOM 0 HG3 ARG A 769 9.158 7.180 -12.809 1.00 0.00 H new ATOM 0 HD2 ARG A 769 7.339 5.299 -14.364 1.00 0.00 H new ATOM 0 HD3 ARG A 769 7.235 7.046 -14.443 1.00 0.00 H new ATOM 0 HE ARG A 769 9.924 6.046 -15.011 1.00 0.00 H new ATOM 0 HH11 ARG A 769 6.721 6.724 -16.332 1.00 0.00 H new ATOM 0 HH12 ARG A 769 7.315 6.909 -17.986 1.00 0.00 H new ATOM 0 HH21 ARG A 769 10.679 6.283 -17.137 1.00 0.00 H new ATOM 0 HH22 ARG A 769 9.547 6.660 -18.440 1.00 0.00 H new ATOM 432 N GLY A 770 6.170 3.683 -12.805 1.00 0.00 N ATOM 433 CA GLY A 770 5.191 3.193 -13.757 1.00 0.00 C ATOM 434 C GLY A 770 4.421 1.996 -13.234 1.00 0.00 C ATOM 435 O GLY A 770 3.246 1.818 -13.552 1.00 0.00 O ATOM 0 H GLY A 770 5.786 4.247 -12.047 1.00 0.00 H new ATOM 0 HA2 GLY A 770 4.492 3.993 -13.999 1.00 0.00 H new ATOM 0 HA3 GLY A 770 5.695 2.920 -14.684 1.00 0.00 H new ATOM 439 N ASP A 771 5.086 1.174 -12.430 1.00 0.00 N ATOM 440 CA ASP A 771 4.457 -0.013 -11.861 1.00 0.00 C ATOM 441 C ASP A 771 3.242 0.366 -11.020 1.00 0.00 C ATOM 442 O ASP A 771 3.370 1.026 -9.989 1.00 0.00 O ATOM 443 CB ASP A 771 5.462 -0.790 -11.009 1.00 0.00 C ATOM 444 CG ASP A 771 6.493 -1.518 -11.848 1.00 0.00 C ATOM 445 OD1 ASP A 771 7.305 -0.839 -12.512 1.00 0.00 O ATOM 446 OD2 ASP A 771 6.489 -2.766 -11.841 1.00 0.00 O ATOM 0 H ASP A 771 6.060 1.307 -12.157 1.00 0.00 H new ATOM 0 HA ASP A 771 4.123 -0.647 -12.683 1.00 0.00 H new ATOM 0 HB2 ASP A 771 5.969 -0.102 -10.333 1.00 0.00 H new ATOM 0 HB3 ASP A 771 4.928 -1.510 -10.389 1.00 0.00 H new ATOM 451 N VAL A 772 2.064 -0.056 -11.467 1.00 0.00 N ATOM 452 CA VAL A 772 0.826 0.239 -10.756 1.00 0.00 C ATOM 453 C VAL A 772 0.685 -0.634 -9.514 1.00 0.00 C ATOM 454 O VAL A 772 1.151 -1.774 -9.486 1.00 0.00 O ATOM 455 CB VAL A 772 -0.404 0.029 -11.659 1.00 0.00 C ATOM 456 CG1 VAL A 772 -1.680 0.397 -10.918 1.00 0.00 C ATOM 457 CG2 VAL A 772 -0.269 0.840 -12.939 1.00 0.00 C ATOM 0 H VAL A 772 1.941 -0.604 -12.319 1.00 0.00 H new ATOM 0 HA VAL A 772 0.874 1.286 -10.458 1.00 0.00 H new ATOM 0 HB VAL A 772 -0.460 -1.026 -11.928 1.00 0.00 H new ATOM 0 HG11 VAL A 772 -2.538 0.242 -11.572 1.00 0.00 H new ATOM 0 HG12 VAL A 772 -1.781 -0.231 -10.033 1.00 0.00 H new ATOM 0 HG13 VAL A 772 -1.637 1.444 -10.617 1.00 0.00 H new ATOM 0 HG21 VAL A 772 -1.147 0.680 -13.565 1.00 0.00 H new ATOM 0 HG22 VAL A 772 -0.188 1.899 -12.692 1.00 0.00 H new ATOM 0 HG23 VAL A 772 0.624 0.523 -13.478 1.00 0.00 H new ATOM 467 N LEU A 773 0.040 -0.091 -8.487 1.00 0.00 N ATOM 468 CA LEU A 773 -0.164 -0.820 -7.240 1.00 0.00 C ATOM 469 C LEU A 773 -1.547 -0.536 -6.662 1.00 0.00 C ATOM 470 O LEU A 773 -1.989 0.613 -6.621 1.00 0.00 O ATOM 471 CB LEU A 773 0.914 -0.441 -6.223 1.00 0.00 C ATOM 472 CG LEU A 773 2.269 -0.033 -6.801 1.00 0.00 C ATOM 473 CD1 LEU A 773 2.969 0.951 -5.878 1.00 0.00 C ATOM 474 CD2 LEU A 773 3.140 -1.259 -7.036 1.00 0.00 C ATOM 0 H LEU A 773 -0.351 0.851 -8.493 1.00 0.00 H new ATOM 0 HA LEU A 773 -0.093 -1.886 -7.456 1.00 0.00 H new ATOM 0 HB2 LEU A 773 0.538 0.382 -5.615 1.00 0.00 H new ATOM 0 HB3 LEU A 773 1.067 -1.288 -5.554 1.00 0.00 H new ATOM 0 HG LEU A 773 2.100 0.457 -7.760 1.00 0.00 H new ATOM 0 HD11 LEU A 773 3.932 1.230 -6.306 1.00 0.00 H new ATOM 0 HD12 LEU A 773 2.352 1.842 -5.761 1.00 0.00 H new ATOM 0 HD13 LEU A 773 3.126 0.488 -4.904 1.00 0.00 H new ATOM 0 HD21 LEU A 773 4.101 -0.949 -7.448 1.00 0.00 H new ATOM 0 HD22 LEU A 773 3.300 -1.778 -6.091 1.00 0.00 H new ATOM 0 HD23 LEU A 773 2.643 -1.929 -7.738 1.00 0.00 H new ATOM 486 N ARG A 774 -2.224 -1.589 -6.216 1.00 0.00 N ATOM 487 CA ARG A 774 -3.556 -1.452 -5.640 1.00 0.00 C ATOM 488 C ARG A 774 -3.475 -1.018 -4.179 1.00 0.00 C ATOM 489 O ARG A 774 -2.755 -1.619 -3.381 1.00 0.00 O ATOM 490 CB ARG A 774 -4.320 -2.773 -5.748 1.00 0.00 C ATOM 491 CG ARG A 774 -5.035 -2.955 -7.077 1.00 0.00 C ATOM 492 CD ARG A 774 -5.944 -4.174 -7.058 1.00 0.00 C ATOM 493 NE ARG A 774 -6.620 -4.373 -8.338 1.00 0.00 N ATOM 494 CZ ARG A 774 -7.711 -5.117 -8.485 1.00 0.00 C ATOM 495 NH1 ARG A 774 -8.246 -5.728 -7.437 1.00 0.00 N ATOM 496 NH2 ARG A 774 -8.268 -5.249 -9.681 1.00 0.00 N ATOM 0 H ARG A 774 -1.872 -2.546 -6.243 1.00 0.00 H new ATOM 0 HA ARG A 774 -4.089 -0.684 -6.201 1.00 0.00 H new ATOM 0 HB2 ARG A 774 -3.623 -3.599 -5.603 1.00 0.00 H new ATOM 0 HB3 ARG A 774 -5.051 -2.828 -4.941 1.00 0.00 H new ATOM 0 HG2 ARG A 774 -5.623 -2.065 -7.300 1.00 0.00 H new ATOM 0 HG3 ARG A 774 -4.300 -3.060 -7.875 1.00 0.00 H new ATOM 0 HD2 ARG A 774 -5.357 -5.060 -6.816 1.00 0.00 H new ATOM 0 HD3 ARG A 774 -6.688 -4.059 -6.269 1.00 0.00 H new ATOM 0 HE ARG A 774 -6.233 -3.916 -9.164 1.00 0.00 H new ATOM 0 HH11 ARG A 774 -7.820 -5.627 -6.516 1.00 0.00 H new ATOM 0 HH12 ARG A 774 -9.084 -6.299 -7.552 1.00 0.00 H new ATOM 0 HH21 ARG A 774 -7.859 -4.779 -10.489 1.00 0.00 H new ATOM 0 HH22 ARG A 774 -9.106 -5.820 -9.793 1.00 0.00 H new ATOM 510 N LEU A 775 -4.216 0.030 -3.836 1.00 0.00 N ATOM 511 CA LEU A 775 -4.228 0.545 -2.472 1.00 0.00 C ATOM 512 C LEU A 775 -5.368 -0.070 -1.667 1.00 0.00 C ATOM 513 O LEU A 775 -6.509 0.389 -1.736 1.00 0.00 O ATOM 514 CB LEU A 775 -4.360 2.069 -2.482 1.00 0.00 C ATOM 515 CG LEU A 775 -3.413 2.819 -3.420 1.00 0.00 C ATOM 516 CD1 LEU A 775 -3.535 4.321 -3.213 1.00 0.00 C ATOM 517 CD2 LEU A 775 -1.977 2.364 -3.202 1.00 0.00 C ATOM 0 H LEU A 775 -4.816 0.540 -4.484 1.00 0.00 H new ATOM 0 HA LEU A 775 -3.285 0.271 -1.999 1.00 0.00 H new ATOM 0 HB2 LEU A 775 -5.385 2.323 -2.753 1.00 0.00 H new ATOM 0 HB3 LEU A 775 -4.199 2.434 -1.468 1.00 0.00 H new ATOM 0 HG LEU A 775 -3.694 2.591 -4.448 1.00 0.00 H new ATOM 0 HD11 LEU A 775 -2.854 4.838 -3.889 1.00 0.00 H new ATOM 0 HD12 LEU A 775 -4.558 4.635 -3.419 1.00 0.00 H new ATOM 0 HD13 LEU A 775 -3.280 4.568 -2.182 1.00 0.00 H new ATOM 0 HD21 LEU A 775 -1.317 2.908 -3.877 1.00 0.00 H new ATOM 0 HD22 LEU A 775 -1.685 2.563 -2.171 1.00 0.00 H new ATOM 0 HD23 LEU A 775 -1.900 1.295 -3.401 1.00 0.00 H new ATOM 529 N HIS A 776 -5.053 -1.110 -0.903 1.00 0.00 N ATOM 530 CA HIS A 776 -6.050 -1.787 -0.082 1.00 0.00 C ATOM 531 C HIS A 776 -6.730 -0.805 0.867 1.00 0.00 C ATOM 532 O HIS A 776 -7.956 -0.697 0.890 1.00 0.00 O ATOM 533 CB HIS A 776 -5.403 -2.920 0.715 1.00 0.00 C ATOM 534 CG HIS A 776 -4.661 -3.903 -0.136 1.00 0.00 C ATOM 535 ND1 HIS A 776 -4.222 -5.124 0.332 1.00 0.00 N ATOM 536 CD2 HIS A 776 -4.282 -3.842 -1.434 1.00 0.00 C ATOM 537 CE1 HIS A 776 -3.604 -5.770 -0.640 1.00 0.00 C ATOM 538 NE2 HIS A 776 -3.627 -5.014 -1.723 1.00 0.00 N ATOM 0 H HIS A 776 -4.114 -1.503 -0.835 1.00 0.00 H new ATOM 0 HA HIS A 776 -6.806 -2.207 -0.746 1.00 0.00 H new ATOM 0 HB2 HIS A 776 -4.716 -2.493 1.445 1.00 0.00 H new ATOM 0 HB3 HIS A 776 -6.176 -3.447 1.274 1.00 0.00 H new ATOM 0 HD1 HIS A 776 -4.354 -5.474 1.281 1.00 0.00 H new ATOM 0 HD2 HIS A 776 -4.461 -3.024 -2.116 1.00 0.00 H new ATOM 0 HE1 HIS A 776 -3.156 -6.750 -0.563 1.00 0.00 H new ATOM 546 N GLU A 777 -5.925 -0.091 1.649 1.00 0.00 N ATOM 547 CA GLU A 777 -6.450 0.881 2.601 1.00 0.00 C ATOM 548 C GLU A 777 -5.341 1.795 3.112 1.00 0.00 C ATOM 549 O GLU A 777 -4.162 1.444 3.066 1.00 0.00 O ATOM 550 CB GLU A 777 -7.119 0.166 3.777 1.00 0.00 C ATOM 551 CG GLU A 777 -6.135 -0.499 4.724 1.00 0.00 C ATOM 552 CD GLU A 777 -6.758 -0.847 6.062 1.00 0.00 C ATOM 553 OE1 GLU A 777 -7.301 0.067 6.718 1.00 0.00 O ATOM 554 OE2 GLU A 777 -6.702 -2.031 6.454 1.00 0.00 O ATOM 0 H GLU A 777 -4.908 -0.168 1.642 1.00 0.00 H new ATOM 0 HA GLU A 777 -7.192 1.491 2.086 1.00 0.00 H new ATOM 0 HB2 GLU A 777 -7.718 0.885 4.335 1.00 0.00 H new ATOM 0 HB3 GLU A 777 -7.805 -0.588 3.390 1.00 0.00 H new ATOM 0 HG2 GLU A 777 -5.747 -1.406 4.261 1.00 0.00 H new ATOM 0 HG3 GLU A 777 -5.286 0.165 4.885 1.00 0.00 H new ATOM 561 N ARG A 778 -5.728 2.971 3.597 1.00 0.00 N ATOM 562 CA ARG A 778 -4.768 3.937 4.115 1.00 0.00 C ATOM 563 C ARG A 778 -4.013 3.366 5.312 1.00 0.00 C ATOM 564 O ARG A 778 -4.619 2.878 6.265 1.00 0.00 O ATOM 565 CB ARG A 778 -5.479 5.230 4.517 1.00 0.00 C ATOM 566 CG ARG A 778 -4.592 6.462 4.444 1.00 0.00 C ATOM 567 CD ARG A 778 -4.282 6.841 3.005 1.00 0.00 C ATOM 568 NE ARG A 778 -4.031 8.272 2.857 1.00 0.00 N ATOM 569 CZ ARG A 778 -4.995 9.180 2.755 1.00 0.00 C ATOM 570 NH1 ARG A 778 -6.267 8.808 2.786 1.00 0.00 N ATOM 571 NH2 ARG A 778 -4.687 10.464 2.623 1.00 0.00 N ATOM 0 H ARG A 778 -6.700 3.277 3.642 1.00 0.00 H new ATOM 0 HA ARG A 778 -4.050 4.156 3.325 1.00 0.00 H new ATOM 0 HB2 ARG A 778 -6.343 5.376 3.869 1.00 0.00 H new ATOM 0 HB3 ARG A 778 -5.858 5.125 5.534 1.00 0.00 H new ATOM 0 HG2 ARG A 778 -5.085 7.296 4.943 1.00 0.00 H new ATOM 0 HG3 ARG A 778 -3.662 6.274 4.980 1.00 0.00 H new ATOM 0 HD2 ARG A 778 -3.410 6.283 2.663 1.00 0.00 H new ATOM 0 HD3 ARG A 778 -5.116 6.552 2.366 1.00 0.00 H new ATOM 0 HE ARG A 778 -3.063 8.592 2.831 1.00 0.00 H new ATOM 0 HH11 ARG A 778 -6.508 7.822 2.888 1.00 0.00 H new ATOM 0 HH12 ARG A 778 -7.005 9.508 2.707 1.00 0.00 H new ATOM 0 HH21 ARG A 778 -3.709 10.754 2.600 1.00 0.00 H new ATOM 0 HH22 ARG A 778 -5.428 11.161 2.545 1.00 0.00 H new ATOM 585 N ALA A 779 -2.687 3.430 5.254 1.00 0.00 N ATOM 586 CA ALA A 779 -1.850 2.920 6.333 1.00 0.00 C ATOM 587 C ALA A 779 -1.434 4.040 7.281 1.00 0.00 C ATOM 588 O ALA A 779 -1.450 3.872 8.500 1.00 0.00 O ATOM 589 CB ALA A 779 -0.622 2.224 5.765 1.00 0.00 C ATOM 0 H ALA A 779 -2.169 3.830 4.471 1.00 0.00 H new ATOM 0 HA ALA A 779 -2.434 2.196 6.901 1.00 0.00 H new ATOM 0 HB1 ALA A 779 -0.006 1.848 6.582 1.00 0.00 H new ATOM 0 HB2 ALA A 779 -0.935 1.392 5.134 1.00 0.00 H new ATOM 0 HB3 ALA A 779 -0.044 2.932 5.171 1.00 0.00 H new ATOM 595 N SER A 780 -1.063 5.183 6.713 1.00 0.00 N ATOM 596 CA SER A 780 -0.639 6.329 7.508 1.00 0.00 C ATOM 597 C SER A 780 -1.007 7.637 6.814 1.00 0.00 C ATOM 598 O SER A 780 -1.633 7.636 5.754 1.00 0.00 O ATOM 599 CB SER A 780 0.870 6.276 7.754 1.00 0.00 C ATOM 600 OG SER A 780 1.212 6.922 8.968 1.00 0.00 O ATOM 0 H SER A 780 -1.048 5.340 5.705 1.00 0.00 H new ATOM 0 HA SER A 780 -1.157 6.287 8.466 1.00 0.00 H new ATOM 0 HB2 SER A 780 1.200 5.238 7.785 1.00 0.00 H new ATOM 0 HB3 SER A 780 1.394 6.752 6.925 1.00 0.00 H new ATOM 0 HG SER A 780 2.181 6.873 9.103 1.00 0.00 H new ATOM 606 N SER A 781 -0.613 8.753 7.420 1.00 0.00 N ATOM 607 CA SER A 781 -0.903 10.069 6.864 1.00 0.00 C ATOM 608 C SER A 781 -0.164 10.277 5.546 1.00 0.00 C ATOM 609 O SER A 781 -0.622 11.015 4.674 1.00 0.00 O ATOM 610 CB SER A 781 -0.514 11.164 7.859 1.00 0.00 C ATOM 611 OG SER A 781 -0.661 12.451 7.284 1.00 0.00 O ATOM 0 H SER A 781 -0.092 8.771 8.297 1.00 0.00 H new ATOM 0 HA SER A 781 -1.974 10.127 6.672 1.00 0.00 H new ATOM 0 HB2 SER A 781 -1.136 11.087 8.751 1.00 0.00 H new ATOM 0 HB3 SER A 781 0.518 11.020 8.178 1.00 0.00 H new ATOM 0 HG SER A 781 -0.408 13.133 7.940 1.00 0.00 H new ATOM 617 N ASP A 782 0.984 9.622 5.409 1.00 0.00 N ATOM 618 CA ASP A 782 1.788 9.733 4.198 1.00 0.00 C ATOM 619 C ASP A 782 2.211 8.355 3.698 1.00 0.00 C ATOM 620 O ASP A 782 3.313 8.185 3.176 1.00 0.00 O ATOM 621 CB ASP A 782 3.023 10.596 4.458 1.00 0.00 C ATOM 622 CG ASP A 782 2.752 12.073 4.251 1.00 0.00 C ATOM 623 OD1 ASP A 782 2.076 12.677 5.110 1.00 0.00 O ATOM 624 OD2 ASP A 782 3.214 12.625 3.230 1.00 0.00 O ATOM 0 H ASP A 782 1.378 9.009 6.122 1.00 0.00 H new ATOM 0 HA ASP A 782 1.178 10.207 3.429 1.00 0.00 H new ATOM 0 HB2 ASP A 782 3.368 10.433 5.479 1.00 0.00 H new ATOM 0 HB3 ASP A 782 3.829 10.281 3.795 1.00 0.00 H new ATOM 629 N TRP A 783 1.329 7.376 3.862 1.00 0.00 N ATOM 630 CA TRP A 783 1.612 6.012 3.428 1.00 0.00 C ATOM 631 C TRP A 783 0.332 5.299 3.005 1.00 0.00 C ATOM 632 O TRP A 783 -0.765 5.839 3.144 1.00 0.00 O ATOM 633 CB TRP A 783 2.299 5.231 4.549 1.00 0.00 C ATOM 634 CG TRP A 783 3.705 5.680 4.810 1.00 0.00 C ATOM 635 CD1 TRP A 783 4.103 6.681 5.649 1.00 0.00 C ATOM 636 CD2 TRP A 783 4.898 5.144 4.228 1.00 0.00 C ATOM 637 NE1 TRP A 783 5.472 6.800 5.623 1.00 0.00 N ATOM 638 CE2 TRP A 783 5.983 5.868 4.760 1.00 0.00 C ATOM 639 CE3 TRP A 783 5.156 4.122 3.310 1.00 0.00 C ATOM 640 CZ2 TRP A 783 7.302 5.601 4.402 1.00 0.00 C ATOM 641 CZ3 TRP A 783 6.465 3.859 2.957 1.00 0.00 C ATOM 642 CH2 TRP A 783 7.525 4.595 3.502 1.00 0.00 C ATOM 0 H TRP A 783 0.412 7.500 4.292 1.00 0.00 H new ATOM 0 HA TRP A 783 2.279 6.062 2.568 1.00 0.00 H new ATOM 0 HB2 TRP A 783 1.716 5.335 5.464 1.00 0.00 H new ATOM 0 HB3 TRP A 783 2.305 4.171 4.293 1.00 0.00 H new ATOM 0 HD1 TRP A 783 3.440 7.290 6.245 1.00 0.00 H new ATOM 0 HE1 TRP A 783 6.019 7.473 6.160 1.00 0.00 H new ATOM 0 HE3 TRP A 783 4.346 3.548 2.884 1.00 0.00 H new ATOM 0 HZ2 TRP A 783 8.120 6.168 4.820 1.00 0.00 H new ATOM 0 HZ3 TRP A 783 6.675 3.072 2.248 1.00 0.00 H new ATOM 0 HH2 TRP A 783 8.538 4.364 3.206 1.00 0.00 H new ATOM 653 N TRP A 784 0.480 4.085 2.488 1.00 0.00 N ATOM 654 CA TRP A 784 -0.665 3.298 2.045 1.00 0.00 C ATOM 655 C TRP A 784 -0.390 1.806 2.191 1.00 0.00 C ATOM 656 O TRP A 784 0.719 1.401 2.541 1.00 0.00 O ATOM 657 CB TRP A 784 -1.003 3.627 0.590 1.00 0.00 C ATOM 658 CG TRP A 784 -1.506 5.026 0.398 1.00 0.00 C ATOM 659 CD1 TRP A 784 -0.758 6.168 0.363 1.00 0.00 C ATOM 660 CD2 TRP A 784 -2.867 5.430 0.218 1.00 0.00 C ATOM 661 NE1 TRP A 784 -1.572 7.258 0.171 1.00 0.00 N ATOM 662 CE2 TRP A 784 -2.871 6.832 0.078 1.00 0.00 C ATOM 663 CE3 TRP A 784 -4.083 4.744 0.159 1.00 0.00 C ATOM 664 CZ2 TRP A 784 -4.043 7.557 -0.115 1.00 0.00 C ATOM 665 CZ3 TRP A 784 -5.246 5.466 -0.033 1.00 0.00 C ATOM 666 CH2 TRP A 784 -5.220 6.860 -0.169 1.00 0.00 C ATOM 0 H TRP A 784 1.382 3.624 2.365 1.00 0.00 H new ATOM 0 HA TRP A 784 -1.516 3.554 2.676 1.00 0.00 H new ATOM 0 HB2 TRP A 784 -0.114 3.481 -0.024 1.00 0.00 H new ATOM 0 HB3 TRP A 784 -1.757 2.925 0.232 1.00 0.00 H new ATOM 0 HD1 TRP A 784 0.316 6.208 0.470 1.00 0.00 H new ATOM 0 HE1 TRP A 784 -1.260 8.227 0.108 1.00 0.00 H new ATOM 0 HE3 TRP A 784 -4.114 3.669 0.262 1.00 0.00 H new ATOM 0 HZ2 TRP A 784 -4.025 8.632 -0.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 784 -6.192 4.946 -0.079 1.00 0.00 H new ATOM 0 HH2 TRP A 784 -6.146 7.395 -0.319 1.00 0.00 H new ATOM 677 N ARG A 785 -1.405 0.992 1.922 1.00 0.00 N ATOM 678 CA ARG A 785 -1.272 -0.456 2.024 1.00 0.00 C ATOM 679 C ARG A 785 -1.665 -1.133 0.714 1.00 0.00 C ATOM 680 O ARG A 785 -2.827 -1.102 0.312 1.00 0.00 O ATOM 681 CB ARG A 785 -2.139 -0.990 3.166 1.00 0.00 C ATOM 682 CG ARG A 785 -1.515 -0.808 4.541 1.00 0.00 C ATOM 683 CD ARG A 785 -2.049 -1.829 5.534 1.00 0.00 C ATOM 684 NE ARG A 785 -1.411 -1.704 6.842 1.00 0.00 N ATOM 685 CZ ARG A 785 -1.626 -2.546 7.847 1.00 0.00 C ATOM 686 NH1 ARG A 785 -2.457 -3.568 7.694 1.00 0.00 N ATOM 687 NH2 ARG A 785 -1.009 -2.366 9.008 1.00 0.00 N ATOM 0 H ARG A 785 -2.329 1.311 1.632 1.00 0.00 H new ATOM 0 HA ARG A 785 -0.227 -0.685 2.232 1.00 0.00 H new ATOM 0 HB2 ARG A 785 -3.105 -0.485 3.145 1.00 0.00 H new ATOM 0 HB3 ARG A 785 -2.330 -2.050 3.001 1.00 0.00 H new ATOM 0 HG2 ARG A 785 -0.432 -0.904 4.466 1.00 0.00 H new ATOM 0 HG3 ARG A 785 -1.722 0.198 4.905 1.00 0.00 H new ATOM 0 HD2 ARG A 785 -3.126 -1.701 5.642 1.00 0.00 H new ATOM 0 HD3 ARG A 785 -1.885 -2.834 5.145 1.00 0.00 H new ATOM 0 HE ARG A 785 -0.766 -0.928 6.992 1.00 0.00 H new ATOM 0 HH11 ARG A 785 -2.933 -3.709 6.803 1.00 0.00 H new ATOM 0 HH12 ARG A 785 -2.620 -4.213 8.467 1.00 0.00 H new ATOM 0 HH21 ARG A 785 -0.369 -1.581 9.129 1.00 0.00 H new ATOM 0 HH22 ARG A 785 -1.175 -3.013 9.779 1.00 0.00 H new ATOM 701 N GLY A 786 -0.686 -1.743 0.053 1.00 0.00 N ATOM 702 CA GLY A 786 -0.949 -2.418 -1.205 1.00 0.00 C ATOM 703 C GLY A 786 -0.157 -3.702 -1.351 1.00 0.00 C ATOM 704 O GLY A 786 0.652 -4.040 -0.488 1.00 0.00 O ATOM 0 H GLY A 786 0.284 -1.782 0.366 1.00 0.00 H new ATOM 0 HA2 GLY A 786 -2.013 -2.641 -1.278 1.00 0.00 H new ATOM 0 HA3 GLY A 786 -0.706 -1.749 -2.030 1.00 0.00 H new ATOM 708 N GLU A 787 -0.392 -4.419 -2.446 1.00 0.00 N ATOM 709 CA GLU A 787 0.305 -5.674 -2.700 1.00 0.00 C ATOM 710 C GLU A 787 0.928 -5.679 -4.093 1.00 0.00 C ATOM 711 O GLU A 787 0.232 -5.516 -5.096 1.00 0.00 O ATOM 712 CB GLU A 787 -0.656 -6.856 -2.555 1.00 0.00 C ATOM 713 CG GLU A 787 -0.237 -8.082 -3.348 1.00 0.00 C ATOM 714 CD GLU A 787 -1.233 -9.220 -3.231 1.00 0.00 C ATOM 715 OE1 GLU A 787 -2.448 -8.961 -3.355 1.00 0.00 O ATOM 716 OE2 GLU A 787 -0.796 -10.370 -3.016 1.00 0.00 O ATOM 0 H GLU A 787 -1.059 -4.152 -3.170 1.00 0.00 H new ATOM 0 HA GLU A 787 1.103 -5.771 -1.964 1.00 0.00 H new ATOM 0 HB2 GLU A 787 -0.732 -7.124 -1.501 1.00 0.00 H new ATOM 0 HB3 GLU A 787 -1.650 -6.547 -2.878 1.00 0.00 H new ATOM 0 HG2 GLU A 787 -0.123 -7.810 -4.397 1.00 0.00 H new ATOM 0 HG3 GLU A 787 0.739 -8.420 -2.999 1.00 0.00 H new ATOM 723 N HIS A 788 2.243 -5.866 -4.147 1.00 0.00 N ATOM 724 CA HIS A 788 2.960 -5.892 -5.417 1.00 0.00 C ATOM 725 C HIS A 788 2.808 -7.249 -6.099 1.00 0.00 C ATOM 726 O HIS A 788 2.105 -8.128 -5.603 1.00 0.00 O ATOM 727 CB HIS A 788 4.441 -5.582 -5.197 1.00 0.00 C ATOM 728 CG HIS A 788 5.088 -4.896 -6.360 1.00 0.00 C ATOM 729 ND1 HIS A 788 6.453 -4.863 -6.550 1.00 0.00 N ATOM 730 CD2 HIS A 788 4.549 -4.216 -7.399 1.00 0.00 C ATOM 731 CE1 HIS A 788 6.726 -4.191 -7.654 1.00 0.00 C ATOM 732 NE2 HIS A 788 5.588 -3.788 -8.189 1.00 0.00 N ATOM 0 H HIS A 788 2.833 -6.002 -3.326 1.00 0.00 H new ATOM 0 HA HIS A 788 2.529 -5.129 -6.065 1.00 0.00 H new ATOM 0 HB2 HIS A 788 4.545 -4.954 -4.312 1.00 0.00 H new ATOM 0 HB3 HIS A 788 4.972 -6.512 -4.993 1.00 0.00 H new ATOM 0 HD1 HIS A 788 7.144 -5.291 -5.934 1.00 0.00 H new ATOM 0 HD2 HIS A 788 3.498 -4.042 -7.574 1.00 0.00 H new ATOM 0 HE1 HIS A 788 7.712 -4.003 -8.052 1.00 0.00 H new ATOM 740 N ASN A 789 3.471 -7.410 -7.240 1.00 0.00 N ATOM 741 CA ASN A 789 3.408 -8.658 -7.990 1.00 0.00 C ATOM 742 C ASN A 789 4.078 -9.791 -7.219 1.00 0.00 C ATOM 743 O ASN A 789 5.176 -10.227 -7.563 1.00 0.00 O ATOM 744 CB ASN A 789 4.077 -8.491 -9.356 1.00 0.00 C ATOM 745 CG ASN A 789 3.107 -8.019 -10.421 1.00 0.00 C ATOM 746 OD1 ASN A 789 2.761 -8.766 -11.337 1.00 0.00 O ATOM 747 ND2 ASN A 789 2.663 -6.772 -10.307 1.00 0.00 N ATOM 0 H ASN A 789 4.058 -6.692 -7.665 1.00 0.00 H new ATOM 0 HA ASN A 789 2.358 -8.912 -8.135 1.00 0.00 H new ATOM 0 HB2 ASN A 789 4.896 -7.776 -9.272 1.00 0.00 H new ATOM 0 HB3 ASN A 789 4.514 -9.441 -9.662 1.00 0.00 H new ATOM 0 HD21 ASN A 789 2.009 -6.399 -10.995 1.00 0.00 H new ATOM 0 HD22 ASN A 789 2.976 -6.188 -9.532 1.00 0.00 H new ATOM 754 N GLY A 790 3.408 -10.264 -6.172 1.00 0.00 N ATOM 755 CA GLY A 790 3.954 -11.343 -5.368 1.00 0.00 C ATOM 756 C GLY A 790 4.416 -10.871 -4.003 1.00 0.00 C ATOM 757 O GLY A 790 4.715 -11.683 -3.128 1.00 0.00 O ATOM 0 H GLY A 790 2.498 -9.920 -5.866 1.00 0.00 H new ATOM 0 HA2 GLY A 790 3.198 -12.119 -5.244 1.00 0.00 H new ATOM 0 HA3 GLY A 790 4.793 -11.797 -5.896 1.00 0.00 H new ATOM 761 N MET A 791 4.478 -9.556 -3.823 1.00 0.00 N ATOM 762 CA MET A 791 4.908 -8.979 -2.555 1.00 0.00 C ATOM 763 C MET A 791 3.770 -8.206 -1.895 1.00 0.00 C ATOM 764 O MET A 791 2.795 -7.838 -2.551 1.00 0.00 O ATOM 765 CB MET A 791 6.109 -8.056 -2.771 1.00 0.00 C ATOM 766 CG MET A 791 7.449 -8.764 -2.652 1.00 0.00 C ATOM 767 SD MET A 791 7.706 -9.494 -1.023 1.00 0.00 S ATOM 768 CE MET A 791 8.824 -8.302 -0.291 1.00 0.00 C ATOM 0 H MET A 791 4.236 -8.870 -4.538 1.00 0.00 H new ATOM 0 HA MET A 791 5.200 -9.795 -1.894 1.00 0.00 H new ATOM 0 HB2 MET A 791 6.034 -7.601 -3.759 1.00 0.00 H new ATOM 0 HB3 MET A 791 6.070 -7.246 -2.043 1.00 0.00 H new ATOM 0 HG2 MET A 791 7.512 -9.545 -3.410 1.00 0.00 H new ATOM 0 HG3 MET A 791 8.250 -8.054 -2.859 1.00 0.00 H new ATOM 0 HE1 MET A 791 9.077 -8.615 0.722 1.00 0.00 H new ATOM 0 HE2 MET A 791 9.733 -8.240 -0.889 1.00 0.00 H new ATOM 0 HE3 MET A 791 8.344 -7.324 -0.259 1.00 0.00 H new ATOM 778 N ARG A 792 3.902 -7.962 -0.595 1.00 0.00 N ATOM 779 CA ARG A 792 2.884 -7.234 0.152 1.00 0.00 C ATOM 780 C ARG A 792 3.522 -6.333 1.204 1.00 0.00 C ATOM 781 O ARG A 792 4.442 -6.742 1.912 1.00 0.00 O ATOM 782 CB ARG A 792 1.916 -8.211 0.822 1.00 0.00 C ATOM 783 CG ARG A 792 1.114 -9.046 -0.163 1.00 0.00 C ATOM 784 CD ARG A 792 -0.122 -9.645 0.490 1.00 0.00 C ATOM 785 NE ARG A 792 -1.135 -8.632 0.776 1.00 0.00 N ATOM 786 CZ ARG A 792 -2.324 -8.910 1.300 1.00 0.00 C ATOM 787 NH1 ARG A 792 -2.646 -10.161 1.595 1.00 0.00 N ATOM 788 NH2 ARG A 792 -3.193 -7.934 1.530 1.00 0.00 N ATOM 0 H ARG A 792 4.704 -8.258 -0.038 1.00 0.00 H new ATOM 0 HA ARG A 792 2.332 -6.609 -0.550 1.00 0.00 H new ATOM 0 HB2 ARG A 792 2.480 -8.877 1.475 1.00 0.00 H new ATOM 0 HB3 ARG A 792 1.228 -7.651 1.455 1.00 0.00 H new ATOM 0 HG2 ARG A 792 0.816 -8.426 -1.008 1.00 0.00 H new ATOM 0 HG3 ARG A 792 1.741 -9.845 -0.559 1.00 0.00 H new ATOM 0 HD2 ARG A 792 -0.545 -10.406 -0.165 1.00 0.00 H new ATOM 0 HD3 ARG A 792 0.163 -10.144 1.416 1.00 0.00 H new ATOM 0 HE ARG A 792 -0.918 -7.659 0.562 1.00 0.00 H new ATOM 0 HH11 ARG A 792 -1.980 -10.914 1.420 1.00 0.00 H new ATOM 0 HH12 ARG A 792 -3.559 -10.371 1.997 1.00 0.00 H new ATOM 0 HH21 ARG A 792 -2.948 -6.970 1.305 1.00 0.00 H new ATOM 0 HH22 ARG A 792 -4.106 -8.148 1.932 1.00 0.00 H new ATOM 802 N GLY A 793 3.028 -5.102 1.301 1.00 0.00 N ATOM 803 CA GLY A 793 3.563 -4.162 2.269 1.00 0.00 C ATOM 804 C GLY A 793 2.940 -2.786 2.146 1.00 0.00 C ATOM 805 O GLY A 793 1.889 -2.625 1.523 1.00 0.00 O ATOM 0 H GLY A 793 2.267 -4.739 0.727 1.00 0.00 H new ATOM 0 HA2 GLY A 793 3.394 -4.545 3.275 1.00 0.00 H new ATOM 0 HA3 GLY A 793 4.642 -4.082 2.136 1.00 0.00 H new ATOM 809 N LEU A 794 3.586 -1.790 2.741 1.00 0.00 N ATOM 810 CA LEU A 794 3.088 -0.419 2.697 1.00 0.00 C ATOM 811 C LEU A 794 3.468 0.256 1.382 1.00 0.00 C ATOM 812 O LEU A 794 4.110 -0.351 0.525 1.00 0.00 O ATOM 813 CB LEU A 794 3.643 0.384 3.874 1.00 0.00 C ATOM 814 CG LEU A 794 3.169 -0.046 5.263 1.00 0.00 C ATOM 815 CD1 LEU A 794 4.234 0.253 6.307 1.00 0.00 C ATOM 816 CD2 LEU A 794 1.861 0.646 5.618 1.00 0.00 C ATOM 0 H LEU A 794 4.456 -1.906 3.260 1.00 0.00 H new ATOM 0 HA LEU A 794 2.001 -0.451 2.767 1.00 0.00 H new ATOM 0 HB2 LEU A 794 4.731 0.323 3.848 1.00 0.00 H new ATOM 0 HB3 LEU A 794 3.379 1.432 3.730 1.00 0.00 H new ATOM 0 HG LEU A 794 2.995 -1.122 5.250 1.00 0.00 H new ATOM 0 HD11 LEU A 794 3.879 -0.060 7.289 1.00 0.00 H new ATOM 0 HD12 LEU A 794 5.147 -0.290 6.061 1.00 0.00 H new ATOM 0 HD13 LEU A 794 4.441 1.323 6.320 1.00 0.00 H new ATOM 0 HD21 LEU A 794 1.539 0.328 6.610 1.00 0.00 H new ATOM 0 HD22 LEU A 794 2.008 1.726 5.613 1.00 0.00 H new ATOM 0 HD23 LEU A 794 1.098 0.380 4.886 1.00 0.00 H new ATOM 828 N ILE A 795 3.067 1.514 1.233 1.00 0.00 N ATOM 829 CA ILE A 795 3.368 2.272 0.025 1.00 0.00 C ATOM 830 C ILE A 795 3.482 3.763 0.325 1.00 0.00 C ATOM 831 O ILE A 795 2.616 4.360 0.964 1.00 0.00 O ATOM 832 CB ILE A 795 2.293 2.058 -1.057 1.00 0.00 C ATOM 833 CG1 ILE A 795 2.416 0.657 -1.659 1.00 0.00 C ATOM 834 CG2 ILE A 795 2.413 3.119 -2.140 1.00 0.00 C ATOM 835 CD1 ILE A 795 1.357 0.349 -2.695 1.00 0.00 C ATOM 0 H ILE A 795 2.533 2.029 1.933 1.00 0.00 H new ATOM 0 HA ILE A 795 4.324 1.905 -0.347 1.00 0.00 H new ATOM 0 HB ILE A 795 1.310 2.149 -0.595 1.00 0.00 H new ATOM 0 HG12 ILE A 795 3.400 0.552 -2.115 1.00 0.00 H new ATOM 0 HG13 ILE A 795 2.355 -0.080 -0.858 1.00 0.00 H new ATOM 0 HG21 ILE A 795 1.647 2.954 -2.897 1.00 0.00 H new ATOM 0 HG22 ILE A 795 2.280 4.107 -1.698 1.00 0.00 H new ATOM 0 HG23 ILE A 795 3.398 3.058 -2.602 1.00 0.00 H new ATOM 0 HD11 ILE A 795 1.506 -0.660 -3.079 1.00 0.00 H new ATOM 0 HD12 ILE A 795 0.370 0.422 -2.239 1.00 0.00 H new ATOM 0 HD13 ILE A 795 1.431 1.063 -3.515 1.00 0.00 H new ATOM 847 N PRO A 796 4.575 4.380 -0.148 1.00 0.00 N ATOM 848 CA PRO A 796 4.827 5.810 0.055 1.00 0.00 C ATOM 849 C PRO A 796 3.867 6.687 -0.741 1.00 0.00 C ATOM 850 O PRO A 796 3.766 6.564 -1.962 1.00 0.00 O ATOM 851 CB PRO A 796 6.261 5.992 -0.448 1.00 0.00 C ATOM 852 CG PRO A 796 6.462 4.888 -1.427 1.00 0.00 C ATOM 853 CD PRO A 796 5.648 3.730 -0.918 1.00 0.00 C ATOM 0 HA PRO A 796 4.685 6.105 1.094 1.00 0.00 H new ATOM 0 HB2 PRO A 796 6.395 6.967 -0.917 1.00 0.00 H new ATOM 0 HB3 PRO A 796 6.978 5.931 0.370 1.00 0.00 H new ATOM 0 HG2 PRO A 796 6.136 5.186 -2.424 1.00 0.00 H new ATOM 0 HG3 PRO A 796 7.516 4.621 -1.503 1.00 0.00 H new ATOM 0 HD2 PRO A 796 5.249 3.129 -1.735 1.00 0.00 H new ATOM 0 HD3 PRO A 796 6.244 3.064 -0.294 1.00 0.00 H new ATOM 861 N HIS A 797 3.164 7.572 -0.043 1.00 0.00 N ATOM 862 CA HIS A 797 2.212 8.471 -0.687 1.00 0.00 C ATOM 863 C HIS A 797 2.938 9.586 -1.434 1.00 0.00 C ATOM 864 O HIS A 797 2.327 10.339 -2.193 1.00 0.00 O ATOM 865 CB HIS A 797 1.263 9.071 0.351 1.00 0.00 C ATOM 866 CG HIS A 797 0.399 10.169 -0.190 1.00 0.00 C ATOM 867 ND1 HIS A 797 -0.938 10.000 -0.481 1.00 0.00 N ATOM 868 CD2 HIS A 797 0.689 11.456 -0.493 1.00 0.00 C ATOM 869 CE1 HIS A 797 -1.433 11.135 -0.940 1.00 0.00 C ATOM 870 NE2 HIS A 797 -0.466 12.035 -0.957 1.00 0.00 N ATOM 0 H HIS A 797 3.235 7.687 0.968 1.00 0.00 H new ATOM 0 HA HIS A 797 1.633 7.892 -1.407 1.00 0.00 H new ATOM 0 HB2 HIS A 797 0.626 8.281 0.748 1.00 0.00 H new ATOM 0 HB3 HIS A 797 1.848 9.458 1.185 1.00 0.00 H new ATOM 0 HD2 HIS A 797 1.650 11.938 -0.389 1.00 0.00 H new ATOM 0 HE1 HIS A 797 -2.455 11.300 -1.249 1.00 0.00 H new ATOM 0 HE2 HIS A 797 -0.562 13.003 -1.265 1.00 0.00 H new ATOM 878 N LYS A 798 4.244 9.686 -1.214 1.00 0.00 N ATOM 879 CA LYS A 798 5.054 10.708 -1.866 1.00 0.00 C ATOM 880 C LYS A 798 5.538 10.230 -3.231 1.00 0.00 C ATOM 881 O LYS A 798 5.593 11.004 -4.187 1.00 0.00 O ATOM 882 CB LYS A 798 6.253 11.075 -0.988 1.00 0.00 C ATOM 883 CG LYS A 798 7.001 12.308 -1.465 1.00 0.00 C ATOM 884 CD LYS A 798 8.110 11.947 -2.438 1.00 0.00 C ATOM 885 CE LYS A 798 9.235 12.970 -2.406 1.00 0.00 C ATOM 886 NZ LYS A 798 8.766 14.323 -2.813 1.00 0.00 N ATOM 0 H LYS A 798 4.765 9.071 -0.589 1.00 0.00 H new ATOM 0 HA LYS A 798 4.432 11.592 -2.009 1.00 0.00 H new ATOM 0 HB2 LYS A 798 5.908 11.242 0.032 1.00 0.00 H new ATOM 0 HB3 LYS A 798 6.942 10.231 -0.958 1.00 0.00 H new ATOM 0 HG2 LYS A 798 6.304 12.994 -1.945 1.00 0.00 H new ATOM 0 HG3 LYS A 798 7.424 12.832 -0.608 1.00 0.00 H new ATOM 0 HD2 LYS A 798 8.506 10.962 -2.191 1.00 0.00 H new ATOM 0 HD3 LYS A 798 7.703 11.883 -3.447 1.00 0.00 H new ATOM 0 HE2 LYS A 798 9.654 13.018 -1.401 1.00 0.00 H new ATOM 0 HE3 LYS A 798 10.037 12.649 -3.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 798 9.581 14.964 -2.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 798 8.283 14.261 -3.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 798 8.106 14.691 -2.099 1.00 0.00 H new ATOM 900 N TYR A 799 5.885 8.950 -3.315 1.00 0.00 N ATOM 901 CA TYR A 799 6.365 8.369 -4.563 1.00 0.00 C ATOM 902 C TYR A 799 5.208 7.806 -5.382 1.00 0.00 C ATOM 903 O TYR A 799 5.339 6.767 -6.030 1.00 0.00 O ATOM 904 CB TYR A 799 7.386 7.267 -4.278 1.00 0.00 C ATOM 905 CG TYR A 799 8.693 7.783 -3.718 1.00 0.00 C ATOM 906 CD1 TYR A 799 8.719 8.568 -2.572 1.00 0.00 C ATOM 907 CD2 TYR A 799 9.902 7.486 -4.336 1.00 0.00 C ATOM 908 CE1 TYR A 799 9.910 9.042 -2.058 1.00 0.00 C ATOM 909 CE2 TYR A 799 11.098 7.954 -3.828 1.00 0.00 C ATOM 910 CZ TYR A 799 11.097 8.732 -2.689 1.00 0.00 C ATOM 911 OH TYR A 799 12.286 9.201 -2.180 1.00 0.00 O ATOM 0 H TYR A 799 5.843 8.296 -2.534 1.00 0.00 H new ATOM 0 HA TYR A 799 6.845 9.159 -5.141 1.00 0.00 H new ATOM 0 HB2 TYR A 799 6.954 6.556 -3.574 1.00 0.00 H new ATOM 0 HB3 TYR A 799 7.586 6.721 -5.200 1.00 0.00 H new ATOM 0 HD1 TYR A 799 7.792 8.812 -2.075 1.00 0.00 H new ATOM 0 HD2 TYR A 799 9.906 6.879 -5.229 1.00 0.00 H new ATOM 0 HE1 TYR A 799 9.912 9.652 -1.167 1.00 0.00 H new ATOM 0 HE2 TYR A 799 12.029 7.712 -4.320 1.00 0.00 H new ATOM 0 HH TYR A 799 13.027 8.892 -2.742 1.00 0.00 H new ATOM 921 N ILE A 800 4.075 8.499 -5.348 1.00 0.00 N ATOM 922 CA ILE A 800 2.894 8.070 -6.088 1.00 0.00 C ATOM 923 C ILE A 800 2.017 9.260 -6.461 1.00 0.00 C ATOM 924 O ILE A 800 2.166 10.353 -5.913 1.00 0.00 O ATOM 925 CB ILE A 800 2.057 7.063 -5.277 1.00 0.00 C ATOM 926 CG1 ILE A 800 1.567 7.704 -3.977 1.00 0.00 C ATOM 927 CG2 ILE A 800 2.872 5.812 -4.983 1.00 0.00 C ATOM 928 CD1 ILE A 800 0.358 7.016 -3.382 1.00 0.00 C ATOM 0 H ILE A 800 3.950 9.360 -4.816 1.00 0.00 H new ATOM 0 HA ILE A 800 3.250 7.585 -6.997 1.00 0.00 H new ATOM 0 HB ILE A 800 1.188 6.776 -5.869 1.00 0.00 H new ATOM 0 HG12 ILE A 800 2.377 7.692 -3.248 1.00 0.00 H new ATOM 0 HG13 ILE A 800 1.324 8.749 -4.166 1.00 0.00 H new ATOM 0 HG21 ILE A 800 2.267 5.110 -4.409 1.00 0.00 H new ATOM 0 HG22 ILE A 800 3.176 5.347 -5.921 1.00 0.00 H new ATOM 0 HG23 ILE A 800 3.758 6.082 -4.408 1.00 0.00 H new ATOM 0 HD11 ILE A 800 0.066 7.524 -2.463 1.00 0.00 H new ATOM 0 HD12 ILE A 800 -0.467 7.051 -4.093 1.00 0.00 H new ATOM 0 HD13 ILE A 800 0.603 5.977 -3.161 1.00 0.00 H new ATOM 940 N THR A 801 1.097 9.040 -7.396 1.00 0.00 N ATOM 941 CA THR A 801 0.195 10.093 -7.843 1.00 0.00 C ATOM 942 C THR A 801 -1.244 9.592 -7.911 1.00 0.00 C ATOM 943 O THR A 801 -1.668 9.029 -8.921 1.00 0.00 O ATOM 944 CB THR A 801 0.604 10.635 -9.225 1.00 0.00 C ATOM 945 OG1 THR A 801 1.846 11.341 -9.127 1.00 0.00 O ATOM 946 CG2 THR A 801 -0.468 11.560 -9.783 1.00 0.00 C ATOM 0 H THR A 801 0.958 8.141 -7.858 1.00 0.00 H new ATOM 0 HA THR A 801 0.263 10.898 -7.111 1.00 0.00 H new ATOM 0 HB THR A 801 0.720 9.789 -9.902 1.00 0.00 H new ATOM 0 HG1 THR A 801 2.100 11.681 -10.010 1.00 0.00 H new ATOM 0 HG21 THR A 801 -0.157 11.930 -10.760 1.00 0.00 H new ATOM 0 HG22 THR A 801 -1.405 11.012 -9.884 1.00 0.00 H new ATOM 0 HG23 THR A 801 -0.612 12.401 -9.105 1.00 0.00 H new ATOM 954 N LEU A 802 -1.990 9.801 -6.832 1.00 0.00 N ATOM 955 CA LEU A 802 -3.382 9.371 -6.770 1.00 0.00 C ATOM 956 C LEU A 802 -4.193 9.986 -7.905 1.00 0.00 C ATOM 957 O LEU A 802 -3.851 11.037 -8.447 1.00 0.00 O ATOM 958 CB LEU A 802 -3.996 9.756 -5.422 1.00 0.00 C ATOM 959 CG LEU A 802 -3.522 8.948 -4.214 1.00 0.00 C ATOM 960 CD1 LEU A 802 -4.194 9.446 -2.943 1.00 0.00 C ATOM 961 CD2 LEU A 802 -3.800 7.466 -4.421 1.00 0.00 C ATOM 0 H LEU A 802 -1.654 10.266 -5.988 1.00 0.00 H new ATOM 0 HA LEU A 802 -3.406 8.287 -6.877 1.00 0.00 H new ATOM 0 HB2 LEU A 802 -3.783 10.809 -5.236 1.00 0.00 H new ATOM 0 HB3 LEU A 802 -5.079 9.658 -5.497 1.00 0.00 H new ATOM 0 HG LEU A 802 -2.446 9.084 -4.109 1.00 0.00 H new ATOM 0 HD11 LEU A 802 -3.845 8.860 -2.093 1.00 0.00 H new ATOM 0 HD12 LEU A 802 -3.944 10.495 -2.787 1.00 0.00 H new ATOM 0 HD13 LEU A 802 -5.275 9.340 -3.037 1.00 0.00 H new ATOM 0 HD21 LEU A 802 -3.456 6.906 -3.551 1.00 0.00 H new ATOM 0 HD22 LEU A 802 -4.871 7.311 -4.552 1.00 0.00 H new ATOM 0 HD23 LEU A 802 -3.272 7.117 -5.309 1.00 0.00 H new ATOM 973 N PRO A 803 -5.296 9.317 -8.275 1.00 0.00 N ATOM 974 CA PRO A 803 -6.181 9.781 -9.348 1.00 0.00 C ATOM 975 C PRO A 803 -6.953 11.037 -8.960 1.00 0.00 C ATOM 976 O PRO A 803 -6.945 11.449 -7.800 1.00 0.00 O ATOM 977 CB PRO A 803 -7.139 8.605 -9.551 1.00 0.00 C ATOM 978 CG PRO A 803 -7.146 7.892 -8.243 1.00 0.00 C ATOM 979 CD PRO A 803 -5.764 8.057 -7.674 1.00 0.00 C ATOM 0 HA PRO A 803 -5.625 10.055 -10.245 1.00 0.00 H new ATOM 0 HB2 PRO A 803 -8.138 8.950 -9.819 1.00 0.00 H new ATOM 0 HB3 PRO A 803 -6.800 7.953 -10.356 1.00 0.00 H new ATOM 0 HG2 PRO A 803 -7.896 8.312 -7.573 1.00 0.00 H new ATOM 0 HG3 PRO A 803 -7.391 6.838 -8.374 1.00 0.00 H new ATOM 0 HD2 PRO A 803 -5.782 8.113 -6.586 1.00 0.00 H new ATOM 0 HD3 PRO A 803 -5.118 7.221 -7.940 1.00 0.00 H new ATOM 987 N ALA A 804 -7.621 11.641 -9.937 1.00 0.00 N ATOM 988 CA ALA A 804 -8.402 12.848 -9.696 1.00 0.00 C ATOM 989 C ALA A 804 -9.558 12.574 -8.741 1.00 0.00 C ATOM 990 O ALA A 804 -10.626 12.125 -9.156 1.00 0.00 O ATOM 991 CB ALA A 804 -8.923 13.411 -11.011 1.00 0.00 C ATOM 0 H ALA A 804 -7.637 11.314 -10.903 1.00 0.00 H new ATOM 0 HA ALA A 804 -7.749 13.586 -9.230 1.00 0.00 H new ATOM 0 HB1 ALA A 804 -9.504 14.312 -10.816 1.00 0.00 H new ATOM 0 HB2 ALA A 804 -8.083 13.655 -11.661 1.00 0.00 H new ATOM 0 HB3 ALA A 804 -9.556 12.670 -11.499 1.00 0.00 H new ATOM 997 N GLY A 805 -9.337 12.845 -7.458 1.00 0.00 N ATOM 998 CA GLY A 805 -10.369 12.620 -6.463 1.00 0.00 C ATOM 999 C GLY A 805 -9.883 12.884 -5.052 1.00 0.00 C ATOM 1000 O GLY A 805 -10.672 13.215 -4.167 1.00 0.00 O ATOM 0 H GLY A 805 -8.461 13.217 -7.090 1.00 0.00 H new ATOM 0 HA2 GLY A 805 -11.222 13.265 -6.677 1.00 0.00 H new ATOM 0 HA3 GLY A 805 -10.721 11.591 -6.536 1.00 0.00 H new ATOM 1004 N THR A 806 -8.579 12.737 -4.840 1.00 0.00 N ATOM 1005 CA THR A 806 -7.988 12.959 -3.526 1.00 0.00 C ATOM 1006 C THR A 806 -7.824 14.448 -3.242 1.00 0.00 C ATOM 1007 O THR A 806 -6.775 14.886 -2.771 1.00 0.00 O ATOM 1008 CB THR A 806 -6.616 12.270 -3.403 1.00 0.00 C ATOM 1009 OG1 THR A 806 -6.074 12.488 -2.096 1.00 0.00 O ATOM 1010 CG2 THR A 806 -5.650 12.798 -4.453 1.00 0.00 C ATOM 0 H THR A 806 -7.912 12.465 -5.562 1.00 0.00 H new ATOM 0 HA THR A 806 -8.670 12.525 -2.795 1.00 0.00 H new ATOM 0 HB THR A 806 -6.755 11.201 -3.564 1.00 0.00 H new ATOM 0 HG1 THR A 806 -6.060 13.449 -1.904 1.00 0.00 H new ATOM 0 HG21 THR A 806 -4.688 12.297 -4.347 1.00 0.00 H new ATOM 0 HG22 THR A 806 -6.052 12.604 -5.447 1.00 0.00 H new ATOM 0 HG23 THR A 806 -5.517 13.871 -4.318 1.00 0.00 H new ATOM 1018 N GLU A 807 -8.867 15.220 -3.532 1.00 0.00 N ATOM 1019 CA GLU A 807 -8.836 16.660 -3.307 1.00 0.00 C ATOM 1020 C GLU A 807 -7.446 17.225 -3.585 1.00 0.00 C ATOM 1021 O GLU A 807 -6.939 18.056 -2.832 1.00 0.00 O ATOM 1022 CB GLU A 807 -9.252 16.983 -1.870 1.00 0.00 C ATOM 1023 CG GLU A 807 -9.569 18.452 -1.644 1.00 0.00 C ATOM 1024 CD GLU A 807 -10.504 18.673 -0.471 1.00 0.00 C ATOM 1025 OE1 GLU A 807 -10.008 18.791 0.669 1.00 0.00 O ATOM 1026 OE2 GLU A 807 -11.731 18.728 -0.693 1.00 0.00 O ATOM 0 H GLU A 807 -9.743 14.872 -3.923 1.00 0.00 H new ATOM 0 HA GLU A 807 -9.542 17.125 -3.995 1.00 0.00 H new ATOM 0 HB2 GLU A 807 -10.127 16.387 -1.611 1.00 0.00 H new ATOM 0 HB3 GLU A 807 -8.452 16.684 -1.193 1.00 0.00 H new ATOM 0 HG2 GLU A 807 -8.641 18.998 -1.472 1.00 0.00 H new ATOM 0 HG3 GLU A 807 -10.020 18.866 -2.546 1.00 0.00 H new ATOM 1033 N LYS A 808 -6.834 16.766 -4.672 1.00 0.00 N ATOM 1034 CA LYS A 808 -5.503 17.224 -5.052 1.00 0.00 C ATOM 1035 C LYS A 808 -5.524 17.870 -6.434 1.00 0.00 C ATOM 1036 O LYS A 808 -6.454 17.660 -7.212 1.00 0.00 O ATOM 1037 CB LYS A 808 -4.516 16.055 -5.039 1.00 0.00 C ATOM 1038 CG LYS A 808 -3.070 16.482 -4.854 1.00 0.00 C ATOM 1039 CD LYS A 808 -2.148 15.283 -4.716 1.00 0.00 C ATOM 1040 CE LYS A 808 -1.908 14.607 -6.058 1.00 0.00 C ATOM 1041 NZ LYS A 808 -1.159 15.488 -6.996 1.00 0.00 N ATOM 0 H LYS A 808 -7.239 16.077 -5.305 1.00 0.00 H new ATOM 0 HA LYS A 808 -5.182 17.971 -4.326 1.00 0.00 H new ATOM 0 HB2 LYS A 808 -4.789 15.369 -4.237 1.00 0.00 H new ATOM 0 HB3 LYS A 808 -4.606 15.504 -5.975 1.00 0.00 H new ATOM 0 HG2 LYS A 808 -2.757 17.087 -5.705 1.00 0.00 H new ATOM 0 HG3 LYS A 808 -2.986 17.111 -3.968 1.00 0.00 H new ATOM 0 HD2 LYS A 808 -1.196 15.602 -4.293 1.00 0.00 H new ATOM 0 HD3 LYS A 808 -2.583 14.567 -4.019 1.00 0.00 H new ATOM 0 HE2 LYS A 808 -1.351 13.683 -5.905 1.00 0.00 H new ATOM 0 HE3 LYS A 808 -2.865 14.333 -6.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 808 -0.724 14.910 -7.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 808 -1.813 16.173 -7.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 808 -0.416 15.997 -6.476 1.00 0.00 H new ATOM 1055 N GLN A 809 -4.493 18.655 -6.731 1.00 0.00 N ATOM 1056 CA GLN A 809 -4.394 19.330 -8.020 1.00 0.00 C ATOM 1057 C GLN A 809 -3.563 18.511 -9.001 1.00 0.00 C ATOM 1058 O GLN A 809 -2.333 18.574 -8.993 1.00 0.00 O ATOM 1059 CB GLN A 809 -3.777 20.719 -7.845 1.00 0.00 C ATOM 1060 CG GLN A 809 -4.549 21.612 -6.888 1.00 0.00 C ATOM 1061 CD GLN A 809 -5.631 22.415 -7.582 1.00 0.00 C ATOM 1062 OE1 GLN A 809 -6.810 22.064 -7.532 1.00 0.00 O ATOM 1063 NE2 GLN A 809 -5.235 23.501 -8.237 1.00 0.00 N ATOM 0 H GLN A 809 -3.715 18.839 -6.097 1.00 0.00 H new ATOM 0 HA GLN A 809 -5.400 19.435 -8.425 1.00 0.00 H new ATOM 0 HB2 GLN A 809 -2.755 20.610 -7.482 1.00 0.00 H new ATOM 0 HB3 GLN A 809 -3.720 21.207 -8.818 1.00 0.00 H new ATOM 0 HG2 GLN A 809 -5.001 20.998 -6.109 1.00 0.00 H new ATOM 0 HG3 GLN A 809 -3.856 22.294 -6.395 1.00 0.00 H new ATOM 0 HE21 GLN A 809 -4.247 23.755 -8.253 1.00 0.00 H new ATOM 0 HE22 GLN A 809 -5.919 24.080 -8.724 1.00 0.00 H new ATOM 1072 N VAL A 810 -4.242 17.741 -9.846 1.00 0.00 N ATOM 1073 CA VAL A 810 -3.566 16.910 -10.834 1.00 0.00 C ATOM 1074 C VAL A 810 -2.521 17.710 -11.604 1.00 0.00 C ATOM 1075 O VAL A 810 -2.629 18.929 -11.733 1.00 0.00 O ATOM 1076 CB VAL A 810 -4.567 16.300 -11.833 1.00 0.00 C ATOM 1077 CG1 VAL A 810 -5.498 15.325 -11.129 1.00 0.00 C ATOM 1078 CG2 VAL A 810 -5.358 17.396 -12.531 1.00 0.00 C ATOM 0 H VAL A 810 -5.260 17.676 -9.866 1.00 0.00 H new ATOM 0 HA VAL A 810 -3.073 16.106 -10.287 1.00 0.00 H new ATOM 0 HB VAL A 810 -4.008 15.749 -12.589 1.00 0.00 H new ATOM 0 HG11 VAL A 810 -6.198 14.904 -11.851 1.00 0.00 H new ATOM 0 HG12 VAL A 810 -4.913 14.522 -10.681 1.00 0.00 H new ATOM 0 HG13 VAL A 810 -6.052 15.849 -10.350 1.00 0.00 H new ATOM 0 HG21 VAL A 810 -6.060 16.947 -13.233 1.00 0.00 H new ATOM 0 HG22 VAL A 810 -5.907 17.977 -11.790 1.00 0.00 H new ATOM 0 HG23 VAL A 810 -4.674 18.051 -13.071 1.00 0.00 H new ATOM 1088 N VAL A 811 -1.509 17.015 -12.113 1.00 0.00 N ATOM 1089 CA VAL A 811 -0.444 17.660 -12.872 1.00 0.00 C ATOM 1090 C VAL A 811 -0.932 18.084 -14.253 1.00 0.00 C ATOM 1091 O VAL A 811 -0.236 18.792 -14.978 1.00 0.00 O ATOM 1092 CB VAL A 811 0.773 16.730 -13.033 1.00 0.00 C ATOM 1093 CG1 VAL A 811 0.343 15.377 -13.579 1.00 0.00 C ATOM 1094 CG2 VAL A 811 1.817 17.370 -13.936 1.00 0.00 C ATOM 0 H VAL A 811 -1.404 16.005 -12.014 1.00 0.00 H new ATOM 0 HA VAL A 811 -0.145 18.544 -12.309 1.00 0.00 H new ATOM 0 HB VAL A 811 1.221 16.574 -12.052 1.00 0.00 H new ATOM 0 HG11 VAL A 811 1.216 14.734 -13.686 1.00 0.00 H new ATOM 0 HG12 VAL A 811 -0.366 14.916 -12.891 1.00 0.00 H new ATOM 0 HG13 VAL A 811 -0.130 15.511 -14.552 1.00 0.00 H new ATOM 0 HG21 VAL A 811 2.670 16.699 -14.039 1.00 0.00 H new ATOM 0 HG22 VAL A 811 1.383 17.558 -14.918 1.00 0.00 H new ATOM 0 HG23 VAL A 811 2.147 18.312 -13.499 1.00 0.00 H new ATOM 1104 N GLY A 812 -2.136 17.646 -14.609 1.00 0.00 N ATOM 1105 CA GLY A 812 -2.697 17.991 -15.902 1.00 0.00 C ATOM 1106 C GLY A 812 -3.803 17.043 -16.326 1.00 0.00 C ATOM 1107 O GLY A 812 -4.716 16.759 -15.551 1.00 0.00 O ATOM 0 H GLY A 812 -2.732 17.059 -14.026 1.00 0.00 H new ATOM 0 HA2 GLY A 812 -3.088 19.008 -15.865 1.00 0.00 H new ATOM 0 HA3 GLY A 812 -1.906 17.981 -16.652 1.00 0.00 H new ATOM 1111 N ALA A 813 -3.721 16.555 -17.559 1.00 0.00 N ATOM 1112 CA ALA A 813 -4.722 15.635 -18.083 1.00 0.00 C ATOM 1113 C ALA A 813 -4.381 14.192 -17.727 1.00 0.00 C ATOM 1114 O ALA A 813 -3.232 13.768 -17.843 1.00 0.00 O ATOM 1115 CB ALA A 813 -4.846 15.793 -19.592 1.00 0.00 C ATOM 0 H ALA A 813 -2.972 16.781 -18.213 1.00 0.00 H new ATOM 0 HA ALA A 813 -5.680 15.879 -17.623 1.00 0.00 H new ATOM 0 HB1 ALA A 813 -5.597 15.100 -19.970 1.00 0.00 H new ATOM 0 HB2 ALA A 813 -5.144 16.815 -19.828 1.00 0.00 H new ATOM 0 HB3 ALA A 813 -3.886 15.578 -20.060 1.00 0.00 H new ATOM 1121 N GLY A 814 -5.389 13.440 -17.293 1.00 0.00 N ATOM 1122 CA GLY A 814 -5.174 12.052 -16.925 1.00 0.00 C ATOM 1123 C GLY A 814 -6.442 11.227 -17.015 1.00 0.00 C ATOM 1124 O GLY A 814 -6.745 10.654 -18.062 1.00 0.00 O ATOM 0 H GLY A 814 -6.350 13.767 -17.190 1.00 0.00 H new ATOM 0 HA2 GLY A 814 -4.415 11.619 -17.577 1.00 0.00 H new ATOM 0 HA3 GLY A 814 -4.785 12.005 -15.908 1.00 0.00 H new TER 1128 GLY A 814