USER MOD reduce.3.24.130724 H: found=0, std=0, add=630, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 629 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 804 SER OG : rot 118:sc= 0.0488 USER MOD Set 1.2: A 843 TYR OH : rot 180:sc= -0.491 USER MOD Single : A 778 SER OG : rot 180:sc= 0 USER MOD Single : A 779 SER OG : rot 180:sc= 0 USER MOD Single : A 781 SER OG : rot 180:sc= 0 USER MOD Single : A 782 SER OG : rot 180:sc= 0 USER MOD Single : A 785 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0819) USER MOD Single : A 788 SER OG : rot 180:sc= 0 USER MOD Single : A 789 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 790 THR OG1 : rot 180:sc= 0 USER MOD Single : A 794 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0301) USER MOD Single : A 796 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 797 SER OG : rot 180:sc= 0 USER MOD Single : A 805 ASN : amide:sc= -3.36! C(o=-3.4!,f=-5!) USER MOD Single : A 806 HIS : no HD1:sc= -8.51! C(o=-8.5!,f=-6.7!) USER MOD Single : A 807 HIS : no HD1:sc= -0.0758 X(o=-0.076,f=0) USER MOD Single : A 810 SER OG : rot -53:sc= 0.127 USER MOD Single : A 811 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 812 SER OG : rot 180:sc= -0.0564 USER MOD Single : A 815 SER OG : rot 180:sc= 0 USER MOD Single : A 816 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 818 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 820 LYS NZ :NH3+ 161:sc= -0.0628 (180deg=-0.343) USER MOD Single : A 823 SER OG : rot 180:sc= 0 USER MOD Single : A 827 TYR OH : rot 30:sc= -0.0527 USER MOD Single : A 828 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 832 SER OG : rot 180:sc= 0 USER MOD Single : A 833 SER OG : rot 180:sc= 0 USER MOD Single : A 834 SER OG : rot 180:sc= 0 USER MOD Single : A 835 MET CE :methyl -155:sc= -0.228 (180deg=-0.908) USER MOD Single : A 841 LYS NZ :NH3+ -133:sc= -0.185 (180deg=-1.48) USER MOD Single : A 842 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 846 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 849 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 850 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 853 SER OG : rot 180:sc= 0 USER MOD Single : A 854 SER OG : rot 29:sc= 0.0638 USER MOD Single : A 857 SER OG : rot 180:sc= 0 USER MOD Single : A 858 SER OG : rot 58:sc= 0.643 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 777 -2.238 -19.030 -9.730 1.00 0.00 N ATOM 2 CA GLY A 777 -1.538 -18.463 -10.867 1.00 0.00 C ATOM 3 C GLY A 777 -0.151 -19.048 -11.046 1.00 0.00 C ATOM 4 O GLY A 777 0.851 -18.372 -10.810 1.00 0.00 O ATOM 0 HA2 GLY A 777 -2.121 -18.636 -11.772 1.00 0.00 H new ATOM 0 HA3 GLY A 777 -1.460 -17.383 -10.740 1.00 0.00 H new ATOM 8 N SER A 778 -0.091 -20.309 -11.462 1.00 0.00 N ATOM 9 CA SER A 778 1.183 -20.987 -11.666 1.00 0.00 C ATOM 10 C SER A 778 2.127 -20.734 -10.494 1.00 0.00 C ATOM 11 O SER A 778 3.320 -20.494 -10.684 1.00 0.00 O ATOM 12 CB SER A 778 1.832 -20.517 -12.969 1.00 0.00 C ATOM 13 OG SER A 778 2.673 -21.520 -13.511 1.00 0.00 O ATOM 0 H SER A 778 -0.910 -20.882 -11.664 1.00 0.00 H new ATOM 0 HA SER A 778 0.990 -22.058 -11.730 1.00 0.00 H new ATOM 0 HB2 SER A 778 1.058 -20.258 -13.691 1.00 0.00 H new ATOM 0 HB3 SER A 778 2.412 -19.613 -12.784 1.00 0.00 H new ATOM 0 HG SER A 778 3.074 -21.195 -14.344 1.00 0.00 H new ATOM 19 N SER A 779 1.584 -20.790 -9.282 1.00 0.00 N ATOM 20 CA SER A 779 2.376 -20.563 -8.079 1.00 0.00 C ATOM 21 C SER A 779 1.742 -21.251 -6.874 1.00 0.00 C ATOM 22 O SER A 779 0.523 -21.238 -6.708 1.00 0.00 O ATOM 23 CB SER A 779 2.514 -19.063 -7.809 1.00 0.00 C ATOM 24 OG SER A 779 3.108 -18.825 -6.544 1.00 0.00 O ATOM 0 H SER A 779 0.599 -20.991 -9.107 1.00 0.00 H new ATOM 0 HA SER A 779 3.366 -20.989 -8.240 1.00 0.00 H new ATOM 0 HB2 SER A 779 3.119 -18.604 -8.591 1.00 0.00 H new ATOM 0 HB3 SER A 779 1.532 -18.591 -7.848 1.00 0.00 H new ATOM 0 HG SER A 779 3.187 -17.859 -6.396 1.00 0.00 H new ATOM 30 N GLY A 780 2.580 -21.853 -6.035 1.00 0.00 N ATOM 31 CA GLY A 780 2.084 -22.539 -4.856 1.00 0.00 C ATOM 32 C GLY A 780 2.764 -23.876 -4.634 1.00 0.00 C ATOM 33 O GLY A 780 2.736 -24.746 -5.505 1.00 0.00 O ATOM 0 H GLY A 780 3.593 -21.878 -6.151 1.00 0.00 H new ATOM 0 HA2 GLY A 780 2.237 -21.907 -3.981 1.00 0.00 H new ATOM 0 HA3 GLY A 780 1.009 -22.693 -4.954 1.00 0.00 H new ATOM 37 N SER A 781 3.378 -24.039 -3.467 1.00 0.00 N ATOM 38 CA SER A 781 4.073 -25.277 -3.136 1.00 0.00 C ATOM 39 C SER A 781 3.437 -25.949 -1.922 1.00 0.00 C ATOM 40 O SER A 781 2.526 -25.402 -1.302 1.00 0.00 O ATOM 41 CB SER A 781 5.553 -24.999 -2.862 1.00 0.00 C ATOM 42 OG SER A 781 6.314 -25.068 -4.055 1.00 0.00 O ATOM 0 H SER A 781 3.408 -23.329 -2.735 1.00 0.00 H new ATOM 0 HA SER A 781 3.989 -25.951 -3.989 1.00 0.00 H new ATOM 0 HB2 SER A 781 5.664 -24.012 -2.413 1.00 0.00 H new ATOM 0 HB3 SER A 781 5.935 -25.722 -2.141 1.00 0.00 H new ATOM 0 HG SER A 781 7.255 -24.885 -3.854 1.00 0.00 H new ATOM 48 N SER A 782 3.926 -27.140 -1.590 1.00 0.00 N ATOM 49 CA SER A 782 3.404 -27.890 -0.453 1.00 0.00 C ATOM 50 C SER A 782 3.860 -27.269 0.864 1.00 0.00 C ATOM 51 O SER A 782 3.044 -26.933 1.721 1.00 0.00 O ATOM 52 CB SER A 782 3.858 -29.349 -0.526 1.00 0.00 C ATOM 53 OG SER A 782 3.061 -30.086 -1.438 1.00 0.00 O ATOM 0 H SER A 782 4.682 -27.606 -2.092 1.00 0.00 H new ATOM 0 HA SER A 782 2.315 -27.853 -0.494 1.00 0.00 H new ATOM 0 HB2 SER A 782 4.903 -29.393 -0.833 1.00 0.00 H new ATOM 0 HB3 SER A 782 3.797 -29.802 0.464 1.00 0.00 H new ATOM 0 HG SER A 782 3.372 -31.015 -1.468 1.00 0.00 H new ATOM 59 N GLY A 783 5.173 -27.118 1.016 1.00 0.00 N ATOM 60 CA GLY A 783 5.717 -26.538 2.230 1.00 0.00 C ATOM 61 C GLY A 783 7.230 -26.458 2.207 1.00 0.00 C ATOM 62 O GLY A 783 7.870 -26.961 1.284 1.00 0.00 O ATOM 0 H GLY A 783 5.869 -27.387 0.320 1.00 0.00 H new ATOM 0 HA2 GLY A 783 5.305 -25.538 2.367 1.00 0.00 H new ATOM 0 HA3 GLY A 783 5.401 -27.133 3.087 1.00 0.00 H new ATOM 66 N GLU A 784 7.803 -25.823 3.225 1.00 0.00 N ATOM 67 CA GLU A 784 9.251 -25.677 3.315 1.00 0.00 C ATOM 68 C GLU A 784 9.814 -25.038 2.049 1.00 0.00 C ATOM 69 O GLU A 784 10.755 -25.552 1.445 1.00 0.00 O ATOM 70 CB GLU A 784 9.910 -27.039 3.547 1.00 0.00 C ATOM 71 CG GLU A 784 10.061 -27.399 5.016 1.00 0.00 C ATOM 72 CD GLU A 784 10.335 -28.875 5.229 1.00 0.00 C ATOM 73 OE1 GLU A 784 9.509 -29.701 4.788 1.00 0.00 O ATOM 74 OE2 GLU A 784 11.374 -29.204 5.838 1.00 0.00 O ATOM 0 H GLU A 784 7.287 -25.402 3.998 1.00 0.00 H new ATOM 0 HA GLU A 784 9.472 -25.025 4.160 1.00 0.00 H new ATOM 0 HB2 GLU A 784 9.318 -27.809 3.052 1.00 0.00 H new ATOM 0 HB3 GLU A 784 10.894 -27.042 3.078 1.00 0.00 H new ATOM 0 HG2 GLU A 784 10.875 -26.816 5.447 1.00 0.00 H new ATOM 0 HG3 GLU A 784 9.152 -27.121 5.550 1.00 0.00 H new ATOM 81 N LYS A 785 9.230 -23.913 1.652 1.00 0.00 N ATOM 82 CA LYS A 785 9.671 -23.201 0.458 1.00 0.00 C ATOM 83 C LYS A 785 10.608 -22.054 0.824 1.00 0.00 C ATOM 84 O LYS A 785 10.237 -21.155 1.577 1.00 0.00 O ATOM 85 CB LYS A 785 8.465 -22.661 -0.314 1.00 0.00 C ATOM 86 CG LYS A 785 7.574 -21.747 0.510 1.00 0.00 C ATOM 87 CD LYS A 785 6.384 -21.254 -0.296 1.00 0.00 C ATOM 88 CE LYS A 785 5.536 -20.277 0.504 1.00 0.00 C ATOM 89 NZ LYS A 785 4.907 -20.927 1.687 1.00 0.00 N ATOM 0 H LYS A 785 8.449 -23.474 2.140 1.00 0.00 H new ATOM 0 HA LYS A 785 10.214 -23.904 -0.174 1.00 0.00 H new ATOM 0 HB2 LYS A 785 8.819 -22.117 -1.189 1.00 0.00 H new ATOM 0 HB3 LYS A 785 7.872 -23.500 -0.678 1.00 0.00 H new ATOM 0 HG2 LYS A 785 7.221 -22.280 1.393 1.00 0.00 H new ATOM 0 HG3 LYS A 785 8.154 -20.894 0.864 1.00 0.00 H new ATOM 0 HD2 LYS A 785 6.736 -20.771 -1.208 1.00 0.00 H new ATOM 0 HD3 LYS A 785 5.773 -22.103 -0.601 1.00 0.00 H new ATOM 0 HE2 LYS A 785 6.156 -19.444 0.835 1.00 0.00 H new ATOM 0 HE3 LYS A 785 4.759 -19.861 -0.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 785 4.221 -20.275 2.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 785 4.419 -21.795 1.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 785 5.642 -21.166 2.384 1.00 0.00 H new ATOM 103 N GLU A 786 11.822 -22.093 0.284 1.00 0.00 N ATOM 104 CA GLU A 786 12.811 -21.056 0.555 1.00 0.00 C ATOM 105 C GLU A 786 12.981 -20.138 -0.653 1.00 0.00 C ATOM 106 O GLU A 786 14.098 -19.752 -1.000 1.00 0.00 O ATOM 107 CB GLU A 786 14.156 -21.686 0.923 1.00 0.00 C ATOM 108 CG GLU A 786 14.197 -22.253 2.333 1.00 0.00 C ATOM 109 CD GLU A 786 14.263 -21.172 3.394 1.00 0.00 C ATOM 110 OE1 GLU A 786 15.124 -20.276 3.277 1.00 0.00 O ATOM 111 OE2 GLU A 786 13.452 -21.223 4.343 1.00 0.00 O ATOM 0 H GLU A 786 12.144 -22.830 -0.343 1.00 0.00 H new ATOM 0 HA GLU A 786 12.455 -20.461 1.396 1.00 0.00 H new ATOM 0 HB2 GLU A 786 14.381 -22.482 0.213 1.00 0.00 H new ATOM 0 HB3 GLU A 786 14.940 -20.936 0.819 1.00 0.00 H new ATOM 0 HG2 GLU A 786 13.312 -22.867 2.500 1.00 0.00 H new ATOM 0 HG3 GLU A 786 15.063 -22.908 2.432 1.00 0.00 H new ATOM 118 N ASP A 787 11.867 -19.794 -1.288 1.00 0.00 N ATOM 119 CA ASP A 787 11.891 -18.922 -2.457 1.00 0.00 C ATOM 120 C ASP A 787 11.139 -17.623 -2.181 1.00 0.00 C ATOM 121 O ASP A 787 10.436 -17.503 -1.177 1.00 0.00 O ATOM 122 CB ASP A 787 11.279 -19.634 -3.664 1.00 0.00 C ATOM 123 CG ASP A 787 12.257 -20.575 -4.338 1.00 0.00 C ATOM 124 OD1 ASP A 787 12.581 -21.622 -3.740 1.00 0.00 O ATOM 125 OD2 ASP A 787 12.700 -20.265 -5.464 1.00 0.00 O ATOM 0 H ASP A 787 10.935 -20.105 -1.013 1.00 0.00 H new ATOM 0 HA ASP A 787 12.931 -18.679 -2.678 1.00 0.00 H new ATOM 0 HB2 ASP A 787 10.401 -20.195 -3.344 1.00 0.00 H new ATOM 0 HB3 ASP A 787 10.938 -18.892 -4.385 1.00 0.00 H new ATOM 130 N SER A 788 11.293 -16.655 -3.078 1.00 0.00 N ATOM 131 CA SER A 788 10.632 -15.363 -2.929 1.00 0.00 C ATOM 132 C SER A 788 9.201 -15.421 -3.454 1.00 0.00 C ATOM 133 O SER A 788 8.748 -14.518 -4.158 1.00 0.00 O ATOM 134 CB SER A 788 11.416 -14.277 -3.669 1.00 0.00 C ATOM 135 OG SER A 788 12.548 -13.867 -2.922 1.00 0.00 O ATOM 0 H SER A 788 11.869 -16.740 -3.915 1.00 0.00 H new ATOM 0 HA SER A 788 10.601 -15.119 -1.867 1.00 0.00 H new ATOM 0 HB2 SER A 788 11.735 -14.653 -4.641 1.00 0.00 H new ATOM 0 HB3 SER A 788 10.769 -13.420 -3.855 1.00 0.00 H new ATOM 0 HG SER A 788 13.033 -13.174 -3.417 1.00 0.00 H new ATOM 141 N LYS A 789 8.493 -16.491 -3.108 1.00 0.00 N ATOM 142 CA LYS A 789 7.113 -16.669 -3.542 1.00 0.00 C ATOM 143 C LYS A 789 6.148 -15.967 -2.591 1.00 0.00 C ATOM 144 O LYS A 789 5.304 -15.178 -3.016 1.00 0.00 O ATOM 145 CB LYS A 789 6.771 -18.158 -3.626 1.00 0.00 C ATOM 146 CG LYS A 789 7.430 -18.869 -4.795 1.00 0.00 C ATOM 147 CD LYS A 789 6.653 -18.661 -6.084 1.00 0.00 C ATOM 148 CE LYS A 789 7.121 -17.417 -6.823 1.00 0.00 C ATOM 149 NZ LYS A 789 6.937 -17.544 -8.295 1.00 0.00 N ATOM 0 H LYS A 789 8.853 -17.249 -2.528 1.00 0.00 H new ATOM 0 HA LYS A 789 7.009 -16.223 -4.531 1.00 0.00 H new ATOM 0 HB2 LYS A 789 7.074 -18.644 -2.699 1.00 0.00 H new ATOM 0 HB3 LYS A 789 5.690 -18.270 -3.707 1.00 0.00 H new ATOM 0 HG2 LYS A 789 8.448 -18.500 -4.919 1.00 0.00 H new ATOM 0 HG3 LYS A 789 7.501 -19.935 -4.580 1.00 0.00 H new ATOM 0 HD2 LYS A 789 6.772 -19.533 -6.727 1.00 0.00 H new ATOM 0 HD3 LYS A 789 5.590 -18.573 -5.859 1.00 0.00 H new ATOM 0 HE2 LYS A 789 6.568 -16.550 -6.461 1.00 0.00 H new ATOM 0 HE3 LYS A 789 8.173 -17.238 -6.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 789 7.268 -16.676 -8.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 789 7.485 -18.356 -8.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 789 5.929 -17.689 -8.508 1.00 0.00 H new ATOM 163 N THR A 790 6.280 -16.259 -1.300 1.00 0.00 N ATOM 164 CA THR A 790 5.421 -15.657 -0.289 1.00 0.00 C ATOM 165 C THR A 790 5.573 -14.140 -0.271 1.00 0.00 C ATOM 166 O THR A 790 4.626 -13.415 0.036 1.00 0.00 O ATOM 167 CB THR A 790 5.732 -16.210 1.115 1.00 0.00 C ATOM 168 OG1 THR A 790 4.962 -15.511 2.099 1.00 0.00 O ATOM 169 CG2 THR A 790 7.214 -16.074 1.433 1.00 0.00 C ATOM 0 H THR A 790 6.974 -16.909 -0.931 1.00 0.00 H new ATOM 0 HA THR A 790 4.395 -15.914 -0.553 1.00 0.00 H new ATOM 0 HB THR A 790 5.468 -17.267 1.132 1.00 0.00 H new ATOM 0 HG1 THR A 790 5.165 -15.870 2.988 1.00 0.00 H new ATOM 0 HG21 THR A 790 7.410 -16.471 2.429 1.00 0.00 H new ATOM 0 HG22 THR A 790 7.796 -16.631 0.699 1.00 0.00 H new ATOM 0 HG23 THR A 790 7.498 -15.022 1.399 1.00 0.00 H new ATOM 177 N ARG A 791 6.770 -13.666 -0.602 1.00 0.00 N ATOM 178 CA ARG A 791 7.046 -12.235 -0.623 1.00 0.00 C ATOM 179 C ARG A 791 5.909 -11.472 -1.297 1.00 0.00 C ATOM 180 O ARG A 791 5.381 -10.509 -0.744 1.00 0.00 O ATOM 181 CB ARG A 791 8.363 -11.958 -1.351 1.00 0.00 C ATOM 182 CG ARG A 791 9.091 -10.724 -0.844 1.00 0.00 C ATOM 183 CD ARG A 791 10.009 -11.058 0.321 1.00 0.00 C ATOM 184 NE ARG A 791 10.650 -9.866 0.871 1.00 0.00 N ATOM 185 CZ ARG A 791 10.005 -8.943 1.575 1.00 0.00 C ATOM 186 NH1 ARG A 791 8.708 -9.074 1.814 1.00 0.00 N ATOM 187 NH2 ARG A 791 10.658 -7.887 2.042 1.00 0.00 N ATOM 0 H ARG A 791 7.564 -14.252 -0.859 1.00 0.00 H new ATOM 0 HA ARG A 791 7.130 -11.892 0.408 1.00 0.00 H new ATOM 0 HB2 ARG A 791 9.016 -12.824 -1.245 1.00 0.00 H new ATOM 0 HB3 ARG A 791 8.162 -11.839 -2.416 1.00 0.00 H new ATOM 0 HG2 ARG A 791 9.674 -10.286 -1.654 1.00 0.00 H new ATOM 0 HG3 ARG A 791 8.364 -9.974 -0.532 1.00 0.00 H new ATOM 0 HD2 ARG A 791 9.436 -11.555 1.103 1.00 0.00 H new ATOM 0 HD3 ARG A 791 10.774 -11.761 -0.010 1.00 0.00 H new ATOM 0 HE ARG A 791 11.648 -9.735 0.705 1.00 0.00 H new ATOM 0 HH11 ARG A 791 8.203 -9.885 1.457 1.00 0.00 H new ATOM 0 HH12 ARG A 791 8.215 -8.364 2.355 1.00 0.00 H new ATOM 0 HH21 ARG A 791 11.656 -7.783 1.860 1.00 0.00 H new ATOM 0 HH22 ARG A 791 10.162 -7.179 2.583 1.00 0.00 H new ATOM 201 N GLY A 792 5.539 -11.910 -2.497 1.00 0.00 N ATOM 202 CA GLY A 792 4.468 -11.257 -3.227 1.00 0.00 C ATOM 203 C GLY A 792 3.205 -11.117 -2.402 1.00 0.00 C ATOM 204 O GLY A 792 2.678 -10.016 -2.245 1.00 0.00 O ATOM 0 H GLY A 792 5.962 -12.705 -2.976 1.00 0.00 H new ATOM 0 HA2 GLY A 792 4.800 -10.270 -3.547 1.00 0.00 H new ATOM 0 HA3 GLY A 792 4.247 -11.827 -4.129 1.00 0.00 H new ATOM 208 N GLU A 793 2.717 -12.236 -1.875 1.00 0.00 N ATOM 209 CA GLU A 793 1.505 -12.232 -1.063 1.00 0.00 C ATOM 210 C GLU A 793 1.640 -11.266 0.110 1.00 0.00 C ATOM 211 O GLU A 793 0.799 -10.387 0.306 1.00 0.00 O ATOM 212 CB GLU A 793 1.206 -13.641 -0.547 1.00 0.00 C ATOM 213 CG GLU A 793 -0.079 -13.734 0.259 1.00 0.00 C ATOM 214 CD GLU A 793 -1.287 -13.238 -0.512 1.00 0.00 C ATOM 215 OE1 GLU A 793 -1.480 -12.006 -0.583 1.00 0.00 O ATOM 216 OE2 GLU A 793 -2.040 -14.081 -1.042 1.00 0.00 O ATOM 0 H GLU A 793 3.142 -13.156 -1.995 1.00 0.00 H new ATOM 0 HA GLU A 793 0.678 -11.900 -1.691 1.00 0.00 H new ATOM 0 HB2 GLU A 793 1.144 -14.324 -1.395 1.00 0.00 H new ATOM 0 HB3 GLU A 793 2.038 -13.976 0.072 1.00 0.00 H new ATOM 0 HG2 GLU A 793 -0.243 -14.770 0.557 1.00 0.00 H new ATOM 0 HG3 GLU A 793 0.027 -13.152 1.174 1.00 0.00 H new ATOM 223 N LYS A 794 2.702 -11.435 0.890 1.00 0.00 N ATOM 224 CA LYS A 794 2.949 -10.579 2.044 1.00 0.00 C ATOM 225 C LYS A 794 2.913 -9.107 1.648 1.00 0.00 C ATOM 226 O LYS A 794 2.099 -8.337 2.159 1.00 0.00 O ATOM 227 CB LYS A 794 4.303 -10.916 2.674 1.00 0.00 C ATOM 228 CG LYS A 794 4.422 -10.487 4.126 1.00 0.00 C ATOM 229 CD LYS A 794 5.736 -10.943 4.737 1.00 0.00 C ATOM 230 CE LYS A 794 5.708 -12.426 5.075 1.00 0.00 C ATOM 231 NZ LYS A 794 4.903 -12.700 6.297 1.00 0.00 N ATOM 0 H LYS A 794 3.406 -12.158 0.744 1.00 0.00 H new ATOM 0 HA LYS A 794 2.160 -10.759 2.774 1.00 0.00 H new ATOM 0 HB2 LYS A 794 4.468 -11.991 2.607 1.00 0.00 H new ATOM 0 HB3 LYS A 794 5.093 -10.436 2.096 1.00 0.00 H new ATOM 0 HG2 LYS A 794 4.346 -9.402 4.193 1.00 0.00 H new ATOM 0 HG3 LYS A 794 3.591 -10.901 4.698 1.00 0.00 H new ATOM 0 HD2 LYS A 794 6.551 -10.742 4.042 1.00 0.00 H new ATOM 0 HD3 LYS A 794 5.938 -10.367 5.640 1.00 0.00 H new ATOM 0 HE2 LYS A 794 5.293 -12.982 4.234 1.00 0.00 H new ATOM 0 HE3 LYS A 794 6.727 -12.784 5.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 794 5.031 -13.692 6.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 794 5.217 -12.075 7.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 794 3.898 -12.525 6.097 1.00 0.00 H new ATOM 245 N ILE A 795 3.798 -8.723 0.734 1.00 0.00 N ATOM 246 CA ILE A 795 3.864 -7.344 0.267 1.00 0.00 C ATOM 247 C ILE A 795 2.484 -6.831 -0.132 1.00 0.00 C ATOM 248 O ILE A 795 2.126 -5.689 0.157 1.00 0.00 O ATOM 249 CB ILE A 795 4.820 -7.200 -0.932 1.00 0.00 C ATOM 250 CG1 ILE A 795 6.229 -7.655 -0.546 1.00 0.00 C ATOM 251 CG2 ILE A 795 4.838 -5.761 -1.425 1.00 0.00 C ATOM 252 CD1 ILE A 795 7.038 -8.170 -1.715 1.00 0.00 C ATOM 0 H ILE A 795 4.479 -9.348 0.302 1.00 0.00 H new ATOM 0 HA ILE A 795 4.244 -6.748 1.097 1.00 0.00 H new ATOM 0 HB ILE A 795 4.463 -7.836 -1.742 1.00 0.00 H new ATOM 0 HG12 ILE A 795 6.759 -6.820 -0.087 1.00 0.00 H new ATOM 0 HG13 ILE A 795 6.155 -8.439 0.208 1.00 0.00 H new ATOM 0 HG21 ILE A 795 5.518 -5.675 -2.272 1.00 0.00 H new ATOM 0 HG22 ILE A 795 3.834 -5.470 -1.734 1.00 0.00 H new ATOM 0 HG23 ILE A 795 5.175 -5.105 -0.622 1.00 0.00 H new ATOM 0 HD11 ILE A 795 8.025 -8.475 -1.368 1.00 0.00 H new ATOM 0 HD12 ILE A 795 6.530 -9.025 -2.160 1.00 0.00 H new ATOM 0 HD13 ILE A 795 7.143 -7.382 -2.460 1.00 0.00 H new ATOM 264 N LYS A 796 1.713 -7.684 -0.797 1.00 0.00 N ATOM 265 CA LYS A 796 0.370 -7.320 -1.235 1.00 0.00 C ATOM 266 C LYS A 796 -0.527 -7.013 -0.040 1.00 0.00 C ATOM 267 O LYS A 796 -1.204 -5.985 -0.009 1.00 0.00 O ATOM 268 CB LYS A 796 -0.241 -8.450 -2.067 1.00 0.00 C ATOM 269 CG LYS A 796 -1.495 -8.041 -2.820 1.00 0.00 C ATOM 270 CD LYS A 796 -2.174 -9.239 -3.464 1.00 0.00 C ATOM 271 CE LYS A 796 -3.111 -9.938 -2.490 1.00 0.00 C ATOM 272 NZ LYS A 796 -3.720 -11.158 -3.087 1.00 0.00 N ATOM 0 H LYS A 796 1.995 -8.633 -1.045 1.00 0.00 H new ATOM 0 HA LYS A 796 0.446 -6.424 -1.850 1.00 0.00 H new ATOM 0 HB2 LYS A 796 0.501 -8.807 -2.781 1.00 0.00 H new ATOM 0 HB3 LYS A 796 -0.479 -9.286 -1.410 1.00 0.00 H new ATOM 0 HG2 LYS A 796 -2.189 -7.553 -2.135 1.00 0.00 H new ATOM 0 HG3 LYS A 796 -1.238 -7.311 -3.588 1.00 0.00 H new ATOM 0 HD2 LYS A 796 -2.735 -8.913 -4.340 1.00 0.00 H new ATOM 0 HD3 LYS A 796 -1.418 -9.943 -3.813 1.00 0.00 H new ATOM 0 HE2 LYS A 796 -2.561 -10.210 -1.589 1.00 0.00 H new ATOM 0 HE3 LYS A 796 -3.900 -9.249 -2.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 796 -4.352 -11.606 -2.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 796 -4.265 -10.895 -3.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 796 -2.969 -11.826 -3.353 1.00 0.00 H new ATOM 286 N SER A 797 -0.525 -7.909 0.942 1.00 0.00 N ATOM 287 CA SER A 797 -1.340 -7.733 2.138 1.00 0.00 C ATOM 288 C SER A 797 -1.045 -6.393 2.805 1.00 0.00 C ATOM 289 O SER A 797 -1.949 -5.590 3.036 1.00 0.00 O ATOM 290 CB SER A 797 -1.087 -8.874 3.125 1.00 0.00 C ATOM 291 OG SER A 797 -1.807 -10.037 2.756 1.00 0.00 O ATOM 0 H SER A 797 0.032 -8.764 0.933 1.00 0.00 H new ATOM 0 HA SER A 797 -2.388 -7.746 1.839 1.00 0.00 H new ATOM 0 HB2 SER A 797 -0.021 -9.099 3.160 1.00 0.00 H new ATOM 0 HB3 SER A 797 -1.381 -8.563 4.128 1.00 0.00 H new ATOM 0 HG SER A 797 -1.627 -10.752 3.402 1.00 0.00 H new ATOM 297 N ASP A 798 0.226 -6.160 3.112 1.00 0.00 N ATOM 298 CA ASP A 798 0.642 -4.917 3.752 1.00 0.00 C ATOM 299 C ASP A 798 0.150 -3.708 2.962 1.00 0.00 C ATOM 300 O ASP A 798 -0.334 -2.733 3.537 1.00 0.00 O ATOM 301 CB ASP A 798 2.165 -4.871 3.882 1.00 0.00 C ATOM 302 CG ASP A 798 2.755 -6.216 4.258 1.00 0.00 C ATOM 303 OD1 ASP A 798 2.126 -6.935 5.062 1.00 0.00 O ATOM 304 OD2 ASP A 798 3.846 -6.549 3.749 1.00 0.00 O ATOM 0 H ASP A 798 0.986 -6.815 2.928 1.00 0.00 H new ATOM 0 HA ASP A 798 0.199 -4.883 4.747 1.00 0.00 H new ATOM 0 HB2 ASP A 798 2.597 -4.539 2.938 1.00 0.00 H new ATOM 0 HB3 ASP A 798 2.440 -4.133 4.636 1.00 0.00 H new ATOM 309 N PHE A 799 0.278 -3.778 1.641 1.00 0.00 N ATOM 310 CA PHE A 799 -0.152 -2.689 0.772 1.00 0.00 C ATOM 311 C PHE A 799 -1.598 -2.299 1.063 1.00 0.00 C ATOM 312 O PHE A 799 -1.884 -1.160 1.432 1.00 0.00 O ATOM 313 CB PHE A 799 -0.006 -3.091 -0.696 1.00 0.00 C ATOM 314 CG PHE A 799 -0.002 -1.923 -1.641 1.00 0.00 C ATOM 315 CD1 PHE A 799 0.991 -0.959 -1.567 1.00 0.00 C ATOM 316 CD2 PHE A 799 -0.991 -1.789 -2.602 1.00 0.00 C ATOM 317 CE1 PHE A 799 0.996 0.117 -2.435 1.00 0.00 C ATOM 318 CE2 PHE A 799 -0.991 -0.716 -3.472 1.00 0.00 C ATOM 319 CZ PHE A 799 0.005 0.238 -3.389 1.00 0.00 C ATOM 0 H PHE A 799 0.676 -4.578 1.149 1.00 0.00 H new ATOM 0 HA PHE A 799 0.485 -1.827 0.970 1.00 0.00 H new ATOM 0 HB2 PHE A 799 0.921 -3.652 -0.820 1.00 0.00 H new ATOM 0 HB3 PHE A 799 -0.823 -3.762 -0.964 1.00 0.00 H new ATOM 0 HD1 PHE A 799 1.769 -1.049 -0.823 1.00 0.00 H new ATOM 0 HD2 PHE A 799 -1.771 -2.532 -2.672 1.00 0.00 H new ATOM 0 HE1 PHE A 799 1.774 0.862 -2.367 1.00 0.00 H new ATOM 0 HE2 PHE A 799 -1.768 -0.623 -4.216 1.00 0.00 H new ATOM 0 HZ PHE A 799 0.008 1.077 -4.069 1.00 0.00 H new ATOM 329 N PHE A 800 -2.507 -3.254 0.894 1.00 0.00 N ATOM 330 CA PHE A 800 -3.925 -3.012 1.136 1.00 0.00 C ATOM 331 C PHE A 800 -4.142 -2.382 2.509 1.00 0.00 C ATOM 332 O PHE A 800 -4.765 -1.328 2.628 1.00 0.00 O ATOM 333 CB PHE A 800 -4.712 -4.320 1.032 1.00 0.00 C ATOM 334 CG PHE A 800 -5.011 -4.729 -0.382 1.00 0.00 C ATOM 335 CD1 PHE A 800 -5.531 -3.816 -1.286 1.00 0.00 C ATOM 336 CD2 PHE A 800 -4.772 -6.026 -0.807 1.00 0.00 C ATOM 337 CE1 PHE A 800 -5.806 -4.190 -2.588 1.00 0.00 C ATOM 338 CE2 PHE A 800 -5.045 -6.404 -2.108 1.00 0.00 C ATOM 339 CZ PHE A 800 -5.564 -5.486 -2.999 1.00 0.00 C ATOM 0 H PHE A 800 -2.287 -4.203 0.590 1.00 0.00 H new ATOM 0 HA PHE A 800 -4.285 -2.318 0.376 1.00 0.00 H new ATOM 0 HB2 PHE A 800 -4.147 -5.114 1.520 1.00 0.00 H new ATOM 0 HB3 PHE A 800 -5.650 -4.215 1.577 1.00 0.00 H new ATOM 0 HD1 PHE A 800 -5.723 -2.801 -0.970 1.00 0.00 H new ATOM 0 HD2 PHE A 800 -4.368 -6.749 -0.114 1.00 0.00 H new ATOM 0 HE1 PHE A 800 -6.210 -3.469 -3.283 1.00 0.00 H new ATOM 0 HE2 PHE A 800 -4.852 -7.417 -2.428 1.00 0.00 H new ATOM 0 HZ PHE A 800 -5.780 -5.781 -4.015 1.00 0.00 H new ATOM 349 N GLU A 801 -3.623 -3.037 3.543 1.00 0.00 N ATOM 350 CA GLU A 801 -3.761 -2.542 4.907 1.00 0.00 C ATOM 351 C GLU A 801 -3.516 -1.037 4.968 1.00 0.00 C ATOM 352 O GLU A 801 -4.351 -0.280 5.464 1.00 0.00 O ATOM 353 CB GLU A 801 -2.787 -3.267 5.838 1.00 0.00 C ATOM 354 CG GLU A 801 -3.053 -4.758 5.957 1.00 0.00 C ATOM 355 CD GLU A 801 -2.110 -5.444 6.926 1.00 0.00 C ATOM 356 OE1 GLU A 801 -1.792 -4.839 7.972 1.00 0.00 O ATOM 357 OE2 GLU A 801 -1.690 -6.584 6.640 1.00 0.00 O ATOM 0 H GLU A 801 -3.104 -3.911 3.462 1.00 0.00 H new ATOM 0 HA GLU A 801 -4.781 -2.740 5.236 1.00 0.00 H new ATOM 0 HB2 GLU A 801 -1.770 -3.116 5.475 1.00 0.00 H new ATOM 0 HB3 GLU A 801 -2.842 -2.817 6.829 1.00 0.00 H new ATOM 0 HG2 GLU A 801 -4.081 -4.915 6.284 1.00 0.00 H new ATOM 0 HG3 GLU A 801 -2.957 -5.220 4.974 1.00 0.00 H new ATOM 364 N LEU A 802 -2.365 -0.611 4.460 1.00 0.00 N ATOM 365 CA LEU A 802 -2.008 0.803 4.456 1.00 0.00 C ATOM 366 C LEU A 802 -3.089 1.636 3.775 1.00 0.00 C ATOM 367 O LEU A 802 -3.715 2.493 4.402 1.00 0.00 O ATOM 368 CB LEU A 802 -0.668 1.009 3.746 1.00 0.00 C ATOM 369 CG LEU A 802 -0.146 2.446 3.701 1.00 0.00 C ATOM 370 CD1 LEU A 802 0.386 2.864 5.062 1.00 0.00 C ATOM 371 CD2 LEU A 802 0.933 2.588 2.637 1.00 0.00 C ATOM 0 H LEU A 802 -1.663 -1.224 4.046 1.00 0.00 H new ATOM 0 HA LEU A 802 -1.919 1.132 5.491 1.00 0.00 H new ATOM 0 HB2 LEU A 802 0.080 0.387 4.237 1.00 0.00 H new ATOM 0 HB3 LEU A 802 -0.762 0.646 2.723 1.00 0.00 H new ATOM 0 HG LEU A 802 -0.974 3.105 3.440 1.00 0.00 H new ATOM 0 HD11 LEU A 802 0.753 3.889 5.010 1.00 0.00 H new ATOM 0 HD12 LEU A 802 -0.414 2.802 5.800 1.00 0.00 H new ATOM 0 HD13 LEU A 802 1.201 2.201 5.353 1.00 0.00 H new ATOM 0 HD21 LEU A 802 1.293 3.617 2.619 1.00 0.00 H new ATOM 0 HD22 LEU A 802 1.761 1.918 2.867 1.00 0.00 H new ATOM 0 HD23 LEU A 802 0.519 2.331 1.662 1.00 0.00 H new ATOM 383 N LEU A 803 -3.306 1.379 2.490 1.00 0.00 N ATOM 384 CA LEU A 803 -4.315 2.103 1.725 1.00 0.00 C ATOM 385 C LEU A 803 -5.584 2.303 2.547 1.00 0.00 C ATOM 386 O LEU A 803 -5.973 3.433 2.841 1.00 0.00 O ATOM 387 CB LEU A 803 -4.643 1.349 0.435 1.00 0.00 C ATOM 388 CG LEU A 803 -3.451 0.972 -0.444 1.00 0.00 C ATOM 389 CD1 LEU A 803 -3.900 0.107 -1.612 1.00 0.00 C ATOM 390 CD2 LEU A 803 -2.742 2.222 -0.946 1.00 0.00 C ATOM 0 H LEU A 803 -2.797 0.675 1.956 1.00 0.00 H new ATOM 0 HA LEU A 803 -3.910 3.083 1.474 1.00 0.00 H new ATOM 0 HB2 LEU A 803 -5.178 0.436 0.697 1.00 0.00 H new ATOM 0 HB3 LEU A 803 -5.325 1.960 -0.156 1.00 0.00 H new ATOM 0 HG LEU A 803 -2.748 0.396 0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 803 -3.037 -0.151 -2.226 1.00 0.00 H new ATOM 0 HD12 LEU A 803 -4.362 -0.805 -1.233 1.00 0.00 H new ATOM 0 HD13 LEU A 803 -4.623 0.656 -2.215 1.00 0.00 H new ATOM 0 HD21 LEU A 803 -1.896 1.935 -1.570 1.00 0.00 H new ATOM 0 HD22 LEU A 803 -3.437 2.824 -1.531 1.00 0.00 H new ATOM 0 HD23 LEU A 803 -2.385 2.804 -0.096 1.00 0.00 H new ATOM 402 N SER A 804 -6.223 1.198 2.918 1.00 0.00 N ATOM 403 CA SER A 804 -7.448 1.252 3.706 1.00 0.00 C ATOM 404 C SER A 804 -7.278 2.169 4.913 1.00 0.00 C ATOM 405 O SER A 804 -8.186 2.920 5.269 1.00 0.00 O ATOM 406 CB SER A 804 -7.844 -0.151 4.169 1.00 0.00 C ATOM 407 OG SER A 804 -8.907 -0.099 5.106 1.00 0.00 O ATOM 0 H SER A 804 -5.912 0.255 2.685 1.00 0.00 H new ATOM 0 HA SER A 804 -8.239 1.655 3.074 1.00 0.00 H new ATOM 0 HB2 SER A 804 -8.142 -0.750 3.309 1.00 0.00 H new ATOM 0 HB3 SER A 804 -6.983 -0.645 4.619 1.00 0.00 H new ATOM 0 HG SER A 804 -9.686 -0.569 4.743 1.00 0.00 H new ATOM 413 N ASN A 805 -6.108 2.102 5.540 1.00 0.00 N ATOM 414 CA ASN A 805 -5.818 2.925 6.708 1.00 0.00 C ATOM 415 C ASN A 805 -5.840 4.408 6.348 1.00 0.00 C ATOM 416 O ASN A 805 -6.088 5.261 7.200 1.00 0.00 O ATOM 417 CB ASN A 805 -4.455 2.552 7.295 1.00 0.00 C ATOM 418 CG ASN A 805 -4.352 1.075 7.625 1.00 0.00 C ATOM 419 OD1 ASN A 805 -5.356 0.363 7.652 1.00 0.00 O ATOM 420 ND2 ASN A 805 -3.135 0.609 7.876 1.00 0.00 N ATOM 0 H ASN A 805 -5.345 1.486 5.258 1.00 0.00 H new ATOM 0 HA ASN A 805 -6.591 2.739 7.454 1.00 0.00 H new ATOM 0 HB2 ASN A 805 -3.672 2.818 6.585 1.00 0.00 H new ATOM 0 HB3 ASN A 805 -4.279 3.136 8.198 1.00 0.00 H new ATOM 0 HD21 ASN A 805 -3.003 -0.377 8.103 1.00 0.00 H new ATOM 0 HD22 ASN A 805 -2.332 1.237 7.842 1.00 0.00 H new ATOM 427 N HIS A 806 -5.580 4.706 5.079 1.00 0.00 N ATOM 428 CA HIS A 806 -5.571 6.086 4.605 1.00 0.00 C ATOM 429 C HIS A 806 -6.989 6.574 4.327 1.00 0.00 C ATOM 430 O HIS A 806 -7.231 7.293 3.357 1.00 0.00 O ATOM 431 CB HIS A 806 -4.720 6.207 3.340 1.00 0.00 C ATOM 432 CG HIS A 806 -3.250 6.285 3.612 1.00 0.00 C ATOM 433 ND1 HIS A 806 -2.434 7.256 3.071 1.00 0.00 N ATOM 434 CD2 HIS A 806 -2.448 5.506 4.376 1.00 0.00 C ATOM 435 CE1 HIS A 806 -1.195 7.070 3.488 1.00 0.00 C ATOM 436 NE2 HIS A 806 -1.176 6.014 4.282 1.00 0.00 N ATOM 0 H HIS A 806 -5.373 4.012 4.361 1.00 0.00 H new ATOM 0 HA HIS A 806 -5.138 6.710 5.387 1.00 0.00 H new ATOM 0 HB2 HIS A 806 -4.917 5.350 2.696 1.00 0.00 H new ATOM 0 HB3 HIS A 806 -5.027 7.096 2.789 1.00 0.00 H new ATOM 0 HD2 HIS A 806 -2.752 4.645 4.952 1.00 0.00 H new ATOM 0 HE1 HIS A 806 -0.342 7.678 3.225 1.00 0.00 H new ATOM 0 HE2 HIS A 806 -0.351 5.638 4.749 1.00 0.00 H new ATOM 444 N HIS A 807 -7.925 6.177 5.184 1.00 0.00 N ATOM 445 CA HIS A 807 -9.320 6.574 5.030 1.00 0.00 C ATOM 446 C HIS A 807 -9.681 6.733 3.556 1.00 0.00 C ATOM 447 O HIS A 807 -10.162 7.786 3.134 1.00 0.00 O ATOM 448 CB HIS A 807 -9.585 7.883 5.776 1.00 0.00 C ATOM 449 CG HIS A 807 -11.025 8.086 6.135 1.00 0.00 C ATOM 450 ND1 HIS A 807 -11.430 8.797 7.246 1.00 0.00 N ATOM 451 CD2 HIS A 807 -12.158 7.669 5.523 1.00 0.00 C ATOM 452 CE1 HIS A 807 -12.750 8.806 7.302 1.00 0.00 C ATOM 453 NE2 HIS A 807 -13.216 8.129 6.267 1.00 0.00 N ATOM 0 H HIS A 807 -7.743 5.581 5.992 1.00 0.00 H new ATOM 0 HA HIS A 807 -9.944 5.789 5.456 1.00 0.00 H new ATOM 0 HB2 HIS A 807 -8.986 7.901 6.686 1.00 0.00 H new ATOM 0 HB3 HIS A 807 -9.252 8.717 5.159 1.00 0.00 H new ATOM 0 HD2 HIS A 807 -12.218 7.083 4.618 1.00 0.00 H new ATOM 0 HE1 HIS A 807 -13.347 9.285 8.064 1.00 0.00 H new ATOM 0 HE2 HIS A 807 -14.202 7.974 6.055 1.00 0.00 H new ATOM 461 N LEU A 808 -9.444 5.683 2.778 1.00 0.00 N ATOM 462 CA LEU A 808 -9.744 5.706 1.350 1.00 0.00 C ATOM 463 C LEU A 808 -11.144 6.254 1.096 1.00 0.00 C ATOM 464 O LEU A 808 -11.956 6.361 2.016 1.00 0.00 O ATOM 465 CB LEU A 808 -9.619 4.300 0.761 1.00 0.00 C ATOM 466 CG LEU A 808 -8.215 3.694 0.762 1.00 0.00 C ATOM 467 CD1 LEU A 808 -8.228 2.319 0.113 1.00 0.00 C ATOM 468 CD2 LEU A 808 -7.236 4.614 0.049 1.00 0.00 C ATOM 0 H LEU A 808 -9.045 4.805 3.111 1.00 0.00 H new ATOM 0 HA LEU A 808 -9.024 6.363 0.863 1.00 0.00 H new ATOM 0 HB2 LEU A 808 -10.280 3.635 1.316 1.00 0.00 H new ATOM 0 HB3 LEU A 808 -9.982 4.325 -0.267 1.00 0.00 H new ATOM 0 HG LEU A 808 -7.889 3.582 1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 808 -7.221 1.903 0.122 1.00 0.00 H new ATOM 0 HD12 LEU A 808 -8.898 1.661 0.667 1.00 0.00 H new ATOM 0 HD13 LEU A 808 -8.575 2.406 -0.917 1.00 0.00 H new ATOM 0 HD21 LEU A 808 -6.242 4.166 0.060 1.00 0.00 H new ATOM 0 HD22 LEU A 808 -7.558 4.759 -0.982 1.00 0.00 H new ATOM 0 HD23 LEU A 808 -7.205 5.577 0.558 1.00 0.00 H new ATOM 480 N ASP A 809 -11.421 6.598 -0.157 1.00 0.00 N ATOM 481 CA ASP A 809 -12.724 7.132 -0.533 1.00 0.00 C ATOM 482 C ASP A 809 -12.985 6.930 -2.022 1.00 0.00 C ATOM 483 O ASP A 809 -12.071 6.623 -2.787 1.00 0.00 O ATOM 484 CB ASP A 809 -12.810 8.619 -0.185 1.00 0.00 C ATOM 485 CG ASP A 809 -13.804 9.362 -1.056 1.00 0.00 C ATOM 486 OD1 ASP A 809 -15.018 9.100 -0.925 1.00 0.00 O ATOM 487 OD2 ASP A 809 -13.369 10.203 -1.870 1.00 0.00 O ATOM 0 H ASP A 809 -10.760 6.516 -0.930 1.00 0.00 H new ATOM 0 HA ASP A 809 -13.486 6.591 0.028 1.00 0.00 H new ATOM 0 HB2 ASP A 809 -13.096 8.728 0.861 1.00 0.00 H new ATOM 0 HB3 ASP A 809 -11.825 9.072 -0.295 1.00 0.00 H new ATOM 492 N SER A 810 -14.240 7.103 -2.427 1.00 0.00 N ATOM 493 CA SER A 810 -14.622 6.934 -3.824 1.00 0.00 C ATOM 494 C SER A 810 -13.853 7.901 -4.718 1.00 0.00 C ATOM 495 O SER A 810 -13.386 7.529 -5.795 1.00 0.00 O ATOM 496 CB SER A 810 -16.127 7.153 -3.993 1.00 0.00 C ATOM 497 OG SER A 810 -16.499 8.463 -3.599 1.00 0.00 O ATOM 0 H SER A 810 -15.009 7.360 -1.808 1.00 0.00 H new ATOM 0 HA SER A 810 -14.374 5.915 -4.122 1.00 0.00 H new ATOM 0 HB2 SER A 810 -16.407 6.990 -5.034 1.00 0.00 H new ATOM 0 HB3 SER A 810 -16.673 6.422 -3.397 1.00 0.00 H new ATOM 0 HG SER A 810 -16.168 8.639 -2.694 1.00 0.00 H new ATOM 503 N GLN A 811 -13.725 9.144 -4.264 1.00 0.00 N ATOM 504 CA GLN A 811 -13.013 10.165 -5.023 1.00 0.00 C ATOM 505 C GLN A 811 -11.533 10.183 -4.656 1.00 0.00 C ATOM 506 O GLN A 811 -10.881 11.225 -4.716 1.00 0.00 O ATOM 507 CB GLN A 811 -13.630 11.541 -4.771 1.00 0.00 C ATOM 508 CG GLN A 811 -15.015 11.708 -5.375 1.00 0.00 C ATOM 509 CD GLN A 811 -15.620 13.067 -5.085 1.00 0.00 C ATOM 510 OE1 GLN A 811 -14.996 13.912 -4.442 1.00 0.00 O ATOM 511 NE2 GLN A 811 -16.841 13.286 -5.558 1.00 0.00 N ATOM 0 H GLN A 811 -14.105 9.468 -3.375 1.00 0.00 H new ATOM 0 HA GLN A 811 -13.103 9.923 -6.082 1.00 0.00 H new ATOM 0 HB2 GLN A 811 -13.689 11.712 -3.696 1.00 0.00 H new ATOM 0 HB3 GLN A 811 -12.970 12.306 -5.180 1.00 0.00 H new ATOM 0 HG2 GLN A 811 -14.956 11.564 -6.454 1.00 0.00 H new ATOM 0 HG3 GLN A 811 -15.673 10.931 -4.985 1.00 0.00 H new ATOM 0 HE21 GLN A 811 -17.322 12.558 -6.086 1.00 0.00 H new ATOM 0 HE22 GLN A 811 -17.298 14.183 -5.394 1.00 0.00 H new ATOM 520 N SER A 812 -11.009 9.022 -4.276 1.00 0.00 N ATOM 521 CA SER A 812 -9.606 8.906 -3.894 1.00 0.00 C ATOM 522 C SER A 812 -8.700 9.012 -5.118 1.00 0.00 C ATOM 523 O SER A 812 -8.858 8.270 -6.087 1.00 0.00 O ATOM 524 CB SER A 812 -9.359 7.578 -3.176 1.00 0.00 C ATOM 525 OG SER A 812 -8.015 7.476 -2.739 1.00 0.00 O ATOM 0 H SER A 812 -11.534 8.149 -4.224 1.00 0.00 H new ATOM 0 HA SER A 812 -9.370 9.726 -3.216 1.00 0.00 H new ATOM 0 HB2 SER A 812 -10.030 7.493 -2.321 1.00 0.00 H new ATOM 0 HB3 SER A 812 -9.590 6.750 -3.846 1.00 0.00 H new ATOM 0 HG SER A 812 -7.884 6.619 -2.282 1.00 0.00 H new ATOM 531 N ARG A 813 -7.750 9.940 -5.064 1.00 0.00 N ATOM 532 CA ARG A 813 -6.819 10.144 -6.167 1.00 0.00 C ATOM 533 C ARG A 813 -5.496 9.431 -5.902 1.00 0.00 C ATOM 534 O ARG A 813 -4.929 9.539 -4.815 1.00 0.00 O ATOM 535 CB ARG A 813 -6.571 11.639 -6.382 1.00 0.00 C ATOM 536 CG ARG A 813 -7.700 12.344 -7.115 1.00 0.00 C ATOM 537 CD ARG A 813 -7.666 12.048 -8.606 1.00 0.00 C ATOM 538 NE ARG A 813 -6.454 12.561 -9.239 1.00 0.00 N ATOM 539 CZ ARG A 813 -5.334 11.857 -9.359 1.00 0.00 C ATOM 540 NH1 ARG A 813 -5.272 10.618 -8.891 1.00 0.00 N ATOM 541 NH2 ARG A 813 -4.272 12.393 -9.948 1.00 0.00 N ATOM 0 H ARG A 813 -7.605 10.562 -4.269 1.00 0.00 H new ATOM 0 HA ARG A 813 -7.264 9.722 -7.068 1.00 0.00 H new ATOM 0 HB2 ARG A 813 -6.423 12.117 -5.414 1.00 0.00 H new ATOM 0 HB3 ARG A 813 -5.647 11.768 -6.945 1.00 0.00 H new ATOM 0 HG2 ARG A 813 -8.658 12.027 -6.702 1.00 0.00 H new ATOM 0 HG3 ARG A 813 -7.624 13.419 -6.955 1.00 0.00 H new ATOM 0 HD2 ARG A 813 -7.729 10.971 -8.763 1.00 0.00 H new ATOM 0 HD3 ARG A 813 -8.540 12.491 -9.084 1.00 0.00 H new ATOM 0 HE ARG A 813 -6.468 13.511 -9.609 1.00 0.00 H new ATOM 0 HH11 ARG A 813 -6.086 10.203 -8.437 1.00 0.00 H new ATOM 0 HH12 ARG A 813 -4.411 10.080 -8.985 1.00 0.00 H new ATOM 0 HH21 ARG A 813 -4.316 13.346 -10.309 1.00 0.00 H new ATOM 0 HH22 ARG A 813 -3.412 11.852 -10.040 1.00 0.00 H new ATOM 555 N TRP A 814 -5.013 8.702 -6.901 1.00 0.00 N ATOM 556 CA TRP A 814 -3.757 7.970 -6.775 1.00 0.00 C ATOM 557 C TRP A 814 -2.616 8.909 -6.400 1.00 0.00 C ATOM 558 O TRP A 814 -1.996 8.757 -5.348 1.00 0.00 O ATOM 559 CB TRP A 814 -3.431 7.247 -8.083 1.00 0.00 C ATOM 560 CG TRP A 814 -2.084 6.591 -8.079 1.00 0.00 C ATOM 561 CD1 TRP A 814 -1.096 6.742 -9.010 1.00 0.00 C ATOM 562 CD2 TRP A 814 -1.578 5.679 -7.098 1.00 0.00 C ATOM 563 NE1 TRP A 814 -0.007 5.978 -8.667 1.00 0.00 N ATOM 564 CE2 TRP A 814 -0.277 5.317 -7.498 1.00 0.00 C ATOM 565 CE3 TRP A 814 -2.097 5.134 -5.921 1.00 0.00 C ATOM 566 CZ2 TRP A 814 0.510 4.436 -6.761 1.00 0.00 C ATOM 567 CZ3 TRP A 814 -1.315 4.259 -5.191 1.00 0.00 C ATOM 568 CH2 TRP A 814 -0.023 3.917 -5.612 1.00 0.00 C ATOM 0 H TRP A 814 -5.471 8.602 -7.807 1.00 0.00 H new ATOM 0 HA TRP A 814 -3.872 7.233 -5.980 1.00 0.00 H new ATOM 0 HB2 TRP A 814 -4.194 6.492 -8.273 1.00 0.00 H new ATOM 0 HB3 TRP A 814 -3.477 7.961 -8.906 1.00 0.00 H new ATOM 0 HD1 TRP A 814 -1.161 7.370 -9.887 1.00 0.00 H new ATOM 0 HE1 TRP A 814 0.862 5.913 -9.197 1.00 0.00 H new ATOM 0 HE3 TRP A 814 -3.091 5.392 -5.588 1.00 0.00 H new ATOM 0 HZ2 TRP A 814 1.506 4.171 -7.085 1.00 0.00 H new ATOM 0 HZ3 TRP A 814 -1.707 3.831 -4.280 1.00 0.00 H new ATOM 0 HH2 TRP A 814 0.563 3.231 -5.019 1.00 0.00 H new ATOM 579 N SER A 815 -2.343 9.878 -7.268 1.00 0.00 N ATOM 580 CA SER A 815 -1.272 10.839 -7.029 1.00 0.00 C ATOM 581 C SER A 815 -1.238 11.260 -5.563 1.00 0.00 C ATOM 582 O SER A 815 -0.168 11.413 -4.973 1.00 0.00 O ATOM 583 CB SER A 815 -1.454 12.069 -7.920 1.00 0.00 C ATOM 584 OG SER A 815 -0.827 11.884 -9.178 1.00 0.00 O ATOM 0 H SER A 815 -2.848 10.019 -8.143 1.00 0.00 H new ATOM 0 HA SER A 815 -0.325 10.359 -7.274 1.00 0.00 H new ATOM 0 HB2 SER A 815 -2.517 12.263 -8.065 1.00 0.00 H new ATOM 0 HB3 SER A 815 -1.034 12.945 -7.426 1.00 0.00 H new ATOM 0 HG SER A 815 -0.959 12.683 -9.730 1.00 0.00 H new ATOM 590 N LYS A 816 -2.417 11.447 -4.980 1.00 0.00 N ATOM 591 CA LYS A 816 -2.526 11.849 -3.582 1.00 0.00 C ATOM 592 C LYS A 816 -2.184 10.689 -2.654 1.00 0.00 C ATOM 593 O LYS A 816 -1.205 10.744 -1.909 1.00 0.00 O ATOM 594 CB LYS A 816 -3.939 12.356 -3.284 1.00 0.00 C ATOM 595 CG LYS A 816 -4.363 13.524 -4.157 1.00 0.00 C ATOM 596 CD LYS A 816 -3.898 14.850 -3.579 1.00 0.00 C ATOM 597 CE LYS A 816 -2.562 15.277 -4.168 1.00 0.00 C ATOM 598 NZ LYS A 816 -1.821 16.193 -3.256 1.00 0.00 N ATOM 0 H LYS A 816 -3.312 11.327 -5.454 1.00 0.00 H new ATOM 0 HA LYS A 816 -1.813 12.654 -3.405 1.00 0.00 H new ATOM 0 HB2 LYS A 816 -4.646 11.537 -3.419 1.00 0.00 H new ATOM 0 HB3 LYS A 816 -3.995 12.656 -2.238 1.00 0.00 H new ATOM 0 HG2 LYS A 816 -3.952 13.399 -5.159 1.00 0.00 H new ATOM 0 HG3 LYS A 816 -5.448 13.530 -4.256 1.00 0.00 H new ATOM 0 HD2 LYS A 816 -4.646 15.617 -3.778 1.00 0.00 H new ATOM 0 HD3 LYS A 816 -3.809 14.765 -2.496 1.00 0.00 H new ATOM 0 HE2 LYS A 816 -1.955 14.394 -4.368 1.00 0.00 H new ATOM 0 HE3 LYS A 816 -2.729 15.773 -5.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 816 -0.916 16.461 -3.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 816 -2.389 17.047 -3.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 816 -1.639 15.711 -2.352 1.00 0.00 H new ATOM 612 N VAL A 817 -2.996 9.637 -2.704 1.00 0.00 N ATOM 613 CA VAL A 817 -2.777 8.462 -1.869 1.00 0.00 C ATOM 614 C VAL A 817 -1.323 8.008 -1.930 1.00 0.00 C ATOM 615 O VAL A 817 -0.805 7.419 -0.980 1.00 0.00 O ATOM 616 CB VAL A 817 -3.687 7.294 -2.295 1.00 0.00 C ATOM 617 CG1 VAL A 817 -2.994 6.430 -3.337 1.00 0.00 C ATOM 618 CG2 VAL A 817 -4.090 6.466 -1.085 1.00 0.00 C ATOM 0 H VAL A 817 -3.811 9.575 -3.314 1.00 0.00 H new ATOM 0 HA VAL A 817 -3.022 8.749 -0.847 1.00 0.00 H new ATOM 0 HB VAL A 817 -4.592 7.705 -2.743 1.00 0.00 H new ATOM 0 HG11 VAL A 817 -3.652 5.610 -3.626 1.00 0.00 H new ATOM 0 HG12 VAL A 817 -2.761 7.034 -4.214 1.00 0.00 H new ATOM 0 HG13 VAL A 817 -2.072 6.025 -2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 817 -4.733 5.645 -1.403 1.00 0.00 H new ATOM 0 HG22 VAL A 817 -3.197 6.063 -0.606 1.00 0.00 H new ATOM 0 HG23 VAL A 817 -4.629 7.095 -0.377 1.00 0.00 H new ATOM 628 N LYS A 818 -0.669 8.284 -3.052 1.00 0.00 N ATOM 629 CA LYS A 818 0.727 7.906 -3.238 1.00 0.00 C ATOM 630 C LYS A 818 1.653 8.852 -2.479 1.00 0.00 C ATOM 631 O LYS A 818 2.576 8.414 -1.793 1.00 0.00 O ATOM 632 CB LYS A 818 1.084 7.911 -4.726 1.00 0.00 C ATOM 633 CG LYS A 818 2.491 7.415 -5.015 1.00 0.00 C ATOM 634 CD LYS A 818 2.733 7.264 -6.508 1.00 0.00 C ATOM 635 CE LYS A 818 3.246 8.556 -7.124 1.00 0.00 C ATOM 636 NZ LYS A 818 4.014 8.308 -8.375 1.00 0.00 N ATOM 0 H LYS A 818 -1.084 8.769 -3.848 1.00 0.00 H new ATOM 0 HA LYS A 818 0.861 6.899 -2.842 1.00 0.00 H new ATOM 0 HB2 LYS A 818 0.370 7.288 -5.265 1.00 0.00 H new ATOM 0 HB3 LYS A 818 0.978 8.924 -5.113 1.00 0.00 H new ATOM 0 HG2 LYS A 818 3.217 8.112 -4.596 1.00 0.00 H new ATOM 0 HG3 LYS A 818 2.649 6.456 -4.521 1.00 0.00 H new ATOM 0 HD2 LYS A 818 3.455 6.466 -6.682 1.00 0.00 H new ATOM 0 HD3 LYS A 818 1.806 6.968 -7.000 1.00 0.00 H new ATOM 0 HE2 LYS A 818 2.405 9.215 -7.339 1.00 0.00 H new ATOM 0 HE3 LYS A 818 3.881 9.074 -6.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 818 4.346 9.214 -8.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 818 4.832 7.700 -8.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 818 3.401 7.837 -9.071 1.00 0.00 H new ATOM 650 N ASP A 819 1.398 10.150 -2.607 1.00 0.00 N ATOM 651 CA ASP A 819 2.207 11.157 -1.931 1.00 0.00 C ATOM 652 C ASP A 819 1.963 11.130 -0.426 1.00 0.00 C ATOM 653 O ASP A 819 2.749 11.671 0.352 1.00 0.00 O ATOM 654 CB ASP A 819 1.896 12.548 -2.486 1.00 0.00 C ATOM 655 CG ASP A 819 2.654 13.643 -1.762 1.00 0.00 C ATOM 656 OD1 ASP A 819 2.127 14.165 -0.757 1.00 0.00 O ATOM 657 OD2 ASP A 819 3.775 13.979 -2.200 1.00 0.00 O ATOM 0 H ASP A 819 0.638 10.529 -3.172 1.00 0.00 H new ATOM 0 HA ASP A 819 3.257 10.927 -2.114 1.00 0.00 H new ATOM 0 HB2 ASP A 819 2.146 12.577 -3.546 1.00 0.00 H new ATOM 0 HB3 ASP A 819 0.826 12.737 -2.406 1.00 0.00 H new ATOM 662 N LYS A 820 0.868 10.496 -0.020 1.00 0.00 N ATOM 663 CA LYS A 820 0.519 10.397 1.392 1.00 0.00 C ATOM 664 C LYS A 820 1.070 9.111 1.999 1.00 0.00 C ATOM 665 O LYS A 820 1.412 9.068 3.181 1.00 0.00 O ATOM 666 CB LYS A 820 -1.001 10.447 1.567 1.00 0.00 C ATOM 667 CG LYS A 820 -1.449 10.360 3.016 1.00 0.00 C ATOM 668 CD LYS A 820 -1.457 11.727 3.680 1.00 0.00 C ATOM 669 CE LYS A 820 -1.475 11.611 5.196 1.00 0.00 C ATOM 670 NZ LYS A 820 -0.197 11.060 5.725 1.00 0.00 N ATOM 0 H LYS A 820 0.206 10.043 -0.650 1.00 0.00 H new ATOM 0 HA LYS A 820 0.966 11.244 1.912 1.00 0.00 H new ATOM 0 HB2 LYS A 820 -1.378 11.373 1.134 1.00 0.00 H new ATOM 0 HB3 LYS A 820 -1.450 9.627 1.007 1.00 0.00 H new ATOM 0 HG2 LYS A 820 -2.448 9.925 3.064 1.00 0.00 H new ATOM 0 HG3 LYS A 820 -0.784 9.692 3.564 1.00 0.00 H new ATOM 0 HD2 LYS A 820 -0.577 12.289 3.368 1.00 0.00 H new ATOM 0 HD3 LYS A 820 -2.329 12.289 3.347 1.00 0.00 H new ATOM 0 HE2 LYS A 820 -1.656 12.593 5.633 1.00 0.00 H new ATOM 0 HE3 LYS A 820 -2.301 10.969 5.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 820 -0.112 11.289 6.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 820 -0.187 10.027 5.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 820 0.602 11.479 5.207 1.00 0.00 H new ATOM 684 N VAL A 821 1.153 8.065 1.184 1.00 0.00 N ATOM 685 CA VAL A 821 1.665 6.779 1.641 1.00 0.00 C ATOM 686 C VAL A 821 3.176 6.690 1.453 1.00 0.00 C ATOM 687 O VAL A 821 3.864 5.996 2.200 1.00 0.00 O ATOM 688 CB VAL A 821 0.996 5.610 0.892 1.00 0.00 C ATOM 689 CG1 VAL A 821 -0.505 5.609 1.137 1.00 0.00 C ATOM 690 CG2 VAL A 821 1.302 5.687 -0.596 1.00 0.00 C ATOM 0 H VAL A 821 0.872 8.083 0.204 1.00 0.00 H new ATOM 0 HA VAL A 821 1.429 6.704 2.702 1.00 0.00 H new ATOM 0 HB VAL A 821 1.403 4.674 1.275 1.00 0.00 H new ATOM 0 HG11 VAL A 821 -0.961 4.777 0.600 1.00 0.00 H new ATOM 0 HG12 VAL A 821 -0.699 5.503 2.204 1.00 0.00 H new ATOM 0 HG13 VAL A 821 -0.932 6.547 0.782 1.00 0.00 H new ATOM 0 HG21 VAL A 821 0.822 4.854 -1.110 1.00 0.00 H new ATOM 0 HG22 VAL A 821 0.924 6.627 -0.997 1.00 0.00 H new ATOM 0 HG23 VAL A 821 2.380 5.635 -0.749 1.00 0.00 H new ATOM 700 N GLU A 822 3.684 7.398 0.449 1.00 0.00 N ATOM 701 CA GLU A 822 5.114 7.399 0.163 1.00 0.00 C ATOM 702 C GLU A 822 5.925 7.586 1.443 1.00 0.00 C ATOM 703 O GLU A 822 6.909 6.884 1.674 1.00 0.00 O ATOM 704 CB GLU A 822 5.456 8.506 -0.836 1.00 0.00 C ATOM 705 CG GLU A 822 5.127 9.902 -0.335 1.00 0.00 C ATOM 706 CD GLU A 822 5.584 10.987 -1.291 1.00 0.00 C ATOM 707 OE1 GLU A 822 5.593 10.734 -2.514 1.00 0.00 O ATOM 708 OE2 GLU A 822 5.932 12.088 -0.816 1.00 0.00 O ATOM 0 H GLU A 822 3.127 7.978 -0.179 1.00 0.00 H new ATOM 0 HA GLU A 822 5.372 6.434 -0.273 1.00 0.00 H new ATOM 0 HB2 GLU A 822 6.519 8.455 -1.072 1.00 0.00 H new ATOM 0 HB3 GLU A 822 4.915 8.326 -1.765 1.00 0.00 H new ATOM 0 HG2 GLU A 822 4.051 9.986 -0.184 1.00 0.00 H new ATOM 0 HG3 GLU A 822 5.598 10.056 0.636 1.00 0.00 H new ATOM 715 N SER A 823 5.504 8.537 2.269 1.00 0.00 N ATOM 716 CA SER A 823 6.192 8.820 3.523 1.00 0.00 C ATOM 717 C SER A 823 6.461 7.534 4.298 1.00 0.00 C ATOM 718 O SER A 823 7.442 7.433 5.035 1.00 0.00 O ATOM 719 CB SER A 823 5.364 9.781 4.379 1.00 0.00 C ATOM 720 OG SER A 823 6.095 10.211 5.514 1.00 0.00 O ATOM 0 H SER A 823 4.689 9.125 2.093 1.00 0.00 H new ATOM 0 HA SER A 823 7.148 9.287 3.286 1.00 0.00 H new ATOM 0 HB2 SER A 823 5.072 10.645 3.782 1.00 0.00 H new ATOM 0 HB3 SER A 823 4.446 9.289 4.699 1.00 0.00 H new ATOM 0 HG SER A 823 5.545 10.825 6.044 1.00 0.00 H new ATOM 726 N ASP A 824 5.582 6.553 4.126 1.00 0.00 N ATOM 727 CA ASP A 824 5.723 5.271 4.807 1.00 0.00 C ATOM 728 C ASP A 824 6.619 4.328 4.010 1.00 0.00 C ATOM 729 O ASP A 824 6.558 4.264 2.782 1.00 0.00 O ATOM 730 CB ASP A 824 4.351 4.631 5.024 1.00 0.00 C ATOM 731 CG ASP A 824 4.368 3.581 6.118 1.00 0.00 C ATOM 732 OD1 ASP A 824 4.827 2.451 5.849 1.00 0.00 O ATOM 733 OD2 ASP A 824 3.924 3.891 7.243 1.00 0.00 O ATOM 0 H ASP A 824 4.764 6.621 3.521 1.00 0.00 H new ATOM 0 HA ASP A 824 6.188 5.451 5.776 1.00 0.00 H new ATOM 0 HB2 ASP A 824 3.628 5.406 5.279 1.00 0.00 H new ATOM 0 HB3 ASP A 824 4.014 4.176 4.093 1.00 0.00 H new ATOM 738 N PRO A 825 7.472 3.578 4.723 1.00 0.00 N ATOM 739 CA PRO A 825 8.397 2.624 4.103 1.00 0.00 C ATOM 740 C PRO A 825 7.676 1.418 3.512 1.00 0.00 C ATOM 741 O PRO A 825 8.145 0.813 2.548 1.00 0.00 O ATOM 742 CB PRO A 825 9.295 2.194 5.265 1.00 0.00 C ATOM 743 CG PRO A 825 8.466 2.410 6.484 1.00 0.00 C ATOM 744 CD PRO A 825 7.599 3.602 6.190 1.00 0.00 C ATOM 0 HA PRO A 825 8.940 3.067 3.268 1.00 0.00 H new ATOM 0 HB2 PRO A 825 9.594 1.150 5.169 1.00 0.00 H new ATOM 0 HB3 PRO A 825 10.210 2.786 5.298 1.00 0.00 H new ATOM 0 HG2 PRO A 825 7.860 1.531 6.704 1.00 0.00 H new ATOM 0 HG3 PRO A 825 9.094 2.590 7.356 1.00 0.00 H new ATOM 0 HD2 PRO A 825 6.628 3.523 6.679 1.00 0.00 H new ATOM 0 HD3 PRO A 825 8.057 4.528 6.539 1.00 0.00 H new ATOM 752 N ARG A 826 6.533 1.072 4.097 1.00 0.00 N ATOM 753 CA ARG A 826 5.748 -0.064 3.629 1.00 0.00 C ATOM 754 C ARG A 826 5.390 0.094 2.154 1.00 0.00 C ATOM 755 O ARG A 826 5.375 -0.879 1.400 1.00 0.00 O ATOM 756 CB ARG A 826 4.473 -0.208 4.462 1.00 0.00 C ATOM 757 CG ARG A 826 4.707 -0.824 5.831 1.00 0.00 C ATOM 758 CD ARG A 826 3.449 -0.780 6.684 1.00 0.00 C ATOM 759 NE ARG A 826 3.207 0.552 7.234 1.00 0.00 N ATOM 760 CZ ARG A 826 2.206 0.835 8.059 1.00 0.00 C ATOM 761 NH1 ARG A 826 1.358 -0.115 8.429 1.00 0.00 N ATOM 762 NH2 ARG A 826 2.051 2.071 8.517 1.00 0.00 N ATOM 0 H ARG A 826 6.130 1.562 4.896 1.00 0.00 H new ATOM 0 HA ARG A 826 6.352 -0.964 3.744 1.00 0.00 H new ATOM 0 HB2 ARG A 826 4.018 0.775 4.588 1.00 0.00 H new ATOM 0 HB3 ARG A 826 3.758 -0.822 3.914 1.00 0.00 H new ATOM 0 HG2 ARG A 826 5.033 -1.858 5.715 1.00 0.00 H new ATOM 0 HG3 ARG A 826 5.511 -0.291 6.339 1.00 0.00 H new ATOM 0 HD2 ARG A 826 2.592 -1.085 6.083 1.00 0.00 H new ATOM 0 HD3 ARG A 826 3.538 -1.498 7.499 1.00 0.00 H new ATOM 0 HE ARG A 826 3.842 1.305 6.970 1.00 0.00 H new ATOM 0 HH11 ARG A 826 1.474 -1.066 8.080 1.00 0.00 H new ATOM 0 HH12 ARG A 826 0.590 0.106 9.063 1.00 0.00 H new ATOM 0 HH21 ARG A 826 2.701 2.805 8.235 1.00 0.00 H new ATOM 0 HH22 ARG A 826 1.282 2.287 9.151 1.00 0.00 H new ATOM 776 N TYR A 827 5.102 1.326 1.750 1.00 0.00 N ATOM 777 CA TYR A 827 4.741 1.612 0.366 1.00 0.00 C ATOM 778 C TYR A 827 5.877 1.241 -0.581 1.00 0.00 C ATOM 779 O TYR A 827 5.645 0.800 -1.707 1.00 0.00 O ATOM 780 CB TYR A 827 4.389 3.091 0.204 1.00 0.00 C ATOM 781 CG TYR A 827 4.467 3.579 -1.225 1.00 0.00 C ATOM 782 CD1 TYR A 827 5.669 4.020 -1.765 1.00 0.00 C ATOM 783 CD2 TYR A 827 3.339 3.598 -2.036 1.00 0.00 C ATOM 784 CE1 TYR A 827 5.745 4.467 -3.070 1.00 0.00 C ATOM 785 CE2 TYR A 827 3.405 4.042 -3.343 1.00 0.00 C ATOM 786 CZ TYR A 827 4.610 4.476 -3.855 1.00 0.00 C ATOM 787 OH TYR A 827 4.682 4.920 -5.156 1.00 0.00 O ATOM 0 H TYR A 827 5.111 2.143 2.361 1.00 0.00 H new ATOM 0 HA TYR A 827 3.870 1.008 0.112 1.00 0.00 H new ATOM 0 HB2 TYR A 827 3.381 3.259 0.582 1.00 0.00 H new ATOM 0 HB3 TYR A 827 5.064 3.686 0.820 1.00 0.00 H new ATOM 0 HD1 TYR A 827 6.559 4.013 -1.154 1.00 0.00 H new ATOM 0 HD2 TYR A 827 2.394 3.260 -1.638 1.00 0.00 H new ATOM 0 HE1 TYR A 827 6.687 4.807 -3.474 1.00 0.00 H new ATOM 0 HE2 TYR A 827 2.518 4.049 -3.960 1.00 0.00 H new ATOM 0 HH TYR A 827 5.576 4.739 -5.515 1.00 0.00 H new ATOM 797 N LYS A 828 7.109 1.423 -0.117 1.00 0.00 N ATOM 798 CA LYS A 828 8.284 1.107 -0.919 1.00 0.00 C ATOM 799 C LYS A 828 8.343 -0.385 -1.234 1.00 0.00 C ATOM 800 O LYS A 828 8.924 -0.794 -2.239 1.00 0.00 O ATOM 801 CB LYS A 828 9.558 1.535 -0.187 1.00 0.00 C ATOM 802 CG LYS A 828 9.732 3.041 -0.099 1.00 0.00 C ATOM 803 CD LYS A 828 10.616 3.433 1.073 1.00 0.00 C ATOM 804 CE LYS A 828 12.091 3.356 0.708 1.00 0.00 C ATOM 805 NZ LYS A 828 12.950 3.165 1.909 1.00 0.00 N ATOM 0 H LYS A 828 7.319 1.788 0.812 1.00 0.00 H new ATOM 0 HA LYS A 828 8.210 1.656 -1.858 1.00 0.00 H new ATOM 0 HB2 LYS A 828 9.545 1.120 0.821 1.00 0.00 H new ATOM 0 HB3 LYS A 828 10.421 1.107 -0.697 1.00 0.00 H new ATOM 0 HG2 LYS A 828 10.169 3.412 -1.026 1.00 0.00 H new ATOM 0 HG3 LYS A 828 8.756 3.515 0.006 1.00 0.00 H new ATOM 0 HD2 LYS A 828 10.371 4.446 1.392 1.00 0.00 H new ATOM 0 HD3 LYS A 828 10.414 2.775 1.918 1.00 0.00 H new ATOM 0 HE2 LYS A 828 12.251 2.532 0.013 1.00 0.00 H new ATOM 0 HE3 LYS A 828 12.386 4.270 0.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 828 13.947 3.117 1.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 828 12.817 3.964 2.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 828 12.686 2.280 2.387 1.00 0.00 H new ATOM 819 N ALA A 829 7.738 -1.192 -0.369 1.00 0.00 N ATOM 820 CA ALA A 829 7.719 -2.637 -0.557 1.00 0.00 C ATOM 821 C ALA A 829 7.384 -2.998 -2.000 1.00 0.00 C ATOM 822 O ALA A 829 8.159 -3.672 -2.678 1.00 0.00 O ATOM 823 CB ALA A 829 6.722 -3.280 0.396 1.00 0.00 C ATOM 0 H ALA A 829 7.254 -0.869 0.469 1.00 0.00 H new ATOM 0 HA ALA A 829 8.715 -3.021 -0.336 1.00 0.00 H new ATOM 0 HB1 ALA A 829 6.718 -4.359 0.245 1.00 0.00 H new ATOM 0 HB2 ALA A 829 7.007 -3.059 1.425 1.00 0.00 H new ATOM 0 HB3 ALA A 829 5.726 -2.883 0.202 1.00 0.00 H new ATOM 829 N VAL A 830 6.223 -2.547 -2.464 1.00 0.00 N ATOM 830 CA VAL A 830 5.785 -2.823 -3.827 1.00 0.00 C ATOM 831 C VAL A 830 6.688 -2.134 -4.844 1.00 0.00 C ATOM 832 O VAL A 830 6.539 -0.943 -5.115 1.00 0.00 O ATOM 833 CB VAL A 830 4.332 -2.364 -4.053 1.00 0.00 C ATOM 834 CG1 VAL A 830 3.886 -2.684 -5.472 1.00 0.00 C ATOM 835 CG2 VAL A 830 3.405 -3.011 -3.035 1.00 0.00 C ATOM 0 H VAL A 830 5.569 -1.989 -1.916 1.00 0.00 H new ATOM 0 HA VAL A 830 5.843 -3.903 -3.966 1.00 0.00 H new ATOM 0 HB VAL A 830 4.285 -1.283 -3.918 1.00 0.00 H new ATOM 0 HG11 VAL A 830 2.857 -2.353 -5.613 1.00 0.00 H new ATOM 0 HG12 VAL A 830 4.534 -2.169 -6.182 1.00 0.00 H new ATOM 0 HG13 VAL A 830 3.947 -3.759 -5.639 1.00 0.00 H new ATOM 0 HG21 VAL A 830 2.383 -2.676 -3.209 1.00 0.00 H new ATOM 0 HG22 VAL A 830 3.454 -4.095 -3.136 1.00 0.00 H new ATOM 0 HG23 VAL A 830 3.714 -2.726 -2.029 1.00 0.00 H new ATOM 845 N ASP A 831 7.624 -2.892 -5.404 1.00 0.00 N ATOM 846 CA ASP A 831 8.551 -2.356 -6.394 1.00 0.00 C ATOM 847 C ASP A 831 7.862 -2.174 -7.742 1.00 0.00 C ATOM 848 O ASP A 831 8.131 -1.213 -8.464 1.00 0.00 O ATOM 849 CB ASP A 831 9.760 -3.281 -6.546 1.00 0.00 C ATOM 850 CG ASP A 831 10.447 -3.559 -5.223 1.00 0.00 C ATOM 851 OD1 ASP A 831 10.336 -2.716 -4.308 1.00 0.00 O ATOM 852 OD2 ASP A 831 11.094 -4.619 -5.103 1.00 0.00 O ATOM 0 H ASP A 831 7.761 -3.880 -5.189 1.00 0.00 H new ATOM 0 HA ASP A 831 8.891 -1.381 -6.046 1.00 0.00 H new ATOM 0 HB2 ASP A 831 9.439 -4.223 -6.990 1.00 0.00 H new ATOM 0 HB3 ASP A 831 10.474 -2.830 -7.235 1.00 0.00 H new ATOM 857 N SER A 832 6.972 -3.103 -8.076 1.00 0.00 N ATOM 858 CA SER A 832 6.247 -3.047 -9.340 1.00 0.00 C ATOM 859 C SER A 832 5.172 -1.965 -9.303 1.00 0.00 C ATOM 860 O SER A 832 4.250 -2.018 -8.489 1.00 0.00 O ATOM 861 CB SER A 832 5.610 -4.404 -9.647 1.00 0.00 C ATOM 862 OG SER A 832 6.597 -5.370 -9.965 1.00 0.00 O ATOM 0 H SER A 832 6.736 -3.903 -7.489 1.00 0.00 H new ATOM 0 HA SER A 832 6.959 -2.800 -10.128 1.00 0.00 H new ATOM 0 HB2 SER A 832 5.031 -4.740 -8.787 1.00 0.00 H new ATOM 0 HB3 SER A 832 4.914 -4.303 -10.480 1.00 0.00 H new ATOM 0 HG SER A 832 6.165 -6.229 -10.155 1.00 0.00 H new ATOM 868 N SER A 833 5.298 -0.984 -10.191 1.00 0.00 N ATOM 869 CA SER A 833 4.340 0.114 -10.259 1.00 0.00 C ATOM 870 C SER A 833 2.949 -0.400 -10.617 1.00 0.00 C ATOM 871 O SER A 833 1.972 -0.109 -9.928 1.00 0.00 O ATOM 872 CB SER A 833 4.794 1.151 -11.288 1.00 0.00 C ATOM 873 OG SER A 833 3.831 2.181 -11.431 1.00 0.00 O ATOM 0 H SER A 833 6.054 -0.927 -10.873 1.00 0.00 H new ATOM 0 HA SER A 833 4.292 0.584 -9.277 1.00 0.00 H new ATOM 0 HB2 SER A 833 5.748 1.580 -10.980 1.00 0.00 H new ATOM 0 HB3 SER A 833 4.958 0.666 -12.250 1.00 0.00 H new ATOM 0 HG SER A 833 4.144 2.832 -12.093 1.00 0.00 H new ATOM 879 N SER A 834 2.869 -1.167 -11.700 1.00 0.00 N ATOM 880 CA SER A 834 1.598 -1.719 -12.153 1.00 0.00 C ATOM 881 C SER A 834 0.777 -2.231 -10.974 1.00 0.00 C ATOM 882 O SER A 834 -0.434 -2.019 -10.908 1.00 0.00 O ATOM 883 CB SER A 834 1.837 -2.852 -13.153 1.00 0.00 C ATOM 884 OG SER A 834 2.375 -2.356 -14.367 1.00 0.00 O ATOM 0 H SER A 834 3.669 -1.420 -12.280 1.00 0.00 H new ATOM 0 HA SER A 834 1.039 -0.923 -12.644 1.00 0.00 H new ATOM 0 HB2 SER A 834 2.519 -3.584 -12.721 1.00 0.00 H new ATOM 0 HB3 SER A 834 0.899 -3.370 -13.352 1.00 0.00 H new ATOM 0 HG SER A 834 2.520 -3.100 -14.988 1.00 0.00 H new ATOM 890 N MET A 835 1.445 -2.907 -10.045 1.00 0.00 N ATOM 891 CA MET A 835 0.778 -3.449 -8.867 1.00 0.00 C ATOM 892 C MET A 835 0.208 -2.329 -8.001 1.00 0.00 C ATOM 893 O MET A 835 -0.911 -2.430 -7.499 1.00 0.00 O ATOM 894 CB MET A 835 1.753 -4.296 -8.047 1.00 0.00 C ATOM 895 CG MET A 835 2.442 -5.383 -8.857 1.00 0.00 C ATOM 896 SD MET A 835 1.371 -6.797 -9.175 1.00 0.00 S ATOM 897 CE MET A 835 1.125 -7.417 -7.512 1.00 0.00 C ATOM 0 H MET A 835 2.447 -3.092 -10.085 1.00 0.00 H new ATOM 0 HA MET A 835 -0.045 -4.079 -9.204 1.00 0.00 H new ATOM 0 HB2 MET A 835 2.510 -3.644 -7.611 1.00 0.00 H new ATOM 0 HB3 MET A 835 1.214 -4.757 -7.219 1.00 0.00 H new ATOM 0 HG2 MET A 835 2.777 -4.966 -9.806 1.00 0.00 H new ATOM 0 HG3 MET A 835 3.332 -5.719 -8.324 1.00 0.00 H new ATOM 0 HE1 MET A 835 0.885 -8.480 -7.552 1.00 0.00 H new ATOM 0 HE2 MET A 835 2.036 -7.272 -6.931 1.00 0.00 H new ATOM 0 HE3 MET A 835 0.304 -6.877 -7.040 1.00 0.00 H new ATOM 907 N ARG A 836 0.985 -1.265 -7.831 1.00 0.00 N ATOM 908 CA ARG A 836 0.558 -0.127 -7.025 1.00 0.00 C ATOM 909 C ARG A 836 -0.768 0.432 -7.534 1.00 0.00 C ATOM 910 O ARG A 836 -1.736 0.538 -6.783 1.00 0.00 O ATOM 911 CB ARG A 836 1.626 0.968 -7.043 1.00 0.00 C ATOM 912 CG ARG A 836 2.806 0.681 -6.129 1.00 0.00 C ATOM 913 CD ARG A 836 3.543 1.957 -5.754 1.00 0.00 C ATOM 914 NE ARG A 836 4.315 2.492 -6.872 1.00 0.00 N ATOM 915 CZ ARG A 836 5.527 2.060 -7.202 1.00 0.00 C ATOM 916 NH1 ARG A 836 6.101 1.090 -6.504 1.00 0.00 N ATOM 917 NH2 ARG A 836 6.167 2.596 -8.234 1.00 0.00 N ATOM 0 H ARG A 836 1.914 -1.167 -8.241 1.00 0.00 H new ATOM 0 HA ARG A 836 0.418 -0.471 -6.000 1.00 0.00 H new ATOM 0 HB2 ARG A 836 1.989 1.093 -8.063 1.00 0.00 H new ATOM 0 HB3 ARG A 836 1.170 1.913 -6.749 1.00 0.00 H new ATOM 0 HG2 ARG A 836 2.455 0.183 -5.225 1.00 0.00 H new ATOM 0 HG3 ARG A 836 3.493 -0.005 -6.624 1.00 0.00 H new ATOM 0 HD2 ARG A 836 2.825 2.705 -5.419 1.00 0.00 H new ATOM 0 HD3 ARG A 836 4.210 1.757 -4.916 1.00 0.00 H new ATOM 0 HE ARG A 836 3.901 3.238 -7.430 1.00 0.00 H new ATOM 0 HH11 ARG A 836 5.612 0.674 -5.712 1.00 0.00 H new ATOM 0 HH12 ARG A 836 7.032 0.760 -6.759 1.00 0.00 H new ATOM 0 HH21 ARG A 836 5.728 3.341 -8.775 1.00 0.00 H new ATOM 0 HH22 ARG A 836 7.098 2.263 -8.486 1.00 0.00 H new ATOM 931 N GLU A 837 -0.801 0.788 -8.815 1.00 0.00 N ATOM 932 CA GLU A 837 -2.008 1.338 -9.423 1.00 0.00 C ATOM 933 C GLU A 837 -3.137 0.311 -9.415 1.00 0.00 C ATOM 934 O GLU A 837 -4.219 0.567 -8.886 1.00 0.00 O ATOM 935 CB GLU A 837 -1.723 1.788 -10.857 1.00 0.00 C ATOM 936 CG GLU A 837 -1.205 3.213 -10.956 1.00 0.00 C ATOM 937 CD GLU A 837 -0.610 3.525 -12.316 1.00 0.00 C ATOM 938 OE1 GLU A 837 -1.372 3.556 -13.304 1.00 0.00 O ATOM 939 OE2 GLU A 837 0.618 3.738 -12.391 1.00 0.00 O ATOM 0 H GLU A 837 -0.008 0.706 -9.451 1.00 0.00 H new ATOM 0 HA GLU A 837 -2.321 2.201 -8.835 1.00 0.00 H new ATOM 0 HB2 GLU A 837 -0.992 1.113 -11.302 1.00 0.00 H new ATOM 0 HB3 GLU A 837 -2.637 1.701 -11.445 1.00 0.00 H new ATOM 0 HG2 GLU A 837 -2.021 3.907 -10.753 1.00 0.00 H new ATOM 0 HG3 GLU A 837 -0.449 3.375 -10.187 1.00 0.00 H new ATOM 946 N ASP A 838 -2.877 -0.850 -10.006 1.00 0.00 N ATOM 947 CA ASP A 838 -3.870 -1.916 -10.067 1.00 0.00 C ATOM 948 C ASP A 838 -4.463 -2.186 -8.688 1.00 0.00 C ATOM 949 O ASP A 838 -5.666 -2.027 -8.475 1.00 0.00 O ATOM 950 CB ASP A 838 -3.244 -3.194 -10.626 1.00 0.00 C ATOM 951 CG ASP A 838 -4.269 -4.109 -11.266 1.00 0.00 C ATOM 952 OD1 ASP A 838 -5.250 -3.591 -11.839 1.00 0.00 O ATOM 953 OD2 ASP A 838 -4.091 -5.343 -11.194 1.00 0.00 O ATOM 0 H ASP A 838 -1.987 -1.077 -10.450 1.00 0.00 H new ATOM 0 HA ASP A 838 -4.672 -1.594 -10.731 1.00 0.00 H new ATOM 0 HB2 ASP A 838 -2.485 -2.931 -11.363 1.00 0.00 H new ATOM 0 HB3 ASP A 838 -2.736 -3.728 -9.823 1.00 0.00 H new ATOM 958 N LEU A 839 -3.612 -2.596 -7.754 1.00 0.00 N ATOM 959 CA LEU A 839 -4.052 -2.890 -6.394 1.00 0.00 C ATOM 960 C LEU A 839 -4.918 -1.761 -5.846 1.00 0.00 C ATOM 961 O LEU A 839 -6.070 -1.975 -5.468 1.00 0.00 O ATOM 962 CB LEU A 839 -2.843 -3.110 -5.483 1.00 0.00 C ATOM 963 CG LEU A 839 -2.088 -4.426 -5.675 1.00 0.00 C ATOM 964 CD1 LEU A 839 -0.764 -4.395 -4.927 1.00 0.00 C ATOM 965 CD2 LEU A 839 -2.937 -5.600 -5.212 1.00 0.00 C ATOM 0 H LEU A 839 -2.614 -2.732 -7.913 1.00 0.00 H new ATOM 0 HA LEU A 839 -4.650 -3.801 -6.420 1.00 0.00 H new ATOM 0 HB2 LEU A 839 -2.144 -2.288 -5.636 1.00 0.00 H new ATOM 0 HB3 LEU A 839 -3.179 -3.055 -4.447 1.00 0.00 H new ATOM 0 HG LEU A 839 -1.879 -4.552 -6.737 1.00 0.00 H new ATOM 0 HD11 LEU A 839 -0.240 -5.339 -5.075 1.00 0.00 H new ATOM 0 HD12 LEU A 839 -0.151 -3.577 -5.306 1.00 0.00 H new ATOM 0 HD13 LEU A 839 -0.950 -4.246 -3.863 1.00 0.00 H new ATOM 0 HD21 LEU A 839 -2.384 -6.528 -5.356 1.00 0.00 H new ATOM 0 HD22 LEU A 839 -3.177 -5.481 -4.155 1.00 0.00 H new ATOM 0 HD23 LEU A 839 -3.859 -5.633 -5.792 1.00 0.00 H new ATOM 977 N PHE A 840 -4.357 -0.557 -5.807 1.00 0.00 N ATOM 978 CA PHE A 840 -5.078 0.607 -5.306 1.00 0.00 C ATOM 979 C PHE A 840 -6.441 0.734 -5.980 1.00 0.00 C ATOM 980 O PHE A 840 -7.480 0.666 -5.324 1.00 0.00 O ATOM 981 CB PHE A 840 -4.260 1.880 -5.539 1.00 0.00 C ATOM 982 CG PHE A 840 -5.020 3.142 -5.247 1.00 0.00 C ATOM 983 CD1 PHE A 840 -5.370 3.471 -3.948 1.00 0.00 C ATOM 984 CD2 PHE A 840 -5.384 4.000 -6.273 1.00 0.00 C ATOM 985 CE1 PHE A 840 -6.068 4.632 -3.675 1.00 0.00 C ATOM 986 CE2 PHE A 840 -6.082 5.163 -6.006 1.00 0.00 C ATOM 987 CZ PHE A 840 -6.426 5.479 -4.706 1.00 0.00 C ATOM 0 H PHE A 840 -3.405 -0.362 -6.117 1.00 0.00 H new ATOM 0 HA PHE A 840 -5.233 0.474 -4.235 1.00 0.00 H new ATOM 0 HB2 PHE A 840 -3.368 1.849 -4.913 1.00 0.00 H new ATOM 0 HB3 PHE A 840 -3.922 1.900 -6.575 1.00 0.00 H new ATOM 0 HD1 PHE A 840 -5.094 2.812 -3.138 1.00 0.00 H new ATOM 0 HD2 PHE A 840 -5.120 3.757 -7.292 1.00 0.00 H new ATOM 0 HE1 PHE A 840 -6.333 4.877 -2.657 1.00 0.00 H new ATOM 0 HE2 PHE A 840 -6.358 5.824 -6.814 1.00 0.00 H new ATOM 0 HZ PHE A 840 -6.973 6.386 -4.496 1.00 0.00 H new ATOM 997 N LYS A 841 -6.428 0.920 -7.296 1.00 0.00 N ATOM 998 CA LYS A 841 -7.661 1.056 -8.062 1.00 0.00 C ATOM 999 C LYS A 841 -8.655 -0.040 -7.692 1.00 0.00 C ATOM 1000 O LYS A 841 -9.839 0.227 -7.486 1.00 0.00 O ATOM 1001 CB LYS A 841 -7.363 1.003 -9.562 1.00 0.00 C ATOM 1002 CG LYS A 841 -6.621 2.225 -10.078 1.00 0.00 C ATOM 1003 CD LYS A 841 -5.885 1.924 -11.372 1.00 0.00 C ATOM 1004 CE LYS A 841 -6.844 1.824 -12.549 1.00 0.00 C ATOM 1005 NZ LYS A 841 -7.470 0.476 -12.641 1.00 0.00 N ATOM 0 H LYS A 841 -5.576 0.980 -7.854 1.00 0.00 H new ATOM 0 HA LYS A 841 -8.105 2.022 -7.820 1.00 0.00 H new ATOM 0 HB2 LYS A 841 -6.772 0.112 -9.775 1.00 0.00 H new ATOM 0 HB3 LYS A 841 -8.301 0.901 -10.107 1.00 0.00 H new ATOM 0 HG2 LYS A 841 -7.327 3.039 -10.241 1.00 0.00 H new ATOM 0 HG3 LYS A 841 -5.910 2.565 -9.325 1.00 0.00 H new ATOM 0 HD2 LYS A 841 -5.151 2.707 -11.565 1.00 0.00 H new ATOM 0 HD3 LYS A 841 -5.334 0.989 -11.270 1.00 0.00 H new ATOM 0 HE2 LYS A 841 -7.623 2.580 -12.448 1.00 0.00 H new ATOM 0 HE3 LYS A 841 -6.308 2.040 -13.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 -7.419 0.136 -13.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 -6.963 -0.185 -12.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 -8.466 0.535 -12.346 1.00 0.00 H new ATOM 1019 N GLN A 842 -8.166 -1.273 -7.609 1.00 0.00 N ATOM 1020 CA GLN A 842 -9.012 -2.409 -7.262 1.00 0.00 C ATOM 1021 C GLN A 842 -9.782 -2.141 -5.973 1.00 0.00 C ATOM 1022 O GLN A 842 -11.011 -2.200 -5.948 1.00 0.00 O ATOM 1023 CB GLN A 842 -8.167 -3.675 -7.113 1.00 0.00 C ATOM 1024 CG GLN A 842 -7.920 -4.401 -8.425 1.00 0.00 C ATOM 1025 CD GLN A 842 -7.554 -5.858 -8.227 1.00 0.00 C ATOM 1026 OE1 GLN A 842 -8.371 -6.752 -8.451 1.00 0.00 O ATOM 1027 NE2 GLN A 842 -6.321 -6.107 -7.803 1.00 0.00 N ATOM 0 H GLN A 842 -7.189 -1.511 -7.777 1.00 0.00 H new ATOM 0 HA GLN A 842 -9.731 -2.554 -8.069 1.00 0.00 H new ATOM 0 HB2 GLN A 842 -7.208 -3.411 -6.668 1.00 0.00 H new ATOM 0 HB3 GLN A 842 -8.664 -4.354 -6.420 1.00 0.00 H new ATOM 0 HG2 GLN A 842 -8.814 -4.336 -9.045 1.00 0.00 H new ATOM 0 HG3 GLN A 842 -7.119 -3.900 -8.968 1.00 0.00 H new ATOM 0 HE21 GLN A 842 -5.676 -5.336 -7.630 1.00 0.00 H new ATOM 0 HE22 GLN A 842 -6.019 -7.069 -7.651 1.00 0.00 H new ATOM 1036 N TYR A 843 -9.050 -1.848 -4.904 1.00 0.00 N ATOM 1037 CA TYR A 843 -9.664 -1.574 -3.610 1.00 0.00 C ATOM 1038 C TYR A 843 -10.758 -0.518 -3.738 1.00 0.00 C ATOM 1039 O TYR A 843 -11.923 -0.775 -3.432 1.00 0.00 O ATOM 1040 CB TYR A 843 -8.606 -1.109 -2.608 1.00 0.00 C ATOM 1041 CG TYR A 843 -9.033 -1.253 -1.165 1.00 0.00 C ATOM 1042 CD1 TYR A 843 -9.789 -0.268 -0.542 1.00 0.00 C ATOM 1043 CD2 TYR A 843 -8.680 -2.374 -0.424 1.00 0.00 C ATOM 1044 CE1 TYR A 843 -10.181 -0.395 0.777 1.00 0.00 C ATOM 1045 CE2 TYR A 843 -9.069 -2.511 0.894 1.00 0.00 C ATOM 1046 CZ TYR A 843 -9.819 -1.518 1.490 1.00 0.00 C ATOM 1047 OH TYR A 843 -10.207 -1.650 2.804 1.00 0.00 O ATOM 0 H TYR A 843 -8.031 -1.794 -4.908 1.00 0.00 H new ATOM 0 HA TYR A 843 -10.116 -2.498 -3.249 1.00 0.00 H new ATOM 0 HB2 TYR A 843 -7.692 -1.681 -2.766 1.00 0.00 H new ATOM 0 HB3 TYR A 843 -8.366 -0.064 -2.804 1.00 0.00 H new ATOM 0 HD1 TYR A 843 -10.075 0.612 -1.098 1.00 0.00 H new ATOM 0 HD2 TYR A 843 -8.091 -3.152 -0.887 1.00 0.00 H new ATOM 0 HE1 TYR A 843 -10.767 0.381 1.247 1.00 0.00 H new ATOM 0 HE2 TYR A 843 -8.788 -3.390 1.455 1.00 0.00 H new ATOM 0 HH TYR A 843 -9.871 -2.499 3.161 1.00 0.00 H new ATOM 1057 N ILE A 844 -10.374 0.670 -4.193 1.00 0.00 N ATOM 1058 CA ILE A 844 -11.321 1.764 -4.363 1.00 0.00 C ATOM 1059 C ILE A 844 -12.543 1.315 -5.158 1.00 0.00 C ATOM 1060 O ILE A 844 -13.680 1.531 -4.741 1.00 0.00 O ATOM 1061 CB ILE A 844 -10.672 2.965 -5.077 1.00 0.00 C ATOM 1062 CG1 ILE A 844 -9.551 3.552 -4.217 1.00 0.00 C ATOM 1063 CG2 ILE A 844 -11.718 4.025 -5.389 1.00 0.00 C ATOM 1064 CD1 ILE A 844 -9.891 3.618 -2.744 1.00 0.00 C ATOM 0 H ILE A 844 -9.414 0.899 -4.450 1.00 0.00 H new ATOM 0 HA ILE A 844 -11.632 2.070 -3.364 1.00 0.00 H new ATOM 0 HB ILE A 844 -10.241 2.620 -6.017 1.00 0.00 H new ATOM 0 HG12 ILE A 844 -8.651 2.951 -4.347 1.00 0.00 H new ATOM 0 HG13 ILE A 844 -9.318 4.555 -4.573 1.00 0.00 H new ATOM 0 HG21 ILE A 844 -11.244 4.867 -5.893 1.00 0.00 H new ATOM 0 HG22 ILE A 844 -12.485 3.600 -6.036 1.00 0.00 H new ATOM 0 HG23 ILE A 844 -12.176 4.369 -4.461 1.00 0.00 H new ATOM 0 HD11 ILE A 844 -9.051 4.044 -2.195 1.00 0.00 H new ATOM 0 HD12 ILE A 844 -10.772 4.243 -2.602 1.00 0.00 H new ATOM 0 HD13 ILE A 844 -10.095 2.614 -2.372 1.00 0.00 H new ATOM 1076 N GLU A 845 -12.299 0.687 -6.304 1.00 0.00 N ATOM 1077 CA GLU A 845 -13.380 0.206 -7.156 1.00 0.00 C ATOM 1078 C GLU A 845 -14.424 -0.547 -6.338 1.00 0.00 C ATOM 1079 O GLU A 845 -15.627 -0.361 -6.522 1.00 0.00 O ATOM 1080 CB GLU A 845 -12.826 -0.702 -8.256 1.00 0.00 C ATOM 1081 CG GLU A 845 -13.666 -0.706 -9.522 1.00 0.00 C ATOM 1082 CD GLU A 845 -13.386 -1.907 -10.405 1.00 0.00 C ATOM 1083 OE1 GLU A 845 -13.400 -3.042 -9.885 1.00 0.00 O ATOM 1084 OE2 GLU A 845 -13.152 -1.711 -11.616 1.00 0.00 O ATOM 0 H GLU A 845 -11.363 0.500 -6.663 1.00 0.00 H new ATOM 0 HA GLU A 845 -13.859 1.071 -7.615 1.00 0.00 H new ATOM 0 HB2 GLU A 845 -11.813 -0.383 -8.503 1.00 0.00 H new ATOM 0 HB3 GLU A 845 -12.755 -1.720 -7.874 1.00 0.00 H new ATOM 0 HG2 GLU A 845 -14.722 -0.696 -9.253 1.00 0.00 H new ATOM 0 HG3 GLU A 845 -13.472 0.207 -10.085 1.00 0.00 H new ATOM 1091 N LYS A 846 -13.956 -1.399 -5.432 1.00 0.00 N ATOM 1092 CA LYS A 846 -14.847 -2.181 -4.583 1.00 0.00 C ATOM 1093 C LYS A 846 -15.680 -1.272 -3.686 1.00 0.00 C ATOM 1094 O LYS A 846 -16.900 -1.418 -3.599 1.00 0.00 O ATOM 1095 CB LYS A 846 -14.040 -3.160 -3.727 1.00 0.00 C ATOM 1096 CG LYS A 846 -14.860 -4.325 -3.201 1.00 0.00 C ATOM 1097 CD LYS A 846 -13.973 -5.483 -2.772 1.00 0.00 C ATOM 1098 CE LYS A 846 -14.711 -6.810 -2.853 1.00 0.00 C ATOM 1099 NZ LYS A 846 -15.516 -7.072 -1.628 1.00 0.00 N ATOM 0 H LYS A 846 -12.963 -1.566 -5.267 1.00 0.00 H new ATOM 0 HA LYS A 846 -15.522 -2.743 -5.228 1.00 0.00 H new ATOM 0 HB2 LYS A 846 -13.210 -3.548 -4.318 1.00 0.00 H new ATOM 0 HB3 LYS A 846 -13.607 -2.621 -2.884 1.00 0.00 H new ATOM 0 HG2 LYS A 846 -15.463 -3.994 -2.355 1.00 0.00 H new ATOM 0 HG3 LYS A 846 -15.552 -4.662 -3.973 1.00 0.00 H new ATOM 0 HD2 LYS A 846 -13.087 -5.519 -3.406 1.00 0.00 H new ATOM 0 HD3 LYS A 846 -13.628 -5.319 -1.751 1.00 0.00 H new ATOM 0 HE2 LYS A 846 -15.366 -6.809 -3.725 1.00 0.00 H new ATOM 0 HE3 LYS A 846 -13.992 -7.617 -2.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 846 -16.004 -7.986 -1.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 846 -14.888 -7.098 -0.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 846 -16.219 -6.315 -1.506 1.00 0.00 H new ATOM 1113 N ILE A 847 -15.014 -0.333 -3.021 1.00 0.00 N ATOM 1114 CA ILE A 847 -15.695 0.601 -2.132 1.00 0.00 C ATOM 1115 C ILE A 847 -16.864 1.279 -2.839 1.00 0.00 C ATOM 1116 O ILE A 847 -18.023 1.073 -2.481 1.00 0.00 O ATOM 1117 CB ILE A 847 -14.731 1.681 -1.606 1.00 0.00 C ATOM 1118 CG1 ILE A 847 -13.571 1.034 -0.848 1.00 0.00 C ATOM 1119 CG2 ILE A 847 -15.473 2.663 -0.712 1.00 0.00 C ATOM 1120 CD1 ILE A 847 -12.448 1.995 -0.526 1.00 0.00 C ATOM 0 H ILE A 847 -14.005 -0.199 -3.081 1.00 0.00 H new ATOM 0 HA ILE A 847 -16.071 0.020 -1.290 1.00 0.00 H new ATOM 0 HB ILE A 847 -14.324 2.229 -2.456 1.00 0.00 H new ATOM 0 HG12 ILE A 847 -13.949 0.605 0.080 1.00 0.00 H new ATOM 0 HG13 ILE A 847 -13.174 0.210 -1.442 1.00 0.00 H new ATOM 0 HG21 ILE A 847 -14.778 3.420 -0.348 1.00 0.00 H new ATOM 0 HG22 ILE A 847 -16.268 3.144 -1.281 1.00 0.00 H new ATOM 0 HG23 ILE A 847 -15.905 2.130 0.135 1.00 0.00 H new ATOM 0 HD11 ILE A 847 -11.660 1.467 0.012 1.00 0.00 H new ATOM 0 HD12 ILE A 847 -12.044 2.405 -1.451 1.00 0.00 H new ATOM 0 HD13 ILE A 847 -12.830 2.806 0.094 1.00 0.00 H new ATOM 1132 N ALA A 848 -16.551 2.088 -3.845 1.00 0.00 N ATOM 1133 CA ALA A 848 -17.575 2.794 -4.605 1.00 0.00 C ATOM 1134 C ALA A 848 -18.696 1.849 -5.025 1.00 0.00 C ATOM 1135 O ALA A 848 -19.874 2.132 -4.809 1.00 0.00 O ATOM 1136 CB ALA A 848 -16.960 3.462 -5.826 1.00 0.00 C ATOM 0 H ALA A 848 -15.596 2.271 -4.153 1.00 0.00 H new ATOM 0 HA ALA A 848 -18.004 3.562 -3.962 1.00 0.00 H new ATOM 0 HB1 ALA A 848 -17.736 3.985 -6.384 1.00 0.00 H new ATOM 0 HB2 ALA A 848 -16.200 4.175 -5.507 1.00 0.00 H new ATOM 0 HB3 ALA A 848 -16.503 2.705 -6.463 1.00 0.00 H new ATOM 1142 N LYS A 849 -18.321 0.726 -5.628 1.00 0.00 N ATOM 1143 CA LYS A 849 -19.294 -0.262 -6.078 1.00 0.00 C ATOM 1144 C LYS A 849 -20.399 -0.449 -5.043 1.00 0.00 C ATOM 1145 O LYS A 849 -21.584 -0.385 -5.368 1.00 0.00 O ATOM 1146 CB LYS A 849 -18.604 -1.601 -6.350 1.00 0.00 C ATOM 1147 CG LYS A 849 -19.312 -2.449 -7.393 1.00 0.00 C ATOM 1148 CD LYS A 849 -19.031 -3.929 -7.192 1.00 0.00 C ATOM 1149 CE LYS A 849 -19.929 -4.790 -8.066 1.00 0.00 C ATOM 1150 NZ LYS A 849 -19.789 -6.238 -7.748 1.00 0.00 N ATOM 0 H LYS A 849 -17.350 0.477 -5.816 1.00 0.00 H new ATOM 0 HA LYS A 849 -19.743 0.103 -7.002 1.00 0.00 H new ATOM 0 HB2 LYS A 849 -17.582 -1.413 -6.679 1.00 0.00 H new ATOM 0 HB3 LYS A 849 -18.541 -2.163 -5.418 1.00 0.00 H new ATOM 0 HG2 LYS A 849 -20.386 -2.271 -7.340 1.00 0.00 H new ATOM 0 HG3 LYS A 849 -18.988 -2.148 -8.389 1.00 0.00 H new ATOM 0 HD2 LYS A 849 -17.987 -4.137 -7.425 1.00 0.00 H new ATOM 0 HD3 LYS A 849 -19.182 -4.190 -6.145 1.00 0.00 H new ATOM 0 HE2 LYS A 849 -20.967 -4.487 -7.930 1.00 0.00 H new ATOM 0 HE3 LYS A 849 -19.683 -4.623 -9.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 849 -20.417 -6.791 -8.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 849 -18.804 -6.534 -7.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 849 -20.048 -6.402 -6.754 1.00 0.00 H new ATOM 1164 N ASN A 850 -20.002 -0.679 -3.796 1.00 0.00 N ATOM 1165 CA ASN A 850 -20.959 -0.874 -2.713 1.00 0.00 C ATOM 1166 C ASN A 850 -21.001 0.345 -1.797 1.00 0.00 C ATOM 1167 O ASN A 850 -20.224 0.448 -0.847 1.00 0.00 O ATOM 1168 CB ASN A 850 -20.599 -2.122 -1.904 1.00 0.00 C ATOM 1169 CG ASN A 850 -20.469 -3.357 -2.774 1.00 0.00 C ATOM 1170 OD1 ASN A 850 -19.379 -3.688 -3.243 1.00 0.00 O ATOM 1171 ND2 ASN A 850 -21.583 -4.046 -2.993 1.00 0.00 N ATOM 0 H ASN A 850 -19.024 -0.735 -3.510 1.00 0.00 H new ATOM 0 HA ASN A 850 -21.946 -1.008 -3.155 1.00 0.00 H new ATOM 0 HB2 ASN A 850 -19.660 -1.952 -1.377 1.00 0.00 H new ATOM 0 HB3 ASN A 850 -21.363 -2.294 -1.146 1.00 0.00 H new ATOM 0 HD21 ASN A 850 -21.558 -4.887 -3.570 1.00 0.00 H new ATOM 0 HD22 ASN A 850 -22.464 -3.735 -2.584 1.00 0.00 H new ATOM 1178 N LEU A 851 -21.912 1.267 -2.088 1.00 0.00 N ATOM 1179 CA LEU A 851 -22.056 2.480 -1.291 1.00 0.00 C ATOM 1180 C LEU A 851 -22.179 2.145 0.192 1.00 0.00 C ATOM 1181 O LEU A 851 -22.940 1.257 0.577 1.00 0.00 O ATOM 1182 CB LEU A 851 -23.281 3.273 -1.750 1.00 0.00 C ATOM 1183 CG LEU A 851 -23.365 3.572 -3.247 1.00 0.00 C ATOM 1184 CD1 LEU A 851 -24.767 4.026 -3.623 1.00 0.00 C ATOM 1185 CD2 LEU A 851 -22.338 4.624 -3.639 1.00 0.00 C ATOM 0 H LEU A 851 -22.562 1.198 -2.871 1.00 0.00 H new ATOM 0 HA LEU A 851 -21.163 3.088 -1.435 1.00 0.00 H new ATOM 0 HB2 LEU A 851 -24.175 2.722 -1.459 1.00 0.00 H new ATOM 0 HB3 LEU A 851 -23.300 4.219 -1.209 1.00 0.00 H new ATOM 0 HG LEU A 851 -23.144 2.656 -3.794 1.00 0.00 H new ATOM 0 HD11 LEU A 851 -24.808 4.234 -4.692 1.00 0.00 H new ATOM 0 HD12 LEU A 851 -25.482 3.240 -3.379 1.00 0.00 H new ATOM 0 HD13 LEU A 851 -25.018 4.930 -3.068 1.00 0.00 H new ATOM 0 HD21 LEU A 851 -22.412 4.824 -4.708 1.00 0.00 H new ATOM 0 HD22 LEU A 851 -22.528 5.542 -3.084 1.00 0.00 H new ATOM 0 HD23 LEU A 851 -21.337 4.260 -3.407 1.00 0.00 H new ATOM 1197 N ASP A 852 -21.428 2.863 1.020 1.00 0.00 N ATOM 1198 CA ASP A 852 -21.455 2.645 2.461 1.00 0.00 C ATOM 1199 C ASP A 852 -22.703 3.264 3.081 1.00 0.00 C ATOM 1200 O ASP A 852 -22.986 4.446 2.883 1.00 0.00 O ATOM 1201 CB ASP A 852 -20.201 3.233 3.111 1.00 0.00 C ATOM 1202 CG ASP A 852 -20.374 3.462 4.600 1.00 0.00 C ATOM 1203 OD1 ASP A 852 -20.283 2.480 5.366 1.00 0.00 O ATOM 1204 OD2 ASP A 852 -20.601 4.623 4.999 1.00 0.00 O ATOM 0 H ASP A 852 -20.793 3.601 0.717 1.00 0.00 H new ATOM 0 HA ASP A 852 -21.478 1.570 2.641 1.00 0.00 H new ATOM 0 HB2 ASP A 852 -19.360 2.560 2.945 1.00 0.00 H new ATOM 0 HB3 ASP A 852 -19.954 4.178 2.627 1.00 0.00 H new ATOM 1209 N SER A 853 -23.447 2.458 3.832 1.00 0.00 N ATOM 1210 CA SER A 853 -24.668 2.926 4.477 1.00 0.00 C ATOM 1211 C SER A 853 -24.361 3.551 5.835 1.00 0.00 C ATOM 1212 O SER A 853 -24.184 2.846 6.829 1.00 0.00 O ATOM 1213 CB SER A 853 -25.656 1.770 4.647 1.00 0.00 C ATOM 1214 OG SER A 853 -26.749 2.149 5.466 1.00 0.00 O ATOM 0 H SER A 853 -23.226 1.478 4.009 1.00 0.00 H new ATOM 0 HA SER A 853 -25.117 3.688 3.839 1.00 0.00 H new ATOM 0 HB2 SER A 853 -26.022 1.454 3.670 1.00 0.00 H new ATOM 0 HB3 SER A 853 -25.146 0.914 5.089 1.00 0.00 H new ATOM 0 HG SER A 853 -27.366 1.394 5.558 1.00 0.00 H new ATOM 1220 N SER A 854 -24.298 4.878 5.868 1.00 0.00 N ATOM 1221 CA SER A 854 -24.008 5.599 7.102 1.00 0.00 C ATOM 1222 C SER A 854 -24.718 6.949 7.122 1.00 0.00 C ATOM 1223 O SER A 854 -25.162 7.445 6.088 1.00 0.00 O ATOM 1224 CB SER A 854 -22.499 5.801 7.257 1.00 0.00 C ATOM 1225 OG SER A 854 -21.908 4.716 7.950 1.00 0.00 O ATOM 0 H SER A 854 -24.444 5.476 5.055 1.00 0.00 H new ATOM 0 HA SER A 854 -24.375 5.003 7.937 1.00 0.00 H new ATOM 0 HB2 SER A 854 -22.040 5.902 6.274 1.00 0.00 H new ATOM 0 HB3 SER A 854 -22.307 6.729 7.796 1.00 0.00 H new ATOM 0 HG SER A 854 -22.432 3.903 7.792 1.00 0.00 H new ATOM 1231 N GLY A 855 -24.822 7.539 8.310 1.00 0.00 N ATOM 1232 CA GLY A 855 -25.479 8.825 8.444 1.00 0.00 C ATOM 1233 C GLY A 855 -24.911 9.868 7.501 1.00 0.00 C ATOM 1234 O GLY A 855 -25.568 10.303 6.555 1.00 0.00 O ATOM 0 H GLY A 855 -24.463 7.148 9.181 1.00 0.00 H new ATOM 0 HA2 GLY A 855 -26.545 8.707 8.250 1.00 0.00 H new ATOM 0 HA3 GLY A 855 -25.379 9.175 9.471 1.00 0.00 H new ATOM 1238 N PRO A 856 -23.663 10.285 7.757 1.00 0.00 N ATOM 1239 CA PRO A 856 -22.980 11.289 6.935 1.00 0.00 C ATOM 1240 C PRO A 856 -22.624 10.759 5.550 1.00 0.00 C ATOM 1241 O PRO A 856 -21.700 9.961 5.398 1.00 0.00 O ATOM 1242 CB PRO A 856 -21.709 11.595 7.733 1.00 0.00 C ATOM 1243 CG PRO A 856 -21.464 10.368 8.540 1.00 0.00 C ATOM 1244 CD PRO A 856 -22.821 9.809 8.867 1.00 0.00 C ATOM 0 HA PRO A 856 -23.607 12.162 6.753 1.00 0.00 H new ATOM 0 HB2 PRO A 856 -20.869 11.809 7.072 1.00 0.00 H new ATOM 0 HB3 PRO A 856 -21.843 12.468 8.371 1.00 0.00 H new ATOM 0 HG2 PRO A 856 -20.869 9.646 7.981 1.00 0.00 H new ATOM 0 HG3 PRO A 856 -20.909 10.603 9.449 1.00 0.00 H new ATOM 0 HD2 PRO A 856 -22.805 8.720 8.921 1.00 0.00 H new ATOM 0 HD3 PRO A 856 -23.183 10.170 9.830 1.00 0.00 H new ATOM 1252 N SER A 857 -23.364 11.210 4.542 1.00 0.00 N ATOM 1253 CA SER A 857 -23.129 10.779 3.169 1.00 0.00 C ATOM 1254 C SER A 857 -22.569 11.923 2.328 1.00 0.00 C ATOM 1255 O SER A 857 -23.062 13.049 2.387 1.00 0.00 O ATOM 1256 CB SER A 857 -24.426 10.260 2.545 1.00 0.00 C ATOM 1257 OG SER A 857 -25.007 9.246 3.346 1.00 0.00 O ATOM 0 H SER A 857 -24.131 11.874 4.650 1.00 0.00 H new ATOM 0 HA SER A 857 -22.396 9.973 3.189 1.00 0.00 H new ATOM 0 HB2 SER A 857 -25.131 11.083 2.427 1.00 0.00 H new ATOM 0 HB3 SER A 857 -24.223 9.869 1.548 1.00 0.00 H new ATOM 0 HG SER A 857 -25.835 8.932 2.927 1.00 0.00 H new ATOM 1263 N SER A 858 -21.537 11.624 1.546 1.00 0.00 N ATOM 1264 CA SER A 858 -20.907 12.627 0.696 1.00 0.00 C ATOM 1265 C SER A 858 -20.681 12.083 -0.711 1.00 0.00 C ATOM 1266 O SER A 858 -19.629 12.298 -1.311 1.00 0.00 O ATOM 1267 CB SER A 858 -19.575 13.076 1.301 1.00 0.00 C ATOM 1268 OG SER A 858 -18.558 12.117 1.064 1.00 0.00 O ATOM 0 H SER A 858 -21.119 10.695 1.483 1.00 0.00 H new ATOM 0 HA SER A 858 -21.577 13.485 0.632 1.00 0.00 H new ATOM 0 HB2 SER A 858 -19.282 14.035 0.873 1.00 0.00 H new ATOM 0 HB3 SER A 858 -19.692 13.229 2.374 1.00 0.00 H new ATOM 0 HG SER A 858 -18.466 11.970 0.100 1.00 0.00 H new ATOM 1274 N GLY A 859 -21.679 11.376 -1.232 1.00 0.00 N ATOM 1275 CA GLY A 859 -21.571 10.811 -2.565 1.00 0.00 C ATOM 1276 C GLY A 859 -22.726 11.213 -3.460 1.00 0.00 C ATOM 1277 O GLY A 859 -23.817 10.651 -3.368 1.00 0.00 O ATOM 0 H GLY A 859 -22.560 11.184 -0.755 1.00 0.00 H new ATOM 0 HA2 GLY A 859 -20.634 11.135 -3.019 1.00 0.00 H new ATOM 0 HA3 GLY A 859 -21.532 9.724 -2.494 1.00 0.00 H new TER 1281 GLY A 859