USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 946 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 902 ASN : amide:sc= 0.105 K(o=0.27,f=-3.4!) USER MOD Set 1.2: A 906 GLN : amide:sc= 0.167 X(o=0.27,f=0.38) USER MOD Set 2.1: A 833 THR OG1 : rot 70:sc= 1.18 USER MOD Set 2.2: A 867 THR OG1 : rot 66:sc= -2.19! USER MOD Set 3.1: A 816 MET CE :methyl 139:sc= -0.279 (180deg=-1.13) USER MOD Set 3.2: A 822 MET CE :methyl 149:sc= -0.296 (180deg=-0.993) USER MOD Set 3.3: A 887 GLN : amide:sc= -2.58! C(o=-3.2!,f=-10!) USER MOD Single : A 786 THR OG1 : rot -51:sc= 0.228 USER MOD Single : A 788 HIS : no HD1:sc= -0.043 X(o=-0.043,f=-0.52) USER MOD Single : A 790 THR OG1 : rot 180:sc= 0 USER MOD Single : A 798 TYR OH : rot 65:sc= 0.811 USER MOD Single : A 800 GLN : amide:sc= -1.98! C(o=-2!,f=-4.1!) USER MOD Single : A 802 THR OG1 : rot 8:sc= -1.24 USER MOD Single : A 804 THR OG1 : rot 74:sc= 0.207 USER MOD Single : A 807 THR OG1 : rot 98:sc= 1.24 USER MOD Single : A 809 THR OG1 : rot 81:sc= 1.23 USER MOD Single : A 811 ASN : amide:sc= -0.0771 K(o=-0.077,f=-1.4!) USER MOD Single : A 814 SER OG : rot 75:sc= 0.24 USER MOD Single : A 815 SER OG : rot 92:sc= 1.21 USER MOD Single : A 825 GLN : amide:sc= -5.75! K(o=-5.8!,f=-1.3) USER MOD Single : A 831 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 834 SER OG : rot 62:sc= 1.3 USER MOD Single : A 838 ASN : amide:sc= 1.19 K(o=1.2,f=-0.1) USER MOD Single : A 841 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 848 SER OG : rot 180:sc= 0 USER MOD Single : A 852 ASN : amide:sc= 0.58 K(o=0.58,f=-0.76) USER MOD Single : A 853 SER OG : rot 68:sc= 1.35 USER MOD Single : A 855 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 858 SER OG : rot 71:sc= 0.83 USER MOD Single : A 861 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 869 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0307) USER MOD Single : A 870 MET CE :methyl 144:sc= -3.68! (180deg=-4.76) USER MOD Single : A 875 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 880 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 883 SER OG : rot 180:sc= -0.349 USER MOD Single : A 886 GLN : amide:sc= -1.8! K(o=-1.8!,f=-0.14) USER MOD Single : A 888 GLN : amide:sc= -0.0547 X(o=-0.055,f=-0.18) USER MOD Single : A 899 MET CE :methyl 138:sc= -0.188 (180deg=-1.32) USER MOD Single : A 901 THR OG1 : rot 73:sc= 0.57 USER MOD Single : A 907 ASN : amide:sc= 1.17 K(o=1.2,f=-0.024) USER MOD Single : A 910 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0688) USER MOD Single : A 911 LYS NZ :NH3+ -166:sc= 0.597 (180deg=0.468) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 781 13.769 -7.472 11.169 1.00 0.00 N ATOM 2 CA GLY A 781 12.496 -7.240 10.443 1.00 0.00 C ATOM 3 C GLY A 781 12.640 -7.435 8.946 1.00 0.00 C ATOM 4 O GLY A 781 11.816 -8.099 8.317 1.00 0.00 O ATOM 0 HA2 GLY A 781 11.735 -7.921 10.824 1.00 0.00 H new ATOM 0 HA3 GLY A 781 12.146 -6.227 10.643 1.00 0.00 H new ATOM 10 N ILE A 782 13.690 -6.869 8.364 1.00 0.00 N ATOM 11 CA ILE A 782 13.934 -7.006 6.933 1.00 0.00 C ATOM 12 C ILE A 782 14.772 -8.264 6.665 1.00 0.00 C ATOM 13 O ILE A 782 15.544 -8.344 5.708 1.00 0.00 O ATOM 14 CB ILE A 782 14.622 -5.731 6.367 1.00 0.00 C ATOM 15 CG1 ILE A 782 14.628 -5.739 4.834 1.00 0.00 C ATOM 16 CG2 ILE A 782 16.039 -5.583 6.905 1.00 0.00 C ATOM 17 CD1 ILE A 782 13.242 -5.761 4.219 1.00 0.00 C ATOM 0 H ILE A 782 14.386 -6.311 8.860 1.00 0.00 H new ATOM 0 HA ILE A 782 12.980 -7.116 6.418 1.00 0.00 H new ATOM 0 HB ILE A 782 14.041 -4.871 6.701 1.00 0.00 H new ATOM 0 HG12 ILE A 782 15.160 -4.857 4.477 1.00 0.00 H new ATOM 0 HG13 ILE A 782 15.184 -6.610 4.486 1.00 0.00 H new ATOM 0 HG21 ILE A 782 16.493 -4.683 6.491 1.00 0.00 H new ATOM 0 HG22 ILE A 782 16.009 -5.508 7.992 1.00 0.00 H new ATOM 0 HG23 ILE A 782 16.630 -6.453 6.618 1.00 0.00 H new ATOM 0 HD11 ILE A 782 13.326 -5.766 3.132 1.00 0.00 H new ATOM 0 HD12 ILE A 782 12.713 -6.656 4.546 1.00 0.00 H new ATOM 0 HD13 ILE A 782 12.689 -4.877 4.536 1.00 0.00 H new ATOM 29 N ASP A 783 14.583 -9.262 7.517 1.00 0.00 N ATOM 30 CA ASP A 783 15.326 -10.513 7.431 1.00 0.00 C ATOM 31 C ASP A 783 14.916 -11.303 6.193 1.00 0.00 C ATOM 32 O ASP A 783 13.725 -11.518 5.947 1.00 0.00 O ATOM 33 CB ASP A 783 15.078 -11.365 8.678 1.00 0.00 C ATOM 34 CG ASP A 783 15.439 -10.651 9.964 1.00 0.00 C ATOM 35 OD1 ASP A 783 14.590 -9.905 10.493 1.00 0.00 O ATOM 36 OD2 ASP A 783 16.580 -10.826 10.445 1.00 0.00 O ATOM 0 H ASP A 783 13.913 -9.228 8.285 1.00 0.00 H new ATOM 0 HA ASP A 783 16.386 -10.269 7.361 1.00 0.00 H new ATOM 0 HB2 ASP A 783 14.027 -11.653 8.711 1.00 0.00 H new ATOM 0 HB3 ASP A 783 15.658 -12.285 8.604 1.00 0.00 H new ATOM 41 N PRO A 784 15.901 -11.730 5.390 1.00 0.00 N ATOM 42 CA PRO A 784 15.670 -12.540 4.211 1.00 0.00 C ATOM 43 C PRO A 784 15.711 -14.034 4.527 1.00 0.00 C ATOM 44 O PRO A 784 16.787 -14.615 4.701 1.00 0.00 O ATOM 45 CB PRO A 784 16.830 -12.152 3.284 1.00 0.00 C ATOM 46 CG PRO A 784 17.831 -11.420 4.134 1.00 0.00 C ATOM 47 CD PRO A 784 17.325 -11.443 5.554 1.00 0.00 C ATOM 0 HA PRO A 784 14.686 -12.366 3.776 1.00 0.00 H new ATOM 0 HB2 PRO A 784 17.278 -13.037 2.833 1.00 0.00 H new ATOM 0 HB3 PRO A 784 16.479 -11.521 2.468 1.00 0.00 H new ATOM 0 HG2 PRO A 784 18.810 -11.895 4.068 1.00 0.00 H new ATOM 0 HG3 PRO A 784 17.951 -10.394 3.787 1.00 0.00 H new ATOM 0 HD2 PRO A 784 17.825 -12.208 6.149 1.00 0.00 H new ATOM 0 HD3 PRO A 784 17.490 -10.490 6.057 1.00 0.00 H new ATOM 55 N PHE A 785 14.541 -14.646 4.627 1.00 0.00 N ATOM 56 CA PHE A 785 14.443 -16.069 4.923 1.00 0.00 C ATOM 57 C PHE A 785 14.416 -16.874 3.632 1.00 0.00 C ATOM 58 O PHE A 785 14.016 -16.351 2.591 1.00 0.00 O ATOM 59 CB PHE A 785 13.192 -16.361 5.754 1.00 0.00 C ATOM 60 CG PHE A 785 13.207 -15.722 7.115 1.00 0.00 C ATOM 61 CD1 PHE A 785 13.831 -16.348 8.181 1.00 0.00 C ATOM 62 CD2 PHE A 785 12.595 -14.496 7.329 1.00 0.00 C ATOM 63 CE1 PHE A 785 13.844 -15.766 9.435 1.00 0.00 C ATOM 64 CE2 PHE A 785 12.605 -13.910 8.579 1.00 0.00 C ATOM 65 CZ PHE A 785 13.231 -14.546 9.634 1.00 0.00 C ATOM 0 H PHE A 785 13.642 -14.178 4.507 1.00 0.00 H new ATOM 0 HA PHE A 785 15.318 -16.362 5.503 1.00 0.00 H new ATOM 0 HB2 PHE A 785 12.315 -16.013 5.209 1.00 0.00 H new ATOM 0 HB3 PHE A 785 13.087 -17.440 5.870 1.00 0.00 H new ATOM 0 HD1 PHE A 785 14.313 -17.303 8.031 1.00 0.00 H new ATOM 0 HD2 PHE A 785 12.105 -13.994 6.508 1.00 0.00 H new ATOM 0 HE1 PHE A 785 14.333 -16.266 10.258 1.00 0.00 H new ATOM 0 HE2 PHE A 785 12.124 -12.955 8.732 1.00 0.00 H new ATOM 0 HZ PHE A 785 13.240 -14.089 10.613 1.00 0.00 H new ATOM 75 N THR A 786 14.866 -18.133 3.716 1.00 0.00 N ATOM 76 CA THR A 786 14.940 -19.062 2.577 1.00 0.00 C ATOM 77 C THR A 786 15.598 -18.402 1.356 1.00 0.00 C ATOM 78 O THR A 786 15.333 -18.764 0.208 1.00 0.00 O ATOM 79 CB THR A 786 13.547 -19.670 2.217 1.00 0.00 C ATOM 80 OG1 THR A 786 13.714 -20.818 1.373 1.00 0.00 O ATOM 81 CG2 THR A 786 12.627 -18.675 1.516 1.00 0.00 C ATOM 0 H THR A 786 15.194 -18.543 4.591 1.00 0.00 H new ATOM 0 HA THR A 786 15.575 -19.892 2.888 1.00 0.00 H new ATOM 0 HB THR A 786 13.079 -19.949 3.161 1.00 0.00 H new ATOM 0 HG1 THR A 786 14.298 -20.588 0.620 1.00 0.00 H new ATOM 0 HG21 THR A 786 11.675 -19.156 1.291 1.00 0.00 H new ATOM 0 HG22 THR A 786 12.456 -17.817 2.166 1.00 0.00 H new ATOM 0 HG23 THR A 786 13.092 -18.340 0.589 1.00 0.00 H new ATOM 89 N ALA A 787 16.513 -17.478 1.628 1.00 0.00 N ATOM 90 CA ALA A 787 17.177 -16.711 0.587 1.00 0.00 C ATOM 91 C ALA A 787 18.104 -17.582 -0.253 1.00 0.00 C ATOM 92 O ALA A 787 19.068 -18.162 0.258 1.00 0.00 O ATOM 93 CB ALA A 787 17.955 -15.560 1.206 1.00 0.00 C ATOM 0 H ALA A 787 16.813 -17.242 2.574 1.00 0.00 H new ATOM 0 HA ALA A 787 16.408 -16.314 -0.076 1.00 0.00 H new ATOM 0 HB1 ALA A 787 18.450 -14.990 0.419 1.00 0.00 H new ATOM 0 HB2 ALA A 787 17.270 -14.909 1.750 1.00 0.00 H new ATOM 0 HB3 ALA A 787 18.703 -15.955 1.893 1.00 0.00 H new ATOM 99 N HIS A 788 17.796 -17.683 -1.539 1.00 0.00 N ATOM 100 CA HIS A 788 18.662 -18.383 -2.478 1.00 0.00 C ATOM 101 C HIS A 788 19.929 -17.571 -2.711 1.00 0.00 C ATOM 102 O HIS A 788 19.863 -16.378 -2.998 1.00 0.00 O ATOM 103 CB HIS A 788 17.933 -18.663 -3.803 1.00 0.00 C ATOM 104 CG HIS A 788 17.358 -17.449 -4.479 1.00 0.00 C ATOM 105 ND1 HIS A 788 16.088 -16.980 -4.223 1.00 0.00 N ATOM 106 CD2 HIS A 788 17.875 -16.623 -5.422 1.00 0.00 C ATOM 107 CE1 HIS A 788 15.847 -15.922 -4.974 1.00 0.00 C ATOM 108 NE2 HIS A 788 16.914 -15.685 -5.710 1.00 0.00 N ATOM 0 H HIS A 788 16.953 -17.289 -1.956 1.00 0.00 H new ATOM 0 HA HIS A 788 18.936 -19.347 -2.049 1.00 0.00 H new ATOM 0 HB2 HIS A 788 18.629 -19.147 -4.488 1.00 0.00 H new ATOM 0 HB3 HIS A 788 17.127 -19.372 -3.614 1.00 0.00 H new ATOM 0 HD2 HIS A 788 18.858 -16.690 -5.864 1.00 0.00 H new ATOM 0 HE1 HIS A 788 14.932 -15.349 -4.984 1.00 0.00 H new ATOM 0 HE2 HIS A 788 17.011 -14.927 -6.385 1.00 0.00 H new ATOM 116 N ALA A 789 21.075 -18.223 -2.580 1.00 0.00 N ATOM 117 CA ALA A 789 22.358 -17.536 -2.630 1.00 0.00 C ATOM 118 C ALA A 789 22.636 -16.965 -4.016 1.00 0.00 C ATOM 119 O ALA A 789 22.211 -17.531 -5.028 1.00 0.00 O ATOM 120 CB ALA A 789 23.474 -18.476 -2.211 1.00 0.00 C ATOM 0 H ALA A 789 21.143 -19.231 -2.438 1.00 0.00 H new ATOM 0 HA ALA A 789 22.316 -16.700 -1.932 1.00 0.00 H new ATOM 0 HB1 ALA A 789 24.428 -17.950 -2.253 1.00 0.00 H new ATOM 0 HB2 ALA A 789 23.295 -18.822 -1.193 1.00 0.00 H new ATOM 0 HB3 ALA A 789 23.502 -19.332 -2.886 1.00 0.00 H new ATOM 126 N THR A 790 23.355 -15.844 -4.038 1.00 0.00 N ATOM 127 CA THR A 790 23.667 -15.131 -5.268 1.00 0.00 C ATOM 128 C THR A 790 22.402 -14.509 -5.850 1.00 0.00 C ATOM 129 O THR A 790 21.689 -15.127 -6.647 1.00 0.00 O ATOM 130 CB THR A 790 24.348 -16.045 -6.308 1.00 0.00 C ATOM 131 OG1 THR A 790 25.453 -16.726 -5.696 1.00 0.00 O ATOM 132 CG2 THR A 790 24.846 -15.240 -7.499 1.00 0.00 C ATOM 0 H THR A 790 23.737 -15.406 -3.199 1.00 0.00 H new ATOM 0 HA THR A 790 24.374 -14.339 -5.021 1.00 0.00 H new ATOM 0 HB THR A 790 23.614 -16.769 -6.663 1.00 0.00 H new ATOM 0 HG1 THR A 790 25.885 -17.308 -6.356 1.00 0.00 H new ATOM 0 HG21 THR A 790 25.322 -15.908 -8.217 1.00 0.00 H new ATOM 0 HG22 THR A 790 24.005 -14.736 -7.975 1.00 0.00 H new ATOM 0 HG23 THR A 790 25.569 -14.498 -7.160 1.00 0.00 H new ATOM 140 N GLY A 791 22.120 -13.288 -5.422 1.00 0.00 N ATOM 141 CA GLY A 791 20.885 -12.635 -5.791 1.00 0.00 C ATOM 142 C GLY A 791 19.872 -12.733 -4.673 1.00 0.00 C ATOM 143 O GLY A 791 18.670 -12.837 -4.914 1.00 0.00 O ATOM 0 H GLY A 791 22.731 -12.735 -4.821 1.00 0.00 H new ATOM 0 HA2 GLY A 791 21.077 -11.587 -6.023 1.00 0.00 H new ATOM 0 HA3 GLY A 791 20.482 -13.093 -6.694 1.00 0.00 H new ATOM 147 N ALA A 792 20.372 -12.709 -3.446 1.00 0.00 N ATOM 148 CA ALA A 792 19.538 -12.865 -2.267 1.00 0.00 C ATOM 149 C ALA A 792 19.246 -11.517 -1.623 1.00 0.00 C ATOM 150 O ALA A 792 19.613 -10.465 -2.156 1.00 0.00 O ATOM 151 CB ALA A 792 20.219 -13.790 -1.268 1.00 0.00 C ATOM 0 H ALA A 792 21.363 -12.581 -3.242 1.00 0.00 H new ATOM 0 HA ALA A 792 18.589 -13.306 -2.573 1.00 0.00 H new ATOM 0 HB1 ALA A 792 19.587 -13.902 -0.387 1.00 0.00 H new ATOM 0 HB2 ALA A 792 20.379 -14.766 -1.726 1.00 0.00 H new ATOM 0 HB3 ALA A 792 21.179 -13.365 -0.975 1.00 0.00 H new ATOM 157 N GLY A 793 18.583 -11.555 -0.477 1.00 0.00 N ATOM 158 CA GLY A 793 18.265 -10.339 0.237 1.00 0.00 C ATOM 159 C GLY A 793 16.837 -9.909 -0.001 1.00 0.00 C ATOM 160 O GLY A 793 16.036 -10.688 -0.522 1.00 0.00 O ATOM 0 H GLY A 793 18.259 -12.412 -0.028 1.00 0.00 H new ATOM 0 HA2 GLY A 793 18.426 -10.491 1.304 1.00 0.00 H new ATOM 0 HA3 GLY A 793 18.942 -9.545 -0.078 1.00 0.00 H new ATOM 164 N PRO A 794 16.477 -8.681 0.381 1.00 0.00 N ATOM 165 CA PRO A 794 15.142 -8.144 0.141 1.00 0.00 C ATOM 166 C PRO A 794 14.889 -7.945 -1.348 1.00 0.00 C ATOM 167 O PRO A 794 15.668 -7.275 -2.026 1.00 0.00 O ATOM 168 CB PRO A 794 15.145 -6.791 0.868 1.00 0.00 C ATOM 169 CG PRO A 794 16.349 -6.814 1.749 1.00 0.00 C ATOM 170 CD PRO A 794 17.339 -7.716 1.073 1.00 0.00 C ATOM 0 HA PRO A 794 14.359 -8.815 0.495 1.00 0.00 H new ATOM 0 HB2 PRO A 794 15.193 -5.965 0.159 1.00 0.00 H new ATOM 0 HB3 PRO A 794 14.234 -6.657 1.452 1.00 0.00 H new ATOM 0 HG2 PRO A 794 16.758 -5.812 1.877 1.00 0.00 H new ATOM 0 HG3 PRO A 794 16.098 -7.185 2.743 1.00 0.00 H new ATOM 0 HD2 PRO A 794 17.975 -7.169 0.377 1.00 0.00 H new ATOM 0 HD3 PRO A 794 17.998 -8.204 1.791 1.00 0.00 H new ATOM 178 N ALA A 795 13.816 -8.547 -1.852 1.00 0.00 N ATOM 179 CA ALA A 795 13.447 -8.403 -3.256 1.00 0.00 C ATOM 180 C ALA A 795 13.254 -6.933 -3.595 1.00 0.00 C ATOM 181 O ALA A 795 12.335 -6.286 -3.087 1.00 0.00 O ATOM 182 CB ALA A 795 12.187 -9.197 -3.564 1.00 0.00 C ATOM 0 H ALA A 795 13.187 -9.139 -1.309 1.00 0.00 H new ATOM 0 HA ALA A 795 14.253 -8.800 -3.873 1.00 0.00 H new ATOM 0 HB1 ALA A 795 11.929 -9.076 -4.616 1.00 0.00 H new ATOM 0 HB2 ALA A 795 12.361 -10.252 -3.352 1.00 0.00 H new ATOM 0 HB3 ALA A 795 11.367 -8.833 -2.945 1.00 0.00 H new ATOM 188 N GLY A 796 14.138 -6.411 -4.435 1.00 0.00 N ATOM 189 CA GLY A 796 14.145 -4.993 -4.711 1.00 0.00 C ATOM 190 C GLY A 796 14.545 -4.216 -3.477 1.00 0.00 C ATOM 191 O GLY A 796 15.703 -4.253 -3.067 1.00 0.00 O ATOM 0 H GLY A 796 14.851 -6.948 -4.930 1.00 0.00 H new ATOM 0 HA2 GLY A 796 14.838 -4.778 -5.524 1.00 0.00 H new ATOM 0 HA3 GLY A 796 13.156 -4.676 -5.043 1.00 0.00 H new ATOM 195 N ARG A 797 13.591 -3.529 -2.879 1.00 0.00 N ATOM 196 CA ARG A 797 13.818 -2.888 -1.593 1.00 0.00 C ATOM 197 C ARG A 797 12.498 -2.718 -0.847 1.00 0.00 C ATOM 198 O ARG A 797 12.361 -3.156 0.297 1.00 0.00 O ATOM 199 CB ARG A 797 14.521 -1.539 -1.762 1.00 0.00 C ATOM 200 CG ARG A 797 14.977 -0.942 -0.443 1.00 0.00 C ATOM 201 CD ARG A 797 15.757 0.344 -0.637 1.00 0.00 C ATOM 202 NE ARG A 797 16.028 1.000 0.642 1.00 0.00 N ATOM 203 CZ ARG A 797 16.729 2.121 0.775 1.00 0.00 C ATOM 204 NH1 ARG A 797 17.326 2.668 -0.273 1.00 0.00 N ATOM 205 NH2 ARG A 797 16.868 2.672 1.972 1.00 0.00 N ATOM 0 H ARG A 797 12.654 -3.399 -3.259 1.00 0.00 H new ATOM 0 HA ARG A 797 14.472 -3.531 -1.004 1.00 0.00 H new ATOM 0 HB2 ARG A 797 15.384 -1.664 -2.416 1.00 0.00 H new ATOM 0 HB3 ARG A 797 13.845 -0.842 -2.256 1.00 0.00 H new ATOM 0 HG2 ARG A 797 14.108 -0.747 0.186 1.00 0.00 H new ATOM 0 HG3 ARG A 797 15.597 -1.665 0.086 1.00 0.00 H new ATOM 0 HD2 ARG A 797 16.698 0.128 -1.144 1.00 0.00 H new ATOM 0 HD3 ARG A 797 15.195 1.019 -1.282 1.00 0.00 H new ATOM 0 HE ARG A 797 15.654 0.569 1.487 1.00 0.00 H new ATOM 0 HH11 ARG A 797 17.249 2.229 -1.190 1.00 0.00 H new ATOM 0 HH12 ARG A 797 17.862 3.529 -0.163 1.00 0.00 H new ATOM 0 HH21 ARG A 797 16.438 2.236 2.787 1.00 0.00 H new ATOM 0 HH22 ARG A 797 17.405 3.532 2.078 1.00 0.00 H new ATOM 219 N TYR A 798 11.527 -2.090 -1.499 1.00 0.00 N ATOM 220 CA TYR A 798 10.201 -1.900 -0.910 1.00 0.00 C ATOM 221 C TYR A 798 9.214 -2.848 -1.570 1.00 0.00 C ATOM 222 O TYR A 798 8.038 -2.898 -1.208 1.00 0.00 O ATOM 223 CB TYR A 798 9.712 -0.456 -1.100 1.00 0.00 C ATOM 224 CG TYR A 798 10.448 0.593 -0.284 1.00 0.00 C ATOM 225 CD1 TYR A 798 11.794 0.433 0.022 1.00 0.00 C ATOM 226 CD2 TYR A 798 9.804 1.727 0.189 1.00 0.00 C ATOM 227 CE1 TYR A 798 12.473 1.373 0.772 1.00 0.00 C ATOM 228 CE2 TYR A 798 10.476 2.672 0.938 1.00 0.00 C ATOM 229 CZ TYR A 798 11.781 2.537 1.191 1.00 0.00 C ATOM 230 OH TYR A 798 12.481 3.432 1.962 1.00 0.00 O ATOM 0 H TYR A 798 11.630 -1.702 -2.437 1.00 0.00 H new ATOM 0 HA TYR A 798 10.270 -2.107 0.158 1.00 0.00 H new ATOM 0 HB2 TYR A 798 9.798 -0.197 -2.155 1.00 0.00 H new ATOM 0 HB3 TYR A 798 8.653 -0.412 -0.846 1.00 0.00 H new ATOM 0 HD1 TYR A 798 12.318 -0.442 -0.333 1.00 0.00 H new ATOM 0 HD2 TYR A 798 8.757 1.873 -0.033 1.00 0.00 H new ATOM 0 HE1 TYR A 798 13.510 1.224 1.034 1.00 0.00 H new ATOM 0 HE2 TYR A 798 9.942 3.528 1.323 1.00 0.00 H new ATOM 0 HH TYR A 798 13.215 3.813 1.436 1.00 0.00 H new ATOM 240 N ASP A 799 9.725 -3.616 -2.521 1.00 0.00 N ATOM 241 CA ASP A 799 8.898 -4.423 -3.406 1.00 0.00 C ATOM 242 C ASP A 799 8.219 -5.566 -2.668 1.00 0.00 C ATOM 243 O ASP A 799 7.125 -5.978 -3.042 1.00 0.00 O ATOM 244 CB ASP A 799 9.748 -4.968 -4.554 1.00 0.00 C ATOM 245 CG ASP A 799 10.473 -3.866 -5.301 1.00 0.00 C ATOM 246 OD1 ASP A 799 11.528 -3.401 -4.817 1.00 0.00 O ATOM 247 OD2 ASP A 799 9.996 -3.466 -6.390 1.00 0.00 O ATOM 0 H ASP A 799 10.726 -3.697 -2.701 1.00 0.00 H new ATOM 0 HA ASP A 799 8.112 -3.781 -3.803 1.00 0.00 H new ATOM 0 HB2 ASP A 799 10.476 -5.678 -4.160 1.00 0.00 H new ATOM 0 HB3 ASP A 799 9.111 -5.517 -5.247 1.00 0.00 H new ATOM 252 N GLN A 800 8.852 -6.074 -1.619 1.00 0.00 N ATOM 253 CA GLN A 800 8.247 -7.136 -0.822 1.00 0.00 C ATOM 254 C GLN A 800 7.072 -6.599 -0.017 1.00 0.00 C ATOM 255 O GLN A 800 6.037 -7.256 0.105 1.00 0.00 O ATOM 256 CB GLN A 800 9.270 -7.777 0.115 1.00 0.00 C ATOM 257 CG GLN A 800 10.319 -8.603 -0.602 1.00 0.00 C ATOM 258 CD GLN A 800 11.244 -9.327 0.354 1.00 0.00 C ATOM 259 OE1 GLN A 800 12.278 -8.801 0.750 1.00 0.00 O ATOM 260 NE2 GLN A 800 10.875 -10.537 0.734 1.00 0.00 N ATOM 0 H GLN A 800 9.774 -5.773 -1.302 1.00 0.00 H new ATOM 0 HA GLN A 800 7.886 -7.900 -1.511 1.00 0.00 H new ATOM 0 HB2 GLN A 800 9.766 -6.993 0.688 1.00 0.00 H new ATOM 0 HB3 GLN A 800 8.747 -8.412 0.830 1.00 0.00 H new ATOM 0 HG2 GLN A 800 9.825 -9.331 -1.245 1.00 0.00 H new ATOM 0 HG3 GLN A 800 10.908 -7.953 -1.249 1.00 0.00 H new ATOM 0 HE21 GLN A 800 10.007 -10.940 0.382 1.00 0.00 H new ATOM 0 HE22 GLN A 800 11.458 -11.069 1.380 1.00 0.00 H new ATOM 269 N ALA A 801 7.236 -5.399 0.522 1.00 0.00 N ATOM 270 CA ALA A 801 6.183 -4.762 1.296 1.00 0.00 C ATOM 271 C ALA A 801 5.010 -4.383 0.399 1.00 0.00 C ATOM 272 O ALA A 801 3.848 -4.595 0.752 1.00 0.00 O ATOM 273 CB ALA A 801 6.726 -3.535 2.015 1.00 0.00 C ATOM 0 H ALA A 801 8.090 -4.847 0.437 1.00 0.00 H new ATOM 0 HA ALA A 801 5.825 -5.471 2.042 1.00 0.00 H new ATOM 0 HB1 ALA A 801 5.927 -3.068 2.591 1.00 0.00 H new ATOM 0 HB2 ALA A 801 7.531 -3.833 2.687 1.00 0.00 H new ATOM 0 HB3 ALA A 801 7.109 -2.824 1.283 1.00 0.00 H new ATOM 279 N THR A 802 5.319 -3.838 -0.773 1.00 0.00 N ATOM 280 CA THR A 802 4.292 -3.456 -1.724 1.00 0.00 C ATOM 281 C THR A 802 3.602 -4.686 -2.305 1.00 0.00 C ATOM 282 O THR A 802 2.401 -4.665 -2.554 1.00 0.00 O ATOM 283 CB THR A 802 4.869 -2.594 -2.860 1.00 0.00 C ATOM 284 OG1 THR A 802 6.040 -3.213 -3.400 1.00 0.00 O ATOM 285 CG2 THR A 802 5.213 -1.201 -2.356 1.00 0.00 C ATOM 0 H THR A 802 6.273 -3.653 -1.083 1.00 0.00 H new ATOM 0 HA THR A 802 3.556 -2.862 -1.183 1.00 0.00 H new ATOM 0 HB THR A 802 4.114 -2.507 -3.641 1.00 0.00 H new ATOM 0 HG1 THR A 802 6.144 -4.108 -3.015 1.00 0.00 H new ATOM 0 HG21 THR A 802 5.620 -0.608 -3.175 1.00 0.00 H new ATOM 0 HG22 THR A 802 4.313 -0.721 -1.972 1.00 0.00 H new ATOM 0 HG23 THR A 802 5.953 -1.275 -1.559 1.00 0.00 H new ATOM 293 N ASP A 803 4.372 -5.756 -2.505 1.00 0.00 N ATOM 294 CA ASP A 803 3.829 -7.030 -2.982 1.00 0.00 C ATOM 295 C ASP A 803 2.691 -7.505 -2.090 1.00 0.00 C ATOM 296 O ASP A 803 1.634 -7.916 -2.576 1.00 0.00 O ATOM 297 CB ASP A 803 4.929 -8.095 -3.031 1.00 0.00 C ATOM 298 CG ASP A 803 4.385 -9.499 -3.221 1.00 0.00 C ATOM 299 OD1 ASP A 803 3.786 -9.768 -4.284 1.00 0.00 O ATOM 300 OD2 ASP A 803 4.540 -10.335 -2.307 1.00 0.00 O ATOM 0 H ASP A 803 5.379 -5.766 -2.343 1.00 0.00 H new ATOM 0 HA ASP A 803 3.439 -6.873 -3.988 1.00 0.00 H new ATOM 0 HB2 ASP A 803 5.615 -7.864 -3.846 1.00 0.00 H new ATOM 0 HB3 ASP A 803 5.506 -8.057 -2.107 1.00 0.00 H new ATOM 305 N THR A 804 2.908 -7.431 -0.784 1.00 0.00 N ATOM 306 CA THR A 804 1.891 -7.808 0.182 1.00 0.00 C ATOM 307 C THR A 804 0.634 -6.958 0.002 1.00 0.00 C ATOM 308 O THR A 804 -0.460 -7.488 -0.191 1.00 0.00 O ATOM 309 CB THR A 804 2.420 -7.655 1.622 1.00 0.00 C ATOM 310 OG1 THR A 804 3.686 -8.318 1.745 1.00 0.00 O ATOM 311 CG2 THR A 804 1.439 -8.238 2.630 1.00 0.00 C ATOM 0 H THR A 804 3.784 -7.112 -0.370 1.00 0.00 H new ATOM 0 HA THR A 804 1.639 -8.854 0.009 1.00 0.00 H new ATOM 0 HB THR A 804 2.538 -6.592 1.832 1.00 0.00 H new ATOM 0 HG1 THR A 804 4.378 -7.788 1.297 1.00 0.00 H new ATOM 0 HG21 THR A 804 1.837 -8.117 3.637 1.00 0.00 H new ATOM 0 HG22 THR A 804 0.485 -7.717 2.552 1.00 0.00 H new ATOM 0 HG23 THR A 804 1.292 -9.298 2.423 1.00 0.00 H new ATOM 319 N ILE A 805 0.803 -5.639 0.029 1.00 0.00 N ATOM 320 CA ILE A 805 -0.318 -4.714 -0.105 1.00 0.00 C ATOM 321 C ILE A 805 -1.032 -4.902 -1.446 1.00 0.00 C ATOM 322 O ILE A 805 -2.255 -5.028 -1.492 1.00 0.00 O ATOM 323 CB ILE A 805 0.143 -3.246 0.034 1.00 0.00 C ATOM 324 CG1 ILE A 805 0.725 -2.994 1.429 1.00 0.00 C ATOM 325 CG2 ILE A 805 -1.013 -2.297 -0.244 1.00 0.00 C ATOM 326 CD1 ILE A 805 1.268 -1.596 1.620 1.00 0.00 C ATOM 0 H ILE A 805 1.709 -5.185 0.143 1.00 0.00 H new ATOM 0 HA ILE A 805 -1.015 -4.939 0.702 1.00 0.00 H new ATOM 0 HB ILE A 805 0.926 -3.059 -0.701 1.00 0.00 H new ATOM 0 HG12 ILE A 805 -0.049 -3.178 2.174 1.00 0.00 H new ATOM 0 HG13 ILE A 805 1.523 -3.712 1.615 1.00 0.00 H new ATOM 0 HG21 ILE A 805 -0.671 -1.267 -0.142 1.00 0.00 H new ATOM 0 HG22 ILE A 805 -1.381 -2.458 -1.257 1.00 0.00 H new ATOM 0 HG23 ILE A 805 -1.817 -2.485 0.468 1.00 0.00 H new ATOM 0 HD11 ILE A 805 1.662 -1.494 2.631 1.00 0.00 H new ATOM 0 HD12 ILE A 805 2.065 -1.414 0.899 1.00 0.00 H new ATOM 0 HD13 ILE A 805 0.468 -0.871 1.468 1.00 0.00 H new ATOM 338 N LEU A 806 -0.256 -4.937 -2.523 1.00 0.00 N ATOM 339 CA LEU A 806 -0.799 -5.105 -3.872 1.00 0.00 C ATOM 340 C LEU A 806 -1.680 -6.351 -3.960 1.00 0.00 C ATOM 341 O LEU A 806 -2.810 -6.292 -4.449 1.00 0.00 O ATOM 342 CB LEU A 806 0.345 -5.194 -4.890 1.00 0.00 C ATOM 343 CG LEU A 806 0.717 -3.880 -5.591 1.00 0.00 C ATOM 344 CD1 LEU A 806 0.735 -2.717 -4.615 1.00 0.00 C ATOM 345 CD2 LEU A 806 2.075 -4.009 -6.262 1.00 0.00 C ATOM 0 H LEU A 806 0.760 -4.851 -2.490 1.00 0.00 H new ATOM 0 HA LEU A 806 -1.417 -4.237 -4.101 1.00 0.00 H new ATOM 0 HB2 LEU A 806 1.230 -5.576 -4.382 1.00 0.00 H new ATOM 0 HB3 LEU A 806 0.074 -5.926 -5.651 1.00 0.00 H new ATOM 0 HG LEU A 806 -0.043 -3.679 -6.346 1.00 0.00 H new ATOM 0 HD11 LEU A 806 1.002 -1.802 -5.144 1.00 0.00 H new ATOM 0 HD12 LEU A 806 -0.252 -2.602 -4.167 1.00 0.00 H new ATOM 0 HD13 LEU A 806 1.468 -2.910 -3.832 1.00 0.00 H new ATOM 0 HD21 LEU A 806 2.328 -3.071 -6.756 1.00 0.00 H new ATOM 0 HD22 LEU A 806 2.831 -4.239 -5.512 1.00 0.00 H new ATOM 0 HD23 LEU A 806 2.041 -4.810 -7.001 1.00 0.00 H new ATOM 357 N THR A 807 -1.166 -7.464 -3.451 1.00 0.00 N ATOM 358 CA THR A 807 -1.873 -8.737 -3.516 1.00 0.00 C ATOM 359 C THR A 807 -3.117 -8.733 -2.626 1.00 0.00 C ATOM 360 O THR A 807 -4.192 -9.157 -3.048 1.00 0.00 O ATOM 361 CB THR A 807 -0.947 -9.900 -3.108 1.00 0.00 C ATOM 362 OG1 THR A 807 0.273 -9.827 -3.863 1.00 0.00 O ATOM 363 CG2 THR A 807 -1.616 -11.245 -3.358 1.00 0.00 C ATOM 0 H THR A 807 -0.259 -7.511 -2.987 1.00 0.00 H new ATOM 0 HA THR A 807 -2.189 -8.878 -4.550 1.00 0.00 H new ATOM 0 HB THR A 807 -0.734 -9.813 -2.043 1.00 0.00 H new ATOM 0 HG1 THR A 807 0.965 -9.388 -3.325 1.00 0.00 H new ATOM 0 HG21 THR A 807 -0.941 -12.048 -3.062 1.00 0.00 H new ATOM 0 HG22 THR A 807 -2.534 -11.309 -2.774 1.00 0.00 H new ATOM 0 HG23 THR A 807 -1.852 -11.342 -4.418 1.00 0.00 H new ATOM 371 N VAL A 808 -2.979 -8.237 -1.403 1.00 0.00 N ATOM 372 CA VAL A 808 -4.111 -8.174 -0.485 1.00 0.00 C ATOM 373 C VAL A 808 -5.212 -7.277 -1.051 1.00 0.00 C ATOM 374 O VAL A 808 -6.399 -7.554 -0.887 1.00 0.00 O ATOM 375 CB VAL A 808 -3.684 -7.672 0.914 1.00 0.00 C ATOM 376 CG1 VAL A 808 -4.892 -7.483 1.820 1.00 0.00 C ATOM 377 CG2 VAL A 808 -2.699 -8.641 1.549 1.00 0.00 C ATOM 0 H VAL A 808 -2.103 -7.875 -1.025 1.00 0.00 H new ATOM 0 HA VAL A 808 -4.498 -9.187 -0.374 1.00 0.00 H new ATOM 0 HB VAL A 808 -3.197 -6.705 0.789 1.00 0.00 H new ATOM 0 HG11 VAL A 808 -4.562 -7.130 2.797 1.00 0.00 H new ATOM 0 HG12 VAL A 808 -5.567 -6.750 1.378 1.00 0.00 H new ATOM 0 HG13 VAL A 808 -5.413 -8.434 1.935 1.00 0.00 H new ATOM 0 HG21 VAL A 808 -2.409 -8.272 2.533 1.00 0.00 H new ATOM 0 HG22 VAL A 808 -3.167 -9.620 1.652 1.00 0.00 H new ATOM 0 HG23 VAL A 808 -1.814 -8.726 0.918 1.00 0.00 H new ATOM 387 N THR A 809 -4.807 -6.223 -1.748 1.00 0.00 N ATOM 388 CA THR A 809 -5.754 -5.299 -2.346 1.00 0.00 C ATOM 389 C THR A 809 -6.550 -5.952 -3.472 1.00 0.00 C ATOM 390 O THR A 809 -7.776 -5.851 -3.513 1.00 0.00 O ATOM 391 CB THR A 809 -5.052 -4.057 -2.908 1.00 0.00 C ATOM 392 OG1 THR A 809 -4.333 -3.383 -1.872 1.00 0.00 O ATOM 393 CG2 THR A 809 -6.072 -3.123 -3.528 1.00 0.00 C ATOM 0 H THR A 809 -3.828 -5.989 -1.912 1.00 0.00 H new ATOM 0 HA THR A 809 -6.434 -5.005 -1.546 1.00 0.00 H new ATOM 0 HB THR A 809 -4.345 -4.370 -3.676 1.00 0.00 H new ATOM 0 HG1 THR A 809 -3.472 -3.829 -1.728 1.00 0.00 H new ATOM 0 HG21 THR A 809 -5.566 -2.243 -3.925 1.00 0.00 H new ATOM 0 HG22 THR A 809 -6.593 -3.637 -4.336 1.00 0.00 H new ATOM 0 HG23 THR A 809 -6.792 -2.816 -2.770 1.00 0.00 H new ATOM 401 N GLU A 810 -5.863 -6.615 -4.392 1.00 0.00 N ATOM 402 CA GLU A 810 -6.550 -7.277 -5.491 1.00 0.00 C ATOM 403 C GLU A 810 -7.438 -8.393 -4.948 1.00 0.00 C ATOM 404 O GLU A 810 -8.443 -8.757 -5.556 1.00 0.00 O ATOM 405 CB GLU A 810 -5.563 -7.808 -6.536 1.00 0.00 C ATOM 406 CG GLU A 810 -4.581 -8.837 -6.010 1.00 0.00 C ATOM 407 CD GLU A 810 -3.656 -9.354 -7.092 1.00 0.00 C ATOM 408 OE1 GLU A 810 -4.073 -10.251 -7.852 1.00 0.00 O ATOM 409 OE2 GLU A 810 -2.513 -8.857 -7.193 1.00 0.00 O ATOM 0 H GLU A 810 -4.847 -6.708 -4.400 1.00 0.00 H new ATOM 0 HA GLU A 810 -7.179 -6.544 -5.996 1.00 0.00 H new ATOM 0 HB2 GLU A 810 -6.127 -8.250 -7.358 1.00 0.00 H new ATOM 0 HB3 GLU A 810 -5.003 -6.968 -6.948 1.00 0.00 H new ATOM 0 HG2 GLU A 810 -3.988 -8.394 -5.209 1.00 0.00 H new ATOM 0 HG3 GLU A 810 -5.131 -9.672 -5.576 1.00 0.00 H new ATOM 416 N ASN A 811 -7.068 -8.912 -3.780 1.00 0.00 N ATOM 417 CA ASN A 811 -7.865 -9.928 -3.112 1.00 0.00 C ATOM 418 C ASN A 811 -9.168 -9.355 -2.568 1.00 0.00 C ATOM 419 O ASN A 811 -10.121 -10.095 -2.345 1.00 0.00 O ATOM 420 CB ASN A 811 -7.081 -10.606 -1.981 1.00 0.00 C ATOM 421 CG ASN A 811 -6.097 -11.648 -2.486 1.00 0.00 C ATOM 422 OD1 ASN A 811 -6.316 -12.280 -3.518 1.00 0.00 O ATOM 423 ND2 ASN A 811 -5.012 -11.846 -1.753 1.00 0.00 N ATOM 0 H ASN A 811 -6.221 -8.643 -3.279 1.00 0.00 H new ATOM 0 HA ASN A 811 -8.107 -10.678 -3.865 1.00 0.00 H new ATOM 0 HB2 ASN A 811 -6.541 -9.847 -1.415 1.00 0.00 H new ATOM 0 HB3 ASN A 811 -7.782 -11.079 -1.293 1.00 0.00 H new ATOM 0 HD21 ASN A 811 -4.324 -12.542 -2.039 1.00 0.00 H new ATOM 0 HD22 ASN A 811 -4.865 -11.302 -0.903 1.00 0.00 H new ATOM 430 N ILE A 812 -9.217 -8.040 -2.359 1.00 0.00 N ATOM 431 CA ILE A 812 -10.446 -7.388 -1.904 1.00 0.00 C ATOM 432 C ILE A 812 -11.548 -7.606 -2.925 1.00 0.00 C ATOM 433 O ILE A 812 -12.653 -8.032 -2.591 1.00 0.00 O ATOM 434 CB ILE A 812 -10.277 -5.864 -1.723 1.00 0.00 C ATOM 435 CG1 ILE A 812 -9.070 -5.544 -0.840 1.00 0.00 C ATOM 436 CG2 ILE A 812 -11.545 -5.253 -1.136 1.00 0.00 C ATOM 437 CD1 ILE A 812 -9.247 -5.906 0.609 1.00 0.00 C ATOM 0 H ILE A 812 -8.427 -7.409 -2.496 1.00 0.00 H new ATOM 0 HA ILE A 812 -10.694 -7.831 -0.940 1.00 0.00 H new ATOM 0 HB ILE A 812 -10.101 -5.426 -2.705 1.00 0.00 H new ATOM 0 HG12 ILE A 812 -8.200 -6.072 -1.230 1.00 0.00 H new ATOM 0 HG13 ILE A 812 -8.855 -4.478 -0.912 1.00 0.00 H new ATOM 0 HG21 ILE A 812 -11.409 -4.178 -1.015 1.00 0.00 H new ATOM 0 HG22 ILE A 812 -12.383 -5.439 -1.808 1.00 0.00 H new ATOM 0 HG23 ILE A 812 -11.751 -5.704 -0.165 1.00 0.00 H new ATOM 0 HD11 ILE A 812 -8.345 -5.645 1.162 1.00 0.00 H new ATOM 0 HD12 ILE A 812 -10.095 -5.358 1.020 1.00 0.00 H new ATOM 0 HD13 ILE A 812 -9.430 -6.977 0.697 1.00 0.00 H new ATOM 449 N PHE A 813 -11.216 -7.326 -4.181 1.00 0.00 N ATOM 450 CA PHE A 813 -12.158 -7.446 -5.282 1.00 0.00 C ATOM 451 C PHE A 813 -12.585 -8.898 -5.470 1.00 0.00 C ATOM 452 O PHE A 813 -13.695 -9.178 -5.919 1.00 0.00 O ATOM 453 CB PHE A 813 -11.537 -6.884 -6.566 1.00 0.00 C ATOM 454 CG PHE A 813 -11.327 -5.396 -6.509 1.00 0.00 C ATOM 455 CD1 PHE A 813 -10.309 -4.857 -5.738 1.00 0.00 C ATOM 456 CD2 PHE A 813 -12.137 -4.536 -7.237 1.00 0.00 C ATOM 457 CE1 PHE A 813 -10.103 -3.490 -5.694 1.00 0.00 C ATOM 458 CE2 PHE A 813 -11.933 -3.172 -7.199 1.00 0.00 C ATOM 459 CZ PHE A 813 -10.960 -2.643 -6.384 1.00 0.00 C ATOM 0 H PHE A 813 -10.288 -7.010 -4.461 1.00 0.00 H new ATOM 0 HA PHE A 813 -13.050 -6.866 -5.047 1.00 0.00 H new ATOM 0 HB2 PHE A 813 -10.581 -7.375 -6.746 1.00 0.00 H new ATOM 0 HB3 PHE A 813 -12.182 -7.123 -7.411 1.00 0.00 H new ATOM 0 HD1 PHE A 813 -9.669 -5.512 -5.165 1.00 0.00 H new ATOM 0 HD2 PHE A 813 -12.937 -4.939 -7.841 1.00 0.00 H new ATOM 0 HE1 PHE A 813 -9.280 -3.083 -5.126 1.00 0.00 H new ATOM 0 HE2 PHE A 813 -12.538 -2.519 -7.810 1.00 0.00 H new ATOM 0 HZ PHE A 813 -10.863 -1.572 -6.281 1.00 0.00 H new ATOM 469 N SER A 814 -11.703 -9.815 -5.100 1.00 0.00 N ATOM 470 CA SER A 814 -12.000 -11.237 -5.164 1.00 0.00 C ATOM 471 C SER A 814 -12.881 -11.660 -3.986 1.00 0.00 C ATOM 472 O SER A 814 -13.712 -12.562 -4.109 1.00 0.00 O ATOM 473 CB SER A 814 -10.692 -12.028 -5.165 1.00 0.00 C ATOM 474 OG SER A 814 -9.780 -11.485 -6.104 1.00 0.00 O ATOM 0 H SER A 814 -10.770 -9.597 -4.750 1.00 0.00 H new ATOM 0 HA SER A 814 -12.548 -11.445 -6.083 1.00 0.00 H new ATOM 0 HB2 SER A 814 -10.250 -12.011 -4.169 1.00 0.00 H new ATOM 0 HB3 SER A 814 -10.892 -13.072 -5.407 1.00 0.00 H new ATOM 0 HG SER A 814 -9.403 -10.652 -5.750 1.00 0.00 H new ATOM 480 N SER A 815 -12.704 -10.995 -2.849 1.00 0.00 N ATOM 481 CA SER A 815 -13.444 -11.327 -1.639 1.00 0.00 C ATOM 482 C SER A 815 -14.827 -10.678 -1.633 1.00 0.00 C ATOM 483 O SER A 815 -15.669 -11.013 -0.799 1.00 0.00 O ATOM 484 CB SER A 815 -12.657 -10.890 -0.402 1.00 0.00 C ATOM 485 OG SER A 815 -11.357 -11.456 -0.400 1.00 0.00 O ATOM 0 H SER A 815 -12.051 -10.219 -2.741 1.00 0.00 H new ATOM 0 HA SER A 815 -13.579 -12.408 -1.618 1.00 0.00 H new ATOM 0 HB2 SER A 815 -12.584 -9.803 -0.379 1.00 0.00 H new ATOM 0 HB3 SER A 815 -13.191 -11.193 0.499 1.00 0.00 H new ATOM 0 HG SER A 815 -10.732 -10.841 -0.837 1.00 0.00 H new ATOM 491 N MET A 816 -15.051 -9.752 -2.565 1.00 0.00 N ATOM 492 CA MET A 816 -16.323 -9.037 -2.661 1.00 0.00 C ATOM 493 C MET A 816 -17.496 -10.001 -2.687 1.00 0.00 C ATOM 494 O MET A 816 -17.597 -10.864 -3.563 1.00 0.00 O ATOM 495 CB MET A 816 -16.339 -8.144 -3.893 1.00 0.00 C ATOM 496 CG MET A 816 -15.351 -7.000 -3.804 1.00 0.00 C ATOM 497 SD MET A 816 -15.454 -5.890 -5.215 1.00 0.00 S ATOM 498 CE MET A 816 -17.128 -5.307 -5.000 1.00 0.00 C ATOM 0 H MET A 816 -14.364 -9.479 -3.268 1.00 0.00 H new ATOM 0 HA MET A 816 -16.424 -8.411 -1.774 1.00 0.00 H new ATOM 0 HB2 MET A 816 -16.113 -8.745 -4.774 1.00 0.00 H new ATOM 0 HB3 MET A 816 -17.342 -7.741 -4.031 1.00 0.00 H new ATOM 0 HG2 MET A 816 -15.534 -6.437 -2.889 1.00 0.00 H new ATOM 0 HG3 MET A 816 -14.340 -7.402 -3.735 1.00 0.00 H new ATOM 0 HE1 MET A 816 -17.170 -4.237 -5.205 1.00 0.00 H new ATOM 0 HE2 MET A 816 -17.788 -5.835 -5.688 1.00 0.00 H new ATOM 0 HE3 MET A 816 -17.449 -5.492 -3.975 1.00 0.00 H new ATOM 508 N GLY A 817 -18.374 -9.848 -1.713 1.00 0.00 N ATOM 509 CA GLY A 817 -19.463 -10.777 -1.528 1.00 0.00 C ATOM 510 C GLY A 817 -19.441 -11.352 -0.130 1.00 0.00 C ATOM 511 O GLY A 817 -20.474 -11.730 0.417 1.00 0.00 O ATOM 0 H GLY A 817 -18.350 -9.084 -1.037 1.00 0.00 H new ATOM 0 HA2 GLY A 817 -20.413 -10.272 -1.704 1.00 0.00 H new ATOM 0 HA3 GLY A 817 -19.389 -11.582 -2.259 1.00 0.00 H new ATOM 515 N ASP A 818 -18.246 -11.416 0.439 1.00 0.00 N ATOM 516 CA ASP A 818 -18.066 -11.839 1.821 1.00 0.00 C ATOM 517 C ASP A 818 -17.631 -10.652 2.662 1.00 0.00 C ATOM 518 O ASP A 818 -16.511 -10.151 2.521 1.00 0.00 O ATOM 519 CB ASP A 818 -17.039 -12.969 1.926 1.00 0.00 C ATOM 520 CG ASP A 818 -17.600 -14.314 1.521 1.00 0.00 C ATOM 521 OD1 ASP A 818 -17.594 -14.631 0.314 1.00 0.00 O ATOM 522 OD2 ASP A 818 -18.050 -15.069 2.415 1.00 0.00 O ATOM 0 H ASP A 818 -17.378 -11.178 -0.041 1.00 0.00 H new ATOM 0 HA ASP A 818 -19.017 -12.220 2.193 1.00 0.00 H new ATOM 0 HB2 ASP A 818 -16.182 -12.734 1.295 1.00 0.00 H new ATOM 0 HB3 ASP A 818 -16.674 -13.027 2.951 1.00 0.00 H new ATOM 527 N ALA A 819 -18.520 -10.215 3.537 1.00 0.00 N ATOM 528 CA ALA A 819 -18.320 -8.996 4.307 1.00 0.00 C ATOM 529 C ALA A 819 -17.131 -9.114 5.260 1.00 0.00 C ATOM 530 O ALA A 819 -16.217 -8.288 5.234 1.00 0.00 O ATOM 531 CB ALA A 819 -19.590 -8.661 5.069 1.00 0.00 C ATOM 0 H ALA A 819 -19.399 -10.693 3.735 1.00 0.00 H new ATOM 0 HA ALA A 819 -18.092 -8.188 3.612 1.00 0.00 H new ATOM 0 HB1 ALA A 819 -19.439 -7.748 5.645 1.00 0.00 H new ATOM 0 HB2 ALA A 819 -20.409 -8.514 4.365 1.00 0.00 H new ATOM 0 HB3 ALA A 819 -19.835 -9.480 5.745 1.00 0.00 H new ATOM 537 N GLY A 820 -17.148 -10.146 6.090 1.00 0.00 N ATOM 538 CA GLY A 820 -16.080 -10.358 7.053 1.00 0.00 C ATOM 539 C GLY A 820 -14.714 -10.518 6.408 1.00 0.00 C ATOM 540 O GLY A 820 -13.700 -10.109 6.978 1.00 0.00 O ATOM 0 H GLY A 820 -17.888 -10.848 6.116 1.00 0.00 H new ATOM 0 HA2 GLY A 820 -16.051 -9.516 7.745 1.00 0.00 H new ATOM 0 HA3 GLY A 820 -16.303 -11.248 7.642 1.00 0.00 H new ATOM 544 N GLU A 821 -14.677 -11.111 5.220 1.00 0.00 N ATOM 545 CA GLU A 821 -13.418 -11.303 4.504 1.00 0.00 C ATOM 546 C GLU A 821 -12.836 -9.963 4.072 1.00 0.00 C ATOM 547 O GLU A 821 -11.676 -9.660 4.354 1.00 0.00 O ATOM 548 CB GLU A 821 -13.623 -12.194 3.278 1.00 0.00 C ATOM 549 CG GLU A 821 -14.151 -13.580 3.607 1.00 0.00 C ATOM 550 CD GLU A 821 -13.189 -14.409 4.433 1.00 0.00 C ATOM 551 OE1 GLU A 821 -13.157 -14.233 5.670 1.00 0.00 O ATOM 552 OE2 GLU A 821 -12.442 -15.220 3.845 1.00 0.00 O ATOM 0 H GLU A 821 -15.500 -11.466 4.733 1.00 0.00 H new ATOM 0 HA GLU A 821 -12.718 -11.791 5.182 1.00 0.00 H new ATOM 0 HB2 GLU A 821 -14.318 -11.703 2.596 1.00 0.00 H new ATOM 0 HB3 GLU A 821 -12.675 -12.293 2.750 1.00 0.00 H new ATOM 0 HG2 GLU A 821 -15.093 -13.483 4.148 1.00 0.00 H new ATOM 0 HG3 GLU A 821 -14.369 -14.108 2.679 1.00 0.00 H new ATOM 559 N MET A 822 -13.657 -9.159 3.404 1.00 0.00 N ATOM 560 CA MET A 822 -13.231 -7.858 2.892 1.00 0.00 C ATOM 561 C MET A 822 -12.722 -6.960 4.014 1.00 0.00 C ATOM 562 O MET A 822 -11.688 -6.306 3.873 1.00 0.00 O ATOM 563 CB MET A 822 -14.390 -7.172 2.168 1.00 0.00 C ATOM 564 CG MET A 822 -14.848 -7.902 0.917 1.00 0.00 C ATOM 565 SD MET A 822 -16.343 -7.194 0.198 1.00 0.00 S ATOM 566 CE MET A 822 -15.826 -5.499 -0.055 1.00 0.00 C ATOM 0 H MET A 822 -14.630 -9.387 3.202 1.00 0.00 H new ATOM 0 HA MET A 822 -12.413 -8.027 2.192 1.00 0.00 H new ATOM 0 HB2 MET A 822 -15.232 -7.082 2.854 1.00 0.00 H new ATOM 0 HB3 MET A 822 -14.089 -6.160 1.897 1.00 0.00 H new ATOM 0 HG2 MET A 822 -14.049 -7.879 0.176 1.00 0.00 H new ATOM 0 HG3 MET A 822 -15.028 -8.949 1.159 1.00 0.00 H new ATOM 0 HE1 MET A 822 -16.340 -5.088 -0.924 1.00 0.00 H new ATOM 0 HE2 MET A 822 -16.074 -4.908 0.826 1.00 0.00 H new ATOM 0 HE3 MET A 822 -14.749 -5.468 -0.222 1.00 0.00 H new ATOM 576 N VAL A 823 -13.442 -6.937 5.131 1.00 0.00 N ATOM 577 CA VAL A 823 -13.052 -6.114 6.270 1.00 0.00 C ATOM 578 C VAL A 823 -11.709 -6.569 6.839 1.00 0.00 C ATOM 579 O VAL A 823 -10.848 -5.744 7.147 1.00 0.00 O ATOM 580 CB VAL A 823 -14.125 -6.132 7.384 1.00 0.00 C ATOM 581 CG1 VAL A 823 -13.669 -5.323 8.590 1.00 0.00 C ATOM 582 CG2 VAL A 823 -15.443 -5.593 6.853 1.00 0.00 C ATOM 0 H VAL A 823 -14.296 -7.477 5.272 1.00 0.00 H new ATOM 0 HA VAL A 823 -12.956 -5.091 5.905 1.00 0.00 H new ATOM 0 HB VAL A 823 -14.270 -7.164 7.703 1.00 0.00 H new ATOM 0 HG11 VAL A 823 -14.440 -5.351 9.360 1.00 0.00 H new ATOM 0 HG12 VAL A 823 -12.746 -5.748 8.985 1.00 0.00 H new ATOM 0 HG13 VAL A 823 -13.493 -4.290 8.290 1.00 0.00 H new ATOM 0 HG21 VAL A 823 -16.190 -5.611 7.647 1.00 0.00 H new ATOM 0 HG22 VAL A 823 -15.305 -4.568 6.508 1.00 0.00 H new ATOM 0 HG23 VAL A 823 -15.781 -6.213 6.023 1.00 0.00 H new ATOM 592 N ARG A 824 -11.528 -7.883 6.952 1.00 0.00 N ATOM 593 CA ARG A 824 -10.272 -8.440 7.446 1.00 0.00 C ATOM 594 C ARG A 824 -9.116 -8.001 6.557 1.00 0.00 C ATOM 595 O ARG A 824 -8.102 -7.498 7.042 1.00 0.00 O ATOM 596 CB ARG A 824 -10.323 -9.971 7.481 1.00 0.00 C ATOM 597 CG ARG A 824 -9.061 -10.596 8.055 1.00 0.00 C ATOM 598 CD ARG A 824 -8.641 -11.839 7.284 1.00 0.00 C ATOM 599 NE ARG A 824 -9.617 -12.922 7.379 1.00 0.00 N ATOM 600 CZ ARG A 824 -9.493 -14.087 6.744 1.00 0.00 C ATOM 601 NH1 ARG A 824 -8.471 -14.294 5.926 1.00 0.00 N ATOM 602 NH2 ARG A 824 -10.397 -15.042 6.919 1.00 0.00 N ATOM 0 H ARG A 824 -12.233 -8.579 6.709 1.00 0.00 H new ATOM 0 HA ARG A 824 -10.120 -8.069 8.460 1.00 0.00 H new ATOM 0 HB2 ARG A 824 -11.181 -10.287 8.075 1.00 0.00 H new ATOM 0 HB3 ARG A 824 -10.480 -10.347 6.470 1.00 0.00 H new ATOM 0 HG2 ARG A 824 -8.252 -9.865 8.034 1.00 0.00 H new ATOM 0 HG3 ARG A 824 -9.228 -10.856 9.100 1.00 0.00 H new ATOM 0 HD2 ARG A 824 -8.495 -11.579 6.236 1.00 0.00 H new ATOM 0 HD3 ARG A 824 -7.680 -12.188 7.662 1.00 0.00 H new ATOM 0 HE ARG A 824 -10.440 -12.778 7.964 1.00 0.00 H new ATOM 0 HH11 ARG A 824 -7.777 -13.561 5.781 1.00 0.00 H new ATOM 0 HH12 ARG A 824 -8.378 -15.187 5.441 1.00 0.00 H new ATOM 0 HH21 ARG A 824 -11.190 -14.886 7.541 1.00 0.00 H new ATOM 0 HH22 ARG A 824 -10.299 -15.933 6.431 1.00 0.00 H new ATOM 616 N GLN A 825 -9.287 -8.182 5.252 1.00 0.00 N ATOM 617 CA GLN A 825 -8.252 -7.852 4.280 1.00 0.00 C ATOM 618 C GLN A 825 -7.930 -6.359 4.304 1.00 0.00 C ATOM 619 O GLN A 825 -6.778 -5.962 4.115 1.00 0.00 O ATOM 620 CB GLN A 825 -8.695 -8.275 2.875 1.00 0.00 C ATOM 621 CG GLN A 825 -9.003 -9.760 2.743 1.00 0.00 C ATOM 622 CD GLN A 825 -7.790 -10.646 2.964 1.00 0.00 C ATOM 623 OE1 GLN A 825 -7.908 -11.767 3.460 1.00 0.00 O ATOM 624 NE2 GLN A 825 -6.622 -10.160 2.580 1.00 0.00 N ATOM 0 H GLN A 825 -10.141 -8.559 4.841 1.00 0.00 H new ATOM 0 HA GLN A 825 -7.347 -8.397 4.549 1.00 0.00 H new ATOM 0 HB2 GLN A 825 -9.582 -7.705 2.598 1.00 0.00 H new ATOM 0 HB3 GLN A 825 -7.912 -8.012 2.164 1.00 0.00 H new ATOM 0 HG2 GLN A 825 -9.777 -10.029 3.462 1.00 0.00 H new ATOM 0 HG3 GLN A 825 -9.409 -9.953 1.750 1.00 0.00 H new ATOM 0 HE21 GLN A 825 -6.567 -9.226 2.173 1.00 0.00 H new ATOM 0 HE22 GLN A 825 -5.776 -10.719 2.690 1.00 0.00 H new ATOM 633 N ALA A 826 -8.945 -5.537 4.552 1.00 0.00 N ATOM 634 CA ALA A 826 -8.762 -4.092 4.626 1.00 0.00 C ATOM 635 C ALA A 826 -7.843 -3.719 5.786 1.00 0.00 C ATOM 636 O ALA A 826 -6.998 -2.833 5.661 1.00 0.00 O ATOM 637 CB ALA A 826 -10.105 -3.393 4.768 1.00 0.00 C ATOM 0 H ALA A 826 -9.904 -5.848 4.705 1.00 0.00 H new ATOM 0 HA ALA A 826 -8.293 -3.761 3.699 1.00 0.00 H new ATOM 0 HB1 ALA A 826 -9.950 -2.315 4.822 1.00 0.00 H new ATOM 0 HB2 ALA A 826 -10.730 -3.627 3.906 1.00 0.00 H new ATOM 0 HB3 ALA A 826 -10.599 -3.735 5.678 1.00 0.00 H new ATOM 643 N ARG A 827 -8.000 -4.413 6.909 1.00 0.00 N ATOM 644 CA ARG A 827 -7.166 -4.161 8.080 1.00 0.00 C ATOM 645 C ARG A 827 -5.732 -4.598 7.811 1.00 0.00 C ATOM 646 O ARG A 827 -4.784 -4.015 8.337 1.00 0.00 O ATOM 647 CB ARG A 827 -7.705 -4.895 9.303 1.00 0.00 C ATOM 648 CG ARG A 827 -9.158 -4.589 9.613 1.00 0.00 C ATOM 649 CD ARG A 827 -9.607 -5.288 10.881 1.00 0.00 C ATOM 650 NE ARG A 827 -9.210 -6.696 10.897 1.00 0.00 N ATOM 651 CZ ARG A 827 -9.922 -7.665 11.463 1.00 0.00 C ATOM 652 NH1 ARG A 827 -11.107 -7.401 12.009 1.00 0.00 N ATOM 653 NH2 ARG A 827 -9.448 -8.903 11.471 1.00 0.00 N ATOM 0 H ARG A 827 -8.693 -5.151 7.033 1.00 0.00 H new ATOM 0 HA ARG A 827 -7.185 -3.090 8.281 1.00 0.00 H new ATOM 0 HB2 ARG A 827 -7.595 -5.968 9.148 1.00 0.00 H new ATOM 0 HB3 ARG A 827 -7.096 -4.634 10.169 1.00 0.00 H new ATOM 0 HG2 ARG A 827 -9.290 -3.513 9.722 1.00 0.00 H new ATOM 0 HG3 ARG A 827 -9.785 -4.905 8.779 1.00 0.00 H new ATOM 0 HD2 ARG A 827 -9.180 -4.781 11.746 1.00 0.00 H new ATOM 0 HD3 ARG A 827 -10.691 -5.215 10.971 1.00 0.00 H new ATOM 0 HE ARG A 827 -8.331 -6.950 10.445 1.00 0.00 H new ATOM 0 HH11 ARG A 827 -11.474 -6.450 11.995 1.00 0.00 H new ATOM 0 HH12 ARG A 827 -11.648 -8.150 12.442 1.00 0.00 H new ATOM 0 HH21 ARG A 827 -8.544 -9.106 11.045 1.00 0.00 H new ATOM 0 HH22 ARG A 827 -9.988 -9.653 11.903 1.00 0.00 H new ATOM 667 N ILE A 828 -5.583 -5.632 6.993 1.00 0.00 N ATOM 668 CA ILE A 828 -4.266 -6.094 6.578 1.00 0.00 C ATOM 669 C ILE A 828 -3.566 -5.002 5.777 1.00 0.00 C ATOM 670 O ILE A 828 -2.374 -4.750 5.957 1.00 0.00 O ATOM 671 CB ILE A 828 -4.351 -7.384 5.732 1.00 0.00 C ATOM 672 CG1 ILE A 828 -5.072 -8.484 6.515 1.00 0.00 C ATOM 673 CG2 ILE A 828 -2.957 -7.847 5.323 1.00 0.00 C ATOM 674 CD1 ILE A 828 -5.293 -9.753 5.719 1.00 0.00 C ATOM 0 H ILE A 828 -6.359 -6.167 6.604 1.00 0.00 H new ATOM 0 HA ILE A 828 -3.695 -6.321 7.478 1.00 0.00 H new ATOM 0 HB ILE A 828 -4.921 -7.170 4.828 1.00 0.00 H new ATOM 0 HG12 ILE A 828 -4.493 -8.722 7.407 1.00 0.00 H new ATOM 0 HG13 ILE A 828 -6.037 -8.105 6.853 1.00 0.00 H new ATOM 0 HG21 ILE A 828 -3.036 -8.757 4.728 1.00 0.00 H new ATOM 0 HG22 ILE A 828 -2.473 -7.068 4.733 1.00 0.00 H new ATOM 0 HG23 ILE A 828 -2.364 -8.047 6.215 1.00 0.00 H new ATOM 0 HD11 ILE A 828 -5.809 -10.486 6.339 1.00 0.00 H new ATOM 0 HD12 ILE A 828 -5.898 -9.531 4.840 1.00 0.00 H new ATOM 0 HD13 ILE A 828 -4.331 -10.157 5.404 1.00 0.00 H new ATOM 686 N LEU A 829 -4.324 -4.342 4.907 1.00 0.00 N ATOM 687 CA LEU A 829 -3.801 -3.219 4.141 1.00 0.00 C ATOM 688 C LEU A 829 -3.372 -2.094 5.066 1.00 0.00 C ATOM 689 O LEU A 829 -2.291 -1.532 4.907 1.00 0.00 O ATOM 690 CB LEU A 829 -4.841 -2.699 3.146 1.00 0.00 C ATOM 691 CG LEU A 829 -5.154 -3.639 1.985 1.00 0.00 C ATOM 692 CD1 LEU A 829 -6.114 -2.974 1.012 1.00 0.00 C ATOM 693 CD2 LEU A 829 -3.871 -4.047 1.280 1.00 0.00 C ATOM 0 H LEU A 829 -5.301 -4.566 4.716 1.00 0.00 H new ATOM 0 HA LEU A 829 -2.934 -3.574 3.585 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -5.765 -2.493 3.685 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -4.490 -1.750 2.740 1.00 0.00 H new ATOM 0 HG LEU A 829 -5.632 -4.537 2.378 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -6.328 -3.656 0.189 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -7.041 -2.726 1.528 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -5.662 -2.063 0.620 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -4.107 -4.718 0.454 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -3.369 -3.159 0.895 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -3.215 -4.557 1.985 1.00 0.00 H new ATOM 705 N ALA A 830 -4.221 -1.780 6.037 1.00 0.00 N ATOM 706 CA ALA A 830 -3.920 -0.741 7.011 1.00 0.00 C ATOM 707 C ALA A 830 -2.631 -1.060 7.760 1.00 0.00 C ATOM 708 O ALA A 830 -1.760 -0.203 7.909 1.00 0.00 O ATOM 709 CB ALA A 830 -5.076 -0.577 7.983 1.00 0.00 C ATOM 0 H ALA A 830 -5.126 -2.232 6.170 1.00 0.00 H new ATOM 0 HA ALA A 830 -3.779 0.199 6.478 1.00 0.00 H new ATOM 0 HB1 ALA A 830 -4.836 0.203 8.705 1.00 0.00 H new ATOM 0 HB2 ALA A 830 -5.976 -0.300 7.434 1.00 0.00 H new ATOM 0 HB3 ALA A 830 -5.246 -1.517 8.508 1.00 0.00 H new ATOM 715 N GLN A 831 -2.513 -2.303 8.212 1.00 0.00 N ATOM 716 CA GLN A 831 -1.325 -2.758 8.925 1.00 0.00 C ATOM 717 C GLN A 831 -0.088 -2.653 8.038 1.00 0.00 C ATOM 718 O GLN A 831 0.906 -2.020 8.407 1.00 0.00 O ATOM 719 CB GLN A 831 -1.516 -4.207 9.381 1.00 0.00 C ATOM 720 CG GLN A 831 -0.397 -4.719 10.269 1.00 0.00 C ATOM 721 CD GLN A 831 -0.522 -6.199 10.578 1.00 0.00 C ATOM 722 OE1 GLN A 831 -1.624 -6.756 10.612 1.00 0.00 O ATOM 723 NE2 GLN A 831 0.606 -6.848 10.811 1.00 0.00 N ATOM 0 H GLN A 831 -3.231 -3.018 8.096 1.00 0.00 H new ATOM 0 HA GLN A 831 -1.180 -2.120 9.797 1.00 0.00 H new ATOM 0 HB2 GLN A 831 -2.461 -4.288 9.919 1.00 0.00 H new ATOM 0 HB3 GLN A 831 -1.593 -4.848 8.503 1.00 0.00 H new ATOM 0 HG2 GLN A 831 0.561 -4.534 9.782 1.00 0.00 H new ATOM 0 HG3 GLN A 831 -0.394 -4.157 11.203 1.00 0.00 H new ATOM 0 HE21 GLN A 831 1.497 -6.352 10.774 1.00 0.00 H new ATOM 0 HE22 GLN A 831 0.586 -7.844 11.028 1.00 0.00 H new ATOM 732 N ALA A 832 -0.171 -3.257 6.858 1.00 0.00 N ATOM 733 CA ALA A 832 0.946 -3.297 5.921 1.00 0.00 C ATOM 734 C ALA A 832 1.370 -1.902 5.491 1.00 0.00 C ATOM 735 O ALA A 832 2.561 -1.595 5.438 1.00 0.00 O ATOM 736 CB ALA A 832 0.573 -4.127 4.708 1.00 0.00 C ATOM 0 H ALA A 832 -1.011 -3.731 6.525 1.00 0.00 H new ATOM 0 HA ALA A 832 1.793 -3.757 6.430 1.00 0.00 H new ATOM 0 HB1 ALA A 832 1.412 -4.152 4.013 1.00 0.00 H new ATOM 0 HB2 ALA A 832 0.331 -5.142 5.022 1.00 0.00 H new ATOM 0 HB3 ALA A 832 -0.293 -3.684 4.216 1.00 0.00 H new ATOM 742 N THR A 833 0.392 -1.060 5.186 1.00 0.00 N ATOM 743 CA THR A 833 0.670 0.300 4.760 1.00 0.00 C ATOM 744 C THR A 833 1.402 1.064 5.851 1.00 0.00 C ATOM 745 O THR A 833 2.344 1.806 5.581 1.00 0.00 O ATOM 746 CB THR A 833 -0.624 1.055 4.395 1.00 0.00 C ATOM 747 OG1 THR A 833 -1.292 0.398 3.310 1.00 0.00 O ATOM 748 CG2 THR A 833 -0.321 2.494 4.017 1.00 0.00 C ATOM 0 H THR A 833 -0.599 -1.297 5.226 1.00 0.00 H new ATOM 0 HA THR A 833 1.299 0.236 3.872 1.00 0.00 H new ATOM 0 HB THR A 833 -1.275 1.055 5.269 1.00 0.00 H new ATOM 0 HG1 THR A 833 -1.655 -0.458 3.620 1.00 0.00 H new ATOM 0 HG21 THR A 833 -1.249 3.007 3.763 1.00 0.00 H new ATOM 0 HG22 THR A 833 0.154 2.999 4.858 1.00 0.00 H new ATOM 0 HG23 THR A 833 0.349 2.511 3.158 1.00 0.00 H new ATOM 756 N SER A 834 0.987 0.847 7.089 1.00 0.00 N ATOM 757 CA SER A 834 1.557 1.573 8.215 1.00 0.00 C ATOM 758 C SER A 834 3.039 1.251 8.366 1.00 0.00 C ATOM 759 O SER A 834 3.858 2.139 8.616 1.00 0.00 O ATOM 760 CB SER A 834 0.800 1.242 9.502 1.00 0.00 C ATOM 761 OG SER A 834 -0.563 1.625 9.400 1.00 0.00 O ATOM 0 H SER A 834 0.260 0.177 7.340 1.00 0.00 H new ATOM 0 HA SER A 834 1.458 2.641 8.022 1.00 0.00 H new ATOM 0 HB2 SER A 834 0.867 0.173 9.704 1.00 0.00 H new ATOM 0 HB3 SER A 834 1.264 1.755 10.344 1.00 0.00 H new ATOM 0 HG SER A 834 -0.990 1.125 8.673 1.00 0.00 H new ATOM 767 N ASP A 835 3.384 -0.015 8.180 1.00 0.00 N ATOM 768 CA ASP A 835 4.773 -0.448 8.269 1.00 0.00 C ATOM 769 C ASP A 835 5.585 0.148 7.122 1.00 0.00 C ATOM 770 O ASP A 835 6.733 0.555 7.301 1.00 0.00 O ATOM 771 CB ASP A 835 4.854 -1.975 8.231 1.00 0.00 C ATOM 772 CG ASP A 835 6.246 -2.488 8.533 1.00 0.00 C ATOM 773 OD1 ASP A 835 6.628 -2.545 9.721 1.00 0.00 O ATOM 774 OD2 ASP A 835 6.972 -2.833 7.577 1.00 0.00 O ATOM 0 H ASP A 835 2.722 -0.761 7.966 1.00 0.00 H new ATOM 0 HA ASP A 835 5.188 -0.097 9.214 1.00 0.00 H new ATOM 0 HB2 ASP A 835 4.152 -2.391 8.953 1.00 0.00 H new ATOM 0 HB3 ASP A 835 4.545 -2.328 7.247 1.00 0.00 H new ATOM 779 N LEU A 836 4.962 0.223 5.953 1.00 0.00 N ATOM 780 CA LEU A 836 5.617 0.740 4.758 1.00 0.00 C ATOM 781 C LEU A 836 5.868 2.243 4.877 1.00 0.00 C ATOM 782 O LEU A 836 6.974 2.711 4.625 1.00 0.00 O ATOM 783 CB LEU A 836 4.762 0.448 3.519 1.00 0.00 C ATOM 784 CG LEU A 836 5.516 -0.123 2.313 1.00 0.00 C ATOM 785 CD1 LEU A 836 4.567 -0.325 1.144 1.00 0.00 C ATOM 786 CD2 LEU A 836 6.669 0.781 1.907 1.00 0.00 C ATOM 0 H LEU A 836 3.996 -0.070 5.806 1.00 0.00 H new ATOM 0 HA LEU A 836 6.580 0.239 4.655 1.00 0.00 H new ATOM 0 HB2 LEU A 836 3.976 -0.254 3.799 1.00 0.00 H new ATOM 0 HB3 LEU A 836 4.270 1.371 3.213 1.00 0.00 H new ATOM 0 HG LEU A 836 5.931 -1.089 2.602 1.00 0.00 H new ATOM 0 HD11 LEU A 836 5.117 -0.731 0.295 1.00 0.00 H new ATOM 0 HD12 LEU A 836 3.778 -1.020 1.432 1.00 0.00 H new ATOM 0 HD13 LEU A 836 4.124 0.631 0.866 1.00 0.00 H new ATOM 0 HD21 LEU A 836 7.185 0.350 1.049 1.00 0.00 H new ATOM 0 HD22 LEU A 836 6.283 1.765 1.641 1.00 0.00 H new ATOM 0 HD23 LEU A 836 7.367 0.877 2.739 1.00 0.00 H new ATOM 798 N VAL A 837 4.837 2.991 5.271 1.00 0.00 N ATOM 799 CA VAL A 837 4.929 4.449 5.364 1.00 0.00 C ATOM 800 C VAL A 837 6.057 4.883 6.302 1.00 0.00 C ATOM 801 O VAL A 837 6.798 5.821 5.999 1.00 0.00 O ATOM 802 CB VAL A 837 3.593 5.076 5.828 1.00 0.00 C ATOM 803 CG1 VAL A 837 3.733 6.579 6.027 1.00 0.00 C ATOM 804 CG2 VAL A 837 2.492 4.785 4.823 1.00 0.00 C ATOM 0 H VAL A 837 3.927 2.611 5.531 1.00 0.00 H new ATOM 0 HA VAL A 837 5.152 4.812 4.361 1.00 0.00 H new ATOM 0 HB VAL A 837 3.327 4.627 6.785 1.00 0.00 H new ATOM 0 HG11 VAL A 837 2.779 6.993 6.353 1.00 0.00 H new ATOM 0 HG12 VAL A 837 4.492 6.777 6.784 1.00 0.00 H new ATOM 0 HG13 VAL A 837 4.028 7.045 5.087 1.00 0.00 H new ATOM 0 HG21 VAL A 837 1.559 5.233 5.165 1.00 0.00 H new ATOM 0 HG22 VAL A 837 2.763 5.206 3.855 1.00 0.00 H new ATOM 0 HG23 VAL A 837 2.363 3.707 4.727 1.00 0.00 H new ATOM 814 N ASN A 838 6.195 4.190 7.429 1.00 0.00 N ATOM 815 CA ASN A 838 7.272 4.479 8.378 1.00 0.00 C ATOM 816 C ASN A 838 8.631 4.311 7.716 1.00 0.00 C ATOM 817 O ASN A 838 9.538 5.124 7.912 1.00 0.00 O ATOM 818 CB ASN A 838 7.183 3.564 9.602 1.00 0.00 C ATOM 819 CG ASN A 838 6.208 4.077 10.647 1.00 0.00 C ATOM 820 OD1 ASN A 838 6.587 4.820 11.552 1.00 0.00 O ATOM 821 ND2 ASN A 838 4.948 3.688 10.539 1.00 0.00 N ATOM 0 H ASN A 838 5.579 3.427 7.709 1.00 0.00 H new ATOM 0 HA ASN A 838 7.158 5.513 8.702 1.00 0.00 H new ATOM 0 HB2 ASN A 838 6.877 2.567 9.284 1.00 0.00 H new ATOM 0 HB3 ASN A 838 8.172 3.466 10.050 1.00 0.00 H new ATOM 0 HD21 ASN A 838 4.256 4.005 11.219 1.00 0.00 H new ATOM 0 HD22 ASN A 838 4.668 3.071 9.776 1.00 0.00 H new ATOM 828 N ALA A 839 8.758 3.260 6.921 1.00 0.00 N ATOM 829 CA ALA A 839 9.995 2.976 6.212 1.00 0.00 C ATOM 830 C ALA A 839 10.273 4.041 5.159 1.00 0.00 C ATOM 831 O ALA A 839 11.406 4.501 5.017 1.00 0.00 O ATOM 832 CB ALA A 839 9.927 1.599 5.577 1.00 0.00 C ATOM 0 H ALA A 839 8.013 2.585 6.750 1.00 0.00 H new ATOM 0 HA ALA A 839 10.816 2.991 6.928 1.00 0.00 H new ATOM 0 HB1 ALA A 839 10.858 1.396 5.048 1.00 0.00 H new ATOM 0 HB2 ALA A 839 9.779 0.848 6.353 1.00 0.00 H new ATOM 0 HB3 ALA A 839 9.095 1.563 4.873 1.00 0.00 H new ATOM 838 N ILE A 840 9.226 4.434 4.439 1.00 0.00 N ATOM 839 CA ILE A 840 9.334 5.458 3.407 1.00 0.00 C ATOM 840 C ILE A 840 9.827 6.777 4.000 1.00 0.00 C ATOM 841 O ILE A 840 10.771 7.378 3.495 1.00 0.00 O ATOM 842 CB ILE A 840 7.979 5.706 2.703 1.00 0.00 C ATOM 843 CG1 ILE A 840 7.444 4.415 2.080 1.00 0.00 C ATOM 844 CG2 ILE A 840 8.123 6.783 1.637 1.00 0.00 C ATOM 845 CD1 ILE A 840 6.059 4.558 1.480 1.00 0.00 C ATOM 0 H ILE A 840 8.286 4.054 4.554 1.00 0.00 H new ATOM 0 HA ILE A 840 10.052 5.091 2.674 1.00 0.00 H new ATOM 0 HB ILE A 840 7.265 6.047 3.453 1.00 0.00 H new ATOM 0 HG12 ILE A 840 8.134 4.083 1.304 1.00 0.00 H new ATOM 0 HG13 ILE A 840 7.422 3.636 2.842 1.00 0.00 H new ATOM 0 HG21 ILE A 840 7.161 6.945 1.151 1.00 0.00 H new ATOM 0 HG22 ILE A 840 8.457 7.711 2.101 1.00 0.00 H new ATOM 0 HG23 ILE A 840 8.855 6.465 0.895 1.00 0.00 H new ATOM 0 HD11 ILE A 840 5.745 3.604 1.057 1.00 0.00 H new ATOM 0 HD12 ILE A 840 5.356 4.860 2.256 1.00 0.00 H new ATOM 0 HD13 ILE A 840 6.079 5.314 0.695 1.00 0.00 H new ATOM 857 N LYS A 841 9.189 7.209 5.084 1.00 0.00 N ATOM 858 CA LYS A 841 9.521 8.485 5.714 1.00 0.00 C ATOM 859 C LYS A 841 10.959 8.513 6.212 1.00 0.00 C ATOM 860 O LYS A 841 11.713 9.433 5.896 1.00 0.00 O ATOM 861 CB LYS A 841 8.577 8.770 6.880 1.00 0.00 C ATOM 862 CG LYS A 841 7.153 9.066 6.448 1.00 0.00 C ATOM 863 CD LYS A 841 6.279 9.402 7.641 1.00 0.00 C ATOM 864 CE LYS A 841 4.880 9.797 7.211 1.00 0.00 C ATOM 865 NZ LYS A 841 4.034 10.182 8.369 1.00 0.00 N ATOM 0 H LYS A 841 8.439 6.695 5.545 1.00 0.00 H new ATOM 0 HA LYS A 841 9.406 9.256 4.952 1.00 0.00 H new ATOM 0 HB2 LYS A 841 8.573 7.912 7.552 1.00 0.00 H new ATOM 0 HB3 LYS A 841 8.960 9.618 7.448 1.00 0.00 H new ATOM 0 HG2 LYS A 841 7.149 9.898 5.744 1.00 0.00 H new ATOM 0 HG3 LYS A 841 6.742 8.203 5.924 1.00 0.00 H new ATOM 0 HD2 LYS A 841 6.226 8.542 8.309 1.00 0.00 H new ATOM 0 HD3 LYS A 841 6.731 10.217 8.206 1.00 0.00 H new ATOM 0 HE2 LYS A 841 4.937 10.630 6.510 1.00 0.00 H new ATOM 0 HE3 LYS A 841 4.414 8.966 6.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 3.085 10.445 8.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 3.959 9.379 9.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 4.465 10.992 8.860 1.00 0.00 H new ATOM 879 N ALA A 842 11.337 7.500 6.981 1.00 0.00 N ATOM 880 CA ALA A 842 12.663 7.446 7.583 1.00 0.00 C ATOM 881 C ALA A 842 13.756 7.423 6.520 1.00 0.00 C ATOM 882 O ALA A 842 14.832 7.997 6.705 1.00 0.00 O ATOM 883 CB ALA A 842 12.779 6.233 8.489 1.00 0.00 C ATOM 0 H ALA A 842 10.742 6.702 7.203 1.00 0.00 H new ATOM 0 HA ALA A 842 12.799 8.348 8.179 1.00 0.00 H new ATOM 0 HB1 ALA A 842 13.774 6.204 8.933 1.00 0.00 H new ATOM 0 HB2 ALA A 842 12.031 6.296 9.279 1.00 0.00 H new ATOM 0 HB3 ALA A 842 12.615 5.327 7.906 1.00 0.00 H new ATOM 889 N ASP A 843 13.473 6.767 5.405 1.00 0.00 N ATOM 890 CA ASP A 843 14.427 6.680 4.310 1.00 0.00 C ATOM 891 C ASP A 843 14.434 7.979 3.515 1.00 0.00 C ATOM 892 O ASP A 843 15.475 8.419 3.022 1.00 0.00 O ATOM 893 CB ASP A 843 14.079 5.497 3.411 1.00 0.00 C ATOM 894 CG ASP A 843 15.107 5.244 2.329 1.00 0.00 C ATOM 895 OD1 ASP A 843 16.309 5.424 2.604 1.00 0.00 O ATOM 896 OD2 ASP A 843 14.711 4.888 1.194 1.00 0.00 O ATOM 0 H ASP A 843 12.590 6.287 5.234 1.00 0.00 H new ATOM 0 HA ASP A 843 15.426 6.524 4.717 1.00 0.00 H new ATOM 0 HB2 ASP A 843 13.979 4.601 4.024 1.00 0.00 H new ATOM 0 HB3 ASP A 843 13.109 5.676 2.946 1.00 0.00 H new ATOM 901 N ALA A 844 13.266 8.601 3.414 1.00 0.00 N ATOM 902 CA ALA A 844 13.135 9.897 2.764 1.00 0.00 C ATOM 903 C ALA A 844 13.932 10.953 3.510 1.00 0.00 C ATOM 904 O ALA A 844 14.582 11.801 2.902 1.00 0.00 O ATOM 905 CB ALA A 844 11.676 10.310 2.682 1.00 0.00 C ATOM 0 H ALA A 844 12.390 8.225 3.777 1.00 0.00 H new ATOM 0 HA ALA A 844 13.531 9.809 1.752 1.00 0.00 H new ATOM 0 HB1 ALA A 844 11.600 11.281 2.193 1.00 0.00 H new ATOM 0 HB2 ALA A 844 11.120 9.570 2.107 1.00 0.00 H new ATOM 0 HB3 ALA A 844 11.260 10.376 3.687 1.00 0.00 H new ATOM 911 N GLU A 845 13.880 10.898 4.834 1.00 0.00 N ATOM 912 CA GLU A 845 14.626 11.831 5.663 1.00 0.00 C ATOM 913 C GLU A 845 16.122 11.586 5.517 1.00 0.00 C ATOM 914 O GLU A 845 16.920 12.522 5.543 1.00 0.00 O ATOM 915 CB GLU A 845 14.207 11.703 7.127 1.00 0.00 C ATOM 916 CG GLU A 845 12.736 11.995 7.363 1.00 0.00 C ATOM 917 CD GLU A 845 12.358 11.921 8.825 1.00 0.00 C ATOM 918 OE1 GLU A 845 12.115 10.807 9.330 1.00 0.00 O ATOM 919 OE2 GLU A 845 12.306 12.980 9.482 1.00 0.00 O ATOM 0 H GLU A 845 13.329 10.217 5.356 1.00 0.00 H new ATOM 0 HA GLU A 845 14.403 12.844 5.329 1.00 0.00 H new ATOM 0 HB2 GLU A 845 14.429 10.694 7.473 1.00 0.00 H new ATOM 0 HB3 GLU A 845 14.806 12.386 7.729 1.00 0.00 H new ATOM 0 HG2 GLU A 845 12.500 12.988 6.980 1.00 0.00 H new ATOM 0 HG3 GLU A 845 12.133 11.284 6.799 1.00 0.00 H new ATOM 926 N GLY A 846 16.490 10.321 5.348 1.00 0.00 N ATOM 927 CA GLY A 846 17.883 9.965 5.169 1.00 0.00 C ATOM 928 C GLY A 846 18.403 10.336 3.794 1.00 0.00 C ATOM 929 O GLY A 846 19.609 10.481 3.600 1.00 0.00 O ATOM 0 H GLY A 846 15.843 9.532 5.332 1.00 0.00 H new ATOM 0 HA2 GLY A 846 18.483 10.466 5.929 1.00 0.00 H new ATOM 0 HA3 GLY A 846 18.004 8.893 5.323 1.00 0.00 H new ATOM 933 N GLU A 847 17.493 10.485 2.838 1.00 0.00 N ATOM 934 CA GLU A 847 17.855 10.882 1.487 1.00 0.00 C ATOM 935 C GLU A 847 18.387 12.316 1.472 1.00 0.00 C ATOM 936 O GLU A 847 17.762 13.229 2.016 1.00 0.00 O ATOM 937 CB GLU A 847 16.637 10.751 0.564 1.00 0.00 C ATOM 938 CG GLU A 847 16.879 11.235 -0.858 1.00 0.00 C ATOM 939 CD GLU A 847 18.006 10.498 -1.551 1.00 0.00 C ATOM 940 OE1 GLU A 847 17.745 9.443 -2.162 1.00 0.00 O ATOM 941 OE2 GLU A 847 19.157 10.966 -1.479 1.00 0.00 O ATOM 0 H GLU A 847 16.494 10.335 2.977 1.00 0.00 H new ATOM 0 HA GLU A 847 18.645 10.224 1.126 1.00 0.00 H new ATOM 0 HB2 GLU A 847 16.329 9.706 0.533 1.00 0.00 H new ATOM 0 HB3 GLU A 847 15.808 11.315 0.992 1.00 0.00 H new ATOM 0 HG2 GLU A 847 15.964 11.115 -1.437 1.00 0.00 H new ATOM 0 HG3 GLU A 847 17.107 12.301 -0.839 1.00 0.00 H new ATOM 948 N SER A 848 19.547 12.502 0.857 1.00 0.00 N ATOM 949 CA SER A 848 20.149 13.818 0.739 1.00 0.00 C ATOM 950 C SER A 848 19.446 14.632 -0.343 1.00 0.00 C ATOM 951 O SER A 848 19.424 15.863 -0.293 1.00 0.00 O ATOM 952 CB SER A 848 21.637 13.685 0.412 1.00 0.00 C ATOM 953 OG SER A 848 22.288 12.840 1.347 1.00 0.00 O ATOM 0 H SER A 848 20.091 11.752 0.431 1.00 0.00 H new ATOM 0 HA SER A 848 20.039 14.338 1.691 1.00 0.00 H new ATOM 0 HB2 SER A 848 21.758 13.282 -0.594 1.00 0.00 H new ATOM 0 HB3 SER A 848 22.104 14.670 0.419 1.00 0.00 H new ATOM 0 HG SER A 848 23.238 12.768 1.117 1.00 0.00 H new ATOM 959 N ASP A 849 18.855 13.938 -1.310 1.00 0.00 N ATOM 960 CA ASP A 849 18.156 14.602 -2.401 1.00 0.00 C ATOM 961 C ASP A 849 16.834 15.153 -1.900 1.00 0.00 C ATOM 962 O ASP A 849 15.917 14.392 -1.594 1.00 0.00 O ATOM 963 CB ASP A 849 17.906 13.642 -3.564 1.00 0.00 C ATOM 964 CG ASP A 849 17.424 14.362 -4.804 1.00 0.00 C ATOM 965 OD1 ASP A 849 16.203 14.555 -4.950 1.00 0.00 O ATOM 966 OD2 ASP A 849 18.265 14.742 -5.641 1.00 0.00 O ATOM 0 H ASP A 849 18.847 12.919 -1.359 1.00 0.00 H new ATOM 0 HA ASP A 849 18.783 15.417 -2.761 1.00 0.00 H new ATOM 0 HB2 ASP A 849 18.826 13.103 -3.793 1.00 0.00 H new ATOM 0 HB3 ASP A 849 17.167 12.898 -3.267 1.00 0.00 H new ATOM 971 N LEU A 850 16.747 16.472 -1.810 1.00 0.00 N ATOM 972 CA LEU A 850 15.563 17.136 -1.281 1.00 0.00 C ATOM 973 C LEU A 850 14.321 16.737 -2.072 1.00 0.00 C ATOM 974 O LEU A 850 13.273 16.453 -1.496 1.00 0.00 O ATOM 975 CB LEU A 850 15.748 18.652 -1.336 1.00 0.00 C ATOM 976 CG LEU A 850 15.278 19.431 -0.099 1.00 0.00 C ATOM 977 CD1 LEU A 850 13.780 19.275 0.116 1.00 0.00 C ATOM 978 CD2 LEU A 850 16.043 18.982 1.137 1.00 0.00 C ATOM 0 H LEU A 850 17.489 17.109 -2.099 1.00 0.00 H new ATOM 0 HA LEU A 850 15.428 16.826 -0.245 1.00 0.00 H new ATOM 0 HB2 LEU A 850 16.805 18.864 -1.495 1.00 0.00 H new ATOM 0 HB3 LEU A 850 15.213 19.032 -2.206 1.00 0.00 H new ATOM 0 HG LEU A 850 15.483 20.487 -0.272 1.00 0.00 H new ATOM 0 HD11 LEU A 850 13.479 19.838 0.999 1.00 0.00 H new ATOM 0 HD12 LEU A 850 13.246 19.654 -0.756 1.00 0.00 H new ATOM 0 HD13 LEU A 850 13.541 18.221 0.259 1.00 0.00 H new ATOM 0 HD21 LEU A 850 15.697 19.545 2.004 1.00 0.00 H new ATOM 0 HD22 LEU A 850 15.873 17.918 1.304 1.00 0.00 H new ATOM 0 HD23 LEU A 850 17.108 19.161 0.990 1.00 0.00 H new ATOM 990 N GLU A 851 14.451 16.692 -3.390 1.00 0.00 N ATOM 991 CA GLU A 851 13.325 16.372 -4.256 1.00 0.00 C ATOM 992 C GLU A 851 12.849 14.942 -4.040 1.00 0.00 C ATOM 993 O GLU A 851 11.654 14.698 -3.895 1.00 0.00 O ATOM 994 CB GLU A 851 13.700 16.595 -5.716 1.00 0.00 C ATOM 995 CG GLU A 851 13.974 18.048 -6.035 1.00 0.00 C ATOM 996 CD GLU A 851 12.759 18.926 -5.798 1.00 0.00 C ATOM 997 OE1 GLU A 851 12.555 19.366 -4.647 1.00 0.00 O ATOM 998 OE2 GLU A 851 12.010 19.192 -6.760 1.00 0.00 O ATOM 0 H GLU A 851 15.325 16.873 -3.883 1.00 0.00 H new ATOM 0 HA GLU A 851 12.502 17.039 -3.998 1.00 0.00 H new ATOM 0 HB2 GLU A 851 14.583 16.003 -5.954 1.00 0.00 H new ATOM 0 HB3 GLU A 851 12.893 16.234 -6.353 1.00 0.00 H new ATOM 0 HG2 GLU A 851 14.802 18.403 -5.421 1.00 0.00 H new ATOM 0 HG3 GLU A 851 14.287 18.137 -7.075 1.00 0.00 H new ATOM 1005 N ASN A 852 13.785 14.002 -4.012 1.00 0.00 N ATOM 1006 CA ASN A 852 13.449 12.605 -3.756 1.00 0.00 C ATOM 1007 C ASN A 852 12.887 12.460 -2.350 1.00 0.00 C ATOM 1008 O ASN A 852 11.964 11.680 -2.117 1.00 0.00 O ATOM 1009 CB ASN A 852 14.674 11.702 -3.925 1.00 0.00 C ATOM 1010 CG ASN A 852 14.316 10.225 -3.848 1.00 0.00 C ATOM 1011 OD1 ASN A 852 13.228 9.813 -4.253 1.00 0.00 O ATOM 1012 ND2 ASN A 852 15.226 9.417 -3.328 1.00 0.00 N ATOM 0 H ASN A 852 14.778 14.179 -4.162 1.00 0.00 H new ATOM 0 HA ASN A 852 12.697 12.295 -4.482 1.00 0.00 H new ATOM 0 HB2 ASN A 852 15.146 11.910 -4.885 1.00 0.00 H new ATOM 0 HB3 ASN A 852 15.406 11.937 -3.152 1.00 0.00 H new ATOM 0 HD21 ASN A 852 15.037 8.418 -3.252 1.00 0.00 H new ATOM 0 HD22 ASN A 852 16.116 9.794 -3.003 1.00 0.00 H new ATOM 1019 N SER A 853 13.431 13.246 -1.427 1.00 0.00 N ATOM 1020 CA SER A 853 12.960 13.249 -0.055 1.00 0.00 C ATOM 1021 C SER A 853 11.490 13.660 -0.022 1.00 0.00 C ATOM 1022 O SER A 853 10.651 12.981 0.572 1.00 0.00 O ATOM 1023 CB SER A 853 13.806 14.213 0.785 1.00 0.00 C ATOM 1024 OG SER A 853 13.473 14.140 2.161 1.00 0.00 O ATOM 0 H SER A 853 14.201 13.890 -1.609 1.00 0.00 H new ATOM 0 HA SER A 853 13.056 12.248 0.365 1.00 0.00 H new ATOM 0 HB2 SER A 853 14.862 13.979 0.653 1.00 0.00 H new ATOM 0 HB3 SER A 853 13.658 15.232 0.428 1.00 0.00 H new ATOM 0 HG SER A 853 13.748 13.270 2.518 1.00 0.00 H new ATOM 1030 N ARG A 854 11.189 14.765 -0.700 1.00 0.00 N ATOM 1031 CA ARG A 854 9.826 15.266 -0.807 1.00 0.00 C ATOM 1032 C ARG A 854 8.917 14.247 -1.480 1.00 0.00 C ATOM 1033 O ARG A 854 7.832 13.959 -0.984 1.00 0.00 O ATOM 1034 CB ARG A 854 9.795 16.573 -1.602 1.00 0.00 C ATOM 1035 CG ARG A 854 10.503 17.727 -0.916 1.00 0.00 C ATOM 1036 CD ARG A 854 10.576 18.943 -1.822 1.00 0.00 C ATOM 1037 NE ARG A 854 9.249 19.413 -2.221 1.00 0.00 N ATOM 1038 CZ ARG A 854 9.007 20.112 -3.330 1.00 0.00 C ATOM 1039 NH1 ARG A 854 9.997 20.392 -4.170 1.00 0.00 N ATOM 1040 NH2 ARG A 854 7.772 20.515 -3.605 1.00 0.00 N ATOM 0 H ARG A 854 11.881 15.334 -1.188 1.00 0.00 H new ATOM 0 HA ARG A 854 9.463 15.447 0.205 1.00 0.00 H new ATOM 0 HB2 ARG A 854 10.254 16.405 -2.576 1.00 0.00 H new ATOM 0 HB3 ARG A 854 8.757 16.852 -1.783 1.00 0.00 H new ATOM 0 HG2 ARG A 854 9.976 17.986 0.003 1.00 0.00 H new ATOM 0 HG3 ARG A 854 11.510 17.422 -0.631 1.00 0.00 H new ATOM 0 HD2 ARG A 854 11.105 19.746 -1.308 1.00 0.00 H new ATOM 0 HD3 ARG A 854 11.156 18.697 -2.712 1.00 0.00 H new ATOM 0 HE ARG A 854 8.460 19.192 -1.613 1.00 0.00 H new ATOM 0 HH11 ARG A 854 10.944 20.072 -3.967 1.00 0.00 H new ATOM 0 HH12 ARG A 854 9.810 20.927 -5.018 1.00 0.00 H new ATOM 0 HH21 ARG A 854 7.008 20.290 -2.968 1.00 0.00 H new ATOM 0 HH22 ARG A 854 7.587 21.050 -4.454 1.00 0.00 H new ATOM 1054 N LYS A 855 9.372 13.699 -2.603 1.00 0.00 N ATOM 1055 CA LYS A 855 8.574 12.749 -3.375 1.00 0.00 C ATOM 1056 C LYS A 855 8.224 11.515 -2.551 1.00 0.00 C ATOM 1057 O LYS A 855 7.098 11.024 -2.618 1.00 0.00 O ATOM 1058 CB LYS A 855 9.301 12.340 -4.660 1.00 0.00 C ATOM 1059 CG LYS A 855 9.395 13.462 -5.682 1.00 0.00 C ATOM 1060 CD LYS A 855 10.072 13.007 -6.966 1.00 0.00 C ATOM 1061 CE LYS A 855 11.517 12.599 -6.730 1.00 0.00 C ATOM 1062 NZ LYS A 855 12.194 12.202 -7.992 1.00 0.00 N ATOM 0 H LYS A 855 10.291 13.896 -3.000 1.00 0.00 H new ATOM 0 HA LYS A 855 7.644 13.250 -3.645 1.00 0.00 H new ATOM 0 HB2 LYS A 855 10.306 12.002 -4.408 1.00 0.00 H new ATOM 0 HB3 LYS A 855 8.783 11.492 -5.108 1.00 0.00 H new ATOM 0 HG2 LYS A 855 8.395 13.830 -5.910 1.00 0.00 H new ATOM 0 HG3 LYS A 855 9.951 14.296 -5.255 1.00 0.00 H new ATOM 0 HD2 LYS A 855 9.522 12.166 -7.389 1.00 0.00 H new ATOM 0 HD3 LYS A 855 10.037 13.812 -7.700 1.00 0.00 H new ATOM 0 HE2 LYS A 855 12.058 13.427 -6.273 1.00 0.00 H new ATOM 0 HE3 LYS A 855 11.549 11.769 -6.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 855 13.177 11.931 -7.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 855 11.693 11.395 -8.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 855 12.186 13.002 -8.657 1.00 0.00 H new ATOM 1076 N LEU A 856 9.175 11.022 -1.770 1.00 0.00 N ATOM 1077 CA LEU A 856 8.918 9.889 -0.891 1.00 0.00 C ATOM 1078 C LEU A 856 7.897 10.263 0.181 1.00 0.00 C ATOM 1079 O LEU A 856 6.960 9.510 0.447 1.00 0.00 O ATOM 1080 CB LEU A 856 10.215 9.394 -0.244 1.00 0.00 C ATOM 1081 CG LEU A 856 11.172 8.644 -1.175 1.00 0.00 C ATOM 1082 CD1 LEU A 856 12.493 8.362 -0.471 1.00 0.00 C ATOM 1083 CD2 LEU A 856 10.536 7.343 -1.651 1.00 0.00 C ATOM 0 H LEU A 856 10.127 11.386 -1.727 1.00 0.00 H new ATOM 0 HA LEU A 856 8.508 9.079 -1.494 1.00 0.00 H new ATOM 0 HB2 LEU A 856 10.741 10.251 0.175 1.00 0.00 H new ATOM 0 HB3 LEU A 856 9.958 8.739 0.589 1.00 0.00 H new ATOM 0 HG LEU A 856 11.372 9.272 -2.043 1.00 0.00 H new ATOM 0 HD11 LEU A 856 13.160 7.829 -1.148 1.00 0.00 H new ATOM 0 HD12 LEU A 856 12.955 9.303 -0.174 1.00 0.00 H new ATOM 0 HD13 LEU A 856 12.311 7.752 0.414 1.00 0.00 H new ATOM 0 HD21 LEU A 856 11.228 6.820 -2.312 1.00 0.00 H new ATOM 0 HD22 LEU A 856 10.310 6.713 -0.791 1.00 0.00 H new ATOM 0 HD23 LEU A 856 9.615 7.564 -2.191 1.00 0.00 H new ATOM 1095 N LEU A 857 8.069 11.439 0.779 1.00 0.00 N ATOM 1096 CA LEU A 857 7.136 11.924 1.793 1.00 0.00 C ATOM 1097 C LEU A 857 5.746 12.140 1.198 1.00 0.00 C ATOM 1098 O LEU A 857 4.732 11.860 1.844 1.00 0.00 O ATOM 1099 CB LEU A 857 7.647 13.224 2.420 1.00 0.00 C ATOM 1100 CG LEU A 857 8.933 13.090 3.238 1.00 0.00 C ATOM 1101 CD1 LEU A 857 9.390 14.450 3.740 1.00 0.00 C ATOM 1102 CD2 LEU A 857 8.725 12.133 4.402 1.00 0.00 C ATOM 0 H LEU A 857 8.843 12.072 0.580 1.00 0.00 H new ATOM 0 HA LEU A 857 7.064 11.164 2.571 1.00 0.00 H new ATOM 0 HB2 LEU A 857 7.815 13.951 1.625 1.00 0.00 H new ATOM 0 HB3 LEU A 857 6.866 13.630 3.063 1.00 0.00 H new ATOM 0 HG LEU A 857 9.712 12.684 2.593 1.00 0.00 H new ATOM 0 HD11 LEU A 857 10.306 14.335 4.320 1.00 0.00 H new ATOM 0 HD12 LEU A 857 9.578 15.107 2.891 1.00 0.00 H new ATOM 0 HD13 LEU A 857 8.614 14.885 4.370 1.00 0.00 H new ATOM 0 HD21 LEU A 857 9.649 12.049 4.974 1.00 0.00 H new ATOM 0 HD22 LEU A 857 7.932 12.512 5.047 1.00 0.00 H new ATOM 0 HD23 LEU A 857 8.444 11.151 4.020 1.00 0.00 H new ATOM 1114 N SER A 858 5.703 12.641 -0.031 1.00 0.00 N ATOM 1115 CA SER A 858 4.446 12.829 -0.738 1.00 0.00 C ATOM 1116 C SER A 858 3.799 11.480 -1.038 1.00 0.00 C ATOM 1117 O SER A 858 2.606 11.294 -0.805 1.00 0.00 O ATOM 1118 CB SER A 858 4.672 13.606 -2.039 1.00 0.00 C ATOM 1119 OG SER A 858 5.258 14.874 -1.788 1.00 0.00 O ATOM 0 H SER A 858 6.529 12.925 -0.559 1.00 0.00 H new ATOM 0 HA SER A 858 3.776 13.406 -0.100 1.00 0.00 H new ATOM 0 HB2 SER A 858 5.318 13.030 -2.702 1.00 0.00 H new ATOM 0 HB3 SER A 858 3.721 13.738 -2.556 1.00 0.00 H new ATOM 0 HG SER A 858 6.188 14.754 -1.503 1.00 0.00 H new ATOM 1125 N ALA A 859 4.597 10.539 -1.536 1.00 0.00 N ATOM 1126 CA ALA A 859 4.107 9.203 -1.856 1.00 0.00 C ATOM 1127 C ALA A 859 3.563 8.510 -0.612 1.00 0.00 C ATOM 1128 O ALA A 859 2.510 7.877 -0.656 1.00 0.00 O ATOM 1129 CB ALA A 859 5.211 8.365 -2.485 1.00 0.00 C ATOM 0 H ALA A 859 5.589 10.679 -1.727 1.00 0.00 H new ATOM 0 HA ALA A 859 3.294 9.306 -2.574 1.00 0.00 H new ATOM 0 HB1 ALA A 859 4.827 7.372 -2.717 1.00 0.00 H new ATOM 0 HB2 ALA A 859 5.554 8.844 -3.402 1.00 0.00 H new ATOM 0 HB3 ALA A 859 6.044 8.278 -1.787 1.00 0.00 H new ATOM 1135 N ALA A 860 4.284 8.649 0.497 1.00 0.00 N ATOM 1136 CA ALA A 860 3.854 8.083 1.769 1.00 0.00 C ATOM 1137 C ALA A 860 2.527 8.690 2.209 1.00 0.00 C ATOM 1138 O ALA A 860 1.654 7.989 2.716 1.00 0.00 O ATOM 1139 CB ALA A 860 4.917 8.307 2.835 1.00 0.00 C ATOM 0 H ALA A 860 5.171 9.151 0.539 1.00 0.00 H new ATOM 0 HA ALA A 860 3.713 7.010 1.636 1.00 0.00 H new ATOM 0 HB1 ALA A 860 4.581 7.879 3.779 1.00 0.00 H new ATOM 0 HB2 ALA A 860 5.846 7.827 2.529 1.00 0.00 H new ATOM 0 HB3 ALA A 860 5.086 9.376 2.961 1.00 0.00 H new ATOM 1145 N LYS A 861 2.381 9.993 1.995 1.00 0.00 N ATOM 1146 CA LYS A 861 1.156 10.698 2.353 1.00 0.00 C ATOM 1147 C LYS A 861 -0.008 10.213 1.497 1.00 0.00 C ATOM 1148 O LYS A 861 -1.077 9.889 2.013 1.00 0.00 O ATOM 1149 CB LYS A 861 1.334 12.209 2.185 1.00 0.00 C ATOM 1150 CG LYS A 861 0.114 13.018 2.595 1.00 0.00 C ATOM 1151 CD LYS A 861 -0.179 12.873 4.081 1.00 0.00 C ATOM 1152 CE LYS A 861 -1.473 13.575 4.462 1.00 0.00 C ATOM 1153 NZ LYS A 861 -1.720 13.525 5.928 1.00 0.00 N ATOM 0 H LYS A 861 3.098 10.584 1.574 1.00 0.00 H new ATOM 0 HA LYS A 861 0.936 10.486 3.399 1.00 0.00 H new ATOM 0 HB2 LYS A 861 2.190 12.533 2.777 1.00 0.00 H new ATOM 0 HB3 LYS A 861 1.568 12.425 1.142 1.00 0.00 H new ATOM 0 HG2 LYS A 861 0.276 14.069 2.356 1.00 0.00 H new ATOM 0 HG3 LYS A 861 -0.751 12.690 2.019 1.00 0.00 H new ATOM 0 HD2 LYS A 861 -0.247 11.816 4.339 1.00 0.00 H new ATOM 0 HD3 LYS A 861 0.646 13.289 4.659 1.00 0.00 H new ATOM 0 HE2 LYS A 861 -1.432 14.614 4.136 1.00 0.00 H new ATOM 0 HE3 LYS A 861 -2.307 13.109 3.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 861 -2.611 14.014 6.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 861 -1.785 12.534 6.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 861 -0.937 13.992 6.428 1.00 0.00 H new ATOM 1167 N ILE A 862 0.215 10.163 0.187 1.00 0.00 N ATOM 1168 CA ILE A 862 -0.798 9.694 -0.750 1.00 0.00 C ATOM 1169 C ILE A 862 -1.208 8.263 -0.419 1.00 0.00 C ATOM 1170 O ILE A 862 -2.394 7.935 -0.400 1.00 0.00 O ATOM 1171 CB ILE A 862 -0.294 9.761 -2.212 1.00 0.00 C ATOM 1172 CG1 ILE A 862 0.020 11.209 -2.598 1.00 0.00 C ATOM 1173 CG2 ILE A 862 -1.322 9.162 -3.167 1.00 0.00 C ATOM 1174 CD1 ILE A 862 0.608 11.356 -3.987 1.00 0.00 C ATOM 0 H ILE A 862 1.093 10.443 -0.250 1.00 0.00 H new ATOM 0 HA ILE A 862 -1.661 10.352 -0.653 1.00 0.00 H new ATOM 0 HB ILE A 862 0.621 9.174 -2.289 1.00 0.00 H new ATOM 0 HG12 ILE A 862 -0.895 11.799 -2.536 1.00 0.00 H new ATOM 0 HG13 ILE A 862 0.718 11.626 -1.872 1.00 0.00 H new ATOM 0 HG21 ILE A 862 -0.947 9.220 -4.189 1.00 0.00 H new ATOM 0 HG22 ILE A 862 -1.499 8.119 -2.904 1.00 0.00 H new ATOM 0 HG23 ILE A 862 -2.256 9.719 -3.092 1.00 0.00 H new ATOM 0 HD11 ILE A 862 0.804 12.409 -4.190 1.00 0.00 H new ATOM 0 HD12 ILE A 862 1.540 10.795 -4.049 1.00 0.00 H new ATOM 0 HD13 ILE A 862 -0.097 10.970 -4.723 1.00 0.00 H new ATOM 1186 N LEU A 863 -0.219 7.425 -0.139 1.00 0.00 N ATOM 1187 CA LEU A 863 -0.467 6.037 0.218 1.00 0.00 C ATOM 1188 C LEU A 863 -1.268 5.932 1.512 1.00 0.00 C ATOM 1189 O LEU A 863 -2.356 5.358 1.526 1.00 0.00 O ATOM 1190 CB LEU A 863 0.857 5.278 0.353 1.00 0.00 C ATOM 1191 CG LEU A 863 0.762 3.932 1.070 1.00 0.00 C ATOM 1192 CD1 LEU A 863 -0.348 3.083 0.469 1.00 0.00 C ATOM 1193 CD2 LEU A 863 2.095 3.202 1.017 1.00 0.00 C ATOM 0 H LEU A 863 0.767 7.685 -0.153 1.00 0.00 H new ATOM 0 HA LEU A 863 -1.056 5.586 -0.581 1.00 0.00 H new ATOM 0 HB2 LEU A 863 1.267 5.113 -0.644 1.00 0.00 H new ATOM 0 HB3 LEU A 863 1.566 5.908 0.889 1.00 0.00 H new ATOM 0 HG LEU A 863 0.519 4.115 2.117 1.00 0.00 H new ATOM 0 HD11 LEU A 863 -0.400 2.128 0.993 1.00 0.00 H new ATOM 0 HD12 LEU A 863 -1.300 3.604 0.569 1.00 0.00 H new ATOM 0 HD13 LEU A 863 -0.140 2.907 -0.586 1.00 0.00 H new ATOM 0 HD21 LEU A 863 2.007 2.246 1.533 1.00 0.00 H new ATOM 0 HD22 LEU A 863 2.374 3.029 -0.022 1.00 0.00 H new ATOM 0 HD23 LEU A 863 2.861 3.807 1.502 1.00 0.00 H new ATOM 1205 N ALA A 864 -0.737 6.507 2.586 1.00 0.00 N ATOM 1206 CA ALA A 864 -1.356 6.406 3.903 1.00 0.00 C ATOM 1207 C ALA A 864 -2.788 6.928 3.882 1.00 0.00 C ATOM 1208 O ALA A 864 -3.626 6.522 4.693 1.00 0.00 O ATOM 1209 CB ALA A 864 -0.528 7.165 4.926 1.00 0.00 C ATOM 0 H ALA A 864 0.126 7.051 2.570 1.00 0.00 H new ATOM 0 HA ALA A 864 -1.391 5.353 4.184 1.00 0.00 H new ATOM 0 HB1 ALA A 864 -0.998 7.084 5.906 1.00 0.00 H new ATOM 0 HB2 ALA A 864 0.475 6.742 4.968 1.00 0.00 H new ATOM 0 HB3 ALA A 864 -0.467 8.215 4.638 1.00 0.00 H new ATOM 1215 N ASP A 865 -3.061 7.824 2.947 1.00 0.00 N ATOM 1216 CA ASP A 865 -4.390 8.384 2.790 1.00 0.00 C ATOM 1217 C ASP A 865 -5.275 7.495 1.942 1.00 0.00 C ATOM 1218 O ASP A 865 -6.451 7.296 2.257 1.00 0.00 O ATOM 1219 CB ASP A 865 -4.302 9.785 2.180 1.00 0.00 C ATOM 1220 CG ASP A 865 -5.646 10.336 1.751 1.00 0.00 C ATOM 1221 OD1 ASP A 865 -6.378 10.877 2.609 1.00 0.00 O ATOM 1222 OD2 ASP A 865 -5.965 10.253 0.548 1.00 0.00 O ATOM 0 H ASP A 865 -2.374 8.180 2.282 1.00 0.00 H new ATOM 0 HA ASP A 865 -4.843 8.451 3.779 1.00 0.00 H new ATOM 0 HB2 ASP A 865 -3.854 10.463 2.907 1.00 0.00 H new ATOM 0 HB3 ASP A 865 -3.636 9.757 1.317 1.00 0.00 H new ATOM 1227 N ALA A 866 -4.708 6.946 0.882 1.00 0.00 N ATOM 1228 CA ALA A 866 -5.433 6.025 0.032 1.00 0.00 C ATOM 1229 C ALA A 866 -5.917 4.838 0.852 1.00 0.00 C ATOM 1230 O ALA A 866 -6.990 4.296 0.603 1.00 0.00 O ATOM 1231 CB ALA A 866 -4.557 5.570 -1.121 1.00 0.00 C ATOM 0 H ALA A 866 -3.747 7.124 0.591 1.00 0.00 H new ATOM 0 HA ALA A 866 -6.302 6.532 -0.387 1.00 0.00 H new ATOM 0 HB1 ALA A 866 -5.116 4.878 -1.751 1.00 0.00 H new ATOM 0 HB2 ALA A 866 -4.254 6.435 -1.711 1.00 0.00 H new ATOM 0 HB3 ALA A 866 -3.671 5.070 -0.730 1.00 0.00 H new ATOM 1237 N THR A 867 -5.123 4.463 1.853 1.00 0.00 N ATOM 1238 CA THR A 867 -5.484 3.386 2.758 1.00 0.00 C ATOM 1239 C THR A 867 -6.705 3.754 3.593 1.00 0.00 C ATOM 1240 O THR A 867 -7.653 2.984 3.679 1.00 0.00 O ATOM 1241 CB THR A 867 -4.317 3.039 3.696 1.00 0.00 C ATOM 1242 OG1 THR A 867 -3.094 3.031 2.955 1.00 0.00 O ATOM 1243 CG2 THR A 867 -4.525 1.678 4.345 1.00 0.00 C ATOM 0 H THR A 867 -4.221 4.895 2.054 1.00 0.00 H new ATOM 0 HA THR A 867 -5.721 2.517 2.144 1.00 0.00 H new ATOM 0 HB THR A 867 -4.271 3.793 4.482 1.00 0.00 H new ATOM 0 HG1 THR A 867 -2.892 3.939 2.647 1.00 0.00 H new ATOM 0 HG21 THR A 867 -3.685 1.457 5.004 1.00 0.00 H new ATOM 0 HG22 THR A 867 -5.448 1.689 4.925 1.00 0.00 H new ATOM 0 HG23 THR A 867 -4.591 0.913 3.572 1.00 0.00 H new ATOM 1251 N ALA A 868 -6.679 4.936 4.199 1.00 0.00 N ATOM 1252 CA ALA A 868 -7.798 5.414 5.004 1.00 0.00 C ATOM 1253 C ALA A 868 -9.083 5.441 4.182 1.00 0.00 C ATOM 1254 O ALA A 868 -10.122 4.945 4.621 1.00 0.00 O ATOM 1255 CB ALA A 868 -7.493 6.795 5.566 1.00 0.00 C ATOM 0 H ALA A 868 -5.892 5.583 4.148 1.00 0.00 H new ATOM 0 HA ALA A 868 -7.942 4.725 5.836 1.00 0.00 H new ATOM 0 HB1 ALA A 868 -8.337 7.139 6.164 1.00 0.00 H new ATOM 0 HB2 ALA A 868 -6.601 6.745 6.191 1.00 0.00 H new ATOM 0 HB3 ALA A 868 -7.322 7.492 4.746 1.00 0.00 H new ATOM 1261 N LYS A 869 -8.993 6.004 2.980 1.00 0.00 N ATOM 1262 CA LYS A 869 -10.129 6.064 2.062 1.00 0.00 C ATOM 1263 C LYS A 869 -10.589 4.657 1.685 1.00 0.00 C ATOM 1264 O LYS A 869 -11.786 4.380 1.617 1.00 0.00 O ATOM 1265 CB LYS A 869 -9.746 6.830 0.793 1.00 0.00 C ATOM 1266 CG LYS A 869 -9.354 8.279 1.037 1.00 0.00 C ATOM 1267 CD LYS A 869 -8.795 8.926 -0.225 1.00 0.00 C ATOM 1268 CE LYS A 869 -9.821 8.966 -1.347 1.00 0.00 C ATOM 1269 NZ LYS A 869 -10.936 9.903 -1.054 1.00 0.00 N ATOM 0 H LYS A 869 -8.140 6.428 2.616 1.00 0.00 H new ATOM 0 HA LYS A 869 -10.945 6.583 2.565 1.00 0.00 H new ATOM 0 HB2 LYS A 869 -8.915 6.317 0.308 1.00 0.00 H new ATOM 0 HB3 LYS A 869 -10.586 6.804 0.098 1.00 0.00 H new ATOM 0 HG2 LYS A 869 -10.224 8.840 1.380 1.00 0.00 H new ATOM 0 HG3 LYS A 869 -8.610 8.327 1.832 1.00 0.00 H new ATOM 0 HD2 LYS A 869 -8.467 9.940 0.002 1.00 0.00 H new ATOM 0 HD3 LYS A 869 -7.916 8.373 -0.557 1.00 0.00 H new ATOM 0 HE2 LYS A 869 -9.332 9.265 -2.274 1.00 0.00 H new ATOM 0 HE3 LYS A 869 -10.222 7.965 -1.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 -11.566 9.962 -1.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 -11.473 9.558 -0.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 -10.551 10.846 -0.844 1.00 0.00 H new ATOM 1283 N MET A 870 -9.618 3.786 1.441 1.00 0.00 N ATOM 1284 CA MET A 870 -9.879 2.404 1.061 1.00 0.00 C ATOM 1285 C MET A 870 -10.570 1.653 2.194 1.00 0.00 C ATOM 1286 O MET A 870 -11.659 1.109 2.017 1.00 0.00 O ATOM 1287 CB MET A 870 -8.550 1.725 0.705 1.00 0.00 C ATOM 1288 CG MET A 870 -8.675 0.325 0.131 1.00 0.00 C ATOM 1289 SD MET A 870 -9.174 -0.912 1.339 1.00 0.00 S ATOM 1290 CE MET A 870 -9.345 -2.325 0.264 1.00 0.00 C ATOM 0 H MET A 870 -8.627 4.018 1.501 1.00 0.00 H new ATOM 0 HA MET A 870 -10.542 2.389 0.196 1.00 0.00 H new ATOM 0 HB2 MET A 870 -8.022 2.350 -0.015 1.00 0.00 H new ATOM 0 HB3 MET A 870 -7.932 1.679 1.601 1.00 0.00 H new ATOM 0 HG2 MET A 870 -9.401 0.339 -0.682 1.00 0.00 H new ATOM 0 HG3 MET A 870 -7.718 0.032 -0.301 1.00 0.00 H new ATOM 0 HE1 MET A 870 -9.021 -3.223 0.789 1.00 0.00 H new ATOM 0 HE2 MET A 870 -10.389 -2.434 -0.031 1.00 0.00 H new ATOM 0 HE3 MET A 870 -8.730 -2.183 -0.625 1.00 0.00 H new ATOM 1300 N VAL A 871 -9.929 1.655 3.355 1.00 0.00 N ATOM 1301 CA VAL A 871 -10.393 0.909 4.516 1.00 0.00 C ATOM 1302 C VAL A 871 -11.820 1.289 4.904 1.00 0.00 C ATOM 1303 O VAL A 871 -12.670 0.419 5.102 1.00 0.00 O ATOM 1304 CB VAL A 871 -9.442 1.126 5.716 1.00 0.00 C ATOM 1305 CG1 VAL A 871 -10.028 0.573 7.003 1.00 0.00 C ATOM 1306 CG2 VAL A 871 -8.089 0.487 5.441 1.00 0.00 C ATOM 0 H VAL A 871 -9.068 2.177 3.518 1.00 0.00 H new ATOM 0 HA VAL A 871 -10.392 -0.146 4.244 1.00 0.00 H new ATOM 0 HB VAL A 871 -9.312 2.201 5.843 1.00 0.00 H new ATOM 0 HG11 VAL A 871 -9.331 0.744 7.823 1.00 0.00 H new ATOM 0 HG12 VAL A 871 -10.972 1.074 7.218 1.00 0.00 H new ATOM 0 HG13 VAL A 871 -10.203 -0.497 6.893 1.00 0.00 H new ATOM 0 HG21 VAL A 871 -7.430 0.648 6.294 1.00 0.00 H new ATOM 0 HG22 VAL A 871 -8.218 -0.583 5.279 1.00 0.00 H new ATOM 0 HG23 VAL A 871 -7.648 0.938 4.552 1.00 0.00 H new ATOM 1316 N GLU A 872 -12.093 2.584 4.986 1.00 0.00 N ATOM 1317 CA GLU A 872 -13.410 3.048 5.403 1.00 0.00 C ATOM 1318 C GLU A 872 -14.466 2.732 4.349 1.00 0.00 C ATOM 1319 O GLU A 872 -15.637 2.520 4.677 1.00 0.00 O ATOM 1320 CB GLU A 872 -13.380 4.544 5.717 1.00 0.00 C ATOM 1321 CG GLU A 872 -12.476 4.881 6.891 1.00 0.00 C ATOM 1322 CD GLU A 872 -12.581 6.325 7.328 1.00 0.00 C ATOM 1323 OE1 GLU A 872 -13.577 6.679 7.992 1.00 0.00 O ATOM 1324 OE2 GLU A 872 -11.676 7.119 6.990 1.00 0.00 O ATOM 0 H GLU A 872 -11.427 3.326 4.772 1.00 0.00 H new ATOM 0 HA GLU A 872 -13.682 2.514 6.313 1.00 0.00 H new ATOM 0 HB2 GLU A 872 -13.042 5.089 4.836 1.00 0.00 H new ATOM 0 HB3 GLU A 872 -14.392 4.886 5.934 1.00 0.00 H new ATOM 0 HG2 GLU A 872 -12.727 4.234 7.732 1.00 0.00 H new ATOM 0 HG3 GLU A 872 -11.443 4.664 6.620 1.00 0.00 H new ATOM 1331 N ALA A 873 -14.052 2.675 3.089 1.00 0.00 N ATOM 1332 CA ALA A 873 -14.951 2.289 2.011 1.00 0.00 C ATOM 1333 C ALA A 873 -15.208 0.787 2.052 1.00 0.00 C ATOM 1334 O ALA A 873 -16.345 0.342 1.909 1.00 0.00 O ATOM 1335 CB ALA A 873 -14.382 2.696 0.661 1.00 0.00 C ATOM 0 H ALA A 873 -13.101 2.891 2.790 1.00 0.00 H new ATOM 0 HA ALA A 873 -15.898 2.810 2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 873 -15.071 2.397 -0.129 1.00 0.00 H new ATOM 0 HB2 ALA A 873 -14.246 3.777 0.634 1.00 0.00 H new ATOM 0 HB3 ALA A 873 -13.421 2.206 0.509 1.00 0.00 H new ATOM 1341 N ALA A 874 -14.144 0.019 2.269 1.00 0.00 N ATOM 1342 CA ALA A 874 -14.238 -1.435 2.364 1.00 0.00 C ATOM 1343 C ALA A 874 -15.134 -1.848 3.522 1.00 0.00 C ATOM 1344 O ALA A 874 -15.958 -2.747 3.384 1.00 0.00 O ATOM 1345 CB ALA A 874 -12.855 -2.047 2.524 1.00 0.00 C ATOM 0 H ALA A 874 -13.198 0.384 2.383 1.00 0.00 H new ATOM 0 HA ALA A 874 -14.682 -1.806 1.440 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -12.943 -3.131 2.593 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -12.240 -1.787 1.662 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -12.389 -1.662 3.431 1.00 0.00 H new ATOM 1351 N LYS A 875 -14.975 -1.177 4.658 1.00 0.00 N ATOM 1352 CA LYS A 875 -15.801 -1.444 5.833 1.00 0.00 C ATOM 1353 C LYS A 875 -17.284 -1.293 5.508 1.00 0.00 C ATOM 1354 O LYS A 875 -18.117 -2.060 5.991 1.00 0.00 O ATOM 1355 CB LYS A 875 -15.428 -0.496 6.975 1.00 0.00 C ATOM 1356 CG LYS A 875 -14.086 -0.798 7.626 1.00 0.00 C ATOM 1357 CD LYS A 875 -13.711 0.268 8.647 1.00 0.00 C ATOM 1358 CE LYS A 875 -14.809 0.468 9.682 1.00 0.00 C ATOM 1359 NZ LYS A 875 -14.454 1.507 10.684 1.00 0.00 N ATOM 0 H LYS A 875 -14.280 -0.442 4.791 1.00 0.00 H new ATOM 0 HA LYS A 875 -15.615 -2.473 6.142 1.00 0.00 H new ATOM 0 HB2 LYS A 875 -15.412 0.525 6.594 1.00 0.00 H new ATOM 0 HB3 LYS A 875 -16.206 -0.540 7.737 1.00 0.00 H new ATOM 0 HG2 LYS A 875 -14.127 -1.772 8.113 1.00 0.00 H new ATOM 0 HG3 LYS A 875 -13.313 -0.858 6.860 1.00 0.00 H new ATOM 0 HD2 LYS A 875 -12.786 -0.018 9.148 1.00 0.00 H new ATOM 0 HD3 LYS A 875 -13.518 1.211 8.135 1.00 0.00 H new ATOM 0 HE2 LYS A 875 -15.733 0.752 9.179 1.00 0.00 H new ATOM 0 HE3 LYS A 875 -15.001 -0.476 10.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 875 -15.231 1.609 11.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 875 -13.587 1.225 11.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 875 -14.296 2.415 10.202 1.00 0.00 H new ATOM 1373 N GLY A 876 -17.607 -0.304 4.687 1.00 0.00 N ATOM 1374 CA GLY A 876 -18.988 -0.076 4.316 1.00 0.00 C ATOM 1375 C GLY A 876 -19.452 -1.012 3.220 1.00 0.00 C ATOM 1376 O GLY A 876 -20.561 -1.542 3.279 1.00 0.00 O ATOM 0 H GLY A 876 -16.938 0.344 4.272 1.00 0.00 H new ATOM 0 HA2 GLY A 876 -19.623 -0.204 5.193 1.00 0.00 H new ATOM 0 HA3 GLY A 876 -19.107 0.955 3.984 1.00 0.00 H new ATOM 1380 N ALA A 877 -18.590 -1.224 2.231 1.00 0.00 N ATOM 1381 CA ALA A 877 -18.920 -2.050 1.076 1.00 0.00 C ATOM 1382 C ALA A 877 -19.080 -3.509 1.470 1.00 0.00 C ATOM 1383 O ALA A 877 -19.896 -4.233 0.907 1.00 0.00 O ATOM 1384 CB ALA A 877 -17.842 -1.911 0.017 1.00 0.00 C ATOM 0 H ALA A 877 -17.649 -0.831 2.207 1.00 0.00 H new ATOM 0 HA ALA A 877 -19.871 -1.705 0.671 1.00 0.00 H new ATOM 0 HB1 ALA A 877 -18.095 -2.531 -0.843 1.00 0.00 H new ATOM 0 HB2 ALA A 877 -17.771 -0.869 -0.295 1.00 0.00 H new ATOM 0 HB3 ALA A 877 -16.885 -2.233 0.427 1.00 0.00 H new ATOM 1390 N ALA A 878 -18.286 -3.932 2.437 1.00 0.00 N ATOM 1391 CA ALA A 878 -18.338 -5.294 2.920 1.00 0.00 C ATOM 1392 C ALA A 878 -19.575 -5.523 3.773 1.00 0.00 C ATOM 1393 O ALA A 878 -20.436 -6.326 3.419 1.00 0.00 O ATOM 1394 CB ALA A 878 -17.085 -5.615 3.711 1.00 0.00 C ATOM 0 H ALA A 878 -17.594 -3.345 2.904 1.00 0.00 H new ATOM 0 HA ALA A 878 -18.394 -5.960 2.059 1.00 0.00 H new ATOM 0 HB1 ALA A 878 -17.135 -6.643 4.070 1.00 0.00 H new ATOM 0 HB2 ALA A 878 -16.210 -5.496 3.071 1.00 0.00 H new ATOM 0 HB3 ALA A 878 -17.008 -4.937 4.561 1.00 0.00 H new ATOM 1400 N ALA A 879 -19.664 -4.801 4.888 1.00 0.00 N ATOM 1401 CA ALA A 879 -20.739 -5.009 5.853 1.00 0.00 C ATOM 1402 C ALA A 879 -22.109 -4.786 5.222 1.00 0.00 C ATOM 1403 O ALA A 879 -23.082 -5.443 5.593 1.00 0.00 O ATOM 1404 CB ALA A 879 -20.545 -4.114 7.062 1.00 0.00 C ATOM 0 H ALA A 879 -19.004 -4.067 5.145 1.00 0.00 H new ATOM 0 HA ALA A 879 -20.699 -6.048 6.181 1.00 0.00 H new ATOM 0 HB1 ALA A 879 -21.355 -4.281 7.772 1.00 0.00 H new ATOM 0 HB2 ALA A 879 -19.592 -4.346 7.537 1.00 0.00 H new ATOM 0 HB3 ALA A 879 -20.549 -3.071 6.747 1.00 0.00 H new ATOM 1410 N HIS A 880 -22.188 -3.844 4.291 1.00 0.00 N ATOM 1411 CA HIS A 880 -23.379 -3.688 3.464 1.00 0.00 C ATOM 1412 C HIS A 880 -23.088 -4.177 2.051 1.00 0.00 C ATOM 1413 O HIS A 880 -22.827 -3.373 1.156 1.00 0.00 O ATOM 1414 CB HIS A 880 -23.858 -2.235 3.435 1.00 0.00 C ATOM 1415 CG HIS A 880 -24.559 -1.809 4.686 1.00 0.00 C ATOM 1416 ND1 HIS A 880 -25.931 -1.766 4.797 1.00 0.00 N ATOM 1417 CD2 HIS A 880 -24.074 -1.404 5.881 1.00 0.00 C ATOM 1418 CE1 HIS A 880 -26.258 -1.352 6.003 1.00 0.00 C ATOM 1419 NE2 HIS A 880 -25.151 -1.125 6.683 1.00 0.00 N ATOM 0 H HIS A 880 -21.443 -3.177 4.089 1.00 0.00 H new ATOM 0 HA HIS A 880 -24.178 -4.288 3.900 1.00 0.00 H new ATOM 0 HB2 HIS A 880 -23.001 -1.582 3.269 1.00 0.00 H new ATOM 0 HB3 HIS A 880 -24.531 -2.100 2.588 1.00 0.00 H new ATOM 0 HD2 HIS A 880 -23.033 -1.316 6.153 1.00 0.00 H new ATOM 0 HE1 HIS A 880 -27.264 -1.220 6.373 1.00 0.00 H new ATOM 0 HE2 HIS A 880 -25.104 -0.796 7.647 1.00 0.00 H new ATOM 1427 N PRO A 881 -23.140 -5.503 1.830 1.00 0.00 N ATOM 1428 CA PRO A 881 -22.698 -6.109 0.570 1.00 0.00 C ATOM 1429 C PRO A 881 -23.605 -5.737 -0.601 1.00 0.00 C ATOM 1430 O PRO A 881 -23.180 -5.717 -1.760 1.00 0.00 O ATOM 1431 CB PRO A 881 -22.769 -7.613 0.845 1.00 0.00 C ATOM 1432 CG PRO A 881 -23.760 -7.757 1.948 1.00 0.00 C ATOM 1433 CD PRO A 881 -23.646 -6.511 2.780 1.00 0.00 C ATOM 0 HA PRO A 881 -21.704 -5.765 0.283 1.00 0.00 H new ATOM 0 HB2 PRO A 881 -23.084 -8.162 -0.042 1.00 0.00 H new ATOM 0 HB3 PRO A 881 -21.795 -8.008 1.135 1.00 0.00 H new ATOM 0 HG2 PRO A 881 -24.769 -7.870 1.552 1.00 0.00 H new ATOM 0 HG3 PRO A 881 -23.551 -8.644 2.545 1.00 0.00 H new ATOM 0 HD2 PRO A 881 -24.609 -6.219 3.199 1.00 0.00 H new ATOM 0 HD3 PRO A 881 -22.963 -6.650 3.618 1.00 0.00 H new ATOM 1441 N ASP A 882 -24.858 -5.438 -0.279 1.00 0.00 N ATOM 1442 CA ASP A 882 -25.868 -5.128 -1.283 1.00 0.00 C ATOM 1443 C ASP A 882 -25.691 -3.722 -1.841 1.00 0.00 C ATOM 1444 O ASP A 882 -26.003 -3.467 -3.004 1.00 0.00 O ATOM 1445 CB ASP A 882 -27.270 -5.262 -0.683 1.00 0.00 C ATOM 1446 CG ASP A 882 -27.546 -6.653 -0.154 1.00 0.00 C ATOM 1447 OD1 ASP A 882 -28.014 -7.507 -0.935 1.00 0.00 O ATOM 1448 OD2 ASP A 882 -27.300 -6.898 1.047 1.00 0.00 O ATOM 0 H ASP A 882 -25.201 -5.404 0.681 1.00 0.00 H new ATOM 0 HA ASP A 882 -25.746 -5.840 -2.099 1.00 0.00 H new ATOM 0 HB2 ASP A 882 -27.386 -4.540 0.126 1.00 0.00 H new ATOM 0 HB3 ASP A 882 -28.011 -5.012 -1.442 1.00 0.00 H new ATOM 1453 N SER A 883 -25.181 -2.823 -1.013 1.00 0.00 N ATOM 1454 CA SER A 883 -25.060 -1.418 -1.382 1.00 0.00 C ATOM 1455 C SER A 883 -24.011 -1.213 -2.474 1.00 0.00 C ATOM 1456 O SER A 883 -22.808 -1.246 -2.206 1.00 0.00 O ATOM 1457 CB SER A 883 -24.698 -0.599 -0.145 1.00 0.00 C ATOM 1458 OG SER A 883 -25.620 -0.835 0.906 1.00 0.00 O ATOM 0 H SER A 883 -24.842 -3.042 -0.076 1.00 0.00 H new ATOM 0 HA SER A 883 -26.018 -1.084 -1.779 1.00 0.00 H new ATOM 0 HB2 SER A 883 -23.691 -0.856 0.184 1.00 0.00 H new ATOM 0 HB3 SER A 883 -24.690 0.462 -0.396 1.00 0.00 H new ATOM 0 HG SER A 883 -25.368 -0.302 1.688 1.00 0.00 H new ATOM 1464 N GLU A 884 -24.469 -0.991 -3.703 1.00 0.00 N ATOM 1465 CA GLU A 884 -23.563 -0.788 -4.825 1.00 0.00 C ATOM 1466 C GLU A 884 -22.808 0.528 -4.690 1.00 0.00 C ATOM 1467 O GLU A 884 -21.682 0.645 -5.158 1.00 0.00 O ATOM 1468 CB GLU A 884 -24.309 -0.821 -6.158 1.00 0.00 C ATOM 1469 CG GLU A 884 -24.884 -2.181 -6.509 1.00 0.00 C ATOM 1470 CD GLU A 884 -25.305 -2.265 -7.959 1.00 0.00 C ATOM 1471 OE1 GLU A 884 -26.455 -1.884 -8.271 1.00 0.00 O ATOM 1472 OE2 GLU A 884 -24.501 -2.719 -8.796 1.00 0.00 O ATOM 0 H GLU A 884 -25.459 -0.948 -3.945 1.00 0.00 H new ATOM 0 HA GLU A 884 -22.846 -1.608 -4.809 1.00 0.00 H new ATOM 0 HB2 GLU A 884 -25.119 -0.092 -6.128 1.00 0.00 H new ATOM 0 HB3 GLU A 884 -23.629 -0.509 -6.951 1.00 0.00 H new ATOM 0 HG2 GLU A 884 -24.142 -2.952 -6.303 1.00 0.00 H new ATOM 0 HG3 GLU A 884 -25.743 -2.386 -5.870 1.00 0.00 H new ATOM 1479 N GLU A 885 -23.432 1.514 -4.052 1.00 0.00 N ATOM 1480 CA GLU A 885 -22.774 2.792 -3.799 1.00 0.00 C ATOM 1481 C GLU A 885 -21.485 2.571 -3.016 1.00 0.00 C ATOM 1482 O GLU A 885 -20.446 3.156 -3.318 1.00 0.00 O ATOM 1483 CB GLU A 885 -23.688 3.748 -3.019 1.00 0.00 C ATOM 1484 CG GLU A 885 -25.031 4.019 -3.681 1.00 0.00 C ATOM 1485 CD GLU A 885 -26.056 2.943 -3.391 1.00 0.00 C ATOM 1486 OE1 GLU A 885 -26.784 3.065 -2.385 1.00 0.00 O ATOM 1487 OE2 GLU A 885 -26.132 1.963 -4.156 1.00 0.00 O ATOM 0 H GLU A 885 -24.388 1.453 -3.702 1.00 0.00 H new ATOM 0 HA GLU A 885 -22.546 3.245 -4.764 1.00 0.00 H new ATOM 0 HB2 GLU A 885 -23.864 3.333 -2.026 1.00 0.00 H new ATOM 0 HB3 GLU A 885 -23.168 4.696 -2.881 1.00 0.00 H new ATOM 0 HG2 GLU A 885 -25.413 4.980 -3.337 1.00 0.00 H new ATOM 0 HG3 GLU A 885 -24.890 4.099 -4.759 1.00 0.00 H new ATOM 1494 N GLN A 886 -21.562 1.700 -2.020 1.00 0.00 N ATOM 1495 CA GLN A 886 -20.407 1.360 -1.205 1.00 0.00 C ATOM 1496 C GLN A 886 -19.372 0.610 -2.033 1.00 0.00 C ATOM 1497 O GLN A 886 -18.176 0.889 -1.951 1.00 0.00 O ATOM 1498 CB GLN A 886 -20.841 0.512 -0.009 1.00 0.00 C ATOM 1499 CG GLN A 886 -21.695 1.266 0.997 1.00 0.00 C ATOM 1500 CD GLN A 886 -20.929 2.365 1.710 1.00 0.00 C ATOM 1501 OE1 GLN A 886 -21.501 3.379 2.107 1.00 0.00 O ATOM 1502 NE2 GLN A 886 -19.630 2.170 1.880 1.00 0.00 N ATOM 0 H GLN A 886 -22.419 1.214 -1.757 1.00 0.00 H new ATOM 0 HA GLN A 886 -19.955 2.282 -0.840 1.00 0.00 H new ATOM 0 HB2 GLN A 886 -21.399 -0.352 -0.371 1.00 0.00 H new ATOM 0 HB3 GLN A 886 -19.953 0.130 0.495 1.00 0.00 H new ATOM 0 HG2 GLN A 886 -22.553 1.701 0.485 1.00 0.00 H new ATOM 0 HG3 GLN A 886 -22.085 0.564 1.734 1.00 0.00 H new ATOM 0 HE21 GLN A 886 -19.193 1.315 1.536 1.00 0.00 H new ATOM 0 HE22 GLN A 886 -19.066 2.875 2.355 1.00 0.00 H new ATOM 1511 N GLN A 887 -19.848 -0.332 -2.840 1.00 0.00 N ATOM 1512 CA GLN A 887 -18.981 -1.120 -3.709 1.00 0.00 C ATOM 1513 C GLN A 887 -18.271 -0.219 -4.715 1.00 0.00 C ATOM 1514 O GLN A 887 -17.072 -0.352 -4.946 1.00 0.00 O ATOM 1515 CB GLN A 887 -19.800 -2.188 -4.443 1.00 0.00 C ATOM 1516 CG GLN A 887 -20.588 -3.101 -3.515 1.00 0.00 C ATOM 1517 CD GLN A 887 -19.714 -4.055 -2.720 1.00 0.00 C ATOM 1518 OE1 GLN A 887 -18.550 -3.773 -2.440 1.00 0.00 O ATOM 1519 NE2 GLN A 887 -20.277 -5.189 -2.339 1.00 0.00 N ATOM 0 H GLN A 887 -20.837 -0.570 -2.910 1.00 0.00 H new ATOM 0 HA GLN A 887 -18.228 -1.613 -3.093 1.00 0.00 H new ATOM 0 HB2 GLN A 887 -20.491 -1.696 -5.127 1.00 0.00 H new ATOM 0 HB3 GLN A 887 -19.128 -2.795 -5.050 1.00 0.00 H new ATOM 0 HG2 GLN A 887 -21.168 -2.490 -2.823 1.00 0.00 H new ATOM 0 HG3 GLN A 887 -21.300 -3.679 -4.105 1.00 0.00 H new ATOM 0 HE21 GLN A 887 -21.245 -5.387 -2.591 1.00 0.00 H new ATOM 0 HE22 GLN A 887 -19.743 -5.865 -1.793 1.00 0.00 H new ATOM 1528 N GLN A 888 -19.025 0.706 -5.300 1.00 0.00 N ATOM 1529 CA GLN A 888 -18.486 1.663 -6.259 1.00 0.00 C ATOM 1530 C GLN A 888 -17.397 2.519 -5.617 1.00 0.00 C ATOM 1531 O GLN A 888 -16.361 2.783 -6.233 1.00 0.00 O ATOM 1532 CB GLN A 888 -19.608 2.546 -6.808 1.00 0.00 C ATOM 1533 CG GLN A 888 -19.140 3.595 -7.803 1.00 0.00 C ATOM 1534 CD GLN A 888 -18.468 2.999 -9.026 1.00 0.00 C ATOM 1535 OE1 GLN A 888 -19.122 2.676 -10.014 1.00 0.00 O ATOM 1536 NE2 GLN A 888 -17.154 2.860 -8.969 1.00 0.00 N ATOM 0 H GLN A 888 -20.024 0.813 -5.123 1.00 0.00 H new ATOM 0 HA GLN A 888 -18.038 1.110 -7.085 1.00 0.00 H new ATOM 0 HB2 GLN A 888 -20.353 1.912 -7.288 1.00 0.00 H new ATOM 0 HB3 GLN A 888 -20.103 3.046 -5.975 1.00 0.00 H new ATOM 0 HG2 GLN A 888 -19.995 4.192 -8.121 1.00 0.00 H new ATOM 0 HG3 GLN A 888 -18.444 4.272 -7.307 1.00 0.00 H new ATOM 0 HE21 GLN A 888 -16.647 3.141 -8.129 1.00 0.00 H new ATOM 0 HE22 GLN A 888 -16.647 2.472 -9.765 1.00 0.00 H new ATOM 1545 N ARG A 889 -17.630 2.942 -4.379 1.00 0.00 N ATOM 1546 CA ARG A 889 -16.633 3.694 -3.630 1.00 0.00 C ATOM 1547 C ARG A 889 -15.371 2.861 -3.444 1.00 0.00 C ATOM 1548 O ARG A 889 -14.259 3.345 -3.660 1.00 0.00 O ATOM 1549 CB ARG A 889 -17.180 4.118 -2.265 1.00 0.00 C ATOM 1550 CG ARG A 889 -18.258 5.184 -2.341 1.00 0.00 C ATOM 1551 CD ARG A 889 -18.827 5.498 -0.967 1.00 0.00 C ATOM 1552 NE ARG A 889 -17.797 5.968 -0.039 1.00 0.00 N ATOM 1553 CZ ARG A 889 -17.992 6.128 1.272 1.00 0.00 C ATOM 1554 NH1 ARG A 889 -19.171 5.840 1.810 1.00 0.00 N ATOM 1555 NH2 ARG A 889 -17.003 6.567 2.045 1.00 0.00 N ATOM 0 H ARG A 889 -18.501 2.776 -3.874 1.00 0.00 H new ATOM 0 HA ARG A 889 -16.389 4.591 -4.200 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -17.584 3.242 -1.758 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -16.357 4.489 -1.654 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -17.844 6.091 -2.781 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -19.059 4.847 -3.000 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -19.603 6.257 -1.061 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -19.302 4.606 -0.559 1.00 0.00 H new ATOM 0 HE ARG A 889 -16.875 6.186 -0.417 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -19.930 5.496 1.222 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -19.318 5.963 2.812 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -16.093 6.782 1.636 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -17.154 6.689 3.046 1.00 0.00 H new ATOM 1569 N LEU A 890 -15.555 1.601 -3.064 1.00 0.00 N ATOM 1570 CA LEU A 890 -14.436 0.699 -2.834 1.00 0.00 C ATOM 1571 C LEU A 890 -13.658 0.437 -4.118 1.00 0.00 C ATOM 1572 O LEU A 890 -12.433 0.337 -4.084 1.00 0.00 O ATOM 1573 CB LEU A 890 -14.915 -0.630 -2.257 1.00 0.00 C ATOM 1574 CG LEU A 890 -13.807 -1.661 -2.043 1.00 0.00 C ATOM 1575 CD1 LEU A 890 -12.822 -1.179 -0.990 1.00 0.00 C ATOM 1576 CD2 LEU A 890 -14.400 -2.999 -1.650 1.00 0.00 C ATOM 0 H LEU A 890 -16.472 1.182 -2.909 1.00 0.00 H new ATOM 0 HA LEU A 890 -13.776 1.187 -2.116 1.00 0.00 H new ATOM 0 HB2 LEU A 890 -15.408 -0.442 -1.304 1.00 0.00 H new ATOM 0 HB3 LEU A 890 -15.665 -1.053 -2.926 1.00 0.00 H new ATOM 0 HG LEU A 890 -13.266 -1.786 -2.981 1.00 0.00 H new ATOM 0 HD11 LEU A 890 -12.041 -1.927 -0.853 1.00 0.00 H new ATOM 0 HD12 LEU A 890 -12.372 -0.241 -1.315 1.00 0.00 H new ATOM 0 HD13 LEU A 890 -13.345 -1.023 -0.047 1.00 0.00 H new ATOM 0 HD21 LEU A 890 -13.599 -3.723 -1.501 1.00 0.00 H new ATOM 0 HD22 LEU A 890 -14.966 -2.889 -0.725 1.00 0.00 H new ATOM 0 HD23 LEU A 890 -15.063 -3.350 -2.441 1.00 0.00 H new ATOM 1588 N ARG A 891 -14.371 0.313 -5.235 1.00 0.00 N ATOM 1589 CA ARG A 891 -13.738 0.089 -6.534 1.00 0.00 C ATOM 1590 C ARG A 891 -12.594 1.067 -6.750 1.00 0.00 C ATOM 1591 O ARG A 891 -11.467 0.671 -7.040 1.00 0.00 O ATOM 1592 CB ARG A 891 -14.749 0.250 -7.674 1.00 0.00 C ATOM 1593 CG ARG A 891 -15.822 -0.822 -7.724 1.00 0.00 C ATOM 1594 CD ARG A 891 -16.804 -0.544 -8.850 1.00 0.00 C ATOM 1595 NE ARG A 891 -17.849 -1.561 -8.950 1.00 0.00 N ATOM 1596 CZ ARG A 891 -18.804 -1.551 -9.878 1.00 0.00 C ATOM 1597 NH1 ARG A 891 -18.857 -0.570 -10.772 1.00 0.00 N ATOM 1598 NH2 ARG A 891 -19.700 -2.526 -9.909 1.00 0.00 N ATOM 0 H ARG A 891 -15.389 0.364 -5.267 1.00 0.00 H new ATOM 0 HA ARG A 891 -13.353 -0.931 -6.537 1.00 0.00 H new ATOM 0 HB2 ARG A 891 -15.231 1.223 -7.580 1.00 0.00 H new ATOM 0 HB3 ARG A 891 -14.211 0.251 -8.622 1.00 0.00 H new ATOM 0 HG2 ARG A 891 -15.361 -1.799 -7.869 1.00 0.00 H new ATOM 0 HG3 ARG A 891 -16.352 -0.858 -6.772 1.00 0.00 H new ATOM 0 HD2 ARG A 891 -17.265 0.431 -8.692 1.00 0.00 H new ATOM 0 HD3 ARG A 891 -16.262 -0.491 -9.794 1.00 0.00 H new ATOM 0 HE ARG A 891 -17.847 -2.322 -8.270 1.00 0.00 H new ATOM 0 HH11 ARG A 891 -18.165 0.179 -10.749 1.00 0.00 H new ATOM 0 HH12 ARG A 891 -19.590 -0.566 -11.481 1.00 0.00 H new ATOM 0 HH21 ARG A 891 -19.657 -3.280 -9.224 1.00 0.00 H new ATOM 0 HH22 ARG A 891 -20.433 -2.522 -10.618 1.00 0.00 H new ATOM 1612 N GLU A 892 -12.887 2.344 -6.569 1.00 0.00 N ATOM 1613 CA GLU A 892 -11.909 3.390 -6.809 1.00 0.00 C ATOM 1614 C GLU A 892 -10.955 3.530 -5.623 1.00 0.00 C ATOM 1615 O GLU A 892 -9.773 3.820 -5.798 1.00 0.00 O ATOM 1616 CB GLU A 892 -12.620 4.718 -7.072 1.00 0.00 C ATOM 1617 CG GLU A 892 -13.728 4.620 -8.112 1.00 0.00 C ATOM 1618 CD GLU A 892 -13.264 3.999 -9.417 1.00 0.00 C ATOM 1619 OE1 GLU A 892 -12.558 4.684 -10.185 1.00 0.00 O ATOM 1620 OE2 GLU A 892 -13.587 2.821 -9.669 1.00 0.00 O ATOM 0 H GLU A 892 -13.797 2.681 -6.256 1.00 0.00 H new ATOM 0 HA GLU A 892 -11.322 3.117 -7.686 1.00 0.00 H new ATOM 0 HB2 GLU A 892 -13.042 5.086 -6.137 1.00 0.00 H new ATOM 0 HB3 GLU A 892 -11.887 5.454 -7.402 1.00 0.00 H new ATOM 0 HG2 GLU A 892 -14.548 4.028 -7.706 1.00 0.00 H new ATOM 0 HG3 GLU A 892 -14.122 5.617 -8.310 1.00 0.00 H new ATOM 1627 N ALA A 893 -11.472 3.311 -4.420 1.00 0.00 N ATOM 1628 CA ALA A 893 -10.677 3.466 -3.207 1.00 0.00 C ATOM 1629 C ALA A 893 -9.609 2.381 -3.093 1.00 0.00 C ATOM 1630 O ALA A 893 -8.443 2.675 -2.837 1.00 0.00 O ATOM 1631 CB ALA A 893 -11.574 3.455 -1.980 1.00 0.00 C ATOM 0 H ALA A 893 -12.438 3.026 -4.258 1.00 0.00 H new ATOM 0 HA ALA A 893 -10.168 4.428 -3.266 1.00 0.00 H new ATOM 0 HB1 ALA A 893 -10.965 3.572 -1.083 1.00 0.00 H new ATOM 0 HB2 ALA A 893 -12.288 4.276 -2.044 1.00 0.00 H new ATOM 0 HB3 ALA A 893 -12.113 2.509 -1.932 1.00 0.00 H new ATOM 1637 N ALA A 894 -10.007 1.129 -3.294 1.00 0.00 N ATOM 1638 CA ALA A 894 -9.085 0.009 -3.158 1.00 0.00 C ATOM 1639 C ALA A 894 -8.074 0.001 -4.295 1.00 0.00 C ATOM 1640 O ALA A 894 -6.882 -0.199 -4.073 1.00 0.00 O ATOM 1641 CB ALA A 894 -9.838 -1.312 -3.094 1.00 0.00 C ATOM 0 H ALA A 894 -10.958 0.866 -3.551 1.00 0.00 H new ATOM 0 HA ALA A 894 -8.542 0.132 -2.221 1.00 0.00 H new ATOM 0 HB1 ALA A 894 -9.127 -2.132 -2.993 1.00 0.00 H new ATOM 0 HB2 ALA A 894 -10.510 -1.306 -2.236 1.00 0.00 H new ATOM 0 HB3 ALA A 894 -10.417 -1.445 -4.008 1.00 0.00 H new ATOM 1647 N GLU A 895 -8.548 0.240 -5.511 1.00 0.00 N ATOM 1648 CA GLU A 895 -7.677 0.297 -6.657 1.00 0.00 C ATOM 1649 C GLU A 895 -6.738 1.492 -6.538 1.00 0.00 C ATOM 1650 O GLU A 895 -5.560 1.405 -6.874 1.00 0.00 O ATOM 1651 CB GLU A 895 -8.522 0.386 -7.919 1.00 0.00 C ATOM 1652 CG GLU A 895 -7.713 0.400 -9.187 1.00 0.00 C ATOM 1653 CD GLU A 895 -6.898 -0.864 -9.379 1.00 0.00 C ATOM 1654 OE1 GLU A 895 -7.409 -1.828 -9.984 1.00 0.00 O ATOM 1655 OE2 GLU A 895 -5.738 -0.900 -8.923 1.00 0.00 O ATOM 0 H GLU A 895 -9.534 0.397 -5.720 1.00 0.00 H new ATOM 0 HA GLU A 895 -7.066 -0.604 -6.706 1.00 0.00 H new ATOM 0 HB2 GLU A 895 -9.209 -0.460 -7.946 1.00 0.00 H new ATOM 0 HB3 GLU A 895 -9.130 1.290 -7.876 1.00 0.00 H new ATOM 0 HG2 GLU A 895 -8.382 0.528 -10.038 1.00 0.00 H new ATOM 0 HG3 GLU A 895 -7.044 1.260 -9.176 1.00 0.00 H new ATOM 1662 N GLY A 896 -7.267 2.602 -6.032 1.00 0.00 N ATOM 1663 CA GLY A 896 -6.445 3.766 -5.768 1.00 0.00 C ATOM 1664 C GLY A 896 -5.384 3.479 -4.725 1.00 0.00 C ATOM 1665 O GLY A 896 -4.258 3.960 -4.828 1.00 0.00 O ATOM 0 H GLY A 896 -8.254 2.715 -5.800 1.00 0.00 H new ATOM 0 HA2 GLY A 896 -5.968 4.091 -6.692 1.00 0.00 H new ATOM 0 HA3 GLY A 896 -7.076 4.587 -5.429 1.00 0.00 H new ATOM 1669 N LEU A 897 -5.751 2.693 -3.719 1.00 0.00 N ATOM 1670 CA LEU A 897 -4.810 2.252 -2.699 1.00 0.00 C ATOM 1671 C LEU A 897 -3.711 1.406 -3.338 1.00 0.00 C ATOM 1672 O LEU A 897 -2.522 1.624 -3.088 1.00 0.00 O ATOM 1673 CB LEU A 897 -5.556 1.468 -1.604 1.00 0.00 C ATOM 1674 CG LEU A 897 -4.721 0.974 -0.407 1.00 0.00 C ATOM 1675 CD1 LEU A 897 -4.026 -0.342 -0.723 1.00 0.00 C ATOM 1676 CD2 LEU A 897 -3.699 2.021 0.008 1.00 0.00 C ATOM 0 H LEU A 897 -6.701 2.347 -3.589 1.00 0.00 H new ATOM 0 HA LEU A 897 -4.341 3.119 -2.234 1.00 0.00 H new ATOM 0 HB2 LEU A 897 -6.357 2.100 -1.221 1.00 0.00 H new ATOM 0 HB3 LEU A 897 -6.028 0.602 -2.069 1.00 0.00 H new ATOM 0 HG LEU A 897 -5.406 0.806 0.424 1.00 0.00 H new ATOM 0 HD11 LEU A 897 -3.445 -0.664 0.142 1.00 0.00 H new ATOM 0 HD12 LEU A 897 -4.773 -1.100 -0.961 1.00 0.00 H new ATOM 0 HD13 LEU A 897 -3.362 -0.207 -1.576 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -3.121 1.650 0.855 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -3.029 2.226 -0.827 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -4.214 2.938 0.294 1.00 0.00 H new ATOM 1688 N ARG A 898 -4.111 0.451 -4.173 1.00 0.00 N ATOM 1689 CA ARG A 898 -3.154 -0.392 -4.874 1.00 0.00 C ATOM 1690 C ARG A 898 -2.269 0.457 -5.775 1.00 0.00 C ATOM 1691 O ARG A 898 -1.054 0.278 -5.806 1.00 0.00 O ATOM 1692 CB ARG A 898 -3.867 -1.468 -5.700 1.00 0.00 C ATOM 1693 CG ARG A 898 -2.907 -2.409 -6.411 1.00 0.00 C ATOM 1694 CD ARG A 898 -3.615 -3.624 -6.991 1.00 0.00 C ATOM 1695 NE ARG A 898 -4.499 -3.295 -8.108 1.00 0.00 N ATOM 1696 CZ ARG A 898 -4.768 -4.138 -9.108 1.00 0.00 C ATOM 1697 NH1 ARG A 898 -4.152 -5.315 -9.172 1.00 0.00 N ATOM 1698 NH2 ARG A 898 -5.633 -3.794 -10.049 1.00 0.00 N ATOM 0 H ARG A 898 -5.088 0.244 -4.379 1.00 0.00 H new ATOM 0 HA ARG A 898 -2.533 -0.891 -4.130 1.00 0.00 H new ATOM 0 HB2 ARG A 898 -4.517 -2.049 -5.045 1.00 0.00 H new ATOM 0 HB3 ARG A 898 -4.507 -0.986 -6.439 1.00 0.00 H new ATOM 0 HG2 ARG A 898 -2.399 -1.870 -7.211 1.00 0.00 H new ATOM 0 HG3 ARG A 898 -2.139 -2.738 -5.711 1.00 0.00 H new ATOM 0 HD2 ARG A 898 -2.870 -4.346 -7.326 1.00 0.00 H new ATOM 0 HD3 ARG A 898 -4.196 -4.107 -6.206 1.00 0.00 H new ATOM 0 HE ARG A 898 -4.933 -2.372 -8.124 1.00 0.00 H new ATOM 0 HH11 ARG A 898 -3.473 -5.575 -8.457 1.00 0.00 H new ATOM 0 HH12 ARG A 898 -4.359 -5.958 -9.937 1.00 0.00 H new ATOM 0 HH21 ARG A 898 -6.094 -2.885 -10.010 1.00 0.00 H new ATOM 0 HH22 ARG A 898 -5.838 -4.438 -10.813 1.00 0.00 H new ATOM 1712 N MET A 899 -2.889 1.391 -6.485 1.00 0.00 N ATOM 1713 CA MET A 899 -2.172 2.306 -7.362 1.00 0.00 C ATOM 1714 C MET A 899 -1.157 3.127 -6.576 1.00 0.00 C ATOM 1715 O MET A 899 0.000 3.233 -6.972 1.00 0.00 O ATOM 1716 CB MET A 899 -3.156 3.236 -8.074 1.00 0.00 C ATOM 1717 CG MET A 899 -2.497 4.205 -9.042 1.00 0.00 C ATOM 1718 SD MET A 899 -3.679 5.329 -9.813 1.00 0.00 S ATOM 1719 CE MET A 899 -4.308 6.199 -8.379 1.00 0.00 C ATOM 0 H MET A 899 -3.899 1.535 -6.469 1.00 0.00 H new ATOM 0 HA MET A 899 -1.637 1.715 -8.106 1.00 0.00 H new ATOM 0 HB2 MET A 899 -3.883 2.632 -8.618 1.00 0.00 H new ATOM 0 HB3 MET A 899 -3.709 3.804 -7.326 1.00 0.00 H new ATOM 0 HG2 MET A 899 -1.742 4.786 -8.511 1.00 0.00 H new ATOM 0 HG3 MET A 899 -1.978 3.641 -9.818 1.00 0.00 H new ATOM 0 HE1 MET A 899 -4.399 7.261 -8.608 1.00 0.00 H new ATOM 0 HE2 MET A 899 -5.287 5.801 -8.112 1.00 0.00 H new ATOM 0 HE3 MET A 899 -3.622 6.066 -7.543 1.00 0.00 H new ATOM 1729 N ALA A 900 -1.592 3.690 -5.452 1.00 0.00 N ATOM 1730 CA ALA A 900 -0.717 4.496 -4.607 1.00 0.00 C ATOM 1731 C ALA A 900 0.446 3.667 -4.076 1.00 0.00 C ATOM 1732 O ALA A 900 1.596 4.108 -4.092 1.00 0.00 O ATOM 1733 CB ALA A 900 -1.505 5.102 -3.453 1.00 0.00 C ATOM 0 H ALA A 900 -2.547 3.602 -5.105 1.00 0.00 H new ATOM 0 HA ALA A 900 -0.308 5.303 -5.216 1.00 0.00 H new ATOM 0 HB1 ALA A 900 -0.838 5.700 -2.832 1.00 0.00 H new ATOM 0 HB2 ALA A 900 -2.299 5.736 -3.848 1.00 0.00 H new ATOM 0 HB3 ALA A 900 -1.942 4.304 -2.852 1.00 0.00 H new ATOM 1739 N THR A 901 0.141 2.462 -3.614 1.00 0.00 N ATOM 1740 CA THR A 901 1.160 1.555 -3.112 1.00 0.00 C ATOM 1741 C THR A 901 2.118 1.151 -4.227 1.00 0.00 C ATOM 1742 O THR A 901 3.336 1.173 -4.058 1.00 0.00 O ATOM 1743 CB THR A 901 0.529 0.287 -2.515 1.00 0.00 C ATOM 1744 OG1 THR A 901 -0.434 0.636 -1.516 1.00 0.00 O ATOM 1745 CG2 THR A 901 1.597 -0.608 -1.903 1.00 0.00 C ATOM 0 H THR A 901 -0.808 2.090 -3.577 1.00 0.00 H new ATOM 0 HA THR A 901 1.708 2.083 -2.332 1.00 0.00 H new ATOM 0 HB THR A 901 0.033 -0.256 -3.319 1.00 0.00 H new ATOM 0 HG1 THR A 901 -1.233 1.005 -1.947 1.00 0.00 H new ATOM 0 HG21 THR A 901 1.129 -1.500 -1.486 1.00 0.00 H new ATOM 0 HG22 THR A 901 2.312 -0.899 -2.672 1.00 0.00 H new ATOM 0 HG23 THR A 901 2.116 -0.067 -1.112 1.00 0.00 H new ATOM 1753 N ASN A 902 1.549 0.789 -5.368 1.00 0.00 N ATOM 1754 CA ASN A 902 2.327 0.373 -6.519 1.00 0.00 C ATOM 1755 C ASN A 902 3.215 1.528 -6.988 1.00 0.00 C ATOM 1756 O ASN A 902 4.375 1.336 -7.323 1.00 0.00 O ATOM 1757 CB ASN A 902 1.399 -0.078 -7.652 1.00 0.00 C ATOM 1758 CG ASN A 902 2.108 -0.902 -8.714 1.00 0.00 C ATOM 1759 OD1 ASN A 902 3.296 -0.723 -8.974 1.00 0.00 O ATOM 1760 ND2 ASN A 902 1.378 -1.813 -9.338 1.00 0.00 N ATOM 0 H ASN A 902 0.540 0.776 -5.519 1.00 0.00 H new ATOM 0 HA ASN A 902 2.960 -0.468 -6.235 1.00 0.00 H new ATOM 0 HB2 ASN A 902 0.582 -0.664 -7.232 1.00 0.00 H new ATOM 0 HB3 ASN A 902 0.954 0.800 -8.120 1.00 0.00 H new ATOM 0 HD21 ASN A 902 1.799 -2.395 -10.062 1.00 0.00 H new ATOM 0 HD22 ASN A 902 0.395 -1.933 -9.095 1.00 0.00 H new ATOM 1767 N ALA A 903 2.659 2.737 -6.989 1.00 0.00 N ATOM 1768 CA ALA A 903 3.417 3.929 -7.354 1.00 0.00 C ATOM 1769 C ALA A 903 4.573 4.149 -6.385 1.00 0.00 C ATOM 1770 O ALA A 903 5.691 4.470 -6.795 1.00 0.00 O ATOM 1771 CB ALA A 903 2.512 5.152 -7.385 1.00 0.00 C ATOM 0 H ALA A 903 1.686 2.916 -6.741 1.00 0.00 H new ATOM 0 HA ALA A 903 3.828 3.778 -8.352 1.00 0.00 H new ATOM 0 HB1 ALA A 903 3.096 6.030 -7.659 1.00 0.00 H new ATOM 0 HB2 ALA A 903 1.720 5.000 -8.118 1.00 0.00 H new ATOM 0 HB3 ALA A 903 2.071 5.303 -6.400 1.00 0.00 H new ATOM 1777 N ALA A 904 4.305 3.963 -5.096 1.00 0.00 N ATOM 1778 CA ALA A 904 5.338 4.066 -4.072 1.00 0.00 C ATOM 1779 C ALA A 904 6.407 3.000 -4.290 1.00 0.00 C ATOM 1780 O ALA A 904 7.575 3.201 -3.961 1.00 0.00 O ATOM 1781 CB ALA A 904 4.730 3.937 -2.682 1.00 0.00 C ATOM 0 H ALA A 904 3.377 3.739 -4.735 1.00 0.00 H new ATOM 0 HA ALA A 904 5.806 5.048 -4.150 1.00 0.00 H new ATOM 0 HB1 ALA A 904 5.517 4.016 -1.932 1.00 0.00 H new ATOM 0 HB2 ALA A 904 4.001 4.732 -2.529 1.00 0.00 H new ATOM 0 HB3 ALA A 904 4.237 2.970 -2.589 1.00 0.00 H new ATOM 1787 N ALA A 905 5.994 1.876 -4.865 1.00 0.00 N ATOM 1788 CA ALA A 905 6.906 0.791 -5.199 1.00 0.00 C ATOM 1789 C ALA A 905 7.925 1.236 -6.251 1.00 0.00 C ATOM 1790 O ALA A 905 9.090 0.843 -6.203 1.00 0.00 O ATOM 1791 CB ALA A 905 6.118 -0.419 -5.687 1.00 0.00 C ATOM 0 H ALA A 905 5.021 1.693 -5.111 1.00 0.00 H new ATOM 0 HA ALA A 905 7.457 0.512 -4.301 1.00 0.00 H new ATOM 0 HB1 ALA A 905 6.807 -1.226 -5.935 1.00 0.00 H new ATOM 0 HB2 ALA A 905 5.438 -0.751 -4.903 1.00 0.00 H new ATOM 0 HB3 ALA A 905 5.545 -0.147 -6.573 1.00 0.00 H new ATOM 1797 N GLN A 906 7.483 2.067 -7.195 1.00 0.00 N ATOM 1798 CA GLN A 906 8.383 2.613 -8.211 1.00 0.00 C ATOM 1799 C GLN A 906 9.219 3.757 -7.644 1.00 0.00 C ATOM 1800 O GLN A 906 10.310 4.046 -8.140 1.00 0.00 O ATOM 1801 CB GLN A 906 7.612 3.109 -9.441 1.00 0.00 C ATOM 1802 CG GLN A 906 7.185 2.013 -10.410 1.00 0.00 C ATOM 1803 CD GLN A 906 5.983 1.222 -9.935 1.00 0.00 C ATOM 1804 OE1 GLN A 906 4.839 1.600 -10.199 1.00 0.00 O ATOM 1805 NE2 GLN A 906 6.225 0.106 -9.267 1.00 0.00 N ATOM 0 H GLN A 906 6.514 2.375 -7.277 1.00 0.00 H new ATOM 0 HA GLN A 906 9.044 1.802 -8.517 1.00 0.00 H new ATOM 0 HB2 GLN A 906 6.724 3.644 -9.105 1.00 0.00 H new ATOM 0 HB3 GLN A 906 8.233 3.827 -9.977 1.00 0.00 H new ATOM 0 HG2 GLN A 906 6.956 2.462 -11.376 1.00 0.00 H new ATOM 0 HG3 GLN A 906 8.021 1.331 -10.566 1.00 0.00 H new ATOM 0 HE21 GLN A 906 7.186 -0.172 -9.069 1.00 0.00 H new ATOM 0 HE22 GLN A 906 5.450 -0.477 -8.950 1.00 0.00 H new ATOM 1814 N ASN A 907 8.700 4.413 -6.610 1.00 0.00 N ATOM 1815 CA ASN A 907 9.415 5.512 -5.960 1.00 0.00 C ATOM 1816 C ASN A 907 10.495 4.979 -5.035 1.00 0.00 C ATOM 1817 O ASN A 907 11.388 5.718 -4.615 1.00 0.00 O ATOM 1818 CB ASN A 907 8.458 6.404 -5.163 1.00 0.00 C ATOM 1819 CG ASN A 907 7.744 7.425 -6.027 1.00 0.00 C ATOM 1820 OD1 ASN A 907 8.236 8.533 -6.236 1.00 0.00 O ATOM 1821 ND2 ASN A 907 6.577 7.062 -6.532 1.00 0.00 N ATOM 0 H ASN A 907 7.788 4.205 -6.203 1.00 0.00 H new ATOM 0 HA ASN A 907 9.877 6.109 -6.747 1.00 0.00 H new ATOM 0 HB2 ASN A 907 7.719 5.779 -4.663 1.00 0.00 H new ATOM 0 HB3 ASN A 907 9.017 6.922 -4.384 1.00 0.00 H new ATOM 0 HD21 ASN A 907 6.051 7.710 -7.118 1.00 0.00 H new ATOM 0 HD22 ASN A 907 6.203 6.134 -6.335 1.00 0.00 H new ATOM 1828 N ALA A 908 10.401 3.694 -4.717 1.00 0.00 N ATOM 1829 CA ALA A 908 11.367 3.040 -3.854 1.00 0.00 C ATOM 1830 C ALA A 908 12.765 3.128 -4.446 1.00 0.00 C ATOM 1831 O ALA A 908 12.982 2.755 -5.601 1.00 0.00 O ATOM 1832 CB ALA A 908 10.981 1.589 -3.640 1.00 0.00 C ATOM 0 H ALA A 908 9.656 3.082 -5.050 1.00 0.00 H new ATOM 0 HA ALA A 908 11.368 3.552 -2.892 1.00 0.00 H new ATOM 0 HB1 ALA A 908 11.714 1.110 -2.991 1.00 0.00 H new ATOM 0 HB2 ALA A 908 9.996 1.539 -3.175 1.00 0.00 H new ATOM 0 HB3 ALA A 908 10.955 1.074 -4.600 1.00 0.00 H new ATOM 1838 N ILE A 909 13.697 3.643 -3.656 1.00 0.00 N ATOM 1839 CA ILE A 909 15.088 3.739 -4.069 1.00 0.00 C ATOM 1840 C ILE A 909 15.610 2.360 -4.457 1.00 0.00 C ATOM 1841 O ILE A 909 15.497 1.405 -3.685 1.00 0.00 O ATOM 1842 CB ILE A 909 15.965 4.336 -2.947 1.00 0.00 C ATOM 1843 CG1 ILE A 909 15.380 5.673 -2.484 1.00 0.00 C ATOM 1844 CG2 ILE A 909 17.399 4.516 -3.427 1.00 0.00 C ATOM 1845 CD1 ILE A 909 16.120 6.298 -1.323 1.00 0.00 C ATOM 0 H ILE A 909 13.512 4.003 -2.720 1.00 0.00 H new ATOM 0 HA ILE A 909 15.141 4.404 -4.931 1.00 0.00 H new ATOM 0 HB ILE A 909 15.975 3.646 -2.103 1.00 0.00 H new ATOM 0 HG12 ILE A 909 15.385 6.370 -3.322 1.00 0.00 H new ATOM 0 HG13 ILE A 909 14.338 5.523 -2.200 1.00 0.00 H new ATOM 0 HG21 ILE A 909 18.002 4.938 -2.623 1.00 0.00 H new ATOM 0 HG22 ILE A 909 17.809 3.549 -3.719 1.00 0.00 H new ATOM 0 HG23 ILE A 909 17.414 5.190 -4.283 1.00 0.00 H new ATOM 0 HD11 ILE A 909 15.645 7.242 -1.054 1.00 0.00 H new ATOM 0 HD12 ILE A 909 16.093 5.622 -0.468 1.00 0.00 H new ATOM 0 HD13 ILE A 909 17.156 6.482 -1.608 1.00 0.00 H new ATOM 1857 N LYS A 910 16.158 2.264 -5.660 1.00 0.00 N ATOM 1858 CA LYS A 910 16.596 0.990 -6.209 1.00 0.00 C ATOM 1859 C LYS A 910 17.839 0.491 -5.477 1.00 0.00 C ATOM 1860 O LYS A 910 18.958 0.887 -5.802 1.00 0.00 O ATOM 1861 CB LYS A 910 16.874 1.144 -7.707 1.00 0.00 C ATOM 1862 CG LYS A 910 16.853 -0.162 -8.485 1.00 0.00 C ATOM 1863 CD LYS A 910 15.520 -0.878 -8.328 1.00 0.00 C ATOM 1864 CE LYS A 910 15.282 -1.881 -9.446 1.00 0.00 C ATOM 1865 NZ LYS A 910 16.397 -2.855 -9.583 1.00 0.00 N ATOM 0 H LYS A 910 16.310 3.061 -6.278 1.00 0.00 H new ATOM 0 HA LYS A 910 15.806 0.252 -6.071 1.00 0.00 H new ATOM 0 HB2 LYS A 910 16.133 1.820 -8.134 1.00 0.00 H new ATOM 0 HB3 LYS A 910 17.848 1.615 -7.837 1.00 0.00 H new ATOM 0 HG2 LYS A 910 17.039 0.038 -9.540 1.00 0.00 H new ATOM 0 HG3 LYS A 910 17.659 -0.808 -8.136 1.00 0.00 H new ATOM 0 HD2 LYS A 910 15.495 -1.392 -7.367 1.00 0.00 H new ATOM 0 HD3 LYS A 910 14.713 -0.145 -8.319 1.00 0.00 H new ATOM 0 HE2 LYS A 910 14.354 -2.420 -9.255 1.00 0.00 H new ATOM 0 HE3 LYS A 910 15.152 -1.347 -10.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 910 16.123 -3.605 -10.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 910 17.243 -2.366 -9.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 910 16.606 -3.276 -8.655 1.00 0.00 H new ATOM 1879 N LYS A 911 17.615 -0.367 -4.481 1.00 0.00 N ATOM 1880 CA LYS A 911 18.682 -0.894 -3.631 1.00 0.00 C ATOM 1881 C LYS A 911 19.373 0.232 -2.871 1.00 0.00 C ATOM 1882 O LYS A 911 20.528 0.565 -3.208 1.00 0.00 O ATOM 1883 CB LYS A 911 19.708 -1.687 -4.449 1.00 0.00 C ATOM 1884 CG LYS A 911 19.172 -2.994 -5.008 1.00 0.00 C ATOM 1885 CD LYS A 911 18.720 -3.930 -3.903 1.00 0.00 C ATOM 1886 CE LYS A 911 18.312 -5.284 -4.456 1.00 0.00 C ATOM 1887 NZ LYS A 911 17.756 -6.171 -3.401 1.00 0.00 N ATOM 1888 OXT LYS A 911 18.747 0.800 -1.953 1.00 0.00 O ATOM 0 H LYS A 911 16.687 -0.716 -4.241 1.00 0.00 H new ATOM 0 HA LYS A 911 18.223 -1.573 -2.912 1.00 0.00 H new ATOM 0 HB2 LYS A 911 20.058 -1.067 -5.274 1.00 0.00 H new ATOM 0 HB3 LYS A 911 20.573 -1.899 -3.821 1.00 0.00 H new ATOM 0 HG2 LYS A 911 18.336 -2.789 -5.677 1.00 0.00 H new ATOM 0 HG3 LYS A 911 19.945 -3.480 -5.604 1.00 0.00 H new ATOM 0 HD2 LYS A 911 19.526 -4.058 -3.180 1.00 0.00 H new ATOM 0 HD3 LYS A 911 17.880 -3.486 -3.368 1.00 0.00 H new ATOM 0 HE2 LYS A 911 17.570 -5.146 -5.242 1.00 0.00 H new ATOM 0 HE3 LYS A 911 19.177 -5.764 -4.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 911 17.712 -7.147 -3.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 911 18.367 -6.136 -2.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 911 16.799 -5.851 -3.147 1.00 0.00 H new TER 1902 LYS A 911