USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 903 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 826 TYR OH : rot 0:sc= -0.995 USER MOD Set 1.2: A 880 SER OG : rot 81:sc= 1.23 USER MOD Set 2.1: A 804 GLN : amide:sc= 0.879 K(o=2.7,f=0.6!) USER MOD Set 2.2: A 808 SER OG : rot 86:sc= 0.967 USER MOD Set 2.3: A 810 TYR OH : rot 150:sc= 0.822 USER MOD Single : A 775 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 776 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 781 GLN : amide:sc= 0.5 K(o=0.5,f=-0.00088) USER MOD Single : A 786 GLN : amide:sc= -0.109 K(o=-0.11,f=-5.4!) USER MOD Single : A 789 GLN : amide:sc= 1.06 K(o=1.1,f=-0.0067) USER MOD Single : A 793 THR OG1 : rot 180:sc= 0 USER MOD Single : A 795 SER OG : rot 180:sc= 0.0258 USER MOD Single : A 802 ASN : amide:sc= 0.114 K(o=0.11,f=-1.9!) USER MOD Single : A 806 HIS : no HD1:sc= -0.0948 X(o=-0.095,f=0.014) USER MOD Single : A 811 TYR OH : rot 153:sc= 0.599 USER MOD Single : A 817 THR OG1 : rot -66:sc= 1.32 USER MOD Single : A 823 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 827 THR OG1 : rot 180:sc= -0.137 USER MOD Single : A 831 THR OG1 : rot 180:sc= 0.0731 USER MOD Single : A 832 SER OG : rot 180:sc= -0.203 USER MOD Single : A 839 GLN : amide:sc= -0.52 X(o=-0.52,f=-0.52) USER MOD Single : A 840 THR OG1 : rot 89:sc= 1.23 USER MOD Single : A 842 HIS : no HE2:sc= 1.16 K(o=1.2,f=-5!) USER MOD Single : A 845 LYS NZ :NH3+ -107:sc= 1.65 (180deg=-0.383) USER MOD Single : A 850 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 852 ASN : amide:sc= 0 X(o=0,f=0.0064) USER MOD Single : A 857 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 858 GLN : amide:sc= 0 X(o=0,f=-0.00066) USER MOD Single : A 860 CYS SG : rot 65:sc= -2.14! USER MOD Single : A 862 THR OG1 : rot 79:sc= 0.981 USER MOD Single : A 865 HIS : no HD1:sc= -0.398 X(o=-0.4,f=0.0053) USER MOD Single : A 870 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 877 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0297) USER MOD Single : A 878 TYR OH : rot 180:sc= 0 USER MOD Single : A 884 SER OG : rot 28:sc= -0.427 USER MOD Single : A 885 TYR OH : rot 180:sc= -1.48! USER MOD Single : A 887 LYS NZ :NH3+ -177:sc= -1.03 (180deg=-1.1) USER MOD Single : A 888 SER OG : rot 51:sc= 1.13 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 775 -26.310 21.381 4.839 1.00 0.00 N ATOM 2 CA MET A 775 -26.101 21.902 6.207 1.00 0.00 C ATOM 3 C MET A 775 -24.640 21.772 6.626 1.00 0.00 C ATOM 4 O MET A 775 -24.044 22.732 7.100 1.00 0.00 O ATOM 5 CB MET A 775 -26.991 21.152 7.201 1.00 0.00 C ATOM 6 CG MET A 775 -27.000 21.761 8.594 1.00 0.00 C ATOM 7 SD MET A 775 -28.431 21.251 9.562 1.00 0.00 S ATOM 8 CE MET A 775 -29.491 22.683 9.370 1.00 0.00 C ATOM 0 HA MET A 775 -26.369 22.959 6.208 1.00 0.00 H new ATOM 0 HB2 MET A 775 -28.011 21.130 6.817 1.00 0.00 H new ATOM 0 HB3 MET A 775 -26.654 20.118 7.268 1.00 0.00 H new ATOM 0 HG2 MET A 775 -26.089 21.473 9.119 1.00 0.00 H new ATOM 0 HG3 MET A 775 -26.990 22.848 8.512 1.00 0.00 H new ATOM 0 HE1 MET A 775 -30.422 22.522 9.914 1.00 0.00 H new ATOM 0 HE2 MET A 775 -28.987 23.565 9.766 1.00 0.00 H new ATOM 0 HE3 MET A 775 -29.710 22.835 8.313 1.00 0.00 H new ATOM 20 N GLN A 776 -24.066 20.586 6.440 1.00 0.00 N ATOM 21 CA GLN A 776 -22.700 20.315 6.891 1.00 0.00 C ATOM 22 C GLN A 776 -21.655 20.960 5.981 1.00 0.00 C ATOM 23 O GLN A 776 -20.482 21.045 6.341 1.00 0.00 O ATOM 24 CB GLN A 776 -22.456 18.807 6.972 1.00 0.00 C ATOM 25 CG GLN A 776 -22.536 18.257 8.386 1.00 0.00 C ATOM 26 CD GLN A 776 -23.759 17.382 8.599 1.00 0.00 C ATOM 27 OE1 GLN A 776 -24.871 17.751 8.224 1.00 0.00 O ATOM 28 NE2 GLN A 776 -23.559 16.217 9.199 1.00 0.00 N ATOM 0 H GLN A 776 -24.523 19.798 5.981 1.00 0.00 H new ATOM 0 HA GLN A 776 -22.595 20.756 7.882 1.00 0.00 H new ATOM 0 HB2 GLN A 776 -23.189 18.294 6.349 1.00 0.00 H new ATOM 0 HB3 GLN A 776 -21.473 18.583 6.558 1.00 0.00 H new ATOM 0 HG2 GLN A 776 -21.637 17.678 8.599 1.00 0.00 H new ATOM 0 HG3 GLN A 776 -22.557 19.085 9.094 1.00 0.00 H new ATOM 0 HE21 GLN A 776 -22.620 15.950 9.494 1.00 0.00 H new ATOM 0 HE22 GLN A 776 -24.344 15.588 9.366 1.00 0.00 H new ATOM 37 N GLU A 777 -22.075 21.403 4.805 1.00 0.00 N ATOM 38 CA GLU A 777 -21.165 22.050 3.866 1.00 0.00 C ATOM 39 C GLU A 777 -21.011 23.518 4.234 1.00 0.00 C ATOM 40 O GLU A 777 -19.952 23.956 4.683 1.00 0.00 O ATOM 41 CB GLU A 777 -21.672 21.922 2.422 1.00 0.00 C ATOM 42 CG GLU A 777 -22.751 20.866 2.225 1.00 0.00 C ATOM 43 CD GLU A 777 -24.143 21.394 2.514 1.00 0.00 C ATOM 44 OE1 GLU A 777 -24.284 22.268 3.395 1.00 0.00 O ATOM 45 OE2 GLU A 777 -25.108 20.918 1.889 1.00 0.00 O ATOM 0 H GLU A 777 -23.038 21.327 4.477 1.00 0.00 H new ATOM 0 HA GLU A 777 -20.197 21.553 3.928 1.00 0.00 H new ATOM 0 HB2 GLU A 777 -22.063 22.887 2.100 1.00 0.00 H new ATOM 0 HB3 GLU A 777 -20.828 21.687 1.773 1.00 0.00 H new ATOM 0 HG2 GLU A 777 -22.711 20.498 1.200 1.00 0.00 H new ATOM 0 HG3 GLU A 777 -22.546 20.016 2.876 1.00 0.00 H new ATOM 52 N ALA A 778 -22.083 24.274 4.063 1.00 0.00 N ATOM 53 CA ALA A 778 -22.095 25.674 4.454 1.00 0.00 C ATOM 54 C ALA A 778 -22.524 25.799 5.907 1.00 0.00 C ATOM 55 O ALA A 778 -23.462 26.523 6.242 1.00 0.00 O ATOM 56 CB ALA A 778 -23.011 26.479 3.547 1.00 0.00 C ATOM 0 H ALA A 778 -22.957 23.941 3.656 1.00 0.00 H new ATOM 0 HA ALA A 778 -21.088 26.078 4.351 1.00 0.00 H new ATOM 0 HB1 ALA A 778 -23.005 27.524 3.858 1.00 0.00 H new ATOM 0 HB2 ALA A 778 -22.661 26.405 2.518 1.00 0.00 H new ATOM 0 HB3 ALA A 778 -24.026 26.087 3.614 1.00 0.00 H new ATOM 62 N VAL A 779 -21.832 25.065 6.760 1.00 0.00 N ATOM 63 CA VAL A 779 -22.144 25.030 8.175 1.00 0.00 C ATOM 64 C VAL A 779 -21.428 26.157 8.909 1.00 0.00 C ATOM 65 O VAL A 779 -20.415 26.676 8.432 1.00 0.00 O ATOM 66 CB VAL A 779 -21.753 23.659 8.788 1.00 0.00 C ATOM 67 CG1 VAL A 779 -20.244 23.519 8.923 1.00 0.00 C ATOM 68 CG2 VAL A 779 -22.437 23.445 10.131 1.00 0.00 C ATOM 0 H VAL A 779 -21.041 24.479 6.492 1.00 0.00 H new ATOM 0 HA VAL A 779 -23.219 25.167 8.289 1.00 0.00 H new ATOM 0 HB VAL A 779 -22.099 22.885 8.103 1.00 0.00 H new ATOM 0 HG11 VAL A 779 -20.006 22.547 9.356 1.00 0.00 H new ATOM 0 HG12 VAL A 779 -19.782 23.601 7.939 1.00 0.00 H new ATOM 0 HG13 VAL A 779 -19.862 24.308 9.571 1.00 0.00 H new ATOM 0 HG21 VAL A 779 -22.145 22.477 10.538 1.00 0.00 H new ATOM 0 HG22 VAL A 779 -22.138 24.234 10.821 1.00 0.00 H new ATOM 0 HG23 VAL A 779 -23.518 23.471 9.997 1.00 0.00 H new ATOM 78 N LEU A 780 -21.978 26.553 10.051 1.00 0.00 N ATOM 79 CA LEU A 780 -21.338 27.536 10.914 1.00 0.00 C ATOM 80 C LEU A 780 -19.919 27.084 11.239 1.00 0.00 C ATOM 81 O LEU A 780 -18.964 27.840 11.069 1.00 0.00 O ATOM 82 CB LEU A 780 -22.143 27.721 12.206 1.00 0.00 C ATOM 83 CG LEU A 780 -23.448 26.922 12.284 1.00 0.00 C ATOM 84 CD1 LEU A 780 -23.354 25.847 13.358 1.00 0.00 C ATOM 85 CD2 LEU A 780 -24.621 27.852 12.551 1.00 0.00 C ATOM 0 H LEU A 780 -22.871 26.206 10.401 1.00 0.00 H new ATOM 0 HA LEU A 780 -21.300 28.493 10.393 1.00 0.00 H new ATOM 0 HB2 LEU A 780 -21.513 27.440 13.050 1.00 0.00 H new ATOM 0 HB3 LEU A 780 -22.377 28.779 12.321 1.00 0.00 H new ATOM 0 HG LEU A 780 -23.612 26.429 11.326 1.00 0.00 H new ATOM 0 HD11 LEU A 780 -24.290 25.290 13.398 1.00 0.00 H new ATOM 0 HD12 LEU A 780 -22.537 25.166 13.121 1.00 0.00 H new ATOM 0 HD13 LEU A 780 -23.168 26.314 14.325 1.00 0.00 H new ATOM 0 HD21 LEU A 780 -25.542 27.271 12.604 1.00 0.00 H new ATOM 0 HD22 LEU A 780 -24.465 28.372 13.496 1.00 0.00 H new ATOM 0 HD23 LEU A 780 -24.698 28.581 11.744 1.00 0.00 H new ATOM 97 N GLN A 781 -19.812 25.831 11.681 1.00 0.00 N ATOM 98 CA GLN A 781 -18.535 25.182 11.976 1.00 0.00 C ATOM 99 C GLN A 781 -18.808 23.826 12.595 1.00 0.00 C ATOM 100 O GLN A 781 -18.194 22.823 12.219 1.00 0.00 O ATOM 101 CB GLN A 781 -17.676 26.036 12.919 1.00 0.00 C ATOM 102 CG GLN A 781 -16.960 25.276 14.026 1.00 0.00 C ATOM 103 CD GLN A 781 -16.158 26.200 14.923 1.00 0.00 C ATOM 104 OE1 GLN A 781 -16.661 26.700 15.928 1.00 0.00 O ATOM 105 NE2 GLN A 781 -14.912 26.446 14.561 1.00 0.00 N ATOM 0 H GLN A 781 -20.620 25.231 11.846 1.00 0.00 H new ATOM 0 HA GLN A 781 -17.977 25.063 11.047 1.00 0.00 H new ATOM 0 HB2 GLN A 781 -16.930 26.564 12.324 1.00 0.00 H new ATOM 0 HB3 GLN A 781 -18.313 26.793 13.376 1.00 0.00 H new ATOM 0 HG2 GLN A 781 -17.692 24.734 14.625 1.00 0.00 H new ATOM 0 HG3 GLN A 781 -16.296 24.533 13.585 1.00 0.00 H new ATOM 0 HE21 GLN A 781 -14.530 26.012 13.721 1.00 0.00 H new ATOM 0 HE22 GLN A 781 -14.332 27.070 15.122 1.00 0.00 H new ATOM 114 N LEU A 782 -19.751 23.820 13.535 1.00 0.00 N ATOM 115 CA LEU A 782 -20.153 22.622 14.253 1.00 0.00 C ATOM 116 C LEU A 782 -19.008 22.120 15.124 1.00 0.00 C ATOM 117 O LEU A 782 -18.932 22.440 16.311 1.00 0.00 O ATOM 118 CB LEU A 782 -20.634 21.531 13.279 1.00 0.00 C ATOM 119 CG LEU A 782 -21.138 20.241 13.929 1.00 0.00 C ATOM 120 CD1 LEU A 782 -22.411 20.500 14.720 1.00 0.00 C ATOM 121 CD2 LEU A 782 -21.371 19.172 12.873 1.00 0.00 C ATOM 0 H LEU A 782 -20.260 24.657 13.819 1.00 0.00 H new ATOM 0 HA LEU A 782 -20.991 22.872 14.903 1.00 0.00 H new ATOM 0 HB2 LEU A 782 -21.434 21.944 12.665 1.00 0.00 H new ATOM 0 HB3 LEU A 782 -19.813 21.281 12.607 1.00 0.00 H new ATOM 0 HG LEU A 782 -20.375 19.883 14.621 1.00 0.00 H new ATOM 0 HD11 LEU A 782 -22.753 19.570 15.174 1.00 0.00 H new ATOM 0 HD12 LEU A 782 -22.211 21.233 15.501 1.00 0.00 H new ATOM 0 HD13 LEU A 782 -23.183 20.883 14.052 1.00 0.00 H new ATOM 0 HD21 LEU A 782 -21.729 18.260 13.351 1.00 0.00 H new ATOM 0 HD22 LEU A 782 -22.115 19.523 12.158 1.00 0.00 H new ATOM 0 HD23 LEU A 782 -20.436 18.965 12.352 1.00 0.00 H new ATOM 133 N ILE A 783 -18.104 21.358 14.524 1.00 0.00 N ATOM 134 CA ILE A 783 -16.959 20.812 15.241 1.00 0.00 C ATOM 135 C ILE A 783 -15.726 20.831 14.347 1.00 0.00 C ATOM 136 O ILE A 783 -14.663 20.355 14.739 1.00 0.00 O ATOM 137 CB ILE A 783 -17.188 19.360 15.736 1.00 0.00 C ATOM 138 CG1 ILE A 783 -18.683 19.026 15.871 1.00 0.00 C ATOM 139 CG2 ILE A 783 -16.466 19.138 17.058 1.00 0.00 C ATOM 140 CD1 ILE A 783 -19.260 19.248 17.258 1.00 0.00 C ATOM 0 H ILE A 783 -18.142 21.103 13.537 1.00 0.00 H new ATOM 0 HA ILE A 783 -16.816 21.445 16.117 1.00 0.00 H new ATOM 0 HB ILE A 783 -16.775 18.685 14.986 1.00 0.00 H new ATOM 0 HG12 ILE A 783 -19.243 19.632 15.158 1.00 0.00 H new ATOM 0 HG13 ILE A 783 -18.835 17.983 15.592 1.00 0.00 H new ATOM 0 HG21 ILE A 783 -16.633 18.116 17.397 1.00 0.00 H new ATOM 0 HG22 ILE A 783 -15.398 19.305 16.922 1.00 0.00 H new ATOM 0 HG23 ILE A 783 -16.850 19.834 17.804 1.00 0.00 H new ATOM 0 HD11 ILE A 783 -20.318 18.987 17.258 1.00 0.00 H new ATOM 0 HD12 ILE A 783 -18.731 18.622 17.977 1.00 0.00 H new ATOM 0 HD13 ILE A 783 -19.145 20.296 17.536 1.00 0.00 H new ATOM 152 N GLU A 784 -15.898 21.357 13.129 1.00 0.00 N ATOM 153 CA GLU A 784 -14.817 21.483 12.137 1.00 0.00 C ATOM 154 C GLU A 784 -14.406 20.133 11.544 1.00 0.00 C ATOM 155 O GLU A 784 -13.798 20.080 10.474 1.00 0.00 O ATOM 156 CB GLU A 784 -13.588 22.173 12.737 1.00 0.00 C ATOM 157 CG GLU A 784 -13.846 23.607 13.149 1.00 0.00 C ATOM 158 CD GLU A 784 -13.595 24.599 12.034 1.00 0.00 C ATOM 159 OE1 GLU A 784 -13.633 24.208 10.847 1.00 0.00 O ATOM 160 OE2 GLU A 784 -13.363 25.784 12.343 1.00 0.00 O ATOM 0 H GLU A 784 -16.796 21.710 12.799 1.00 0.00 H new ATOM 0 HA GLU A 784 -15.217 22.098 11.331 1.00 0.00 H new ATOM 0 HB2 GLU A 784 -13.251 21.608 13.606 1.00 0.00 H new ATOM 0 HB3 GLU A 784 -12.777 22.152 12.009 1.00 0.00 H new ATOM 0 HG2 GLU A 784 -14.878 23.702 13.486 1.00 0.00 H new ATOM 0 HG3 GLU A 784 -13.209 23.855 13.998 1.00 0.00 H new ATOM 167 N VAL A 785 -14.737 19.047 12.227 1.00 0.00 N ATOM 168 CA VAL A 785 -14.323 17.721 11.794 1.00 0.00 C ATOM 169 C VAL A 785 -15.387 17.095 10.906 1.00 0.00 C ATOM 170 O VAL A 785 -15.133 16.787 9.743 1.00 0.00 O ATOM 171 CB VAL A 785 -14.036 16.787 12.993 1.00 0.00 C ATOM 172 CG1 VAL A 785 -12.572 16.867 13.387 1.00 0.00 C ATOM 173 CG2 VAL A 785 -14.926 17.127 14.182 1.00 0.00 C ATOM 0 H VAL A 785 -15.291 19.058 13.083 1.00 0.00 H new ATOM 0 HA VAL A 785 -13.399 17.842 11.228 1.00 0.00 H new ATOM 0 HB VAL A 785 -14.262 15.766 12.686 1.00 0.00 H new ATOM 0 HG11 VAL A 785 -12.386 16.204 14.232 1.00 0.00 H new ATOM 0 HG12 VAL A 785 -11.951 16.563 12.544 1.00 0.00 H new ATOM 0 HG13 VAL A 785 -12.326 17.891 13.668 1.00 0.00 H new ATOM 0 HG21 VAL A 785 -14.701 16.454 15.009 1.00 0.00 H new ATOM 0 HG22 VAL A 785 -14.742 18.156 14.491 1.00 0.00 H new ATOM 0 HG23 VAL A 785 -15.972 17.015 13.897 1.00 0.00 H new ATOM 183 N GLN A 786 -16.570 16.900 11.483 1.00 0.00 N ATOM 184 CA GLN A 786 -17.742 16.403 10.766 1.00 0.00 C ATOM 185 C GLN A 786 -17.560 14.965 10.272 1.00 0.00 C ATOM 186 O GLN A 786 -18.433 14.427 9.596 1.00 0.00 O ATOM 187 CB GLN A 786 -18.076 17.322 9.591 1.00 0.00 C ATOM 188 CG GLN A 786 -18.990 18.481 9.959 1.00 0.00 C ATOM 189 CD GLN A 786 -18.232 19.658 10.543 1.00 0.00 C ATOM 190 OE1 GLN A 786 -18.110 19.792 11.761 1.00 0.00 O ATOM 191 NE2 GLN A 786 -17.704 20.511 9.679 1.00 0.00 N ATOM 0 H GLN A 786 -16.744 17.084 12.471 1.00 0.00 H new ATOM 0 HA GLN A 786 -18.571 16.400 11.474 1.00 0.00 H new ATOM 0 HB2 GLN A 786 -17.149 17.719 9.178 1.00 0.00 H new ATOM 0 HB3 GLN A 786 -18.549 16.734 8.805 1.00 0.00 H new ATOM 0 HG2 GLN A 786 -19.533 18.807 9.072 1.00 0.00 H new ATOM 0 HG3 GLN A 786 -19.733 18.139 10.679 1.00 0.00 H new ATOM 0 HE21 GLN A 786 -17.828 20.365 8.677 1.00 0.00 H new ATOM 0 HE22 GLN A 786 -17.173 21.315 10.015 1.00 0.00 H new ATOM 200 N LEU A 787 -16.434 14.350 10.622 1.00 0.00 N ATOM 201 CA LEU A 787 -16.124 12.991 10.181 1.00 0.00 C ATOM 202 C LEU A 787 -14.924 12.441 10.945 1.00 0.00 C ATOM 203 O LEU A 787 -14.958 11.325 11.453 1.00 0.00 O ATOM 204 CB LEU A 787 -15.826 12.964 8.674 1.00 0.00 C ATOM 205 CG LEU A 787 -16.501 11.838 7.873 1.00 0.00 C ATOM 206 CD1 LEU A 787 -17.077 10.771 8.791 1.00 0.00 C ATOM 207 CD2 LEU A 787 -17.588 12.408 6.977 1.00 0.00 C ATOM 0 H LEU A 787 -15.717 14.772 11.212 1.00 0.00 H new ATOM 0 HA LEU A 787 -16.994 12.367 10.383 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -16.130 13.919 8.247 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -14.747 12.883 8.539 1.00 0.00 H new ATOM 0 HG LEU A 787 -15.740 11.367 7.251 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -17.547 9.991 8.192 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -16.277 10.336 9.391 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -17.821 11.220 9.449 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -18.058 11.600 6.416 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -18.338 12.909 7.589 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -17.149 13.125 6.283 1.00 0.00 H new ATOM 219 N ALA A 788 -13.864 13.241 11.022 1.00 0.00 N ATOM 220 CA ALA A 788 -12.646 12.842 11.728 1.00 0.00 C ATOM 221 C ALA A 788 -12.893 12.689 13.228 1.00 0.00 C ATOM 222 O ALA A 788 -12.100 12.067 13.937 1.00 0.00 O ATOM 223 CB ALA A 788 -11.538 13.851 11.478 1.00 0.00 C ATOM 0 H ALA A 788 -13.822 14.171 10.604 1.00 0.00 H new ATOM 0 HA ALA A 788 -12.339 11.871 11.340 1.00 0.00 H new ATOM 0 HB1 ALA A 788 -10.638 13.542 12.009 1.00 0.00 H new ATOM 0 HB2 ALA A 788 -11.329 13.904 10.410 1.00 0.00 H new ATOM 0 HB3 ALA A 788 -11.852 14.832 11.836 1.00 0.00 H new ATOM 229 N GLN A 789 -13.983 13.271 13.704 1.00 0.00 N ATOM 230 CA GLN A 789 -14.387 13.154 15.095 1.00 0.00 C ATOM 231 C GLN A 789 -15.904 13.135 15.163 1.00 0.00 C ATOM 232 O GLN A 789 -16.562 13.873 14.420 1.00 0.00 O ATOM 233 CB GLN A 789 -13.832 14.312 15.933 1.00 0.00 C ATOM 234 CG GLN A 789 -12.715 13.905 16.883 1.00 0.00 C ATOM 235 CD GLN A 789 -11.375 14.503 16.494 1.00 0.00 C ATOM 236 OE1 GLN A 789 -10.893 15.440 17.127 1.00 0.00 O ATOM 237 NE2 GLN A 789 -10.762 13.959 15.458 1.00 0.00 N ATOM 0 H GLN A 789 -14.612 13.838 13.136 1.00 0.00 H new ATOM 0 HA GLN A 789 -13.984 12.229 15.506 1.00 0.00 H new ATOM 0 HB2 GLN A 789 -13.461 15.088 15.263 1.00 0.00 H new ATOM 0 HB3 GLN A 789 -14.645 14.752 16.511 1.00 0.00 H new ATOM 0 HG2 GLN A 789 -12.970 14.220 17.895 1.00 0.00 H new ATOM 0 HG3 GLN A 789 -12.634 12.818 16.899 1.00 0.00 H new ATOM 0 HE21 GLN A 789 -11.196 13.182 14.959 1.00 0.00 H new ATOM 0 HE22 GLN A 789 -9.855 14.316 15.157 1.00 0.00 H new ATOM 246 N GLU A 790 -16.438 12.295 16.044 1.00 0.00 N ATOM 247 CA GLU A 790 -17.870 12.062 16.153 1.00 0.00 C ATOM 248 C GLU A 790 -18.421 11.453 14.867 1.00 0.00 C ATOM 249 O GLU A 790 -17.667 11.114 13.953 1.00 0.00 O ATOM 250 CB GLU A 790 -18.597 13.357 16.491 1.00 0.00 C ATOM 251 CG GLU A 790 -19.882 13.163 17.277 1.00 0.00 C ATOM 252 CD GLU A 790 -19.660 13.139 18.775 1.00 0.00 C ATOM 253 OE1 GLU A 790 -18.964 12.226 19.262 1.00 0.00 O ATOM 254 OE2 GLU A 790 -20.188 14.029 19.472 1.00 0.00 O ATOM 0 H GLU A 790 -15.883 11.754 16.707 1.00 0.00 H new ATOM 0 HA GLU A 790 -18.040 11.351 16.962 1.00 0.00 H new ATOM 0 HB2 GLU A 790 -17.927 13.998 17.064 1.00 0.00 H new ATOM 0 HB3 GLU A 790 -18.827 13.884 15.565 1.00 0.00 H new ATOM 0 HG2 GLU A 790 -20.577 13.966 17.031 1.00 0.00 H new ATOM 0 HG3 GLU A 790 -20.352 12.229 16.970 1.00 0.00 H new ATOM 261 N GLU A 791 -19.739 11.317 14.822 1.00 0.00 N ATOM 262 CA GLU A 791 -20.433 10.665 13.706 1.00 0.00 C ATOM 263 C GLU A 791 -19.911 9.242 13.485 1.00 0.00 C ATOM 264 O GLU A 791 -20.041 8.692 12.389 1.00 0.00 O ATOM 265 CB GLU A 791 -20.280 11.494 12.425 1.00 0.00 C ATOM 266 CG GLU A 791 -21.542 11.560 11.578 1.00 0.00 C ATOM 267 CD GLU A 791 -22.628 12.396 12.217 1.00 0.00 C ATOM 268 OE1 GLU A 791 -22.406 13.607 12.419 1.00 0.00 O ATOM 269 OE2 GLU A 791 -23.708 11.850 12.520 1.00 0.00 O ATOM 0 H GLU A 791 -20.363 11.654 15.555 1.00 0.00 H new ATOM 0 HA GLU A 791 -21.491 10.600 13.960 1.00 0.00 H new ATOM 0 HB2 GLU A 791 -19.981 12.507 12.693 1.00 0.00 H new ATOM 0 HB3 GLU A 791 -19.474 11.072 11.825 1.00 0.00 H new ATOM 0 HG2 GLU A 791 -21.297 11.975 10.600 1.00 0.00 H new ATOM 0 HG3 GLU A 791 -21.917 10.550 11.411 1.00 0.00 H new ATOM 276 N VAL A 792 -19.373 8.643 14.562 1.00 0.00 N ATOM 277 CA VAL A 792 -18.682 7.340 14.523 1.00 0.00 C ATOM 278 C VAL A 792 -17.912 7.121 13.211 1.00 0.00 C ATOM 279 O VAL A 792 -17.322 8.050 12.662 1.00 0.00 O ATOM 280 CB VAL A 792 -19.633 6.138 14.788 1.00 0.00 C ATOM 281 CG1 VAL A 792 -19.710 5.850 16.279 1.00 0.00 C ATOM 282 CG2 VAL A 792 -21.031 6.365 14.218 1.00 0.00 C ATOM 0 H VAL A 792 -19.406 9.054 15.495 1.00 0.00 H new ATOM 0 HA VAL A 792 -17.962 7.380 15.340 1.00 0.00 H new ATOM 0 HB VAL A 792 -19.214 5.274 14.272 1.00 0.00 H new ATOM 0 HG11 VAL A 792 -20.378 5.007 16.453 1.00 0.00 H new ATOM 0 HG12 VAL A 792 -18.716 5.608 16.655 1.00 0.00 H new ATOM 0 HG13 VAL A 792 -20.091 6.728 16.800 1.00 0.00 H new ATOM 0 HG21 VAL A 792 -21.656 5.497 14.430 1.00 0.00 H new ATOM 0 HG22 VAL A 792 -21.472 7.250 14.677 1.00 0.00 H new ATOM 0 HG23 VAL A 792 -20.965 6.510 13.140 1.00 0.00 H new ATOM 292 N THR A 793 -17.884 5.884 12.736 1.00 0.00 N ATOM 293 CA THR A 793 -17.256 5.581 11.455 1.00 0.00 C ATOM 294 C THR A 793 -18.149 4.695 10.594 1.00 0.00 C ATOM 295 O THR A 793 -17.811 4.391 9.450 1.00 0.00 O ATOM 296 CB THR A 793 -15.891 4.898 11.645 1.00 0.00 C ATOM 297 OG1 THR A 793 -15.567 4.828 13.038 1.00 0.00 O ATOM 298 CG2 THR A 793 -14.799 5.653 10.904 1.00 0.00 C ATOM 0 H THR A 793 -18.286 5.077 13.214 1.00 0.00 H new ATOM 0 HA THR A 793 -17.106 6.533 10.946 1.00 0.00 H new ATOM 0 HB THR A 793 -15.956 3.890 11.236 1.00 0.00 H new ATOM 0 HG1 THR A 793 -14.697 4.390 13.150 1.00 0.00 H new ATOM 0 HG21 THR A 793 -13.843 5.151 11.054 1.00 0.00 H new ATOM 0 HG22 THR A 793 -15.033 5.679 9.840 1.00 0.00 H new ATOM 0 HG23 THR A 793 -14.737 6.672 11.287 1.00 0.00 H new ATOM 306 N GLU A 794 -19.298 4.308 11.153 1.00 0.00 N ATOM 307 CA GLU A 794 -20.253 3.420 10.487 1.00 0.00 C ATOM 308 C GLU A 794 -19.659 2.030 10.263 1.00 0.00 C ATOM 309 O GLU A 794 -19.886 1.115 11.053 1.00 0.00 O ATOM 310 CB GLU A 794 -20.736 4.021 9.158 1.00 0.00 C ATOM 311 CG GLU A 794 -22.218 4.362 9.152 1.00 0.00 C ATOM 312 CD GLU A 794 -23.091 3.197 8.731 1.00 0.00 C ATOM 313 OE1 GLU A 794 -22.579 2.066 8.631 1.00 0.00 O ATOM 314 OE2 GLU A 794 -24.303 3.411 8.502 1.00 0.00 O ATOM 0 H GLU A 794 -19.593 4.603 12.084 1.00 0.00 H new ATOM 0 HA GLU A 794 -21.114 3.316 11.147 1.00 0.00 H new ATOM 0 HB2 GLU A 794 -20.162 4.923 8.946 1.00 0.00 H new ATOM 0 HB3 GLU A 794 -20.530 3.316 8.353 1.00 0.00 H new ATOM 0 HG2 GLU A 794 -22.514 4.689 10.149 1.00 0.00 H new ATOM 0 HG3 GLU A 794 -22.390 5.200 8.477 1.00 0.00 H new ATOM 321 N SER A 795 -18.898 1.881 9.192 1.00 0.00 N ATOM 322 CA SER A 795 -18.292 0.607 8.848 1.00 0.00 C ATOM 323 C SER A 795 -17.025 0.353 9.669 1.00 0.00 C ATOM 324 O SER A 795 -16.041 1.093 9.565 1.00 0.00 O ATOM 325 CB SER A 795 -17.968 0.577 7.354 1.00 0.00 C ATOM 326 OG SER A 795 -18.823 1.449 6.622 1.00 0.00 O ATOM 0 H SER A 795 -18.684 2.636 8.540 1.00 0.00 H new ATOM 0 HA SER A 795 -19.004 -0.185 9.081 1.00 0.00 H new ATOM 0 HB2 SER A 795 -16.929 0.868 7.199 1.00 0.00 H new ATOM 0 HB3 SER A 795 -18.074 -0.440 6.977 1.00 0.00 H new ATOM 0 HG SER A 795 -18.592 1.411 5.670 1.00 0.00 H new ATOM 332 N PRO A 796 -17.044 -0.686 10.517 1.00 0.00 N ATOM 333 CA PRO A 796 -15.873 -1.104 11.294 1.00 0.00 C ATOM 334 C PRO A 796 -14.845 -1.841 10.433 1.00 0.00 C ATOM 335 O PRO A 796 -14.841 -3.073 10.371 1.00 0.00 O ATOM 336 CB PRO A 796 -16.467 -2.036 12.350 1.00 0.00 C ATOM 337 CG PRO A 796 -17.692 -2.598 11.713 1.00 0.00 C ATOM 338 CD PRO A 796 -18.225 -1.521 10.808 1.00 0.00 C ATOM 0 HA PRO A 796 -15.332 -0.257 11.716 1.00 0.00 H new ATOM 0 HB2 PRO A 796 -15.765 -2.824 12.622 1.00 0.00 H new ATOM 0 HB3 PRO A 796 -16.709 -1.495 13.265 1.00 0.00 H new ATOM 0 HG2 PRO A 796 -17.458 -3.501 11.148 1.00 0.00 H new ATOM 0 HG3 PRO A 796 -18.430 -2.875 12.466 1.00 0.00 H new ATOM 0 HD2 PRO A 796 -18.652 -1.940 9.897 1.00 0.00 H new ATOM 0 HD3 PRO A 796 -19.012 -0.944 11.294 1.00 0.00 H new ATOM 346 N LEU A 797 -13.983 -1.069 9.774 1.00 0.00 N ATOM 347 CA LEU A 797 -12.954 -1.610 8.888 1.00 0.00 C ATOM 348 C LEU A 797 -13.587 -2.455 7.786 1.00 0.00 C ATOM 349 O LEU A 797 -14.553 -2.031 7.146 1.00 0.00 O ATOM 350 CB LEU A 797 -11.933 -2.446 9.669 1.00 0.00 C ATOM 351 CG LEU A 797 -11.448 -1.834 10.982 1.00 0.00 C ATOM 352 CD1 LEU A 797 -11.428 -2.887 12.076 1.00 0.00 C ATOM 353 CD2 LEU A 797 -10.069 -1.220 10.803 1.00 0.00 C ATOM 0 H LEU A 797 -13.978 -0.051 9.839 1.00 0.00 H new ATOM 0 HA LEU A 797 -12.431 -0.768 8.434 1.00 0.00 H new ATOM 0 HB2 LEU A 797 -12.374 -3.419 9.883 1.00 0.00 H new ATOM 0 HB3 LEU A 797 -11.068 -2.622 9.029 1.00 0.00 H new ATOM 0 HG LEU A 797 -12.139 -1.044 11.276 1.00 0.00 H new ATOM 0 HD11 LEU A 797 -11.081 -2.438 13.007 1.00 0.00 H new ATOM 0 HD12 LEU A 797 -12.433 -3.284 12.218 1.00 0.00 H new ATOM 0 HD13 LEU A 797 -10.756 -3.696 11.790 1.00 0.00 H new ATOM 0 HD21 LEU A 797 -9.738 -0.788 11.747 1.00 0.00 H new ATOM 0 HD22 LEU A 797 -9.365 -1.991 10.490 1.00 0.00 H new ATOM 0 HD23 LEU A 797 -10.114 -0.440 10.043 1.00 0.00 H new ATOM 365 N GLY A 798 -13.054 -3.650 7.581 1.00 0.00 N ATOM 366 CA GLY A 798 -13.573 -4.524 6.556 1.00 0.00 C ATOM 367 C GLY A 798 -13.710 -5.955 7.033 1.00 0.00 C ATOM 368 O GLY A 798 -14.812 -6.501 7.061 1.00 0.00 O ATOM 0 H GLY A 798 -12.268 -4.029 8.110 1.00 0.00 H new ATOM 0 HA2 GLY A 798 -14.546 -4.158 6.229 1.00 0.00 H new ATOM 0 HA3 GLY A 798 -12.913 -4.494 5.689 1.00 0.00 H new ATOM 372 N GLY A 799 -12.591 -6.568 7.401 1.00 0.00 N ATOM 373 CA GLY A 799 -12.604 -7.963 7.808 1.00 0.00 C ATOM 374 C GLY A 799 -12.423 -8.874 6.615 1.00 0.00 C ATOM 375 O GLY A 799 -12.157 -10.070 6.748 1.00 0.00 O ATOM 0 H GLY A 799 -11.673 -6.124 7.425 1.00 0.00 H new ATOM 0 HA2 GLY A 799 -11.809 -8.142 8.532 1.00 0.00 H new ATOM 0 HA3 GLY A 799 -13.546 -8.192 8.306 1.00 0.00 H new ATOM 379 N ASP A 800 -12.587 -8.286 5.442 1.00 0.00 N ATOM 380 CA ASP A 800 -12.385 -8.969 4.178 1.00 0.00 C ATOM 381 C ASP A 800 -11.438 -8.135 3.333 1.00 0.00 C ATOM 382 O ASP A 800 -11.722 -7.813 2.178 1.00 0.00 O ATOM 383 CB ASP A 800 -13.717 -9.168 3.449 1.00 0.00 C ATOM 384 CG ASP A 800 -13.935 -10.605 3.024 1.00 0.00 C ATOM 385 OD1 ASP A 800 -13.510 -11.521 3.759 1.00 0.00 O ATOM 386 OD2 ASP A 800 -14.549 -10.833 1.960 1.00 0.00 O ATOM 0 H ASP A 800 -12.867 -7.310 5.341 1.00 0.00 H new ATOM 0 HA ASP A 800 -11.958 -9.956 4.357 1.00 0.00 H new ATOM 0 HB2 ASP A 800 -14.534 -8.857 4.100 1.00 0.00 H new ATOM 0 HB3 ASP A 800 -13.747 -8.524 2.570 1.00 0.00 H new ATOM 391 N GLU A 801 -10.323 -7.767 3.948 1.00 0.00 N ATOM 392 CA GLU A 801 -9.342 -6.871 3.345 1.00 0.00 C ATOM 393 C GLU A 801 -8.882 -7.369 1.977 1.00 0.00 C ATOM 394 O GLU A 801 -8.618 -6.568 1.080 1.00 0.00 O ATOM 395 CB GLU A 801 -8.140 -6.706 4.277 1.00 0.00 C ATOM 396 CG GLU A 801 -8.371 -5.706 5.404 1.00 0.00 C ATOM 397 CD GLU A 801 -9.478 -6.127 6.357 1.00 0.00 C ATOM 398 OE1 GLU A 801 -9.601 -7.337 6.632 1.00 0.00 O ATOM 399 OE2 GLU A 801 -10.236 -5.247 6.819 1.00 0.00 O ATOM 0 H GLU A 801 -10.071 -8.082 4.885 1.00 0.00 H new ATOM 0 HA GLU A 801 -9.824 -5.904 3.198 1.00 0.00 H new ATOM 0 HB2 GLU A 801 -7.891 -7.675 4.709 1.00 0.00 H new ATOM 0 HB3 GLU A 801 -7.278 -6.387 3.691 1.00 0.00 H new ATOM 0 HG2 GLU A 801 -7.445 -5.580 5.965 1.00 0.00 H new ATOM 0 HG3 GLU A 801 -8.619 -4.735 4.975 1.00 0.00 H new ATOM 406 N ASN A 802 -8.801 -8.684 1.813 1.00 0.00 N ATOM 407 CA ASN A 802 -8.406 -9.272 0.538 1.00 0.00 C ATOM 408 C ASN A 802 -9.413 -8.924 -0.552 1.00 0.00 C ATOM 409 O ASN A 802 -9.034 -8.576 -1.667 1.00 0.00 O ATOM 410 CB ASN A 802 -8.265 -10.798 0.661 1.00 0.00 C ATOM 411 CG ASN A 802 -9.479 -11.454 1.300 1.00 0.00 C ATOM 412 OD1 ASN A 802 -9.682 -11.362 2.511 1.00 0.00 O ATOM 413 ND2 ASN A 802 -10.296 -12.111 0.493 1.00 0.00 N ATOM 0 H ASN A 802 -9.003 -9.363 2.546 1.00 0.00 H new ATOM 0 HA ASN A 802 -7.437 -8.855 0.262 1.00 0.00 H new ATOM 0 HB2 ASN A 802 -8.107 -11.224 -0.330 1.00 0.00 H new ATOM 0 HB3 ASN A 802 -7.379 -11.030 1.253 1.00 0.00 H new ATOM 0 HD21 ASN A 802 -11.129 -12.564 0.869 1.00 0.00 H new ATOM 0 HD22 ASN A 802 -10.093 -12.164 -0.505 1.00 0.00 H new ATOM 420 N ALA A 803 -10.696 -8.989 -0.217 1.00 0.00 N ATOM 421 CA ALA A 803 -11.747 -8.677 -1.172 1.00 0.00 C ATOM 422 C ALA A 803 -11.777 -7.183 -1.459 1.00 0.00 C ATOM 423 O ALA A 803 -11.966 -6.766 -2.599 1.00 0.00 O ATOM 424 CB ALA A 803 -13.097 -9.154 -0.658 1.00 0.00 C ATOM 0 H ALA A 803 -11.031 -9.255 0.709 1.00 0.00 H new ATOM 0 HA ALA A 803 -11.534 -9.201 -2.104 1.00 0.00 H new ATOM 0 HB1 ALA A 803 -13.870 -8.911 -1.387 1.00 0.00 H new ATOM 0 HB2 ALA A 803 -13.068 -10.233 -0.506 1.00 0.00 H new ATOM 0 HB3 ALA A 803 -13.322 -8.660 0.287 1.00 0.00 H new ATOM 430 N GLN A 804 -11.573 -6.385 -0.419 1.00 0.00 N ATOM 431 CA GLN A 804 -11.512 -4.936 -0.566 1.00 0.00 C ATOM 432 C GLN A 804 -10.348 -4.551 -1.480 1.00 0.00 C ATOM 433 O GLN A 804 -10.511 -3.759 -2.410 1.00 0.00 O ATOM 434 CB GLN A 804 -11.369 -4.274 0.816 1.00 0.00 C ATOM 435 CG GLN A 804 -10.520 -3.007 0.826 1.00 0.00 C ATOM 436 CD GLN A 804 -11.308 -1.765 0.458 1.00 0.00 C ATOM 437 OE1 GLN A 804 -12.485 -1.637 0.792 1.00 0.00 O ATOM 438 NE2 GLN A 804 -10.661 -0.838 -0.232 1.00 0.00 N ATOM 0 H GLN A 804 -11.447 -6.717 0.537 1.00 0.00 H new ATOM 0 HA GLN A 804 -12.436 -4.581 -1.022 1.00 0.00 H new ATOM 0 HB2 GLN A 804 -12.363 -4.033 1.194 1.00 0.00 H new ATOM 0 HB3 GLN A 804 -10.931 -4.995 1.507 1.00 0.00 H new ATOM 0 HG2 GLN A 804 -10.085 -2.875 1.817 1.00 0.00 H new ATOM 0 HG3 GLN A 804 -9.691 -3.125 0.128 1.00 0.00 H new ATOM 0 HE21 GLN A 804 -9.685 -0.983 -0.490 1.00 0.00 H new ATOM 0 HE22 GLN A 804 -11.139 0.020 -0.506 1.00 0.00 H new ATOM 447 N LEU A 805 -9.190 -5.141 -1.220 1.00 0.00 N ATOM 448 CA LEU A 805 -7.991 -4.857 -1.986 1.00 0.00 C ATOM 449 C LEU A 805 -8.131 -5.380 -3.418 1.00 0.00 C ATOM 450 O LEU A 805 -7.622 -4.776 -4.366 1.00 0.00 O ATOM 451 CB LEU A 805 -6.769 -5.455 -1.264 1.00 0.00 C ATOM 452 CG LEU A 805 -5.718 -6.122 -2.135 1.00 0.00 C ATOM 453 CD1 LEU A 805 -4.564 -5.169 -2.405 1.00 0.00 C ATOM 454 CD2 LEU A 805 -5.214 -7.396 -1.474 1.00 0.00 C ATOM 0 H LEU A 805 -9.058 -5.826 -0.476 1.00 0.00 H new ATOM 0 HA LEU A 805 -7.846 -3.779 -2.057 1.00 0.00 H new ATOM 0 HB2 LEU A 805 -6.286 -4.659 -0.698 1.00 0.00 H new ATOM 0 HB3 LEU A 805 -7.127 -6.188 -0.541 1.00 0.00 H new ATOM 0 HG LEU A 805 -6.176 -6.384 -3.089 1.00 0.00 H new ATOM 0 HD11 LEU A 805 -3.821 -5.665 -3.030 1.00 0.00 H new ATOM 0 HD12 LEU A 805 -4.937 -4.282 -2.918 1.00 0.00 H new ATOM 0 HD13 LEU A 805 -4.106 -4.876 -1.461 1.00 0.00 H new ATOM 0 HD21 LEU A 805 -4.462 -7.863 -2.110 1.00 0.00 H new ATOM 0 HD22 LEU A 805 -4.773 -7.154 -0.507 1.00 0.00 H new ATOM 0 HD23 LEU A 805 -6.046 -8.085 -1.331 1.00 0.00 H new ATOM 466 N HIS A 806 -8.854 -6.482 -3.565 1.00 0.00 N ATOM 467 CA HIS A 806 -9.117 -7.070 -4.876 1.00 0.00 C ATOM 468 C HIS A 806 -10.082 -6.201 -5.685 1.00 0.00 C ATOM 469 O HIS A 806 -9.802 -5.837 -6.828 1.00 0.00 O ATOM 470 CB HIS A 806 -9.700 -8.476 -4.703 1.00 0.00 C ATOM 471 CG HIS A 806 -9.590 -9.345 -5.918 1.00 0.00 C ATOM 472 ND1 HIS A 806 -10.661 -9.642 -6.722 1.00 0.00 N ATOM 473 CD2 HIS A 806 -8.532 -10.000 -6.450 1.00 0.00 C ATOM 474 CE1 HIS A 806 -10.274 -10.445 -7.693 1.00 0.00 C ATOM 475 NE2 HIS A 806 -8.984 -10.679 -7.554 1.00 0.00 N ATOM 0 H HIS A 806 -9.273 -6.992 -2.787 1.00 0.00 H new ATOM 0 HA HIS A 806 -8.175 -7.130 -5.422 1.00 0.00 H new ATOM 0 HB2 HIS A 806 -9.192 -8.967 -3.873 1.00 0.00 H new ATOM 0 HB3 HIS A 806 -10.751 -8.389 -4.427 1.00 0.00 H new ATOM 0 HD2 HIS A 806 -7.519 -9.990 -6.075 1.00 0.00 H new ATOM 0 HE1 HIS A 806 -10.907 -10.844 -8.472 1.00 0.00 H new ATOM 0 HE2 HIS A 806 -8.417 -11.267 -8.165 1.00 0.00 H new ATOM 484 N ALA A 807 -11.209 -5.854 -5.073 1.00 0.00 N ATOM 485 CA ALA A 807 -12.268 -5.119 -5.756 1.00 0.00 C ATOM 486 C ALA A 807 -11.853 -3.688 -6.078 1.00 0.00 C ATOM 487 O ALA A 807 -12.338 -3.097 -7.043 1.00 0.00 O ATOM 488 CB ALA A 807 -13.533 -5.117 -4.912 1.00 0.00 C ATOM 0 H ALA A 807 -11.414 -6.072 -4.098 1.00 0.00 H new ATOM 0 HA ALA A 807 -12.462 -5.627 -6.701 1.00 0.00 H new ATOM 0 HB1 ALA A 807 -14.316 -4.566 -5.432 1.00 0.00 H new ATOM 0 HB2 ALA A 807 -13.861 -6.143 -4.745 1.00 0.00 H new ATOM 0 HB3 ALA A 807 -13.330 -4.641 -3.953 1.00 0.00 H new ATOM 494 N SER A 808 -10.951 -3.132 -5.280 1.00 0.00 N ATOM 495 CA SER A 808 -10.522 -1.752 -5.470 1.00 0.00 C ATOM 496 C SER A 808 -9.507 -1.622 -6.604 1.00 0.00 C ATOM 497 O SER A 808 -9.037 -0.526 -6.901 1.00 0.00 O ATOM 498 CB SER A 808 -9.946 -1.193 -4.173 1.00 0.00 C ATOM 499 OG SER A 808 -10.943 -1.127 -3.167 1.00 0.00 O ATOM 0 H SER A 808 -10.504 -3.612 -4.499 1.00 0.00 H new ATOM 0 HA SER A 808 -11.400 -1.170 -5.750 1.00 0.00 H new ATOM 0 HB2 SER A 808 -9.123 -1.822 -3.835 1.00 0.00 H new ATOM 0 HB3 SER A 808 -9.536 -0.199 -4.351 1.00 0.00 H new ATOM 0 HG SER A 808 -11.004 -1.992 -2.710 1.00 0.00 H new ATOM 505 N GLY A 809 -9.151 -2.742 -7.220 1.00 0.00 N ATOM 506 CA GLY A 809 -8.330 -2.697 -8.413 1.00 0.00 C ATOM 507 C GLY A 809 -6.839 -2.679 -8.136 1.00 0.00 C ATOM 508 O GLY A 809 -6.057 -3.215 -8.922 1.00 0.00 O ATOM 0 H GLY A 809 -9.416 -3.679 -6.915 1.00 0.00 H new ATOM 0 HA2 GLY A 809 -8.563 -3.561 -9.035 1.00 0.00 H new ATOM 0 HA3 GLY A 809 -8.593 -1.810 -8.989 1.00 0.00 H new ATOM 512 N TYR A 810 -6.425 -2.087 -7.016 1.00 0.00 N ATOM 513 CA TYR A 810 -5.001 -1.965 -6.724 1.00 0.00 C ATOM 514 C TYR A 810 -4.385 -3.304 -6.314 1.00 0.00 C ATOM 515 O TYR A 810 -3.232 -3.366 -5.890 1.00 0.00 O ATOM 516 CB TYR A 810 -4.716 -0.877 -5.673 1.00 0.00 C ATOM 517 CG TYR A 810 -5.584 -0.898 -4.430 1.00 0.00 C ATOM 518 CD1 TYR A 810 -5.593 -1.988 -3.572 1.00 0.00 C ATOM 519 CD2 TYR A 810 -6.366 0.201 -4.097 1.00 0.00 C ATOM 520 CE1 TYR A 810 -6.361 -1.986 -2.424 1.00 0.00 C ATOM 521 CE2 TYR A 810 -7.132 0.213 -2.946 1.00 0.00 C ATOM 522 CZ TYR A 810 -7.128 -0.884 -2.114 1.00 0.00 C ATOM 523 OH TYR A 810 -7.887 -0.877 -0.964 1.00 0.00 O ATOM 0 H TYR A 810 -7.044 -1.691 -6.309 1.00 0.00 H new ATOM 0 HA TYR A 810 -4.521 -1.653 -7.652 1.00 0.00 H new ATOM 0 HB2 TYR A 810 -3.674 -0.965 -5.364 1.00 0.00 H new ATOM 0 HB3 TYR A 810 -4.826 0.097 -6.150 1.00 0.00 H new ATOM 0 HD1 TYR A 810 -4.989 -2.853 -3.806 1.00 0.00 H new ATOM 0 HD2 TYR A 810 -6.376 1.062 -4.749 1.00 0.00 H new ATOM 0 HE1 TYR A 810 -6.360 -2.846 -1.771 1.00 0.00 H new ATOM 0 HE2 TYR A 810 -7.730 1.078 -2.701 1.00 0.00 H new ATOM 0 HH TYR A 810 -7.972 0.042 -0.634 1.00 0.00 H new ATOM 533 N TYR A 811 -5.161 -4.374 -6.455 1.00 0.00 N ATOM 534 CA TYR A 811 -4.646 -5.728 -6.304 1.00 0.00 C ATOM 535 C TYR A 811 -3.574 -5.986 -7.358 1.00 0.00 C ATOM 536 O TYR A 811 -2.618 -6.722 -7.121 1.00 0.00 O ATOM 537 CB TYR A 811 -5.782 -6.745 -6.452 1.00 0.00 C ATOM 538 CG TYR A 811 -5.483 -8.112 -5.862 1.00 0.00 C ATOM 539 CD1 TYR A 811 -4.751 -9.053 -6.573 1.00 0.00 C ATOM 540 CD2 TYR A 811 -5.942 -8.462 -4.601 1.00 0.00 C ATOM 541 CE1 TYR A 811 -4.486 -10.303 -6.043 1.00 0.00 C ATOM 542 CE2 TYR A 811 -5.680 -9.708 -4.062 1.00 0.00 C ATOM 543 CZ TYR A 811 -4.952 -10.623 -4.788 1.00 0.00 C ATOM 544 OH TYR A 811 -4.695 -11.866 -4.257 1.00 0.00 O ATOM 0 H TYR A 811 -6.156 -4.327 -6.675 1.00 0.00 H new ATOM 0 HA TYR A 811 -4.209 -5.836 -5.311 1.00 0.00 H new ATOM 0 HB2 TYR A 811 -6.676 -6.344 -5.974 1.00 0.00 H new ATOM 0 HB3 TYR A 811 -6.012 -6.863 -7.511 1.00 0.00 H new ATOM 0 HD1 TYR A 811 -4.382 -8.805 -7.557 1.00 0.00 H new ATOM 0 HD2 TYR A 811 -6.515 -7.747 -4.029 1.00 0.00 H new ATOM 0 HE1 TYR A 811 -3.917 -11.024 -6.611 1.00 0.00 H new ATOM 0 HE2 TYR A 811 -6.044 -9.962 -3.077 1.00 0.00 H new ATOM 0 HH TYR A 811 -4.692 -11.810 -3.279 1.00 0.00 H new ATOM 554 N ALA A 812 -3.737 -5.361 -8.519 1.00 0.00 N ATOM 555 CA ALA A 812 -2.764 -5.477 -9.596 1.00 0.00 C ATOM 556 C ALA A 812 -1.407 -4.941 -9.153 1.00 0.00 C ATOM 557 O ALA A 812 -0.375 -5.549 -9.418 1.00 0.00 O ATOM 558 CB ALA A 812 -3.253 -4.736 -10.830 1.00 0.00 C ATOM 0 H ALA A 812 -4.537 -4.767 -8.737 1.00 0.00 H new ATOM 0 HA ALA A 812 -2.649 -6.532 -9.847 1.00 0.00 H new ATOM 0 HB1 ALA A 812 -2.516 -4.831 -11.627 1.00 0.00 H new ATOM 0 HB2 ALA A 812 -4.200 -5.163 -11.159 1.00 0.00 H new ATOM 0 HB3 ALA A 812 -3.394 -3.682 -10.590 1.00 0.00 H new ATOM 564 N LEU A 813 -1.422 -3.809 -8.455 1.00 0.00 N ATOM 565 CA LEU A 813 -0.193 -3.219 -7.930 1.00 0.00 C ATOM 566 C LEU A 813 0.305 -4.035 -6.747 1.00 0.00 C ATOM 567 O LEU A 813 1.513 -4.137 -6.504 1.00 0.00 O ATOM 568 CB LEU A 813 -0.419 -1.766 -7.493 1.00 0.00 C ATOM 569 CG LEU A 813 -1.562 -1.029 -8.193 1.00 0.00 C ATOM 570 CD1 LEU A 813 -1.833 0.303 -7.512 1.00 0.00 C ATOM 571 CD2 LEU A 813 -1.244 -0.816 -9.664 1.00 0.00 C ATOM 0 H LEU A 813 -2.269 -3.283 -8.240 1.00 0.00 H new ATOM 0 HA LEU A 813 0.554 -3.227 -8.724 1.00 0.00 H new ATOM 0 HB2 LEU A 813 -0.608 -1.755 -6.420 1.00 0.00 H new ATOM 0 HB3 LEU A 813 0.503 -1.209 -7.660 1.00 0.00 H new ATOM 0 HG LEU A 813 -2.459 -1.645 -8.121 1.00 0.00 H new ATOM 0 HD11 LEU A 813 -2.649 0.814 -8.023 1.00 0.00 H new ATOM 0 HD12 LEU A 813 -2.108 0.130 -6.472 1.00 0.00 H new ATOM 0 HD13 LEU A 813 -0.936 0.921 -7.552 1.00 0.00 H new ATOM 0 HD21 LEU A 813 -2.070 -0.290 -10.142 1.00 0.00 H new ATOM 0 HD22 LEU A 813 -0.334 -0.223 -9.757 1.00 0.00 H new ATOM 0 HD23 LEU A 813 -1.099 -1.782 -10.149 1.00 0.00 H new ATOM 583 N PHE A 814 -0.641 -4.624 -6.027 1.00 0.00 N ATOM 584 CA PHE A 814 -0.338 -5.475 -4.886 1.00 0.00 C ATOM 585 C PHE A 814 0.495 -6.677 -5.319 1.00 0.00 C ATOM 586 O PHE A 814 1.423 -7.074 -4.627 1.00 0.00 O ATOM 587 CB PHE A 814 -1.640 -5.933 -4.222 1.00 0.00 C ATOM 588 CG PHE A 814 -1.479 -7.057 -3.234 1.00 0.00 C ATOM 589 CD1 PHE A 814 -0.942 -6.821 -1.980 1.00 0.00 C ATOM 590 CD2 PHE A 814 -1.871 -8.346 -3.560 1.00 0.00 C ATOM 591 CE1 PHE A 814 -0.798 -7.848 -1.071 1.00 0.00 C ATOM 592 CE2 PHE A 814 -1.729 -9.378 -2.653 1.00 0.00 C ATOM 593 CZ PHE A 814 -1.191 -9.128 -1.408 1.00 0.00 C ATOM 0 H PHE A 814 -1.638 -4.525 -6.218 1.00 0.00 H new ATOM 0 HA PHE A 814 0.245 -4.903 -4.164 1.00 0.00 H new ATOM 0 HB2 PHE A 814 -2.092 -5.082 -3.713 1.00 0.00 H new ATOM 0 HB3 PHE A 814 -2.337 -6.247 -4.999 1.00 0.00 H new ATOM 0 HD1 PHE A 814 -0.633 -5.822 -1.711 1.00 0.00 H new ATOM 0 HD2 PHE A 814 -2.292 -8.546 -4.534 1.00 0.00 H new ATOM 0 HE1 PHE A 814 -0.378 -7.651 -0.096 1.00 0.00 H new ATOM 0 HE2 PHE A 814 -2.038 -10.378 -2.918 1.00 0.00 H new ATOM 0 HZ PHE A 814 -1.077 -9.933 -0.697 1.00 0.00 H new ATOM 603 N VAL A 815 0.166 -7.246 -6.471 1.00 0.00 N ATOM 604 CA VAL A 815 0.907 -8.392 -6.987 1.00 0.00 C ATOM 605 C VAL A 815 2.017 -7.950 -7.935 1.00 0.00 C ATOM 606 O VAL A 815 2.727 -8.779 -8.508 1.00 0.00 O ATOM 607 CB VAL A 815 -0.016 -9.397 -7.713 1.00 0.00 C ATOM 608 CG1 VAL A 815 -1.085 -9.911 -6.768 1.00 0.00 C ATOM 609 CG2 VAL A 815 -0.645 -8.770 -8.948 1.00 0.00 C ATOM 0 H VAL A 815 -0.604 -6.936 -7.064 1.00 0.00 H new ATOM 0 HA VAL A 815 1.349 -8.890 -6.124 1.00 0.00 H new ATOM 0 HB VAL A 815 0.592 -10.241 -8.041 1.00 0.00 H new ATOM 0 HG11 VAL A 815 -1.727 -10.618 -7.294 1.00 0.00 H new ATOM 0 HG12 VAL A 815 -0.613 -10.410 -5.922 1.00 0.00 H new ATOM 0 HG13 VAL A 815 -1.685 -9.075 -6.408 1.00 0.00 H new ATOM 0 HG21 VAL A 815 -1.289 -9.500 -9.439 1.00 0.00 H new ATOM 0 HG22 VAL A 815 -1.237 -7.903 -8.655 1.00 0.00 H new ATOM 0 HG23 VAL A 815 0.140 -8.457 -9.637 1.00 0.00 H new ATOM 619 N ASP A 816 2.170 -6.643 -8.091 1.00 0.00 N ATOM 620 CA ASP A 816 3.175 -6.094 -8.993 1.00 0.00 C ATOM 621 C ASP A 816 4.476 -5.823 -8.251 1.00 0.00 C ATOM 622 O ASP A 816 5.511 -6.417 -8.556 1.00 0.00 O ATOM 623 CB ASP A 816 2.673 -4.802 -9.643 1.00 0.00 C ATOM 624 CG ASP A 816 3.221 -4.594 -11.044 1.00 0.00 C ATOM 625 OD1 ASP A 816 4.373 -5.002 -11.309 1.00 0.00 O ATOM 626 OD2 ASP A 816 2.508 -4.006 -11.885 1.00 0.00 O ATOM 0 H ASP A 816 1.611 -5.942 -7.605 1.00 0.00 H new ATOM 0 HA ASP A 816 3.361 -6.832 -9.773 1.00 0.00 H new ATOM 0 HB2 ASP A 816 1.584 -4.821 -9.683 1.00 0.00 H new ATOM 0 HB3 ASP A 816 2.954 -3.954 -9.019 1.00 0.00 H new ATOM 631 N THR A 817 4.426 -4.941 -7.263 1.00 0.00 N ATOM 632 CA THR A 817 5.636 -4.544 -6.568 1.00 0.00 C ATOM 633 C THR A 817 5.752 -5.177 -5.179 1.00 0.00 C ATOM 634 O THR A 817 6.847 -5.524 -4.760 1.00 0.00 O ATOM 635 CB THR A 817 5.756 -2.997 -6.474 1.00 0.00 C ATOM 636 OG1 THR A 817 7.127 -2.613 -6.292 1.00 0.00 O ATOM 637 CG2 THR A 817 4.911 -2.428 -5.340 1.00 0.00 C ATOM 0 H THR A 817 3.572 -4.494 -6.930 1.00 0.00 H new ATOM 0 HA THR A 817 6.467 -4.920 -7.165 1.00 0.00 H new ATOM 0 HB THR A 817 5.381 -2.587 -7.412 1.00 0.00 H new ATOM 0 HG1 THR A 817 7.441 -2.924 -5.417 1.00 0.00 H new ATOM 0 HG21 THR A 817 5.024 -1.344 -5.310 1.00 0.00 H new ATOM 0 HG22 THR A 817 3.863 -2.679 -5.506 1.00 0.00 H new ATOM 0 HG23 THR A 817 5.240 -2.853 -4.392 1.00 0.00 H new ATOM 645 N VAL A 818 4.628 -5.377 -4.491 1.00 0.00 N ATOM 646 CA VAL A 818 4.660 -5.774 -3.080 1.00 0.00 C ATOM 647 C VAL A 818 5.444 -7.078 -2.837 1.00 0.00 C ATOM 648 O VAL A 818 6.374 -7.082 -2.032 1.00 0.00 O ATOM 649 CB VAL A 818 3.241 -5.892 -2.483 1.00 0.00 C ATOM 650 CG1 VAL A 818 3.309 -6.221 -1.000 1.00 0.00 C ATOM 651 CG2 VAL A 818 2.459 -4.604 -2.708 1.00 0.00 C ATOM 0 H VAL A 818 3.691 -5.272 -4.881 1.00 0.00 H new ATOM 0 HA VAL A 818 5.191 -4.973 -2.566 1.00 0.00 H new ATOM 0 HB VAL A 818 2.722 -6.705 -2.991 1.00 0.00 H new ATOM 0 HG11 VAL A 818 2.299 -6.300 -0.598 1.00 0.00 H new ATOM 0 HG12 VAL A 818 3.830 -7.168 -0.861 1.00 0.00 H new ATOM 0 HG13 VAL A 818 3.847 -5.431 -0.476 1.00 0.00 H new ATOM 0 HG21 VAL A 818 1.461 -4.705 -2.281 1.00 0.00 H new ATOM 0 HG22 VAL A 818 2.978 -3.775 -2.227 1.00 0.00 H new ATOM 0 HG23 VAL A 818 2.378 -4.410 -3.777 1.00 0.00 H new ATOM 661 N PRO A 819 5.106 -8.199 -3.511 1.00 0.00 N ATOM 662 CA PRO A 819 5.821 -9.465 -3.306 1.00 0.00 C ATOM 663 C PRO A 819 7.300 -9.349 -3.666 1.00 0.00 C ATOM 664 O PRO A 819 8.164 -9.884 -2.970 1.00 0.00 O ATOM 665 CB PRO A 819 5.110 -10.454 -4.238 1.00 0.00 C ATOM 666 CG PRO A 819 4.373 -9.610 -5.220 1.00 0.00 C ATOM 667 CD PRO A 819 4.026 -8.340 -4.501 1.00 0.00 C ATOM 0 HA PRO A 819 5.802 -9.777 -2.262 1.00 0.00 H new ATOM 0 HB2 PRO A 819 5.826 -11.106 -4.739 1.00 0.00 H new ATOM 0 HB3 PRO A 819 4.428 -11.097 -3.682 1.00 0.00 H new ATOM 0 HG2 PRO A 819 4.988 -9.406 -6.097 1.00 0.00 H new ATOM 0 HG3 PRO A 819 3.474 -10.117 -5.572 1.00 0.00 H new ATOM 0 HD2 PRO A 819 3.992 -7.490 -5.182 1.00 0.00 H new ATOM 0 HD3 PRO A 819 3.049 -8.404 -4.022 1.00 0.00 H new ATOM 675 N ASP A 820 7.585 -8.628 -4.745 1.00 0.00 N ATOM 676 CA ASP A 820 8.960 -8.411 -5.185 1.00 0.00 C ATOM 677 C ASP A 820 9.716 -7.579 -4.158 1.00 0.00 C ATOM 678 O ASP A 820 10.877 -7.845 -3.860 1.00 0.00 O ATOM 679 CB ASP A 820 8.987 -7.706 -6.543 1.00 0.00 C ATOM 680 CG ASP A 820 10.372 -7.696 -7.161 1.00 0.00 C ATOM 681 OD1 ASP A 820 10.704 -8.657 -7.892 1.00 0.00 O ATOM 682 OD2 ASP A 820 11.128 -6.726 -6.930 1.00 0.00 O ATOM 0 H ASP A 820 6.881 -8.183 -5.333 1.00 0.00 H new ATOM 0 HA ASP A 820 9.444 -9.382 -5.285 1.00 0.00 H new ATOM 0 HB2 ASP A 820 8.293 -8.203 -7.221 1.00 0.00 H new ATOM 0 HB3 ASP A 820 8.638 -6.680 -6.424 1.00 0.00 H new ATOM 687 N ASP A 821 9.031 -6.582 -3.613 1.00 0.00 N ATOM 688 CA ASP A 821 9.589 -5.717 -2.580 1.00 0.00 C ATOM 689 C ASP A 821 9.978 -6.537 -1.358 1.00 0.00 C ATOM 690 O ASP A 821 11.024 -6.310 -0.748 1.00 0.00 O ATOM 691 CB ASP A 821 8.577 -4.630 -2.193 1.00 0.00 C ATOM 692 CG ASP A 821 8.758 -3.356 -2.996 1.00 0.00 C ATOM 693 OD1 ASP A 821 8.619 -3.400 -4.238 1.00 0.00 O ATOM 694 OD2 ASP A 821 9.059 -2.304 -2.399 1.00 0.00 O ATOM 0 H ASP A 821 8.073 -6.350 -3.874 1.00 0.00 H new ATOM 0 HA ASP A 821 10.484 -5.235 -2.974 1.00 0.00 H new ATOM 0 HB2 ASP A 821 7.566 -5.009 -2.342 1.00 0.00 H new ATOM 0 HB3 ASP A 821 8.679 -4.404 -1.132 1.00 0.00 H new ATOM 699 N VAL A 822 9.133 -7.504 -1.016 1.00 0.00 N ATOM 700 CA VAL A 822 9.422 -8.428 0.073 1.00 0.00 C ATOM 701 C VAL A 822 10.646 -9.283 -0.262 1.00 0.00 C ATOM 702 O VAL A 822 11.513 -9.502 0.584 1.00 0.00 O ATOM 703 CB VAL A 822 8.213 -9.342 0.372 1.00 0.00 C ATOM 704 CG1 VAL A 822 8.561 -10.376 1.431 1.00 0.00 C ATOM 705 CG2 VAL A 822 7.014 -8.515 0.811 1.00 0.00 C ATOM 0 H VAL A 822 8.239 -7.668 -1.480 1.00 0.00 H new ATOM 0 HA VAL A 822 9.630 -7.834 0.963 1.00 0.00 H new ATOM 0 HB VAL A 822 7.954 -9.870 -0.546 1.00 0.00 H new ATOM 0 HG11 VAL A 822 7.693 -11.007 1.623 1.00 0.00 H new ATOM 0 HG12 VAL A 822 9.387 -10.994 1.079 1.00 0.00 H new ATOM 0 HG13 VAL A 822 8.853 -9.870 2.351 1.00 0.00 H new ATOM 0 HG21 VAL A 822 6.172 -9.176 1.017 1.00 0.00 H new ATOM 0 HG22 VAL A 822 7.267 -7.958 1.713 1.00 0.00 H new ATOM 0 HG23 VAL A 822 6.743 -7.818 0.018 1.00 0.00 H new ATOM 715 N LYS A 823 10.720 -9.750 -1.505 1.00 0.00 N ATOM 716 CA LYS A 823 11.859 -10.541 -1.965 1.00 0.00 C ATOM 717 C LYS A 823 13.143 -9.722 -1.895 1.00 0.00 C ATOM 718 O LYS A 823 14.196 -10.230 -1.511 1.00 0.00 O ATOM 719 CB LYS A 823 11.630 -11.030 -3.398 1.00 0.00 C ATOM 720 CG LYS A 823 10.695 -12.222 -3.487 1.00 0.00 C ATOM 721 CD LYS A 823 9.719 -12.077 -4.641 1.00 0.00 C ATOM 722 CE LYS A 823 9.406 -13.420 -5.277 1.00 0.00 C ATOM 723 NZ LYS A 823 9.930 -13.510 -6.665 1.00 0.00 N ATOM 0 H LYS A 823 10.003 -9.594 -2.214 1.00 0.00 H new ATOM 0 HA LYS A 823 11.958 -11.406 -1.310 1.00 0.00 H new ATOM 0 HB2 LYS A 823 11.222 -10.212 -3.992 1.00 0.00 H new ATOM 0 HB3 LYS A 823 12.590 -11.297 -3.840 1.00 0.00 H new ATOM 0 HG2 LYS A 823 11.278 -13.134 -3.614 1.00 0.00 H new ATOM 0 HG3 LYS A 823 10.143 -12.324 -2.553 1.00 0.00 H new ATOM 0 HD2 LYS A 823 8.797 -11.619 -4.284 1.00 0.00 H new ATOM 0 HD3 LYS A 823 10.138 -11.407 -5.391 1.00 0.00 H new ATOM 0 HE2 LYS A 823 9.838 -14.218 -4.673 1.00 0.00 H new ATOM 0 HE3 LYS A 823 8.327 -13.576 -5.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 9.696 -14.441 -7.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 9.498 -12.765 -7.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 10.963 -13.387 -6.655 1.00 0.00 H new ATOM 737 N ARG A 824 13.048 -8.452 -2.258 1.00 0.00 N ATOM 738 CA ARG A 824 14.188 -7.550 -2.188 1.00 0.00 C ATOM 739 C ARG A 824 14.547 -7.267 -0.734 1.00 0.00 C ATOM 740 O ARG A 824 15.720 -7.136 -0.396 1.00 0.00 O ATOM 741 CB ARG A 824 13.895 -6.251 -2.937 1.00 0.00 C ATOM 742 CG ARG A 824 13.637 -6.468 -4.421 1.00 0.00 C ATOM 743 CD ARG A 824 13.750 -5.178 -5.222 1.00 0.00 C ATOM 744 NE ARG A 824 13.206 -4.025 -4.508 1.00 0.00 N ATOM 745 CZ ARG A 824 11.917 -3.687 -4.492 1.00 0.00 C ATOM 746 NH1 ARG A 824 11.018 -4.391 -5.180 1.00 0.00 N ATOM 747 NH2 ARG A 824 11.529 -2.630 -3.793 1.00 0.00 N ATOM 0 H ARG A 824 12.191 -8.022 -2.605 1.00 0.00 H new ATOM 0 HA ARG A 824 15.041 -8.030 -2.667 1.00 0.00 H new ATOM 0 HB2 ARG A 824 13.027 -5.767 -2.489 1.00 0.00 H new ATOM 0 HB3 ARG A 824 14.737 -5.570 -2.816 1.00 0.00 H new ATOM 0 HG2 ARG A 824 14.349 -7.197 -4.808 1.00 0.00 H new ATOM 0 HG3 ARG A 824 12.642 -6.891 -4.556 1.00 0.00 H new ATOM 0 HD2 ARG A 824 14.797 -4.993 -5.460 1.00 0.00 H new ATOM 0 HD3 ARG A 824 13.224 -5.295 -6.169 1.00 0.00 H new ATOM 0 HE ARG A 824 13.857 -3.439 -3.986 1.00 0.00 H new ATOM 0 HH11 ARG A 824 11.314 -5.199 -5.727 1.00 0.00 H new ATOM 0 HH12 ARG A 824 10.035 -4.121 -5.159 1.00 0.00 H new ATOM 0 HH21 ARG A 824 12.215 -2.083 -3.273 1.00 0.00 H new ATOM 0 HH22 ARG A 824 10.544 -2.364 -3.775 1.00 0.00 H new ATOM 761 N LEU A 825 13.532 -7.189 0.124 1.00 0.00 N ATOM 762 CA LEU A 825 13.756 -7.082 1.564 1.00 0.00 C ATOM 763 C LEU A 825 14.557 -8.286 2.054 1.00 0.00 C ATOM 764 O LEU A 825 15.470 -8.150 2.868 1.00 0.00 O ATOM 765 CB LEU A 825 12.423 -7.003 2.317 1.00 0.00 C ATOM 766 CG LEU A 825 12.102 -5.645 2.944 1.00 0.00 C ATOM 767 CD1 LEU A 825 10.766 -5.693 3.665 1.00 0.00 C ATOM 768 CD2 LEU A 825 13.204 -5.216 3.899 1.00 0.00 C ATOM 0 H LEU A 825 12.550 -7.198 -0.151 1.00 0.00 H new ATOM 0 HA LEU A 825 14.318 -6.169 1.759 1.00 0.00 H new ATOM 0 HB2 LEU A 825 11.620 -7.265 1.628 1.00 0.00 H new ATOM 0 HB3 LEU A 825 12.425 -7.756 3.105 1.00 0.00 H new ATOM 0 HG LEU A 825 12.038 -4.909 2.143 1.00 0.00 H new ATOM 0 HD11 LEU A 825 10.555 -4.718 4.105 1.00 0.00 H new ATOM 0 HD12 LEU A 825 9.979 -5.950 2.956 1.00 0.00 H new ATOM 0 HD13 LEU A 825 10.804 -6.446 4.453 1.00 0.00 H new ATOM 0 HD21 LEU A 825 12.953 -4.248 4.332 1.00 0.00 H new ATOM 0 HD22 LEU A 825 13.304 -5.955 4.694 1.00 0.00 H new ATOM 0 HD23 LEU A 825 14.146 -5.138 3.356 1.00 0.00 H new ATOM 780 N TYR A 826 14.201 -9.464 1.545 1.00 0.00 N ATOM 781 CA TYR A 826 14.954 -10.688 1.809 1.00 0.00 C ATOM 782 C TYR A 826 16.406 -10.516 1.371 1.00 0.00 C ATOM 783 O TYR A 826 17.336 -10.906 2.079 1.00 0.00 O ATOM 784 CB TYR A 826 14.343 -11.868 1.045 1.00 0.00 C ATOM 785 CG TYR A 826 13.265 -12.624 1.788 1.00 0.00 C ATOM 786 CD1 TYR A 826 13.565 -13.383 2.910 1.00 0.00 C ATOM 787 CD2 TYR A 826 11.947 -12.593 1.349 1.00 0.00 C ATOM 788 CE1 TYR A 826 12.581 -14.088 3.576 1.00 0.00 C ATOM 789 CE2 TYR A 826 10.959 -13.297 2.009 1.00 0.00 C ATOM 790 CZ TYR A 826 11.281 -14.042 3.123 1.00 0.00 C ATOM 791 OH TYR A 826 10.301 -14.745 3.785 1.00 0.00 O ATOM 0 H TYR A 826 13.389 -9.596 0.942 1.00 0.00 H new ATOM 0 HA TYR A 826 14.913 -10.888 2.880 1.00 0.00 H new ATOM 0 HB2 TYR A 826 13.926 -11.498 0.109 1.00 0.00 H new ATOM 0 HB3 TYR A 826 15.140 -12.564 0.785 1.00 0.00 H new ATOM 0 HD1 TYR A 826 14.583 -13.423 3.268 1.00 0.00 H new ATOM 0 HD2 TYR A 826 11.691 -12.009 0.477 1.00 0.00 H new ATOM 0 HE1 TYR A 826 12.830 -14.673 4.449 1.00 0.00 H new ATOM 0 HE2 TYR A 826 9.940 -13.264 1.654 1.00 0.00 H new ATOM 0 HH TYR A 826 10.696 -15.219 4.546 1.00 0.00 H new ATOM 801 N THR A 827 16.588 -9.913 0.202 1.00 0.00 N ATOM 802 CA THR A 827 17.911 -9.743 -0.380 1.00 0.00 C ATOM 803 C THR A 827 18.783 -8.811 0.464 1.00 0.00 C ATOM 804 O THR A 827 19.942 -9.124 0.739 1.00 0.00 O ATOM 805 CB THR A 827 17.821 -9.202 -1.819 1.00 0.00 C ATOM 806 OG1 THR A 827 16.723 -9.820 -2.510 1.00 0.00 O ATOM 807 CG2 THR A 827 19.109 -9.462 -2.584 1.00 0.00 C ATOM 0 H THR A 827 15.830 -9.532 -0.364 1.00 0.00 H new ATOM 0 HA THR A 827 18.376 -10.729 -0.400 1.00 0.00 H new ATOM 0 HB THR A 827 17.661 -8.125 -1.763 1.00 0.00 H new ATOM 0 HG1 THR A 827 16.672 -9.469 -3.424 1.00 0.00 H new ATOM 0 HG21 THR A 827 19.016 -9.069 -3.597 1.00 0.00 H new ATOM 0 HG22 THR A 827 19.939 -8.968 -2.078 1.00 0.00 H new ATOM 0 HG23 THR A 827 19.297 -10.535 -2.627 1.00 0.00 H new ATOM 815 N GLU A 828 18.221 -7.683 0.892 1.00 0.00 N ATOM 816 CA GLU A 828 18.969 -6.720 1.698 1.00 0.00 C ATOM 817 C GLU A 828 19.217 -7.269 3.102 1.00 0.00 C ATOM 818 O GLU A 828 20.203 -6.920 3.757 1.00 0.00 O ATOM 819 CB GLU A 828 18.225 -5.382 1.778 1.00 0.00 C ATOM 820 CG GLU A 828 17.661 -4.899 0.447 1.00 0.00 C ATOM 821 CD GLU A 828 18.727 -4.387 -0.505 1.00 0.00 C ATOM 822 OE1 GLU A 828 19.754 -5.074 -0.685 1.00 0.00 O ATOM 823 OE2 GLU A 828 18.533 -3.300 -1.094 1.00 0.00 O ATOM 0 H GLU A 828 17.257 -7.414 0.696 1.00 0.00 H new ATOM 0 HA GLU A 828 19.931 -6.552 1.214 1.00 0.00 H new ATOM 0 HB2 GLU A 828 17.408 -5.476 2.493 1.00 0.00 H new ATOM 0 HB3 GLU A 828 18.904 -4.624 2.168 1.00 0.00 H new ATOM 0 HG2 GLU A 828 17.121 -5.717 -0.029 1.00 0.00 H new ATOM 0 HG3 GLU A 828 16.938 -4.105 0.633 1.00 0.00 H new ATOM 830 N ALA A 829 18.315 -8.137 3.557 1.00 0.00 N ATOM 831 CA ALA A 829 18.461 -8.786 4.855 1.00 0.00 C ATOM 832 C ALA A 829 19.603 -9.795 4.827 1.00 0.00 C ATOM 833 O ALA A 829 20.302 -9.981 5.821 1.00 0.00 O ATOM 834 CB ALA A 829 17.163 -9.468 5.262 1.00 0.00 C ATOM 0 H ALA A 829 17.475 -8.406 3.044 1.00 0.00 H new ATOM 0 HA ALA A 829 18.696 -8.019 5.593 1.00 0.00 H new ATOM 0 HB1 ALA A 829 17.292 -9.946 6.233 1.00 0.00 H new ATOM 0 HB2 ALA A 829 16.367 -8.726 5.326 1.00 0.00 H new ATOM 0 HB3 ALA A 829 16.899 -10.221 4.519 1.00 0.00 H new ATOM 840 N ALA A 830 19.788 -10.434 3.675 1.00 0.00 N ATOM 841 CA ALA A 830 20.862 -11.404 3.493 1.00 0.00 C ATOM 842 C ALA A 830 22.232 -10.739 3.616 1.00 0.00 C ATOM 843 O ALA A 830 23.200 -11.366 4.044 1.00 0.00 O ATOM 844 CB ALA A 830 20.727 -12.094 2.139 1.00 0.00 C ATOM 0 H ALA A 830 19.204 -10.296 2.850 1.00 0.00 H new ATOM 0 HA ALA A 830 20.779 -12.153 4.281 1.00 0.00 H new ATOM 0 HB1 ALA A 830 21.535 -12.815 2.016 1.00 0.00 H new ATOM 0 HB2 ALA A 830 19.768 -12.610 2.088 1.00 0.00 H new ATOM 0 HB3 ALA A 830 20.781 -11.350 1.344 1.00 0.00 H new ATOM 850 N THR A 831 22.315 -9.471 3.235 1.00 0.00 N ATOM 851 CA THR A 831 23.559 -8.724 3.350 1.00 0.00 C ATOM 852 C THR A 831 23.654 -8.022 4.704 1.00 0.00 C ATOM 853 O THR A 831 24.696 -7.460 5.052 1.00 0.00 O ATOM 854 CB THR A 831 23.684 -7.680 2.229 1.00 0.00 C ATOM 855 OG1 THR A 831 22.444 -7.575 1.516 1.00 0.00 O ATOM 856 CG2 THR A 831 24.795 -8.057 1.265 1.00 0.00 C ATOM 0 H THR A 831 21.537 -8.940 2.844 1.00 0.00 H new ATOM 0 HA THR A 831 24.375 -9.441 3.261 1.00 0.00 H new ATOM 0 HB THR A 831 23.925 -6.718 2.682 1.00 0.00 H new ATOM 0 HG1 THR A 831 22.531 -6.907 0.804 1.00 0.00 H new ATOM 0 HG21 THR A 831 24.866 -7.305 0.480 1.00 0.00 H new ATOM 0 HG22 THR A 831 25.741 -8.110 1.803 1.00 0.00 H new ATOM 0 HG23 THR A 831 24.576 -9.027 0.819 1.00 0.00 H new ATOM 864 N SER A 832 22.555 -8.067 5.463 1.00 0.00 N ATOM 865 CA SER A 832 22.451 -7.406 6.759 1.00 0.00 C ATOM 866 C SER A 832 22.689 -5.912 6.609 1.00 0.00 C ATOM 867 O SER A 832 23.233 -5.254 7.502 1.00 0.00 O ATOM 868 CB SER A 832 23.415 -8.015 7.784 1.00 0.00 C ATOM 869 OG SER A 832 23.985 -9.226 7.314 1.00 0.00 O ATOM 0 H SER A 832 21.709 -8.567 5.190 1.00 0.00 H new ATOM 0 HA SER A 832 21.440 -7.562 7.135 1.00 0.00 H new ATOM 0 HB2 SER A 832 24.209 -7.301 8.006 1.00 0.00 H new ATOM 0 HB3 SER A 832 22.884 -8.201 8.717 1.00 0.00 H new ATOM 0 HG SER A 832 24.595 -9.585 7.992 1.00 0.00 H new ATOM 875 N ASP A 833 22.273 -5.380 5.467 1.00 0.00 N ATOM 876 CA ASP A 833 22.381 -3.957 5.211 1.00 0.00 C ATOM 877 C ASP A 833 21.175 -3.257 5.806 1.00 0.00 C ATOM 878 O ASP A 833 20.228 -2.916 5.105 1.00 0.00 O ATOM 879 CB ASP A 833 22.480 -3.665 3.712 1.00 0.00 C ATOM 880 CG ASP A 833 23.207 -2.365 3.431 1.00 0.00 C ATOM 881 OD1 ASP A 833 22.834 -1.326 4.021 1.00 0.00 O ATOM 882 OD2 ASP A 833 24.164 -2.375 2.628 1.00 0.00 O ATOM 0 H ASP A 833 21.858 -5.916 4.705 1.00 0.00 H new ATOM 0 HA ASP A 833 23.294 -3.584 5.676 1.00 0.00 H new ATOM 0 HB2 ASP A 833 23.000 -4.485 3.217 1.00 0.00 H new ATOM 0 HB3 ASP A 833 21.478 -3.619 3.285 1.00 0.00 H new ATOM 887 N PHE A 834 21.206 -3.103 7.121 1.00 0.00 N ATOM 888 CA PHE A 834 20.112 -2.484 7.870 1.00 0.00 C ATOM 889 C PHE A 834 19.719 -1.117 7.317 1.00 0.00 C ATOM 890 O PHE A 834 18.558 -0.725 7.407 1.00 0.00 O ATOM 891 CB PHE A 834 20.480 -2.369 9.350 1.00 0.00 C ATOM 892 CG PHE A 834 20.737 -3.696 10.002 1.00 0.00 C ATOM 893 CD1 PHE A 834 19.688 -4.478 10.455 1.00 0.00 C ATOM 894 CD2 PHE A 834 22.031 -4.165 10.158 1.00 0.00 C ATOM 895 CE1 PHE A 834 19.925 -5.702 11.050 1.00 0.00 C ATOM 896 CE2 PHE A 834 22.272 -5.387 10.752 1.00 0.00 C ATOM 897 CZ PHE A 834 21.220 -6.157 11.199 1.00 0.00 C ATOM 0 H PHE A 834 21.988 -3.402 7.703 1.00 0.00 H new ATOM 0 HA PHE A 834 19.244 -3.134 7.759 1.00 0.00 H new ATOM 0 HB2 PHE A 834 21.368 -1.745 9.449 1.00 0.00 H new ATOM 0 HB3 PHE A 834 19.674 -1.862 9.880 1.00 0.00 H new ATOM 0 HD1 PHE A 834 18.673 -4.127 10.342 1.00 0.00 H new ATOM 0 HD2 PHE A 834 22.861 -3.567 9.811 1.00 0.00 H new ATOM 0 HE1 PHE A 834 19.098 -6.303 11.398 1.00 0.00 H new ATOM 0 HE2 PHE A 834 23.286 -5.740 10.867 1.00 0.00 H new ATOM 0 HZ PHE A 834 21.408 -7.113 11.664 1.00 0.00 H new ATOM 907 N ALA A 835 20.672 -0.398 6.744 1.00 0.00 N ATOM 908 CA ALA A 835 20.376 0.880 6.110 1.00 0.00 C ATOM 909 C ALA A 835 19.415 0.678 4.941 1.00 0.00 C ATOM 910 O ALA A 835 18.437 1.413 4.774 1.00 0.00 O ATOM 911 CB ALA A 835 21.662 1.540 5.643 1.00 0.00 C ATOM 0 H ALA A 835 21.653 -0.675 6.704 1.00 0.00 H new ATOM 0 HA ALA A 835 19.897 1.535 6.837 1.00 0.00 H new ATOM 0 HB1 ALA A 835 21.430 2.495 5.170 1.00 0.00 H new ATOM 0 HB2 ALA A 835 22.316 1.708 6.498 1.00 0.00 H new ATOM 0 HB3 ALA A 835 22.164 0.892 4.924 1.00 0.00 H new ATOM 917 N ALA A 836 19.668 -0.365 4.168 1.00 0.00 N ATOM 918 CA ALA A 836 18.859 -0.659 2.996 1.00 0.00 C ATOM 919 C ALA A 836 17.592 -1.371 3.422 1.00 0.00 C ATOM 920 O ALA A 836 16.529 -1.191 2.830 1.00 0.00 O ATOM 921 CB ALA A 836 19.644 -1.502 2.003 1.00 0.00 C ATOM 0 H ALA A 836 20.429 -1.024 4.331 1.00 0.00 H new ATOM 0 HA ALA A 836 18.591 0.275 2.503 1.00 0.00 H new ATOM 0 HB1 ALA A 836 19.022 -1.712 1.133 1.00 0.00 H new ATOM 0 HB2 ALA A 836 20.536 -0.959 1.690 1.00 0.00 H new ATOM 0 HB3 ALA A 836 19.937 -2.440 2.474 1.00 0.00 H new ATOM 927 N LEU A 837 17.719 -2.180 4.463 1.00 0.00 N ATOM 928 CA LEU A 837 16.582 -2.851 5.068 1.00 0.00 C ATOM 929 C LEU A 837 15.560 -1.823 5.533 1.00 0.00 C ATOM 930 O LEU A 837 14.367 -1.963 5.275 1.00 0.00 O ATOM 931 CB LEU A 837 17.039 -3.700 6.257 1.00 0.00 C ATOM 932 CG LEU A 837 17.237 -5.185 5.962 1.00 0.00 C ATOM 933 CD1 LEU A 837 18.412 -5.735 6.754 1.00 0.00 C ATOM 934 CD2 LEU A 837 15.968 -5.962 6.275 1.00 0.00 C ATOM 0 H LEU A 837 18.612 -2.389 4.910 1.00 0.00 H new ATOM 0 HA LEU A 837 16.124 -3.502 4.324 1.00 0.00 H new ATOM 0 HB2 LEU A 837 17.978 -3.293 6.633 1.00 0.00 H new ATOM 0 HB3 LEU A 837 16.305 -3.600 7.057 1.00 0.00 H new ATOM 0 HG LEU A 837 17.458 -5.300 4.901 1.00 0.00 H new ATOM 0 HD11 LEU A 837 18.537 -6.794 6.531 1.00 0.00 H new ATOM 0 HD12 LEU A 837 19.319 -5.197 6.480 1.00 0.00 H new ATOM 0 HD13 LEU A 837 18.223 -5.609 7.820 1.00 0.00 H new ATOM 0 HD21 LEU A 837 16.126 -7.019 6.059 1.00 0.00 H new ATOM 0 HD22 LEU A 837 15.717 -5.840 7.329 1.00 0.00 H new ATOM 0 HD23 LEU A 837 15.150 -5.585 5.662 1.00 0.00 H new ATOM 946 N ALA A 838 16.047 -0.784 6.200 1.00 0.00 N ATOM 947 CA ALA A 838 15.189 0.286 6.694 1.00 0.00 C ATOM 948 C ALA A 838 14.559 1.063 5.546 1.00 0.00 C ATOM 949 O ALA A 838 13.383 1.410 5.604 1.00 0.00 O ATOM 950 CB ALA A 838 15.970 1.223 7.596 1.00 0.00 C ATOM 0 H ALA A 838 17.037 -0.659 6.412 1.00 0.00 H new ATOM 0 HA ALA A 838 14.387 -0.172 7.273 1.00 0.00 H new ATOM 0 HB1 ALA A 838 15.312 2.015 7.955 1.00 0.00 H new ATOM 0 HB2 ALA A 838 16.364 0.666 8.446 1.00 0.00 H new ATOM 0 HB3 ALA A 838 16.796 1.663 7.036 1.00 0.00 H new ATOM 956 N GLN A 839 15.342 1.339 4.506 1.00 0.00 N ATOM 957 CA GLN A 839 14.830 2.045 3.335 1.00 0.00 C ATOM 958 C GLN A 839 13.766 1.218 2.612 1.00 0.00 C ATOM 959 O GLN A 839 12.759 1.757 2.151 1.00 0.00 O ATOM 960 CB GLN A 839 15.969 2.397 2.382 1.00 0.00 C ATOM 961 CG GLN A 839 16.551 3.776 2.638 1.00 0.00 C ATOM 962 CD GLN A 839 15.493 4.867 2.655 1.00 0.00 C ATOM 963 OE1 GLN A 839 14.851 5.148 1.643 1.00 0.00 O ATOM 964 NE2 GLN A 839 15.300 5.488 3.810 1.00 0.00 N ATOM 0 H GLN A 839 16.329 1.086 4.450 1.00 0.00 H new ATOM 0 HA GLN A 839 14.363 2.968 3.678 1.00 0.00 H new ATOM 0 HB2 GLN A 839 16.759 1.652 2.477 1.00 0.00 H new ATOM 0 HB3 GLN A 839 15.605 2.347 1.356 1.00 0.00 H new ATOM 0 HG2 GLN A 839 17.078 3.772 3.592 1.00 0.00 H new ATOM 0 HG3 GLN A 839 17.288 4.003 1.868 1.00 0.00 H new ATOM 0 HE21 GLN A 839 15.852 5.227 4.628 1.00 0.00 H new ATOM 0 HE22 GLN A 839 14.600 6.226 3.881 1.00 0.00 H new ATOM 973 N THR A 840 13.977 -0.088 2.524 1.00 0.00 N ATOM 974 CA THR A 840 13.006 -0.965 1.883 1.00 0.00 C ATOM 975 C THR A 840 11.783 -1.165 2.778 1.00 0.00 C ATOM 976 O THR A 840 10.653 -1.204 2.296 1.00 0.00 O ATOM 977 CB THR A 840 13.632 -2.323 1.514 1.00 0.00 C ATOM 978 OG1 THR A 840 14.933 -2.108 0.951 1.00 0.00 O ATOM 979 CG2 THR A 840 12.767 -3.069 0.511 1.00 0.00 C ATOM 0 H THR A 840 14.805 -0.561 2.885 1.00 0.00 H new ATOM 0 HA THR A 840 12.685 -0.483 0.960 1.00 0.00 H new ATOM 0 HB THR A 840 13.708 -2.925 2.419 1.00 0.00 H new ATOM 0 HG1 THR A 840 15.601 -2.094 1.668 1.00 0.00 H new ATOM 0 HG21 THR A 840 13.233 -4.024 0.268 1.00 0.00 H new ATOM 0 HG22 THR A 840 11.781 -3.245 0.941 1.00 0.00 H new ATOM 0 HG23 THR A 840 12.666 -2.474 -0.396 1.00 0.00 H new ATOM 987 N ALA A 841 12.007 -1.268 4.082 1.00 0.00 N ATOM 988 CA ALA A 841 10.906 -1.327 5.033 1.00 0.00 C ATOM 989 C ALA A 841 10.119 -0.025 4.995 1.00 0.00 C ATOM 990 O ALA A 841 8.901 -0.016 5.161 1.00 0.00 O ATOM 991 CB ALA A 841 11.424 -1.598 6.437 1.00 0.00 C ATOM 0 H ALA A 841 12.935 -1.312 4.503 1.00 0.00 H new ATOM 0 HA ALA A 841 10.244 -2.147 4.753 1.00 0.00 H new ATOM 0 HB1 ALA A 841 10.586 -1.638 7.133 1.00 0.00 H new ATOM 0 HB2 ALA A 841 11.954 -2.550 6.452 1.00 0.00 H new ATOM 0 HB3 ALA A 841 12.104 -0.800 6.734 1.00 0.00 H new ATOM 997 N HIS A 842 10.836 1.070 4.769 1.00 0.00 N ATOM 998 CA HIS A 842 10.229 2.379 4.573 1.00 0.00 C ATOM 999 C HIS A 842 9.298 2.347 3.371 1.00 0.00 C ATOM 1000 O HIS A 842 8.184 2.865 3.419 1.00 0.00 O ATOM 1001 CB HIS A 842 11.321 3.429 4.349 1.00 0.00 C ATOM 1002 CG HIS A 842 11.240 4.632 5.236 1.00 0.00 C ATOM 1003 ND1 HIS A 842 11.112 4.567 6.609 1.00 0.00 N ATOM 1004 CD2 HIS A 842 11.302 5.948 4.932 1.00 0.00 C ATOM 1005 CE1 HIS A 842 11.106 5.790 7.105 1.00 0.00 C ATOM 1006 NE2 HIS A 842 11.220 6.647 6.109 1.00 0.00 N ATOM 0 H HIS A 842 11.855 1.074 4.717 1.00 0.00 H new ATOM 0 HA HIS A 842 9.655 2.639 5.462 1.00 0.00 H new ATOM 0 HB2 HIS A 842 12.292 2.956 4.493 1.00 0.00 H new ATOM 0 HB3 HIS A 842 11.278 3.759 3.311 1.00 0.00 H new ATOM 0 HD1 HIS A 842 11.034 3.709 7.154 1.00 0.00 H new ATOM 0 HD2 HIS A 842 11.398 6.371 3.943 1.00 0.00 H new ATOM 0 HE1 HIS A 842 11.022 6.046 8.151 1.00 0.00 H new ATOM 1015 N ARG A 843 9.769 1.728 2.296 1.00 0.00 N ATOM 1016 CA ARG A 843 8.980 1.577 1.079 1.00 0.00 C ATOM 1017 C ARG A 843 7.753 0.708 1.331 1.00 0.00 C ATOM 1018 O ARG A 843 6.646 1.048 0.920 1.00 0.00 O ATOM 1019 CB ARG A 843 9.836 0.963 -0.030 1.00 0.00 C ATOM 1020 CG ARG A 843 10.017 1.876 -1.229 1.00 0.00 C ATOM 1021 CD ARG A 843 11.136 1.391 -2.136 1.00 0.00 C ATOM 1022 NE ARG A 843 12.461 1.663 -1.571 1.00 0.00 N ATOM 1023 CZ ARG A 843 13.075 2.850 -1.618 1.00 0.00 C ATOM 1024 NH1 ARG A 843 12.492 3.887 -2.210 1.00 0.00 N ATOM 1025 NH2 ARG A 843 14.278 2.989 -1.076 1.00 0.00 N ATOM 0 H ARG A 843 10.702 1.319 2.242 1.00 0.00 H new ATOM 0 HA ARG A 843 8.643 2.565 0.766 1.00 0.00 H new ATOM 0 HB2 ARG A 843 10.816 0.710 0.376 1.00 0.00 H new ATOM 0 HB3 ARG A 843 9.377 0.031 -0.359 1.00 0.00 H new ATOM 0 HG2 ARG A 843 9.086 1.926 -1.793 1.00 0.00 H new ATOM 0 HG3 ARG A 843 10.237 2.887 -0.887 1.00 0.00 H new ATOM 0 HD2 ARG A 843 11.027 0.320 -2.304 1.00 0.00 H new ATOM 0 HD3 ARG A 843 11.050 1.877 -3.108 1.00 0.00 H new ATOM 0 HE ARG A 843 12.948 0.894 -1.110 1.00 0.00 H new ATOM 0 HH11 ARG A 843 11.570 3.781 -2.633 1.00 0.00 H new ATOM 0 HH12 ARG A 843 12.967 4.789 -2.242 1.00 0.00 H new ATOM 0 HH21 ARG A 843 14.730 2.193 -0.626 1.00 0.00 H new ATOM 0 HH22 ARG A 843 14.751 3.892 -1.109 1.00 0.00 H new ATOM 1039 N LEU A 844 7.953 -0.401 2.033 1.00 0.00 N ATOM 1040 CA LEU A 844 6.870 -1.339 2.314 1.00 0.00 C ATOM 1041 C LEU A 844 5.838 -0.699 3.236 1.00 0.00 C ATOM 1042 O LEU A 844 4.631 -0.878 3.064 1.00 0.00 O ATOM 1043 CB LEU A 844 7.419 -2.618 2.952 1.00 0.00 C ATOM 1044 CG LEU A 844 7.593 -3.811 2.005 1.00 0.00 C ATOM 1045 CD1 LEU A 844 6.357 -4.007 1.140 1.00 0.00 C ATOM 1046 CD2 LEU A 844 8.829 -3.627 1.137 1.00 0.00 C ATOM 0 H LEU A 844 8.857 -0.674 2.419 1.00 0.00 H new ATOM 0 HA LEU A 844 6.388 -1.597 1.371 1.00 0.00 H new ATOM 0 HB2 LEU A 844 8.385 -2.391 3.403 1.00 0.00 H new ATOM 0 HB3 LEU A 844 6.751 -2.914 3.761 1.00 0.00 H new ATOM 0 HG LEU A 844 7.725 -4.707 2.611 1.00 0.00 H new ATOM 0 HD11 LEU A 844 6.508 -4.860 0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 844 5.492 -4.191 1.777 1.00 0.00 H new ATOM 0 HD13 LEU A 844 6.184 -3.111 0.544 1.00 0.00 H new ATOM 0 HD21 LEU A 844 8.937 -4.483 0.471 1.00 0.00 H new ATOM 0 HD22 LEU A 844 8.726 -2.718 0.545 1.00 0.00 H new ATOM 0 HD23 LEU A 844 9.711 -3.548 1.772 1.00 0.00 H new ATOM 1058 N LYS A 845 6.322 0.047 4.214 1.00 0.00 N ATOM 1059 CA LYS A 845 5.453 0.794 5.109 1.00 0.00 C ATOM 1060 C LYS A 845 4.674 1.841 4.318 1.00 0.00 C ATOM 1061 O LYS A 845 3.483 2.045 4.543 1.00 0.00 O ATOM 1062 CB LYS A 845 6.294 1.447 6.215 1.00 0.00 C ATOM 1063 CG LYS A 845 5.732 2.751 6.762 1.00 0.00 C ATOM 1064 CD LYS A 845 6.768 3.489 7.596 1.00 0.00 C ATOM 1065 CE LYS A 845 7.384 2.579 8.648 1.00 0.00 C ATOM 1066 NZ LYS A 845 8.065 3.351 9.718 1.00 0.00 N ATOM 0 H LYS A 845 7.318 0.152 4.410 1.00 0.00 H new ATOM 0 HA LYS A 845 4.736 0.119 5.576 1.00 0.00 H new ATOM 0 HB2 LYS A 845 6.398 0.740 7.038 1.00 0.00 H new ATOM 0 HB3 LYS A 845 7.295 1.634 5.827 1.00 0.00 H new ATOM 0 HG2 LYS A 845 5.407 3.385 5.937 1.00 0.00 H new ATOM 0 HG3 LYS A 845 4.852 2.544 7.371 1.00 0.00 H new ATOM 0 HD2 LYS A 845 7.551 3.878 6.945 1.00 0.00 H new ATOM 0 HD3 LYS A 845 6.302 4.346 8.082 1.00 0.00 H new ATOM 0 HE2 LYS A 845 6.606 1.956 9.089 1.00 0.00 H new ATOM 0 HE3 LYS A 845 8.100 1.908 8.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 845 9.095 3.261 9.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 845 7.795 4.353 9.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 845 7.782 2.980 10.647 1.00 0.00 H new ATOM 1080 N GLY A 846 5.357 2.472 3.370 1.00 0.00 N ATOM 1081 CA GLY A 846 4.741 3.498 2.556 1.00 0.00 C ATOM 1082 C GLY A 846 3.680 2.953 1.621 1.00 0.00 C ATOM 1083 O GLY A 846 2.599 3.528 1.511 1.00 0.00 O ATOM 0 H GLY A 846 6.336 2.287 3.151 1.00 0.00 H new ATOM 0 HA2 GLY A 846 4.293 4.250 3.206 1.00 0.00 H new ATOM 0 HA3 GLY A 846 5.511 4.000 1.970 1.00 0.00 H new ATOM 1087 N VAL A 847 3.980 1.848 0.942 1.00 0.00 N ATOM 1088 CA VAL A 847 3.027 1.262 0.001 1.00 0.00 C ATOM 1089 C VAL A 847 1.787 0.743 0.722 1.00 0.00 C ATOM 1090 O VAL A 847 0.660 0.951 0.264 1.00 0.00 O ATOM 1091 CB VAL A 847 3.648 0.130 -0.854 1.00 0.00 C ATOM 1092 CG1 VAL A 847 4.657 0.699 -1.834 1.00 0.00 C ATOM 1093 CG2 VAL A 847 4.292 -0.941 0.006 1.00 0.00 C ATOM 0 H VAL A 847 4.864 1.345 1.023 1.00 0.00 H new ATOM 0 HA VAL A 847 2.739 2.066 -0.676 1.00 0.00 H new ATOM 0 HB VAL A 847 2.838 -0.341 -1.411 1.00 0.00 H new ATOM 0 HG11 VAL A 847 5.084 -0.110 -2.427 1.00 0.00 H new ATOM 0 HG12 VAL A 847 4.161 1.411 -2.494 1.00 0.00 H new ATOM 0 HG13 VAL A 847 5.451 1.205 -1.286 1.00 0.00 H new ATOM 0 HG21 VAL A 847 4.715 -1.716 -0.634 1.00 0.00 H new ATOM 0 HG22 VAL A 847 5.083 -0.496 0.609 1.00 0.00 H new ATOM 0 HG23 VAL A 847 3.541 -1.382 0.661 1.00 0.00 H new ATOM 1103 N PHE A 848 1.985 0.099 1.868 1.00 0.00 N ATOM 1104 CA PHE A 848 0.870 -0.431 2.636 1.00 0.00 C ATOM 1105 C PHE A 848 0.028 0.711 3.199 1.00 0.00 C ATOM 1106 O PHE A 848 -1.198 0.651 3.184 1.00 0.00 O ATOM 1107 CB PHE A 848 1.373 -1.351 3.753 1.00 0.00 C ATOM 1108 CG PHE A 848 1.665 -2.759 3.289 1.00 0.00 C ATOM 1109 CD1 PHE A 848 0.746 -3.456 2.518 1.00 0.00 C ATOM 1110 CD2 PHE A 848 2.859 -3.382 3.622 1.00 0.00 C ATOM 1111 CE1 PHE A 848 1.012 -4.745 2.090 1.00 0.00 C ATOM 1112 CE2 PHE A 848 3.130 -4.671 3.196 1.00 0.00 C ATOM 1113 CZ PHE A 848 2.204 -5.354 2.429 1.00 0.00 C ATOM 0 H PHE A 848 2.903 -0.067 2.281 1.00 0.00 H new ATOM 0 HA PHE A 848 0.239 -1.025 1.975 1.00 0.00 H new ATOM 0 HB2 PHE A 848 2.278 -0.924 4.184 1.00 0.00 H new ATOM 0 HB3 PHE A 848 0.627 -1.386 4.547 1.00 0.00 H new ATOM 0 HD1 PHE A 848 -0.189 -2.987 2.248 1.00 0.00 H new ATOM 0 HD2 PHE A 848 3.586 -2.855 4.221 1.00 0.00 H new ATOM 0 HE1 PHE A 848 0.287 -5.275 1.490 1.00 0.00 H new ATOM 0 HE2 PHE A 848 4.064 -5.143 3.463 1.00 0.00 H new ATOM 0 HZ PHE A 848 2.412 -6.360 2.096 1.00 0.00 H new ATOM 1123 N ALA A 849 0.688 1.765 3.668 1.00 0.00 N ATOM 1124 CA ALA A 849 -0.014 2.937 4.180 1.00 0.00 C ATOM 1125 C ALA A 849 -0.767 3.650 3.062 1.00 0.00 C ATOM 1126 O ALA A 849 -1.852 4.190 3.278 1.00 0.00 O ATOM 1127 CB ALA A 849 0.960 3.890 4.854 1.00 0.00 C ATOM 0 H ALA A 849 1.705 1.832 3.704 1.00 0.00 H new ATOM 0 HA ALA A 849 -0.740 2.601 4.920 1.00 0.00 H new ATOM 0 HB1 ALA A 849 0.418 4.758 5.230 1.00 0.00 H new ATOM 0 HB2 ALA A 849 1.451 3.382 5.684 1.00 0.00 H new ATOM 0 HB3 ALA A 849 1.710 4.214 4.132 1.00 0.00 H new ATOM 1133 N MET A 850 -0.186 3.637 1.867 1.00 0.00 N ATOM 1134 CA MET A 850 -0.800 4.242 0.689 1.00 0.00 C ATOM 1135 C MET A 850 -2.136 3.583 0.378 1.00 0.00 C ATOM 1136 O MET A 850 -3.137 4.258 0.138 1.00 0.00 O ATOM 1137 CB MET A 850 0.133 4.108 -0.518 1.00 0.00 C ATOM 1138 CG MET A 850 -0.387 4.776 -1.780 1.00 0.00 C ATOM 1139 SD MET A 850 -0.868 3.596 -3.056 1.00 0.00 S ATOM 1140 CE MET A 850 -1.663 4.680 -4.239 1.00 0.00 C ATOM 0 H MET A 850 0.722 3.208 1.687 1.00 0.00 H new ATOM 0 HA MET A 850 -0.972 5.298 0.898 1.00 0.00 H new ATOM 0 HB2 MET A 850 1.102 4.538 -0.265 1.00 0.00 H new ATOM 0 HB3 MET A 850 0.298 3.050 -0.721 1.00 0.00 H new ATOM 0 HG2 MET A 850 -1.245 5.399 -1.527 1.00 0.00 H new ATOM 0 HG3 MET A 850 0.382 5.438 -2.177 1.00 0.00 H new ATOM 0 HE1 MET A 850 -2.016 4.095 -5.089 1.00 0.00 H new ATOM 0 HE2 MET A 850 -2.509 5.178 -3.765 1.00 0.00 H new ATOM 0 HE3 MET A 850 -0.949 5.428 -4.584 1.00 0.00 H new ATOM 1150 N LEU A 851 -2.142 2.259 0.387 1.00 0.00 N ATOM 1151 CA LEU A 851 -3.347 1.500 0.094 1.00 0.00 C ATOM 1152 C LEU A 851 -4.190 1.308 1.356 1.00 0.00 C ATOM 1153 O LEU A 851 -5.293 0.763 1.299 1.00 0.00 O ATOM 1154 CB LEU A 851 -2.969 0.151 -0.515 1.00 0.00 C ATOM 1155 CG LEU A 851 -1.904 0.221 -1.617 1.00 0.00 C ATOM 1156 CD1 LEU A 851 -1.063 -1.050 -1.635 1.00 0.00 C ATOM 1157 CD2 LEU A 851 -2.554 0.450 -2.972 1.00 0.00 C ATOM 0 H LEU A 851 -1.323 1.687 0.595 1.00 0.00 H new ATOM 0 HA LEU A 851 -3.948 2.057 -0.625 1.00 0.00 H new ATOM 0 HB2 LEU A 851 -2.608 -0.502 0.279 1.00 0.00 H new ATOM 0 HB3 LEU A 851 -3.867 -0.312 -0.925 1.00 0.00 H new ATOM 0 HG LEU A 851 -1.246 1.063 -1.403 1.00 0.00 H new ATOM 0 HD11 LEU A 851 -0.314 -0.980 -2.424 1.00 0.00 H new ATOM 0 HD12 LEU A 851 -0.566 -1.171 -0.672 1.00 0.00 H new ATOM 0 HD13 LEU A 851 -1.707 -1.910 -1.822 1.00 0.00 H new ATOM 0 HD21 LEU A 851 -1.784 0.497 -3.742 1.00 0.00 H new ATOM 0 HD22 LEU A 851 -3.237 -0.371 -3.191 1.00 0.00 H new ATOM 0 HD23 LEU A 851 -3.108 1.388 -2.956 1.00 0.00 H new ATOM 1169 N ASN A 852 -3.637 1.747 2.488 1.00 0.00 N ATOM 1170 CA ASN A 852 -4.322 1.733 3.786 1.00 0.00 C ATOM 1171 C ASN A 852 -4.471 0.312 4.311 1.00 0.00 C ATOM 1172 O ASN A 852 -5.450 -0.032 4.973 1.00 0.00 O ATOM 1173 CB ASN A 852 -5.683 2.436 3.726 1.00 0.00 C ATOM 1174 CG ASN A 852 -5.936 3.288 4.959 1.00 0.00 C ATOM 1175 OD1 ASN A 852 -6.326 2.784 6.014 1.00 0.00 O ATOM 1176 ND2 ASN A 852 -5.706 4.586 4.840 1.00 0.00 N ATOM 0 H ASN A 852 -2.691 2.127 2.532 1.00 0.00 H new ATOM 0 HA ASN A 852 -3.698 2.293 4.482 1.00 0.00 H new ATOM 0 HB2 ASN A 852 -5.729 3.063 2.836 1.00 0.00 H new ATOM 0 HB3 ASN A 852 -6.473 1.691 3.632 1.00 0.00 H new ATOM 0 HD21 ASN A 852 -5.851 5.205 5.638 1.00 0.00 H new ATOM 0 HD22 ASN A 852 -5.384 4.967 3.951 1.00 0.00 H new ATOM 1183 N LEU A 853 -3.476 -0.506 4.024 1.00 0.00 N ATOM 1184 CA LEU A 853 -3.418 -1.849 4.560 1.00 0.00 C ATOM 1185 C LEU A 853 -2.768 -1.810 5.937 1.00 0.00 C ATOM 1186 O LEU A 853 -1.562 -2.030 6.080 1.00 0.00 O ATOM 1187 CB LEU A 853 -2.644 -2.768 3.612 1.00 0.00 C ATOM 1188 CG LEU A 853 -3.511 -3.547 2.619 1.00 0.00 C ATOM 1189 CD1 LEU A 853 -2.646 -4.441 1.749 1.00 0.00 C ATOM 1190 CD2 LEU A 853 -4.556 -4.374 3.354 1.00 0.00 C ATOM 0 H LEU A 853 -2.693 -0.260 3.418 1.00 0.00 H new ATOM 0 HA LEU A 853 -4.427 -2.248 4.657 1.00 0.00 H new ATOM 0 HB2 LEU A 853 -1.927 -2.168 3.053 1.00 0.00 H new ATOM 0 HB3 LEU A 853 -2.070 -3.479 4.206 1.00 0.00 H new ATOM 0 HG LEU A 853 -4.027 -2.832 1.978 1.00 0.00 H new ATOM 0 HD11 LEU A 853 -3.277 -4.988 1.049 1.00 0.00 H new ATOM 0 HD12 LEU A 853 -1.934 -3.830 1.195 1.00 0.00 H new ATOM 0 HD13 LEU A 853 -2.105 -5.148 2.378 1.00 0.00 H new ATOM 0 HD21 LEU A 853 -5.162 -4.920 2.631 1.00 0.00 H new ATOM 0 HD22 LEU A 853 -4.059 -5.081 4.019 1.00 0.00 H new ATOM 0 HD23 LEU A 853 -5.196 -3.714 3.939 1.00 0.00 H new ATOM 1202 N VAL A 854 -3.589 -1.489 6.937 1.00 0.00 N ATOM 1203 CA VAL A 854 -3.135 -1.331 8.318 1.00 0.00 C ATOM 1204 C VAL A 854 -2.275 -2.509 8.799 1.00 0.00 C ATOM 1205 O VAL A 854 -1.156 -2.285 9.259 1.00 0.00 O ATOM 1206 CB VAL A 854 -4.333 -1.109 9.277 1.00 0.00 C ATOM 1207 CG1 VAL A 854 -3.951 -1.392 10.723 1.00 0.00 C ATOM 1208 CG2 VAL A 854 -4.859 0.310 9.140 1.00 0.00 C ATOM 0 H VAL A 854 -4.589 -1.331 6.812 1.00 0.00 H new ATOM 0 HA VAL A 854 -2.501 -0.444 8.333 1.00 0.00 H new ATOM 0 HB VAL A 854 -5.119 -1.811 8.997 1.00 0.00 H new ATOM 0 HG11 VAL A 854 -4.815 -1.226 11.367 1.00 0.00 H new ATOM 0 HG12 VAL A 854 -3.622 -2.427 10.817 1.00 0.00 H new ATOM 0 HG13 VAL A 854 -3.142 -0.726 11.023 1.00 0.00 H new ATOM 0 HG21 VAL A 854 -5.700 0.453 9.818 1.00 0.00 H new ATOM 0 HG22 VAL A 854 -4.068 1.017 9.389 1.00 0.00 H new ATOM 0 HG23 VAL A 854 -5.187 0.479 8.114 1.00 0.00 H new ATOM 1218 N PRO A 855 -2.757 -3.770 8.698 1.00 0.00 N ATOM 1219 CA PRO A 855 -1.990 -4.935 9.163 1.00 0.00 C ATOM 1220 C PRO A 855 -0.603 -5.008 8.523 1.00 0.00 C ATOM 1221 O PRO A 855 0.393 -5.265 9.203 1.00 0.00 O ATOM 1222 CB PRO A 855 -2.841 -6.129 8.728 1.00 0.00 C ATOM 1223 CG PRO A 855 -4.221 -5.591 8.587 1.00 0.00 C ATOM 1224 CD PRO A 855 -4.068 -4.165 8.144 1.00 0.00 C ATOM 0 HA PRO A 855 -1.810 -4.897 10.237 1.00 0.00 H new ATOM 0 HB2 PRO A 855 -2.483 -6.546 7.787 1.00 0.00 H new ATOM 0 HB3 PRO A 855 -2.804 -6.930 9.467 1.00 0.00 H new ATOM 0 HG2 PRO A 855 -4.791 -6.167 7.858 1.00 0.00 H new ATOM 0 HG3 PRO A 855 -4.761 -5.650 9.532 1.00 0.00 H new ATOM 0 HD2 PRO A 855 -4.087 -4.078 7.058 1.00 0.00 H new ATOM 0 HD3 PRO A 855 -4.872 -3.537 8.528 1.00 0.00 H new ATOM 1232 N GLY A 856 -0.546 -4.765 7.220 1.00 0.00 N ATOM 1233 CA GLY A 856 0.718 -4.788 6.515 1.00 0.00 C ATOM 1234 C GLY A 856 1.653 -3.686 6.971 1.00 0.00 C ATOM 1235 O GLY A 856 2.818 -3.935 7.268 1.00 0.00 O ATOM 0 H GLY A 856 -1.356 -4.552 6.638 1.00 0.00 H new ATOM 0 HA2 GLY A 856 1.198 -5.755 6.667 1.00 0.00 H new ATOM 0 HA3 GLY A 856 0.536 -4.687 5.445 1.00 0.00 H new ATOM 1239 N LYS A 857 1.136 -2.466 7.044 1.00 0.00 N ATOM 1240 CA LYS A 857 1.939 -1.323 7.459 1.00 0.00 C ATOM 1241 C LYS A 857 2.381 -1.476 8.918 1.00 0.00 C ATOM 1242 O LYS A 857 3.499 -1.104 9.276 1.00 0.00 O ATOM 1243 CB LYS A 857 1.150 -0.022 7.246 1.00 0.00 C ATOM 1244 CG LYS A 857 1.727 1.189 7.965 1.00 0.00 C ATOM 1245 CD LYS A 857 0.797 1.683 9.062 1.00 0.00 C ATOM 1246 CE LYS A 857 0.153 3.016 8.704 1.00 0.00 C ATOM 1247 NZ LYS A 857 -0.615 3.584 9.844 1.00 0.00 N ATOM 0 H LYS A 857 0.166 -2.243 6.822 1.00 0.00 H new ATOM 0 HA LYS A 857 2.839 -1.280 6.846 1.00 0.00 H new ATOM 0 HB2 LYS A 857 1.107 0.192 6.178 1.00 0.00 H new ATOM 0 HB3 LYS A 857 0.124 -0.174 7.582 1.00 0.00 H new ATOM 0 HG2 LYS A 857 2.694 0.930 8.396 1.00 0.00 H new ATOM 0 HG3 LYS A 857 1.902 1.990 7.247 1.00 0.00 H new ATOM 0 HD2 LYS A 857 0.019 0.940 9.240 1.00 0.00 H new ATOM 0 HD3 LYS A 857 1.356 1.788 9.992 1.00 0.00 H new ATOM 0 HE2 LYS A 857 0.925 3.722 8.399 1.00 0.00 H new ATOM 0 HE3 LYS A 857 -0.511 2.881 7.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 857 -1.038 4.491 9.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 857 -1.368 2.922 10.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 857 0.023 3.737 10.651 1.00 0.00 H new ATOM 1261 N GLN A 858 1.508 -2.045 9.743 1.00 0.00 N ATOM 1262 CA GLN A 858 1.831 -2.306 11.144 1.00 0.00 C ATOM 1263 C GLN A 858 2.987 -3.298 11.240 1.00 0.00 C ATOM 1264 O GLN A 858 3.850 -3.190 12.118 1.00 0.00 O ATOM 1265 CB GLN A 858 0.591 -2.832 11.885 1.00 0.00 C ATOM 1266 CG GLN A 858 0.667 -4.295 12.301 1.00 0.00 C ATOM 1267 CD GLN A 858 0.205 -4.527 13.724 1.00 0.00 C ATOM 1268 OE1 GLN A 858 0.836 -4.072 14.676 1.00 0.00 O ATOM 1269 NE2 GLN A 858 -0.906 -5.233 13.882 1.00 0.00 N ATOM 0 H GLN A 858 0.570 -2.335 9.467 1.00 0.00 H new ATOM 0 HA GLN A 858 2.140 -1.374 11.618 1.00 0.00 H new ATOM 0 HB2 GLN A 858 0.432 -2.224 12.775 1.00 0.00 H new ATOM 0 HB3 GLN A 858 -0.281 -2.696 11.246 1.00 0.00 H new ATOM 0 HG2 GLN A 858 0.056 -4.892 11.624 1.00 0.00 H new ATOM 0 HG3 GLN A 858 1.694 -4.645 12.196 1.00 0.00 H new ATOM 0 HE21 GLN A 858 -1.401 -5.594 13.067 1.00 0.00 H new ATOM 0 HE22 GLN A 858 -1.265 -5.415 14.819 1.00 0.00 H new ATOM 1278 N LEU A 859 3.005 -4.259 10.322 1.00 0.00 N ATOM 1279 CA LEU A 859 4.083 -5.226 10.260 1.00 0.00 C ATOM 1280 C LEU A 859 5.395 -4.520 9.930 1.00 0.00 C ATOM 1281 O LEU A 859 6.421 -4.766 10.563 1.00 0.00 O ATOM 1282 CB LEU A 859 3.784 -6.304 9.214 1.00 0.00 C ATOM 1283 CG LEU A 859 3.426 -7.678 9.780 1.00 0.00 C ATOM 1284 CD1 LEU A 859 2.473 -8.407 8.849 1.00 0.00 C ATOM 1285 CD2 LEU A 859 4.679 -8.507 10.010 1.00 0.00 C ATOM 0 H LEU A 859 2.283 -4.385 9.613 1.00 0.00 H new ATOM 0 HA LEU A 859 4.173 -5.710 11.233 1.00 0.00 H new ATOM 0 HB2 LEU A 859 2.961 -5.961 8.587 1.00 0.00 H new ATOM 0 HB3 LEU A 859 4.654 -6.411 8.567 1.00 0.00 H new ATOM 0 HG LEU A 859 2.929 -7.532 10.739 1.00 0.00 H new ATOM 0 HD11 LEU A 859 2.230 -9.383 9.269 1.00 0.00 H new ATOM 0 HD12 LEU A 859 1.559 -7.824 8.734 1.00 0.00 H new ATOM 0 HD13 LEU A 859 2.945 -8.538 7.875 1.00 0.00 H new ATOM 0 HD21 LEU A 859 4.402 -9.481 10.413 1.00 0.00 H new ATOM 0 HD22 LEU A 859 5.205 -8.642 9.065 1.00 0.00 H new ATOM 0 HD23 LEU A 859 5.330 -7.994 10.717 1.00 0.00 H new ATOM 1297 N CYS A 860 5.337 -3.622 8.951 1.00 0.00 N ATOM 1298 CA CYS A 860 6.507 -2.855 8.527 1.00 0.00 C ATOM 1299 C CYS A 860 7.016 -1.947 9.648 1.00 0.00 C ATOM 1300 O CYS A 860 8.223 -1.835 9.857 1.00 0.00 O ATOM 1301 CB CYS A 860 6.168 -2.022 7.287 1.00 0.00 C ATOM 1302 SG CYS A 860 5.479 -2.979 5.921 1.00 0.00 S ATOM 0 H CYS A 860 4.486 -3.406 8.432 1.00 0.00 H new ATOM 0 HA CYS A 860 7.301 -3.561 8.281 1.00 0.00 H new ATOM 0 HB2 CYS A 860 5.456 -1.246 7.568 1.00 0.00 H new ATOM 0 HB3 CYS A 860 7.071 -1.517 6.944 1.00 0.00 H new ATOM 0 HG CYS A 860 4.326 -3.467 6.271 1.00 0.00 H new ATOM 1308 N GLU A 861 6.098 -1.298 10.360 1.00 0.00 N ATOM 1309 CA GLU A 861 6.463 -0.437 11.487 1.00 0.00 C ATOM 1310 C GLU A 861 7.241 -1.227 12.539 1.00 0.00 C ATOM 1311 O GLU A 861 8.303 -0.798 13.003 1.00 0.00 O ATOM 1312 CB GLU A 861 5.212 0.181 12.124 1.00 0.00 C ATOM 1313 CG GLU A 861 4.546 1.243 11.262 1.00 0.00 C ATOM 1314 CD GLU A 861 5.325 2.546 11.216 1.00 0.00 C ATOM 1315 OE1 GLU A 861 6.430 2.617 11.801 1.00 0.00 O ATOM 1316 OE2 GLU A 861 4.847 3.503 10.580 1.00 0.00 O ATOM 0 H GLU A 861 5.096 -1.351 10.178 1.00 0.00 H new ATOM 0 HA GLU A 861 7.097 0.364 11.106 1.00 0.00 H new ATOM 0 HB2 GLU A 861 4.492 -0.611 12.330 1.00 0.00 H new ATOM 0 HB3 GLU A 861 5.484 0.622 13.083 1.00 0.00 H new ATOM 0 HG2 GLU A 861 4.430 0.860 10.248 1.00 0.00 H new ATOM 0 HG3 GLU A 861 3.545 1.438 11.645 1.00 0.00 H new ATOM 1323 N THR A 862 6.714 -2.393 12.896 1.00 0.00 N ATOM 1324 CA THR A 862 7.357 -3.259 13.874 1.00 0.00 C ATOM 1325 C THR A 862 8.682 -3.798 13.335 1.00 0.00 C ATOM 1326 O THR A 862 9.657 -3.938 14.075 1.00 0.00 O ATOM 1327 CB THR A 862 6.437 -4.429 14.273 1.00 0.00 C ATOM 1328 OG1 THR A 862 5.108 -3.941 14.520 1.00 0.00 O ATOM 1329 CG2 THR A 862 6.959 -5.130 15.520 1.00 0.00 C ATOM 0 H THR A 862 5.840 -2.760 12.520 1.00 0.00 H new ATOM 0 HA THR A 862 7.556 -2.659 14.762 1.00 0.00 H new ATOM 0 HB THR A 862 6.420 -5.146 13.452 1.00 0.00 H new ATOM 0 HG1 THR A 862 4.651 -3.790 13.666 1.00 0.00 H new ATOM 0 HG21 THR A 862 6.292 -5.952 15.781 1.00 0.00 H new ATOM 0 HG22 THR A 862 7.958 -5.521 15.327 1.00 0.00 H new ATOM 0 HG23 THR A 862 7.001 -4.420 16.346 1.00 0.00 H new ATOM 1337 N LEU A 863 8.715 -4.077 12.036 1.00 0.00 N ATOM 1338 CA LEU A 863 9.936 -4.524 11.381 1.00 0.00 C ATOM 1339 C LEU A 863 11.004 -3.437 11.444 1.00 0.00 C ATOM 1340 O LEU A 863 12.160 -3.712 11.752 1.00 0.00 O ATOM 1341 CB LEU A 863 9.660 -4.906 9.926 1.00 0.00 C ATOM 1342 CG LEU A 863 9.853 -6.388 9.599 1.00 0.00 C ATOM 1343 CD1 LEU A 863 9.136 -6.749 8.307 1.00 0.00 C ATOM 1344 CD2 LEU A 863 11.333 -6.717 9.499 1.00 0.00 C ATOM 0 H LEU A 863 7.908 -4.001 11.417 1.00 0.00 H new ATOM 0 HA LEU A 863 10.301 -5.406 11.908 1.00 0.00 H new ATOM 0 HB2 LEU A 863 8.636 -4.626 9.681 1.00 0.00 H new ATOM 0 HB3 LEU A 863 10.314 -4.319 9.282 1.00 0.00 H new ATOM 0 HG LEU A 863 9.420 -6.980 10.405 1.00 0.00 H new ATOM 0 HD11 LEU A 863 9.285 -7.807 8.092 1.00 0.00 H new ATOM 0 HD12 LEU A 863 8.070 -6.547 8.414 1.00 0.00 H new ATOM 0 HD13 LEU A 863 9.538 -6.152 7.489 1.00 0.00 H new ATOM 0 HD21 LEU A 863 11.456 -7.775 9.266 1.00 0.00 H new ATOM 0 HD22 LEU A 863 11.787 -6.117 8.710 1.00 0.00 H new ATOM 0 HD23 LEU A 863 11.820 -6.496 10.449 1.00 0.00 H new ATOM 1356 N GLU A 864 10.603 -2.199 11.168 1.00 0.00 N ATOM 1357 CA GLU A 864 11.515 -1.062 11.237 1.00 0.00 C ATOM 1358 C GLU A 864 12.080 -0.917 12.645 1.00 0.00 C ATOM 1359 O GLU A 864 13.241 -0.556 12.826 1.00 0.00 O ATOM 1360 CB GLU A 864 10.799 0.222 10.825 1.00 0.00 C ATOM 1361 CG GLU A 864 11.097 0.647 9.398 1.00 0.00 C ATOM 1362 CD GLU A 864 11.319 2.137 9.270 1.00 0.00 C ATOM 1363 OE1 GLU A 864 12.205 2.677 9.966 1.00 0.00 O ATOM 1364 OE2 GLU A 864 10.602 2.781 8.478 1.00 0.00 O ATOM 0 H GLU A 864 9.651 -1.958 10.894 1.00 0.00 H new ATOM 0 HA GLU A 864 12.339 -1.241 10.546 1.00 0.00 H new ATOM 0 HB2 GLU A 864 9.724 0.082 10.938 1.00 0.00 H new ATOM 0 HB3 GLU A 864 11.089 1.025 11.503 1.00 0.00 H new ATOM 0 HG2 GLU A 864 11.982 0.120 9.043 1.00 0.00 H new ATOM 0 HG3 GLU A 864 10.269 0.350 8.754 1.00 0.00 H new ATOM 1371 N HIS A 865 11.244 -1.201 13.637 1.00 0.00 N ATOM 1372 CA HIS A 865 11.671 -1.226 15.034 1.00 0.00 C ATOM 1373 C HIS A 865 12.774 -2.268 15.226 1.00 0.00 C ATOM 1374 O HIS A 865 13.809 -1.992 15.835 1.00 0.00 O ATOM 1375 CB HIS A 865 10.462 -1.553 15.922 1.00 0.00 C ATOM 1376 CG HIS A 865 10.667 -1.345 17.395 1.00 0.00 C ATOM 1377 ND1 HIS A 865 9.641 -0.985 18.240 1.00 0.00 N ATOM 1378 CD2 HIS A 865 11.765 -1.479 18.176 1.00 0.00 C ATOM 1379 CE1 HIS A 865 10.100 -0.906 19.474 1.00 0.00 C ATOM 1380 NE2 HIS A 865 11.385 -1.203 19.463 1.00 0.00 N ATOM 0 H HIS A 865 10.257 -1.419 13.499 1.00 0.00 H new ATOM 0 HA HIS A 865 12.070 -0.251 15.314 1.00 0.00 H new ATOM 0 HB2 HIS A 865 9.620 -0.940 15.600 1.00 0.00 H new ATOM 0 HB3 HIS A 865 10.181 -2.593 15.755 1.00 0.00 H new ATOM 0 HD2 HIS A 865 12.756 -1.753 17.846 1.00 0.00 H new ATOM 0 HE1 HIS A 865 9.521 -0.642 20.347 1.00 0.00 H new ATOM 0 HE2 HIS A 865 11.996 -1.224 20.279 1.00 0.00 H new ATOM 1389 N LEU A 866 12.548 -3.456 14.682 1.00 0.00 N ATOM 1390 CA LEU A 866 13.514 -4.544 14.775 1.00 0.00 C ATOM 1391 C LEU A 866 14.803 -4.186 14.046 1.00 0.00 C ATOM 1392 O LEU A 866 15.894 -4.559 14.470 1.00 0.00 O ATOM 1393 CB LEU A 866 12.922 -5.827 14.190 1.00 0.00 C ATOM 1394 CG LEU A 866 11.827 -6.482 15.028 1.00 0.00 C ATOM 1395 CD1 LEU A 866 10.819 -7.178 14.132 1.00 0.00 C ATOM 1396 CD2 LEU A 866 12.434 -7.463 16.017 1.00 0.00 C ATOM 0 H LEU A 866 11.699 -3.692 14.169 1.00 0.00 H new ATOM 0 HA LEU A 866 13.746 -4.706 15.828 1.00 0.00 H new ATOM 0 HB2 LEU A 866 12.517 -5.603 13.203 1.00 0.00 H new ATOM 0 HB3 LEU A 866 13.728 -6.547 14.048 1.00 0.00 H new ATOM 0 HG LEU A 866 11.307 -5.706 15.589 1.00 0.00 H new ATOM 0 HD11 LEU A 866 10.045 -7.640 14.745 1.00 0.00 H new ATOM 0 HD12 LEU A 866 10.364 -6.449 13.461 1.00 0.00 H new ATOM 0 HD13 LEU A 866 11.323 -7.946 13.545 1.00 0.00 H new ATOM 0 HD21 LEU A 866 11.641 -7.922 16.607 1.00 0.00 H new ATOM 0 HD22 LEU A 866 12.977 -8.237 15.475 1.00 0.00 H new ATOM 0 HD23 LEU A 866 13.120 -6.935 16.679 1.00 0.00 H new ATOM 1408 N ILE A 867 14.673 -3.437 12.960 1.00 0.00 N ATOM 1409 CA ILE A 867 15.827 -3.037 12.167 1.00 0.00 C ATOM 1410 C ILE A 867 16.597 -1.948 12.901 1.00 0.00 C ATOM 1411 O ILE A 867 17.827 -1.919 12.898 1.00 0.00 O ATOM 1412 CB ILE A 867 15.406 -2.531 10.765 1.00 0.00 C ATOM 1413 CG1 ILE A 867 14.775 -3.667 9.955 1.00 0.00 C ATOM 1414 CG2 ILE A 867 16.594 -1.945 10.015 1.00 0.00 C ATOM 1415 CD1 ILE A 867 13.887 -3.192 8.824 1.00 0.00 C ATOM 0 H ILE A 867 13.779 -3.094 12.608 1.00 0.00 H new ATOM 0 HA ILE A 867 16.463 -3.911 12.029 1.00 0.00 H new ATOM 0 HB ILE A 867 14.667 -1.741 10.900 1.00 0.00 H new ATOM 0 HG12 ILE A 867 15.568 -4.291 9.544 1.00 0.00 H new ATOM 0 HG13 ILE A 867 14.189 -4.296 10.625 1.00 0.00 H new ATOM 0 HG21 ILE A 867 16.270 -1.598 9.034 1.00 0.00 H new ATOM 0 HG22 ILE A 867 17.003 -1.107 10.580 1.00 0.00 H new ATOM 0 HG23 ILE A 867 17.361 -2.710 9.894 1.00 0.00 H new ATOM 0 HD11 ILE A 867 13.477 -4.054 8.297 1.00 0.00 H new ATOM 0 HD12 ILE A 867 13.072 -2.592 9.229 1.00 0.00 H new ATOM 0 HD13 ILE A 867 14.472 -2.588 8.131 1.00 0.00 H new ATOM 1427 N ARG A 868 15.851 -1.072 13.558 1.00 0.00 N ATOM 1428 CA ARG A 868 16.430 0.020 14.322 1.00 0.00 C ATOM 1429 C ARG A 868 17.275 -0.514 15.476 1.00 0.00 C ATOM 1430 O ARG A 868 18.311 0.058 15.809 1.00 0.00 O ATOM 1431 CB ARG A 868 15.317 0.950 14.825 1.00 0.00 C ATOM 1432 CG ARG A 868 15.027 0.859 16.314 1.00 0.00 C ATOM 1433 CD ARG A 868 15.687 1.998 17.069 1.00 0.00 C ATOM 1434 NE ARG A 868 14.882 2.470 18.194 1.00 0.00 N ATOM 1435 CZ ARG A 868 15.390 2.794 19.384 1.00 0.00 C ATOM 1436 NH1 ARG A 868 16.691 2.654 19.616 1.00 0.00 N ATOM 1437 NH2 ARG A 868 14.600 3.261 20.342 1.00 0.00 N ATOM 0 H ARG A 868 14.832 -1.099 13.576 1.00 0.00 H new ATOM 0 HA ARG A 868 17.092 0.595 13.674 1.00 0.00 H new ATOM 0 HB2 ARG A 868 15.588 1.978 14.585 1.00 0.00 H new ATOM 0 HB3 ARG A 868 14.402 0.725 14.278 1.00 0.00 H new ATOM 0 HG2 ARG A 868 13.950 0.884 16.480 1.00 0.00 H new ATOM 0 HG3 ARG A 868 15.387 -0.095 16.700 1.00 0.00 H new ATOM 0 HD2 ARG A 868 16.660 1.670 17.436 1.00 0.00 H new ATOM 0 HD3 ARG A 868 15.868 2.826 16.384 1.00 0.00 H new ATOM 0 HE ARG A 868 13.874 2.557 18.062 1.00 0.00 H new ATOM 0 HH11 ARG A 868 17.304 2.298 18.883 1.00 0.00 H new ATOM 0 HH12 ARG A 868 17.076 2.903 20.527 1.00 0.00 H new ATOM 0 HH21 ARG A 868 13.601 3.373 20.170 1.00 0.00 H new ATOM 0 HH22 ARG A 868 14.992 3.508 21.251 1.00 0.00 H new ATOM 1451 N GLU A 869 16.836 -1.612 16.083 1.00 0.00 N ATOM 1452 CA GLU A 869 17.583 -2.209 17.181 1.00 0.00 C ATOM 1453 C GLU A 869 18.550 -3.273 16.666 1.00 0.00 C ATOM 1454 O GLU A 869 19.296 -3.874 17.441 1.00 0.00 O ATOM 1455 CB GLU A 869 16.633 -2.792 18.230 1.00 0.00 C ATOM 1456 CG GLU A 869 15.802 -3.966 17.745 1.00 0.00 C ATOM 1457 CD GLU A 869 14.690 -4.327 18.709 1.00 0.00 C ATOM 1458 OE1 GLU A 869 14.769 -3.934 19.895 1.00 0.00 O ATOM 1459 OE2 GLU A 869 13.729 -5.004 18.288 1.00 0.00 O ATOM 0 H GLU A 869 15.976 -2.101 15.836 1.00 0.00 H new ATOM 0 HA GLU A 869 18.171 -1.425 17.658 1.00 0.00 H new ATOM 0 HB2 GLU A 869 17.217 -3.109 19.094 1.00 0.00 H new ATOM 0 HB3 GLU A 869 15.961 -2.004 18.571 1.00 0.00 H new ATOM 0 HG2 GLU A 869 15.372 -3.726 16.773 1.00 0.00 H new ATOM 0 HG3 GLU A 869 16.450 -4.831 17.602 1.00 0.00 H new ATOM 1466 N LYS A 870 18.535 -3.475 15.348 1.00 0.00 N ATOM 1467 CA LYS A 870 19.427 -4.416 14.676 1.00 0.00 C ATOM 1468 C LYS A 870 19.227 -5.843 15.179 1.00 0.00 C ATOM 1469 O LYS A 870 20.181 -6.611 15.306 1.00 0.00 O ATOM 1470 CB LYS A 870 20.889 -3.991 14.846 1.00 0.00 C ATOM 1471 CG LYS A 870 21.286 -2.822 13.959 1.00 0.00 C ATOM 1472 CD LYS A 870 22.795 -2.724 13.805 1.00 0.00 C ATOM 1473 CE LYS A 870 23.177 -1.872 12.603 1.00 0.00 C ATOM 1474 NZ LYS A 870 24.634 -1.940 12.315 1.00 0.00 N ATOM 0 H LYS A 870 17.900 -2.988 14.715 1.00 0.00 H new ATOM 0 HA LYS A 870 19.177 -4.400 13.615 1.00 0.00 H new ATOM 0 HB2 LYS A 870 21.062 -3.722 15.888 1.00 0.00 H new ATOM 0 HB3 LYS A 870 21.535 -4.841 14.625 1.00 0.00 H new ATOM 0 HG2 LYS A 870 20.826 -2.937 12.977 1.00 0.00 H new ATOM 0 HG3 LYS A 870 20.902 -1.895 14.384 1.00 0.00 H new ATOM 0 HD2 LYS A 870 23.227 -2.295 14.709 1.00 0.00 H new ATOM 0 HD3 LYS A 870 23.216 -3.723 13.693 1.00 0.00 H new ATOM 0 HE2 LYS A 870 22.618 -2.206 11.729 1.00 0.00 H new ATOM 0 HE3 LYS A 870 22.891 -0.836 12.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 870 24.853 -1.346 11.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 870 25.167 -1.597 13.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 870 24.903 -2.924 12.114 1.00 0.00 H new ATOM 1488 N ASP A 871 17.978 -6.198 15.450 1.00 0.00 N ATOM 1489 CA ASP A 871 17.653 -7.554 15.871 1.00 0.00 C ATOM 1490 C ASP A 871 17.410 -8.432 14.652 1.00 0.00 C ATOM 1491 O ASP A 871 16.268 -8.619 14.226 1.00 0.00 O ATOM 1492 CB ASP A 871 16.426 -7.571 16.787 1.00 0.00 C ATOM 1493 CG ASP A 871 16.206 -8.937 17.410 1.00 0.00 C ATOM 1494 OD1 ASP A 871 17.204 -9.632 17.694 1.00 0.00 O ATOM 1495 OD2 ASP A 871 15.034 -9.325 17.618 1.00 0.00 O ATOM 0 H ASP A 871 17.177 -5.570 15.386 1.00 0.00 H new ATOM 0 HA ASP A 871 18.499 -7.947 16.435 1.00 0.00 H new ATOM 0 HB2 ASP A 871 16.550 -6.828 17.575 1.00 0.00 H new ATOM 0 HB3 ASP A 871 15.542 -7.285 16.216 1.00 0.00 H new ATOM 1500 N VAL A 872 18.496 -8.956 14.094 1.00 0.00 N ATOM 1501 CA VAL A 872 18.447 -9.760 12.870 1.00 0.00 C ATOM 1502 C VAL A 872 17.424 -10.906 12.946 1.00 0.00 C ATOM 1503 O VAL A 872 16.590 -11.033 12.048 1.00 0.00 O ATOM 1504 CB VAL A 872 19.834 -10.334 12.500 1.00 0.00 C ATOM 1505 CG1 VAL A 872 20.094 -10.151 11.013 1.00 0.00 C ATOM 1506 CG2 VAL A 872 20.941 -9.681 13.321 1.00 0.00 C ATOM 0 H VAL A 872 19.435 -8.838 14.474 1.00 0.00 H new ATOM 0 HA VAL A 872 18.125 -9.072 12.088 1.00 0.00 H new ATOM 0 HB VAL A 872 19.834 -11.399 12.732 1.00 0.00 H new ATOM 0 HG11 VAL A 872 21.073 -10.558 10.762 1.00 0.00 H new ATOM 0 HG12 VAL A 872 19.326 -10.674 10.442 1.00 0.00 H new ATOM 0 HG13 VAL A 872 20.069 -9.089 10.767 1.00 0.00 H new ATOM 0 HG21 VAL A 872 21.904 -10.106 13.037 1.00 0.00 H new ATOM 0 HG22 VAL A 872 20.949 -8.607 13.132 1.00 0.00 H new ATOM 0 HG23 VAL A 872 20.763 -9.862 14.381 1.00 0.00 H new ATOM 1516 N PRO A 873 17.456 -11.756 14.004 1.00 0.00 N ATOM 1517 CA PRO A 873 16.504 -12.872 14.145 1.00 0.00 C ATOM 1518 C PRO A 873 15.049 -12.411 14.092 1.00 0.00 C ATOM 1519 O PRO A 873 14.206 -13.049 13.457 1.00 0.00 O ATOM 1520 CB PRO A 873 16.823 -13.457 15.521 1.00 0.00 C ATOM 1521 CG PRO A 873 18.225 -13.052 15.793 1.00 0.00 C ATOM 1522 CD PRO A 873 18.412 -11.721 15.127 1.00 0.00 C ATOM 0 HA PRO A 873 16.608 -13.588 13.330 1.00 0.00 H new ATOM 0 HB2 PRO A 873 16.145 -13.070 16.282 1.00 0.00 H new ATOM 0 HB3 PRO A 873 16.718 -14.542 15.523 1.00 0.00 H new ATOM 0 HG2 PRO A 873 18.409 -12.980 16.865 1.00 0.00 H new ATOM 0 HG3 PRO A 873 18.926 -13.787 15.398 1.00 0.00 H new ATOM 0 HD2 PRO A 873 18.199 -10.898 15.809 1.00 0.00 H new ATOM 0 HD3 PRO A 873 19.436 -11.588 14.778 1.00 0.00 H new ATOM 1530 N GLY A 874 14.761 -11.301 14.760 1.00 0.00 N ATOM 1531 CA GLY A 874 13.421 -10.754 14.746 1.00 0.00 C ATOM 1532 C GLY A 874 13.042 -10.223 13.381 1.00 0.00 C ATOM 1533 O GLY A 874 11.908 -10.393 12.931 1.00 0.00 O ATOM 0 H GLY A 874 15.434 -10.770 15.312 1.00 0.00 H new ATOM 0 HA2 GLY A 874 12.711 -11.525 15.045 1.00 0.00 H new ATOM 0 HA3 GLY A 874 13.349 -9.952 15.480 1.00 0.00 H new ATOM 1537 N ILE A 875 14.003 -9.593 12.715 1.00 0.00 N ATOM 1538 CA ILE A 875 13.788 -9.046 11.383 1.00 0.00 C ATOM 1539 C ILE A 875 13.425 -10.152 10.397 1.00 0.00 C ATOM 1540 O ILE A 875 12.392 -10.082 9.738 1.00 0.00 O ATOM 1541 CB ILE A 875 15.037 -8.287 10.875 1.00 0.00 C ATOM 1542 CG1 ILE A 875 15.216 -6.986 11.653 1.00 0.00 C ATOM 1543 CG2 ILE A 875 14.930 -7.993 9.383 1.00 0.00 C ATOM 1544 CD1 ILE A 875 16.642 -6.481 11.666 1.00 0.00 C ATOM 0 H ILE A 875 14.944 -9.448 13.080 1.00 0.00 H new ATOM 0 HA ILE A 875 12.960 -8.341 11.452 1.00 0.00 H new ATOM 0 HB ILE A 875 15.908 -8.922 11.036 1.00 0.00 H new ATOM 0 HG12 ILE A 875 14.572 -6.221 11.219 1.00 0.00 H new ATOM 0 HG13 ILE A 875 14.883 -7.137 12.680 1.00 0.00 H new ATOM 0 HG21 ILE A 875 15.821 -7.459 9.053 1.00 0.00 H new ATOM 0 HG22 ILE A 875 14.844 -8.930 8.833 1.00 0.00 H new ATOM 0 HG23 ILE A 875 14.049 -7.379 9.195 1.00 0.00 H new ATOM 0 HD11 ILE A 875 16.694 -5.554 12.237 1.00 0.00 H new ATOM 0 HD12 ILE A 875 17.288 -7.228 12.127 1.00 0.00 H new ATOM 0 HD13 ILE A 875 16.972 -6.297 10.644 1.00 0.00 H new ATOM 1556 N GLU A 876 14.268 -11.179 10.316 1.00 0.00 N ATOM 1557 CA GLU A 876 14.036 -12.275 9.377 1.00 0.00 C ATOM 1558 C GLU A 876 12.733 -12.995 9.704 1.00 0.00 C ATOM 1559 O GLU A 876 12.006 -13.415 8.804 1.00 0.00 O ATOM 1560 CB GLU A 876 15.210 -13.262 9.373 1.00 0.00 C ATOM 1561 CG GLU A 876 15.668 -13.686 10.757 1.00 0.00 C ATOM 1562 CD GLU A 876 16.084 -15.138 10.822 1.00 0.00 C ATOM 1563 OE1 GLU A 876 15.202 -16.020 10.758 1.00 0.00 O ATOM 1564 OE2 GLU A 876 17.300 -15.410 10.937 1.00 0.00 O ATOM 0 H GLU A 876 15.110 -11.276 10.883 1.00 0.00 H new ATOM 0 HA GLU A 876 13.955 -11.847 8.378 1.00 0.00 H new ATOM 0 HB2 GLU A 876 14.923 -14.150 8.809 1.00 0.00 H new ATOM 0 HB3 GLU A 876 16.050 -12.809 8.847 1.00 0.00 H new ATOM 0 HG2 GLU A 876 16.505 -13.060 11.064 1.00 0.00 H new ATOM 0 HG3 GLU A 876 14.862 -13.512 11.470 1.00 0.00 H new ATOM 1571 N LYS A 877 12.431 -13.111 10.991 1.00 0.00 N ATOM 1572 CA LYS A 877 11.186 -13.721 11.430 1.00 0.00 C ATOM 1573 C LYS A 877 9.987 -12.923 10.922 1.00 0.00 C ATOM 1574 O LYS A 877 9.058 -13.480 10.335 1.00 0.00 O ATOM 1575 CB LYS A 877 11.143 -13.795 12.955 1.00 0.00 C ATOM 1576 CG LYS A 877 11.013 -15.207 13.495 1.00 0.00 C ATOM 1577 CD LYS A 877 9.560 -15.563 13.772 1.00 0.00 C ATOM 1578 CE LYS A 877 9.088 -15.000 15.105 1.00 0.00 C ATOM 1579 NZ LYS A 877 9.618 -15.777 16.256 1.00 0.00 N ATOM 0 H LYS A 877 13.033 -12.790 11.749 1.00 0.00 H new ATOM 0 HA LYS A 877 11.138 -14.729 11.019 1.00 0.00 H new ATOM 0 HB2 LYS A 877 12.050 -13.344 13.357 1.00 0.00 H new ATOM 0 HB3 LYS A 877 10.304 -13.199 13.315 1.00 0.00 H new ATOM 0 HG2 LYS A 877 11.432 -15.913 12.778 1.00 0.00 H new ATOM 0 HG3 LYS A 877 11.594 -15.302 14.412 1.00 0.00 H new ATOM 0 HD2 LYS A 877 8.931 -15.176 12.970 1.00 0.00 H new ATOM 0 HD3 LYS A 877 9.444 -16.647 13.773 1.00 0.00 H new ATOM 0 HE2 LYS A 877 9.405 -13.961 15.192 1.00 0.00 H new ATOM 0 HE3 LYS A 877 7.998 -15.005 15.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 877 9.168 -15.448 17.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 877 9.411 -16.787 16.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 877 10.647 -15.641 16.322 1.00 0.00 H new ATOM 1593 N TYR A 878 10.027 -11.615 11.132 1.00 0.00 N ATOM 1594 CA TYR A 878 8.927 -10.748 10.741 1.00 0.00 C ATOM 1595 C TYR A 878 8.858 -10.581 9.226 1.00 0.00 C ATOM 1596 O TYR A 878 7.775 -10.416 8.671 1.00 0.00 O ATOM 1597 CB TYR A 878 9.040 -9.392 11.435 1.00 0.00 C ATOM 1598 CG TYR A 878 8.087 -9.251 12.600 1.00 0.00 C ATOM 1599 CD1 TYR A 878 8.194 -10.077 13.713 1.00 0.00 C ATOM 1600 CD2 TYR A 878 7.073 -8.306 12.582 1.00 0.00 C ATOM 1601 CE1 TYR A 878 7.316 -9.963 14.775 1.00 0.00 C ATOM 1602 CE2 TYR A 878 6.192 -8.183 13.641 1.00 0.00 C ATOM 1603 CZ TYR A 878 6.317 -9.014 14.734 1.00 0.00 C ATOM 1604 OH TYR A 878 5.437 -8.897 15.787 1.00 0.00 O ATOM 0 H TYR A 878 10.810 -11.131 11.571 1.00 0.00 H new ATOM 0 HA TYR A 878 7.999 -11.222 11.060 1.00 0.00 H new ATOM 0 HB2 TYR A 878 10.062 -9.253 11.788 1.00 0.00 H new ATOM 0 HB3 TYR A 878 8.843 -8.601 10.712 1.00 0.00 H new ATOM 0 HD1 TYR A 878 8.976 -10.821 13.749 1.00 0.00 H new ATOM 0 HD2 TYR A 878 6.969 -7.655 11.727 1.00 0.00 H new ATOM 0 HE1 TYR A 878 7.412 -10.614 15.632 1.00 0.00 H new ATOM 0 HE2 TYR A 878 5.409 -7.439 13.612 1.00 0.00 H new ATOM 0 HH TYR A 878 4.796 -8.180 15.599 1.00 0.00 H new ATOM 1614 N ILE A 879 10.007 -10.614 8.558 1.00 0.00 N ATOM 1615 CA ILE A 879 10.033 -10.582 7.098 1.00 0.00 C ATOM 1616 C ILE A 879 9.333 -11.817 6.531 1.00 0.00 C ATOM 1617 O ILE A 879 8.517 -11.714 5.618 1.00 0.00 O ATOM 1618 CB ILE A 879 11.478 -10.494 6.541 1.00 0.00 C ATOM 1619 CG1 ILE A 879 12.027 -9.076 6.730 1.00 0.00 C ATOM 1620 CG2 ILE A 879 11.517 -10.880 5.067 1.00 0.00 C ATOM 1621 CD1 ILE A 879 13.410 -8.874 6.148 1.00 0.00 C ATOM 0 H ILE A 879 10.926 -10.662 8.999 1.00 0.00 H new ATOM 0 HA ILE A 879 9.503 -9.683 6.784 1.00 0.00 H new ATOM 0 HB ILE A 879 12.103 -11.196 7.094 1.00 0.00 H new ATOM 0 HG12 ILE A 879 11.341 -8.366 6.268 1.00 0.00 H new ATOM 0 HG13 ILE A 879 12.054 -8.846 7.795 1.00 0.00 H new ATOM 0 HG21 ILE A 879 12.541 -10.810 4.700 1.00 0.00 H new ATOM 0 HG22 ILE A 879 11.158 -11.902 4.949 1.00 0.00 H new ATOM 0 HG23 ILE A 879 10.880 -10.204 4.497 1.00 0.00 H new ATOM 0 HD11 ILE A 879 13.731 -7.847 6.321 1.00 0.00 H new ATOM 0 HD12 ILE A 879 14.110 -9.558 6.627 1.00 0.00 H new ATOM 0 HD13 ILE A 879 13.386 -9.071 5.076 1.00 0.00 H new ATOM 1633 N SER A 880 9.631 -12.980 7.102 1.00 0.00 N ATOM 1634 CA SER A 880 8.973 -14.214 6.692 1.00 0.00 C ATOM 1635 C SER A 880 7.479 -14.145 7.006 1.00 0.00 C ATOM 1636 O SER A 880 6.650 -14.688 6.274 1.00 0.00 O ATOM 1637 CB SER A 880 9.617 -15.419 7.388 1.00 0.00 C ATOM 1638 OG SER A 880 11.037 -15.356 7.326 1.00 0.00 O ATOM 0 H SER A 880 10.320 -13.093 7.846 1.00 0.00 H new ATOM 0 HA SER A 880 9.094 -14.335 5.616 1.00 0.00 H new ATOM 0 HB2 SER A 880 9.298 -15.453 8.430 1.00 0.00 H new ATOM 0 HB3 SER A 880 9.271 -16.340 6.919 1.00 0.00 H new ATOM 0 HG SER A 880 11.369 -14.755 8.025 1.00 0.00 H new ATOM 1644 N ASP A 881 7.143 -13.451 8.090 1.00 0.00 N ATOM 1645 CA ASP A 881 5.753 -13.269 8.499 1.00 0.00 C ATOM 1646 C ASP A 881 5.030 -12.296 7.570 1.00 0.00 C ATOM 1647 O ASP A 881 3.835 -12.430 7.319 1.00 0.00 O ATOM 1648 CB ASP A 881 5.690 -12.753 9.935 1.00 0.00 C ATOM 1649 CG ASP A 881 4.662 -13.481 10.773 1.00 0.00 C ATOM 1650 OD1 ASP A 881 4.922 -14.635 11.173 1.00 0.00 O ATOM 1651 OD2 ASP A 881 3.600 -12.893 11.056 1.00 0.00 O ATOM 0 H ASP A 881 7.821 -13.002 8.706 1.00 0.00 H new ATOM 0 HA ASP A 881 5.255 -14.237 8.440 1.00 0.00 H new ATOM 0 HB2 ASP A 881 6.671 -12.859 10.398 1.00 0.00 H new ATOM 0 HB3 ASP A 881 5.456 -11.688 9.924 1.00 0.00 H new ATOM 1656 N ILE A 882 5.758 -11.304 7.074 1.00 0.00 N ATOM 1657 CA ILE A 882 5.212 -10.362 6.106 1.00 0.00 C ATOM 1658 C ILE A 882 5.009 -11.054 4.758 1.00 0.00 C ATOM 1659 O ILE A 882 4.090 -10.726 4.002 1.00 0.00 O ATOM 1660 CB ILE A 882 6.101 -9.094 5.963 1.00 0.00 C ATOM 1661 CG1 ILE A 882 5.224 -7.839 5.946 1.00 0.00 C ATOM 1662 CG2 ILE A 882 6.982 -9.142 4.718 1.00 0.00 C ATOM 1663 CD1 ILE A 882 5.996 -6.550 6.128 1.00 0.00 C ATOM 0 H ILE A 882 6.731 -11.131 7.327 1.00 0.00 H new ATOM 0 HA ILE A 882 4.243 -10.024 6.474 1.00 0.00 H new ATOM 0 HB ILE A 882 6.767 -9.062 6.826 1.00 0.00 H new ATOM 0 HG12 ILE A 882 4.684 -7.797 5.000 1.00 0.00 H new ATOM 0 HG13 ILE A 882 4.477 -7.919 6.736 1.00 0.00 H new ATOM 0 HG21 ILE A 882 7.584 -8.235 4.663 1.00 0.00 H new ATOM 0 HG22 ILE A 882 7.639 -10.010 4.770 1.00 0.00 H new ATOM 0 HG23 ILE A 882 6.354 -9.215 3.830 1.00 0.00 H new ATOM 0 HD11 ILE A 882 5.306 -5.706 6.105 1.00 0.00 H new ATOM 0 HD12 ILE A 882 6.514 -6.569 7.087 1.00 0.00 H new ATOM 0 HD13 ILE A 882 6.724 -6.445 5.324 1.00 0.00 H new ATOM 1675 N ASP A 883 5.868 -12.027 4.475 1.00 0.00 N ATOM 1676 CA ASP A 883 5.810 -12.764 3.224 1.00 0.00 C ATOM 1677 C ASP A 883 4.622 -13.703 3.250 1.00 0.00 C ATOM 1678 O ASP A 883 3.873 -13.815 2.280 1.00 0.00 O ATOM 1679 CB ASP A 883 7.108 -13.547 3.018 1.00 0.00 C ATOM 1680 CG ASP A 883 7.007 -14.581 1.915 1.00 0.00 C ATOM 1681 OD1 ASP A 883 7.171 -14.222 0.731 1.00 0.00 O ATOM 1682 OD2 ASP A 883 6.767 -15.766 2.229 1.00 0.00 O ATOM 0 H ASP A 883 6.616 -12.323 5.102 1.00 0.00 H new ATOM 0 HA ASP A 883 5.694 -12.067 2.394 1.00 0.00 H new ATOM 0 HB2 ASP A 883 7.913 -12.850 2.783 1.00 0.00 H new ATOM 0 HB3 ASP A 883 7.378 -14.043 3.950 1.00 0.00 H new ATOM 1687 N SER A 884 4.437 -14.349 4.389 1.00 0.00 N ATOM 1688 CA SER A 884 3.310 -15.230 4.586 1.00 0.00 C ATOM 1689 C SER A 884 2.019 -14.418 4.624 1.00 0.00 C ATOM 1690 O SER A 884 0.975 -14.879 4.174 1.00 0.00 O ATOM 1691 CB SER A 884 3.499 -16.032 5.872 1.00 0.00 C ATOM 1692 OG SER A 884 3.954 -15.219 6.933 1.00 0.00 O ATOM 0 H SER A 884 5.060 -14.276 5.193 1.00 0.00 H new ATOM 0 HA SER A 884 3.244 -15.932 3.755 1.00 0.00 H new ATOM 0 HB2 SER A 884 2.555 -16.500 6.151 1.00 0.00 H new ATOM 0 HB3 SER A 884 4.214 -16.836 5.698 1.00 0.00 H new ATOM 0 HG SER A 884 3.651 -14.298 6.793 1.00 0.00 H new ATOM 1698 N TYR A 885 2.121 -13.189 5.133 1.00 0.00 N ATOM 1699 CA TYR A 885 0.995 -12.253 5.163 1.00 0.00 C ATOM 1700 C TYR A 885 0.456 -12.053 3.767 1.00 0.00 C ATOM 1701 O TYR A 885 -0.718 -12.299 3.465 1.00 0.00 O ATOM 1702 CB TYR A 885 1.472 -10.890 5.674 1.00 0.00 C ATOM 1703 CG TYR A 885 0.398 -9.820 5.689 1.00 0.00 C ATOM 1704 CD1 TYR A 885 -0.672 -9.888 6.569 1.00 0.00 C ATOM 1705 CD2 TYR A 885 0.459 -8.746 4.809 1.00 0.00 C ATOM 1706 CE1 TYR A 885 -1.653 -8.913 6.573 1.00 0.00 C ATOM 1707 CE2 TYR A 885 -0.520 -7.769 4.806 1.00 0.00 C ATOM 1708 CZ TYR A 885 -1.573 -7.856 5.689 1.00 0.00 C ATOM 1709 OH TYR A 885 -2.551 -6.886 5.687 1.00 0.00 O ATOM 0 H TYR A 885 2.981 -12.816 5.534 1.00 0.00 H new ATOM 0 HA TYR A 885 0.223 -12.662 5.815 1.00 0.00 H new ATOM 0 HB2 TYR A 885 1.863 -11.010 6.684 1.00 0.00 H new ATOM 0 HB3 TYR A 885 2.299 -10.550 5.050 1.00 0.00 H new ATOM 0 HD1 TYR A 885 -0.740 -10.714 7.261 1.00 0.00 H new ATOM 0 HD2 TYR A 885 1.284 -8.673 4.116 1.00 0.00 H new ATOM 0 HE1 TYR A 885 -2.479 -8.979 7.266 1.00 0.00 H new ATOM 0 HE2 TYR A 885 -0.459 -6.942 4.114 1.00 0.00 H new ATOM 0 HH TYR A 885 -2.343 -6.213 5.005 1.00 0.00 H new ATOM 1719 N VAL A 886 1.360 -11.614 2.926 1.00 0.00 N ATOM 1720 CA VAL A 886 1.067 -11.274 1.562 1.00 0.00 C ATOM 1721 C VAL A 886 0.629 -12.513 0.777 1.00 0.00 C ATOM 1722 O VAL A 886 -0.185 -12.422 -0.137 1.00 0.00 O ATOM 1723 CB VAL A 886 2.310 -10.588 0.958 1.00 0.00 C ATOM 1724 CG1 VAL A 886 2.941 -11.386 -0.176 1.00 0.00 C ATOM 1725 CG2 VAL A 886 1.972 -9.181 0.500 1.00 0.00 C ATOM 0 H VAL A 886 2.339 -11.482 3.179 1.00 0.00 H new ATOM 0 HA VAL A 886 0.230 -10.578 1.509 1.00 0.00 H new ATOM 0 HB VAL A 886 3.055 -10.538 1.752 1.00 0.00 H new ATOM 0 HG11 VAL A 886 3.810 -10.850 -0.558 1.00 0.00 H new ATOM 0 HG12 VAL A 886 3.251 -12.363 0.195 1.00 0.00 H new ATOM 0 HG13 VAL A 886 2.214 -11.516 -0.978 1.00 0.00 H new ATOM 0 HG21 VAL A 886 2.861 -8.713 0.077 1.00 0.00 H new ATOM 0 HG22 VAL A 886 1.189 -9.223 -0.257 1.00 0.00 H new ATOM 0 HG23 VAL A 886 1.623 -8.595 1.351 1.00 0.00 H new ATOM 1735 N LYS A 887 1.149 -13.672 1.166 1.00 0.00 N ATOM 1736 CA LYS A 887 0.779 -14.930 0.528 1.00 0.00 C ATOM 1737 C LYS A 887 -0.653 -15.331 0.877 1.00 0.00 C ATOM 1738 O LYS A 887 -1.361 -15.890 0.040 1.00 0.00 O ATOM 1739 CB LYS A 887 1.754 -16.037 0.924 1.00 0.00 C ATOM 1740 CG LYS A 887 3.051 -16.000 0.136 1.00 0.00 C ATOM 1741 CD LYS A 887 3.870 -17.261 0.345 1.00 0.00 C ATOM 1742 CE LYS A 887 5.265 -17.140 -0.253 1.00 0.00 C ATOM 1743 NZ LYS A 887 5.570 -15.757 -0.714 1.00 0.00 N ATOM 0 H LYS A 887 1.829 -13.766 1.921 1.00 0.00 H new ATOM 0 HA LYS A 887 0.832 -14.785 -0.551 1.00 0.00 H new ATOM 0 HB2 LYS A 887 1.979 -15.951 1.987 1.00 0.00 H new ATOM 0 HB3 LYS A 887 1.274 -17.005 0.777 1.00 0.00 H new ATOM 0 HG2 LYS A 887 2.829 -15.881 -0.925 1.00 0.00 H new ATOM 0 HG3 LYS A 887 3.636 -15.132 0.438 1.00 0.00 H new ATOM 0 HD2 LYS A 887 3.950 -17.469 1.412 1.00 0.00 H new ATOM 0 HD3 LYS A 887 3.354 -18.108 -0.107 1.00 0.00 H new ATOM 0 HE2 LYS A 887 6.003 -17.443 0.490 1.00 0.00 H new ATOM 0 HE3 LYS A 887 5.358 -17.828 -1.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 887 6.510 -15.739 -1.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 887 4.854 -15.456 -1.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 887 5.559 -15.110 0.100 1.00 0.00 H new ATOM 1757 N SER A 888 -1.087 -15.053 2.105 1.00 0.00 N ATOM 1758 CA SER A 888 -2.472 -15.321 2.484 1.00 0.00 C ATOM 1759 C SER A 888 -3.404 -14.311 1.825 1.00 0.00 C ATOM 1760 O SER A 888 -4.582 -14.589 1.607 1.00 0.00 O ATOM 1761 CB SER A 888 -2.651 -15.291 4.007 1.00 0.00 C ATOM 1762 OG SER A 888 -1.628 -14.544 4.638 1.00 0.00 O ATOM 0 H SER A 888 -0.511 -14.649 2.843 1.00 0.00 H new ATOM 0 HA SER A 888 -2.726 -16.322 2.136 1.00 0.00 H new ATOM 0 HB2 SER A 888 -3.621 -14.859 4.251 1.00 0.00 H new ATOM 0 HB3 SER A 888 -2.650 -16.310 4.394 1.00 0.00 H new ATOM 0 HG SER A 888 -1.551 -13.667 4.208 1.00 0.00 H new ATOM 1768 N LEU A 889 -2.870 -13.134 1.516 1.00 0.00 N ATOM 1769 CA LEU A 889 -3.628 -12.116 0.800 1.00 0.00 C ATOM 1770 C LEU A 889 -3.624 -12.399 -0.701 1.00 0.00 C ATOM 1771 O LEU A 889 -4.460 -11.887 -1.447 1.00 0.00 O ATOM 1772 CB LEU A 889 -3.044 -10.728 1.078 1.00 0.00 C ATOM 1773 CG LEU A 889 -3.892 -9.834 1.981 1.00 0.00 C ATOM 1774 CD1 LEU A 889 -3.805 -10.298 3.425 1.00 0.00 C ATOM 1775 CD2 LEU A 889 -3.447 -8.384 1.861 1.00 0.00 C ATOM 0 H LEU A 889 -1.915 -12.862 1.750 1.00 0.00 H new ATOM 0 HA LEU A 889 -4.659 -12.142 1.153 1.00 0.00 H new ATOM 0 HB2 LEU A 889 -2.061 -10.850 1.534 1.00 0.00 H new ATOM 0 HB3 LEU A 889 -2.893 -10.218 0.127 1.00 0.00 H new ATOM 0 HG LEU A 889 -4.931 -9.906 1.659 1.00 0.00 H new ATOM 0 HD11 LEU A 889 -4.415 -9.649 4.053 1.00 0.00 H new ATOM 0 HD12 LEU A 889 -4.169 -11.323 3.500 1.00 0.00 H new ATOM 0 HD13 LEU A 889 -2.768 -10.255 3.759 1.00 0.00 H new ATOM 0 HD21 LEU A 889 -4.061 -7.760 2.510 1.00 0.00 H new ATOM 0 HD22 LEU A 889 -2.402 -8.298 2.158 1.00 0.00 H new ATOM 0 HD23 LEU A 889 -3.559 -8.053 0.828 1.00 0.00 H new ATOM 1787 N LEU A 890 -2.669 -13.214 -1.132 1.00 0.00 N ATOM 1788 CA LEU A 890 -2.552 -13.613 -2.530 1.00 0.00 C ATOM 1789 C LEU A 890 -3.508 -14.756 -2.858 1.00 0.00 C ATOM 1790 O LEU A 890 -4.443 -15.009 -2.065 1.00 0.00 O ATOM 1791 CB LEU A 890 -1.114 -14.046 -2.830 1.00 0.00 C ATOM 1792 CG LEU A 890 -0.245 -12.992 -3.510 1.00 0.00 C ATOM 1793 CD1 LEU A 890 1.227 -13.338 -3.349 1.00 0.00 C ATOM 1794 CD2 LEU A 890 -0.611 -12.878 -4.980 1.00 0.00 C ATOM 1795 OXT LEU A 890 -3.310 -15.420 -3.898 1.00 0.00 O ATOM 0 H LEU A 890 -1.955 -13.616 -0.524 1.00 0.00 H new ATOM 0 HA LEU A 890 -2.815 -12.755 -3.149 1.00 0.00 H new ATOM 0 HB2 LEU A 890 -0.637 -14.338 -1.894 1.00 0.00 H new ATOM 0 HB3 LEU A 890 -1.143 -14.933 -3.463 1.00 0.00 H new ATOM 0 HG LEU A 890 -0.425 -12.028 -3.034 1.00 0.00 H new ATOM 0 HD11 LEU A 890 1.835 -12.578 -3.839 1.00 0.00 H new ATOM 0 HD12 LEU A 890 1.478 -13.376 -2.289 1.00 0.00 H new ATOM 0 HD13 LEU A 890 1.424 -14.309 -3.804 1.00 0.00 H new ATOM 0 HD21 LEU A 890 0.016 -12.123 -5.454 1.00 0.00 H new ATOM 0 HD22 LEU A 890 -0.454 -13.839 -5.470 1.00 0.00 H new ATOM 0 HD23 LEU A 890 -1.658 -12.590 -5.073 1.00 0.00 H new TER 1807 LEU A 890