USER MOD reduce.3.24.130724 H: found=0, std=0, add=566, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 560 hydrogens (11 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 759 HIS : no HD1:sc= 0.574 K(o=0.21,f=-12!) USER MOD Set 1.2: A 769 HIS : no HE2:sc= -0.361 K(o=0.21,f=-10!) USER MOD Set 2.1: A 751 ASN : amide:sc= 1.39 K(o=1.4,f=-6!) USER MOD Set 2.2: A 753 HIS : no HD1:sc= 0 X(o=1.4,f=1.4) USER MOD Set 3.1: A 737 MET CE :methyl -136:sc= -0.643 (180deg=-0.971) USER MOD Set 3.2: A 765 HIS : no HD1:sc= -1.07 X(o=-1.7,f=-1.5) USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 723 GLN : amide:sc= -0.728! C(o=-0.73!,f=-4.3!) USER MOD Single : A 728 HIS : no HD1:sc= -0.126 X(o=-0.13,f=0) USER MOD Single : A 732 MET CE :methyl -166:sc= 0 (180deg=-0.106) USER MOD Single : A 739 SER OG : rot 79:sc= 1.27 USER MOD Single : A 740 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0418) USER MOD Single : A 741 LYS NZ :NH3+ -159:sc= -0.0691 (180deg=-0.472) USER MOD Single : A 742 MET CE :methyl 162:sc= 0 (180deg=-0.212) USER MOD Single : A 743 GLN : amide:sc= -0.929 K(o=-0.93,f=0) USER MOD Single : A 749 SER OG : rot 180:sc= 0.0337 USER MOD Single : A 752 SER OG : rot 180:sc= 0 USER MOD Single : A 760 GLN : amide:sc= -0.699 X(o=-0.7,f=-0.78) USER MOD Single : A 771 SER OG : rot -163:sc= 0.731 USER MOD Single : A 772 SER OG : rot 180:sc= -0.036 USER MOD Single : A 776 LYS NZ :NH3+ -171:sc=-0.00867 (180deg=-0.129) USER MOD Single : A 781 THR OG1 : rot -150:sc= -0.369 USER MOD Single : A 783 SER OG : rot 180:sc= 0 USER MOD Single : A 784 LYS NZ :NH3+ -121:sc= -0.21 (180deg=-1.52!) USER MOD Single : A 801 DGP O3' : rot 180:sc= -0.198 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 717 6.192 -0.452 0.579 1.00 0.00 N ATOM 2 CA PRO A 717 6.002 -0.815 -0.841 1.00 0.00 C ATOM 3 C PRO A 717 7.340 -1.149 -1.486 1.00 0.00 C ATOM 4 O PRO A 717 8.359 -0.541 -1.163 1.00 0.00 O ATOM 5 CB PRO A 717 5.337 0.346 -1.563 1.00 0.00 C ATOM 6 CG PRO A 717 4.981 1.284 -0.463 1.00 0.00 C ATOM 7 CD PRO A 717 5.950 0.999 0.662 1.00 0.00 C ATOM 0 HA PRO A 717 5.365 -1.697 -0.911 1.00 0.00 H new ATOM 0 HB2 PRO A 717 6.011 0.810 -2.283 1.00 0.00 H new ATOM 0 HB3 PRO A 717 4.455 0.022 -2.115 1.00 0.00 H new ATOM 0 HG2 PRO A 717 5.061 2.320 -0.793 1.00 0.00 H new ATOM 0 HG3 PRO A 717 3.952 1.131 -0.139 1.00 0.00 H new ATOM 0 HD2 PRO A 717 6.875 1.563 0.542 1.00 0.00 H new ATOM 0 HD3 PRO A 717 5.530 1.277 1.628 1.00 0.00 H new ATOM 15 N GLU A 718 7.334 -2.116 -2.390 1.00 0.00 N ATOM 16 CA GLU A 718 8.555 -2.559 -3.041 1.00 0.00 C ATOM 17 C GLU A 718 8.262 -2.965 -4.484 1.00 0.00 C ATOM 18 O GLU A 718 7.791 -4.071 -4.748 1.00 0.00 O ATOM 19 CB GLU A 718 9.164 -3.726 -2.255 1.00 0.00 C ATOM 20 CG GLU A 718 10.508 -4.206 -2.778 1.00 0.00 C ATOM 21 CD GLU A 718 11.061 -5.356 -1.962 1.00 0.00 C ATOM 22 OE1 GLU A 718 10.488 -6.461 -2.025 1.00 0.00 O ATOM 23 OE2 GLU A 718 12.070 -5.161 -1.249 1.00 0.00 O ATOM 0 H GLU A 718 6.494 -2.610 -2.690 1.00 0.00 H new ATOM 0 HA GLU A 718 9.275 -1.741 -3.059 1.00 0.00 H new ATOM 0 HB2 GLU A 718 9.280 -3.425 -1.214 1.00 0.00 H new ATOM 0 HB3 GLU A 718 8.464 -4.561 -2.269 1.00 0.00 H new ATOM 0 HG2 GLU A 718 10.401 -4.518 -3.817 1.00 0.00 H new ATOM 0 HG3 GLU A 718 11.218 -3.379 -2.765 1.00 0.00 H new ATOM 30 N GLY A 719 8.515 -2.052 -5.414 1.00 0.00 N ATOM 31 CA GLY A 719 8.242 -2.320 -6.814 1.00 0.00 C ATOM 32 C GLY A 719 9.503 -2.634 -7.595 1.00 0.00 C ATOM 33 O GLY A 719 9.750 -2.055 -8.653 1.00 0.00 O ATOM 0 H GLY A 719 8.905 -1.129 -5.223 1.00 0.00 H new ATOM 0 HA2 GLY A 719 7.550 -3.158 -6.893 1.00 0.00 H new ATOM 0 HA3 GLY A 719 7.748 -1.456 -7.258 1.00 0.00 H new ATOM 37 N VAL A 720 10.296 -3.563 -7.075 1.00 0.00 N ATOM 38 CA VAL A 720 11.551 -3.949 -7.711 1.00 0.00 C ATOM 39 C VAL A 720 11.325 -5.040 -8.752 1.00 0.00 C ATOM 40 O VAL A 720 12.268 -5.543 -9.355 1.00 0.00 O ATOM 41 CB VAL A 720 12.581 -4.439 -6.671 1.00 0.00 C ATOM 42 CG1 VAL A 720 12.922 -3.327 -5.691 1.00 0.00 C ATOM 43 CG2 VAL A 720 12.065 -5.672 -5.936 1.00 0.00 C ATOM 0 H VAL A 720 10.092 -4.065 -6.211 1.00 0.00 H new ATOM 0 HA VAL A 720 11.945 -3.061 -8.205 1.00 0.00 H new ATOM 0 HB VAL A 720 13.493 -4.719 -7.199 1.00 0.00 H new ATOM 0 HG11 VAL A 720 13.649 -3.692 -4.966 1.00 0.00 H new ATOM 0 HG12 VAL A 720 13.343 -2.481 -6.233 1.00 0.00 H new ATOM 0 HG13 VAL A 720 12.018 -3.011 -5.171 1.00 0.00 H new ATOM 0 HG21 VAL A 720 12.808 -5.999 -5.208 1.00 0.00 H new ATOM 0 HG22 VAL A 720 11.136 -5.427 -5.421 1.00 0.00 H new ATOM 0 HG23 VAL A 720 11.882 -6.473 -6.653 1.00 0.00 H new ATOM 53 N GLU A 721 10.065 -5.397 -8.953 1.00 0.00 N ATOM 54 CA GLU A 721 9.702 -6.432 -9.904 1.00 0.00 C ATOM 55 C GLU A 721 8.328 -6.119 -10.483 1.00 0.00 C ATOM 56 O GLU A 721 7.406 -5.762 -9.745 1.00 0.00 O ATOM 57 CB GLU A 721 9.698 -7.799 -9.205 1.00 0.00 C ATOM 58 CG GLU A 721 10.089 -8.970 -10.099 1.00 0.00 C ATOM 59 CD GLU A 721 9.113 -9.225 -11.228 1.00 0.00 C ATOM 60 OE1 GLU A 721 8.076 -9.879 -10.985 1.00 0.00 O ATOM 61 OE2 GLU A 721 9.382 -8.787 -12.364 1.00 0.00 O ATOM 0 H GLU A 721 9.273 -4.980 -8.465 1.00 0.00 H new ATOM 0 HA GLU A 721 10.429 -6.463 -10.715 1.00 0.00 H new ATOM 0 HB2 GLU A 721 10.383 -7.761 -8.358 1.00 0.00 H new ATOM 0 HB3 GLU A 721 8.702 -7.983 -8.802 1.00 0.00 H new ATOM 0 HG2 GLU A 721 11.077 -8.781 -10.520 1.00 0.00 H new ATOM 0 HG3 GLU A 721 10.169 -9.870 -9.490 1.00 0.00 H new ATOM 68 N SER A 722 8.195 -6.238 -11.792 1.00 0.00 N ATOM 69 CA SER A 722 6.938 -5.949 -12.454 1.00 0.00 C ATOM 70 C SER A 722 6.356 -7.237 -13.021 1.00 0.00 C ATOM 71 O SER A 722 6.774 -7.704 -14.079 1.00 0.00 O ATOM 72 CB SER A 722 7.138 -4.910 -13.559 1.00 0.00 C ATOM 73 OG SER A 722 5.903 -4.338 -13.952 1.00 0.00 O ATOM 0 H SER A 722 8.944 -6.533 -12.418 1.00 0.00 H new ATOM 0 HA SER A 722 6.238 -5.533 -11.729 1.00 0.00 H new ATOM 0 HB2 SER A 722 7.810 -4.127 -13.208 1.00 0.00 H new ATOM 0 HB3 SER A 722 7.616 -5.378 -14.420 1.00 0.00 H new ATOM 0 HG SER A 722 6.059 -3.676 -14.658 1.00 0.00 H new ATOM 79 N GLN A 723 5.396 -7.801 -12.298 1.00 0.00 N ATOM 80 CA GLN A 723 4.843 -9.117 -12.615 1.00 0.00 C ATOM 81 C GLN A 723 4.206 -9.153 -14.001 1.00 0.00 C ATOM 82 O GLN A 723 4.279 -10.163 -14.702 1.00 0.00 O ATOM 83 CB GLN A 723 3.815 -9.539 -11.555 1.00 0.00 C ATOM 84 CG GLN A 723 4.407 -9.741 -10.165 1.00 0.00 C ATOM 85 CD GLN A 723 4.829 -8.440 -9.501 1.00 0.00 C ATOM 86 OE1 GLN A 723 4.221 -7.388 -9.723 1.00 0.00 O ATOM 87 NE2 GLN A 723 5.885 -8.493 -8.706 1.00 0.00 N ATOM 0 H GLN A 723 4.978 -7.362 -11.477 1.00 0.00 H new ATOM 0 HA GLN A 723 5.674 -9.822 -12.613 1.00 0.00 H new ATOM 0 HB2 GLN A 723 3.033 -8.781 -11.499 1.00 0.00 H new ATOM 0 HB3 GLN A 723 3.338 -10.466 -11.874 1.00 0.00 H new ATOM 0 HG2 GLN A 723 3.674 -10.243 -9.534 1.00 0.00 H new ATOM 0 HG3 GLN A 723 5.271 -10.402 -10.237 1.00 0.00 H new ATOM 0 HE21 GLN A 723 6.360 -9.382 -8.548 1.00 0.00 H new ATOM 0 HE22 GLN A 723 6.224 -7.645 -8.251 1.00 0.00 H new ATOM 96 N ASP A 724 3.590 -8.054 -14.399 1.00 0.00 N ATOM 97 CA ASP A 724 2.953 -7.988 -15.702 1.00 0.00 C ATOM 98 C ASP A 724 3.973 -7.601 -16.768 1.00 0.00 C ATOM 99 O ASP A 724 4.211 -6.420 -17.025 1.00 0.00 O ATOM 100 CB ASP A 724 1.783 -7.003 -15.690 1.00 0.00 C ATOM 101 CG ASP A 724 1.032 -6.985 -17.007 1.00 0.00 C ATOM 102 OD1 ASP A 724 0.410 -8.012 -17.357 1.00 0.00 O ATOM 103 OD2 ASP A 724 1.073 -5.957 -17.706 1.00 0.00 O ATOM 0 H ASP A 724 3.517 -7.201 -13.844 1.00 0.00 H new ATOM 0 HA ASP A 724 2.556 -8.975 -15.941 1.00 0.00 H new ATOM 0 HB2 ASP A 724 1.096 -7.268 -14.886 1.00 0.00 H new ATOM 0 HB3 ASP A 724 2.156 -6.002 -15.473 1.00 0.00 H new ATOM 108 N GLY A 725 4.599 -8.607 -17.358 1.00 0.00 N ATOM 109 CA GLY A 725 5.593 -8.365 -18.381 1.00 0.00 C ATOM 110 C GLY A 725 6.252 -9.645 -18.845 1.00 0.00 C ATOM 111 O GLY A 725 7.154 -10.165 -18.186 1.00 0.00 O ATOM 0 H GLY A 725 4.435 -9.591 -17.145 1.00 0.00 H new ATOM 0 HA2 GLY A 725 5.125 -7.869 -19.231 1.00 0.00 H new ATOM 0 HA3 GLY A 725 6.353 -7.685 -17.995 1.00 0.00 H new ATOM 115 N VAL A 726 5.810 -10.165 -19.981 1.00 0.00 N ATOM 116 CA VAL A 726 6.365 -11.400 -20.506 1.00 0.00 C ATOM 117 C VAL A 726 7.569 -11.090 -21.376 1.00 0.00 C ATOM 118 O VAL A 726 7.481 -11.034 -22.606 1.00 0.00 O ATOM 119 CB VAL A 726 5.339 -12.198 -21.326 1.00 0.00 C ATOM 120 CG1 VAL A 726 5.873 -13.588 -21.658 1.00 0.00 C ATOM 121 CG2 VAL A 726 4.010 -12.288 -20.592 1.00 0.00 C ATOM 0 H VAL A 726 5.073 -9.752 -20.553 1.00 0.00 H new ATOM 0 HA VAL A 726 6.658 -12.013 -19.653 1.00 0.00 H new ATOM 0 HB VAL A 726 5.170 -11.668 -22.264 1.00 0.00 H new ATOM 0 HG11 VAL A 726 5.130 -14.134 -22.239 1.00 0.00 H new ATOM 0 HG12 VAL A 726 6.791 -13.496 -22.239 1.00 0.00 H new ATOM 0 HG13 VAL A 726 6.080 -14.128 -20.734 1.00 0.00 H new ATOM 0 HG21 VAL A 726 3.301 -12.857 -21.192 1.00 0.00 H new ATOM 0 HG22 VAL A 726 4.157 -12.787 -19.634 1.00 0.00 H new ATOM 0 HG23 VAL A 726 3.619 -11.285 -20.423 1.00 0.00 H new ATOM 131 N ASP A 727 8.680 -10.852 -20.719 1.00 0.00 N ATOM 132 CA ASP A 727 9.909 -10.493 -21.395 1.00 0.00 C ATOM 133 C ASP A 727 10.908 -11.639 -21.318 1.00 0.00 C ATOM 134 O ASP A 727 10.981 -12.334 -20.303 1.00 0.00 O ATOM 135 CB ASP A 727 10.504 -9.225 -20.780 1.00 0.00 C ATOM 136 CG ASP A 727 11.831 -8.849 -21.401 1.00 0.00 C ATOM 137 OD1 ASP A 727 11.833 -8.125 -22.418 1.00 0.00 O ATOM 138 OD2 ASP A 727 12.874 -9.287 -20.878 1.00 0.00 O ATOM 0 H ASP A 727 8.760 -10.901 -19.703 1.00 0.00 H new ATOM 0 HA ASP A 727 9.685 -10.297 -22.444 1.00 0.00 H new ATOM 0 HB2 ASP A 727 9.802 -8.401 -20.904 1.00 0.00 H new ATOM 0 HB3 ASP A 727 10.637 -9.372 -19.708 1.00 0.00 H new ATOM 143 N HIS A 728 11.662 -11.830 -22.399 1.00 0.00 N ATOM 144 CA HIS A 728 12.654 -12.898 -22.487 1.00 0.00 C ATOM 145 C HIS A 728 13.647 -12.810 -21.335 1.00 0.00 C ATOM 146 O HIS A 728 13.801 -13.749 -20.557 1.00 0.00 O ATOM 147 CB HIS A 728 13.402 -12.802 -23.827 1.00 0.00 C ATOM 148 CG HIS A 728 14.303 -13.965 -24.131 1.00 0.00 C ATOM 149 ND1 HIS A 728 14.051 -14.894 -25.116 1.00 0.00 N ATOM 150 CD2 HIS A 728 15.495 -14.319 -23.584 1.00 0.00 C ATOM 151 CE1 HIS A 728 15.068 -15.763 -25.136 1.00 0.00 C ATOM 152 NE2 HIS A 728 15.973 -15.457 -24.227 1.00 0.00 N ATOM 0 H HIS A 728 11.602 -11.250 -23.236 1.00 0.00 H new ATOM 0 HA HIS A 728 12.138 -13.856 -22.425 1.00 0.00 H new ATOM 0 HB2 HIS A 728 12.670 -12.708 -24.629 1.00 0.00 H new ATOM 0 HB3 HIS A 728 13.997 -11.889 -23.830 1.00 0.00 H new ATOM 0 HD2 HIS A 728 15.993 -13.800 -22.778 1.00 0.00 H new ATOM 0 HE1 HIS A 728 15.139 -16.605 -25.809 1.00 0.00 H new ATOM 0 HE2 HIS A 728 16.844 -15.952 -24.035 1.00 0.00 H new ATOM 160 N PHE A 729 14.289 -11.660 -21.212 1.00 0.00 N ATOM 161 CA PHE A 729 15.367 -11.495 -20.256 1.00 0.00 C ATOM 162 C PHE A 729 14.834 -11.364 -18.836 1.00 0.00 C ATOM 163 O PHE A 729 15.488 -11.792 -17.888 1.00 0.00 O ATOM 164 CB PHE A 729 16.236 -10.297 -20.636 1.00 0.00 C ATOM 165 CG PHE A 729 16.947 -10.492 -21.948 1.00 0.00 C ATOM 166 CD1 PHE A 729 17.768 -11.592 -22.140 1.00 0.00 C ATOM 167 CD2 PHE A 729 16.796 -9.584 -22.987 1.00 0.00 C ATOM 168 CE1 PHE A 729 18.420 -11.786 -23.341 1.00 0.00 C ATOM 169 CE2 PHE A 729 17.451 -9.775 -24.191 1.00 0.00 C ATOM 170 CZ PHE A 729 18.261 -10.876 -24.366 1.00 0.00 C ATOM 0 H PHE A 729 14.081 -10.827 -21.763 1.00 0.00 H new ATOM 0 HA PHE A 729 15.988 -12.390 -20.285 1.00 0.00 H new ATOM 0 HB2 PHE A 729 15.613 -9.404 -20.694 1.00 0.00 H new ATOM 0 HB3 PHE A 729 16.971 -10.122 -19.851 1.00 0.00 H new ATOM 0 HD1 PHE A 729 17.899 -12.306 -21.340 1.00 0.00 H new ATOM 0 HD2 PHE A 729 16.161 -8.720 -22.855 1.00 0.00 H new ATOM 0 HE1 PHE A 729 19.054 -12.649 -23.478 1.00 0.00 H new ATOM 0 HE2 PHE A 729 17.327 -9.062 -24.993 1.00 0.00 H new ATOM 0 HZ PHE A 729 18.772 -11.027 -25.306 1.00 0.00 H new ATOM 180 N ARG A 730 13.643 -10.791 -18.686 1.00 0.00 N ATOM 181 CA ARG A 730 13.002 -10.738 -17.374 1.00 0.00 C ATOM 182 C ARG A 730 12.784 -12.148 -16.838 1.00 0.00 C ATOM 183 O ARG A 730 13.075 -12.432 -15.676 1.00 0.00 O ATOM 184 CB ARG A 730 11.656 -10.006 -17.417 1.00 0.00 C ATOM 185 CG ARG A 730 10.987 -9.961 -16.050 1.00 0.00 C ATOM 186 CD ARG A 730 9.543 -9.492 -16.113 1.00 0.00 C ATOM 187 NE ARG A 730 8.863 -9.714 -14.837 1.00 0.00 N ATOM 188 CZ ARG A 730 7.910 -10.629 -14.641 1.00 0.00 C ATOM 189 NH1 ARG A 730 7.435 -11.341 -15.656 1.00 0.00 N ATOM 190 NH2 ARG A 730 7.414 -10.816 -13.429 1.00 0.00 N ATOM 0 H ARG A 730 13.109 -10.363 -19.442 1.00 0.00 H new ATOM 0 HA ARG A 730 13.670 -10.183 -16.715 1.00 0.00 H new ATOM 0 HB2 ARG A 730 11.808 -8.989 -17.780 1.00 0.00 H new ATOM 0 HB3 ARG A 730 10.996 -10.503 -18.128 1.00 0.00 H new ATOM 0 HG2 ARG A 730 11.022 -10.954 -15.601 1.00 0.00 H new ATOM 0 HG3 ARG A 730 11.552 -9.296 -15.397 1.00 0.00 H new ATOM 0 HD2 ARG A 730 9.512 -8.432 -16.366 1.00 0.00 H new ATOM 0 HD3 ARG A 730 9.018 -10.025 -16.906 1.00 0.00 H new ATOM 0 HE ARG A 730 9.135 -9.132 -14.045 1.00 0.00 H new ATOM 0 HH11 ARG A 730 7.798 -11.192 -16.598 1.00 0.00 H new ATOM 0 HH12 ARG A 730 6.707 -12.037 -15.494 1.00 0.00 H new ATOM 0 HH21 ARG A 730 7.759 -10.262 -12.646 1.00 0.00 H new ATOM 0 HH22 ARG A 730 6.686 -11.514 -13.278 1.00 0.00 H new ATOM 204 N ALA A 731 12.278 -13.028 -17.698 1.00 0.00 N ATOM 205 CA ALA A 731 12.014 -14.410 -17.318 1.00 0.00 C ATOM 206 C ALA A 731 13.303 -15.104 -16.897 1.00 0.00 C ATOM 207 O ALA A 731 13.339 -15.826 -15.898 1.00 0.00 O ATOM 208 CB ALA A 731 11.351 -15.158 -18.465 1.00 0.00 C ATOM 0 H ALA A 731 12.042 -12.806 -18.665 1.00 0.00 H new ATOM 0 HA ALA A 731 11.332 -14.411 -16.467 1.00 0.00 H new ATOM 0 HB1 ALA A 731 11.160 -16.189 -18.165 1.00 0.00 H new ATOM 0 HB2 ALA A 731 10.408 -14.674 -18.719 1.00 0.00 H new ATOM 0 HB3 ALA A 731 12.009 -15.149 -19.334 1.00 0.00 H new ATOM 214 N MET A 732 14.364 -14.858 -17.656 1.00 0.00 N ATOM 215 CA MET A 732 15.673 -15.428 -17.369 1.00 0.00 C ATOM 216 C MET A 732 16.195 -14.943 -16.017 1.00 0.00 C ATOM 217 O MET A 732 16.777 -15.713 -15.257 1.00 0.00 O ATOM 218 CB MET A 732 16.649 -15.052 -18.486 1.00 0.00 C ATOM 219 CG MET A 732 16.180 -15.496 -19.863 1.00 0.00 C ATOM 220 SD MET A 732 16.771 -17.133 -20.320 1.00 0.00 S ATOM 221 CE MET A 732 18.473 -16.748 -20.723 1.00 0.00 C ATOM 0 H MET A 732 14.341 -14.261 -18.483 1.00 0.00 H new ATOM 0 HA MET A 732 15.581 -16.513 -17.321 1.00 0.00 H new ATOM 0 HB2 MET A 732 16.791 -13.971 -18.488 1.00 0.00 H new ATOM 0 HB3 MET A 732 17.620 -15.500 -18.278 1.00 0.00 H new ATOM 0 HG2 MET A 732 15.090 -15.490 -19.888 1.00 0.00 H new ATOM 0 HG3 MET A 732 16.520 -14.774 -20.606 1.00 0.00 H new ATOM 0 HE1 MET A 732 18.919 -17.586 -21.259 1.00 0.00 H new ATOM 0 HE2 MET A 732 18.506 -15.858 -21.351 1.00 0.00 H new ATOM 0 HE3 MET A 732 19.032 -16.565 -19.805 1.00 0.00 H new ATOM 231 N ILE A 733 15.958 -13.671 -15.711 1.00 0.00 N ATOM 232 CA ILE A 733 16.447 -13.071 -14.472 1.00 0.00 C ATOM 233 C ILE A 733 15.593 -13.471 -13.265 1.00 0.00 C ATOM 234 O ILE A 733 16.125 -13.737 -12.184 1.00 0.00 O ATOM 235 CB ILE A 733 16.505 -11.529 -14.591 1.00 0.00 C ATOM 236 CG1 ILE A 733 17.563 -11.123 -15.622 1.00 0.00 C ATOM 237 CG2 ILE A 733 16.789 -10.876 -13.245 1.00 0.00 C ATOM 238 CD1 ILE A 733 17.675 -9.628 -15.837 1.00 0.00 C ATOM 0 H ILE A 733 15.429 -13.033 -16.306 1.00 0.00 H new ATOM 0 HA ILE A 733 17.455 -13.454 -14.310 1.00 0.00 H new ATOM 0 HB ILE A 733 15.529 -11.177 -14.926 1.00 0.00 H new ATOM 0 HG12 ILE A 733 18.532 -11.507 -15.303 1.00 0.00 H new ATOM 0 HG13 ILE A 733 17.329 -11.600 -16.574 1.00 0.00 H new ATOM 0 HG21 ILE A 733 16.823 -9.793 -13.366 1.00 0.00 H new ATOM 0 HG22 ILE A 733 16.000 -11.138 -12.540 1.00 0.00 H new ATOM 0 HG23 ILE A 733 17.748 -11.229 -12.865 1.00 0.00 H new ATOM 0 HD11 ILE A 733 18.445 -9.424 -16.581 1.00 0.00 H new ATOM 0 HD12 ILE A 733 16.719 -9.238 -16.188 1.00 0.00 H new ATOM 0 HD13 ILE A 733 17.941 -9.144 -14.897 1.00 0.00 H new ATOM 250 N VAL A 734 14.276 -13.532 -13.442 1.00 0.00 N ATOM 251 CA VAL A 734 13.390 -13.872 -12.333 1.00 0.00 C ATOM 252 C VAL A 734 13.635 -15.310 -11.861 1.00 0.00 C ATOM 253 O VAL A 734 13.616 -15.586 -10.661 1.00 0.00 O ATOM 254 CB VAL A 734 11.894 -13.652 -12.682 1.00 0.00 C ATOM 255 CG1 VAL A 734 11.411 -14.623 -13.746 1.00 0.00 C ATOM 256 CG2 VAL A 734 11.031 -13.752 -11.429 1.00 0.00 C ATOM 0 H VAL A 734 13.804 -13.353 -14.329 1.00 0.00 H new ATOM 0 HA VAL A 734 13.628 -13.192 -11.515 1.00 0.00 H new ATOM 0 HB VAL A 734 11.799 -12.647 -13.093 1.00 0.00 H new ATOM 0 HG11 VAL A 734 10.359 -14.434 -13.960 1.00 0.00 H new ATOM 0 HG12 VAL A 734 11.997 -14.487 -14.655 1.00 0.00 H new ATOM 0 HG13 VAL A 734 11.530 -15.645 -13.387 1.00 0.00 H new ATOM 0 HG21 VAL A 734 9.985 -13.595 -11.694 1.00 0.00 H new ATOM 0 HG22 VAL A 734 11.148 -14.740 -10.984 1.00 0.00 H new ATOM 0 HG23 VAL A 734 11.342 -12.992 -10.712 1.00 0.00 H new ATOM 266 N GLU A 735 13.901 -16.217 -12.800 1.00 0.00 N ATOM 267 CA GLU A 735 14.217 -17.594 -12.440 1.00 0.00 C ATOM 268 C GLU A 735 15.660 -17.699 -11.959 1.00 0.00 C ATOM 269 O GLU A 735 15.984 -18.549 -11.133 1.00 0.00 O ATOM 270 CB GLU A 735 13.986 -18.543 -13.616 1.00 0.00 C ATOM 271 CG GLU A 735 12.530 -18.648 -14.033 1.00 0.00 C ATOM 272 CD GLU A 735 12.266 -19.854 -14.907 1.00 0.00 C ATOM 273 OE1 GLU A 735 12.456 -19.762 -16.137 1.00 0.00 O ATOM 274 OE2 GLU A 735 11.870 -20.908 -14.363 1.00 0.00 O ATOM 0 H GLU A 735 13.904 -16.025 -13.802 1.00 0.00 H new ATOM 0 HA GLU A 735 13.549 -17.888 -11.631 1.00 0.00 H new ATOM 0 HB2 GLU A 735 14.576 -18.204 -14.467 1.00 0.00 H new ATOM 0 HB3 GLU A 735 14.352 -19.535 -13.350 1.00 0.00 H new ATOM 0 HG2 GLU A 735 11.903 -18.703 -13.143 1.00 0.00 H new ATOM 0 HG3 GLU A 735 12.242 -17.744 -14.570 1.00 0.00 H new ATOM 281 N PHE A 736 16.511 -16.822 -12.475 1.00 0.00 N ATOM 282 CA PHE A 736 17.904 -16.726 -12.043 1.00 0.00 C ATOM 283 C PHE A 736 17.994 -16.573 -10.526 1.00 0.00 C ATOM 284 O PHE A 736 18.788 -17.249 -9.865 1.00 0.00 O ATOM 285 CB PHE A 736 18.559 -15.533 -12.748 1.00 0.00 C ATOM 286 CG PHE A 736 19.851 -15.057 -12.152 1.00 0.00 C ATOM 287 CD1 PHE A 736 20.992 -15.836 -12.205 1.00 0.00 C ATOM 288 CD2 PHE A 736 19.925 -13.806 -11.562 1.00 0.00 C ATOM 289 CE1 PHE A 736 22.184 -15.375 -11.680 1.00 0.00 C ATOM 290 CE2 PHE A 736 21.111 -13.345 -11.031 1.00 0.00 C ATOM 291 CZ PHE A 736 22.242 -14.129 -11.092 1.00 0.00 C ATOM 0 H PHE A 736 16.258 -16.156 -13.205 1.00 0.00 H new ATOM 0 HA PHE A 736 18.430 -17.642 -12.311 1.00 0.00 H new ATOM 0 HB2 PHE A 736 18.737 -15.802 -13.789 1.00 0.00 H new ATOM 0 HB3 PHE A 736 17.853 -14.703 -12.750 1.00 0.00 H new ATOM 0 HD1 PHE A 736 20.951 -16.814 -12.661 1.00 0.00 H new ATOM 0 HD2 PHE A 736 19.043 -13.184 -11.517 1.00 0.00 H new ATOM 0 HE1 PHE A 736 23.070 -15.990 -11.730 1.00 0.00 H new ATOM 0 HE2 PHE A 736 21.153 -12.370 -10.568 1.00 0.00 H new ATOM 0 HZ PHE A 736 23.173 -13.768 -10.680 1.00 0.00 H new ATOM 301 N MET A 737 17.152 -15.707 -9.981 1.00 0.00 N ATOM 302 CA MET A 737 17.134 -15.457 -8.544 1.00 0.00 C ATOM 303 C MET A 737 16.653 -16.681 -7.762 1.00 0.00 C ATOM 304 O MET A 737 16.973 -16.837 -6.584 1.00 0.00 O ATOM 305 CB MET A 737 16.254 -14.249 -8.216 1.00 0.00 C ATOM 306 CG MET A 737 16.760 -12.948 -8.818 1.00 0.00 C ATOM 307 SD MET A 737 15.836 -11.501 -8.260 1.00 0.00 S ATOM 308 CE MET A 737 14.188 -11.890 -8.840 1.00 0.00 C ATOM 0 H MET A 737 16.471 -15.164 -10.512 1.00 0.00 H new ATOM 0 HA MET A 737 18.159 -15.244 -8.241 1.00 0.00 H new ATOM 0 HB2 MET A 737 15.243 -14.438 -8.577 1.00 0.00 H new ATOM 0 HB3 MET A 737 16.191 -14.139 -7.133 1.00 0.00 H new ATOM 0 HG2 MET A 737 17.812 -12.821 -8.561 1.00 0.00 H new ATOM 0 HG3 MET A 737 16.703 -13.011 -9.905 1.00 0.00 H new ATOM 0 HE1 MET A 737 13.744 -11.005 -9.295 1.00 0.00 H new ATOM 0 HE2 MET A 737 14.242 -12.690 -9.579 1.00 0.00 H new ATOM 0 HE3 MET A 737 13.573 -12.213 -8.000 1.00 0.00 H new ATOM 318 N ALA A 738 15.904 -17.556 -8.416 1.00 0.00 N ATOM 319 CA ALA A 738 15.371 -18.742 -7.757 1.00 0.00 C ATOM 320 C ALA A 738 16.248 -19.970 -8.015 1.00 0.00 C ATOM 321 O ALA A 738 16.062 -21.017 -7.394 1.00 0.00 O ATOM 322 CB ALA A 738 13.946 -19.006 -8.222 1.00 0.00 C ATOM 0 H ALA A 738 15.651 -17.469 -9.400 1.00 0.00 H new ATOM 0 HA ALA A 738 15.368 -18.554 -6.683 1.00 0.00 H new ATOM 0 HB1 ALA A 738 13.559 -19.894 -7.723 1.00 0.00 H new ATOM 0 HB2 ALA A 738 13.318 -18.149 -7.976 1.00 0.00 H new ATOM 0 HB3 ALA A 738 13.939 -19.164 -9.300 1.00 0.00 H new ATOM 328 N SER A 739 17.205 -19.835 -8.923 1.00 0.00 N ATOM 329 CA SER A 739 18.067 -20.952 -9.302 1.00 0.00 C ATOM 330 C SER A 739 19.318 -21.020 -8.426 1.00 0.00 C ATOM 331 O SER A 739 20.183 -21.871 -8.640 1.00 0.00 O ATOM 332 CB SER A 739 18.466 -20.834 -10.777 1.00 0.00 C ATOM 333 OG SER A 739 17.324 -20.817 -11.615 1.00 0.00 O ATOM 0 H SER A 739 17.406 -18.963 -9.413 1.00 0.00 H new ATOM 0 HA SER A 739 17.503 -21.872 -9.152 1.00 0.00 H new ATOM 0 HB2 SER A 739 19.045 -19.923 -10.928 1.00 0.00 H new ATOM 0 HB3 SER A 739 19.109 -21.670 -11.051 1.00 0.00 H new ATOM 0 HG SER A 739 16.921 -19.924 -11.600 1.00 0.00 H new ATOM 339 N LYS A 740 19.400 -20.113 -7.449 1.00 0.00 N ATOM 340 CA LYS A 740 20.535 -20.039 -6.520 1.00 0.00 C ATOM 341 C LYS A 740 21.826 -19.657 -7.257 1.00 0.00 C ATOM 342 O LYS A 740 22.919 -19.689 -6.690 1.00 0.00 O ATOM 343 CB LYS A 740 20.708 -21.369 -5.762 1.00 0.00 C ATOM 344 CG LYS A 740 21.719 -21.305 -4.624 1.00 0.00 C ATOM 345 CD LYS A 740 21.906 -22.658 -3.961 1.00 0.00 C ATOM 346 CE LYS A 740 23.044 -22.628 -2.952 1.00 0.00 C ATOM 347 NZ LYS A 740 22.784 -21.683 -1.831 1.00 0.00 N ATOM 0 H LYS A 740 18.682 -19.409 -7.278 1.00 0.00 H new ATOM 0 HA LYS A 740 20.323 -19.258 -5.790 1.00 0.00 H new ATOM 0 HB2 LYS A 740 19.742 -21.675 -5.360 1.00 0.00 H new ATOM 0 HB3 LYS A 740 21.018 -22.140 -6.467 1.00 0.00 H new ATOM 0 HG2 LYS A 740 22.676 -20.952 -5.007 1.00 0.00 H new ATOM 0 HG3 LYS A 740 21.386 -20.579 -3.882 1.00 0.00 H new ATOM 0 HD2 LYS A 740 20.982 -22.951 -3.462 1.00 0.00 H new ATOM 0 HD3 LYS A 740 22.111 -23.412 -4.721 1.00 0.00 H new ATOM 0 HE2 LYS A 740 23.197 -23.630 -2.551 1.00 0.00 H new ATOM 0 HE3 LYS A 740 23.967 -22.343 -3.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 23.555 -21.748 -1.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 22.732 -20.712 -2.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 21.883 -21.928 -1.372 1.00 0.00 H new ATOM 361 N LYS A 741 21.692 -19.266 -8.519 1.00 0.00 N ATOM 362 CA LYS A 741 22.839 -18.862 -9.312 1.00 0.00 C ATOM 363 C LYS A 741 23.418 -17.557 -8.790 1.00 0.00 C ATOM 364 O LYS A 741 22.693 -16.584 -8.579 1.00 0.00 O ATOM 365 CB LYS A 741 22.458 -18.700 -10.781 1.00 0.00 C ATOM 366 CG LYS A 741 22.216 -20.010 -11.508 1.00 0.00 C ATOM 367 CD LYS A 741 21.838 -19.765 -12.961 1.00 0.00 C ATOM 368 CE LYS A 741 21.860 -21.050 -13.767 1.00 0.00 C ATOM 369 NZ LYS A 741 23.229 -21.628 -13.845 1.00 0.00 N ATOM 0 H LYS A 741 20.800 -19.221 -9.012 1.00 0.00 H new ATOM 0 HA LYS A 741 23.592 -19.646 -9.229 1.00 0.00 H new ATOM 0 HB2 LYS A 741 21.557 -18.089 -10.846 1.00 0.00 H new ATOM 0 HB3 LYS A 741 23.251 -18.154 -11.293 1.00 0.00 H new ATOM 0 HG2 LYS A 741 23.113 -20.627 -11.461 1.00 0.00 H new ATOM 0 HG3 LYS A 741 21.421 -20.565 -11.010 1.00 0.00 H new ATOM 0 HD2 LYS A 741 20.844 -19.321 -13.009 1.00 0.00 H new ATOM 0 HD3 LYS A 741 22.529 -19.046 -13.401 1.00 0.00 H new ATOM 0 HE2 LYS A 741 21.184 -21.775 -13.314 1.00 0.00 H new ATOM 0 HE3 LYS A 741 21.490 -20.855 -14.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 741 23.288 -22.271 -14.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 741 23.923 -20.862 -13.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 741 23.433 -22.156 -12.972 1.00 0.00 H new ATOM 383 N MET A 742 24.721 -17.544 -8.574 1.00 0.00 N ATOM 384 CA MET A 742 25.402 -16.342 -8.127 1.00 0.00 C ATOM 385 C MET A 742 25.607 -15.392 -9.298 1.00 0.00 C ATOM 386 O MET A 742 25.708 -14.177 -9.115 1.00 0.00 O ATOM 387 CB MET A 742 26.744 -16.683 -7.469 1.00 0.00 C ATOM 388 CG MET A 742 27.764 -17.332 -8.398 1.00 0.00 C ATOM 389 SD MET A 742 27.254 -18.962 -8.984 1.00 0.00 S ATOM 390 CE MET A 742 28.635 -19.384 -10.042 1.00 0.00 C ATOM 0 H MET A 742 25.329 -18.353 -8.701 1.00 0.00 H new ATOM 0 HA MET A 742 24.778 -15.851 -7.380 1.00 0.00 H new ATOM 0 HB2 MET A 742 27.175 -15.769 -7.060 1.00 0.00 H new ATOM 0 HB3 MET A 742 26.561 -17.353 -6.629 1.00 0.00 H new ATOM 0 HG2 MET A 742 27.931 -16.680 -9.256 1.00 0.00 H new ATOM 0 HG3 MET A 742 28.716 -17.422 -7.876 1.00 0.00 H new ATOM 0 HE1 MET A 742 28.639 -20.459 -10.223 1.00 0.00 H new ATOM 0 HE2 MET A 742 28.541 -18.856 -10.991 1.00 0.00 H new ATOM 0 HE3 MET A 742 29.567 -19.094 -9.557 1.00 0.00 H new ATOM 400 N GLN A 743 25.653 -15.956 -10.500 1.00 0.00 N ATOM 401 CA GLN A 743 25.790 -15.174 -11.717 1.00 0.00 C ATOM 402 C GLN A 743 25.223 -15.940 -12.904 1.00 0.00 C ATOM 403 O GLN A 743 25.235 -17.173 -12.923 1.00 0.00 O ATOM 404 CB GLN A 743 27.253 -14.799 -11.974 1.00 0.00 C ATOM 405 CG GLN A 743 28.187 -15.989 -12.105 1.00 0.00 C ATOM 406 CD GLN A 743 29.612 -15.581 -12.425 1.00 0.00 C ATOM 407 OE1 GLN A 743 30.356 -16.328 -13.054 1.00 0.00 O ATOM 408 NE2 GLN A 743 30.008 -14.392 -11.995 1.00 0.00 N ATOM 0 H GLN A 743 25.597 -16.963 -10.655 1.00 0.00 H new ATOM 0 HA GLN A 743 25.224 -14.251 -11.590 1.00 0.00 H new ATOM 0 HB2 GLN A 743 27.309 -14.205 -12.886 1.00 0.00 H new ATOM 0 HB3 GLN A 743 27.602 -14.165 -11.159 1.00 0.00 H new ATOM 0 HG2 GLN A 743 28.176 -16.558 -11.176 1.00 0.00 H new ATOM 0 HG3 GLN A 743 27.818 -16.651 -12.889 1.00 0.00 H new ATOM 0 HE21 GLN A 743 29.363 -13.797 -11.475 1.00 0.00 H new ATOM 0 HE22 GLN A 743 30.958 -14.072 -12.184 1.00 0.00 H new ATOM 417 N LEU A 744 24.698 -15.200 -13.868 1.00 0.00 N ATOM 418 CA LEU A 744 24.143 -15.778 -15.078 1.00 0.00 C ATOM 419 C LEU A 744 24.813 -15.163 -16.296 1.00 0.00 C ATOM 420 O LEU A 744 24.606 -13.985 -16.607 1.00 0.00 O ATOM 421 CB LEU A 744 22.631 -15.548 -15.143 1.00 0.00 C ATOM 422 CG LEU A 744 21.922 -16.158 -16.355 1.00 0.00 C ATOM 423 CD1 LEU A 744 22.069 -17.673 -16.364 1.00 0.00 C ATOM 424 CD2 LEU A 744 20.452 -15.768 -16.359 1.00 0.00 C ATOM 0 H LEU A 744 24.645 -14.182 -13.832 1.00 0.00 H new ATOM 0 HA LEU A 744 24.328 -16.852 -15.067 1.00 0.00 H new ATOM 0 HB2 LEU A 744 22.180 -15.955 -14.238 1.00 0.00 H new ATOM 0 HB3 LEU A 744 22.444 -14.474 -15.137 1.00 0.00 H new ATOM 0 HG LEU A 744 22.391 -15.766 -17.257 1.00 0.00 H new ATOM 0 HD11 LEU A 744 21.557 -18.083 -17.234 1.00 0.00 H new ATOM 0 HD12 LEU A 744 23.126 -17.936 -16.408 1.00 0.00 H new ATOM 0 HD13 LEU A 744 21.629 -18.087 -15.456 1.00 0.00 H new ATOM 0 HD21 LEU A 744 19.961 -16.209 -17.226 1.00 0.00 H new ATOM 0 HD22 LEU A 744 19.976 -16.133 -15.449 1.00 0.00 H new ATOM 0 HD23 LEU A 744 20.364 -14.683 -16.405 1.00 0.00 H new ATOM 436 N GLU A 745 25.640 -15.953 -16.949 1.00 0.00 N ATOM 437 CA GLU A 745 26.352 -15.521 -18.139 1.00 0.00 C ATOM 438 C GLU A 745 25.454 -15.606 -19.373 1.00 0.00 C ATOM 439 O GLU A 745 25.040 -16.693 -19.781 1.00 0.00 O ATOM 440 CB GLU A 745 27.610 -16.371 -18.344 1.00 0.00 C ATOM 441 CG GLU A 745 28.487 -16.478 -17.102 1.00 0.00 C ATOM 442 CD GLU A 745 28.201 -17.718 -16.268 1.00 0.00 C ATOM 443 OE1 GLU A 745 27.020 -17.977 -15.943 1.00 0.00 O ATOM 444 OE2 GLU A 745 29.169 -18.435 -15.927 1.00 0.00 O ATOM 0 H GLU A 745 25.839 -16.914 -16.671 1.00 0.00 H new ATOM 0 HA GLU A 745 26.646 -14.481 -17.999 1.00 0.00 H new ATOM 0 HB2 GLU A 745 27.314 -17.373 -18.656 1.00 0.00 H new ATOM 0 HB3 GLU A 745 28.197 -15.944 -19.157 1.00 0.00 H new ATOM 0 HG2 GLU A 745 29.534 -16.486 -17.405 1.00 0.00 H new ATOM 0 HG3 GLU A 745 28.340 -15.592 -16.485 1.00 0.00 H new ATOM 451 N PHE A 746 25.150 -14.455 -19.955 1.00 0.00 N ATOM 452 CA PHE A 746 24.342 -14.393 -21.164 1.00 0.00 C ATOM 453 C PHE A 746 25.233 -14.437 -22.400 1.00 0.00 C ATOM 454 O PHE A 746 26.405 -14.067 -22.335 1.00 0.00 O ATOM 455 CB PHE A 746 23.502 -13.113 -21.189 1.00 0.00 C ATOM 456 CG PHE A 746 22.323 -13.121 -20.259 1.00 0.00 C ATOM 457 CD1 PHE A 746 22.458 -12.728 -18.938 1.00 0.00 C ATOM 458 CD2 PHE A 746 21.076 -13.508 -20.716 1.00 0.00 C ATOM 459 CE1 PHE A 746 21.368 -12.723 -18.092 1.00 0.00 C ATOM 460 CE2 PHE A 746 19.984 -13.506 -19.872 1.00 0.00 C ATOM 461 CZ PHE A 746 20.129 -13.113 -18.558 1.00 0.00 C ATOM 0 H PHE A 746 25.453 -13.546 -19.606 1.00 0.00 H new ATOM 0 HA PHE A 746 23.675 -15.255 -21.168 1.00 0.00 H new ATOM 0 HB2 PHE A 746 24.143 -12.269 -20.935 1.00 0.00 H new ATOM 0 HB3 PHE A 746 23.145 -12.948 -22.206 1.00 0.00 H new ATOM 0 HD1 PHE A 746 23.425 -12.423 -18.567 1.00 0.00 H new ATOM 0 HD2 PHE A 746 20.956 -13.815 -21.744 1.00 0.00 H new ATOM 0 HE1 PHE A 746 21.485 -12.413 -17.064 1.00 0.00 H new ATOM 0 HE2 PHE A 746 19.016 -13.812 -20.240 1.00 0.00 H new ATOM 0 HZ PHE A 746 19.276 -13.110 -17.896 1.00 0.00 H new ATOM 471 N PRO A 747 24.694 -14.901 -23.541 1.00 0.00 N ATOM 472 CA PRO A 747 25.425 -14.918 -24.812 1.00 0.00 C ATOM 473 C PRO A 747 25.875 -13.517 -25.243 1.00 0.00 C ATOM 474 O PRO A 747 25.279 -12.512 -24.851 1.00 0.00 O ATOM 475 CB PRO A 747 24.403 -15.481 -25.809 1.00 0.00 C ATOM 476 CG PRO A 747 23.414 -16.216 -24.974 1.00 0.00 C ATOM 477 CD PRO A 747 23.341 -15.464 -23.677 1.00 0.00 C ATOM 0 HA PRO A 747 26.341 -15.505 -24.745 1.00 0.00 H new ATOM 0 HB2 PRO A 747 23.924 -14.683 -26.377 1.00 0.00 H new ATOM 0 HB3 PRO A 747 24.880 -16.144 -26.531 1.00 0.00 H new ATOM 0 HG2 PRO A 747 22.440 -16.252 -25.461 1.00 0.00 H new ATOM 0 HG3 PRO A 747 23.728 -17.247 -24.812 1.00 0.00 H new ATOM 0 HD2 PRO A 747 22.581 -14.684 -23.706 1.00 0.00 H new ATOM 0 HD3 PRO A 747 23.092 -16.121 -22.844 1.00 0.00 H new ATOM 485 N PRO A 748 26.936 -13.430 -26.060 1.00 0.00 N ATOM 486 CA PRO A 748 27.468 -12.151 -26.529 1.00 0.00 C ATOM 487 C PRO A 748 26.598 -11.530 -27.617 1.00 0.00 C ATOM 488 O PRO A 748 26.726 -10.345 -27.927 1.00 0.00 O ATOM 489 CB PRO A 748 28.850 -12.502 -27.102 1.00 0.00 C ATOM 490 CG PRO A 748 29.054 -13.964 -26.854 1.00 0.00 C ATOM 491 CD PRO A 748 27.703 -14.562 -26.590 1.00 0.00 C ATOM 0 HA PRO A 748 27.505 -11.418 -25.723 1.00 0.00 H new ATOM 0 HB2 PRO A 748 28.896 -12.279 -28.168 1.00 0.00 H new ATOM 0 HB3 PRO A 748 29.631 -11.914 -26.620 1.00 0.00 H new ATOM 0 HG2 PRO A 748 29.523 -14.439 -27.716 1.00 0.00 H new ATOM 0 HG3 PRO A 748 29.717 -14.121 -26.003 1.00 0.00 H new ATOM 0 HD2 PRO A 748 27.255 -14.962 -27.499 1.00 0.00 H new ATOM 0 HD3 PRO A 748 27.758 -15.382 -25.874 1.00 0.00 H new ATOM 499 N SER A 749 25.704 -12.341 -28.172 1.00 0.00 N ATOM 500 CA SER A 749 24.862 -11.934 -29.290 1.00 0.00 C ATOM 501 C SER A 749 23.779 -10.931 -28.877 1.00 0.00 C ATOM 502 O SER A 749 23.113 -10.348 -29.733 1.00 0.00 O ATOM 503 CB SER A 749 24.237 -13.174 -29.929 1.00 0.00 C ATOM 504 OG SER A 749 23.730 -14.060 -28.942 1.00 0.00 O ATOM 0 H SER A 749 25.543 -13.298 -27.859 1.00 0.00 H new ATOM 0 HA SER A 749 25.493 -11.422 -30.016 1.00 0.00 H new ATOM 0 HB2 SER A 749 23.432 -12.874 -30.600 1.00 0.00 H new ATOM 0 HB3 SER A 749 24.982 -13.689 -30.535 1.00 0.00 H new ATOM 0 HG SER A 749 23.334 -14.844 -29.378 1.00 0.00 H new ATOM 510 N LEU A 750 23.598 -10.745 -27.570 1.00 0.00 N ATOM 511 CA LEU A 750 22.686 -9.724 -27.055 1.00 0.00 C ATOM 512 C LEU A 750 23.111 -8.346 -27.563 1.00 0.00 C ATOM 513 O LEU A 750 24.177 -7.851 -27.193 1.00 0.00 O ATOM 514 CB LEU A 750 22.689 -9.729 -25.521 1.00 0.00 C ATOM 515 CG LEU A 750 21.758 -10.744 -24.850 1.00 0.00 C ATOM 516 CD1 LEU A 750 22.112 -12.172 -25.239 1.00 0.00 C ATOM 517 CD2 LEU A 750 21.807 -10.578 -23.340 1.00 0.00 C ATOM 0 H LEU A 750 24.071 -11.288 -26.848 1.00 0.00 H new ATOM 0 HA LEU A 750 21.679 -9.947 -27.407 1.00 0.00 H new ATOM 0 HB2 LEU A 750 23.707 -9.919 -25.180 1.00 0.00 H new ATOM 0 HB3 LEU A 750 22.417 -8.732 -25.174 1.00 0.00 H new ATOM 0 HG LEU A 750 20.744 -10.550 -25.199 1.00 0.00 H new ATOM 0 HD11 LEU A 750 21.430 -12.864 -24.744 1.00 0.00 H new ATOM 0 HD12 LEU A 750 22.024 -12.287 -26.319 1.00 0.00 H new ATOM 0 HD13 LEU A 750 23.135 -12.389 -24.933 1.00 0.00 H new ATOM 0 HD21 LEU A 750 21.142 -11.304 -22.872 1.00 0.00 H new ATOM 0 HD22 LEU A 750 22.826 -10.741 -22.989 1.00 0.00 H new ATOM 0 HD23 LEU A 750 21.488 -9.570 -23.074 1.00 0.00 H new ATOM 529 N ASN A 751 22.282 -7.729 -28.401 1.00 0.00 N ATOM 530 CA ASN A 751 22.640 -6.455 -29.023 1.00 0.00 C ATOM 531 C ASN A 751 22.523 -5.316 -28.008 1.00 0.00 C ATOM 532 O ASN A 751 22.153 -5.546 -26.855 1.00 0.00 O ATOM 533 CB ASN A 751 21.768 -6.182 -30.264 1.00 0.00 C ATOM 534 CG ASN A 751 20.445 -5.500 -29.955 1.00 0.00 C ATOM 535 OD1 ASN A 751 20.352 -4.272 -29.961 1.00 0.00 O ATOM 536 ND2 ASN A 751 19.418 -6.279 -29.676 1.00 0.00 N ATOM 0 H ASN A 751 21.364 -8.086 -28.664 1.00 0.00 H new ATOM 0 HA ASN A 751 23.677 -6.514 -29.354 1.00 0.00 H new ATOM 0 HB2 ASN A 751 22.331 -5.561 -30.961 1.00 0.00 H new ATOM 0 HB3 ASN A 751 21.568 -7.127 -30.769 1.00 0.00 H new ATOM 0 HD21 ASN A 751 18.511 -5.868 -29.456 1.00 0.00 H new ATOM 0 HD22 ASN A 751 19.531 -7.293 -29.680 1.00 0.00 H new ATOM 543 N SER A 752 22.842 -4.097 -28.436 1.00 0.00 N ATOM 544 CA SER A 752 22.835 -2.937 -27.544 1.00 0.00 C ATOM 545 C SER A 752 21.507 -2.817 -26.788 1.00 0.00 C ATOM 546 O SER A 752 21.492 -2.557 -25.584 1.00 0.00 O ATOM 547 CB SER A 752 23.099 -1.661 -28.345 1.00 0.00 C ATOM 548 OG SER A 752 24.316 -1.756 -29.071 1.00 0.00 O ATOM 0 H SER A 752 23.109 -3.885 -29.397 1.00 0.00 H new ATOM 0 HA SER A 752 23.627 -3.075 -26.808 1.00 0.00 H new ATOM 0 HB2 SER A 752 22.274 -1.483 -29.034 1.00 0.00 H new ATOM 0 HB3 SER A 752 23.140 -0.806 -27.670 1.00 0.00 H new ATOM 0 HG SER A 752 24.461 -0.929 -29.576 1.00 0.00 H new ATOM 554 N HIS A 753 20.403 -3.038 -27.493 1.00 0.00 N ATOM 555 CA HIS A 753 19.077 -2.940 -26.895 1.00 0.00 C ATOM 556 C HIS A 753 18.828 -4.086 -25.921 1.00 0.00 C ATOM 557 O HIS A 753 18.204 -3.894 -24.874 1.00 0.00 O ATOM 558 CB HIS A 753 17.998 -2.914 -27.979 1.00 0.00 C ATOM 559 CG HIS A 753 17.969 -1.636 -28.763 1.00 0.00 C ATOM 560 ND1 HIS A 753 18.628 -1.446 -29.959 1.00 0.00 N ATOM 561 CD2 HIS A 753 17.338 -0.465 -28.493 1.00 0.00 C ATOM 562 CE1 HIS A 753 18.384 -0.195 -30.370 1.00 0.00 C ATOM 563 NE2 HIS A 753 17.606 0.444 -29.514 1.00 0.00 N ATOM 0 H HIS A 753 20.401 -3.287 -28.482 1.00 0.00 H new ATOM 0 HA HIS A 753 19.029 -2.006 -26.336 1.00 0.00 H new ATOM 0 HB2 HIS A 753 18.161 -3.747 -28.663 1.00 0.00 H new ATOM 0 HB3 HIS A 753 17.024 -3.069 -27.515 1.00 0.00 H new ATOM 0 HD2 HIS A 753 16.726 -0.269 -27.625 1.00 0.00 H new ATOM 0 HE1 HIS A 753 18.772 0.235 -31.281 1.00 0.00 H new ATOM 0 HE2 HIS A 753 17.271 1.405 -29.586 1.00 0.00 H new ATOM 571 N ASP A 754 19.329 -5.272 -26.259 1.00 0.00 N ATOM 572 CA ASP A 754 19.210 -6.433 -25.378 1.00 0.00 C ATOM 573 C ASP A 754 19.980 -6.189 -24.092 1.00 0.00 C ATOM 574 O ASP A 754 19.454 -6.385 -22.997 1.00 0.00 O ATOM 575 CB ASP A 754 19.747 -7.707 -26.039 1.00 0.00 C ATOM 576 CG ASP A 754 18.955 -8.147 -27.251 1.00 0.00 C ATOM 577 OD1 ASP A 754 17.706 -8.121 -27.199 1.00 0.00 O ATOM 578 OD2 ASP A 754 19.583 -8.542 -28.259 1.00 0.00 O ATOM 0 H ASP A 754 19.820 -5.455 -27.134 1.00 0.00 H new ATOM 0 HA ASP A 754 18.150 -6.572 -25.167 1.00 0.00 H new ATOM 0 HB2 ASP A 754 20.783 -7.543 -26.334 1.00 0.00 H new ATOM 0 HB3 ASP A 754 19.748 -8.513 -25.305 1.00 0.00 H new ATOM 583 N ARG A 755 21.231 -5.755 -24.240 1.00 0.00 N ATOM 584 CA ARG A 755 22.085 -5.448 -23.096 1.00 0.00 C ATOM 585 C ARG A 755 21.384 -4.454 -22.188 1.00 0.00 C ATOM 586 O ARG A 755 21.150 -4.725 -21.012 1.00 0.00 O ATOM 587 CB ARG A 755 23.417 -4.848 -23.557 1.00 0.00 C ATOM 588 CG ARG A 755 24.156 -5.684 -24.583 1.00 0.00 C ATOM 589 CD ARG A 755 24.626 -7.019 -24.019 1.00 0.00 C ATOM 590 NE ARG A 755 26.085 -7.083 -23.868 1.00 0.00 N ATOM 591 CZ ARG A 755 26.886 -7.789 -24.673 1.00 0.00 C ATOM 592 NH1 ARG A 755 26.400 -8.364 -25.766 1.00 0.00 N ATOM 593 NH2 ARG A 755 28.185 -7.884 -24.405 1.00 0.00 N ATOM 0 H ARG A 755 21.676 -5.608 -25.146 1.00 0.00 H new ATOM 0 HA ARG A 755 22.281 -6.375 -22.557 1.00 0.00 H new ATOM 0 HB2 ARG A 755 23.231 -3.860 -23.977 1.00 0.00 H new ATOM 0 HB3 ARG A 755 24.060 -4.709 -22.688 1.00 0.00 H new ATOM 0 HG2 ARG A 755 23.504 -5.864 -25.438 1.00 0.00 H new ATOM 0 HG3 ARG A 755 25.017 -5.125 -24.950 1.00 0.00 H new ATOM 0 HD2 ARG A 755 24.156 -7.186 -23.050 1.00 0.00 H new ATOM 0 HD3 ARG A 755 24.296 -7.824 -24.676 1.00 0.00 H new ATOM 0 HE ARG A 755 26.512 -6.558 -23.105 1.00 0.00 H new ATOM 0 HH11 ARG A 755 25.411 -8.269 -25.996 1.00 0.00 H new ATOM 0 HH12 ARG A 755 27.016 -8.901 -26.376 1.00 0.00 H new ATOM 0 HH21 ARG A 755 28.572 -7.418 -23.584 1.00 0.00 H new ATOM 0 HH22 ARG A 755 28.795 -8.423 -25.020 1.00 0.00 H new ATOM 607 N LEU A 756 21.034 -3.313 -22.770 1.00 0.00 N ATOM 608 CA LEU A 756 20.373 -2.227 -22.049 1.00 0.00 C ATOM 609 C LEU A 756 19.134 -2.713 -21.297 1.00 0.00 C ATOM 610 O LEU A 756 18.899 -2.317 -20.155 1.00 0.00 O ATOM 611 CB LEU A 756 19.994 -1.113 -23.029 1.00 0.00 C ATOM 612 CG LEU A 756 19.261 0.086 -22.422 1.00 0.00 C ATOM 613 CD1 LEU A 756 20.142 0.801 -21.407 1.00 0.00 C ATOM 614 CD2 LEU A 756 18.815 1.045 -23.518 1.00 0.00 C ATOM 0 H LEU A 756 21.200 -3.113 -23.756 1.00 0.00 H new ATOM 0 HA LEU A 756 21.073 -1.842 -21.308 1.00 0.00 H new ATOM 0 HB2 LEU A 756 20.903 -0.753 -23.511 1.00 0.00 H new ATOM 0 HB3 LEU A 756 19.367 -1.541 -23.811 1.00 0.00 H new ATOM 0 HG LEU A 756 18.376 -0.280 -21.902 1.00 0.00 H new ATOM 0 HD11 LEU A 756 19.600 1.649 -20.989 1.00 0.00 H new ATOM 0 HD12 LEU A 756 20.409 0.111 -20.607 1.00 0.00 H new ATOM 0 HD13 LEU A 756 21.048 1.155 -21.898 1.00 0.00 H new ATOM 0 HD21 LEU A 756 18.295 1.892 -23.071 1.00 0.00 H new ATOM 0 HD22 LEU A 756 19.687 1.402 -24.066 1.00 0.00 H new ATOM 0 HD23 LEU A 756 18.143 0.528 -24.203 1.00 0.00 H new ATOM 626 N ARG A 757 18.344 -3.573 -21.934 1.00 0.00 N ATOM 627 CA ARG A 757 17.153 -4.119 -21.296 1.00 0.00 C ATOM 628 C ARG A 757 17.528 -4.948 -20.073 1.00 0.00 C ATOM 629 O ARG A 757 16.924 -4.798 -19.009 1.00 0.00 O ATOM 630 CB ARG A 757 16.339 -4.959 -22.283 1.00 0.00 C ATOM 631 CG ARG A 757 15.008 -4.324 -22.664 1.00 0.00 C ATOM 632 CD ARG A 757 15.194 -2.987 -23.372 1.00 0.00 C ATOM 633 NE ARG A 757 13.924 -2.276 -23.547 1.00 0.00 N ATOM 634 CZ ARG A 757 13.693 -1.381 -24.508 1.00 0.00 C ATOM 635 NH1 ARG A 757 14.637 -1.096 -25.401 1.00 0.00 N ATOM 636 NH2 ARG A 757 12.512 -0.776 -24.579 1.00 0.00 N ATOM 0 H ARG A 757 18.506 -3.904 -22.885 1.00 0.00 H new ATOM 0 HA ARG A 757 16.534 -3.283 -20.970 1.00 0.00 H new ATOM 0 HB2 ARG A 757 16.929 -5.118 -23.186 1.00 0.00 H new ATOM 0 HB3 ARG A 757 16.153 -5.940 -21.846 1.00 0.00 H new ATOM 0 HG2 ARG A 757 14.455 -5.003 -23.312 1.00 0.00 H new ATOM 0 HG3 ARG A 757 14.406 -4.178 -21.767 1.00 0.00 H new ATOM 0 HD2 ARG A 757 15.881 -2.365 -22.798 1.00 0.00 H new ATOM 0 HD3 ARG A 757 15.653 -3.154 -24.346 1.00 0.00 H new ATOM 0 HE ARG A 757 13.169 -2.479 -22.892 1.00 0.00 H new ATOM 0 HH11 ARG A 757 15.543 -1.563 -25.353 1.00 0.00 H new ATOM 0 HH12 ARG A 757 14.455 -0.411 -26.134 1.00 0.00 H new ATOM 0 HH21 ARG A 757 11.784 -0.997 -23.899 1.00 0.00 H new ATOM 0 HH22 ARG A 757 12.333 -0.091 -25.313 1.00 0.00 H new ATOM 650 N VAL A 758 18.538 -5.800 -20.219 1.00 0.00 N ATOM 651 CA VAL A 758 19.010 -6.618 -19.107 1.00 0.00 C ATOM 652 C VAL A 758 19.503 -5.739 -17.961 1.00 0.00 C ATOM 653 O VAL A 758 19.137 -5.961 -16.803 1.00 0.00 O ATOM 654 CB VAL A 758 20.144 -7.579 -19.530 1.00 0.00 C ATOM 655 CG1 VAL A 758 20.630 -8.390 -18.340 1.00 0.00 C ATOM 656 CG2 VAL A 758 19.679 -8.507 -20.639 1.00 0.00 C ATOM 0 H VAL A 758 19.044 -5.942 -21.093 1.00 0.00 H new ATOM 0 HA VAL A 758 18.160 -7.215 -18.777 1.00 0.00 H new ATOM 0 HB VAL A 758 20.972 -6.978 -19.906 1.00 0.00 H new ATOM 0 HG11 VAL A 758 21.428 -9.061 -18.658 1.00 0.00 H new ATOM 0 HG12 VAL A 758 21.007 -7.717 -17.570 1.00 0.00 H new ATOM 0 HG13 VAL A 758 19.804 -8.975 -17.937 1.00 0.00 H new ATOM 0 HG21 VAL A 758 20.494 -9.174 -20.921 1.00 0.00 H new ATOM 0 HG22 VAL A 758 18.832 -9.096 -20.289 1.00 0.00 H new ATOM 0 HG23 VAL A 758 19.378 -7.917 -21.505 1.00 0.00 H new ATOM 666 N HIS A 759 20.319 -4.736 -18.293 1.00 0.00 N ATOM 667 CA HIS A 759 20.833 -3.804 -17.291 1.00 0.00 C ATOM 668 C HIS A 759 19.681 -3.142 -16.549 1.00 0.00 C ATOM 669 O HIS A 759 19.633 -3.159 -15.322 1.00 0.00 O ATOM 670 CB HIS A 759 21.727 -2.723 -17.922 1.00 0.00 C ATOM 671 CG HIS A 759 23.031 -3.234 -18.465 1.00 0.00 C ATOM 672 ND1 HIS A 759 24.066 -3.589 -17.637 1.00 0.00 N ATOM 673 CD2 HIS A 759 23.418 -3.418 -19.747 1.00 0.00 C ATOM 674 CE1 HIS A 759 25.048 -3.976 -18.421 1.00 0.00 C ATOM 675 NE2 HIS A 759 24.704 -3.893 -19.713 1.00 0.00 N ATOM 0 H HIS A 759 20.636 -4.550 -19.244 1.00 0.00 H new ATOM 0 HA HIS A 759 21.440 -4.379 -16.592 1.00 0.00 H new ATOM 0 HB2 HIS A 759 21.176 -2.239 -18.729 1.00 0.00 H new ATOM 0 HB3 HIS A 759 21.934 -1.958 -17.174 1.00 0.00 H new ATOM 0 HD2 HIS A 759 22.827 -3.227 -20.630 1.00 0.00 H new ATOM 0 HE1 HIS A 759 26.010 -4.317 -18.068 1.00 0.00 H new ATOM 0 HE2 HIS A 759 25.285 -4.136 -20.515 1.00 0.00 H new ATOM 683 N GLN A 760 18.737 -2.585 -17.307 1.00 0.00 N ATOM 684 CA GLN A 760 17.570 -1.927 -16.731 1.00 0.00 C ATOM 685 C GLN A 760 16.813 -2.852 -15.780 1.00 0.00 C ATOM 686 O GLN A 760 16.467 -2.454 -14.664 1.00 0.00 O ATOM 687 CB GLN A 760 16.626 -1.446 -17.831 1.00 0.00 C ATOM 688 CG GLN A 760 17.096 -0.190 -18.545 1.00 0.00 C ATOM 689 CD GLN A 760 16.114 0.277 -19.601 1.00 0.00 C ATOM 690 OE1 GLN A 760 14.908 0.042 -19.495 1.00 0.00 O ATOM 691 NE2 GLN A 760 16.618 0.953 -20.618 1.00 0.00 N ATOM 0 H GLN A 760 18.760 -2.578 -18.327 1.00 0.00 H new ATOM 0 HA GLN A 760 17.932 -1.070 -16.162 1.00 0.00 H new ATOM 0 HB2 GLN A 760 16.503 -2.243 -18.564 1.00 0.00 H new ATOM 0 HB3 GLN A 760 15.644 -1.258 -17.396 1.00 0.00 H new ATOM 0 HG2 GLN A 760 17.245 0.605 -17.815 1.00 0.00 H new ATOM 0 HG3 GLN A 760 18.063 -0.381 -19.011 1.00 0.00 H new ATOM 0 HE21 GLN A 760 17.622 1.126 -20.668 1.00 0.00 H new ATOM 0 HE22 GLN A 760 16.003 1.302 -21.353 1.00 0.00 H new ATOM 700 N ILE A 761 16.562 -4.076 -16.225 1.00 0.00 N ATOM 701 CA ILE A 761 15.826 -5.051 -15.428 1.00 0.00 C ATOM 702 C ILE A 761 16.585 -5.403 -14.151 1.00 0.00 C ATOM 703 O ILE A 761 16.060 -5.246 -13.049 1.00 0.00 O ATOM 704 CB ILE A 761 15.531 -6.333 -16.238 1.00 0.00 C ATOM 705 CG1 ILE A 761 14.591 -6.005 -17.400 1.00 0.00 C ATOM 706 CG2 ILE A 761 14.923 -7.412 -15.350 1.00 0.00 C ATOM 707 CD1 ILE A 761 14.388 -7.153 -18.360 1.00 0.00 C ATOM 0 H ILE A 761 16.859 -4.420 -17.138 1.00 0.00 H new ATOM 0 HA ILE A 761 14.876 -4.592 -15.154 1.00 0.00 H new ATOM 0 HB ILE A 761 16.471 -6.717 -16.635 1.00 0.00 H new ATOM 0 HG12 ILE A 761 13.623 -5.703 -16.999 1.00 0.00 H new ATOM 0 HG13 ILE A 761 14.989 -5.151 -17.948 1.00 0.00 H new ATOM 0 HG21 ILE A 761 14.725 -8.304 -15.945 1.00 0.00 H new ATOM 0 HG22 ILE A 761 15.619 -7.658 -14.548 1.00 0.00 H new ATOM 0 HG23 ILE A 761 13.990 -7.047 -14.921 1.00 0.00 H new ATOM 0 HD11 ILE A 761 13.710 -6.846 -19.157 1.00 0.00 H new ATOM 0 HD12 ILE A 761 15.347 -7.441 -18.791 1.00 0.00 H new ATOM 0 HD13 ILE A 761 13.960 -8.002 -17.827 1.00 0.00 H new ATOM 719 N ALA A 762 17.831 -5.845 -14.296 1.00 0.00 N ATOM 720 CA ALA A 762 18.637 -6.254 -13.149 1.00 0.00 C ATOM 721 C ALA A 762 18.823 -5.095 -12.174 1.00 0.00 C ATOM 722 O ALA A 762 18.849 -5.288 -10.957 1.00 0.00 O ATOM 723 CB ALA A 762 19.986 -6.781 -13.611 1.00 0.00 C ATOM 0 H ALA A 762 18.305 -5.929 -15.195 1.00 0.00 H new ATOM 0 HA ALA A 762 18.109 -7.054 -12.629 1.00 0.00 H new ATOM 0 HB1 ALA A 762 20.575 -7.082 -12.745 1.00 0.00 H new ATOM 0 HB2 ALA A 762 19.836 -7.641 -14.264 1.00 0.00 H new ATOM 0 HB3 ALA A 762 20.515 -5.999 -14.156 1.00 0.00 H new ATOM 729 N GLU A 763 18.932 -3.895 -12.719 1.00 0.00 N ATOM 730 CA GLU A 763 19.101 -2.694 -11.917 1.00 0.00 C ATOM 731 C GLU A 763 17.851 -2.406 -11.085 1.00 0.00 C ATOM 732 O GLU A 763 17.950 -1.990 -9.930 1.00 0.00 O ATOM 733 CB GLU A 763 19.427 -1.514 -12.834 1.00 0.00 C ATOM 734 CG GLU A 763 19.802 -0.236 -12.111 1.00 0.00 C ATOM 735 CD GLU A 763 20.377 0.798 -13.057 1.00 0.00 C ATOM 736 OE1 GLU A 763 19.598 1.431 -13.803 1.00 0.00 O ATOM 737 OE2 GLU A 763 21.613 0.974 -13.071 1.00 0.00 O ATOM 0 H GLU A 763 18.906 -3.726 -13.725 1.00 0.00 H new ATOM 0 HA GLU A 763 19.926 -2.847 -11.222 1.00 0.00 H new ATOM 0 HB2 GLU A 763 20.249 -1.798 -13.491 1.00 0.00 H new ATOM 0 HB3 GLU A 763 18.564 -1.316 -13.470 1.00 0.00 H new ATOM 0 HG2 GLU A 763 18.921 0.174 -11.617 1.00 0.00 H new ATOM 0 HG3 GLU A 763 20.530 -0.460 -11.331 1.00 0.00 H new ATOM 744 N GLU A 764 16.679 -2.646 -11.659 1.00 0.00 N ATOM 745 CA GLU A 764 15.429 -2.422 -10.945 1.00 0.00 C ATOM 746 C GLU A 764 15.170 -3.554 -9.956 1.00 0.00 C ATOM 747 O GLU A 764 14.675 -3.321 -8.852 1.00 0.00 O ATOM 748 CB GLU A 764 14.259 -2.274 -11.920 1.00 0.00 C ATOM 749 CG GLU A 764 12.930 -2.013 -11.226 1.00 0.00 C ATOM 750 CD GLU A 764 11.878 -1.458 -12.161 1.00 0.00 C ATOM 751 OE1 GLU A 764 11.792 -0.217 -12.293 1.00 0.00 O ATOM 752 OE2 GLU A 764 11.122 -2.249 -12.755 1.00 0.00 O ATOM 0 H GLU A 764 16.568 -2.994 -12.611 1.00 0.00 H new ATOM 0 HA GLU A 764 15.518 -1.490 -10.387 1.00 0.00 H new ATOM 0 HB2 GLU A 764 14.469 -1.455 -12.608 1.00 0.00 H new ATOM 0 HB3 GLU A 764 14.177 -3.181 -12.519 1.00 0.00 H new ATOM 0 HG2 GLU A 764 12.566 -2.942 -10.788 1.00 0.00 H new ATOM 0 HG3 GLU A 764 13.086 -1.313 -10.405 1.00 0.00 H new ATOM 759 N HIS A 765 15.536 -4.771 -10.343 1.00 0.00 N ATOM 760 CA HIS A 765 15.416 -5.927 -9.455 1.00 0.00 C ATOM 761 C HIS A 765 16.346 -5.784 -8.255 1.00 0.00 C ATOM 762 O HIS A 765 16.121 -6.385 -7.204 1.00 0.00 O ATOM 763 CB HIS A 765 15.733 -7.225 -10.203 1.00 0.00 C ATOM 764 CG HIS A 765 14.609 -7.731 -11.061 1.00 0.00 C ATOM 765 ND1 HIS A 765 14.146 -9.027 -11.027 1.00 0.00 N ATOM 766 CD2 HIS A 765 13.865 -7.095 -12.002 1.00 0.00 C ATOM 767 CE1 HIS A 765 13.164 -9.139 -11.930 1.00 0.00 C ATOM 768 NE2 HIS A 765 12.954 -7.995 -12.548 1.00 0.00 N ATOM 0 H HIS A 765 15.918 -4.985 -11.264 1.00 0.00 H new ATOM 0 HA HIS A 765 14.386 -5.969 -9.101 1.00 0.00 H new ATOM 0 HB2 HIS A 765 16.610 -7.065 -10.830 1.00 0.00 H new ATOM 0 HB3 HIS A 765 15.996 -7.995 -9.477 1.00 0.00 H new ATOM 0 HD2 HIS A 765 13.964 -6.057 -12.282 1.00 0.00 H new ATOM 0 HE1 HIS A 765 12.616 -10.049 -12.126 1.00 0.00 H new ATOM 0 HE2 HIS A 765 12.266 -7.807 -13.277 1.00 0.00 H new ATOM 776 N GLY A 766 17.393 -4.989 -8.420 1.00 0.00 N ATOM 777 CA GLY A 766 18.316 -4.745 -7.334 1.00 0.00 C ATOM 778 C GLY A 766 19.437 -5.756 -7.303 1.00 0.00 C ATOM 779 O GLY A 766 19.887 -6.165 -6.231 1.00 0.00 O ATOM 0 H GLY A 766 17.619 -4.508 -9.290 1.00 0.00 H new ATOM 0 HA2 GLY A 766 18.734 -3.743 -7.433 1.00 0.00 H new ATOM 0 HA3 GLY A 766 17.777 -4.773 -6.387 1.00 0.00 H new ATOM 783 N LEU A 767 19.873 -6.174 -8.479 1.00 0.00 N ATOM 784 CA LEU A 767 20.985 -7.101 -8.599 1.00 0.00 C ATOM 785 C LEU A 767 22.154 -6.400 -9.270 1.00 0.00 C ATOM 786 O LEU A 767 22.041 -5.239 -9.666 1.00 0.00 O ATOM 787 CB LEU A 767 20.580 -8.331 -9.420 1.00 0.00 C ATOM 788 CG LEU A 767 19.352 -9.088 -8.915 1.00 0.00 C ATOM 789 CD1 LEU A 767 18.974 -10.188 -9.895 1.00 0.00 C ATOM 790 CD2 LEU A 767 19.609 -9.669 -7.531 1.00 0.00 C ATOM 0 H LEU A 767 19.470 -5.884 -9.370 1.00 0.00 H new ATOM 0 HA LEU A 767 21.275 -7.432 -7.602 1.00 0.00 H new ATOM 0 HB2 LEU A 767 20.393 -8.015 -10.446 1.00 0.00 H new ATOM 0 HB3 LEU A 767 21.424 -9.021 -9.448 1.00 0.00 H new ATOM 0 HG LEU A 767 18.520 -8.388 -8.839 1.00 0.00 H new ATOM 0 HD11 LEU A 767 18.098 -10.720 -9.524 1.00 0.00 H new ATOM 0 HD12 LEU A 767 18.747 -9.748 -10.866 1.00 0.00 H new ATOM 0 HD13 LEU A 767 19.805 -10.885 -9.998 1.00 0.00 H new ATOM 0 HD21 LEU A 767 18.722 -10.204 -7.190 1.00 0.00 H new ATOM 0 HD22 LEU A 767 20.453 -10.358 -7.576 1.00 0.00 H new ATOM 0 HD23 LEU A 767 19.836 -8.862 -6.834 1.00 0.00 H new ATOM 802 N ARG A 768 23.270 -7.094 -9.402 1.00 0.00 N ATOM 803 CA ARG A 768 24.429 -6.527 -10.058 1.00 0.00 C ATOM 804 C ARG A 768 24.438 -6.954 -11.517 1.00 0.00 C ATOM 805 O ARG A 768 24.039 -8.070 -11.845 1.00 0.00 O ATOM 806 CB ARG A 768 25.718 -6.981 -9.372 1.00 0.00 C ATOM 807 CG ARG A 768 26.857 -5.981 -9.503 1.00 0.00 C ATOM 808 CD ARG A 768 28.179 -6.573 -9.049 1.00 0.00 C ATOM 809 NE ARG A 768 28.772 -7.423 -10.077 1.00 0.00 N ATOM 810 CZ ARG A 768 29.608 -8.429 -9.839 1.00 0.00 C ATOM 811 NH1 ARG A 768 29.968 -8.725 -8.597 1.00 0.00 N ATOM 812 NH2 ARG A 768 30.097 -9.133 -10.853 1.00 0.00 N ATOM 0 H ARG A 768 23.396 -8.048 -9.064 1.00 0.00 H new ATOM 0 HA ARG A 768 24.375 -5.440 -9.993 1.00 0.00 H new ATOM 0 HB2 ARG A 768 25.517 -7.154 -8.315 1.00 0.00 H new ATOM 0 HB3 ARG A 768 26.031 -7.935 -9.798 1.00 0.00 H new ATOM 0 HG2 ARG A 768 26.940 -5.658 -10.541 1.00 0.00 H new ATOM 0 HG3 ARG A 768 26.633 -5.094 -8.910 1.00 0.00 H new ATOM 0 HD2 ARG A 768 28.871 -5.769 -8.798 1.00 0.00 H new ATOM 0 HD3 ARG A 768 28.024 -7.155 -8.140 1.00 0.00 H new ATOM 0 HE ARG A 768 28.527 -7.231 -11.048 1.00 0.00 H new ATOM 0 HH11 ARG A 768 29.603 -8.179 -7.816 1.00 0.00 H new ATOM 0 HH12 ARG A 768 30.610 -9.498 -8.423 1.00 0.00 H new ATOM 0 HH21 ARG A 768 29.831 -8.901 -11.810 1.00 0.00 H new ATOM 0 HH22 ARG A 768 30.739 -9.906 -10.675 1.00 0.00 H new ATOM 826 N HIS A 769 24.877 -6.069 -12.387 1.00 0.00 N ATOM 827 CA HIS A 769 24.897 -6.350 -13.815 1.00 0.00 C ATOM 828 C HIS A 769 26.165 -5.796 -14.443 1.00 0.00 C ATOM 829 O HIS A 769 26.456 -4.605 -14.342 1.00 0.00 O ATOM 830 CB HIS A 769 23.646 -5.785 -14.503 1.00 0.00 C ATOM 831 CG HIS A 769 23.257 -4.404 -14.059 1.00 0.00 C ATOM 832 ND1 HIS A 769 23.472 -3.309 -14.851 1.00 0.00 N ATOM 833 CD2 HIS A 769 22.657 -4.004 -12.911 1.00 0.00 C ATOM 834 CE1 HIS A 769 23.000 -2.278 -14.186 1.00 0.00 C ATOM 835 NE2 HIS A 769 22.497 -2.645 -13.000 1.00 0.00 N ATOM 0 H HIS A 769 25.227 -5.145 -12.134 1.00 0.00 H new ATOM 0 HA HIS A 769 24.890 -7.431 -13.955 1.00 0.00 H new ATOM 0 HB2 HIS A 769 23.814 -5.772 -15.580 1.00 0.00 H new ATOM 0 HB3 HIS A 769 22.810 -6.460 -14.319 1.00 0.00 H new ATOM 0 HD1 HIS A 769 23.910 -3.296 -15.772 1.00 0.00 H new ATOM 0 HD2 HIS A 769 22.362 -4.634 -12.085 1.00 0.00 H new ATOM 0 HE1 HIS A 769 23.016 -1.261 -14.551 1.00 0.00 H new ATOM 843 N ASP A 770 26.926 -6.675 -15.074 1.00 0.00 N ATOM 844 CA ASP A 770 28.224 -6.307 -15.630 1.00 0.00 C ATOM 845 C ASP A 770 28.390 -6.861 -17.023 1.00 0.00 C ATOM 846 O ASP A 770 27.768 -7.852 -17.392 1.00 0.00 O ATOM 847 CB ASP A 770 29.365 -6.843 -14.758 1.00 0.00 C ATOM 848 CG ASP A 770 29.413 -6.228 -13.377 1.00 0.00 C ATOM 849 OD1 ASP A 770 28.629 -6.656 -12.508 1.00 0.00 O ATOM 850 OD2 ASP A 770 30.259 -5.337 -13.144 1.00 0.00 O ATOM 0 H ASP A 770 26.669 -7.652 -15.216 1.00 0.00 H new ATOM 0 HA ASP A 770 28.263 -5.218 -15.660 1.00 0.00 H new ATOM 0 HB2 ASP A 770 29.260 -7.924 -14.662 1.00 0.00 H new ATOM 0 HB3 ASP A 770 30.314 -6.658 -15.262 1.00 0.00 H new ATOM 855 N SER A 771 29.233 -6.212 -17.793 1.00 0.00 N ATOM 856 CA SER A 771 29.617 -6.721 -19.085 1.00 0.00 C ATOM 857 C SER A 771 31.121 -6.914 -19.103 1.00 0.00 C ATOM 858 O SER A 771 31.878 -6.014 -18.740 1.00 0.00 O ATOM 859 CB SER A 771 29.181 -5.767 -20.185 1.00 0.00 C ATOM 860 OG SER A 771 27.823 -5.389 -20.019 1.00 0.00 O ATOM 0 H SER A 771 29.668 -5.324 -17.542 1.00 0.00 H new ATOM 0 HA SER A 771 29.126 -7.677 -19.266 1.00 0.00 H new ATOM 0 HB2 SER A 771 29.814 -4.879 -20.174 1.00 0.00 H new ATOM 0 HB3 SER A 771 29.314 -6.241 -21.157 1.00 0.00 H new ATOM 0 HG SER A 771 27.483 -5.014 -20.858 1.00 0.00 H new ATOM 866 N SER A 772 31.541 -8.087 -19.515 1.00 0.00 N ATOM 867 CA SER A 772 32.932 -8.475 -19.404 1.00 0.00 C ATOM 868 C SER A 772 33.275 -9.505 -20.472 1.00 0.00 C ATOM 869 O SER A 772 32.406 -9.932 -21.233 1.00 0.00 O ATOM 870 CB SER A 772 33.197 -9.040 -18.002 1.00 0.00 C ATOM 871 OG SER A 772 34.582 -9.228 -17.766 1.00 0.00 O ATOM 0 H SER A 772 30.937 -8.795 -19.933 1.00 0.00 H new ATOM 0 HA SER A 772 33.565 -7.601 -19.557 1.00 0.00 H new ATOM 0 HB2 SER A 772 32.789 -8.361 -17.253 1.00 0.00 H new ATOM 0 HB3 SER A 772 32.676 -9.991 -17.888 1.00 0.00 H new ATOM 0 HG SER A 772 34.714 -9.587 -16.864 1.00 0.00 H new ATOM 877 N GLY A 773 34.536 -9.892 -20.522 1.00 0.00 N ATOM 878 CA GLY A 773 34.975 -10.858 -21.497 1.00 0.00 C ATOM 879 C GLY A 773 36.022 -10.280 -22.419 1.00 0.00 C ATOM 880 O GLY A 773 36.222 -9.063 -22.454 1.00 0.00 O ATOM 0 H GLY A 773 35.268 -9.551 -19.899 1.00 0.00 H new ATOM 0 HA2 GLY A 773 35.381 -11.732 -20.987 1.00 0.00 H new ATOM 0 HA3 GLY A 773 34.121 -11.198 -22.083 1.00 0.00 H new ATOM 884 N GLU A 774 36.701 -11.146 -23.150 1.00 0.00 N ATOM 885 CA GLU A 774 37.717 -10.716 -24.098 1.00 0.00 C ATOM 886 C GLU A 774 37.077 -10.022 -25.296 1.00 0.00 C ATOM 887 O GLU A 774 35.856 -9.922 -25.383 1.00 0.00 O ATOM 888 CB GLU A 774 38.541 -11.915 -24.566 1.00 0.00 C ATOM 889 CG GLU A 774 39.202 -12.679 -23.430 1.00 0.00 C ATOM 890 CD GLU A 774 40.158 -11.821 -22.630 1.00 0.00 C ATOM 891 OE1 GLU A 774 41.229 -11.461 -23.165 1.00 0.00 O ATOM 892 OE2 GLU A 774 39.850 -11.513 -21.462 1.00 0.00 O ATOM 0 H GLU A 774 36.567 -12.156 -23.106 1.00 0.00 H new ATOM 0 HA GLU A 774 38.375 -10.005 -23.598 1.00 0.00 H new ATOM 0 HB2 GLU A 774 37.895 -12.594 -25.122 1.00 0.00 H new ATOM 0 HB3 GLU A 774 39.310 -11.569 -25.257 1.00 0.00 H new ATOM 0 HG2 GLU A 774 38.432 -13.074 -22.767 1.00 0.00 H new ATOM 0 HG3 GLU A 774 39.741 -13.534 -23.838 1.00 0.00 H new ATOM 899 N GLY A 775 37.901 -9.559 -26.225 1.00 0.00 N ATOM 900 CA GLY A 775 37.389 -8.890 -27.409 1.00 0.00 C ATOM 901 C GLY A 775 36.432 -9.766 -28.199 1.00 0.00 C ATOM 902 O GLY A 775 35.454 -9.281 -28.767 1.00 0.00 O ATOM 0 H GLY A 775 38.917 -9.634 -26.182 1.00 0.00 H new ATOM 0 HA2 GLY A 775 36.879 -7.973 -27.113 1.00 0.00 H new ATOM 0 HA3 GLY A 775 38.223 -8.599 -28.048 1.00 0.00 H new ATOM 906 N LYS A 776 36.716 -11.063 -28.229 1.00 0.00 N ATOM 907 CA LYS A 776 35.858 -12.021 -28.920 1.00 0.00 C ATOM 908 C LYS A 776 34.991 -12.792 -27.925 1.00 0.00 C ATOM 909 O LYS A 776 34.359 -13.789 -28.278 1.00 0.00 O ATOM 910 CB LYS A 776 36.711 -13.001 -29.737 1.00 0.00 C ATOM 911 CG LYS A 776 37.663 -13.838 -28.894 1.00 0.00 C ATOM 912 CD LYS A 776 38.505 -14.764 -29.755 1.00 0.00 C ATOM 913 CE LYS A 776 39.428 -15.634 -28.913 1.00 0.00 C ATOM 914 NZ LYS A 776 40.416 -14.829 -28.150 1.00 0.00 N ATOM 0 H LYS A 776 37.535 -11.477 -27.783 1.00 0.00 H new ATOM 0 HA LYS A 776 35.203 -11.468 -29.593 1.00 0.00 H new ATOM 0 HB2 LYS A 776 36.051 -13.667 -30.292 1.00 0.00 H new ATOM 0 HB3 LYS A 776 37.289 -12.440 -30.472 1.00 0.00 H new ATOM 0 HG2 LYS A 776 38.316 -13.180 -28.320 1.00 0.00 H new ATOM 0 HG3 LYS A 776 37.092 -14.427 -28.176 1.00 0.00 H new ATOM 0 HD2 LYS A 776 37.851 -15.399 -30.352 1.00 0.00 H new ATOM 0 HD3 LYS A 776 39.099 -14.173 -30.452 1.00 0.00 H new ATOM 0 HE2 LYS A 776 38.832 -16.228 -28.219 1.00 0.00 H new ATOM 0 HE3 LYS A 776 39.955 -16.334 -29.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 776 41.117 -15.462 -27.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 776 40.898 -14.170 -28.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 776 39.926 -14.291 -27.407 1.00 0.00 H new ATOM 928 N ARG A 777 34.956 -12.327 -26.684 1.00 0.00 N ATOM 929 CA ARG A 777 34.236 -13.024 -25.624 1.00 0.00 C ATOM 930 C ARG A 777 33.449 -12.048 -24.757 1.00 0.00 C ATOM 931 O ARG A 777 33.081 -12.368 -23.634 1.00 0.00 O ATOM 932 CB ARG A 777 35.214 -13.799 -24.749 1.00 0.00 C ATOM 933 CG ARG A 777 35.831 -14.999 -25.438 1.00 0.00 C ATOM 934 CD ARG A 777 34.822 -16.112 -25.645 1.00 0.00 C ATOM 935 NE ARG A 777 34.352 -16.671 -24.378 1.00 0.00 N ATOM 936 CZ ARG A 777 33.698 -17.827 -24.272 1.00 0.00 C ATOM 937 NH1 ARG A 777 33.457 -18.560 -25.349 1.00 0.00 N ATOM 938 NH2 ARG A 777 33.296 -18.251 -23.082 1.00 0.00 N ATOM 0 H ARG A 777 35.418 -11.468 -26.385 1.00 0.00 H new ATOM 0 HA ARG A 777 33.536 -13.714 -26.095 1.00 0.00 H new ATOM 0 HB2 ARG A 777 36.010 -13.128 -24.427 1.00 0.00 H new ATOM 0 HB3 ARG A 777 34.696 -14.134 -23.850 1.00 0.00 H new ATOM 0 HG2 ARG A 777 36.239 -14.694 -26.402 1.00 0.00 H new ATOM 0 HG3 ARG A 777 36.665 -15.371 -24.842 1.00 0.00 H new ATOM 0 HD2 ARG A 777 33.972 -15.729 -26.210 1.00 0.00 H new ATOM 0 HD3 ARG A 777 35.273 -16.903 -26.245 1.00 0.00 H new ATOM 0 HE ARG A 777 34.536 -16.144 -23.524 1.00 0.00 H new ATOM 0 HH11 ARG A 777 33.773 -18.240 -26.265 1.00 0.00 H new ATOM 0 HH12 ARG A 777 32.956 -19.444 -25.262 1.00 0.00 H new ATOM 0 HH21 ARG A 777 33.488 -17.693 -22.250 1.00 0.00 H new ATOM 0 HH22 ARG A 777 32.795 -19.136 -22.998 1.00 0.00 H new ATOM 952 N ARG A 778 33.199 -10.857 -25.278 1.00 0.00 N ATOM 953 CA ARG A 778 32.499 -9.830 -24.517 1.00 0.00 C ATOM 954 C ARG A 778 31.002 -10.115 -24.434 1.00 0.00 C ATOM 955 O ARG A 778 30.282 -10.056 -25.431 1.00 0.00 O ATOM 956 CB ARG A 778 32.728 -8.451 -25.127 1.00 0.00 C ATOM 957 CG ARG A 778 32.116 -7.325 -24.312 1.00 0.00 C ATOM 958 CD ARG A 778 32.260 -5.992 -25.019 1.00 0.00 C ATOM 959 NE ARG A 778 31.657 -4.896 -24.257 1.00 0.00 N ATOM 960 CZ ARG A 778 31.007 -3.870 -24.811 1.00 0.00 C ATOM 961 NH1 ARG A 778 30.907 -3.773 -26.130 1.00 0.00 N ATOM 962 NH2 ARG A 778 30.479 -2.929 -24.044 1.00 0.00 N ATOM 0 H ARG A 778 33.469 -10.577 -26.221 1.00 0.00 H new ATOM 0 HA ARG A 778 32.907 -9.845 -23.506 1.00 0.00 H new ATOM 0 HB2 ARG A 778 33.800 -8.278 -25.225 1.00 0.00 H new ATOM 0 HB3 ARG A 778 32.308 -8.432 -26.133 1.00 0.00 H new ATOM 0 HG2 ARG A 778 31.061 -7.533 -24.135 1.00 0.00 H new ATOM 0 HG3 ARG A 778 32.599 -7.275 -23.336 1.00 0.00 H new ATOM 0 HD2 ARG A 778 33.317 -5.781 -25.182 1.00 0.00 H new ATOM 0 HD3 ARG A 778 31.791 -6.051 -26.001 1.00 0.00 H new ATOM 0 HE ARG A 778 31.739 -4.918 -23.241 1.00 0.00 H new ATOM 0 HH11 ARG A 778 31.328 -4.485 -26.727 1.00 0.00 H new ATOM 0 HH12 ARG A 778 30.409 -2.987 -26.547 1.00 0.00 H new ATOM 0 HH21 ARG A 778 30.569 -2.988 -23.030 1.00 0.00 H new ATOM 0 HH22 ARG A 778 29.982 -2.145 -24.467 1.00 0.00 H new ATOM 976 N PHE A 779 30.548 -10.386 -23.228 1.00 0.00 N ATOM 977 CA PHE A 779 29.146 -10.689 -22.971 1.00 0.00 C ATOM 978 C PHE A 779 28.665 -9.927 -21.740 1.00 0.00 C ATOM 979 O PHE A 779 29.333 -8.999 -21.276 1.00 0.00 O ATOM 980 CB PHE A 779 28.937 -12.205 -22.794 1.00 0.00 C ATOM 981 CG PHE A 779 29.855 -12.861 -21.790 1.00 0.00 C ATOM 982 CD1 PHE A 779 29.693 -12.659 -20.426 1.00 0.00 C ATOM 983 CD2 PHE A 779 30.879 -13.690 -22.217 1.00 0.00 C ATOM 984 CE1 PHE A 779 30.538 -13.266 -19.515 1.00 0.00 C ATOM 985 CE2 PHE A 779 31.726 -14.298 -21.311 1.00 0.00 C ATOM 986 CZ PHE A 779 31.556 -14.086 -19.959 1.00 0.00 C ATOM 0 H PHE A 779 31.136 -10.404 -22.395 1.00 0.00 H new ATOM 0 HA PHE A 779 28.557 -10.370 -23.831 1.00 0.00 H new ATOM 0 HB2 PHE A 779 27.905 -12.382 -22.491 1.00 0.00 H new ATOM 0 HB3 PHE A 779 29.073 -12.691 -23.760 1.00 0.00 H new ATOM 0 HD1 PHE A 779 28.897 -12.020 -20.072 1.00 0.00 H new ATOM 0 HD2 PHE A 779 31.017 -13.864 -23.274 1.00 0.00 H new ATOM 0 HE1 PHE A 779 30.402 -13.099 -18.457 1.00 0.00 H new ATOM 0 HE2 PHE A 779 32.521 -14.939 -21.661 1.00 0.00 H new ATOM 0 HZ PHE A 779 32.218 -14.560 -19.249 1.00 0.00 H new ATOM 996 N ILE A 780 27.503 -10.300 -21.227 1.00 0.00 N ATOM 997 CA ILE A 780 26.966 -9.676 -20.028 1.00 0.00 C ATOM 998 C ILE A 780 26.629 -10.738 -18.985 1.00 0.00 C ATOM 999 O ILE A 780 26.140 -11.817 -19.317 1.00 0.00 O ATOM 1000 CB ILE A 780 25.719 -8.811 -20.336 1.00 0.00 C ATOM 1001 CG1 ILE A 780 25.121 -8.249 -19.040 1.00 0.00 C ATOM 1002 CG2 ILE A 780 24.680 -9.607 -21.110 1.00 0.00 C ATOM 1003 CD1 ILE A 780 23.869 -7.421 -19.242 1.00 0.00 C ATOM 0 H ILE A 780 26.913 -11.032 -21.623 1.00 0.00 H new ATOM 0 HA ILE A 780 27.735 -9.013 -19.630 1.00 0.00 H new ATOM 0 HB ILE A 780 26.032 -7.975 -20.961 1.00 0.00 H new ATOM 0 HG12 ILE A 780 24.891 -9.077 -18.370 1.00 0.00 H new ATOM 0 HG13 ILE A 780 25.872 -7.636 -18.542 1.00 0.00 H new ATOM 0 HG21 ILE A 780 23.815 -8.976 -21.313 1.00 0.00 H new ATOM 0 HG22 ILE A 780 25.110 -9.947 -22.052 1.00 0.00 H new ATOM 0 HG23 ILE A 780 24.369 -10.470 -20.521 1.00 0.00 H new ATOM 0 HD11 ILE A 780 23.511 -7.062 -18.277 1.00 0.00 H new ATOM 0 HD12 ILE A 780 24.095 -6.570 -19.885 1.00 0.00 H new ATOM 0 HD13 ILE A 780 23.099 -8.034 -19.710 1.00 0.00 H new ATOM 1015 N THR A 781 26.917 -10.434 -17.731 1.00 0.00 N ATOM 1016 CA THR A 781 26.670 -11.357 -16.642 1.00 0.00 C ATOM 1017 C THR A 781 25.873 -10.680 -15.534 1.00 0.00 C ATOM 1018 O THR A 781 26.322 -9.696 -14.941 1.00 0.00 O ATOM 1019 CB THR A 781 27.996 -11.885 -16.063 1.00 0.00 C ATOM 1020 OG1 THR A 781 28.815 -12.393 -17.122 1.00 0.00 O ATOM 1021 CG2 THR A 781 27.750 -12.983 -15.037 1.00 0.00 C ATOM 0 H THR A 781 27.326 -9.545 -17.442 1.00 0.00 H new ATOM 0 HA THR A 781 26.095 -12.193 -17.040 1.00 0.00 H new ATOM 0 HB THR A 781 28.504 -11.059 -15.565 1.00 0.00 H new ATOM 0 HG1 THR A 781 29.382 -13.116 -16.780 1.00 0.00 H new ATOM 0 HG21 THR A 781 28.704 -13.336 -14.646 1.00 0.00 H new ATOM 0 HG22 THR A 781 27.146 -12.589 -14.220 1.00 0.00 H new ATOM 0 HG23 THR A 781 27.223 -13.812 -15.510 1.00 0.00 H new ATOM 1029 N VAL A 782 24.684 -11.196 -15.275 1.00 0.00 N ATOM 1030 CA VAL A 782 23.869 -10.718 -14.170 1.00 0.00 C ATOM 1031 C VAL A 782 24.262 -11.470 -12.911 1.00 0.00 C ATOM 1032 O VAL A 782 24.309 -12.694 -12.914 1.00 0.00 O ATOM 1033 CB VAL A 782 22.366 -10.913 -14.451 1.00 0.00 C ATOM 1034 CG1 VAL A 782 21.519 -10.357 -13.320 1.00 0.00 C ATOM 1035 CG2 VAL A 782 21.986 -10.263 -15.763 1.00 0.00 C ATOM 0 H VAL A 782 24.260 -11.949 -15.817 1.00 0.00 H new ATOM 0 HA VAL A 782 24.044 -9.650 -14.043 1.00 0.00 H new ATOM 0 HB VAL A 782 22.173 -11.984 -14.520 1.00 0.00 H new ATOM 0 HG11 VAL A 782 20.464 -10.509 -13.547 1.00 0.00 H new ATOM 0 HG12 VAL A 782 21.768 -10.871 -12.392 1.00 0.00 H new ATOM 0 HG13 VAL A 782 21.716 -9.291 -13.208 1.00 0.00 H new ATOM 0 HG21 VAL A 782 20.922 -10.410 -15.947 1.00 0.00 H new ATOM 0 HG22 VAL A 782 22.203 -9.196 -15.716 1.00 0.00 H new ATOM 0 HG23 VAL A 782 22.560 -10.715 -16.572 1.00 0.00 H new ATOM 1045 N SER A 783 24.563 -10.748 -11.849 1.00 0.00 N ATOM 1046 CA SER A 783 25.079 -11.372 -10.647 1.00 0.00 C ATOM 1047 C SER A 783 24.287 -10.969 -9.407 1.00 0.00 C ATOM 1048 O SER A 783 23.887 -9.817 -9.250 1.00 0.00 O ATOM 1049 CB SER A 783 26.554 -11.008 -10.469 1.00 0.00 C ATOM 1050 OG SER A 783 27.310 -11.359 -11.617 1.00 0.00 O ATOM 0 H SER A 783 24.460 -9.735 -11.794 1.00 0.00 H new ATOM 0 HA SER A 783 24.976 -12.451 -10.762 1.00 0.00 H new ATOM 0 HB2 SER A 783 26.647 -9.938 -10.282 1.00 0.00 H new ATOM 0 HB3 SER A 783 26.955 -11.521 -9.595 1.00 0.00 H new ATOM 0 HG SER A 783 28.249 -11.114 -11.478 1.00 0.00 H new ATOM 1056 N LYS A 784 24.059 -11.943 -8.537 1.00 0.00 N ATOM 1057 CA LYS A 784 23.466 -11.691 -7.231 1.00 0.00 C ATOM 1058 C LYS A 784 24.561 -11.298 -6.256 1.00 0.00 C ATOM 1059 O LYS A 784 24.307 -10.835 -5.143 1.00 0.00 O ATOM 1060 CB LYS A 784 22.737 -12.940 -6.737 1.00 0.00 C ATOM 1061 CG LYS A 784 21.508 -13.272 -7.565 1.00 0.00 C ATOM 1062 CD LYS A 784 20.829 -14.570 -7.137 1.00 0.00 C ATOM 1063 CE LYS A 784 20.222 -14.486 -5.743 1.00 0.00 C ATOM 1064 NZ LYS A 784 21.204 -14.820 -4.675 1.00 0.00 N ATOM 0 H LYS A 784 24.278 -12.923 -8.714 1.00 0.00 H new ATOM 0 HA LYS A 784 22.743 -10.879 -7.307 1.00 0.00 H new ATOM 0 HB2 LYS A 784 23.423 -13.787 -6.758 1.00 0.00 H new ATOM 0 HB3 LYS A 784 22.441 -12.795 -5.698 1.00 0.00 H new ATOM 0 HG2 LYS A 784 20.793 -12.453 -7.488 1.00 0.00 H new ATOM 0 HG3 LYS A 784 21.794 -13.348 -8.614 1.00 0.00 H new ATOM 0 HD2 LYS A 784 20.047 -14.820 -7.854 1.00 0.00 H new ATOM 0 HD3 LYS A 784 21.557 -15.381 -7.163 1.00 0.00 H new ATOM 0 HE2 LYS A 784 19.837 -13.480 -5.577 1.00 0.00 H new ATOM 0 HE3 LYS A 784 19.373 -15.166 -5.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 784 20.855 -15.630 -4.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 784 22.118 -15.063 -5.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 784 21.326 -14.000 -4.047 1.00 0.00 H new ATOM 1078 N ARG A 785 25.782 -11.526 -6.697 1.00 0.00 N ATOM 1079 CA ARG A 785 26.974 -11.126 -5.967 1.00 0.00 C ATOM 1080 C ARG A 785 27.214 -9.627 -6.109 1.00 0.00 C ATOM 1081 O ARG A 785 27.038 -9.067 -7.189 1.00 0.00 O ATOM 1082 CB ARG A 785 28.190 -11.890 -6.493 1.00 0.00 C ATOM 1083 CG ARG A 785 28.310 -13.305 -5.956 1.00 0.00 C ATOM 1084 CD ARG A 785 28.623 -13.302 -4.471 1.00 0.00 C ATOM 1085 NE ARG A 785 29.765 -12.442 -4.163 1.00 0.00 N ATOM 1086 CZ ARG A 785 30.236 -12.230 -2.938 1.00 0.00 C ATOM 1087 NH1 ARG A 785 29.706 -12.860 -1.898 1.00 0.00 N ATOM 1088 NH2 ARG A 785 31.247 -11.390 -2.761 1.00 0.00 N ATOM 0 H ARG A 785 25.979 -11.998 -7.579 1.00 0.00 H new ATOM 0 HA ARG A 785 26.825 -11.360 -4.913 1.00 0.00 H new ATOM 0 HB2 ARG A 785 28.139 -11.928 -7.581 1.00 0.00 H new ATOM 0 HB3 ARG A 785 29.093 -11.337 -6.235 1.00 0.00 H new ATOM 0 HG2 ARG A 785 27.380 -13.845 -6.133 1.00 0.00 H new ATOM 0 HG3 ARG A 785 29.094 -13.836 -6.495 1.00 0.00 H new ATOM 0 HD2 ARG A 785 27.750 -12.961 -3.915 1.00 0.00 H new ATOM 0 HD3 ARG A 785 28.833 -14.319 -4.141 1.00 0.00 H new ATOM 0 HE ARG A 785 30.231 -11.974 -4.940 1.00 0.00 H new ATOM 0 HH11 ARG A 785 28.933 -13.511 -2.036 1.00 0.00 H new ATOM 0 HH12 ARG A 785 30.071 -12.693 -0.960 1.00 0.00 H new ATOM 0 HH21 ARG A 785 31.658 -10.911 -3.562 1.00 0.00 H new ATOM 0 HH22 ARG A 785 31.613 -11.223 -1.824 1.00 0.00 H new ATOM 1102 N ALA A 786 27.616 -8.989 -5.020 1.00 0.00 N ATOM 1103 CA ALA A 786 27.922 -7.567 -5.042 1.00 0.00 C ATOM 1104 C ALA A 786 29.415 -7.348 -5.252 1.00 0.00 C ATOM 1105 O ALA A 786 30.167 -7.353 -4.258 1.00 0.00 O ATOM 1106 CB ALA A 786 27.456 -6.902 -3.753 1.00 0.00 C ATOM 0 H ALA A 786 27.738 -9.434 -4.110 1.00 0.00 H new ATOM 0 HA ALA A 786 27.388 -7.110 -5.875 1.00 0.00 H new ATOM 0 HB1 ALA A 786 27.693 -5.839 -3.786 1.00 0.00 H new ATOM 0 HB2 ALA A 786 26.379 -7.031 -3.646 1.00 0.00 H new ATOM 0 HB3 ALA A 786 27.963 -7.360 -2.904 1.00 0.00 H new TER 1112 ALA A 786 HETATM 1113 P DGP A 801 26.998 -2.542 -21.751 1.00 0.00 P HETATM 1114 OP1 DGP A 801 26.453 -3.900 -22.029 1.00 0.00 O HETATM 1115 OP2 DGP A 801 28.252 -2.108 -22.419 1.00 0.00 O HETATM 1116 OP3 DGP A 801 27.184 -2.386 -20.178 1.00 0.00 O HETATM 1117 O5' DGP A 801 25.860 -1.477 -22.083 1.00 0.00 O HETATM 1118 C5' DGP A 801 24.799 -1.800 -22.977 1.00 0.00 C HETATM 1119 C4' DGP A 801 23.616 -0.889 -22.745 1.00 0.00 C HETATM 1120 O4' DGP A 801 23.298 -0.883 -21.333 1.00 0.00 O HETATM 1121 C3' DGP A 801 23.846 0.569 -23.137 1.00 0.00 C HETATM 1122 O3' DGP A 801 22.662 1.134 -23.707 1.00 0.00 O HETATM 1123 C2' DGP A 801 24.196 1.247 -21.824 1.00 0.00 C HETATM 1124 C1' DGP A 801 23.461 0.415 -20.784 1.00 0.00 C HETATM 1125 N9 DGP A 801 24.174 0.272 -19.520 1.00 0.00 N HETATM 1126 C8 DGP A 801 25.490 -0.084 -19.353 1.00 0.00 C HETATM 1127 N7 DGP A 801 25.857 -0.137 -18.104 1.00 0.00 N HETATM 1128 C5 DGP A 801 24.715 0.206 -17.396 1.00 0.00 C HETATM 1129 C6 DGP A 801 24.504 0.319 -15.999 1.00 0.00 C HETATM 1130 O6 DGP A 801 25.316 0.132 -15.084 1.00 0.00 O HETATM 1131 N1 DGP A 801 23.198 0.693 -15.698 1.00 0.00 N HETATM 1132 C2 DGP A 801 22.221 0.926 -16.636 1.00 0.00 C HETATM 1133 N2 DGP A 801 21.023 1.271 -16.149 1.00 0.00 N HETATM 1134 N3 DGP A 801 22.402 0.825 -17.946 1.00 0.00 N HETATM 1135 C4 DGP A 801 23.664 0.463 -18.254 1.00 0.00 C HETATM 0 HO3' DGP A 801 22.830 2.069 -23.950 1.00 0.00 H new HETATM 0 HN22 DGP A 801 20.249 1.460 -16.786 1.00 0.00 H new HETATM 0 HN21 DGP A 801 20.884 1.345 -15.141 1.00 0.00 H new HETATM 0 H5'' DGP A 801 25.142 -1.705 -24.007 1.00 0.00 H new HETATM 0 H2'' DGP A 801 25.272 1.249 -21.648 1.00 0.00 H new HETATM 0 HN1 DGP A 801 22.949 0.802 -14.715 1.00 0.00 H new HETATM 0 H8 DGP A 801 26.161 -0.301 -20.184 1.00 0.00 H new HETATM 0 H5' DGP A 801 24.499 -2.838 -22.835 1.00 0.00 H new HETATM 0 H4' DGP A 801 22.820 -1.286 -23.375 1.00 0.00 H new HETATM 0 H3' DGP A 801 24.625 0.687 -23.890 1.00 0.00 H new HETATM 0 H2' DGP A 801 23.869 2.287 -21.810 1.00 0.00 H new HETATM 0 H1' DGP A 801 22.524 0.925 -20.561 1.00 0.00 H new