USER MOD reduce.3.24.130724 H: found=0, std=0, add=566, rem=0, adj=16 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 737 MET CE :methyl 174:sc= -0.711 (180deg=-0.857) USER MOD Set 1.2: A 765 HIS : no HD1:sc= -1.05 K(o=-1.8,f=-2.6) USER MOD Set 2.1: A 759 HIS : no HD1:sc= -1.89 K(o=-0.97,f=-10!) USER MOD Set 2.2: A 769 HIS : no HE2:sc= 0.889 K(o=-0.97,f=-11!) USER MOD Set 2.3: A 771 SER OG : rot -160:sc= 0.0324 USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 723 GLN : amide:sc= -0.0803 K(o=-0.08,f=-0.95) USER MOD Single : A 728 HIS : no HD1:sc= -0.0583 X(o=-0.058,f=0.0052) USER MOD Single : A 732 MET CE :methyl 176:sc= -0.0532 (180deg=-0.0805) USER MOD Single : A 739 SER OG : rot 62:sc= 1.27 USER MOD Single : A 740 LYS NZ :NH3+ -160:sc= -1.75! (180deg=-2.96!) USER MOD Single : A 741 LYS NZ :NH3+ 165:sc= -0.0114 (180deg=-0.17) USER MOD Single : A 742 MET CE :methyl -166:sc= -0.0375 (180deg=-0.356) USER MOD Single : A 743 GLN : amide:sc= -0.577 K(o=-0.58,f=0) USER MOD Single : A 749 SER OG : rot 180:sc= 0 USER MOD Single : A 751 ASN : amide:sc= -0.172 X(o=-0.17,f=-0.57) USER MOD Single : A 752 SER OG : rot 180:sc= 0.0102 USER MOD Single : A 753 HIS : no HD1:sc= -0.0126 X(o=-0.013,f=0) USER MOD Single : A 760 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 772 SER OG : rot 180:sc= 0 USER MOD Single : A 776 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 781 THR OG1 : rot 180:sc= 0 USER MOD Single : A 783 SER OG : rot 180:sc= 0 USER MOD Single : A 784 LYS NZ :NH3+ -168:sc= 0.804 (180deg=0.764) USER MOD Single : A 801 DGP O3' : rot 180:sc= -0.187 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 717 7.794 5.691 -11.395 1.00 0.00 N ATOM 2 CA PRO A 717 7.031 4.678 -12.149 1.00 0.00 C ATOM 3 C PRO A 717 6.735 5.176 -13.557 1.00 0.00 C ATOM 4 O PRO A 717 6.375 6.338 -13.748 1.00 0.00 O ATOM 5 CB PRO A 717 5.732 4.393 -11.407 1.00 0.00 C ATOM 6 CG PRO A 717 5.772 5.326 -10.245 1.00 0.00 C ATOM 7 CD PRO A 717 7.226 5.690 -10.041 1.00 0.00 C ATOM 0 HA PRO A 717 7.618 3.763 -12.230 1.00 0.00 H new ATOM 0 HB2 PRO A 717 4.863 4.577 -12.038 1.00 0.00 H new ATOM 0 HB3 PRO A 717 5.676 3.354 -11.083 1.00 0.00 H new ATOM 0 HG2 PRO A 717 5.172 6.215 -10.440 1.00 0.00 H new ATOM 0 HG3 PRO A 717 5.361 4.854 -9.353 1.00 0.00 H new ATOM 0 HD2 PRO A 717 7.329 6.666 -9.566 1.00 0.00 H new ATOM 0 HD3 PRO A 717 7.730 4.968 -9.399 1.00 0.00 H new ATOM 15 N GLU A 718 6.894 4.300 -14.538 1.00 0.00 N ATOM 16 CA GLU A 718 6.646 4.660 -15.927 1.00 0.00 C ATOM 17 C GLU A 718 5.331 4.052 -16.398 1.00 0.00 C ATOM 18 O GLU A 718 4.299 4.724 -16.454 1.00 0.00 O ATOM 19 CB GLU A 718 7.795 4.178 -16.820 1.00 0.00 C ATOM 20 CG GLU A 718 9.161 4.719 -16.420 1.00 0.00 C ATOM 21 CD GLU A 718 9.244 6.228 -16.509 1.00 0.00 C ATOM 22 OE1 GLU A 718 9.434 6.754 -17.624 1.00 0.00 O ATOM 23 OE2 GLU A 718 9.130 6.896 -15.461 1.00 0.00 O ATOM 0 H GLU A 718 7.194 3.335 -14.398 1.00 0.00 H new ATOM 0 HA GLU A 718 6.582 5.746 -15.997 1.00 0.00 H new ATOM 0 HB2 GLU A 718 7.826 3.089 -16.797 1.00 0.00 H new ATOM 0 HB3 GLU A 718 7.588 4.469 -17.850 1.00 0.00 H new ATOM 0 HG2 GLU A 718 9.386 4.407 -15.400 1.00 0.00 H new ATOM 0 HG3 GLU A 718 9.923 4.279 -17.063 1.00 0.00 H new ATOM 30 N GLY A 719 5.372 2.764 -16.696 1.00 0.00 N ATOM 31 CA GLY A 719 4.196 2.054 -17.147 1.00 0.00 C ATOM 32 C GLY A 719 4.513 0.598 -17.383 1.00 0.00 C ATOM 33 O GLY A 719 5.659 0.255 -17.683 1.00 0.00 O ATOM 0 H GLY A 719 6.213 2.190 -16.632 1.00 0.00 H new ATOM 0 HA2 GLY A 719 3.403 2.143 -16.404 1.00 0.00 H new ATOM 0 HA3 GLY A 719 3.823 2.504 -18.067 1.00 0.00 H new ATOM 37 N VAL A 720 3.523 -0.267 -17.242 1.00 0.00 N ATOM 38 CA VAL A 720 3.754 -1.697 -17.396 1.00 0.00 C ATOM 39 C VAL A 720 3.145 -2.206 -18.694 1.00 0.00 C ATOM 40 O VAL A 720 3.476 -3.294 -19.165 1.00 0.00 O ATOM 41 CB VAL A 720 3.197 -2.504 -16.204 1.00 0.00 C ATOM 42 CG1 VAL A 720 3.901 -2.101 -14.916 1.00 0.00 C ATOM 43 CG2 VAL A 720 1.695 -2.316 -16.072 1.00 0.00 C ATOM 0 H VAL A 720 2.560 -0.010 -17.023 1.00 0.00 H new ATOM 0 HA VAL A 720 4.834 -1.843 -17.425 1.00 0.00 H new ATOM 0 HB VAL A 720 3.388 -3.561 -16.390 1.00 0.00 H new ATOM 0 HG11 VAL A 720 3.497 -2.679 -14.085 1.00 0.00 H new ATOM 0 HG12 VAL A 720 4.969 -2.296 -15.009 1.00 0.00 H new ATOM 0 HG13 VAL A 720 3.741 -1.039 -14.731 1.00 0.00 H new ATOM 0 HG21 VAL A 720 1.329 -2.896 -15.225 1.00 0.00 H new ATOM 0 HG22 VAL A 720 1.473 -1.261 -15.913 1.00 0.00 H new ATOM 0 HG23 VAL A 720 1.204 -2.657 -16.984 1.00 0.00 H new ATOM 53 N GLU A 721 2.276 -1.395 -19.283 1.00 0.00 N ATOM 54 CA GLU A 721 1.619 -1.751 -20.537 1.00 0.00 C ATOM 55 C GLU A 721 2.614 -1.690 -21.690 1.00 0.00 C ATOM 56 O GLU A 721 2.319 -2.120 -22.804 1.00 0.00 O ATOM 57 CB GLU A 721 0.437 -0.819 -20.836 1.00 0.00 C ATOM 58 CG GLU A 721 -0.408 -0.461 -19.623 1.00 0.00 C ATOM 59 CD GLU A 721 0.205 0.656 -18.807 1.00 0.00 C ATOM 60 OE1 GLU A 721 0.134 1.821 -19.248 1.00 0.00 O ATOM 61 OE2 GLU A 721 0.776 0.376 -17.732 1.00 0.00 O ATOM 0 H GLU A 721 2.008 -0.483 -18.912 1.00 0.00 H new ATOM 0 HA GLU A 721 1.240 -2.767 -20.432 1.00 0.00 H new ATOM 0 HB2 GLU A 721 0.819 0.100 -21.281 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -0.202 -1.292 -21.581 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -1.404 -0.164 -19.951 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -0.530 -1.343 -18.994 1.00 0.00 H new ATOM 68 N SER A 722 3.792 -1.143 -21.410 1.00 0.00 N ATOM 69 CA SER A 722 4.855 -1.055 -22.400 1.00 0.00 C ATOM 70 C SER A 722 5.386 -2.449 -22.755 1.00 0.00 C ATOM 71 O SER A 722 6.048 -2.632 -23.779 1.00 0.00 O ATOM 72 CB SER A 722 5.989 -0.174 -21.869 1.00 0.00 C ATOM 73 OG SER A 722 5.491 1.063 -21.370 1.00 0.00 O ATOM 0 H SER A 722 4.034 -0.752 -20.499 1.00 0.00 H new ATOM 0 HA SER A 722 4.449 -0.606 -23.306 1.00 0.00 H new ATOM 0 HB2 SER A 722 6.521 -0.701 -21.077 1.00 0.00 H new ATOM 0 HB3 SER A 722 6.709 0.016 -22.665 1.00 0.00 H new ATOM 0 HG SER A 722 6.236 1.605 -21.036 1.00 0.00 H new ATOM 79 N GLN A 723 5.094 -3.425 -21.899 1.00 0.00 N ATOM 80 CA GLN A 723 5.487 -4.809 -22.135 1.00 0.00 C ATOM 81 C GLN A 723 4.363 -5.751 -21.716 1.00 0.00 C ATOM 82 O GLN A 723 3.270 -5.310 -21.360 1.00 0.00 O ATOM 83 CB GLN A 723 6.757 -5.167 -21.353 1.00 0.00 C ATOM 84 CG GLN A 723 7.994 -4.392 -21.775 1.00 0.00 C ATOM 85 CD GLN A 723 9.268 -4.966 -21.187 1.00 0.00 C ATOM 86 OE1 GLN A 723 9.266 -5.540 -20.096 1.00 0.00 O ATOM 87 NE2 GLN A 723 10.367 -4.815 -21.907 1.00 0.00 N ATOM 0 H GLN A 723 4.582 -3.279 -21.029 1.00 0.00 H new ATOM 0 HA GLN A 723 5.688 -4.920 -23.201 1.00 0.00 H new ATOM 0 HB2 GLN A 723 6.577 -4.991 -20.292 1.00 0.00 H new ATOM 0 HB3 GLN A 723 6.953 -6.233 -21.471 1.00 0.00 H new ATOM 0 HG2 GLN A 723 8.067 -4.394 -22.863 1.00 0.00 H new ATOM 0 HG3 GLN A 723 7.891 -3.352 -21.465 1.00 0.00 H new ATOM 0 HE21 GLN A 723 10.326 -4.334 -22.805 1.00 0.00 H new ATOM 0 HE22 GLN A 723 11.256 -5.180 -21.564 1.00 0.00 H new ATOM 96 N ASP A 724 4.633 -7.048 -21.767 1.00 0.00 N ATOM 97 CA ASP A 724 3.694 -8.054 -21.270 1.00 0.00 C ATOM 98 C ASP A 724 3.977 -8.334 -19.802 1.00 0.00 C ATOM 99 O ASP A 724 3.265 -9.097 -19.149 1.00 0.00 O ATOM 100 CB ASP A 724 3.828 -9.371 -22.052 1.00 0.00 C ATOM 101 CG ASP A 724 3.619 -9.216 -23.543 1.00 0.00 C ATOM 102 OD1 ASP A 724 4.603 -8.913 -24.249 1.00 0.00 O ATOM 103 OD2 ASP A 724 2.483 -9.422 -24.018 1.00 0.00 O ATOM 0 H ASP A 724 5.497 -7.433 -22.148 1.00 0.00 H new ATOM 0 HA ASP A 724 2.684 -7.664 -21.399 1.00 0.00 H new ATOM 0 HB2 ASP A 724 4.819 -9.790 -21.874 1.00 0.00 H new ATOM 0 HB3 ASP A 724 3.104 -10.089 -21.665 1.00 0.00 H new ATOM 108 N GLY A 725 5.035 -7.716 -19.297 1.00 0.00 N ATOM 109 CA GLY A 725 5.535 -8.048 -17.980 1.00 0.00 C ATOM 110 C GLY A 725 6.597 -9.123 -18.075 1.00 0.00 C ATOM 111 O GLY A 725 7.492 -9.223 -17.234 1.00 0.00 O ATOM 0 H GLY A 725 5.559 -6.986 -19.780 1.00 0.00 H new ATOM 0 HA2 GLY A 725 5.950 -7.158 -17.507 1.00 0.00 H new ATOM 0 HA3 GLY A 725 4.716 -8.392 -17.349 1.00 0.00 H new ATOM 115 N VAL A 726 6.494 -9.924 -19.126 1.00 0.00 N ATOM 116 CA VAL A 726 7.475 -10.950 -19.401 1.00 0.00 C ATOM 117 C VAL A 726 8.334 -10.546 -20.583 1.00 0.00 C ATOM 118 O VAL A 726 7.977 -10.769 -21.741 1.00 0.00 O ATOM 119 CB VAL A 726 6.822 -12.306 -19.709 1.00 0.00 C ATOM 120 CG1 VAL A 726 7.873 -13.400 -19.840 1.00 0.00 C ATOM 121 CG2 VAL A 726 5.805 -12.664 -18.644 1.00 0.00 C ATOM 0 H VAL A 726 5.733 -9.878 -19.804 1.00 0.00 H new ATOM 0 HA VAL A 726 8.085 -11.056 -18.504 1.00 0.00 H new ATOM 0 HB VAL A 726 6.303 -12.222 -20.664 1.00 0.00 H new ATOM 0 HG11 VAL A 726 7.384 -14.350 -20.058 1.00 0.00 H new ATOM 0 HG12 VAL A 726 8.559 -13.151 -20.650 1.00 0.00 H new ATOM 0 HG13 VAL A 726 8.429 -13.484 -18.906 1.00 0.00 H new ATOM 0 HG21 VAL A 726 5.354 -13.628 -18.881 1.00 0.00 H new ATOM 0 HG22 VAL A 726 6.299 -12.723 -17.674 1.00 0.00 H new ATOM 0 HG23 VAL A 726 5.029 -11.899 -18.610 1.00 0.00 H new ATOM 131 N ASP A 727 9.428 -9.892 -20.277 1.00 0.00 N ATOM 132 CA ASP A 727 10.455 -9.617 -21.266 1.00 0.00 C ATOM 133 C ASP A 727 11.361 -10.837 -21.335 1.00 0.00 C ATOM 134 O ASP A 727 11.466 -11.561 -20.347 1.00 0.00 O ATOM 135 CB ASP A 727 11.245 -8.354 -20.878 1.00 0.00 C ATOM 136 CG ASP A 727 12.412 -8.043 -21.805 1.00 0.00 C ATOM 137 OD1 ASP A 727 13.460 -8.711 -21.686 1.00 0.00 O ATOM 138 OD2 ASP A 727 12.291 -7.114 -22.635 1.00 0.00 O ATOM 0 H ASP A 727 9.636 -9.536 -19.344 1.00 0.00 H new ATOM 0 HA ASP A 727 10.013 -9.429 -22.244 1.00 0.00 H new ATOM 0 HB2 ASP A 727 10.565 -7.502 -20.868 1.00 0.00 H new ATOM 0 HB3 ASP A 727 11.623 -8.472 -19.862 1.00 0.00 H new ATOM 143 N HIS A 728 11.990 -11.082 -22.480 1.00 0.00 N ATOM 144 CA HIS A 728 12.820 -12.274 -22.649 1.00 0.00 C ATOM 145 C HIS A 728 13.860 -12.351 -21.539 1.00 0.00 C ATOM 146 O HIS A 728 13.972 -13.361 -20.840 1.00 0.00 O ATOM 147 CB HIS A 728 13.524 -12.263 -24.010 1.00 0.00 C ATOM 148 CG HIS A 728 14.049 -13.605 -24.429 1.00 0.00 C ATOM 149 ND1 HIS A 728 13.347 -14.491 -25.218 1.00 0.00 N ATOM 150 CD2 HIS A 728 15.238 -14.203 -24.164 1.00 0.00 C ATOM 151 CE1 HIS A 728 14.111 -15.573 -25.403 1.00 0.00 C ATOM 152 NE2 HIS A 728 15.271 -15.449 -24.784 1.00 0.00 N ATOM 0 H HIS A 728 11.943 -10.477 -23.300 1.00 0.00 H new ATOM 0 HA HIS A 728 12.170 -13.147 -22.599 1.00 0.00 H new ATOM 0 HB2 HIS A 728 12.827 -11.903 -24.767 1.00 0.00 H new ATOM 0 HB3 HIS A 728 14.351 -11.554 -23.976 1.00 0.00 H new ATOM 0 HD2 HIS A 728 16.032 -13.780 -23.567 1.00 0.00 H new ATOM 0 HE1 HIS A 728 13.818 -16.436 -25.983 1.00 0.00 H new ATOM 0 HE2 HIS A 728 16.034 -16.126 -24.764 1.00 0.00 H new ATOM 160 N PHE A 729 14.578 -11.257 -21.346 1.00 0.00 N ATOM 161 CA PHE A 729 15.658 -11.221 -20.380 1.00 0.00 C ATOM 162 C PHE A 729 15.115 -11.080 -18.965 1.00 0.00 C ATOM 163 O PHE A 729 15.713 -11.579 -18.014 1.00 0.00 O ATOM 164 CB PHE A 729 16.631 -10.090 -20.714 1.00 0.00 C ATOM 165 CG PHE A 729 17.319 -10.298 -22.034 1.00 0.00 C ATOM 166 CD1 PHE A 729 18.067 -11.442 -22.256 1.00 0.00 C ATOM 167 CD2 PHE A 729 17.209 -9.365 -23.055 1.00 0.00 C ATOM 168 CE1 PHE A 729 18.693 -11.654 -23.466 1.00 0.00 C ATOM 169 CE2 PHE A 729 17.835 -9.577 -24.268 1.00 0.00 C ATOM 170 CZ PHE A 729 18.577 -10.721 -24.472 1.00 0.00 C ATOM 0 H PHE A 729 14.430 -10.381 -21.848 1.00 0.00 H new ATOM 0 HA PHE A 729 16.202 -12.164 -20.432 1.00 0.00 H new ATOM 0 HB2 PHE A 729 16.091 -9.144 -20.734 1.00 0.00 H new ATOM 0 HB3 PHE A 729 17.379 -10.013 -19.925 1.00 0.00 H new ATOM 0 HD1 PHE A 729 18.161 -12.178 -21.471 1.00 0.00 H new ATOM 0 HD2 PHE A 729 16.630 -8.467 -22.900 1.00 0.00 H new ATOM 0 HE1 PHE A 729 19.274 -12.551 -23.625 1.00 0.00 H new ATOM 0 HE2 PHE A 729 17.743 -8.846 -25.057 1.00 0.00 H new ATOM 0 HZ PHE A 729 19.067 -10.885 -25.420 1.00 0.00 H new ATOM 180 N ARG A 730 13.965 -10.426 -18.829 1.00 0.00 N ATOM 181 CA ARG A 730 13.320 -10.303 -17.524 1.00 0.00 C ATOM 182 C ARG A 730 12.866 -11.672 -17.039 1.00 0.00 C ATOM 183 O ARG A 730 12.969 -11.985 -15.853 1.00 0.00 O ATOM 184 CB ARG A 730 12.129 -9.335 -17.573 1.00 0.00 C ATOM 185 CG ARG A 730 11.485 -9.097 -16.214 1.00 0.00 C ATOM 186 CD ARG A 730 10.404 -8.028 -16.275 1.00 0.00 C ATOM 187 NE ARG A 730 10.946 -6.712 -16.624 1.00 0.00 N ATOM 188 CZ ARG A 730 11.114 -5.716 -15.748 1.00 0.00 C ATOM 189 NH1 ARG A 730 10.837 -5.902 -14.463 1.00 0.00 N ATOM 190 NH2 ARG A 730 11.564 -4.535 -16.154 1.00 0.00 N ATOM 0 H ARG A 730 13.465 -9.977 -19.596 1.00 0.00 H new ATOM 0 HA ARG A 730 14.050 -9.895 -16.824 1.00 0.00 H new ATOM 0 HB2 ARG A 730 12.463 -8.381 -17.980 1.00 0.00 H new ATOM 0 HB3 ARG A 730 11.378 -9.729 -18.258 1.00 0.00 H new ATOM 0 HG2 ARG A 730 11.053 -10.029 -15.849 1.00 0.00 H new ATOM 0 HG3 ARG A 730 12.250 -8.798 -15.497 1.00 0.00 H new ATOM 0 HD2 ARG A 730 9.652 -8.316 -17.010 1.00 0.00 H new ATOM 0 HD3 ARG A 730 9.900 -7.967 -15.310 1.00 0.00 H new ATOM 0 HE ARG A 730 11.211 -6.546 -17.595 1.00 0.00 H new ATOM 0 HH11 ARG A 730 10.495 -6.807 -14.141 1.00 0.00 H new ATOM 0 HH12 ARG A 730 10.967 -5.140 -13.798 1.00 0.00 H new ATOM 0 HH21 ARG A 730 11.783 -4.384 -17.139 1.00 0.00 H new ATOM 0 HH22 ARG A 730 11.690 -3.779 -15.481 1.00 0.00 H new ATOM 204 N ALA A 731 12.385 -12.491 -17.968 1.00 0.00 N ATOM 205 CA ALA A 731 11.984 -13.854 -17.655 1.00 0.00 C ATOM 206 C ALA A 731 13.193 -14.681 -17.242 1.00 0.00 C ATOM 207 O ALA A 731 13.126 -15.466 -16.296 1.00 0.00 O ATOM 208 CB ALA A 731 11.293 -14.495 -18.847 1.00 0.00 C ATOM 0 H ALA A 731 12.264 -12.231 -18.947 1.00 0.00 H new ATOM 0 HA ALA A 731 11.281 -13.822 -16.823 1.00 0.00 H new ATOM 0 HB1 ALA A 731 11.001 -15.514 -18.593 1.00 0.00 H new ATOM 0 HB2 ALA A 731 10.406 -13.917 -19.107 1.00 0.00 H new ATOM 0 HB3 ALA A 731 11.976 -14.514 -19.696 1.00 0.00 H new ATOM 214 N MET A 732 14.298 -14.489 -17.951 1.00 0.00 N ATOM 215 CA MET A 732 15.540 -15.188 -17.643 1.00 0.00 C ATOM 216 C MET A 732 16.050 -14.785 -16.260 1.00 0.00 C ATOM 217 O MET A 732 16.471 -15.632 -15.473 1.00 0.00 O ATOM 218 CB MET A 732 16.591 -14.886 -18.720 1.00 0.00 C ATOM 219 CG MET A 732 16.172 -15.333 -20.113 1.00 0.00 C ATOM 220 SD MET A 732 17.321 -14.810 -21.401 1.00 0.00 S ATOM 221 CE MET A 732 18.734 -15.847 -21.048 1.00 0.00 C ATOM 0 H MET A 732 14.360 -13.853 -18.746 1.00 0.00 H new ATOM 0 HA MET A 732 15.350 -16.261 -17.634 1.00 0.00 H new ATOM 0 HB2 MET A 732 16.789 -13.814 -18.734 1.00 0.00 H new ATOM 0 HB3 MET A 732 17.526 -15.379 -18.454 1.00 0.00 H new ATOM 0 HG2 MET A 732 16.088 -16.420 -20.129 1.00 0.00 H new ATOM 0 HG3 MET A 732 15.182 -14.933 -20.334 1.00 0.00 H new ATOM 0 HE1 MET A 732 19.501 -15.688 -21.806 1.00 0.00 H new ATOM 0 HE2 MET A 732 19.136 -15.593 -20.067 1.00 0.00 H new ATOM 0 HE3 MET A 732 18.428 -16.893 -21.055 1.00 0.00 H new ATOM 231 N ILE A 733 15.976 -13.493 -15.962 1.00 0.00 N ATOM 232 CA ILE A 733 16.452 -12.962 -14.686 1.00 0.00 C ATOM 233 C ILE A 733 15.539 -13.362 -13.520 1.00 0.00 C ATOM 234 O ILE A 733 16.026 -13.741 -12.452 1.00 0.00 O ATOM 235 CB ILE A 733 16.596 -11.419 -14.745 1.00 0.00 C ATOM 236 CG1 ILE A 733 17.747 -11.039 -15.683 1.00 0.00 C ATOM 237 CG2 ILE A 733 16.820 -10.824 -13.360 1.00 0.00 C ATOM 238 CD1 ILE A 733 17.964 -9.548 -15.823 1.00 0.00 C ATOM 0 H ILE A 733 15.589 -12.788 -16.590 1.00 0.00 H new ATOM 0 HA ILE A 733 17.433 -13.402 -14.507 1.00 0.00 H new ATOM 0 HB ILE A 733 15.664 -11.006 -15.132 1.00 0.00 H new ATOM 0 HG12 ILE A 733 18.666 -11.496 -15.316 1.00 0.00 H new ATOM 0 HG13 ILE A 733 17.552 -11.461 -16.669 1.00 0.00 H new ATOM 0 HG21 ILE A 733 16.916 -9.741 -13.440 1.00 0.00 H new ATOM 0 HG22 ILE A 733 15.973 -11.066 -12.719 1.00 0.00 H new ATOM 0 HG23 ILE A 733 17.731 -11.238 -12.929 1.00 0.00 H new ATOM 0 HD11 ILE A 733 18.796 -9.364 -16.503 1.00 0.00 H new ATOM 0 HD12 ILE A 733 17.061 -9.085 -16.220 1.00 0.00 H new ATOM 0 HD13 ILE A 733 18.192 -9.120 -14.847 1.00 0.00 H new ATOM 250 N VAL A 734 14.224 -13.301 -13.717 1.00 0.00 N ATOM 251 CA VAL A 734 13.291 -13.602 -12.634 1.00 0.00 C ATOM 252 C VAL A 734 13.392 -15.071 -12.209 1.00 0.00 C ATOM 253 O VAL A 734 13.393 -15.377 -11.016 1.00 0.00 O ATOM 254 CB VAL A 734 11.828 -13.237 -13.000 1.00 0.00 C ATOM 255 CG1 VAL A 734 11.287 -14.115 -14.117 1.00 0.00 C ATOM 256 CG2 VAL A 734 10.929 -13.314 -11.770 1.00 0.00 C ATOM 0 H VAL A 734 13.785 -13.050 -14.603 1.00 0.00 H new ATOM 0 HA VAL A 734 13.579 -12.977 -11.788 1.00 0.00 H new ATOM 0 HB VAL A 734 11.831 -12.210 -13.366 1.00 0.00 H new ATOM 0 HG11 VAL A 734 10.260 -13.826 -14.342 1.00 0.00 H new ATOM 0 HG12 VAL A 734 11.903 -13.991 -15.008 1.00 0.00 H new ATOM 0 HG13 VAL A 734 11.310 -15.159 -13.803 1.00 0.00 H new ATOM 0 HG21 VAL A 734 9.908 -13.054 -12.049 1.00 0.00 H new ATOM 0 HG22 VAL A 734 10.949 -14.327 -11.368 1.00 0.00 H new ATOM 0 HG23 VAL A 734 11.287 -12.616 -11.013 1.00 0.00 H new ATOM 266 N GLU A 735 13.516 -15.974 -13.179 1.00 0.00 N ATOM 267 CA GLU A 735 13.690 -17.390 -12.873 1.00 0.00 C ATOM 268 C GLU A 735 15.075 -17.638 -12.289 1.00 0.00 C ATOM 269 O GLU A 735 15.254 -18.498 -11.427 1.00 0.00 O ATOM 270 CB GLU A 735 13.473 -18.251 -14.119 1.00 0.00 C ATOM 271 CG GLU A 735 12.026 -18.282 -14.585 1.00 0.00 C ATOM 272 CD GLU A 735 11.820 -19.165 -15.797 1.00 0.00 C ATOM 273 OE1 GLU A 735 12.067 -20.384 -15.699 1.00 0.00 O ATOM 274 OE2 GLU A 735 11.387 -18.646 -16.849 1.00 0.00 O ATOM 0 H GLU A 735 13.499 -15.753 -14.175 1.00 0.00 H new ATOM 0 HA GLU A 735 12.941 -17.673 -12.133 1.00 0.00 H new ATOM 0 HB2 GLU A 735 14.099 -17.873 -14.927 1.00 0.00 H new ATOM 0 HB3 GLU A 735 13.802 -19.269 -13.910 1.00 0.00 H new ATOM 0 HG2 GLU A 735 11.394 -18.637 -13.771 1.00 0.00 H new ATOM 0 HG3 GLU A 735 11.703 -17.268 -14.821 1.00 0.00 H new ATOM 281 N PHE A 736 16.044 -16.856 -12.751 1.00 0.00 N ATOM 282 CA PHE A 736 17.411 -16.910 -12.242 1.00 0.00 C ATOM 283 C PHE A 736 17.452 -16.595 -10.746 1.00 0.00 C ATOM 284 O PHE A 736 18.223 -17.194 -9.990 1.00 0.00 O ATOM 285 CB PHE A 736 18.281 -15.933 -13.038 1.00 0.00 C ATOM 286 CG PHE A 736 19.539 -15.496 -12.345 1.00 0.00 C ATOM 287 CD1 PHE A 736 20.551 -16.398 -12.067 1.00 0.00 C ATOM 288 CD2 PHE A 736 19.708 -14.170 -11.980 1.00 0.00 C ATOM 289 CE1 PHE A 736 21.707 -15.987 -11.438 1.00 0.00 C ATOM 290 CE2 PHE A 736 20.862 -13.753 -11.350 1.00 0.00 C ATOM 291 CZ PHE A 736 21.861 -14.662 -11.078 1.00 0.00 C ATOM 0 H PHE A 736 15.905 -16.166 -13.489 1.00 0.00 H new ATOM 0 HA PHE A 736 17.802 -17.920 -12.368 1.00 0.00 H new ATOM 0 HB2 PHE A 736 18.549 -16.398 -13.987 1.00 0.00 H new ATOM 0 HB3 PHE A 736 17.687 -15.049 -13.273 1.00 0.00 H new ATOM 0 HD1 PHE A 736 20.434 -17.435 -12.346 1.00 0.00 H new ATOM 0 HD2 PHE A 736 18.927 -13.455 -12.191 1.00 0.00 H new ATOM 0 HE1 PHE A 736 22.491 -16.699 -11.227 1.00 0.00 H new ATOM 0 HE2 PHE A 736 20.982 -12.717 -11.071 1.00 0.00 H new ATOM 0 HZ PHE A 736 22.765 -14.339 -10.583 1.00 0.00 H new ATOM 301 N MET A 737 16.609 -15.667 -10.315 1.00 0.00 N ATOM 302 CA MET A 737 16.528 -15.324 -8.904 1.00 0.00 C ATOM 303 C MET A 737 16.036 -16.514 -8.090 1.00 0.00 C ATOM 304 O MET A 737 16.468 -16.718 -6.957 1.00 0.00 O ATOM 305 CB MET A 737 15.647 -14.092 -8.675 1.00 0.00 C ATOM 306 CG MET A 737 16.254 -12.806 -9.215 1.00 0.00 C ATOM 307 SD MET A 737 15.441 -11.317 -8.597 1.00 0.00 S ATOM 308 CE MET A 737 13.781 -11.539 -9.225 1.00 0.00 C ATOM 0 H MET A 737 15.976 -15.142 -10.918 1.00 0.00 H new ATOM 0 HA MET A 737 17.532 -15.071 -8.563 1.00 0.00 H new ATOM 0 HB2 MET A 737 14.678 -14.254 -9.148 1.00 0.00 H new ATOM 0 HB3 MET A 737 15.465 -13.978 -7.606 1.00 0.00 H new ATOM 0 HG2 MET A 737 17.310 -12.772 -8.949 1.00 0.00 H new ATOM 0 HG3 MET A 737 16.200 -12.816 -10.304 1.00 0.00 H new ATOM 0 HE1 MET A 737 13.136 -10.752 -8.835 1.00 0.00 H new ATOM 0 HE2 MET A 737 13.794 -11.491 -10.314 1.00 0.00 H new ATOM 0 HE3 MET A 737 13.400 -12.510 -8.910 1.00 0.00 H new ATOM 318 N ALA A 738 15.186 -17.330 -8.692 1.00 0.00 N ATOM 319 CA ALA A 738 14.667 -18.513 -8.024 1.00 0.00 C ATOM 320 C ALA A 738 15.530 -19.738 -8.325 1.00 0.00 C ATOM 321 O ALA A 738 15.165 -20.864 -7.988 1.00 0.00 O ATOM 322 CB ALA A 738 13.230 -18.760 -8.448 1.00 0.00 C ATOM 0 H ALA A 738 14.841 -17.195 -9.642 1.00 0.00 H new ATOM 0 HA ALA A 738 14.696 -18.340 -6.948 1.00 0.00 H new ATOM 0 HB1 ALA A 738 12.849 -19.648 -7.943 1.00 0.00 H new ATOM 0 HB2 ALA A 738 12.618 -17.899 -8.179 1.00 0.00 H new ATOM 0 HB3 ALA A 738 13.190 -18.911 -9.527 1.00 0.00 H new ATOM 328 N SER A 739 16.676 -19.517 -8.958 1.00 0.00 N ATOM 329 CA SER A 739 17.582 -20.601 -9.297 1.00 0.00 C ATOM 330 C SER A 739 18.742 -20.670 -8.307 1.00 0.00 C ATOM 331 O SER A 739 18.960 -19.740 -7.523 1.00 0.00 O ATOM 332 CB SER A 739 18.114 -20.415 -10.721 1.00 0.00 C ATOM 333 OG SER A 739 17.056 -20.415 -11.663 1.00 0.00 O ATOM 0 H SER A 739 16.998 -18.593 -9.246 1.00 0.00 H new ATOM 0 HA SER A 739 17.030 -21.539 -9.242 1.00 0.00 H new ATOM 0 HB2 SER A 739 18.665 -19.477 -10.787 1.00 0.00 H new ATOM 0 HB3 SER A 739 18.816 -21.214 -10.958 1.00 0.00 H new ATOM 0 HG SER A 739 16.453 -19.665 -11.477 1.00 0.00 H new ATOM 339 N LYS A 740 19.486 -21.769 -8.358 1.00 0.00 N ATOM 340 CA LYS A 740 20.615 -21.982 -7.465 1.00 0.00 C ATOM 341 C LYS A 740 21.789 -21.100 -7.881 1.00 0.00 C ATOM 342 O LYS A 740 22.589 -20.674 -7.045 1.00 0.00 O ATOM 343 CB LYS A 740 21.027 -23.458 -7.486 1.00 0.00 C ATOM 344 CG LYS A 740 22.087 -23.820 -6.454 1.00 0.00 C ATOM 345 CD LYS A 740 21.565 -23.720 -5.024 1.00 0.00 C ATOM 346 CE LYS A 740 20.783 -24.960 -4.596 1.00 0.00 C ATOM 347 NZ LYS A 740 19.549 -25.174 -5.400 1.00 0.00 N ATOM 0 H LYS A 740 19.324 -22.532 -9.015 1.00 0.00 H new ATOM 0 HA LYS A 740 20.320 -21.713 -6.451 1.00 0.00 H new ATOM 0 HB2 LYS A 740 20.144 -24.074 -7.316 1.00 0.00 H new ATOM 0 HB3 LYS A 740 21.402 -23.706 -8.479 1.00 0.00 H new ATOM 0 HG2 LYS A 740 22.439 -24.835 -6.639 1.00 0.00 H new ATOM 0 HG3 LYS A 740 22.945 -23.159 -6.572 1.00 0.00 H new ATOM 0 HD2 LYS A 740 22.404 -23.572 -4.344 1.00 0.00 H new ATOM 0 HD3 LYS A 740 20.924 -22.843 -4.936 1.00 0.00 H new ATOM 0 HE2 LYS A 740 21.425 -25.836 -4.685 1.00 0.00 H new ATOM 0 HE3 LYS A 740 20.513 -24.868 -3.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 18.898 -25.795 -4.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 19.087 -24.259 -5.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 19.798 -25.618 -6.307 1.00 0.00 H new ATOM 361 N LYS A 741 21.868 -20.822 -9.179 1.00 0.00 N ATOM 362 CA LYS A 741 22.920 -19.972 -9.726 1.00 0.00 C ATOM 363 C LYS A 741 22.872 -18.602 -9.063 1.00 0.00 C ATOM 364 O LYS A 741 21.813 -17.977 -9.008 1.00 0.00 O ATOM 365 CB LYS A 741 22.749 -19.806 -11.242 1.00 0.00 C ATOM 366 CG LYS A 741 22.601 -21.117 -12.000 1.00 0.00 C ATOM 367 CD LYS A 741 22.308 -20.883 -13.476 1.00 0.00 C ATOM 368 CE LYS A 741 23.547 -20.459 -14.249 1.00 0.00 C ATOM 369 NZ LYS A 741 24.533 -21.566 -14.371 1.00 0.00 N ATOM 0 H LYS A 741 21.212 -21.176 -9.875 1.00 0.00 H new ATOM 0 HA LYS A 741 23.882 -20.445 -9.528 1.00 0.00 H new ATOM 0 HB2 LYS A 741 21.871 -19.188 -11.432 1.00 0.00 H new ATOM 0 HB3 LYS A 741 23.610 -19.266 -11.637 1.00 0.00 H new ATOM 0 HG2 LYS A 741 23.515 -21.701 -11.899 1.00 0.00 H new ATOM 0 HG3 LYS A 741 21.796 -21.704 -11.558 1.00 0.00 H new ATOM 0 HD2 LYS A 741 21.904 -21.796 -13.913 1.00 0.00 H new ATOM 0 HD3 LYS A 741 21.540 -20.116 -13.575 1.00 0.00 H new ATOM 0 HE2 LYS A 741 23.256 -20.121 -15.244 1.00 0.00 H new ATOM 0 HE3 LYS A 741 24.014 -19.611 -13.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 741 25.232 -21.329 -15.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 741 25.018 -21.701 -13.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 741 24.040 -22.443 -14.634 1.00 0.00 H new ATOM 383 N MET A 742 24.002 -18.145 -8.543 1.00 0.00 N ATOM 384 CA MET A 742 24.060 -16.828 -7.923 1.00 0.00 C ATOM 385 C MET A 742 24.567 -15.791 -8.914 1.00 0.00 C ATOM 386 O MET A 742 24.502 -14.589 -8.658 1.00 0.00 O ATOM 387 CB MET A 742 24.931 -16.845 -6.665 1.00 0.00 C ATOM 388 CG MET A 742 24.343 -17.685 -5.540 1.00 0.00 C ATOM 389 SD MET A 742 25.224 -17.487 -3.978 1.00 0.00 S ATOM 390 CE MET A 742 26.869 -18.016 -4.446 1.00 0.00 C ATOM 0 H MET A 742 24.883 -18.660 -8.537 1.00 0.00 H new ATOM 0 HA MET A 742 23.048 -16.554 -7.624 1.00 0.00 H new ATOM 0 HB2 MET A 742 25.918 -17.230 -6.920 1.00 0.00 H new ATOM 0 HB3 MET A 742 25.069 -15.823 -6.313 1.00 0.00 H new ATOM 0 HG2 MET A 742 23.297 -17.412 -5.398 1.00 0.00 H new ATOM 0 HG3 MET A 742 24.361 -18.735 -5.831 1.00 0.00 H new ATOM 0 HE1 MET A 742 27.464 -18.189 -3.550 1.00 0.00 H new ATOM 0 HE2 MET A 742 26.804 -18.939 -5.022 1.00 0.00 H new ATOM 0 HE3 MET A 742 27.341 -17.243 -5.052 1.00 0.00 H new ATOM 400 N GLN A 743 25.063 -16.268 -10.046 1.00 0.00 N ATOM 401 CA GLN A 743 25.470 -15.392 -11.132 1.00 0.00 C ATOM 402 C GLN A 743 25.053 -15.991 -12.472 1.00 0.00 C ATOM 403 O GLN A 743 25.337 -17.151 -12.764 1.00 0.00 O ATOM 404 CB GLN A 743 26.982 -15.130 -11.102 1.00 0.00 C ATOM 405 CG GLN A 743 27.841 -16.382 -11.189 1.00 0.00 C ATOM 406 CD GLN A 743 29.306 -16.069 -11.439 1.00 0.00 C ATOM 407 OE1 GLN A 743 30.017 -16.851 -12.072 1.00 0.00 O ATOM 408 NE2 GLN A 743 29.769 -14.931 -10.942 1.00 0.00 N ATOM 0 H GLN A 743 25.193 -17.262 -10.236 1.00 0.00 H new ATOM 0 HA GLN A 743 24.968 -14.433 -11.002 1.00 0.00 H new ATOM 0 HB2 GLN A 743 27.240 -14.469 -11.930 1.00 0.00 H new ATOM 0 HB3 GLN A 743 27.228 -14.599 -10.182 1.00 0.00 H new ATOM 0 HG2 GLN A 743 27.747 -16.948 -10.262 1.00 0.00 H new ATOM 0 HG3 GLN A 743 27.468 -17.019 -11.990 1.00 0.00 H new ATOM 0 HE21 GLN A 743 29.147 -14.311 -10.423 1.00 0.00 H new ATOM 0 HE22 GLN A 743 30.747 -14.676 -11.078 1.00 0.00 H new ATOM 417 N LEU A 744 24.346 -15.205 -13.264 1.00 0.00 N ATOM 418 CA LEU A 744 23.884 -15.643 -14.564 1.00 0.00 C ATOM 419 C LEU A 744 24.771 -15.054 -15.643 1.00 0.00 C ATOM 420 O LEU A 744 24.722 -13.852 -15.920 1.00 0.00 O ATOM 421 CB LEU A 744 22.428 -15.229 -14.785 1.00 0.00 C ATOM 422 CG LEU A 744 21.790 -15.697 -16.098 1.00 0.00 C ATOM 423 CD1 LEU A 744 21.834 -17.213 -16.217 1.00 0.00 C ATOM 424 CD2 LEU A 744 20.354 -15.209 -16.189 1.00 0.00 C ATOM 0 H LEU A 744 24.078 -14.251 -13.024 1.00 0.00 H new ATOM 0 HA LEU A 744 23.938 -16.731 -14.611 1.00 0.00 H new ATOM 0 HB2 LEU A 744 21.832 -15.613 -13.957 1.00 0.00 H new ATOM 0 HB3 LEU A 744 22.369 -14.141 -14.743 1.00 0.00 H new ATOM 0 HG LEU A 744 22.364 -15.273 -16.922 1.00 0.00 H new ATOM 0 HD11 LEU A 744 21.375 -17.518 -17.157 1.00 0.00 H new ATOM 0 HD12 LEU A 744 22.870 -17.550 -16.193 1.00 0.00 H new ATOM 0 HD13 LEU A 744 21.288 -17.659 -15.386 1.00 0.00 H new ATOM 0 HD21 LEU A 744 19.913 -15.548 -17.126 1.00 0.00 H new ATOM 0 HD22 LEU A 744 19.780 -15.608 -15.353 1.00 0.00 H new ATOM 0 HD23 LEU A 744 20.337 -14.120 -16.154 1.00 0.00 H new ATOM 436 N GLU A 745 25.613 -15.895 -16.208 1.00 0.00 N ATOM 437 CA GLU A 745 26.499 -15.488 -17.280 1.00 0.00 C ATOM 438 C GLU A 745 25.788 -15.635 -18.619 1.00 0.00 C ATOM 439 O GLU A 745 25.576 -16.747 -19.103 1.00 0.00 O ATOM 440 CB GLU A 745 27.774 -16.333 -17.253 1.00 0.00 C ATOM 441 CG GLU A 745 28.448 -16.361 -15.889 1.00 0.00 C ATOM 442 CD GLU A 745 29.707 -17.199 -15.870 1.00 0.00 C ATOM 443 OE1 GLU A 745 29.607 -18.438 -15.716 1.00 0.00 O ATOM 444 OE2 GLU A 745 30.807 -16.623 -15.995 1.00 0.00 O ATOM 0 H GLU A 745 25.703 -16.875 -15.939 1.00 0.00 H new ATOM 0 HA GLU A 745 26.774 -14.442 -17.143 1.00 0.00 H new ATOM 0 HB2 GLU A 745 27.532 -17.353 -17.552 1.00 0.00 H new ATOM 0 HB3 GLU A 745 28.476 -15.943 -17.990 1.00 0.00 H new ATOM 0 HG2 GLU A 745 28.692 -15.342 -15.589 1.00 0.00 H new ATOM 0 HG3 GLU A 745 27.747 -16.751 -15.151 1.00 0.00 H new ATOM 451 N PHE A 746 25.392 -14.513 -19.194 1.00 0.00 N ATOM 452 CA PHE A 746 24.674 -14.517 -20.457 1.00 0.00 C ATOM 453 C PHE A 746 25.623 -14.788 -21.619 1.00 0.00 C ATOM 454 O PHE A 746 26.784 -14.378 -21.584 1.00 0.00 O ATOM 455 CB PHE A 746 23.963 -13.183 -20.680 1.00 0.00 C ATOM 456 CG PHE A 746 22.748 -12.974 -19.821 1.00 0.00 C ATOM 457 CD1 PHE A 746 22.863 -12.481 -18.533 1.00 0.00 C ATOM 458 CD2 PHE A 746 21.483 -13.259 -20.312 1.00 0.00 C ATOM 459 CE1 PHE A 746 21.742 -12.276 -17.752 1.00 0.00 C ATOM 460 CE2 PHE A 746 20.359 -13.057 -19.535 1.00 0.00 C ATOM 461 CZ PHE A 746 20.489 -12.565 -18.254 1.00 0.00 C ATOM 0 H PHE A 746 25.556 -13.584 -18.805 1.00 0.00 H new ATOM 0 HA PHE A 746 23.931 -15.313 -20.413 1.00 0.00 H new ATOM 0 HB2 PHE A 746 24.669 -12.374 -20.493 1.00 0.00 H new ATOM 0 HB3 PHE A 746 23.669 -13.113 -21.727 1.00 0.00 H new ATOM 0 HD1 PHE A 746 23.840 -12.254 -18.134 1.00 0.00 H new ATOM 0 HD2 PHE A 746 21.375 -13.644 -21.315 1.00 0.00 H new ATOM 0 HE1 PHE A 746 21.846 -11.890 -16.749 1.00 0.00 H new ATOM 0 HE2 PHE A 746 19.380 -13.284 -19.930 1.00 0.00 H new ATOM 0 HZ PHE A 746 19.612 -12.406 -17.644 1.00 0.00 H new ATOM 471 N PRO A 747 25.139 -15.487 -22.657 1.00 0.00 N ATOM 472 CA PRO A 747 25.927 -15.780 -23.859 1.00 0.00 C ATOM 473 C PRO A 747 26.345 -14.514 -24.608 1.00 0.00 C ATOM 474 O PRO A 747 25.656 -13.492 -24.555 1.00 0.00 O ATOM 475 CB PRO A 747 24.972 -16.612 -24.729 1.00 0.00 C ATOM 476 CG PRO A 747 23.930 -17.114 -23.793 1.00 0.00 C ATOM 477 CD PRO A 747 23.786 -16.058 -22.738 1.00 0.00 C ATOM 0 HA PRO A 747 26.857 -16.291 -23.610 1.00 0.00 H new ATOM 0 HB2 PRO A 747 24.531 -16.006 -25.521 1.00 0.00 H new ATOM 0 HB3 PRO A 747 25.497 -17.436 -25.213 1.00 0.00 H new ATOM 0 HG2 PRO A 747 22.986 -17.280 -24.312 1.00 0.00 H new ATOM 0 HG3 PRO A 747 24.225 -18.067 -23.354 1.00 0.00 H new ATOM 0 HD2 PRO A 747 23.047 -15.307 -23.017 1.00 0.00 H new ATOM 0 HD3 PRO A 747 23.468 -16.480 -21.785 1.00 0.00 H new ATOM 485 N PRO A 748 27.475 -14.576 -25.333 1.00 0.00 N ATOM 486 CA PRO A 748 27.974 -13.453 -26.143 1.00 0.00 C ATOM 487 C PRO A 748 27.049 -13.115 -27.313 1.00 0.00 C ATOM 488 O PRO A 748 27.294 -12.172 -28.065 1.00 0.00 O ATOM 489 CB PRO A 748 29.318 -13.957 -26.670 1.00 0.00 C ATOM 490 CG PRO A 748 29.236 -15.442 -26.592 1.00 0.00 C ATOM 491 CD PRO A 748 28.373 -15.743 -25.401 1.00 0.00 C ATOM 0 HA PRO A 748 28.042 -12.537 -25.555 1.00 0.00 H new ATOM 0 HB2 PRO A 748 29.489 -13.625 -27.694 1.00 0.00 H new ATOM 0 HB3 PRO A 748 30.144 -13.576 -26.070 1.00 0.00 H new ATOM 0 HG2 PRO A 748 28.805 -15.858 -27.502 1.00 0.00 H new ATOM 0 HG3 PRO A 748 30.226 -15.883 -26.478 1.00 0.00 H new ATOM 0 HD2 PRO A 748 27.817 -16.672 -25.531 1.00 0.00 H new ATOM 0 HD3 PRO A 748 28.964 -15.850 -24.492 1.00 0.00 H new ATOM 499 N SER A 749 26.005 -13.914 -27.471 1.00 0.00 N ATOM 500 CA SER A 749 24.991 -13.684 -28.486 1.00 0.00 C ATOM 501 C SER A 749 24.206 -12.405 -28.187 1.00 0.00 C ATOM 502 O SER A 749 23.653 -11.776 -29.091 1.00 0.00 O ATOM 503 CB SER A 749 24.053 -14.887 -28.534 1.00 0.00 C ATOM 504 OG SER A 749 24.793 -16.094 -28.628 1.00 0.00 O ATOM 0 H SER A 749 25.838 -14.741 -26.898 1.00 0.00 H new ATOM 0 HA SER A 749 25.474 -13.560 -29.455 1.00 0.00 H new ATOM 0 HB2 SER A 749 23.430 -14.905 -27.640 1.00 0.00 H new ATOM 0 HB3 SER A 749 23.382 -14.798 -29.388 1.00 0.00 H new ATOM 0 HG SER A 749 24.176 -16.855 -28.656 1.00 0.00 H new ATOM 510 N LEU A 750 24.167 -12.023 -26.914 1.00 0.00 N ATOM 511 CA LEU A 750 23.522 -10.784 -26.502 1.00 0.00 C ATOM 512 C LEU A 750 24.348 -9.586 -26.951 1.00 0.00 C ATOM 513 O LEU A 750 25.456 -9.368 -26.455 1.00 0.00 O ATOM 514 CB LEU A 750 23.359 -10.731 -24.983 1.00 0.00 C ATOM 515 CG LEU A 750 22.174 -11.503 -24.403 1.00 0.00 C ATOM 516 CD1 LEU A 750 22.364 -13.008 -24.540 1.00 0.00 C ATOM 517 CD2 LEU A 750 21.973 -11.111 -22.951 1.00 0.00 C ATOM 0 H LEU A 750 24.577 -12.558 -26.148 1.00 0.00 H new ATOM 0 HA LEU A 750 22.537 -10.751 -26.968 1.00 0.00 H new ATOM 0 HB2 LEU A 750 24.273 -11.113 -24.527 1.00 0.00 H new ATOM 0 HB3 LEU A 750 23.266 -9.687 -24.685 1.00 0.00 H new ATOM 0 HG LEU A 750 21.281 -11.241 -24.970 1.00 0.00 H new ATOM 0 HD11 LEU A 750 21.502 -13.524 -24.117 1.00 0.00 H new ATOM 0 HD12 LEU A 750 22.461 -13.268 -25.594 1.00 0.00 H new ATOM 0 HD13 LEU A 750 23.265 -13.311 -24.007 1.00 0.00 H new ATOM 0 HD21 LEU A 750 21.128 -11.662 -22.539 1.00 0.00 H new ATOM 0 HD22 LEU A 750 22.872 -11.348 -22.382 1.00 0.00 H new ATOM 0 HD23 LEU A 750 21.774 -10.041 -22.887 1.00 0.00 H new ATOM 529 N ASN A 751 23.820 -8.813 -27.887 1.00 0.00 N ATOM 530 CA ASN A 751 24.516 -7.621 -28.356 1.00 0.00 C ATOM 531 C ASN A 751 24.186 -6.432 -27.459 1.00 0.00 C ATOM 532 O ASN A 751 23.463 -6.577 -26.474 1.00 0.00 O ATOM 533 CB ASN A 751 24.190 -7.321 -29.829 1.00 0.00 C ATOM 534 CG ASN A 751 22.722 -7.475 -30.154 1.00 0.00 C ATOM 535 OD1 ASN A 751 22.275 -8.559 -30.522 1.00 0.00 O ATOM 536 ND2 ASN A 751 21.967 -6.396 -30.043 1.00 0.00 N ATOM 0 H ASN A 751 22.920 -8.986 -28.335 1.00 0.00 H new ATOM 0 HA ASN A 751 25.589 -7.807 -28.299 1.00 0.00 H new ATOM 0 HB2 ASN A 751 24.504 -6.304 -30.065 1.00 0.00 H new ATOM 0 HB3 ASN A 751 24.769 -7.989 -30.467 1.00 0.00 H new ATOM 0 HD21 ASN A 751 20.973 -6.444 -30.267 1.00 0.00 H new ATOM 0 HD22 ASN A 751 22.378 -5.515 -29.734 1.00 0.00 H new ATOM 543 N SER A 752 24.715 -5.264 -27.800 1.00 0.00 N ATOM 544 CA SER A 752 24.648 -4.088 -26.937 1.00 0.00 C ATOM 545 C SER A 752 23.217 -3.776 -26.475 1.00 0.00 C ATOM 546 O SER A 752 22.987 -3.520 -25.293 1.00 0.00 O ATOM 547 CB SER A 752 25.247 -2.892 -27.674 1.00 0.00 C ATOM 548 OG SER A 752 26.507 -3.238 -28.235 1.00 0.00 O ATOM 0 H SER A 752 25.203 -5.103 -28.681 1.00 0.00 H new ATOM 0 HA SER A 752 25.224 -4.299 -26.036 1.00 0.00 H new ATOM 0 HB2 SER A 752 24.568 -2.565 -28.462 1.00 0.00 H new ATOM 0 HB3 SER A 752 25.365 -2.055 -26.986 1.00 0.00 H new ATOM 0 HG SER A 752 26.879 -2.463 -28.706 1.00 0.00 H new ATOM 554 N HIS A 753 22.263 -3.817 -27.399 1.00 0.00 N ATOM 555 CA HIS A 753 20.867 -3.531 -27.067 1.00 0.00 C ATOM 556 C HIS A 753 20.278 -4.597 -26.144 1.00 0.00 C ATOM 557 O HIS A 753 19.546 -4.280 -25.205 1.00 0.00 O ATOM 558 CB HIS A 753 20.022 -3.404 -28.341 1.00 0.00 C ATOM 559 CG HIS A 753 20.364 -2.201 -29.168 1.00 0.00 C ATOM 560 ND1 HIS A 753 20.394 -2.193 -30.546 1.00 0.00 N ATOM 561 CD2 HIS A 753 20.681 -0.939 -28.781 1.00 0.00 C ATOM 562 CE1 HIS A 753 20.726 -0.957 -30.943 1.00 0.00 C ATOM 563 NE2 HIS A 753 20.910 -0.158 -29.909 1.00 0.00 N ATOM 0 H HIS A 753 22.427 -4.044 -28.380 1.00 0.00 H new ATOM 0 HA HIS A 753 20.846 -2.580 -26.535 1.00 0.00 H new ATOM 0 HB2 HIS A 753 20.155 -4.301 -28.946 1.00 0.00 H new ATOM 0 HB3 HIS A 753 18.968 -3.358 -28.066 1.00 0.00 H new ATOM 0 HD2 HIS A 753 20.745 -0.596 -27.759 1.00 0.00 H new ATOM 0 HE1 HIS A 753 20.829 -0.654 -31.975 1.00 0.00 H new ATOM 0 HE2 HIS A 753 21.167 0.829 -29.932 1.00 0.00 H new ATOM 571 N ASP A 754 20.611 -5.856 -26.402 1.00 0.00 N ATOM 572 CA ASP A 754 20.127 -6.960 -25.575 1.00 0.00 C ATOM 573 C ASP A 754 20.728 -6.886 -24.182 1.00 0.00 C ATOM 574 O ASP A 754 20.041 -7.105 -23.184 1.00 0.00 O ATOM 575 CB ASP A 754 20.457 -8.308 -26.215 1.00 0.00 C ATOM 576 CG ASP A 754 19.681 -8.538 -27.492 1.00 0.00 C ATOM 577 OD1 ASP A 754 18.501 -8.930 -27.417 1.00 0.00 O ATOM 578 OD2 ASP A 754 20.241 -8.304 -28.577 1.00 0.00 O ATOM 0 H ASP A 754 21.213 -6.140 -27.175 1.00 0.00 H new ATOM 0 HA ASP A 754 19.043 -6.870 -25.498 1.00 0.00 H new ATOM 0 HB2 ASP A 754 21.525 -8.356 -26.427 1.00 0.00 H new ATOM 0 HB3 ASP A 754 20.236 -9.108 -25.508 1.00 0.00 H new ATOM 583 N ARG A 755 22.013 -6.568 -24.116 1.00 0.00 N ATOM 584 CA ARG A 755 22.687 -6.420 -22.835 1.00 0.00 C ATOM 585 C ARG A 755 22.089 -5.252 -22.066 1.00 0.00 C ATOM 586 O ARG A 755 21.886 -5.344 -20.861 1.00 0.00 O ATOM 587 CB ARG A 755 24.198 -6.244 -23.028 1.00 0.00 C ATOM 588 CG ARG A 755 24.832 -7.412 -23.766 1.00 0.00 C ATOM 589 CD ARG A 755 26.352 -7.381 -23.736 1.00 0.00 C ATOM 590 NE ARG A 755 26.907 -6.316 -24.573 1.00 0.00 N ATOM 591 CZ ARG A 755 27.637 -6.531 -25.676 1.00 0.00 C ATOM 592 NH1 ARG A 755 27.805 -7.764 -26.145 1.00 0.00 N ATOM 593 NH2 ARG A 755 28.181 -5.504 -26.325 1.00 0.00 N ATOM 0 H ARG A 755 22.607 -6.408 -24.930 1.00 0.00 H new ATOM 0 HA ARG A 755 22.537 -7.329 -22.252 1.00 0.00 H new ATOM 0 HB2 ARG A 755 24.385 -5.324 -23.582 1.00 0.00 H new ATOM 0 HB3 ARG A 755 24.675 -6.132 -22.054 1.00 0.00 H new ATOM 0 HG2 ARG A 755 24.485 -8.346 -23.323 1.00 0.00 H new ATOM 0 HG3 ARG A 755 24.495 -7.406 -24.802 1.00 0.00 H new ATOM 0 HD2 ARG A 755 26.689 -7.244 -22.709 1.00 0.00 H new ATOM 0 HD3 ARG A 755 26.739 -8.343 -24.073 1.00 0.00 H new ATOM 0 HE ARG A 755 26.727 -5.350 -24.300 1.00 0.00 H new ATOM 0 HH11 ARG A 755 27.377 -8.555 -25.664 1.00 0.00 H new ATOM 0 HH12 ARG A 755 28.362 -7.919 -26.985 1.00 0.00 H new ATOM 0 HH21 ARG A 755 28.042 -4.553 -25.983 1.00 0.00 H new ATOM 0 HH22 ARG A 755 28.737 -5.668 -27.165 1.00 0.00 H new ATOM 607 N LEU A 756 21.773 -4.176 -22.784 1.00 0.00 N ATOM 608 CA LEU A 756 21.118 -3.009 -22.196 1.00 0.00 C ATOM 609 C LEU A 756 19.838 -3.412 -21.473 1.00 0.00 C ATOM 610 O LEU A 756 19.586 -2.969 -20.353 1.00 0.00 O ATOM 611 CB LEU A 756 20.802 -1.977 -23.282 1.00 0.00 C ATOM 612 CG LEU A 756 20.038 -0.740 -22.810 1.00 0.00 C ATOM 613 CD1 LEU A 756 20.870 0.068 -21.829 1.00 0.00 C ATOM 614 CD2 LEU A 756 19.630 0.114 -23.999 1.00 0.00 C ATOM 0 H LEU A 756 21.962 -4.088 -23.782 1.00 0.00 H new ATOM 0 HA LEU A 756 21.800 -2.566 -21.470 1.00 0.00 H new ATOM 0 HB2 LEU A 756 21.739 -1.653 -23.735 1.00 0.00 H new ATOM 0 HB3 LEU A 756 20.221 -2.465 -24.065 1.00 0.00 H new ATOM 0 HG LEU A 756 19.136 -1.070 -22.294 1.00 0.00 H new ATOM 0 HD11 LEU A 756 20.305 0.943 -21.507 1.00 0.00 H new ATOM 0 HD12 LEU A 756 21.110 -0.548 -20.962 1.00 0.00 H new ATOM 0 HD13 LEU A 756 21.793 0.389 -22.313 1.00 0.00 H new ATOM 0 HD21 LEU A 756 19.087 0.991 -23.648 1.00 0.00 H new ATOM 0 HD22 LEU A 756 20.520 0.432 -24.541 1.00 0.00 H new ATOM 0 HD23 LEU A 756 18.990 -0.468 -24.662 1.00 0.00 H new ATOM 626 N ARG A 757 19.037 -4.257 -22.118 1.00 0.00 N ATOM 627 CA ARG A 757 17.833 -4.796 -21.494 1.00 0.00 C ATOM 628 C ARG A 757 18.175 -5.478 -20.179 1.00 0.00 C ATOM 629 O ARG A 757 17.565 -5.198 -19.150 1.00 0.00 O ATOM 630 CB ARG A 757 17.139 -5.786 -22.433 1.00 0.00 C ATOM 631 CG ARG A 757 16.355 -5.119 -23.547 1.00 0.00 C ATOM 632 CD ARG A 757 15.049 -4.539 -23.030 1.00 0.00 C ATOM 633 NE ARG A 757 14.446 -3.614 -23.986 1.00 0.00 N ATOM 634 CZ ARG A 757 13.258 -3.785 -24.566 1.00 0.00 C ATOM 635 NH1 ARG A 757 12.535 -4.879 -24.337 1.00 0.00 N ATOM 636 NH2 ARG A 757 12.791 -2.854 -25.387 1.00 0.00 N ATOM 0 H ARG A 757 19.200 -4.582 -23.071 1.00 0.00 H new ATOM 0 HA ARG A 757 17.153 -3.968 -21.293 1.00 0.00 H new ATOM 0 HB2 ARG A 757 17.889 -6.444 -22.872 1.00 0.00 H new ATOM 0 HB3 ARG A 757 16.464 -6.414 -21.851 1.00 0.00 H new ATOM 0 HG2 ARG A 757 16.956 -4.327 -23.994 1.00 0.00 H new ATOM 0 HG3 ARG A 757 16.147 -5.844 -24.334 1.00 0.00 H new ATOM 0 HD2 ARG A 757 14.351 -5.349 -22.819 1.00 0.00 H new ATOM 0 HD3 ARG A 757 15.230 -4.021 -22.088 1.00 0.00 H new ATOM 0 HE ARG A 757 14.973 -2.775 -24.228 1.00 0.00 H new ATOM 0 HH11 ARG A 757 12.888 -5.602 -23.710 1.00 0.00 H new ATOM 0 HH12 ARG A 757 11.628 -4.995 -24.789 1.00 0.00 H new ATOM 0 HH21 ARG A 757 13.340 -2.014 -25.571 1.00 0.00 H new ATOM 0 HH22 ARG A 757 11.883 -2.978 -25.835 1.00 0.00 H new ATOM 650 N VAL A 758 19.168 -6.356 -20.216 1.00 0.00 N ATOM 651 CA VAL A 758 19.606 -7.068 -19.020 1.00 0.00 C ATOM 652 C VAL A 758 20.050 -6.090 -17.931 1.00 0.00 C ATOM 653 O VAL A 758 19.628 -6.208 -16.777 1.00 0.00 O ATOM 654 CB VAL A 758 20.761 -8.043 -19.334 1.00 0.00 C ATOM 655 CG1 VAL A 758 21.220 -8.756 -18.073 1.00 0.00 C ATOM 656 CG2 VAL A 758 20.340 -9.054 -20.388 1.00 0.00 C ATOM 0 H VAL A 758 19.687 -6.593 -21.061 1.00 0.00 H new ATOM 0 HA VAL A 758 18.752 -7.642 -18.660 1.00 0.00 H new ATOM 0 HB VAL A 758 21.596 -7.462 -19.726 1.00 0.00 H new ATOM 0 HG11 VAL A 758 22.034 -9.438 -18.317 1.00 0.00 H new ATOM 0 HG12 VAL A 758 21.567 -8.022 -17.346 1.00 0.00 H new ATOM 0 HG13 VAL A 758 20.388 -9.320 -17.651 1.00 0.00 H new ATOM 0 HG21 VAL A 758 21.169 -9.731 -20.594 1.00 0.00 H new ATOM 0 HG22 VAL A 758 19.486 -9.626 -20.024 1.00 0.00 H new ATOM 0 HG23 VAL A 758 20.062 -8.531 -21.303 1.00 0.00 H new ATOM 666 N HIS A 759 20.889 -5.122 -18.306 1.00 0.00 N ATOM 667 CA HIS A 759 21.372 -4.113 -17.365 1.00 0.00 C ATOM 668 C HIS A 759 20.206 -3.384 -16.712 1.00 0.00 C ATOM 669 O HIS A 759 20.121 -3.313 -15.490 1.00 0.00 O ATOM 670 CB HIS A 759 22.289 -3.087 -18.052 1.00 0.00 C ATOM 671 CG HIS A 759 23.636 -3.618 -18.451 1.00 0.00 C ATOM 672 ND1 HIS A 759 24.631 -3.824 -17.528 1.00 0.00 N ATOM 673 CD2 HIS A 759 24.103 -3.951 -19.679 1.00 0.00 C ATOM 674 CE1 HIS A 759 25.668 -4.274 -18.203 1.00 0.00 C ATOM 675 NE2 HIS A 759 25.398 -4.369 -19.511 1.00 0.00 N ATOM 0 H HIS A 759 21.247 -5.017 -19.255 1.00 0.00 H new ATOM 0 HA HIS A 759 21.948 -4.638 -16.603 1.00 0.00 H new ATOM 0 HB2 HIS A 759 21.785 -2.708 -18.941 1.00 0.00 H new ATOM 0 HB3 HIS A 759 22.432 -2.240 -17.381 1.00 0.00 H new ATOM 0 HD2 HIS A 759 23.560 -3.897 -20.611 1.00 0.00 H new ATOM 0 HE1 HIS A 759 26.617 -4.534 -17.758 1.00 0.00 H new ATOM 0 HE2 HIS A 759 26.033 -4.690 -20.242 1.00 0.00 H new ATOM 683 N GLN A 760 19.298 -2.867 -17.533 1.00 0.00 N ATOM 684 CA GLN A 760 18.156 -2.108 -17.040 1.00 0.00 C ATOM 685 C GLN A 760 17.275 -2.947 -16.115 1.00 0.00 C ATOM 686 O GLN A 760 16.810 -2.461 -15.083 1.00 0.00 O ATOM 687 CB GLN A 760 17.326 -1.585 -18.210 1.00 0.00 C ATOM 688 CG GLN A 760 18.027 -0.509 -19.021 1.00 0.00 C ATOM 689 CD GLN A 760 17.178 -0.006 -20.173 1.00 0.00 C ATOM 690 OE1 GLN A 760 16.373 -0.746 -20.739 1.00 0.00 O ATOM 691 NE2 GLN A 760 17.351 1.257 -20.528 1.00 0.00 N ATOM 0 H GLN A 760 19.332 -2.961 -18.548 1.00 0.00 H new ATOM 0 HA GLN A 760 18.544 -1.268 -16.464 1.00 0.00 H new ATOM 0 HB2 GLN A 760 17.075 -2.418 -18.867 1.00 0.00 H new ATOM 0 HB3 GLN A 760 16.386 -1.186 -17.828 1.00 0.00 H new ATOM 0 HG2 GLN A 760 18.280 0.326 -18.368 1.00 0.00 H new ATOM 0 HG3 GLN A 760 18.965 -0.905 -19.411 1.00 0.00 H new ATOM 0 HE21 GLN A 760 18.028 1.838 -20.034 1.00 0.00 H new ATOM 0 HE22 GLN A 760 16.807 1.650 -21.296 1.00 0.00 H new ATOM 700 N ILE A 761 17.053 -4.200 -16.488 1.00 0.00 N ATOM 701 CA ILE A 761 16.216 -5.097 -15.700 1.00 0.00 C ATOM 702 C ILE A 761 16.885 -5.454 -14.374 1.00 0.00 C ATOM 703 O ILE A 761 16.261 -5.377 -13.318 1.00 0.00 O ATOM 704 CB ILE A 761 15.875 -6.380 -16.491 1.00 0.00 C ATOM 705 CG1 ILE A 761 15.029 -6.022 -17.718 1.00 0.00 C ATOM 706 CG2 ILE A 761 15.138 -7.376 -15.603 1.00 0.00 C ATOM 707 CD1 ILE A 761 14.898 -7.152 -18.713 1.00 0.00 C ATOM 0 H ILE A 761 17.441 -4.620 -17.333 1.00 0.00 H new ATOM 0 HA ILE A 761 15.287 -4.570 -15.484 1.00 0.00 H new ATOM 0 HB ILE A 761 16.802 -6.847 -16.825 1.00 0.00 H new ATOM 0 HG12 ILE A 761 14.034 -5.722 -17.388 1.00 0.00 H new ATOM 0 HG13 ILE A 761 15.473 -5.160 -18.216 1.00 0.00 H new ATOM 0 HG21 ILE A 761 14.906 -8.273 -16.177 1.00 0.00 H new ATOM 0 HG22 ILE A 761 15.767 -7.641 -14.754 1.00 0.00 H new ATOM 0 HG23 ILE A 761 14.213 -6.927 -15.242 1.00 0.00 H new ATOM 0 HD11 ILE A 761 14.287 -6.827 -19.555 1.00 0.00 H new ATOM 0 HD12 ILE A 761 15.887 -7.437 -19.072 1.00 0.00 H new ATOM 0 HD13 ILE A 761 14.426 -8.008 -18.231 1.00 0.00 H new ATOM 719 N ALA A 762 18.164 -5.814 -14.422 1.00 0.00 N ATOM 720 CA ALA A 762 18.911 -6.138 -13.210 1.00 0.00 C ATOM 721 C ALA A 762 19.008 -4.910 -12.313 1.00 0.00 C ATOM 722 O ALA A 762 18.951 -5.007 -11.086 1.00 0.00 O ATOM 723 CB ALA A 762 20.296 -6.662 -13.563 1.00 0.00 C ATOM 0 H ALA A 762 18.704 -5.889 -15.284 1.00 0.00 H new ATOM 0 HA ALA A 762 18.382 -6.921 -12.668 1.00 0.00 H new ATOM 0 HB1 ALA A 762 20.840 -6.899 -12.648 1.00 0.00 H new ATOM 0 HB2 ALA A 762 20.201 -7.561 -14.171 1.00 0.00 H new ATOM 0 HB3 ALA A 762 20.841 -5.902 -14.122 1.00 0.00 H new ATOM 729 N GLU A 763 19.130 -3.756 -12.949 1.00 0.00 N ATOM 730 CA GLU A 763 19.162 -2.474 -12.261 1.00 0.00 C ATOM 731 C GLU A 763 17.833 -2.222 -11.541 1.00 0.00 C ATOM 732 O GLU A 763 17.803 -1.731 -10.413 1.00 0.00 O ATOM 733 CB GLU A 763 19.451 -1.379 -13.294 1.00 0.00 C ATOM 734 CG GLU A 763 19.694 0.008 -12.729 1.00 0.00 C ATOM 735 CD GLU A 763 20.179 0.966 -13.802 1.00 0.00 C ATOM 736 OE1 GLU A 763 19.370 1.375 -14.663 1.00 0.00 O ATOM 737 OE2 GLU A 763 21.381 1.306 -13.805 1.00 0.00 O ATOM 0 H GLU A 763 19.210 -3.681 -13.963 1.00 0.00 H new ATOM 0 HA GLU A 763 19.946 -2.472 -11.504 1.00 0.00 H new ATOM 0 HB2 GLU A 763 20.325 -1.674 -13.874 1.00 0.00 H new ATOM 0 HB3 GLU A 763 18.611 -1.327 -13.987 1.00 0.00 H new ATOM 0 HG2 GLU A 763 18.773 0.389 -12.288 1.00 0.00 H new ATOM 0 HG3 GLU A 763 20.432 -0.048 -11.928 1.00 0.00 H new ATOM 744 N GLU A 764 16.739 -2.589 -12.198 1.00 0.00 N ATOM 745 CA GLU A 764 15.407 -2.444 -11.625 1.00 0.00 C ATOM 746 C GLU A 764 15.214 -3.401 -10.448 1.00 0.00 C ATOM 747 O GLU A 764 14.708 -3.014 -9.396 1.00 0.00 O ATOM 748 CB GLU A 764 14.341 -2.722 -12.689 1.00 0.00 C ATOM 749 CG GLU A 764 12.922 -2.437 -12.222 1.00 0.00 C ATOM 750 CD GLU A 764 11.876 -3.044 -13.130 1.00 0.00 C ATOM 751 OE1 GLU A 764 11.799 -2.651 -14.310 1.00 0.00 O ATOM 752 OE2 GLU A 764 11.123 -3.926 -12.666 1.00 0.00 O ATOM 0 H GLU A 764 16.750 -2.992 -13.135 1.00 0.00 H new ATOM 0 HA GLU A 764 15.303 -1.420 -11.266 1.00 0.00 H new ATOM 0 HB2 GLU A 764 14.553 -2.116 -13.570 1.00 0.00 H new ATOM 0 HB3 GLU A 764 14.410 -3.766 -12.996 1.00 0.00 H new ATOM 0 HG2 GLU A 764 12.791 -2.826 -11.212 1.00 0.00 H new ATOM 0 HG3 GLU A 764 12.771 -1.359 -12.170 1.00 0.00 H new ATOM 759 N HIS A 765 15.638 -4.647 -10.631 1.00 0.00 N ATOM 760 CA HIS A 765 15.457 -5.684 -9.613 1.00 0.00 C ATOM 761 C HIS A 765 16.415 -5.493 -8.439 1.00 0.00 C ATOM 762 O HIS A 765 16.171 -5.998 -7.340 1.00 0.00 O ATOM 763 CB HIS A 765 15.644 -7.079 -10.223 1.00 0.00 C ATOM 764 CG HIS A 765 14.490 -7.526 -11.073 1.00 0.00 C ATOM 765 ND1 HIS A 765 13.658 -8.573 -10.745 1.00 0.00 N ATOM 766 CD2 HIS A 765 14.040 -7.053 -12.261 1.00 0.00 C ATOM 767 CE1 HIS A 765 12.752 -8.702 -11.722 1.00 0.00 C ATOM 768 NE2 HIS A 765 12.938 -7.803 -12.665 1.00 0.00 N ATOM 0 H HIS A 765 16.111 -4.967 -11.476 1.00 0.00 H new ATOM 0 HA HIS A 765 14.439 -5.595 -9.235 1.00 0.00 H new ATOM 0 HB2 HIS A 765 16.551 -7.083 -10.827 1.00 0.00 H new ATOM 0 HB3 HIS A 765 15.793 -7.800 -9.419 1.00 0.00 H new ATOM 0 HD2 HIS A 765 14.468 -6.226 -12.808 1.00 0.00 H new ATOM 0 HE1 HIS A 765 11.970 -9.447 -11.735 1.00 0.00 H new ATOM 0 HE2 HIS A 765 12.389 -7.681 -13.516 1.00 0.00 H new ATOM 776 N GLY A 766 17.503 -4.771 -8.671 1.00 0.00 N ATOM 777 CA GLY A 766 18.451 -4.484 -7.608 1.00 0.00 C ATOM 778 C GLY A 766 19.536 -5.534 -7.509 1.00 0.00 C ATOM 779 O GLY A 766 19.941 -5.926 -6.411 1.00 0.00 O ATOM 0 H GLY A 766 17.748 -4.377 -9.579 1.00 0.00 H new ATOM 0 HA2 GLY A 766 18.906 -3.509 -7.783 1.00 0.00 H new ATOM 0 HA3 GLY A 766 17.921 -4.422 -6.658 1.00 0.00 H new ATOM 783 N LEU A 767 19.998 -6.000 -8.657 1.00 0.00 N ATOM 784 CA LEU A 767 21.059 -6.990 -8.710 1.00 0.00 C ATOM 785 C LEU A 767 22.322 -6.356 -9.275 1.00 0.00 C ATOM 786 O LEU A 767 22.286 -5.233 -9.782 1.00 0.00 O ATOM 787 CB LEU A 767 20.632 -8.179 -9.577 1.00 0.00 C ATOM 788 CG LEU A 767 19.310 -8.842 -9.175 1.00 0.00 C ATOM 789 CD1 LEU A 767 18.942 -9.937 -10.159 1.00 0.00 C ATOM 790 CD2 LEU A 767 19.403 -9.409 -7.767 1.00 0.00 C ATOM 0 H LEU A 767 19.652 -5.706 -9.570 1.00 0.00 H new ATOM 0 HA LEU A 767 21.260 -7.351 -7.701 1.00 0.00 H new ATOM 0 HB2 LEU A 767 20.551 -7.843 -10.611 1.00 0.00 H new ATOM 0 HB3 LEU A 767 21.420 -8.931 -9.547 1.00 0.00 H new ATOM 0 HG LEU A 767 18.528 -8.083 -9.192 1.00 0.00 H new ATOM 0 HD11 LEU A 767 18.001 -10.396 -9.857 1.00 0.00 H new ATOM 0 HD12 LEU A 767 18.834 -9.509 -11.156 1.00 0.00 H new ATOM 0 HD13 LEU A 767 19.727 -10.693 -10.172 1.00 0.00 H new ATOM 0 HD21 LEU A 767 18.455 -9.876 -7.499 1.00 0.00 H new ATOM 0 HD22 LEU A 767 20.198 -10.153 -7.726 1.00 0.00 H new ATOM 0 HD23 LEU A 767 19.623 -8.605 -7.065 1.00 0.00 H new ATOM 802 N ARG A 768 23.433 -7.068 -9.190 1.00 0.00 N ATOM 803 CA ARG A 768 24.686 -6.582 -9.744 1.00 0.00 C ATOM 804 C ARG A 768 24.819 -7.041 -11.185 1.00 0.00 C ATOM 805 O ARG A 768 24.611 -8.210 -11.490 1.00 0.00 O ATOM 806 CB ARG A 768 25.875 -7.091 -8.930 1.00 0.00 C ATOM 807 CG ARG A 768 27.218 -6.590 -9.441 1.00 0.00 C ATOM 808 CD ARG A 768 28.384 -7.220 -8.697 1.00 0.00 C ATOM 809 NE ARG A 768 28.368 -6.918 -7.265 1.00 0.00 N ATOM 810 CZ ARG A 768 29.299 -7.342 -6.410 1.00 0.00 C ATOM 811 NH1 ARG A 768 30.341 -8.039 -6.849 1.00 0.00 N ATOM 812 NH2 ARG A 768 29.191 -7.065 -5.115 1.00 0.00 N ATOM 0 H ARG A 768 23.493 -7.983 -8.744 1.00 0.00 H new ATOM 0 HA ARG A 768 24.682 -5.493 -9.704 1.00 0.00 H new ATOM 0 HB2 ARG A 768 25.753 -6.784 -7.891 1.00 0.00 H new ATOM 0 HB3 ARG A 768 25.874 -8.181 -8.942 1.00 0.00 H new ATOM 0 HG2 ARG A 768 27.306 -6.811 -10.505 1.00 0.00 H new ATOM 0 HG3 ARG A 768 27.264 -5.506 -9.335 1.00 0.00 H new ATOM 0 HD2 ARG A 768 28.358 -8.301 -8.837 1.00 0.00 H new ATOM 0 HD3 ARG A 768 29.320 -6.865 -9.129 1.00 0.00 H new ATOM 0 HE ARG A 768 27.602 -6.352 -6.901 1.00 0.00 H new ATOM 0 HH11 ARG A 768 30.431 -8.251 -7.843 1.00 0.00 H new ATOM 0 HH12 ARG A 768 31.052 -8.362 -6.192 1.00 0.00 H new ATOM 0 HH21 ARG A 768 28.395 -6.527 -4.773 1.00 0.00 H new ATOM 0 HH22 ARG A 768 29.904 -7.390 -4.463 1.00 0.00 H new ATOM 826 N HIS A 769 25.167 -6.126 -12.067 1.00 0.00 N ATOM 827 CA HIS A 769 25.282 -6.439 -13.480 1.00 0.00 C ATOM 828 C HIS A 769 26.505 -5.764 -14.076 1.00 0.00 C ATOM 829 O HIS A 769 26.798 -4.606 -13.769 1.00 0.00 O ATOM 830 CB HIS A 769 24.009 -6.021 -14.232 1.00 0.00 C ATOM 831 CG HIS A 769 23.532 -4.632 -13.912 1.00 0.00 C ATOM 832 ND1 HIS A 769 23.706 -3.596 -14.789 1.00 0.00 N ATOM 833 CD2 HIS A 769 22.889 -4.173 -12.810 1.00 0.00 C ATOM 834 CE1 HIS A 769 23.172 -2.536 -14.218 1.00 0.00 C ATOM 835 NE2 HIS A 769 22.664 -2.835 -13.014 1.00 0.00 N ATOM 0 H HIS A 769 25.376 -5.156 -11.831 1.00 0.00 H new ATOM 0 HA HIS A 769 25.401 -7.517 -13.586 1.00 0.00 H new ATOM 0 HB2 HIS A 769 24.194 -6.091 -15.304 1.00 0.00 H new ATOM 0 HB3 HIS A 769 23.214 -6.729 -13.999 1.00 0.00 H new ATOM 0 HD1 HIS A 769 24.159 -3.637 -15.702 1.00 0.00 H new ATOM 0 HD2 HIS A 769 22.608 -4.749 -11.940 1.00 0.00 H new ATOM 0 HE1 HIS A 769 23.147 -1.552 -14.663 1.00 0.00 H new ATOM 843 N ASP A 770 27.236 -6.507 -14.894 1.00 0.00 N ATOM 844 CA ASP A 770 28.411 -5.971 -15.572 1.00 0.00 C ATOM 845 C ASP A 770 28.798 -6.854 -16.744 1.00 0.00 C ATOM 846 O ASP A 770 28.589 -8.068 -16.717 1.00 0.00 O ATOM 847 CB ASP A 770 29.590 -5.845 -14.598 1.00 0.00 C ATOM 848 CG ASP A 770 30.846 -5.312 -15.261 1.00 0.00 C ATOM 849 OD1 ASP A 770 30.775 -4.252 -15.923 1.00 0.00 O ATOM 850 OD2 ASP A 770 31.912 -5.946 -15.117 1.00 0.00 O ATOM 0 H ASP A 770 27.037 -7.485 -15.106 1.00 0.00 H new ATOM 0 HA ASP A 770 28.162 -4.978 -15.947 1.00 0.00 H new ATOM 0 HB2 ASP A 770 29.309 -5.184 -13.778 1.00 0.00 H new ATOM 0 HB3 ASP A 770 29.801 -6.821 -14.162 1.00 0.00 H new ATOM 855 N SER A 771 29.337 -6.239 -17.781 1.00 0.00 N ATOM 856 CA SER A 771 29.785 -6.971 -18.944 1.00 0.00 C ATOM 857 C SER A 771 31.302 -6.959 -19.021 1.00 0.00 C ATOM 858 O SER A 771 31.940 -5.937 -18.768 1.00 0.00 O ATOM 859 CB SER A 771 29.197 -6.360 -20.206 1.00 0.00 C ATOM 860 OG SER A 771 27.802 -6.150 -20.074 1.00 0.00 O ATOM 0 H SER A 771 29.474 -5.230 -17.838 1.00 0.00 H new ATOM 0 HA SER A 771 29.445 -8.003 -18.858 1.00 0.00 H new ATOM 0 HB2 SER A 771 29.691 -5.412 -20.418 1.00 0.00 H new ATOM 0 HB3 SER A 771 29.390 -7.017 -21.054 1.00 0.00 H new ATOM 0 HG SER A 771 27.398 -6.065 -20.963 1.00 0.00 H new ATOM 866 N SER A 772 31.872 -8.090 -19.378 1.00 0.00 N ATOM 867 CA SER A 772 33.311 -8.220 -19.453 1.00 0.00 C ATOM 868 C SER A 772 33.711 -8.641 -20.860 1.00 0.00 C ATOM 869 O SER A 772 32.915 -9.249 -21.584 1.00 0.00 O ATOM 870 CB SER A 772 33.804 -9.239 -18.420 1.00 0.00 C ATOM 871 OG SER A 772 35.194 -9.098 -18.180 1.00 0.00 O ATOM 0 H SER A 772 31.358 -8.936 -19.622 1.00 0.00 H new ATOM 0 HA SER A 772 33.774 -7.259 -19.229 1.00 0.00 H new ATOM 0 HB2 SER A 772 33.257 -9.108 -17.487 1.00 0.00 H new ATOM 0 HB3 SER A 772 33.594 -10.249 -18.773 1.00 0.00 H new ATOM 0 HG SER A 772 35.480 -9.760 -17.516 1.00 0.00 H new ATOM 877 N GLY A 773 34.929 -8.306 -21.250 1.00 0.00 N ATOM 878 CA GLY A 773 35.380 -8.604 -22.590 1.00 0.00 C ATOM 879 C GLY A 773 35.015 -7.508 -23.568 1.00 0.00 C ATOM 880 O GLY A 773 34.504 -6.458 -23.172 1.00 0.00 O ATOM 0 H GLY A 773 35.614 -7.832 -20.661 1.00 0.00 H new ATOM 0 HA2 GLY A 773 36.461 -8.741 -22.586 1.00 0.00 H new ATOM 0 HA3 GLY A 773 34.940 -9.545 -22.920 1.00 0.00 H new ATOM 884 N GLU A 774 35.280 -7.748 -24.843 1.00 0.00 N ATOM 885 CA GLU A 774 34.947 -6.804 -25.902 1.00 0.00 C ATOM 886 C GLU A 774 34.573 -7.536 -27.182 1.00 0.00 C ATOM 887 O GLU A 774 34.745 -8.755 -27.288 1.00 0.00 O ATOM 888 CB GLU A 774 36.115 -5.860 -26.173 1.00 0.00 C ATOM 889 CG GLU A 774 36.160 -4.660 -25.242 1.00 0.00 C ATOM 890 CD GLU A 774 35.130 -3.600 -25.599 1.00 0.00 C ATOM 891 OE1 GLU A 774 33.912 -3.855 -25.452 1.00 0.00 O ATOM 892 OE2 GLU A 774 35.535 -2.503 -26.041 1.00 0.00 O ATOM 0 H GLU A 774 35.731 -8.601 -25.174 1.00 0.00 H new ATOM 0 HA GLU A 774 34.090 -6.219 -25.567 1.00 0.00 H new ATOM 0 HB2 GLU A 774 37.048 -6.415 -26.081 1.00 0.00 H new ATOM 0 HB3 GLU A 774 36.054 -5.508 -27.203 1.00 0.00 H new ATOM 0 HG2 GLU A 774 35.992 -4.994 -24.218 1.00 0.00 H new ATOM 0 HG3 GLU A 774 37.156 -4.218 -25.274 1.00 0.00 H new ATOM 899 N GLY A 775 34.061 -6.784 -28.145 1.00 0.00 N ATOM 900 CA GLY A 775 33.696 -7.342 -29.430 1.00 0.00 C ATOM 901 C GLY A 775 32.597 -8.376 -29.326 1.00 0.00 C ATOM 902 O GLY A 775 31.602 -8.175 -28.628 1.00 0.00 O ATOM 0 H GLY A 775 33.890 -5.782 -28.056 1.00 0.00 H new ATOM 0 HA2 GLY A 775 33.372 -6.539 -30.092 1.00 0.00 H new ATOM 0 HA3 GLY A 775 34.575 -7.797 -29.887 1.00 0.00 H new ATOM 906 N LYS A 776 32.798 -9.498 -29.999 1.00 0.00 N ATOM 907 CA LYS A 776 31.800 -10.558 -30.049 1.00 0.00 C ATOM 908 C LYS A 776 31.921 -11.472 -28.834 1.00 0.00 C ATOM 909 O LYS A 776 31.145 -12.412 -28.676 1.00 0.00 O ATOM 910 CB LYS A 776 31.967 -11.379 -31.329 1.00 0.00 C ATOM 911 CG LYS A 776 31.983 -10.538 -32.596 1.00 0.00 C ATOM 912 CD LYS A 776 32.189 -11.398 -33.830 1.00 0.00 C ATOM 913 CE LYS A 776 32.367 -10.546 -35.074 1.00 0.00 C ATOM 914 NZ LYS A 776 32.560 -11.373 -36.291 1.00 0.00 N ATOM 0 H LYS A 776 33.650 -9.700 -30.522 1.00 0.00 H new ATOM 0 HA LYS A 776 30.813 -10.097 -30.042 1.00 0.00 H new ATOM 0 HB2 LYS A 776 32.896 -11.946 -31.268 1.00 0.00 H new ATOM 0 HB3 LYS A 776 31.155 -12.103 -31.394 1.00 0.00 H new ATOM 0 HG2 LYS A 776 31.044 -9.992 -32.684 1.00 0.00 H new ATOM 0 HG3 LYS A 776 32.778 -9.795 -32.531 1.00 0.00 H new ATOM 0 HD2 LYS A 776 33.065 -12.031 -33.692 1.00 0.00 H new ATOM 0 HD3 LYS A 776 31.334 -12.061 -33.960 1.00 0.00 H new ATOM 0 HE2 LYS A 776 31.493 -9.908 -35.204 1.00 0.00 H new ATOM 0 HE3 LYS A 776 33.226 -9.888 -34.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 776 32.678 -10.753 -37.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 776 33.408 -11.964 -36.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 776 31.729 -11.983 -36.432 1.00 0.00 H new ATOM 928 N ARG A 777 32.898 -11.196 -27.983 1.00 0.00 N ATOM 929 CA ARG A 777 33.122 -12.002 -26.794 1.00 0.00 C ATOM 930 C ARG A 777 32.831 -11.208 -25.532 1.00 0.00 C ATOM 931 O ARG A 777 33.179 -11.632 -24.431 1.00 0.00 O ATOM 932 CB ARG A 777 34.554 -12.539 -26.764 1.00 0.00 C ATOM 933 CG ARG A 777 34.784 -13.681 -27.735 1.00 0.00 C ATOM 934 CD ARG A 777 36.185 -14.251 -27.605 1.00 0.00 C ATOM 935 NE ARG A 777 36.341 -15.481 -28.376 1.00 0.00 N ATOM 936 CZ ARG A 777 37.512 -16.058 -28.641 1.00 0.00 C ATOM 937 NH1 ARG A 777 38.649 -15.502 -28.226 1.00 0.00 N ATOM 938 NH2 ARG A 777 37.541 -17.191 -29.332 1.00 0.00 N ATOM 0 H ARG A 777 33.549 -10.419 -28.095 1.00 0.00 H new ATOM 0 HA ARG A 777 32.435 -12.847 -26.832 1.00 0.00 H new ATOM 0 HB2 ARG A 777 35.244 -11.728 -26.997 1.00 0.00 H new ATOM 0 HB3 ARG A 777 34.788 -12.877 -25.754 1.00 0.00 H new ATOM 0 HG2 ARG A 777 34.052 -14.468 -27.552 1.00 0.00 H new ATOM 0 HG3 ARG A 777 34.627 -13.330 -28.755 1.00 0.00 H new ATOM 0 HD2 ARG A 777 36.911 -13.513 -27.946 1.00 0.00 H new ATOM 0 HD3 ARG A 777 36.401 -14.450 -26.555 1.00 0.00 H new ATOM 0 HE ARG A 777 35.498 -15.928 -28.735 1.00 0.00 H new ATOM 0 HH11 ARG A 777 38.627 -14.628 -27.701 1.00 0.00 H new ATOM 0 HH12 ARG A 777 39.541 -15.950 -28.433 1.00 0.00 H new ATOM 0 HH21 ARG A 777 36.671 -17.613 -29.656 1.00 0.00 H new ATOM 0 HH22 ARG A 777 38.433 -17.639 -29.539 1.00 0.00 H new ATOM 952 N ARG A 778 32.203 -10.051 -25.688 1.00 0.00 N ATOM 953 CA ARG A 778 31.759 -9.293 -24.536 1.00 0.00 C ATOM 954 C ARG A 778 30.438 -9.844 -24.031 1.00 0.00 C ATOM 955 O ARG A 778 29.407 -9.748 -24.703 1.00 0.00 O ATOM 956 CB ARG A 778 31.625 -7.807 -24.856 1.00 0.00 C ATOM 957 CG ARG A 778 31.250 -6.976 -23.643 1.00 0.00 C ATOM 958 CD ARG A 778 31.471 -5.497 -23.893 1.00 0.00 C ATOM 959 NE ARG A 778 31.157 -4.692 -22.712 1.00 0.00 N ATOM 960 CZ ARG A 778 31.805 -3.575 -22.372 1.00 0.00 C ATOM 961 NH1 ARG A 778 32.825 -3.140 -23.104 1.00 0.00 N ATOM 962 NH2 ARG A 778 31.440 -2.902 -21.285 1.00 0.00 N ATOM 0 H ARG A 778 31.993 -9.624 -26.590 1.00 0.00 H new ATOM 0 HA ARG A 778 32.514 -9.395 -23.757 1.00 0.00 H new ATOM 0 HB2 ARG A 778 32.567 -7.441 -25.264 1.00 0.00 H new ATOM 0 HB3 ARG A 778 30.869 -7.673 -25.630 1.00 0.00 H new ATOM 0 HG2 ARG A 778 30.204 -7.151 -23.390 1.00 0.00 H new ATOM 0 HG3 ARG A 778 31.843 -7.294 -22.785 1.00 0.00 H new ATOM 0 HD2 ARG A 778 32.508 -5.329 -24.182 1.00 0.00 H new ATOM 0 HD3 ARG A 778 30.851 -5.173 -24.729 1.00 0.00 H new ATOM 0 HE ARG A 778 30.395 -5.004 -22.110 1.00 0.00 H new ATOM 0 HH11 ARG A 778 33.117 -3.660 -23.931 1.00 0.00 H new ATOM 0 HH12 ARG A 778 33.316 -2.286 -22.839 1.00 0.00 H new ATOM 0 HH21 ARG A 778 30.666 -3.239 -20.712 1.00 0.00 H new ATOM 0 HH22 ARG A 778 31.934 -2.049 -21.024 1.00 0.00 H new ATOM 976 N PHE A 779 30.482 -10.416 -22.848 1.00 0.00 N ATOM 977 CA PHE A 779 29.318 -11.056 -22.262 1.00 0.00 C ATOM 978 C PHE A 779 28.948 -10.363 -20.961 1.00 0.00 C ATOM 979 O PHE A 779 29.774 -9.672 -20.362 1.00 0.00 O ATOM 980 CB PHE A 779 29.581 -12.549 -22.021 1.00 0.00 C ATOM 981 CG PHE A 779 30.721 -12.826 -21.078 1.00 0.00 C ATOM 982 CD1 PHE A 779 32.024 -12.891 -21.544 1.00 0.00 C ATOM 983 CD2 PHE A 779 30.488 -13.016 -19.725 1.00 0.00 C ATOM 984 CE1 PHE A 779 33.073 -13.142 -20.682 1.00 0.00 C ATOM 985 CE2 PHE A 779 31.531 -13.268 -18.858 1.00 0.00 C ATOM 986 CZ PHE A 779 32.826 -13.328 -19.335 1.00 0.00 C ATOM 0 H PHE A 779 31.319 -10.452 -22.266 1.00 0.00 H new ATOM 0 HA PHE A 779 28.484 -10.969 -22.959 1.00 0.00 H new ATOM 0 HB2 PHE A 779 28.675 -13.007 -21.624 1.00 0.00 H new ATOM 0 HB3 PHE A 779 29.789 -13.030 -22.977 1.00 0.00 H new ATOM 0 HD1 PHE A 779 32.222 -12.743 -22.595 1.00 0.00 H new ATOM 0 HD2 PHE A 779 29.478 -12.966 -19.345 1.00 0.00 H new ATOM 0 HE1 PHE A 779 34.084 -13.193 -21.059 1.00 0.00 H new ATOM 0 HE2 PHE A 779 31.335 -13.418 -17.807 1.00 0.00 H new ATOM 0 HZ PHE A 779 33.644 -13.520 -18.656 1.00 0.00 H new ATOM 996 N ILE A 780 27.717 -10.550 -20.520 1.00 0.00 N ATOM 997 CA ILE A 780 27.236 -9.878 -19.329 1.00 0.00 C ATOM 998 C ILE A 780 26.934 -10.880 -18.219 1.00 0.00 C ATOM 999 O ILE A 780 26.325 -11.923 -18.451 1.00 0.00 O ATOM 1000 CB ILE A 780 25.989 -9.013 -19.633 1.00 0.00 C ATOM 1001 CG1 ILE A 780 25.472 -8.343 -18.358 1.00 0.00 C ATOM 1002 CG2 ILE A 780 24.891 -9.844 -20.287 1.00 0.00 C ATOM 1003 CD1 ILE A 780 24.305 -7.414 -18.593 1.00 0.00 C ATOM 0 H ILE A 780 27.034 -11.161 -20.969 1.00 0.00 H new ATOM 0 HA ILE A 780 28.030 -9.215 -18.986 1.00 0.00 H new ATOM 0 HB ILE A 780 26.284 -8.234 -20.336 1.00 0.00 H new ATOM 0 HG12 ILE A 780 25.174 -9.114 -17.648 1.00 0.00 H new ATOM 0 HG13 ILE A 780 26.285 -7.782 -17.897 1.00 0.00 H new ATOM 0 HG21 ILE A 780 24.027 -9.211 -20.489 1.00 0.00 H new ATOM 0 HG22 ILE A 780 25.261 -10.263 -21.223 1.00 0.00 H new ATOM 0 HG23 ILE A 780 24.599 -10.653 -19.617 1.00 0.00 H new ATOM 0 HD11 ILE A 780 23.992 -6.976 -17.645 1.00 0.00 H new ATOM 0 HD12 ILE A 780 24.604 -6.621 -19.279 1.00 0.00 H new ATOM 0 HD13 ILE A 780 23.476 -7.974 -19.025 1.00 0.00 H new ATOM 1015 N THR A 781 27.397 -10.575 -17.020 1.00 0.00 N ATOM 1016 CA THR A 781 27.152 -11.428 -15.875 1.00 0.00 C ATOM 1017 C THR A 781 26.294 -10.697 -14.842 1.00 0.00 C ATOM 1018 O THR A 781 26.635 -9.593 -14.402 1.00 0.00 O ATOM 1019 CB THR A 781 28.477 -11.884 -15.225 1.00 0.00 C ATOM 1020 OG1 THR A 781 29.323 -12.487 -16.216 1.00 0.00 O ATOM 1021 CG2 THR A 781 28.218 -12.880 -14.103 1.00 0.00 C ATOM 0 H THR A 781 27.946 -9.740 -16.815 1.00 0.00 H new ATOM 0 HA THR A 781 26.619 -12.312 -16.225 1.00 0.00 H new ATOM 0 HB THR A 781 28.970 -11.008 -14.804 1.00 0.00 H new ATOM 0 HG1 THR A 781 30.163 -12.773 -15.799 1.00 0.00 H new ATOM 0 HG21 THR A 781 29.167 -13.186 -13.662 1.00 0.00 H new ATOM 0 HG22 THR A 781 27.596 -12.414 -13.339 1.00 0.00 H new ATOM 0 HG23 THR A 781 27.706 -13.755 -14.504 1.00 0.00 H new ATOM 1029 N VAL A 782 25.169 -11.304 -14.488 1.00 0.00 N ATOM 1030 CA VAL A 782 24.289 -10.762 -13.464 1.00 0.00 C ATOM 1031 C VAL A 782 24.461 -11.545 -12.175 1.00 0.00 C ATOM 1032 O VAL A 782 24.244 -12.752 -12.139 1.00 0.00 O ATOM 1033 CB VAL A 782 22.810 -10.812 -13.902 1.00 0.00 C ATOM 1034 CG1 VAL A 782 21.897 -10.205 -12.845 1.00 0.00 C ATOM 1035 CG2 VAL A 782 22.635 -10.093 -15.226 1.00 0.00 C ATOM 0 H VAL A 782 24.844 -12.179 -14.899 1.00 0.00 H new ATOM 0 HA VAL A 782 24.561 -9.718 -13.307 1.00 0.00 H new ATOM 0 HB VAL A 782 22.529 -11.858 -14.023 1.00 0.00 H new ATOM 0 HG11 VAL A 782 20.863 -10.256 -13.185 1.00 0.00 H new ATOM 0 HG12 VAL A 782 22.000 -10.760 -11.913 1.00 0.00 H new ATOM 0 HG13 VAL A 782 22.174 -9.164 -12.680 1.00 0.00 H new ATOM 0 HG21 VAL A 782 21.588 -10.134 -15.527 1.00 0.00 H new ATOM 0 HG22 VAL A 782 22.941 -9.052 -15.118 1.00 0.00 H new ATOM 0 HG23 VAL A 782 23.250 -10.575 -15.986 1.00 0.00 H new ATOM 1045 N SER A 783 24.867 -10.863 -11.126 1.00 0.00 N ATOM 1046 CA SER A 783 25.130 -11.512 -9.861 1.00 0.00 C ATOM 1047 C SER A 783 24.130 -11.068 -8.801 1.00 0.00 C ATOM 1048 O SER A 783 23.844 -9.879 -8.656 1.00 0.00 O ATOM 1049 CB SER A 783 26.558 -11.199 -9.415 1.00 0.00 C ATOM 1050 OG SER A 783 27.472 -11.458 -10.467 1.00 0.00 O ATOM 0 H SER A 783 25.023 -9.855 -11.125 1.00 0.00 H new ATOM 0 HA SER A 783 25.021 -12.589 -9.989 1.00 0.00 H new ATOM 0 HB2 SER A 783 26.630 -10.155 -9.111 1.00 0.00 H new ATOM 0 HB3 SER A 783 26.815 -11.803 -8.545 1.00 0.00 H new ATOM 0 HG SER A 783 28.382 -11.252 -10.168 1.00 0.00 H new ATOM 1056 N LYS A 784 23.594 -12.035 -8.071 1.00 0.00 N ATOM 1057 CA LYS A 784 22.670 -11.758 -6.982 1.00 0.00 C ATOM 1058 C LYS A 784 23.431 -11.380 -5.729 1.00 0.00 C ATOM 1059 O LYS A 784 22.855 -10.996 -4.710 1.00 0.00 O ATOM 1060 CB LYS A 784 21.791 -12.969 -6.721 1.00 0.00 C ATOM 1061 CG LYS A 784 20.786 -13.201 -7.832 1.00 0.00 C ATOM 1062 CD LYS A 784 19.842 -14.356 -7.540 1.00 0.00 C ATOM 1063 CE LYS A 784 20.570 -15.687 -7.511 1.00 0.00 C ATOM 1064 NZ LYS A 784 19.627 -16.837 -7.433 1.00 0.00 N ATOM 0 H LYS A 784 23.786 -13.026 -8.215 1.00 0.00 H new ATOM 0 HA LYS A 784 22.035 -10.919 -7.267 1.00 0.00 H new ATOM 0 HB2 LYS A 784 22.418 -13.854 -6.611 1.00 0.00 H new ATOM 0 HB3 LYS A 784 21.262 -12.834 -5.778 1.00 0.00 H new ATOM 0 HG2 LYS A 784 20.204 -12.292 -7.985 1.00 0.00 H new ATOM 0 HG3 LYS A 784 21.319 -13.399 -8.762 1.00 0.00 H new ATOM 0 HD2 LYS A 784 19.350 -14.190 -6.581 1.00 0.00 H new ATOM 0 HD3 LYS A 784 19.060 -14.386 -8.298 1.00 0.00 H new ATOM 0 HE2 LYS A 784 21.186 -15.783 -8.405 1.00 0.00 H new ATOM 0 HE3 LYS A 784 21.245 -15.713 -6.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 784 20.156 -17.705 -7.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 784 18.924 -16.660 -6.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 784 19.142 -16.950 -8.346 1.00 0.00 H new ATOM 1078 N ARG A 785 24.730 -11.530 -5.807 1.00 0.00 N ATOM 1079 CA ARG A 785 25.606 -11.059 -4.760 1.00 0.00 C ATOM 1080 C ARG A 785 26.065 -9.646 -5.082 1.00 0.00 C ATOM 1081 O ARG A 785 27.104 -9.444 -5.704 1.00 0.00 O ATOM 1082 CB ARG A 785 26.795 -12.004 -4.574 1.00 0.00 C ATOM 1083 CG ARG A 785 26.386 -13.388 -4.087 1.00 0.00 C ATOM 1084 CD ARG A 785 25.874 -13.367 -2.650 1.00 0.00 C ATOM 1085 NE ARG A 785 24.648 -12.577 -2.505 1.00 0.00 N ATOM 1086 CZ ARG A 785 24.233 -12.049 -1.355 1.00 0.00 C ATOM 1087 NH1 ARG A 785 24.888 -12.303 -0.231 1.00 0.00 N ATOM 1088 NH2 ARG A 785 23.151 -11.280 -1.329 1.00 0.00 N ATOM 0 H ARG A 785 25.208 -11.977 -6.589 1.00 0.00 H new ATOM 0 HA ARG A 785 25.060 -11.043 -3.817 1.00 0.00 H new ATOM 0 HB2 ARG A 785 27.327 -12.101 -5.521 1.00 0.00 H new ATOM 0 HB3 ARG A 785 27.492 -11.565 -3.860 1.00 0.00 H new ATOM 0 HG2 ARG A 785 25.611 -13.787 -4.741 1.00 0.00 H new ATOM 0 HG3 ARG A 785 27.239 -14.062 -4.157 1.00 0.00 H new ATOM 0 HD2 ARG A 785 25.686 -14.388 -2.319 1.00 0.00 H new ATOM 0 HD3 ARG A 785 26.646 -12.958 -1.998 1.00 0.00 H new ATOM 0 HE ARG A 785 24.077 -12.422 -3.336 1.00 0.00 H new ATOM 0 HH11 ARG A 785 25.712 -12.904 -0.246 1.00 0.00 H new ATOM 0 HH12 ARG A 785 24.568 -11.897 0.648 1.00 0.00 H new ATOM 0 HH21 ARG A 785 22.637 -11.093 -2.190 1.00 0.00 H new ATOM 0 HH22 ARG A 785 22.834 -10.876 -0.448 1.00 0.00 H new ATOM 1102 N ALA A 786 25.243 -8.678 -4.709 1.00 0.00 N ATOM 1103 CA ALA A 786 25.521 -7.282 -4.996 1.00 0.00 C ATOM 1104 C ALA A 786 25.945 -6.553 -3.733 1.00 0.00 C ATOM 1105 O ALA A 786 25.084 -6.333 -2.858 1.00 0.00 O ATOM 1106 CB ALA A 786 24.303 -6.617 -5.620 1.00 0.00 C ATOM 0 H ALA A 786 24.372 -8.837 -4.203 1.00 0.00 H new ATOM 0 HA ALA A 786 26.343 -7.231 -5.710 1.00 0.00 H new ATOM 0 HB1 ALA A 786 24.527 -5.571 -5.829 1.00 0.00 H new ATOM 0 HB2 ALA A 786 24.046 -7.126 -6.549 1.00 0.00 H new ATOM 0 HB3 ALA A 786 23.462 -6.677 -4.929 1.00 0.00 H new TER 1112 ALA A 786 HETATM 1113 P DGP A 801 28.077 -2.990 -22.583 1.00 0.00 P HETATM 1114 OP1 DGP A 801 28.624 -3.430 -21.276 1.00 0.00 O HETATM 1115 OP2 DGP A 801 27.921 -3.983 -23.676 1.00 0.00 O HETATM 1116 OP3 DGP A 801 28.973 -1.788 -23.118 1.00 0.00 O HETATM 1117 O5' DGP A 801 26.663 -2.306 -22.324 1.00 0.00 O HETATM 1118 C5' DGP A 801 25.456 -2.905 -22.798 1.00 0.00 C HETATM 1119 C4' DGP A 801 24.328 -1.906 -22.757 1.00 0.00 C HETATM 1120 O4' DGP A 801 23.931 -1.686 -21.381 1.00 0.00 O HETATM 1121 C3' DGP A 801 24.663 -0.523 -23.318 1.00 0.00 C HETATM 1122 O3' DGP A 801 23.540 0.021 -24.011 1.00 0.00 O HETATM 1123 C2' DGP A 801 24.990 0.298 -22.084 1.00 0.00 C HETATM 1124 C1' DGP A 801 24.113 -0.327 -21.013 1.00 0.00 C HETATM 1125 N9 DGP A 801 24.689 -0.303 -19.670 1.00 0.00 N HETATM 1126 C8 DGP A 801 25.987 -0.586 -19.330 1.00 0.00 C HETATM 1127 N7 DGP A 801 26.221 -0.477 -18.049 1.00 0.00 N HETATM 1128 C5 DGP A 801 24.998 -0.099 -17.510 1.00 0.00 C HETATM 1129 C6 DGP A 801 24.635 0.167 -16.165 1.00 0.00 C HETATM 1130 O6 DGP A 801 25.348 0.132 -15.154 1.00 0.00 O HETATM 1131 N1 DGP A 801 23.293 0.516 -16.049 1.00 0.00 N HETATM 1132 C2 DGP A 801 22.416 0.598 -17.104 1.00 0.00 C HETATM 1133 N2 DGP A 801 21.159 0.945 -16.791 1.00 0.00 N HETATM 1134 N3 DGP A 801 22.740 0.354 -18.365 1.00 0.00 N HETATM 1135 C4 DGP A 801 24.040 0.012 -18.495 1.00 0.00 C HETATM 0 HO3' DGP A 801 23.770 0.906 -24.362 1.00 0.00 H new HETATM 0 HN22 DGP A 801 20.454 1.025 -17.524 1.00 0.00 H new HETATM 0 HN21 DGP A 801 20.907 1.129 -15.820 1.00 0.00 H new HETATM 0 H5'' DGP A 801 25.596 -3.265 -23.817 1.00 0.00 H new HETATM 0 H2'' DGP A 801 26.047 0.235 -21.827 1.00 0.00 H new HETATM 0 HN1 DGP A 801 22.936 0.725 -15.117 1.00 0.00 H new HETATM 0 H8 DGP A 801 26.748 -0.873 -20.056 1.00 0.00 H new HETATM 0 H5' DGP A 801 25.207 -3.771 -22.186 1.00 0.00 H new HETATM 0 H4' DGP A 801 23.550 -2.347 -23.380 1.00 0.00 H new HETATM 0 H3' DGP A 801 25.482 -0.542 -24.037 1.00 0.00 H new HETATM 0 H2' DGP A 801 24.759 1.353 -22.229 1.00 0.00 H new HETATM 0 H1' DGP A 801 23.191 0.252 -20.963 1.00 0.00 H new