USER MOD reduce.3.24.130724 H: found=0, std=0, add=524, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 525 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 685 HIS HD1 : A 685 HIS ND1 : A 801 ZNZN :(H bumps) USER MOD Set 1.1: A 695 ASN : amide:sc= -1.14 K(o=-0.72,f=-1.5) USER MOD Set 1.2: A 699 LYS NZ :NH3+ -151:sc= 0.419 (180deg=0) USER MOD Single : A 653 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 654 THR OG1 : rot 180:sc= 0.0269 USER MOD Single : A 655 SER OG : rot 180:sc= 0 USER MOD Single : A 657 TYR OH : rot 180:sc= 0 USER MOD Single : A 668 GLN : amide:sc= -0.141 X(o=-0.14,f=-0.048) USER MOD Single : A 672 LYS NZ :NH3+ -112:sc= 0.292 (180deg=0.098) USER MOD Single : A 676 GLN : amide:sc= -3.41 K(o=-3.4,f=-1.1) USER MOD Single : A 679 LYS NZ :NH3+ -151:sc= 1.34 (180deg=1.08) USER MOD Single : A 681 HIS : no HD1:sc=-0.00905 X(o=-0.009,f=0) USER MOD Single : A 684 GLN : amide:sc= -4.78! C(o=-4.8!,f=-4.5!) USER MOD Single : A 687 LYS NZ :NH3+ -173:sc=-0.00655 (180deg=-0.0926) USER MOD Single : A 690 ASN : amide:sc=-0.00102 K(o=-0.001,f=-0.74) USER MOD Single : A 691 TYR OH : rot -149:sc= 0.575 USER MOD Single : A 694 LYS NZ :NH3+ -174:sc= 0.0558 (180deg=0.0493) USER MOD Single : A 697 LYS NZ :NH3+ 147:sc= 0.0172 (180deg=-0.0444) USER MOD Single : A 702 TYR OH : rot 180:sc= 0 USER MOD Single : A 705 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 710 MET CE :methyl 171:sc= 0 (180deg=-0.0847) USER MOD Single : A 714 SER OG : rot 180:sc= 0 USER MOD Single : A 715 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 652 -13.554 -1.674 -0.200 1.00 0.00 N ATOM 2 CA PHE A 652 -13.490 -1.067 -1.557 1.00 0.00 C ATOM 3 C PHE A 652 -12.039 -0.674 -1.910 1.00 0.00 C ATOM 4 O PHE A 652 -11.612 -0.822 -3.062 1.00 0.00 O ATOM 5 CB PHE A 652 -14.429 0.165 -1.644 1.00 0.00 C ATOM 6 CG PHE A 652 -15.894 -0.141 -1.324 1.00 0.00 C ATOM 7 CD1 PHE A 652 -16.700 -0.811 -2.246 1.00 0.00 C ATOM 8 CD2 PHE A 652 -16.468 0.246 -0.108 1.00 0.00 C ATOM 9 CE1 PHE A 652 -18.026 -1.092 -1.962 1.00 0.00 C ATOM 10 CE2 PHE A 652 -17.793 -0.035 0.173 1.00 0.00 C ATOM 11 CZ PHE A 652 -18.573 -0.703 -0.754 1.00 0.00 C ATOM 0 HA PHE A 652 -13.827 -1.808 -2.282 1.00 0.00 H new ATOM 0 HB2 PHE A 652 -14.070 0.931 -0.956 1.00 0.00 H new ATOM 0 HB3 PHE A 652 -14.368 0.585 -2.648 1.00 0.00 H new ATOM 0 HD1 PHE A 652 -16.283 -1.115 -3.195 1.00 0.00 H new ATOM 0 HD2 PHE A 652 -15.869 0.771 0.621 1.00 0.00 H new ATOM 0 HE1 PHE A 652 -18.633 -1.616 -2.685 1.00 0.00 H new ATOM 0 HE2 PHE A 652 -18.219 0.268 1.118 1.00 0.00 H new ATOM 0 HZ PHE A 652 -19.608 -0.920 -0.534 1.00 0.00 H new ATOM 21 N ASN A 653 -11.289 -0.179 -0.902 1.00 0.00 N ATOM 22 CA ASN A 653 -9.880 0.241 -1.069 1.00 0.00 C ATOM 23 C ASN A 653 -8.938 -0.981 -1.139 1.00 0.00 C ATOM 24 O ASN A 653 -8.644 -1.618 -0.116 1.00 0.00 O ATOM 25 CB ASN A 653 -9.453 1.201 0.078 1.00 0.00 C ATOM 26 CG ASN A 653 -10.174 2.549 0.007 1.00 0.00 C ATOM 27 OD1 ASN A 653 -11.221 2.747 0.621 1.00 0.00 O ATOM 28 ND2 ASN A 653 -9.623 3.478 -0.766 1.00 0.00 N ATOM 0 H ASN A 653 -11.641 -0.059 0.048 1.00 0.00 H new ATOM 0 HA ASN A 653 -9.800 0.778 -2.014 1.00 0.00 H new ATOM 0 HB2 ASN A 653 -9.661 0.730 1.039 1.00 0.00 H new ATOM 0 HB3 ASN A 653 -8.376 1.365 0.030 1.00 0.00 H new ATOM 0 HD21 ASN A 653 -10.069 4.390 -0.865 1.00 0.00 H new ATOM 0 HD22 ASN A 653 -8.754 3.280 -1.261 1.00 0.00 H new ATOM 35 N THR A 654 -8.493 -1.312 -2.368 1.00 0.00 N ATOM 36 CA THR A 654 -7.544 -2.411 -2.632 1.00 0.00 C ATOM 37 C THR A 654 -6.916 -2.237 -4.032 1.00 0.00 C ATOM 38 O THR A 654 -7.588 -1.779 -4.965 1.00 0.00 O ATOM 39 CB THR A 654 -8.234 -3.820 -2.510 1.00 0.00 C ATOM 40 OG1 THR A 654 -7.307 -4.871 -2.820 1.00 0.00 O ATOM 41 CG2 THR A 654 -9.472 -3.950 -3.414 1.00 0.00 C ATOM 0 H THR A 654 -8.785 -0.819 -3.212 1.00 0.00 H new ATOM 0 HA THR A 654 -6.760 -2.367 -1.876 1.00 0.00 H new ATOM 0 HB THR A 654 -8.563 -3.912 -1.475 1.00 0.00 H new ATOM 0 HG1 THR A 654 -7.756 -5.738 -2.736 1.00 0.00 H new ATOM 0 HG21 THR A 654 -9.910 -4.941 -3.291 1.00 0.00 H new ATOM 0 HG22 THR A 654 -10.205 -3.192 -3.138 1.00 0.00 H new ATOM 0 HG23 THR A 654 -9.179 -3.809 -4.454 1.00 0.00 H new ATOM 49 N SER A 655 -5.617 -2.586 -4.166 1.00 0.00 N ATOM 50 CA SER A 655 -4.888 -2.534 -5.458 1.00 0.00 C ATOM 51 C SER A 655 -4.872 -3.919 -6.150 1.00 0.00 C ATOM 52 O SER A 655 -4.073 -4.154 -7.070 1.00 0.00 O ATOM 53 CB SER A 655 -3.445 -2.017 -5.219 1.00 0.00 C ATOM 54 OG SER A 655 -3.455 -0.714 -4.655 1.00 0.00 O ATOM 0 H SER A 655 -5.044 -2.911 -3.387 1.00 0.00 H new ATOM 0 HA SER A 655 -5.407 -1.845 -6.125 1.00 0.00 H new ATOM 0 HB2 SER A 655 -2.916 -2.700 -4.554 1.00 0.00 H new ATOM 0 HB3 SER A 655 -2.899 -2.004 -6.162 1.00 0.00 H new ATOM 0 HG SER A 655 -2.534 -0.412 -4.513 1.00 0.00 H new ATOM 60 N ASP A 656 -5.765 -4.826 -5.698 1.00 0.00 N ATOM 61 CA ASP A 656 -5.891 -6.198 -6.248 1.00 0.00 C ATOM 62 C ASP A 656 -6.315 -6.167 -7.731 1.00 0.00 C ATOM 63 O ASP A 656 -7.077 -5.288 -8.148 1.00 0.00 O ATOM 64 CB ASP A 656 -6.917 -7.013 -5.414 1.00 0.00 C ATOM 65 CG ASP A 656 -7.114 -8.464 -5.909 1.00 0.00 C ATOM 66 OD1 ASP A 656 -6.280 -9.340 -5.573 1.00 0.00 O ATOM 67 OD2 ASP A 656 -8.094 -8.738 -6.636 1.00 0.00 O ATOM 0 H ASP A 656 -6.420 -4.630 -4.941 1.00 0.00 H new ATOM 0 HA ASP A 656 -4.915 -6.680 -6.187 1.00 0.00 H new ATOM 0 HB2 ASP A 656 -6.590 -7.035 -4.375 1.00 0.00 H new ATOM 0 HB3 ASP A 656 -7.878 -6.499 -5.435 1.00 0.00 H new ATOM 72 N TYR A 657 -5.805 -7.131 -8.507 1.00 0.00 N ATOM 73 CA TYR A 657 -6.108 -7.266 -9.935 1.00 0.00 C ATOM 74 C TYR A 657 -7.296 -8.219 -10.129 1.00 0.00 C ATOM 75 O TYR A 657 -7.123 -9.443 -10.160 1.00 0.00 O ATOM 76 CB TYR A 657 -4.856 -7.787 -10.700 1.00 0.00 C ATOM 77 CG TYR A 657 -3.643 -6.849 -10.624 1.00 0.00 C ATOM 78 CD1 TYR A 657 -2.705 -6.952 -9.590 1.00 0.00 C ATOM 79 CD2 TYR A 657 -3.435 -5.859 -11.588 1.00 0.00 C ATOM 80 CE1 TYR A 657 -1.616 -6.105 -9.523 1.00 0.00 C ATOM 81 CE2 TYR A 657 -2.345 -5.012 -11.519 1.00 0.00 C ATOM 82 CZ TYR A 657 -1.438 -5.138 -10.491 1.00 0.00 C ATOM 83 OH TYR A 657 -0.343 -4.297 -10.435 1.00 0.00 O ATOM 0 H TYR A 657 -5.165 -7.845 -8.158 1.00 0.00 H new ATOM 0 HA TYR A 657 -6.376 -6.289 -10.338 1.00 0.00 H new ATOM 0 HB2 TYR A 657 -4.576 -8.760 -10.297 1.00 0.00 H new ATOM 0 HB3 TYR A 657 -5.120 -7.939 -11.747 1.00 0.00 H new ATOM 0 HD1 TYR A 657 -2.835 -7.708 -8.830 1.00 0.00 H new ATOM 0 HD2 TYR A 657 -4.138 -5.754 -12.401 1.00 0.00 H new ATOM 0 HE1 TYR A 657 -0.906 -6.199 -8.715 1.00 0.00 H new ATOM 0 HE2 TYR A 657 -2.205 -4.251 -12.272 1.00 0.00 H new ATOM 0 HH TYR A 657 -0.369 -3.676 -11.193 1.00 0.00 H new ATOM 93 N ARG A 658 -8.513 -7.656 -10.178 1.00 0.00 N ATOM 94 CA ARG A 658 -9.713 -8.399 -10.580 1.00 0.00 C ATOM 95 C ARG A 658 -9.715 -8.568 -12.114 1.00 0.00 C ATOM 96 O ARG A 658 -10.339 -7.783 -12.847 1.00 0.00 O ATOM 97 CB ARG A 658 -10.985 -7.670 -10.076 1.00 0.00 C ATOM 98 CG ARG A 658 -11.044 -7.484 -8.541 1.00 0.00 C ATOM 99 CD ARG A 658 -12.228 -6.609 -8.116 1.00 0.00 C ATOM 100 NE ARG A 658 -12.296 -6.426 -6.646 1.00 0.00 N ATOM 101 CZ ARG A 658 -13.376 -6.647 -5.872 1.00 0.00 C ATOM 102 NH1 ARG A 658 -14.494 -7.156 -6.381 1.00 0.00 N ATOM 103 NH2 ARG A 658 -13.317 -6.386 -4.572 1.00 0.00 N ATOM 0 H ARG A 658 -8.691 -6.680 -9.942 1.00 0.00 H new ATOM 0 HA ARG A 658 -9.708 -9.391 -10.128 1.00 0.00 H new ATOM 0 HB2 ARG A 658 -11.041 -6.691 -10.552 1.00 0.00 H new ATOM 0 HB3 ARG A 658 -11.863 -8.231 -10.397 1.00 0.00 H new ATOM 0 HG2 ARG A 658 -11.122 -8.459 -8.060 1.00 0.00 H new ATOM 0 HG3 ARG A 658 -10.115 -7.031 -8.194 1.00 0.00 H new ATOM 0 HD2 ARG A 658 -12.147 -5.634 -8.597 1.00 0.00 H new ATOM 0 HD3 ARG A 658 -13.155 -7.062 -8.466 1.00 0.00 H new ATOM 0 HE ARG A 658 -11.448 -6.104 -6.179 1.00 0.00 H new ATOM 0 HH11 ARG A 658 -14.544 -7.386 -7.373 1.00 0.00 H new ATOM 0 HH12 ARG A 658 -15.302 -7.316 -5.779 1.00 0.00 H new ATOM 0 HH21 ARG A 658 -12.457 -6.020 -4.164 1.00 0.00 H new ATOM 0 HH22 ARG A 658 -14.132 -6.551 -3.981 1.00 0.00 H new ATOM 117 N PHE A 659 -8.926 -9.556 -12.582 1.00 0.00 N ATOM 118 CA PHE A 659 -8.783 -9.891 -14.012 1.00 0.00 C ATOM 119 C PHE A 659 -10.058 -10.594 -14.532 1.00 0.00 C ATOM 120 O PHE A 659 -10.111 -11.816 -14.684 1.00 0.00 O ATOM 121 CB PHE A 659 -7.463 -10.713 -14.276 1.00 0.00 C ATOM 122 CG PHE A 659 -7.014 -11.642 -13.136 1.00 0.00 C ATOM 123 CD1 PHE A 659 -7.737 -12.784 -12.804 1.00 0.00 C ATOM 124 CD2 PHE A 659 -5.868 -11.355 -12.386 1.00 0.00 C ATOM 125 CE1 PHE A 659 -7.339 -13.608 -11.772 1.00 0.00 C ATOM 126 CE2 PHE A 659 -5.472 -12.180 -11.347 1.00 0.00 C ATOM 127 CZ PHE A 659 -6.210 -13.306 -11.042 1.00 0.00 C ATOM 0 H PHE A 659 -8.365 -10.149 -11.971 1.00 0.00 H new ATOM 0 HA PHE A 659 -8.679 -8.969 -14.585 1.00 0.00 H new ATOM 0 HB2 PHE A 659 -7.605 -11.314 -15.174 1.00 0.00 H new ATOM 0 HB3 PHE A 659 -6.656 -10.011 -14.486 1.00 0.00 H new ATOM 0 HD1 PHE A 659 -8.627 -13.030 -13.365 1.00 0.00 H new ATOM 0 HD2 PHE A 659 -5.284 -10.477 -12.621 1.00 0.00 H new ATOM 0 HE1 PHE A 659 -7.913 -14.492 -11.536 1.00 0.00 H new ATOM 0 HE2 PHE A 659 -4.587 -11.943 -10.776 1.00 0.00 H new ATOM 0 HZ PHE A 659 -5.903 -13.950 -10.231 1.00 0.00 H new ATOM 137 N GLU A 660 -11.096 -9.778 -14.767 1.00 0.00 N ATOM 138 CA GLU A 660 -12.448 -10.242 -15.140 1.00 0.00 C ATOM 139 C GLU A 660 -12.906 -9.571 -16.443 1.00 0.00 C ATOM 140 O GLU A 660 -12.311 -8.585 -16.882 1.00 0.00 O ATOM 141 CB GLU A 660 -13.446 -9.886 -14.008 1.00 0.00 C ATOM 142 CG GLU A 660 -13.127 -10.497 -12.635 1.00 0.00 C ATOM 143 CD GLU A 660 -14.166 -10.117 -11.567 1.00 0.00 C ATOM 144 OE1 GLU A 660 -14.172 -8.949 -11.123 1.00 0.00 O ATOM 145 OE2 GLU A 660 -14.994 -10.975 -11.186 1.00 0.00 O ATOM 0 H GLU A 660 -11.023 -8.763 -14.703 1.00 0.00 H new ATOM 0 HA GLU A 660 -12.419 -11.322 -15.288 1.00 0.00 H new ATOM 0 HB2 GLU A 660 -13.481 -8.801 -13.905 1.00 0.00 H new ATOM 0 HB3 GLU A 660 -14.442 -10.210 -14.309 1.00 0.00 H new ATOM 0 HG2 GLU A 660 -13.083 -11.582 -12.725 1.00 0.00 H new ATOM 0 HG3 GLU A 660 -12.140 -10.164 -12.313 1.00 0.00 H new ATOM 152 N CYS A 661 -13.987 -10.089 -17.036 1.00 0.00 N ATOM 153 CA CYS A 661 -14.585 -9.494 -18.236 1.00 0.00 C ATOM 154 C CYS A 661 -15.673 -8.476 -17.863 1.00 0.00 C ATOM 155 O CYS A 661 -16.403 -8.678 -16.890 1.00 0.00 O ATOM 156 CB CYS A 661 -15.174 -10.574 -19.141 1.00 0.00 C ATOM 157 SG CYS A 661 -15.883 -9.911 -20.677 1.00 0.00 S ATOM 0 H CYS A 661 -14.468 -10.924 -16.702 1.00 0.00 H new ATOM 0 HA CYS A 661 -13.793 -8.975 -18.776 1.00 0.00 H new ATOM 0 HB2 CYS A 661 -14.395 -11.295 -19.389 1.00 0.00 H new ATOM 0 HB3 CYS A 661 -15.947 -11.115 -18.595 1.00 0.00 H new ATOM 162 N ILE A 662 -15.792 -7.414 -18.692 1.00 0.00 N ATOM 163 CA ILE A 662 -16.717 -6.266 -18.489 1.00 0.00 C ATOM 164 C ILE A 662 -18.198 -6.680 -18.235 1.00 0.00 C ATOM 165 O ILE A 662 -18.937 -5.951 -17.560 1.00 0.00 O ATOM 166 CB ILE A 662 -16.644 -5.284 -19.725 1.00 0.00 C ATOM 167 CG1 ILE A 662 -17.007 -6.024 -21.061 1.00 0.00 C ATOM 168 CG2 ILE A 662 -15.242 -4.615 -19.827 1.00 0.00 C ATOM 169 CD1 ILE A 662 -17.149 -5.122 -22.279 1.00 0.00 C ATOM 0 H ILE A 662 -15.236 -7.326 -19.542 1.00 0.00 H new ATOM 0 HA ILE A 662 -16.378 -5.767 -17.581 1.00 0.00 H new ATOM 0 HB ILE A 662 -17.382 -4.498 -19.566 1.00 0.00 H new ATOM 0 HG12 ILE A 662 -16.238 -6.768 -21.267 1.00 0.00 H new ATOM 0 HG13 ILE A 662 -17.943 -6.564 -20.917 1.00 0.00 H new ATOM 0 HG21 ILE A 662 -15.220 -3.945 -20.686 1.00 0.00 H new ATOM 0 HG22 ILE A 662 -15.043 -4.047 -18.918 1.00 0.00 H new ATOM 0 HG23 ILE A 662 -14.480 -5.385 -19.948 1.00 0.00 H new ATOM 0 HD11 ILE A 662 -17.400 -5.725 -23.151 1.00 0.00 H new ATOM 0 HD12 ILE A 662 -17.940 -4.393 -22.102 1.00 0.00 H new ATOM 0 HD13 ILE A 662 -16.209 -4.601 -22.457 1.00 0.00 H new ATOM 181 N CYS A 663 -18.620 -7.836 -18.781 1.00 0.00 N ATOM 182 CA CYS A 663 -20.010 -8.341 -18.615 1.00 0.00 C ATOM 183 C CYS A 663 -20.149 -9.130 -17.293 1.00 0.00 C ATOM 184 O CYS A 663 -21.102 -8.933 -16.531 1.00 0.00 O ATOM 185 CB CYS A 663 -20.401 -9.249 -19.800 1.00 0.00 C ATOM 186 SG CYS A 663 -19.484 -10.818 -19.842 1.00 0.00 S ATOM 0 H CYS A 663 -18.023 -8.443 -19.343 1.00 0.00 H new ATOM 0 HA CYS A 663 -20.679 -7.481 -18.588 1.00 0.00 H new ATOM 0 HB2 CYS A 663 -21.469 -9.462 -19.748 1.00 0.00 H new ATOM 0 HB3 CYS A 663 -20.229 -8.711 -20.732 1.00 0.00 H new ATOM 191 N GLY A 664 -19.175 -10.024 -17.030 1.00 0.00 N ATOM 192 CA GLY A 664 -19.177 -10.875 -15.827 1.00 0.00 C ATOM 193 C GLY A 664 -19.893 -12.223 -16.009 1.00 0.00 C ATOM 194 O GLY A 664 -20.533 -12.709 -15.076 1.00 0.00 O ATOM 0 H GLY A 664 -18.372 -10.175 -17.641 1.00 0.00 H new ATOM 0 HA2 GLY A 664 -18.146 -11.062 -15.526 1.00 0.00 H new ATOM 0 HA3 GLY A 664 -19.653 -10.331 -15.012 1.00 0.00 H new ATOM 198 N GLU A 665 -19.764 -12.837 -17.211 1.00 0.00 N ATOM 199 CA GLU A 665 -20.363 -14.165 -17.520 1.00 0.00 C ATOM 200 C GLU A 665 -19.427 -15.317 -17.040 1.00 0.00 C ATOM 201 O GLU A 665 -19.651 -15.910 -15.983 1.00 0.00 O ATOM 202 CB GLU A 665 -20.626 -14.305 -19.049 1.00 0.00 C ATOM 203 CG GLU A 665 -21.571 -13.261 -19.672 1.00 0.00 C ATOM 204 CD GLU A 665 -21.556 -13.304 -21.216 1.00 0.00 C ATOM 205 OE1 GLU A 665 -20.651 -12.688 -21.840 1.00 0.00 O ATOM 206 OE2 GLU A 665 -22.419 -13.973 -21.815 1.00 0.00 O ATOM 0 H GLU A 665 -19.246 -12.431 -17.990 1.00 0.00 H new ATOM 0 HA GLU A 665 -21.312 -14.237 -16.989 1.00 0.00 H new ATOM 0 HB2 GLU A 665 -19.669 -14.254 -19.568 1.00 0.00 H new ATOM 0 HB3 GLU A 665 -21.038 -15.296 -19.237 1.00 0.00 H new ATOM 0 HG2 GLU A 665 -22.586 -13.435 -19.316 1.00 0.00 H new ATOM 0 HG3 GLU A 665 -21.281 -12.265 -19.336 1.00 0.00 H new ATOM 213 N LEU A 666 -18.345 -15.585 -17.821 1.00 0.00 N ATOM 214 CA LEU A 666 -17.420 -16.743 -17.624 1.00 0.00 C ATOM 215 C LEU A 666 -15.993 -16.365 -18.063 1.00 0.00 C ATOM 216 O LEU A 666 -15.795 -15.349 -18.745 1.00 0.00 O ATOM 217 CB LEU A 666 -17.868 -17.975 -18.479 1.00 0.00 C ATOM 218 CG LEU A 666 -19.219 -18.658 -18.099 1.00 0.00 C ATOM 219 CD1 LEU A 666 -19.611 -19.741 -19.131 1.00 0.00 C ATOM 220 CD2 LEU A 666 -19.165 -19.243 -16.665 1.00 0.00 C ATOM 0 H LEU A 666 -18.085 -14.999 -18.614 1.00 0.00 H new ATOM 0 HA LEU A 666 -17.444 -16.999 -16.565 1.00 0.00 H new ATOM 0 HB2 LEU A 666 -17.932 -17.658 -19.520 1.00 0.00 H new ATOM 0 HB3 LEU A 666 -17.082 -18.728 -18.423 1.00 0.00 H new ATOM 0 HG LEU A 666 -19.994 -17.891 -18.116 1.00 0.00 H new ATOM 0 HD11 LEU A 666 -20.556 -20.198 -18.838 1.00 0.00 H new ATOM 0 HD12 LEU A 666 -19.718 -19.284 -20.115 1.00 0.00 H new ATOM 0 HD13 LEU A 666 -18.835 -20.505 -19.169 1.00 0.00 H new ATOM 0 HD21 LEU A 666 -20.120 -19.713 -16.427 1.00 0.00 H new ATOM 0 HD22 LEU A 666 -18.370 -19.986 -16.605 1.00 0.00 H new ATOM 0 HD23 LEU A 666 -18.967 -18.442 -15.953 1.00 0.00 H new ATOM 232 N ASP A 667 -15.013 -17.206 -17.681 1.00 0.00 N ATOM 233 CA ASP A 667 -13.650 -17.204 -18.283 1.00 0.00 C ATOM 234 C ASP A 667 -13.417 -18.528 -19.056 1.00 0.00 C ATOM 235 O ASP A 667 -12.320 -18.777 -19.570 1.00 0.00 O ATOM 236 CB ASP A 667 -12.560 -16.973 -17.199 1.00 0.00 C ATOM 237 CG ASP A 667 -12.342 -18.168 -16.256 1.00 0.00 C ATOM 238 OD1 ASP A 667 -13.221 -18.438 -15.407 1.00 0.00 O ATOM 239 OD2 ASP A 667 -11.305 -18.860 -16.371 1.00 0.00 O ATOM 0 H ASP A 667 -15.135 -17.907 -16.950 1.00 0.00 H new ATOM 0 HA ASP A 667 -13.576 -16.377 -18.989 1.00 0.00 H new ATOM 0 HB2 ASP A 667 -11.617 -16.738 -17.693 1.00 0.00 H new ATOM 0 HB3 ASP A 667 -12.834 -16.101 -16.605 1.00 0.00 H new ATOM 244 N GLN A 668 -14.469 -19.377 -19.108 1.00 0.00 N ATOM 245 CA GLN A 668 -14.527 -20.585 -19.973 1.00 0.00 C ATOM 246 C GLN A 668 -15.080 -20.207 -21.362 1.00 0.00 C ATOM 247 O GLN A 668 -15.782 -19.197 -21.480 1.00 0.00 O ATOM 248 CB GLN A 668 -15.449 -21.693 -19.354 1.00 0.00 C ATOM 249 CG GLN A 668 -14.855 -22.506 -18.186 1.00 0.00 C ATOM 250 CD GLN A 668 -14.583 -21.689 -16.921 1.00 0.00 C ATOM 251 OE1 GLN A 668 -15.455 -21.556 -16.061 1.00 0.00 O ATOM 252 NE2 GLN A 668 -13.389 -21.124 -16.814 1.00 0.00 N ATOM 0 H GLN A 668 -15.310 -19.244 -18.547 1.00 0.00 H new ATOM 0 HA GLN A 668 -13.514 -20.977 -20.057 1.00 0.00 H new ATOM 0 HB2 GLN A 668 -16.367 -21.219 -19.008 1.00 0.00 H new ATOM 0 HB3 GLN A 668 -15.728 -22.387 -20.147 1.00 0.00 H new ATOM 0 HG2 GLN A 668 -15.539 -23.318 -17.939 1.00 0.00 H new ATOM 0 HG3 GLN A 668 -13.922 -22.964 -18.515 1.00 0.00 H new ATOM 0 HE21 GLN A 668 -12.694 -21.258 -17.548 1.00 0.00 H new ATOM 0 HE22 GLN A 668 -13.165 -20.555 -15.998 1.00 0.00 H new ATOM 261 N ILE A 669 -14.741 -21.015 -22.407 1.00 0.00 N ATOM 262 CA ILE A 669 -15.412 -20.908 -23.717 1.00 0.00 C ATOM 263 C ILE A 669 -16.869 -21.388 -23.511 1.00 0.00 C ATOM 264 O ILE A 669 -17.768 -20.564 -23.359 1.00 0.00 O ATOM 265 CB ILE A 669 -14.704 -21.745 -24.870 1.00 0.00 C ATOM 266 CG1 ILE A 669 -13.203 -21.335 -25.079 1.00 0.00 C ATOM 267 CG2 ILE A 669 -15.492 -21.617 -26.200 1.00 0.00 C ATOM 268 CD1 ILE A 669 -12.980 -19.975 -25.719 1.00 0.00 C ATOM 0 H ILE A 669 -14.018 -21.733 -22.361 1.00 0.00 H new ATOM 0 HA ILE A 669 -15.365 -19.873 -24.054 1.00 0.00 H new ATOM 0 HB ILE A 669 -14.708 -22.787 -24.551 1.00 0.00 H new ATOM 0 HG12 ILE A 669 -12.703 -21.348 -24.111 1.00 0.00 H new ATOM 0 HG13 ILE A 669 -12.720 -22.092 -25.697 1.00 0.00 H new ATOM 0 HG21 ILE A 669 -14.992 -22.196 -26.976 1.00 0.00 H new ATOM 0 HG22 ILE A 669 -16.505 -21.995 -26.061 1.00 0.00 H new ATOM 0 HG23 ILE A 669 -15.534 -20.570 -26.499 1.00 0.00 H new ATOM 0 HD11 ILE A 669 -11.910 -19.790 -25.818 1.00 0.00 H new ATOM 0 HD12 ILE A 669 -13.444 -19.957 -26.705 1.00 0.00 H new ATOM 0 HD13 ILE A 669 -13.426 -19.201 -25.094 1.00 0.00 H new ATOM 280 N ASP A 670 -17.041 -22.732 -23.402 1.00 0.00 N ATOM 281 CA ASP A 670 -18.332 -23.412 -23.102 1.00 0.00 C ATOM 282 C ASP A 670 -19.459 -23.030 -24.103 1.00 0.00 C ATOM 283 O ASP A 670 -19.830 -23.834 -24.965 1.00 0.00 O ATOM 284 CB ASP A 670 -18.747 -23.167 -21.616 1.00 0.00 C ATOM 285 CG ASP A 670 -20.074 -23.847 -21.217 1.00 0.00 C ATOM 286 OD1 ASP A 670 -20.246 -25.055 -21.492 1.00 0.00 O ATOM 287 OD2 ASP A 670 -20.958 -23.177 -20.637 1.00 0.00 O ATOM 0 H ASP A 670 -16.270 -23.388 -23.523 1.00 0.00 H new ATOM 0 HA ASP A 670 -18.178 -24.483 -23.234 1.00 0.00 H new ATOM 0 HB2 ASP A 670 -17.953 -23.530 -20.963 1.00 0.00 H new ATOM 0 HB3 ASP A 670 -18.834 -22.094 -21.446 1.00 0.00 H new ATOM 292 N ARG A 671 -20.014 -21.808 -23.956 1.00 0.00 N ATOM 293 CA ARG A 671 -20.869 -21.157 -24.970 1.00 0.00 C ATOM 294 C ARG A 671 -20.101 -19.958 -25.552 1.00 0.00 C ATOM 295 O ARG A 671 -19.750 -19.940 -26.740 1.00 0.00 O ATOM 296 CB ARG A 671 -22.234 -20.671 -24.370 1.00 0.00 C ATOM 297 CG ARG A 671 -23.352 -21.733 -24.247 1.00 0.00 C ATOM 298 CD ARG A 671 -23.055 -22.858 -23.246 1.00 0.00 C ATOM 299 NE ARG A 671 -24.181 -23.808 -23.148 1.00 0.00 N ATOM 300 CZ ARG A 671 -24.225 -24.887 -22.356 1.00 0.00 C ATOM 301 NH1 ARG A 671 -23.226 -25.179 -21.533 1.00 0.00 N ATOM 302 NH2 ARG A 671 -25.312 -25.647 -22.370 1.00 0.00 N ATOM 0 H ARG A 671 -19.879 -21.240 -23.120 1.00 0.00 H new ATOM 0 HA ARG A 671 -21.102 -21.886 -25.746 1.00 0.00 H new ATOM 0 HB2 ARG A 671 -22.044 -20.260 -23.379 1.00 0.00 H new ATOM 0 HB3 ARG A 671 -22.606 -19.854 -24.988 1.00 0.00 H new ATOM 0 HG2 ARG A 671 -24.276 -21.236 -23.952 1.00 0.00 H new ATOM 0 HG3 ARG A 671 -23.526 -22.174 -25.228 1.00 0.00 H new ATOM 0 HD2 ARG A 671 -22.154 -23.390 -23.552 1.00 0.00 H new ATOM 0 HD3 ARG A 671 -22.853 -22.429 -22.264 1.00 0.00 H new ATOM 0 HE ARG A 671 -24.996 -23.627 -23.734 1.00 0.00 H new ATOM 0 HH11 ARG A 671 -22.404 -24.576 -21.495 1.00 0.00 H new ATOM 0 HH12 ARG A 671 -23.280 -26.006 -20.938 1.00 0.00 H new ATOM 0 HH21 ARG A 671 -26.095 -25.405 -22.977 1.00 0.00 H new ATOM 0 HH22 ARG A 671 -25.364 -26.473 -21.774 1.00 0.00 H new ATOM 316 N LYS A 672 -19.807 -18.979 -24.678 1.00 0.00 N ATOM 317 CA LYS A 672 -19.263 -17.672 -25.077 1.00 0.00 C ATOM 318 C LYS A 672 -17.724 -17.714 -25.188 1.00 0.00 C ATOM 319 O LYS A 672 -17.050 -18.035 -24.204 1.00 0.00 O ATOM 320 CB LYS A 672 -19.680 -16.579 -24.065 1.00 0.00 C ATOM 321 CG LYS A 672 -21.203 -16.468 -23.838 1.00 0.00 C ATOM 322 CD LYS A 672 -22.019 -16.182 -25.125 1.00 0.00 C ATOM 323 CE LYS A 672 -21.809 -14.767 -25.694 1.00 0.00 C ATOM 324 NZ LYS A 672 -22.280 -13.715 -24.748 1.00 0.00 N ATOM 0 H LYS A 672 -19.941 -19.074 -23.671 1.00 0.00 H new ATOM 0 HA LYS A 672 -19.674 -17.432 -26.058 1.00 0.00 H new ATOM 0 HB2 LYS A 672 -19.196 -16.782 -23.110 1.00 0.00 H new ATOM 0 HB3 LYS A 672 -19.306 -15.616 -24.414 1.00 0.00 H new ATOM 0 HG2 LYS A 672 -21.561 -17.396 -23.393 1.00 0.00 H new ATOM 0 HG3 LYS A 672 -21.394 -15.674 -23.116 1.00 0.00 H new ATOM 0 HD2 LYS A 672 -21.747 -16.913 -25.886 1.00 0.00 H new ATOM 0 HD3 LYS A 672 -23.078 -16.324 -24.911 1.00 0.00 H new ATOM 0 HE2 LYS A 672 -20.751 -14.615 -25.910 1.00 0.00 H new ATOM 0 HE3 LYS A 672 -22.344 -14.672 -26.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 672 -23.115 -13.240 -25.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 672 -22.531 -14.153 -23.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 672 -21.523 -13.018 -24.599 1.00 0.00 H new ATOM 338 N PRO A 673 -17.147 -17.332 -26.368 1.00 0.00 N ATOM 339 CA PRO A 673 -15.685 -17.373 -26.590 1.00 0.00 C ATOM 340 C PRO A 673 -14.943 -16.322 -25.735 1.00 0.00 C ATOM 341 O PRO A 673 -15.464 -15.224 -25.534 1.00 0.00 O ATOM 342 CB PRO A 673 -15.540 -17.084 -28.092 1.00 0.00 C ATOM 343 CG PRO A 673 -16.768 -16.316 -28.469 1.00 0.00 C ATOM 344 CD PRO A 673 -17.870 -16.802 -27.553 1.00 0.00 C ATOM 0 HA PRO A 673 -15.245 -18.327 -26.298 1.00 0.00 H new ATOM 0 HB2 PRO A 673 -14.638 -16.507 -28.296 1.00 0.00 H new ATOM 0 HB3 PRO A 673 -15.463 -18.008 -28.664 1.00 0.00 H new ATOM 0 HG2 PRO A 673 -16.608 -15.244 -28.351 1.00 0.00 H new ATOM 0 HG3 PRO A 673 -17.028 -16.486 -29.514 1.00 0.00 H new ATOM 0 HD2 PRO A 673 -18.546 -15.993 -27.278 1.00 0.00 H new ATOM 0 HD3 PRO A 673 -18.474 -17.574 -28.030 1.00 0.00 H new ATOM 352 N ARG A 674 -13.722 -16.652 -25.266 1.00 0.00 N ATOM 353 CA ARG A 674 -12.984 -15.832 -24.282 1.00 0.00 C ATOM 354 C ARG A 674 -11.529 -15.579 -24.714 1.00 0.00 C ATOM 355 O ARG A 674 -10.821 -16.501 -25.126 1.00 0.00 O ATOM 356 CB ARG A 674 -13.103 -16.439 -22.841 1.00 0.00 C ATOM 357 CG ARG A 674 -12.902 -17.970 -22.708 1.00 0.00 C ATOM 358 CD ARG A 674 -11.444 -18.425 -22.701 1.00 0.00 C ATOM 359 NE ARG A 674 -11.289 -19.887 -22.575 1.00 0.00 N ATOM 360 CZ ARG A 674 -10.193 -20.493 -22.099 1.00 0.00 C ATOM 361 NH1 ARG A 674 -9.219 -19.801 -21.520 1.00 0.00 N ATOM 362 NH2 ARG A 674 -10.100 -21.807 -22.165 1.00 0.00 N ATOM 0 H ARG A 674 -13.221 -17.491 -25.557 1.00 0.00 H new ATOM 0 HA ARG A 674 -13.453 -14.849 -24.247 1.00 0.00 H new ATOM 0 HB2 ARG A 674 -12.371 -15.944 -22.202 1.00 0.00 H new ATOM 0 HB3 ARG A 674 -14.089 -16.191 -22.448 1.00 0.00 H new ATOM 0 HG2 ARG A 674 -13.378 -18.306 -21.787 1.00 0.00 H new ATOM 0 HG3 ARG A 674 -13.418 -18.463 -23.532 1.00 0.00 H new ATOM 0 HD2 ARG A 674 -10.963 -18.094 -23.621 1.00 0.00 H new ATOM 0 HD3 ARG A 674 -10.923 -17.939 -21.876 1.00 0.00 H new ATOM 0 HE ARG A 674 -12.068 -20.475 -22.870 1.00 0.00 H new ATOM 0 HH11 ARG A 674 -9.297 -18.788 -21.431 1.00 0.00 H new ATOM 0 HH12 ARG A 674 -8.393 -20.282 -21.164 1.00 0.00 H new ATOM 0 HH21 ARG A 674 -10.858 -22.352 -22.576 1.00 0.00 H new ATOM 0 HH22 ARG A 674 -9.270 -22.278 -21.806 1.00 0.00 H new ATOM 376 N VAL A 675 -11.101 -14.306 -24.612 1.00 0.00 N ATOM 377 CA VAL A 675 -9.769 -13.853 -25.038 1.00 0.00 C ATOM 378 C VAL A 675 -8.868 -13.540 -23.817 1.00 0.00 C ATOM 379 O VAL A 675 -9.203 -12.716 -22.953 1.00 0.00 O ATOM 380 CB VAL A 675 -9.876 -12.618 -26.014 1.00 0.00 C ATOM 381 CG1 VAL A 675 -10.616 -13.018 -27.307 1.00 0.00 C ATOM 382 CG2 VAL A 675 -10.550 -11.383 -25.370 1.00 0.00 C ATOM 0 H VAL A 675 -11.678 -13.558 -24.227 1.00 0.00 H new ATOM 0 HA VAL A 675 -9.297 -14.666 -25.590 1.00 0.00 H new ATOM 0 HB VAL A 675 -8.854 -12.324 -26.251 1.00 0.00 H new ATOM 0 HG11 VAL A 675 -10.682 -12.155 -27.970 1.00 0.00 H new ATOM 0 HG12 VAL A 675 -10.070 -13.819 -27.806 1.00 0.00 H new ATOM 0 HG13 VAL A 675 -11.620 -13.363 -27.060 1.00 0.00 H new ATOM 0 HG21 VAL A 675 -10.591 -10.571 -26.096 1.00 0.00 H new ATOM 0 HG22 VAL A 675 -11.562 -11.642 -25.058 1.00 0.00 H new ATOM 0 HG23 VAL A 675 -9.973 -11.065 -24.502 1.00 0.00 H new ATOM 392 N GLN A 676 -7.743 -14.271 -23.739 1.00 0.00 N ATOM 393 CA GLN A 676 -6.724 -14.114 -22.689 1.00 0.00 C ATOM 394 C GLN A 676 -5.780 -12.999 -23.117 1.00 0.00 C ATOM 395 O GLN A 676 -4.830 -13.233 -23.871 1.00 0.00 O ATOM 396 CB GLN A 676 -5.933 -15.450 -22.444 1.00 0.00 C ATOM 397 CG GLN A 676 -6.747 -16.605 -21.818 1.00 0.00 C ATOM 398 CD GLN A 676 -7.924 -17.048 -22.679 1.00 0.00 C ATOM 399 OE1 GLN A 676 -7.803 -17.940 -23.513 1.00 0.00 O ATOM 400 NE2 GLN A 676 -9.069 -16.402 -22.496 1.00 0.00 N ATOM 0 H GLN A 676 -7.513 -14.999 -24.415 1.00 0.00 H new ATOM 0 HA GLN A 676 -7.209 -13.862 -21.746 1.00 0.00 H new ATOM 0 HB2 GLN A 676 -5.527 -15.791 -23.397 1.00 0.00 H new ATOM 0 HB3 GLN A 676 -5.084 -15.235 -21.795 1.00 0.00 H new ATOM 0 HG2 GLN A 676 -6.087 -17.456 -21.651 1.00 0.00 H new ATOM 0 HG3 GLN A 676 -7.117 -16.292 -20.842 1.00 0.00 H new ATOM 0 HE21 GLN A 676 -9.132 -15.666 -21.793 1.00 0.00 H new ATOM 0 HE22 GLN A 676 -9.885 -16.642 -23.058 1.00 0.00 H new ATOM 409 N CYS A 677 -6.094 -11.765 -22.696 1.00 0.00 N ATOM 410 CA CYS A 677 -5.269 -10.597 -23.003 1.00 0.00 C ATOM 411 C CYS A 677 -3.899 -10.723 -22.325 1.00 0.00 C ATOM 412 O CYS A 677 -3.703 -10.241 -21.211 1.00 0.00 O ATOM 413 CB CYS A 677 -5.960 -9.296 -22.567 1.00 0.00 C ATOM 414 SG CYS A 677 -4.994 -7.814 -22.984 1.00 0.00 S ATOM 0 H CYS A 677 -6.921 -11.554 -22.138 1.00 0.00 H new ATOM 0 HA CYS A 677 -5.130 -10.558 -24.083 1.00 0.00 H new ATOM 0 HB2 CYS A 677 -6.939 -9.232 -23.043 1.00 0.00 H new ATOM 0 HB3 CYS A 677 -6.130 -9.323 -21.491 1.00 0.00 H new ATOM 419 N LEU A 678 -2.972 -11.393 -23.026 1.00 0.00 N ATOM 420 CA LEU A 678 -1.618 -11.726 -22.522 1.00 0.00 C ATOM 421 C LEU A 678 -0.784 -10.470 -22.172 1.00 0.00 C ATOM 422 O LEU A 678 0.147 -10.527 -21.361 1.00 0.00 O ATOM 423 CB LEU A 678 -0.914 -12.640 -23.572 1.00 0.00 C ATOM 424 CG LEU A 678 -0.863 -12.119 -25.061 1.00 0.00 C ATOM 425 CD1 LEU A 678 0.319 -11.160 -25.320 1.00 0.00 C ATOM 426 CD2 LEU A 678 -0.858 -13.288 -26.075 1.00 0.00 C ATOM 0 H LEU A 678 -3.138 -11.727 -23.975 1.00 0.00 H new ATOM 0 HA LEU A 678 -1.710 -12.265 -21.579 1.00 0.00 H new ATOM 0 HB2 LEU A 678 0.109 -12.812 -23.239 1.00 0.00 H new ATOM 0 HB3 LEU A 678 -1.417 -13.607 -23.569 1.00 0.00 H new ATOM 0 HG LEU A 678 -1.776 -11.543 -25.210 1.00 0.00 H new ATOM 0 HD11 LEU A 678 0.302 -10.835 -26.360 1.00 0.00 H new ATOM 0 HD12 LEU A 678 0.233 -10.292 -24.667 1.00 0.00 H new ATOM 0 HD13 LEU A 678 1.257 -11.676 -25.116 1.00 0.00 H new ATOM 0 HD21 LEU A 678 -0.822 -12.890 -27.089 1.00 0.00 H new ATOM 0 HD22 LEU A 678 0.015 -13.917 -25.901 1.00 0.00 H new ATOM 0 HD23 LEU A 678 -1.763 -13.882 -25.950 1.00 0.00 H new ATOM 438 N LYS A 679 -1.163 -9.339 -22.789 1.00 0.00 N ATOM 439 CA LYS A 679 -0.520 -8.034 -22.586 1.00 0.00 C ATOM 440 C LYS A 679 -0.742 -7.482 -21.149 1.00 0.00 C ATOM 441 O LYS A 679 0.022 -6.631 -20.687 1.00 0.00 O ATOM 442 CB LYS A 679 -1.033 -7.056 -23.677 1.00 0.00 C ATOM 443 CG LYS A 679 -0.418 -5.638 -23.646 1.00 0.00 C ATOM 444 CD LYS A 679 -0.692 -4.813 -24.932 1.00 0.00 C ATOM 445 CE LYS A 679 0.039 -5.380 -26.164 1.00 0.00 C ATOM 446 NZ LYS A 679 -0.017 -4.471 -27.333 1.00 0.00 N ATOM 0 H LYS A 679 -1.937 -9.307 -23.453 1.00 0.00 H new ATOM 0 HA LYS A 679 0.560 -8.148 -22.684 1.00 0.00 H new ATOM 0 HB2 LYS A 679 -0.837 -7.496 -24.655 1.00 0.00 H new ATOM 0 HB3 LYS A 679 -2.115 -6.966 -23.579 1.00 0.00 H new ATOM 0 HG2 LYS A 679 -0.815 -5.098 -22.786 1.00 0.00 H new ATOM 0 HG3 LYS A 679 0.659 -5.721 -23.501 1.00 0.00 H new ATOM 0 HD2 LYS A 679 -1.764 -4.795 -25.126 1.00 0.00 H new ATOM 0 HD3 LYS A 679 -0.380 -3.781 -24.771 1.00 0.00 H new ATOM 0 HE2 LYS A 679 1.081 -5.570 -25.907 1.00 0.00 H new ATOM 0 HE3 LYS A 679 -0.403 -6.339 -26.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 679 0.022 -5.030 -28.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 679 -0.903 -3.928 -27.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 679 0.791 -3.817 -27.303 1.00 0.00 H new ATOM 460 N CYS A 680 -1.779 -7.992 -20.429 1.00 0.00 N ATOM 461 CA CYS A 680 -2.020 -7.612 -19.011 1.00 0.00 C ATOM 462 C CYS A 680 -2.674 -8.764 -18.201 1.00 0.00 C ATOM 463 O CYS A 680 -3.197 -8.527 -17.106 1.00 0.00 O ATOM 464 CB CYS A 680 -2.879 -6.320 -18.935 1.00 0.00 C ATOM 465 SG CYS A 680 -4.620 -6.538 -19.411 1.00 0.00 S ATOM 0 H CYS A 680 -2.453 -8.659 -20.803 1.00 0.00 H new ATOM 0 HA CYS A 680 -1.050 -7.414 -18.554 1.00 0.00 H new ATOM 0 HB2 CYS A 680 -2.840 -5.933 -17.917 1.00 0.00 H new ATOM 0 HB3 CYS A 680 -2.432 -5.564 -19.580 1.00 0.00 H new ATOM 470 N HIS A 681 -2.598 -10.012 -18.745 1.00 0.00 N ATOM 471 CA HIS A 681 -3.167 -11.249 -18.125 1.00 0.00 C ATOM 472 C HIS A 681 -4.658 -11.071 -17.735 1.00 0.00 C ATOM 473 O HIS A 681 -5.103 -11.506 -16.668 1.00 0.00 O ATOM 474 CB HIS A 681 -2.308 -11.706 -16.912 1.00 0.00 C ATOM 475 CG HIS A 681 -0.898 -12.114 -17.273 1.00 0.00 C ATOM 476 ND1 HIS A 681 -0.426 -13.401 -17.133 1.00 0.00 N ATOM 477 CD2 HIS A 681 0.143 -11.388 -17.753 1.00 0.00 C ATOM 478 CE1 HIS A 681 0.840 -13.447 -17.501 1.00 0.00 C ATOM 479 NE2 HIS A 681 1.209 -12.241 -17.884 1.00 0.00 N ATOM 0 H HIS A 681 -2.135 -10.191 -19.636 1.00 0.00 H new ATOM 0 HA HIS A 681 -3.132 -12.038 -18.876 1.00 0.00 H new ATOM 0 HB2 HIS A 681 -2.265 -10.895 -16.185 1.00 0.00 H new ATOM 0 HB3 HIS A 681 -2.804 -12.545 -16.425 1.00 0.00 H new ATOM 0 HD2 HIS A 681 0.134 -10.334 -17.988 1.00 0.00 H new ATOM 0 HE1 HIS A 681 1.468 -14.325 -17.490 1.00 0.00 H new ATOM 0 HE2 HIS A 681 2.136 -11.984 -18.223 1.00 0.00 H new ATOM 488 N LEU A 682 -5.426 -10.449 -18.640 1.00 0.00 N ATOM 489 CA LEU A 682 -6.829 -10.067 -18.390 1.00 0.00 C ATOM 490 C LEU A 682 -7.753 -11.076 -19.099 1.00 0.00 C ATOM 491 O LEU A 682 -7.657 -11.249 -20.319 1.00 0.00 O ATOM 492 CB LEU A 682 -7.071 -8.610 -18.907 1.00 0.00 C ATOM 493 CG LEU A 682 -8.178 -7.765 -18.199 1.00 0.00 C ATOM 494 CD1 LEU A 682 -9.576 -8.376 -18.365 1.00 0.00 C ATOM 495 CD2 LEU A 682 -7.834 -7.550 -16.715 1.00 0.00 C ATOM 0 H LEU A 682 -5.094 -10.194 -19.570 1.00 0.00 H new ATOM 0 HA LEU A 682 -7.048 -10.086 -17.322 1.00 0.00 H new ATOM 0 HB2 LEU A 682 -6.130 -8.065 -18.828 1.00 0.00 H new ATOM 0 HB3 LEU A 682 -7.318 -8.667 -19.967 1.00 0.00 H new ATOM 0 HG LEU A 682 -8.204 -6.792 -18.690 1.00 0.00 H new ATOM 0 HD11 LEU A 682 -10.309 -7.751 -17.855 1.00 0.00 H new ATOM 0 HD12 LEU A 682 -9.824 -8.435 -19.425 1.00 0.00 H new ATOM 0 HD13 LEU A 682 -9.589 -9.377 -17.933 1.00 0.00 H new ATOM 0 HD21 LEU A 682 -8.618 -6.959 -16.242 1.00 0.00 H new ATOM 0 HD22 LEU A 682 -7.756 -8.516 -16.216 1.00 0.00 H new ATOM 0 HD23 LEU A 682 -6.884 -7.022 -16.635 1.00 0.00 H new ATOM 507 N TRP A 683 -8.652 -11.714 -18.328 1.00 0.00 N ATOM 508 CA TRP A 683 -9.541 -12.773 -18.836 1.00 0.00 C ATOM 509 C TRP A 683 -10.866 -12.147 -19.286 1.00 0.00 C ATOM 510 O TRP A 683 -11.759 -11.898 -18.470 1.00 0.00 O ATOM 511 CB TRP A 683 -9.777 -13.874 -17.757 1.00 0.00 C ATOM 512 CG TRP A 683 -8.544 -14.291 -16.965 1.00 0.00 C ATOM 513 CD1 TRP A 683 -8.506 -14.541 -15.626 1.00 0.00 C ATOM 514 CD2 TRP A 683 -7.193 -14.499 -17.439 1.00 0.00 C ATOM 515 NE1 TRP A 683 -7.239 -14.864 -15.235 1.00 0.00 N ATOM 516 CE2 TRP A 683 -6.416 -14.849 -16.325 1.00 0.00 C ATOM 517 CE3 TRP A 683 -6.563 -14.421 -18.688 1.00 0.00 C ATOM 518 CZ2 TRP A 683 -5.053 -15.113 -16.413 1.00 0.00 C ATOM 519 CZ3 TRP A 683 -5.210 -14.685 -18.774 1.00 0.00 C ATOM 520 CH2 TRP A 683 -4.468 -15.029 -17.640 1.00 0.00 C ATOM 0 H TRP A 683 -8.782 -11.510 -17.337 1.00 0.00 H new ATOM 0 HA TRP A 683 -9.067 -13.257 -19.690 1.00 0.00 H new ATOM 0 HB2 TRP A 683 -10.533 -13.517 -17.058 1.00 0.00 H new ATOM 0 HB3 TRP A 683 -10.188 -14.756 -18.247 1.00 0.00 H new ATOM 0 HD1 TRP A 683 -9.360 -14.491 -14.966 1.00 0.00 H new ATOM 0 HE1 TRP A 683 -6.952 -15.082 -14.281 1.00 0.00 H new ATOM 0 HE3 TRP A 683 -7.127 -14.158 -19.571 1.00 0.00 H new ATOM 0 HZ2 TRP A 683 -4.478 -15.376 -15.537 1.00 0.00 H new ATOM 0 HZ3 TRP A 683 -4.717 -14.625 -19.733 1.00 0.00 H new ATOM 0 HH2 TRP A 683 -3.412 -15.232 -17.739 1.00 0.00 H new ATOM 531 N GLN A 684 -10.960 -11.847 -20.590 1.00 0.00 N ATOM 532 CA GLN A 684 -12.143 -11.198 -21.182 1.00 0.00 C ATOM 533 C GLN A 684 -12.799 -12.135 -22.213 1.00 0.00 C ATOM 534 O GLN A 684 -12.397 -13.287 -22.340 1.00 0.00 O ATOM 535 CB GLN A 684 -11.725 -9.817 -21.795 1.00 0.00 C ATOM 536 CG GLN A 684 -12.812 -8.704 -21.668 1.00 0.00 C ATOM 537 CD GLN A 684 -12.290 -7.389 -21.086 1.00 0.00 C ATOM 538 OE1 GLN A 684 -11.929 -6.482 -21.810 1.00 0.00 O ATOM 539 NE2 GLN A 684 -12.185 -7.321 -19.768 1.00 0.00 N ATOM 0 H GLN A 684 -10.221 -12.046 -21.264 1.00 0.00 H new ATOM 0 HA GLN A 684 -12.892 -11.002 -20.415 1.00 0.00 H new ATOM 0 HB2 GLN A 684 -10.813 -9.476 -21.305 1.00 0.00 H new ATOM 0 HB3 GLN A 684 -11.487 -9.958 -22.849 1.00 0.00 H new ATOM 0 HG2 GLN A 684 -13.236 -8.510 -22.653 1.00 0.00 H new ATOM 0 HG3 GLN A 684 -13.622 -9.072 -21.039 1.00 0.00 H new ATOM 0 HE21 GLN A 684 -12.498 -8.101 -19.191 1.00 0.00 H new ATOM 0 HE22 GLN A 684 -11.791 -6.488 -19.330 1.00 0.00 H new ATOM 548 N HIS A 685 -13.840 -11.651 -22.917 1.00 0.00 N ATOM 549 CA HIS A 685 -14.513 -12.423 -23.990 1.00 0.00 C ATOM 550 C HIS A 685 -14.221 -11.834 -25.366 1.00 0.00 C ATOM 551 O HIS A 685 -13.977 -10.631 -25.485 1.00 0.00 O ATOM 552 CB HIS A 685 -16.039 -12.483 -23.784 1.00 0.00 C ATOM 553 CG HIS A 685 -16.512 -13.426 -22.707 1.00 0.00 C ATOM 554 ND1 HIS A 685 -17.284 -12.959 -21.696 1.00 0.00 N ATOM 555 CD2 HIS A 685 -16.360 -14.767 -22.565 1.00 0.00 C ATOM 556 CE1 HIS A 685 -17.599 -13.994 -20.956 1.00 0.00 C ATOM 557 NE2 HIS A 685 -17.062 -15.120 -21.446 1.00 0.00 N ATOM 0 H HIS A 685 -14.238 -10.724 -22.764 1.00 0.00 H new ATOM 0 HA HIS A 685 -14.111 -13.435 -23.937 1.00 0.00 H new ATOM 0 HB2 HIS A 685 -16.396 -11.481 -23.547 1.00 0.00 H new ATOM 0 HB3 HIS A 685 -16.504 -12.773 -24.726 1.00 0.00 H new ATOM 0 HD2 HIS A 685 -15.796 -15.425 -23.209 1.00 0.00 H new ATOM 0 HE1 HIS A 685 -18.211 -13.946 -20.068 1.00 0.00 H new ATOM 0 HE2 HIS A 685 -17.158 -16.059 -21.059 1.00 0.00 H new ATOM 565 N ALA A 686 -14.289 -12.698 -26.393 1.00 0.00 N ATOM 566 CA ALA A 686 -14.128 -12.304 -27.793 1.00 0.00 C ATOM 567 C ALA A 686 -15.229 -11.306 -28.215 1.00 0.00 C ATOM 568 O ALA A 686 -14.945 -10.146 -28.494 1.00 0.00 O ATOM 569 CB ALA A 686 -14.133 -13.552 -28.695 1.00 0.00 C ATOM 0 H ALA A 686 -14.459 -13.696 -26.268 1.00 0.00 H new ATOM 0 HA ALA A 686 -13.168 -11.800 -27.907 1.00 0.00 H new ATOM 0 HB1 ALA A 686 -14.013 -13.250 -29.735 1.00 0.00 H new ATOM 0 HB2 ALA A 686 -13.311 -14.210 -28.411 1.00 0.00 H new ATOM 0 HB3 ALA A 686 -15.079 -14.082 -28.578 1.00 0.00 H new ATOM 575 N LYS A 687 -16.494 -11.764 -28.204 1.00 0.00 N ATOM 576 CA LYS A 687 -17.647 -10.963 -28.697 1.00 0.00 C ATOM 577 C LYS A 687 -17.890 -9.691 -27.843 1.00 0.00 C ATOM 578 O LYS A 687 -18.472 -8.719 -28.337 1.00 0.00 O ATOM 579 CB LYS A 687 -18.938 -11.843 -28.791 1.00 0.00 C ATOM 580 CG LYS A 687 -19.168 -12.532 -30.162 1.00 0.00 C ATOM 581 CD LYS A 687 -18.070 -13.546 -30.556 1.00 0.00 C ATOM 582 CE LYS A 687 -18.304 -14.159 -31.952 1.00 0.00 C ATOM 583 NZ LYS A 687 -19.645 -14.800 -32.079 1.00 0.00 N ATOM 0 H LYS A 687 -16.752 -12.688 -27.859 1.00 0.00 H new ATOM 0 HA LYS A 687 -17.395 -10.620 -29.701 1.00 0.00 H new ATOM 0 HB2 LYS A 687 -18.892 -12.611 -28.019 1.00 0.00 H new ATOM 0 HB3 LYS A 687 -19.802 -11.218 -28.567 1.00 0.00 H new ATOM 0 HG2 LYS A 687 -20.129 -13.045 -30.141 1.00 0.00 H new ATOM 0 HG3 LYS A 687 -19.233 -11.766 -30.934 1.00 0.00 H new ATOM 0 HD2 LYS A 687 -17.099 -13.050 -30.539 1.00 0.00 H new ATOM 0 HD3 LYS A 687 -18.034 -14.344 -29.814 1.00 0.00 H new ATOM 0 HE2 LYS A 687 -18.204 -13.380 -32.708 1.00 0.00 H new ATOM 0 HE3 LYS A 687 -17.530 -14.900 -32.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 687 -19.707 -15.298 -32.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 687 -19.780 -15.480 -31.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 687 -20.384 -14.070 -32.032 1.00 0.00 H new ATOM 597 N CYS A 688 -17.420 -9.705 -26.577 1.00 0.00 N ATOM 598 CA CYS A 688 -17.518 -8.534 -25.670 1.00 0.00 C ATOM 599 C CYS A 688 -16.555 -7.399 -26.095 1.00 0.00 C ATOM 600 O CYS A 688 -16.783 -6.232 -25.759 1.00 0.00 O ATOM 601 CB CYS A 688 -17.230 -8.935 -24.214 1.00 0.00 C ATOM 602 SG CYS A 688 -18.430 -10.100 -23.494 1.00 0.00 S ATOM 0 H CYS A 688 -16.967 -10.516 -26.156 1.00 0.00 H new ATOM 0 HA CYS A 688 -18.541 -8.164 -25.742 1.00 0.00 H new ATOM 0 HB2 CYS A 688 -16.237 -9.381 -24.164 1.00 0.00 H new ATOM 0 HB3 CYS A 688 -17.206 -8.034 -23.601 1.00 0.00 H new ATOM 607 N VAL A 689 -15.466 -7.759 -26.810 1.00 0.00 N ATOM 608 CA VAL A 689 -14.443 -6.792 -27.286 1.00 0.00 C ATOM 609 C VAL A 689 -14.472 -6.679 -28.838 1.00 0.00 C ATOM 610 O VAL A 689 -13.531 -6.155 -29.452 1.00 0.00 O ATOM 611 CB VAL A 689 -13.000 -7.193 -26.758 1.00 0.00 C ATOM 612 CG1 VAL A 689 -13.016 -7.421 -25.225 1.00 0.00 C ATOM 613 CG2 VAL A 689 -12.415 -8.433 -27.477 1.00 0.00 C ATOM 0 H VAL A 689 -15.269 -8.724 -27.074 1.00 0.00 H new ATOM 0 HA VAL A 689 -14.681 -5.809 -26.879 1.00 0.00 H new ATOM 0 HB VAL A 689 -12.346 -6.352 -26.990 1.00 0.00 H new ATOM 0 HG11 VAL A 689 -12.016 -7.695 -24.887 1.00 0.00 H new ATOM 0 HG12 VAL A 689 -13.330 -6.505 -24.724 1.00 0.00 H new ATOM 0 HG13 VAL A 689 -13.713 -8.224 -24.984 1.00 0.00 H new ATOM 0 HG21 VAL A 689 -11.428 -8.657 -27.072 1.00 0.00 H new ATOM 0 HG22 VAL A 689 -13.073 -9.288 -27.322 1.00 0.00 H new ATOM 0 HG23 VAL A 689 -12.331 -8.229 -28.544 1.00 0.00 H new ATOM 623 N ASN A 690 -15.589 -7.170 -29.446 1.00 0.00 N ATOM 624 CA ASN A 690 -15.843 -7.149 -30.918 1.00 0.00 C ATOM 625 C ASN A 690 -14.849 -8.029 -31.718 1.00 0.00 C ATOM 626 O ASN A 690 -14.664 -7.861 -32.931 1.00 0.00 O ATOM 627 CB ASN A 690 -15.904 -5.688 -31.463 1.00 0.00 C ATOM 628 CG ASN A 690 -17.144 -4.915 -30.985 1.00 0.00 C ATOM 629 OD1 ASN A 690 -18.220 -5.491 -30.791 1.00 0.00 O ATOM 630 ND2 ASN A 690 -17.007 -3.614 -30.803 1.00 0.00 N ATOM 0 H ASN A 690 -16.351 -7.598 -28.920 1.00 0.00 H new ATOM 0 HA ASN A 690 -16.824 -7.599 -31.070 1.00 0.00 H new ATOM 0 HB2 ASN A 690 -15.007 -5.153 -31.151 1.00 0.00 H new ATOM 0 HB3 ASN A 690 -15.897 -5.713 -32.553 1.00 0.00 H new ATOM 0 HD21 ASN A 690 -17.803 -3.056 -30.494 1.00 0.00 H new ATOM 0 HD22 ASN A 690 -16.106 -3.168 -30.972 1.00 0.00 H new ATOM 637 N TYR A 691 -14.249 -8.990 -31.019 1.00 0.00 N ATOM 638 CA TYR A 691 -13.379 -10.039 -31.590 1.00 0.00 C ATOM 639 C TYR A 691 -14.223 -11.329 -31.771 1.00 0.00 C ATOM 640 O TYR A 691 -15.338 -11.405 -31.243 1.00 0.00 O ATOM 641 CB TYR A 691 -12.185 -10.231 -30.610 1.00 0.00 C ATOM 642 CG TYR A 691 -10.985 -11.031 -31.132 1.00 0.00 C ATOM 643 CD1 TYR A 691 -10.022 -10.437 -31.957 1.00 0.00 C ATOM 644 CD2 TYR A 691 -10.796 -12.360 -30.773 1.00 0.00 C ATOM 645 CE1 TYR A 691 -8.931 -11.152 -32.405 1.00 0.00 C ATOM 646 CE2 TYR A 691 -9.708 -13.073 -31.217 1.00 0.00 C ATOM 647 CZ TYR A 691 -8.777 -12.467 -32.029 1.00 0.00 C ATOM 648 OH TYR A 691 -7.702 -13.185 -32.477 1.00 0.00 O ATOM 0 H TYR A 691 -14.352 -9.071 -30.007 1.00 0.00 H new ATOM 0 HA TYR A 691 -12.981 -9.773 -32.569 1.00 0.00 H new ATOM 0 HB2 TYR A 691 -11.831 -9.245 -30.308 1.00 0.00 H new ATOM 0 HB3 TYR A 691 -12.558 -10.724 -29.712 1.00 0.00 H new ATOM 0 HD1 TYR A 691 -10.135 -9.403 -32.247 1.00 0.00 H new ATOM 0 HD2 TYR A 691 -11.519 -12.843 -30.132 1.00 0.00 H new ATOM 0 HE1 TYR A 691 -8.201 -10.682 -33.048 1.00 0.00 H new ATOM 0 HE2 TYR A 691 -9.584 -14.107 -30.929 1.00 0.00 H new ATOM 0 HH TYR A 691 -7.951 -14.129 -32.562 1.00 0.00 H new ATOM 658 N ASP A 692 -13.733 -12.331 -32.522 1.00 0.00 N ATOM 659 CA ASP A 692 -14.490 -13.603 -32.736 1.00 0.00 C ATOM 660 C ASP A 692 -13.619 -14.827 -32.427 1.00 0.00 C ATOM 661 O ASP A 692 -12.411 -14.694 -32.194 1.00 0.00 O ATOM 662 CB ASP A 692 -15.068 -13.682 -34.175 1.00 0.00 C ATOM 663 CG ASP A 692 -13.993 -13.753 -35.274 1.00 0.00 C ATOM 664 OD1 ASP A 692 -13.484 -14.860 -35.554 1.00 0.00 O ATOM 665 OD2 ASP A 692 -13.654 -12.704 -35.863 1.00 0.00 O ATOM 0 H ASP A 692 -12.828 -12.298 -32.991 1.00 0.00 H new ATOM 0 HA ASP A 692 -15.329 -13.605 -32.040 1.00 0.00 H new ATOM 0 HB2 ASP A 692 -15.710 -14.560 -34.251 1.00 0.00 H new ATOM 0 HB3 ASP A 692 -15.698 -12.810 -34.352 1.00 0.00 H new ATOM 670 N GLU A 693 -14.236 -16.038 -32.450 1.00 0.00 N ATOM 671 CA GLU A 693 -13.551 -17.276 -32.024 1.00 0.00 C ATOM 672 C GLU A 693 -12.816 -17.980 -33.176 1.00 0.00 C ATOM 673 O GLU A 693 -11.825 -18.682 -32.933 1.00 0.00 O ATOM 674 CB GLU A 693 -14.504 -18.223 -31.244 1.00 0.00 C ATOM 675 CG GLU A 693 -15.645 -18.914 -32.026 1.00 0.00 C ATOM 676 CD GLU A 693 -15.342 -20.386 -32.398 1.00 0.00 C ATOM 677 OE1 GLU A 693 -15.305 -21.237 -31.483 1.00 0.00 O ATOM 678 OE2 GLU A 693 -15.150 -20.702 -33.585 1.00 0.00 O ATOM 0 H GLU A 693 -15.199 -16.177 -32.757 1.00 0.00 H new ATOM 0 HA GLU A 693 -12.770 -16.976 -31.325 1.00 0.00 H new ATOM 0 HB2 GLU A 693 -13.896 -19.002 -30.783 1.00 0.00 H new ATOM 0 HB3 GLU A 693 -14.955 -17.649 -30.434 1.00 0.00 H new ATOM 0 HG2 GLU A 693 -16.556 -18.880 -31.428 1.00 0.00 H new ATOM 0 HG3 GLU A 693 -15.841 -18.351 -32.938 1.00 0.00 H new ATOM 685 N LYS A 694 -13.243 -17.724 -34.425 1.00 0.00 N ATOM 686 CA LYS A 694 -12.602 -18.309 -35.629 1.00 0.00 C ATOM 687 C LYS A 694 -11.121 -17.891 -35.708 1.00 0.00 C ATOM 688 O LYS A 694 -10.267 -18.694 -36.106 1.00 0.00 O ATOM 689 CB LYS A 694 -13.364 -17.914 -36.937 1.00 0.00 C ATOM 690 CG LYS A 694 -14.629 -18.760 -37.255 1.00 0.00 C ATOM 691 CD LYS A 694 -15.682 -18.718 -36.129 1.00 0.00 C ATOM 692 CE LYS A 694 -16.905 -19.607 -36.399 1.00 0.00 C ATOM 693 NZ LYS A 694 -17.757 -19.731 -35.185 1.00 0.00 N ATOM 0 H LYS A 694 -14.033 -17.113 -34.634 1.00 0.00 H new ATOM 0 HA LYS A 694 -12.652 -19.394 -35.539 1.00 0.00 H new ATOM 0 HB2 LYS A 694 -13.657 -16.867 -36.864 1.00 0.00 H new ATOM 0 HB3 LYS A 694 -12.674 -17.994 -37.777 1.00 0.00 H new ATOM 0 HG2 LYS A 694 -15.079 -18.397 -38.179 1.00 0.00 H new ATOM 0 HG3 LYS A 694 -14.333 -19.794 -37.429 1.00 0.00 H new ATOM 0 HD2 LYS A 694 -15.215 -19.030 -35.195 1.00 0.00 H new ATOM 0 HD3 LYS A 694 -16.014 -17.689 -35.991 1.00 0.00 H new ATOM 0 HE2 LYS A 694 -17.491 -19.186 -37.216 1.00 0.00 H new ATOM 0 HE3 LYS A 694 -16.576 -20.596 -36.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 694 -18.519 -20.416 -35.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 694 -17.177 -20.059 -34.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 694 -18.171 -18.805 -34.955 1.00 0.00 H new ATOM 707 N ASN A 695 -10.824 -16.633 -35.307 1.00 0.00 N ATOM 708 CA ASN A 695 -9.438 -16.121 -35.236 1.00 0.00 C ATOM 709 C ASN A 695 -8.883 -16.109 -33.793 1.00 0.00 C ATOM 710 O ASN A 695 -7.726 -15.761 -33.591 1.00 0.00 O ATOM 711 CB ASN A 695 -9.298 -14.722 -35.910 1.00 0.00 C ATOM 712 CG ASN A 695 -10.282 -13.624 -35.478 1.00 0.00 C ATOM 713 OD1 ASN A 695 -10.550 -12.712 -36.258 1.00 0.00 O ATOM 714 ND2 ASN A 695 -10.817 -13.661 -34.262 1.00 0.00 N ATOM 0 H ASN A 695 -11.530 -15.952 -35.027 1.00 0.00 H new ATOM 0 HA ASN A 695 -8.826 -16.822 -35.804 1.00 0.00 H new ATOM 0 HB2 ASN A 695 -8.287 -14.359 -35.725 1.00 0.00 H new ATOM 0 HB3 ASN A 695 -9.396 -14.856 -36.987 1.00 0.00 H new ATOM 0 HD21 ASN A 695 -11.459 -12.926 -33.965 1.00 0.00 H new ATOM 0 HD22 ASN A 695 -10.585 -14.424 -33.626 1.00 0.00 H new ATOM 721 N LEU A 696 -9.701 -16.495 -32.804 1.00 0.00 N ATOM 722 CA LEU A 696 -9.236 -16.702 -31.398 1.00 0.00 C ATOM 723 C LEU A 696 -8.257 -17.893 -31.368 1.00 0.00 C ATOM 724 O LEU A 696 -7.223 -17.866 -30.692 1.00 0.00 O ATOM 725 CB LEU A 696 -10.479 -16.932 -30.485 1.00 0.00 C ATOM 726 CG LEU A 696 -10.328 -16.925 -28.921 1.00 0.00 C ATOM 727 CD1 LEU A 696 -11.709 -16.694 -28.259 1.00 0.00 C ATOM 728 CD2 LEU A 696 -9.698 -18.227 -28.367 1.00 0.00 C ATOM 0 H LEU A 696 -10.696 -16.675 -32.939 1.00 0.00 H new ATOM 0 HA LEU A 696 -8.706 -15.827 -31.022 1.00 0.00 H new ATOM 0 HB2 LEU A 696 -11.213 -16.168 -30.741 1.00 0.00 H new ATOM 0 HB3 LEU A 696 -10.910 -17.894 -30.763 1.00 0.00 H new ATOM 0 HG LEU A 696 -9.647 -16.110 -28.675 1.00 0.00 H new ATOM 0 HD11 LEU A 696 -11.597 -16.690 -27.175 1.00 0.00 H new ATOM 0 HD12 LEU A 696 -12.113 -15.736 -28.585 1.00 0.00 H new ATOM 0 HD13 LEU A 696 -12.390 -17.493 -28.550 1.00 0.00 H new ATOM 0 HD21 LEU A 696 -9.620 -18.161 -27.282 1.00 0.00 H new ATOM 0 HD22 LEU A 696 -10.325 -19.077 -28.635 1.00 0.00 H new ATOM 0 HD23 LEU A 696 -8.704 -18.361 -28.794 1.00 0.00 H new ATOM 740 N LYS A 697 -8.591 -18.922 -32.155 1.00 0.00 N ATOM 741 CA LYS A 697 -7.755 -20.128 -32.312 1.00 0.00 C ATOM 742 C LYS A 697 -6.576 -19.918 -33.306 1.00 0.00 C ATOM 743 O LYS A 697 -5.848 -20.870 -33.598 1.00 0.00 O ATOM 744 CB LYS A 697 -8.654 -21.345 -32.722 1.00 0.00 C ATOM 745 CG LYS A 697 -9.280 -22.119 -31.530 1.00 0.00 C ATOM 746 CD LYS A 697 -10.400 -21.349 -30.786 1.00 0.00 C ATOM 747 CE LYS A 697 -11.744 -21.366 -31.538 1.00 0.00 C ATOM 748 NZ LYS A 697 -12.386 -22.705 -31.569 1.00 0.00 N ATOM 0 H LYS A 697 -9.450 -18.946 -32.704 1.00 0.00 H new ATOM 0 HA LYS A 697 -7.291 -20.341 -31.349 1.00 0.00 H new ATOM 0 HB2 LYS A 697 -9.457 -20.986 -33.366 1.00 0.00 H new ATOM 0 HB3 LYS A 697 -8.056 -22.038 -33.314 1.00 0.00 H new ATOM 0 HG2 LYS A 697 -9.686 -23.062 -31.897 1.00 0.00 H new ATOM 0 HG3 LYS A 697 -8.492 -22.367 -30.819 1.00 0.00 H new ATOM 0 HD2 LYS A 697 -10.538 -21.785 -29.797 1.00 0.00 H new ATOM 0 HD3 LYS A 697 -10.086 -20.316 -30.638 1.00 0.00 H new ATOM 0 HE2 LYS A 697 -12.424 -20.656 -31.067 1.00 0.00 H new ATOM 0 HE3 LYS A 697 -11.584 -21.024 -32.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 697 -13.420 -22.595 -31.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 697 -12.106 -23.204 -32.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 697 -12.082 -23.255 -30.740 1.00 0.00 H new ATOM 762 N ILE A 698 -6.372 -18.672 -33.803 1.00 0.00 N ATOM 763 CA ILE A 698 -5.272 -18.343 -34.750 1.00 0.00 C ATOM 764 C ILE A 698 -4.480 -17.123 -34.233 1.00 0.00 C ATOM 765 O ILE A 698 -3.371 -17.247 -33.706 1.00 0.00 O ATOM 766 CB ILE A 698 -5.814 -18.001 -36.204 1.00 0.00 C ATOM 767 CG1 ILE A 698 -6.867 -19.043 -36.683 1.00 0.00 C ATOM 768 CG2 ILE A 698 -4.648 -17.862 -37.220 1.00 0.00 C ATOM 769 CD1 ILE A 698 -7.549 -18.695 -37.998 1.00 0.00 C ATOM 0 H ILE A 698 -6.958 -17.873 -33.563 1.00 0.00 H new ATOM 0 HA ILE A 698 -4.634 -19.225 -34.813 1.00 0.00 H new ATOM 0 HB ILE A 698 -6.318 -17.036 -36.147 1.00 0.00 H new ATOM 0 HG12 ILE A 698 -6.379 -20.012 -36.787 1.00 0.00 H new ATOM 0 HG13 ILE A 698 -7.629 -19.151 -35.911 1.00 0.00 H new ATOM 0 HG21 ILE A 698 -5.050 -17.628 -38.206 1.00 0.00 H new ATOM 0 HG22 ILE A 698 -3.981 -17.061 -36.901 1.00 0.00 H new ATOM 0 HG23 ILE A 698 -4.093 -18.799 -37.268 1.00 0.00 H new ATOM 0 HD11 ILE A 698 -8.266 -19.475 -38.254 1.00 0.00 H new ATOM 0 HD12 ILE A 698 -8.070 -17.743 -37.897 1.00 0.00 H new ATOM 0 HD13 ILE A 698 -6.801 -18.617 -38.787 1.00 0.00 H new ATOM 781 N LYS A 699 -5.111 -15.958 -34.392 1.00 0.00 N ATOM 782 CA LYS A 699 -4.509 -14.623 -34.219 1.00 0.00 C ATOM 783 C LYS A 699 -4.484 -14.167 -32.732 1.00 0.00 C ATOM 784 O LYS A 699 -5.295 -14.636 -31.927 1.00 0.00 O ATOM 785 CB LYS A 699 -5.335 -13.627 -35.094 1.00 0.00 C ATOM 786 CG LYS A 699 -5.123 -13.799 -36.628 1.00 0.00 C ATOM 787 CD LYS A 699 -6.356 -13.404 -37.490 1.00 0.00 C ATOM 788 CE LYS A 699 -6.909 -12.002 -37.175 1.00 0.00 C ATOM 789 NZ LYS A 699 -8.158 -11.708 -37.923 1.00 0.00 N ATOM 0 H LYS A 699 -6.095 -15.911 -34.655 1.00 0.00 H new ATOM 0 HA LYS A 699 -3.466 -14.652 -34.534 1.00 0.00 H new ATOM 0 HB2 LYS A 699 -6.394 -13.754 -34.868 1.00 0.00 H new ATOM 0 HB3 LYS A 699 -5.069 -12.608 -34.814 1.00 0.00 H new ATOM 0 HG2 LYS A 699 -4.270 -13.194 -36.936 1.00 0.00 H new ATOM 0 HG3 LYS A 699 -4.868 -14.838 -36.834 1.00 0.00 H new ATOM 0 HD2 LYS A 699 -6.080 -13.448 -38.544 1.00 0.00 H new ATOM 0 HD3 LYS A 699 -7.146 -14.139 -37.336 1.00 0.00 H new ATOM 0 HE2 LYS A 699 -7.101 -11.922 -36.105 1.00 0.00 H new ATOM 0 HE3 LYS A 699 -6.156 -11.253 -37.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 -8.231 -10.684 -38.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 -8.141 -12.206 -38.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 -8.978 -12.028 -37.369 1.00 0.00 H new ATOM 803 N PRO A 700 -3.525 -13.252 -32.348 1.00 0.00 N ATOM 804 CA PRO A 700 -3.477 -12.620 -30.993 1.00 0.00 C ATOM 805 C PRO A 700 -4.753 -11.819 -30.647 1.00 0.00 C ATOM 806 O PRO A 700 -5.454 -11.317 -31.535 1.00 0.00 O ATOM 807 CB PRO A 700 -2.237 -11.685 -31.077 1.00 0.00 C ATOM 808 CG PRO A 700 -2.023 -11.476 -32.541 1.00 0.00 C ATOM 809 CD PRO A 700 -2.375 -12.793 -33.179 1.00 0.00 C ATOM 0 HA PRO A 700 -3.412 -13.368 -30.203 1.00 0.00 H new ATOM 0 HB2 PRO A 700 -2.417 -10.740 -30.564 1.00 0.00 H new ATOM 0 HB3 PRO A 700 -1.364 -12.141 -30.610 1.00 0.00 H new ATOM 0 HG2 PRO A 700 -2.654 -10.672 -32.921 1.00 0.00 H new ATOM 0 HG3 PRO A 700 -0.991 -11.198 -32.753 1.00 0.00 H new ATOM 0 HD2 PRO A 700 -2.652 -12.676 -34.227 1.00 0.00 H new ATOM 0 HD3 PRO A 700 -1.543 -13.496 -33.146 1.00 0.00 H new ATOM 817 N PHE A 701 -5.021 -11.700 -29.339 1.00 0.00 N ATOM 818 CA PHE A 701 -6.225 -11.054 -28.807 1.00 0.00 C ATOM 819 C PHE A 701 -5.896 -10.263 -27.531 1.00 0.00 C ATOM 820 O PHE A 701 -5.064 -10.691 -26.715 1.00 0.00 O ATOM 821 CB PHE A 701 -7.335 -12.109 -28.543 1.00 0.00 C ATOM 822 CG PHE A 701 -6.870 -13.483 -28.039 1.00 0.00 C ATOM 823 CD1 PHE A 701 -6.187 -13.622 -26.832 1.00 0.00 C ATOM 824 CD2 PHE A 701 -7.128 -14.638 -28.773 1.00 0.00 C ATOM 825 CE1 PHE A 701 -5.778 -14.864 -26.386 1.00 0.00 C ATOM 826 CE2 PHE A 701 -6.719 -15.878 -28.318 1.00 0.00 C ATOM 827 CZ PHE A 701 -6.045 -15.991 -27.128 1.00 0.00 C ATOM 0 H PHE A 701 -4.398 -12.055 -28.613 1.00 0.00 H new ATOM 0 HA PHE A 701 -6.599 -10.349 -29.550 1.00 0.00 H new ATOM 0 HB2 PHE A 701 -8.031 -11.696 -27.813 1.00 0.00 H new ATOM 0 HB3 PHE A 701 -7.893 -12.256 -29.468 1.00 0.00 H new ATOM 0 HD1 PHE A 701 -5.974 -12.746 -26.237 1.00 0.00 H new ATOM 0 HD2 PHE A 701 -7.656 -14.564 -29.712 1.00 0.00 H new ATOM 0 HE1 PHE A 701 -5.246 -14.950 -25.450 1.00 0.00 H new ATOM 0 HE2 PHE A 701 -6.931 -16.762 -28.902 1.00 0.00 H new ATOM 0 HZ PHE A 701 -5.726 -16.961 -26.776 1.00 0.00 H new ATOM 837 N TYR A 702 -6.555 -9.099 -27.368 1.00 0.00 N ATOM 838 CA TYR A 702 -6.319 -8.187 -26.234 1.00 0.00 C ATOM 839 C TYR A 702 -7.654 -7.572 -25.747 1.00 0.00 C ATOM 840 O TYR A 702 -8.682 -7.670 -26.421 1.00 0.00 O ATOM 841 CB TYR A 702 -5.317 -7.056 -26.625 1.00 0.00 C ATOM 842 CG TYR A 702 -4.020 -7.545 -27.293 1.00 0.00 C ATOM 843 CD1 TYR A 702 -3.015 -8.177 -26.554 1.00 0.00 C ATOM 844 CD2 TYR A 702 -3.811 -7.392 -28.670 1.00 0.00 C ATOM 845 CE1 TYR A 702 -1.862 -8.641 -27.164 1.00 0.00 C ATOM 846 CE2 TYR A 702 -2.659 -7.850 -29.275 1.00 0.00 C ATOM 847 CZ TYR A 702 -1.687 -8.472 -28.521 1.00 0.00 C ATOM 848 OH TYR A 702 -0.537 -8.932 -29.129 1.00 0.00 O ATOM 0 H TYR A 702 -7.266 -8.766 -28.019 1.00 0.00 H new ATOM 0 HA TYR A 702 -5.881 -8.767 -25.422 1.00 0.00 H new ATOM 0 HB2 TYR A 702 -5.818 -6.364 -27.301 1.00 0.00 H new ATOM 0 HB3 TYR A 702 -5.057 -6.494 -25.728 1.00 0.00 H new ATOM 0 HD1 TYR A 702 -3.140 -8.305 -25.489 1.00 0.00 H new ATOM 0 HD2 TYR A 702 -4.567 -6.906 -29.269 1.00 0.00 H new ATOM 0 HE1 TYR A 702 -1.101 -9.135 -26.578 1.00 0.00 H new ATOM 0 HE2 TYR A 702 -2.519 -7.721 -30.338 1.00 0.00 H new ATOM 0 HH TYR A 702 -0.573 -8.734 -30.088 1.00 0.00 H new ATOM 858 N CYS A 703 -7.611 -6.962 -24.551 1.00 0.00 N ATOM 859 CA CYS A 703 -8.758 -6.233 -23.953 1.00 0.00 C ATOM 860 C CYS A 703 -8.710 -4.749 -24.399 1.00 0.00 C ATOM 861 O CYS A 703 -7.606 -4.210 -24.556 1.00 0.00 O ATOM 862 CB CYS A 703 -8.702 -6.335 -22.409 1.00 0.00 C ATOM 863 SG CYS A 703 -7.473 -5.251 -21.615 1.00 0.00 S ATOM 0 H CYS A 703 -6.778 -6.957 -23.963 1.00 0.00 H new ATOM 0 HA CYS A 703 -9.692 -6.679 -24.294 1.00 0.00 H new ATOM 0 HB2 CYS A 703 -9.687 -6.098 -22.008 1.00 0.00 H new ATOM 0 HB3 CYS A 703 -8.486 -7.368 -22.135 1.00 0.00 H new ATOM 868 N PRO A 704 -9.890 -4.057 -24.572 1.00 0.00 N ATOM 869 CA PRO A 704 -9.975 -2.699 -25.199 1.00 0.00 C ATOM 870 C PRO A 704 -9.159 -1.600 -24.467 1.00 0.00 C ATOM 871 O PRO A 704 -8.775 -0.600 -25.085 1.00 0.00 O ATOM 872 CB PRO A 704 -11.504 -2.390 -25.183 1.00 0.00 C ATOM 873 CG PRO A 704 -12.058 -3.269 -24.108 1.00 0.00 C ATOM 874 CD PRO A 704 -11.244 -4.531 -24.178 1.00 0.00 C ATOM 0 HA PRO A 704 -9.535 -2.699 -26.196 1.00 0.00 H new ATOM 0 HB2 PRO A 704 -11.693 -1.338 -24.971 1.00 0.00 H new ATOM 0 HB3 PRO A 704 -11.962 -2.608 -26.148 1.00 0.00 H new ATOM 0 HG2 PRO A 704 -11.971 -2.797 -23.129 1.00 0.00 H new ATOM 0 HG3 PRO A 704 -13.116 -3.473 -24.271 1.00 0.00 H new ATOM 0 HD2 PRO A 704 -11.224 -5.048 -23.219 1.00 0.00 H new ATOM 0 HD3 PRO A 704 -11.652 -5.230 -24.908 1.00 0.00 H new ATOM 882 N HIS A 705 -8.886 -1.807 -23.166 1.00 0.00 N ATOM 883 CA HIS A 705 -8.074 -0.870 -22.353 1.00 0.00 C ATOM 884 C HIS A 705 -6.640 -0.790 -22.905 1.00 0.00 C ATOM 885 O HIS A 705 -6.058 0.297 -23.010 1.00 0.00 O ATOM 886 CB HIS A 705 -8.076 -1.308 -20.868 1.00 0.00 C ATOM 887 CG HIS A 705 -7.425 -0.327 -19.915 1.00 0.00 C ATOM 888 ND1 HIS A 705 -8.082 0.780 -19.419 1.00 0.00 N ATOM 889 CD2 HIS A 705 -6.185 -0.299 -19.362 1.00 0.00 C ATOM 890 CE1 HIS A 705 -7.283 1.439 -18.600 1.00 0.00 C ATOM 891 NE2 HIS A 705 -6.125 0.806 -18.549 1.00 0.00 N ATOM 0 H HIS A 705 -9.217 -2.621 -22.648 1.00 0.00 H new ATOM 0 HA HIS A 705 -8.516 0.125 -22.413 1.00 0.00 H new ATOM 0 HB2 HIS A 705 -9.107 -1.469 -20.553 1.00 0.00 H new ATOM 0 HB3 HIS A 705 -7.564 -2.267 -20.786 1.00 0.00 H new ATOM 0 HD2 HIS A 705 -5.393 -1.013 -19.530 1.00 0.00 H new ATOM 0 HE1 HIS A 705 -7.534 2.342 -18.063 1.00 0.00 H new ATOM 0 HE2 HIS A 705 -5.317 1.092 -17.996 1.00 0.00 H new ATOM 900 N CYS A 706 -6.096 -1.965 -23.279 1.00 0.00 N ATOM 901 CA CYS A 706 -4.786 -2.065 -23.939 1.00 0.00 C ATOM 902 C CYS A 706 -4.824 -1.418 -25.335 1.00 0.00 C ATOM 903 O CYS A 706 -3.909 -0.682 -25.682 1.00 0.00 O ATOM 904 CB CYS A 706 -4.322 -3.535 -24.024 1.00 0.00 C ATOM 905 SG CYS A 706 -3.865 -4.251 -22.412 1.00 0.00 S ATOM 0 H CYS A 706 -6.552 -2.865 -23.132 1.00 0.00 H new ATOM 0 HA CYS A 706 -4.062 -1.519 -23.335 1.00 0.00 H new ATOM 0 HB2 CYS A 706 -5.119 -4.134 -24.465 1.00 0.00 H new ATOM 0 HB3 CYS A 706 -3.466 -3.599 -24.696 1.00 0.00 H new ATOM 910 N LEU A 707 -5.915 -1.662 -26.097 1.00 0.00 N ATOM 911 CA LEU A 707 -6.076 -1.134 -27.483 1.00 0.00 C ATOM 912 C LEU A 707 -5.967 0.408 -27.510 1.00 0.00 C ATOM 913 O LEU A 707 -5.216 0.961 -28.317 1.00 0.00 O ATOM 914 CB LEU A 707 -7.422 -1.604 -28.127 1.00 0.00 C ATOM 915 CG LEU A 707 -7.433 -3.033 -28.765 1.00 0.00 C ATOM 916 CD1 LEU A 707 -7.105 -4.128 -27.742 1.00 0.00 C ATOM 917 CD2 LEU A 707 -8.783 -3.324 -29.467 1.00 0.00 C ATOM 0 H LEU A 707 -6.704 -2.224 -25.778 1.00 0.00 H new ATOM 0 HA LEU A 707 -5.261 -1.544 -28.080 1.00 0.00 H new ATOM 0 HB2 LEU A 707 -8.197 -1.567 -27.361 1.00 0.00 H new ATOM 0 HB3 LEU A 707 -7.700 -0.885 -28.897 1.00 0.00 H new ATOM 0 HG LEU A 707 -6.645 -3.047 -29.518 1.00 0.00 H new ATOM 0 HD11 LEU A 707 -7.125 -5.101 -28.232 1.00 0.00 H new ATOM 0 HD12 LEU A 707 -6.113 -3.952 -27.326 1.00 0.00 H new ATOM 0 HD13 LEU A 707 -7.844 -4.110 -26.941 1.00 0.00 H new ATOM 0 HD21 LEU A 707 -8.760 -4.324 -29.900 1.00 0.00 H new ATOM 0 HD22 LEU A 707 -9.592 -3.263 -28.739 1.00 0.00 H new ATOM 0 HD23 LEU A 707 -8.948 -2.590 -30.256 1.00 0.00 H new ATOM 929 N VAL A 708 -6.697 1.071 -26.590 1.00 0.00 N ATOM 930 CA VAL A 708 -6.681 2.545 -26.445 1.00 0.00 C ATOM 931 C VAL A 708 -5.268 3.043 -26.061 1.00 0.00 C ATOM 932 O VAL A 708 -4.776 4.041 -26.609 1.00 0.00 O ATOM 933 CB VAL A 708 -7.745 3.022 -25.375 1.00 0.00 C ATOM 934 CG1 VAL A 708 -7.671 4.551 -25.120 1.00 0.00 C ATOM 935 CG2 VAL A 708 -9.177 2.613 -25.805 1.00 0.00 C ATOM 0 H VAL A 708 -7.314 0.602 -25.927 1.00 0.00 H new ATOM 0 HA VAL A 708 -6.950 2.978 -27.408 1.00 0.00 H new ATOM 0 HB VAL A 708 -7.503 2.523 -24.437 1.00 0.00 H new ATOM 0 HG11 VAL A 708 -8.419 4.833 -24.379 1.00 0.00 H new ATOM 0 HG12 VAL A 708 -6.679 4.811 -24.751 1.00 0.00 H new ATOM 0 HG13 VAL A 708 -7.863 5.085 -26.051 1.00 0.00 H new ATOM 0 HG21 VAL A 708 -9.892 2.951 -25.055 1.00 0.00 H new ATOM 0 HG22 VAL A 708 -9.414 3.072 -26.765 1.00 0.00 H new ATOM 0 HG23 VAL A 708 -9.233 1.528 -25.898 1.00 0.00 H new ATOM 945 N ALA A 709 -4.612 2.294 -25.157 1.00 0.00 N ATOM 946 CA ALA A 709 -3.264 2.623 -24.651 1.00 0.00 C ATOM 947 C ALA A 709 -2.177 2.423 -25.732 1.00 0.00 C ATOM 948 O ALA A 709 -1.098 3.018 -25.654 1.00 0.00 O ATOM 949 CB ALA A 709 -2.957 1.771 -23.411 1.00 0.00 C ATOM 0 H ALA A 709 -5.001 1.441 -24.755 1.00 0.00 H new ATOM 0 HA ALA A 709 -3.253 3.678 -24.378 1.00 0.00 H new ATOM 0 HB1 ALA A 709 -1.962 2.015 -23.039 1.00 0.00 H new ATOM 0 HB2 ALA A 709 -3.695 1.978 -22.636 1.00 0.00 H new ATOM 0 HB3 ALA A 709 -2.996 0.715 -23.677 1.00 0.00 H new ATOM 955 N MET A 710 -2.476 1.567 -26.723 1.00 0.00 N ATOM 956 CA MET A 710 -1.573 1.271 -27.859 1.00 0.00 C ATOM 957 C MET A 710 -1.646 2.376 -28.929 1.00 0.00 C ATOM 958 O MET A 710 -0.691 2.577 -29.685 1.00 0.00 O ATOM 959 CB MET A 710 -1.947 -0.108 -28.476 1.00 0.00 C ATOM 960 CG MET A 710 -1.605 -1.318 -27.586 1.00 0.00 C ATOM 961 SD MET A 710 -2.442 -2.842 -28.102 1.00 0.00 S ATOM 962 CE MET A 710 -1.957 -2.979 -29.826 1.00 0.00 C ATOM 0 H MET A 710 -3.357 1.054 -26.763 1.00 0.00 H new ATOM 0 HA MET A 710 -0.548 1.235 -27.489 1.00 0.00 H new ATOM 0 HB2 MET A 710 -3.016 -0.119 -28.688 1.00 0.00 H new ATOM 0 HB3 MET A 710 -1.431 -0.217 -29.430 1.00 0.00 H new ATOM 0 HG2 MET A 710 -0.527 -1.480 -27.602 1.00 0.00 H new ATOM 0 HG3 MET A 710 -1.878 -1.092 -26.555 1.00 0.00 H new ATOM 0 HE1 MET A 710 -2.269 -3.948 -30.216 1.00 0.00 H new ATOM 0 HE2 MET A 710 -2.434 -2.186 -30.402 1.00 0.00 H new ATOM 0 HE3 MET A 710 -0.874 -2.886 -29.908 1.00 0.00 H new ATOM 972 N GLU A 711 -2.793 3.070 -28.987 1.00 0.00 N ATOM 973 CA GLU A 711 -3.032 4.175 -29.937 1.00 0.00 C ATOM 974 C GLU A 711 -2.374 5.483 -29.423 1.00 0.00 C ATOM 975 O GLU A 711 -2.321 5.698 -28.205 1.00 0.00 O ATOM 976 CB GLU A 711 -4.561 4.383 -30.122 1.00 0.00 C ATOM 977 CG GLU A 711 -5.300 3.156 -30.688 1.00 0.00 C ATOM 978 CD GLU A 711 -6.816 3.366 -30.817 1.00 0.00 C ATOM 979 OE1 GLU A 711 -7.530 3.238 -29.802 1.00 0.00 O ATOM 980 OE2 GLU A 711 -7.302 3.668 -31.936 1.00 0.00 O ATOM 0 H GLU A 711 -3.587 2.882 -28.374 1.00 0.00 H new ATOM 0 HA GLU A 711 -2.585 3.919 -30.898 1.00 0.00 H new ATOM 0 HB2 GLU A 711 -5.000 4.646 -29.159 1.00 0.00 H new ATOM 0 HB3 GLU A 711 -4.723 5.230 -30.788 1.00 0.00 H new ATOM 0 HG2 GLU A 711 -4.889 2.913 -31.668 1.00 0.00 H new ATOM 0 HG3 GLU A 711 -5.113 2.298 -30.042 1.00 0.00 H new ATOM 987 N PRO A 712 -1.847 6.362 -30.335 1.00 0.00 N ATOM 988 CA PRO A 712 -1.314 7.690 -29.952 1.00 0.00 C ATOM 989 C PRO A 712 -2.443 8.739 -29.780 1.00 0.00 C ATOM 990 O PRO A 712 -3.446 8.708 -30.513 1.00 0.00 O ATOM 991 CB PRO A 712 -0.379 8.033 -31.136 1.00 0.00 C ATOM 992 CG PRO A 712 -1.028 7.385 -32.321 1.00 0.00 C ATOM 993 CD PRO A 712 -1.701 6.121 -31.799 1.00 0.00 C ATOM 0 HA PRO A 712 -0.804 7.688 -28.989 1.00 0.00 H new ATOM 0 HB2 PRO A 712 -0.289 9.111 -31.272 1.00 0.00 H new ATOM 0 HB3 PRO A 712 0.627 7.647 -30.973 1.00 0.00 H new ATOM 0 HG2 PRO A 712 -1.757 8.053 -32.779 1.00 0.00 H new ATOM 0 HG3 PRO A 712 -0.290 7.145 -33.086 1.00 0.00 H new ATOM 0 HD2 PRO A 712 -2.668 5.960 -32.274 1.00 0.00 H new ATOM 0 HD3 PRO A 712 -1.096 5.236 -31.999 1.00 0.00 H new ATOM 1001 N VAL A 713 -2.290 9.636 -28.784 1.00 0.00 N ATOM 1002 CA VAL A 713 -3.250 10.738 -28.550 1.00 0.00 C ATOM 1003 C VAL A 713 -3.041 11.862 -29.594 1.00 0.00 C ATOM 1004 O VAL A 713 -1.899 12.234 -29.900 1.00 0.00 O ATOM 1005 CB VAL A 713 -3.157 11.315 -27.076 1.00 0.00 C ATOM 1006 CG1 VAL A 713 -3.430 10.204 -26.033 1.00 0.00 C ATOM 1007 CG2 VAL A 713 -1.797 12.012 -26.794 1.00 0.00 C ATOM 0 H VAL A 713 -1.510 9.620 -28.127 1.00 0.00 H new ATOM 0 HA VAL A 713 -4.253 10.327 -28.666 1.00 0.00 H new ATOM 0 HB VAL A 713 -3.929 12.079 -26.986 1.00 0.00 H new ATOM 0 HG11 VAL A 713 -3.361 10.623 -25.029 1.00 0.00 H new ATOM 0 HG12 VAL A 713 -4.429 9.797 -26.188 1.00 0.00 H new ATOM 0 HG13 VAL A 713 -2.693 9.409 -26.146 1.00 0.00 H new ATOM 0 HG21 VAL A 713 -1.786 12.389 -25.771 1.00 0.00 H new ATOM 0 HG22 VAL A 713 -0.987 11.295 -26.925 1.00 0.00 H new ATOM 0 HG23 VAL A 713 -1.663 12.842 -27.488 1.00 0.00 H new ATOM 1017 N SER A 714 -4.152 12.372 -30.153 1.00 0.00 N ATOM 1018 CA SER A 714 -4.130 13.399 -31.209 1.00 0.00 C ATOM 1019 C SER A 714 -3.926 14.801 -30.603 1.00 0.00 C ATOM 1020 O SER A 714 -4.476 15.115 -29.540 1.00 0.00 O ATOM 1021 CB SER A 714 -5.446 13.347 -32.029 1.00 0.00 C ATOM 1022 OG SER A 714 -5.420 14.249 -33.137 1.00 0.00 O ATOM 0 H SER A 714 -5.093 12.083 -29.885 1.00 0.00 H new ATOM 0 HA SER A 714 -3.292 13.194 -31.876 1.00 0.00 H new ATOM 0 HB2 SER A 714 -5.608 12.332 -32.391 1.00 0.00 H new ATOM 0 HB3 SER A 714 -6.287 13.592 -31.381 1.00 0.00 H new ATOM 0 HG SER A 714 -6.265 14.186 -33.630 1.00 0.00 H new ATOM 1028 N THR A 715 -3.117 15.625 -31.288 1.00 0.00 N ATOM 1029 CA THR A 715 -2.875 17.034 -30.913 1.00 0.00 C ATOM 1030 C THR A 715 -4.083 17.909 -31.346 1.00 0.00 C ATOM 1031 O THR A 715 -4.751 17.583 -32.330 1.00 0.00 O ATOM 1032 CB THR A 715 -1.555 17.545 -31.591 1.00 0.00 C ATOM 1033 OG1 THR A 715 -0.498 16.595 -31.351 1.00 0.00 O ATOM 1034 CG2 THR A 715 -1.105 18.928 -31.074 1.00 0.00 C ATOM 0 H THR A 715 -2.608 15.334 -32.123 1.00 0.00 H new ATOM 0 HA THR A 715 -2.762 17.106 -29.831 1.00 0.00 H new ATOM 0 HB THR A 715 -1.765 17.646 -32.656 1.00 0.00 H new ATOM 0 HG1 THR A 715 0.328 16.910 -31.775 1.00 0.00 H new ATOM 0 HG21 THR A 715 -0.187 19.225 -31.581 1.00 0.00 H new ATOM 0 HG22 THR A 715 -1.885 19.663 -31.275 1.00 0.00 H new ATOM 0 HG23 THR A 715 -0.925 18.874 -30.000 1.00 0.00 H new ATOM 1042 N ARG A 716 -4.363 18.998 -30.594 1.00 0.00 N ATOM 1043 CA ARG A 716 -5.481 19.916 -30.896 1.00 0.00 C ATOM 1044 C ARG A 716 -5.139 20.785 -32.140 1.00 0.00 C ATOM 1045 O ARG A 716 -4.303 21.707 -32.021 1.00 0.00 O ATOM 1046 CB ARG A 716 -5.828 20.791 -29.659 1.00 0.00 C ATOM 1047 CG ARG A 716 -6.175 19.969 -28.392 1.00 0.00 C ATOM 1048 CD ARG A 716 -7.020 20.759 -27.387 1.00 0.00 C ATOM 1049 NE ARG A 716 -7.312 19.961 -26.174 1.00 0.00 N ATOM 1050 CZ ARG A 716 -8.450 19.991 -25.461 1.00 0.00 C ATOM 1051 NH1 ARG A 716 -9.487 20.729 -25.842 1.00 0.00 N ATOM 1052 NH2 ARG A 716 -8.545 19.238 -24.377 1.00 0.00 N ATOM 1053 OXT ARG A 716 -5.685 20.527 -33.237 1.00 0.00 O ATOM 0 H ARG A 716 -3.825 19.262 -29.769 1.00 0.00 H new ATOM 0 HA ARG A 716 -6.367 19.327 -31.132 1.00 0.00 H new ATOM 0 HB2 ARG A 716 -4.983 21.443 -29.438 1.00 0.00 H new ATOM 0 HB3 ARG A 716 -6.672 21.435 -29.906 1.00 0.00 H new ATOM 0 HG2 ARG A 716 -6.714 19.068 -28.685 1.00 0.00 H new ATOM 0 HG3 ARG A 716 -5.252 19.646 -27.910 1.00 0.00 H new ATOM 0 HD2 ARG A 716 -6.493 21.671 -27.105 1.00 0.00 H new ATOM 0 HD3 ARG A 716 -7.955 21.063 -27.857 1.00 0.00 H new ATOM 0 HE ARG A 716 -6.580 19.329 -25.849 1.00 0.00 H new ATOM 0 HH11 ARG A 716 -9.429 21.289 -26.693 1.00 0.00 H new ATOM 0 HH12 ARG A 716 -10.341 20.736 -25.284 1.00 0.00 H new ATOM 0 HH21 ARG A 716 -7.762 18.648 -24.096 1.00 0.00 H new ATOM 0 HH22 ARG A 716 -9.401 19.248 -23.823 1.00 0.00 H new TER 1067 ARG A 716 HETATM 1068 ZN ZN A 801 -17.797 -10.975 -21.426 1.00 0.00 ZN HETATM 1069 ZN ZN A 802 -5.236 -5.957 -21.594 1.00 0.00 ZN