USER MOD reduce.3.24.130724 H: found=0, std=0, add=872, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 872 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 724 THR OG1 : rot -100:sc= -1.55 USER MOD Set 1.2: A 773 HIS : no HE2:sc= -1.23 K(o=-2.8,f=-8.4!) USER MOD Set 2.1: A 714 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 732 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 728 HIS : no HD1:sc= -0.0266 X(o=-0.027,f=0.46) USER MOD Set 3.2: A 730 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 703 GLN : amide:sc= -1.04! X(o=0.03!,f=0.53) USER MOD Set 4.2: A 718 ASN : amide:sc= 1.07 X(o=0.03,f=0.53) USER MOD Single : A 690 THR OG1 : rot 48:sc= 1.25 USER MOD Single : A 699 HIS : no HD1:sc= -0.191 X(o=-0.19,f=-0.0056) USER MOD Single : A 705 SER OG : rot 119:sc= 0.597 USER MOD Single : A 706 SER OG : rot 180:sc= 0 USER MOD Single : A 709 TYR OH : rot 180:sc= -0.0541 USER MOD Single : A 710 TYR OH : rot 180:sc= 0 USER MOD Single : A 711 TYR OH : rot 165:sc= 0 USER MOD Single : A 720 SER OG : rot 180:sc= 0 USER MOD Single : A 722 SER OG : rot 72:sc= 1.24 USER MOD Single : A 725 MET CE :methyl 153:sc= -0.181 (180deg=-0.697) USER MOD Single : A 735 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 739 THR OG1 : rot 52:sc= -1.52! USER MOD Single : A 740 GLN : amide:sc= -1.63! C(o=-1.6!,f=-1.5!) USER MOD Single : A 743 GLN :FLIP amide:sc=-0.00345 F(o=-1,f=-0.0034) USER MOD Single : A 749 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 751 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 752 LYS NZ :NH3+ 174:sc= 1.3 (180deg=1.01) USER MOD Single : A 754 LYS NZ :NH3+ 139:sc= 1.21 (180deg=-0.107) USER MOD Single : A 755 SER OG : rot 180:sc= 0 USER MOD Single : A 756 SER OG : rot -170:sc= 0 USER MOD Single : A 757 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 764 HIS : no HD1:sc=-0.00805 X(o=-0.008,f=-0.008) USER MOD Single : A 766 LYS NZ :NH3+ 165:sc= -0.0537 (180deg=-0.28) USER MOD Single : A 767 ASN : amide:sc= 0 X(o=0,f=0.083) USER MOD Single : A 768 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 769 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 774 ASN : amide:sc= -0.403 X(o=-0.4,f=-0.095) USER MOD Single : A 775 SER OG : rot 180:sc= 0 USER MOD Single : A 776 ASN :FLIP amide:sc= -0.434 F(o=-2.1!,f=-0.43) USER MOD Single : A 779 TYR OH : rot 180:sc= 0 USER MOD Single : A 781 CYS SG : rot 150:sc= -1.25 USER MOD Single : A 784 LYS NZ :NH3+ -167:sc= -0.0134 (180deg=-0.208) USER MOD Single : A 789 HIS :FLIP no HD1:sc= -0.285 F(o=-1.1,f=-0.29) USER MOD Single : A 790 THR OG1 : rot 118:sc= -0.239! USER MOD Single : A 794 ASN :FLIP amide:sc= -6.87! C(o=-8!,f=-6.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 690 28.421 -8.969 -1.883 1.00 0.00 N ATOM 2 CA THR A 690 27.734 -7.910 -1.183 1.00 0.00 C ATOM 3 C THR A 690 27.288 -6.855 -2.181 1.00 0.00 C ATOM 4 O THR A 690 27.984 -6.576 -3.157 1.00 0.00 O ATOM 5 CB THR A 690 28.649 -7.271 -0.072 1.00 0.00 C ATOM 6 OG1 THR A 690 28.023 -6.142 0.549 1.00 0.00 O ATOM 7 CG2 THR A 690 30.025 -6.879 -0.608 1.00 0.00 C ATOM 0 HA THR A 690 26.861 -8.329 -0.684 1.00 0.00 H new ATOM 0 HB THR A 690 28.791 -8.045 0.682 1.00 0.00 H new ATOM 0 HG1 THR A 690 27.103 -6.372 0.795 1.00 0.00 H new ATOM 0 HG21 THR A 690 30.618 -6.443 0.196 1.00 0.00 H new ATOM 0 HG22 THR A 690 30.531 -7.764 -0.993 1.00 0.00 H new ATOM 0 HG23 THR A 690 29.909 -6.150 -1.410 1.00 0.00 H new ATOM 15 N CYS A 691 26.109 -6.333 -1.980 1.00 0.00 N ATOM 16 CA CYS A 691 25.612 -5.253 -2.818 1.00 0.00 C ATOM 17 C CYS A 691 26.350 -3.966 -2.499 1.00 0.00 C ATOM 18 O CYS A 691 27.248 -3.544 -3.246 1.00 0.00 O ATOM 19 CB CYS A 691 24.089 -5.062 -2.695 1.00 0.00 C ATOM 20 SG CYS A 691 23.106 -6.362 -3.505 1.00 0.00 S ATOM 0 H CYS A 691 25.467 -6.631 -1.245 1.00 0.00 H new ATOM 0 HA CYS A 691 25.805 -5.528 -3.855 1.00 0.00 H new ATOM 0 HB2 CYS A 691 23.823 -5.026 -1.639 1.00 0.00 H new ATOM 0 HB3 CYS A 691 23.819 -4.097 -3.125 1.00 0.00 H new ATOM 25 N GLY A 692 26.010 -3.364 -1.405 1.00 0.00 N ATOM 26 CA GLY A 692 26.639 -2.210 -0.989 1.00 0.00 C ATOM 27 C GLY A 692 25.647 -1.304 -0.411 1.00 0.00 C ATOM 28 O GLY A 692 24.644 -1.758 0.146 1.00 0.00 O ATOM 0 H GLY A 692 25.270 -3.688 -0.783 1.00 0.00 H new ATOM 0 HA2 GLY A 692 27.407 -2.445 -0.252 1.00 0.00 H new ATOM 0 HA3 GLY A 692 27.140 -1.731 -1.830 1.00 0.00 H new ATOM 32 N ASP A 693 25.879 -0.066 -0.628 1.00 0.00 N ATOM 33 CA ASP A 693 25.090 1.040 -0.114 1.00 0.00 C ATOM 34 C ASP A 693 23.653 0.886 -0.434 1.00 0.00 C ATOM 35 O ASP A 693 23.277 0.557 -1.575 1.00 0.00 O ATOM 36 CB ASP A 693 25.561 2.384 -0.672 1.00 0.00 C ATOM 37 CG ASP A 693 26.895 2.830 -0.153 1.00 0.00 C ATOM 38 OD1 ASP A 693 26.977 3.259 1.019 1.00 0.00 O ATOM 39 OD2 ASP A 693 27.885 2.793 -0.916 1.00 0.00 O ATOM 0 H ASP A 693 26.665 0.245 -1.199 1.00 0.00 H new ATOM 0 HA ASP A 693 25.228 1.025 0.967 1.00 0.00 H new ATOM 0 HB2 ASP A 693 25.610 2.317 -1.759 1.00 0.00 H new ATOM 0 HB3 ASP A 693 24.818 3.145 -0.433 1.00 0.00 H new ATOM 44 N ILE A 694 22.855 1.104 0.547 1.00 0.00 N ATOM 45 CA ILE A 694 21.456 1.068 0.379 1.00 0.00 C ATOM 46 C ILE A 694 20.960 2.329 -0.317 1.00 0.00 C ATOM 47 O ILE A 694 21.587 3.394 -0.227 1.00 0.00 O ATOM 48 CB ILE A 694 20.681 0.792 1.709 1.00 0.00 C ATOM 49 CG1 ILE A 694 21.248 1.532 2.945 1.00 0.00 C ATOM 50 CG2 ILE A 694 20.633 -0.664 1.957 1.00 0.00 C ATOM 51 CD1 ILE A 694 21.261 3.027 2.871 1.00 0.00 C ATOM 0 H ILE A 694 23.162 1.314 1.497 1.00 0.00 H new ATOM 0 HA ILE A 694 21.240 0.216 -0.266 1.00 0.00 H new ATOM 0 HB ILE A 694 19.677 1.192 1.569 1.00 0.00 H new ATOM 0 HG12 ILE A 694 20.666 1.237 3.818 1.00 0.00 H new ATOM 0 HG13 ILE A 694 22.269 1.188 3.112 1.00 0.00 H new ATOM 0 HG21 ILE A 694 20.093 -0.858 2.884 1.00 0.00 H new ATOM 0 HG22 ILE A 694 20.123 -1.157 1.130 1.00 0.00 H new ATOM 0 HG23 ILE A 694 21.648 -1.053 2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 694 21.679 3.433 3.792 1.00 0.00 H new ATOM 0 HD12 ILE A 694 21.871 3.344 2.025 1.00 0.00 H new ATOM 0 HD13 ILE A 694 20.243 3.394 2.742 1.00 0.00 H new ATOM 63 N PRO A 695 19.912 2.198 -1.086 1.00 0.00 N ATOM 64 CA PRO A 695 19.269 3.322 -1.768 1.00 0.00 C ATOM 65 C PRO A 695 18.513 4.255 -0.794 1.00 0.00 C ATOM 66 O PRO A 695 18.722 4.215 0.428 1.00 0.00 O ATOM 67 CB PRO A 695 18.290 2.618 -2.708 1.00 0.00 C ATOM 68 CG PRO A 695 18.018 1.309 -2.057 1.00 0.00 C ATOM 69 CD PRO A 695 19.287 0.920 -1.410 1.00 0.00 C ATOM 0 HA PRO A 695 19.987 3.972 -2.268 1.00 0.00 H new ATOM 0 HB2 PRO A 695 17.375 3.196 -2.832 1.00 0.00 H new ATOM 0 HB3 PRO A 695 18.720 2.485 -3.701 1.00 0.00 H new ATOM 0 HG2 PRO A 695 17.214 1.394 -1.326 1.00 0.00 H new ATOM 0 HG3 PRO A 695 17.706 0.564 -2.789 1.00 0.00 H new ATOM 0 HD2 PRO A 695 19.114 0.320 -0.516 1.00 0.00 H new ATOM 0 HD3 PRO A 695 19.912 0.326 -2.077 1.00 0.00 H new ATOM 77 N GLU A 696 17.649 5.080 -1.335 1.00 0.00 N ATOM 78 CA GLU A 696 16.878 5.985 -0.581 1.00 0.00 C ATOM 79 C GLU A 696 15.578 6.151 -1.320 1.00 0.00 C ATOM 80 O GLU A 696 15.437 5.664 -2.460 1.00 0.00 O ATOM 81 CB GLU A 696 17.592 7.349 -0.449 1.00 0.00 C ATOM 82 CG GLU A 696 17.776 8.099 -1.764 1.00 0.00 C ATOM 83 CD GLU A 696 18.478 9.419 -1.581 1.00 0.00 C ATOM 84 OE1 GLU A 696 17.891 10.352 -0.995 1.00 0.00 O ATOM 85 OE2 GLU A 696 19.647 9.547 -1.988 1.00 0.00 O ATOM 0 H GLU A 696 17.473 5.126 -2.339 1.00 0.00 H new ATOM 0 HA GLU A 696 16.722 5.609 0.430 1.00 0.00 H new ATOM 0 HB2 GLU A 696 17.023 7.977 0.236 1.00 0.00 H new ATOM 0 HB3 GLU A 696 18.571 7.190 0.003 1.00 0.00 H new ATOM 0 HG2 GLU A 696 18.348 7.480 -2.455 1.00 0.00 H new ATOM 0 HG3 GLU A 696 16.801 8.270 -2.221 1.00 0.00 H new ATOM 92 N LEU A 697 14.660 6.771 -0.698 1.00 0.00 N ATOM 93 CA LEU A 697 13.405 7.097 -1.302 1.00 0.00 C ATOM 94 C LEU A 697 13.352 8.531 -1.691 1.00 0.00 C ATOM 95 O LEU A 697 13.937 9.394 -1.035 1.00 0.00 O ATOM 96 CB LEU A 697 12.223 6.783 -0.401 1.00 0.00 C ATOM 97 CG LEU A 697 11.721 5.362 -0.433 1.00 0.00 C ATOM 98 CD1 LEU A 697 10.595 5.173 0.535 1.00 0.00 C ATOM 99 CD2 LEU A 697 11.299 4.986 -1.834 1.00 0.00 C ATOM 0 H LEU A 697 14.747 7.081 0.270 1.00 0.00 H new ATOM 0 HA LEU A 697 13.330 6.472 -2.192 1.00 0.00 H new ATOM 0 HB2 LEU A 697 12.500 7.025 0.625 1.00 0.00 H new ATOM 0 HB3 LEU A 697 11.400 7.443 -0.673 1.00 0.00 H new ATOM 0 HG LEU A 697 12.534 4.702 -0.131 1.00 0.00 H new ATOM 0 HD11 LEU A 697 10.249 4.140 0.494 1.00 0.00 H new ATOM 0 HD12 LEU A 697 10.940 5.400 1.544 1.00 0.00 H new ATOM 0 HD13 LEU A 697 9.774 5.841 0.273 1.00 0.00 H new ATOM 0 HD21 LEU A 697 10.939 3.957 -1.842 1.00 0.00 H new ATOM 0 HD22 LEU A 697 10.502 5.652 -2.165 1.00 0.00 H new ATOM 0 HD23 LEU A 697 12.151 5.077 -2.507 1.00 0.00 H new ATOM 111 N GLU A 698 12.666 8.780 -2.763 1.00 0.00 N ATOM 112 CA GLU A 698 12.450 10.122 -3.245 1.00 0.00 C ATOM 113 C GLU A 698 11.597 10.952 -2.281 1.00 0.00 C ATOM 114 O GLU A 698 11.831 12.136 -2.104 1.00 0.00 O ATOM 115 CB GLU A 698 11.819 10.107 -4.641 1.00 0.00 C ATOM 116 CG GLU A 698 10.583 9.218 -4.784 1.00 0.00 C ATOM 117 CD GLU A 698 9.975 9.313 -6.163 1.00 0.00 C ATOM 118 OE1 GLU A 698 10.573 8.792 -7.113 1.00 0.00 O ATOM 119 OE2 GLU A 698 8.913 9.949 -6.316 1.00 0.00 O ATOM 0 H GLU A 698 12.234 8.056 -3.338 1.00 0.00 H new ATOM 0 HA GLU A 698 13.429 10.598 -3.308 1.00 0.00 H new ATOM 0 HB2 GLU A 698 11.547 11.127 -4.911 1.00 0.00 H new ATOM 0 HB3 GLU A 698 12.570 9.777 -5.359 1.00 0.00 H new ATOM 0 HG2 GLU A 698 10.855 8.183 -4.578 1.00 0.00 H new ATOM 0 HG3 GLU A 698 9.841 9.506 -4.040 1.00 0.00 H new ATOM 126 N HIS A 699 10.603 10.330 -1.665 1.00 0.00 N ATOM 127 CA HIS A 699 9.694 11.055 -0.765 1.00 0.00 C ATOM 128 C HIS A 699 9.367 10.220 0.448 1.00 0.00 C ATOM 129 O HIS A 699 8.314 10.373 1.055 1.00 0.00 O ATOM 130 CB HIS A 699 8.389 11.445 -1.481 1.00 0.00 C ATOM 131 CG HIS A 699 8.561 12.396 -2.616 1.00 0.00 C ATOM 132 ND1 HIS A 699 8.640 13.762 -2.474 1.00 0.00 N ATOM 133 CD2 HIS A 699 8.704 12.152 -3.923 1.00 0.00 C ATOM 134 CE1 HIS A 699 8.820 14.306 -3.654 1.00 0.00 C ATOM 135 NE2 HIS A 699 8.867 13.349 -4.555 1.00 0.00 N ATOM 0 H HIS A 699 10.399 9.335 -1.765 1.00 0.00 H new ATOM 0 HA HIS A 699 10.206 11.965 -0.452 1.00 0.00 H new ATOM 0 HB2 HIS A 699 7.910 10.539 -1.853 1.00 0.00 H new ATOM 0 HB3 HIS A 699 7.710 11.889 -0.753 1.00 0.00 H new ATOM 0 HD2 HIS A 699 8.692 11.180 -4.394 1.00 0.00 H new ATOM 0 HE1 HIS A 699 8.914 15.363 -3.853 1.00 0.00 H new ATOM 0 HE2 HIS A 699 9.003 13.480 -5.557 1.00 0.00 H new ATOM 144 N GLY A 700 10.270 9.359 0.802 1.00 0.00 N ATOM 145 CA GLY A 700 10.069 8.500 1.950 1.00 0.00 C ATOM 146 C GLY A 700 11.337 8.344 2.720 1.00 0.00 C ATOM 147 O GLY A 700 12.136 9.273 2.764 1.00 0.00 O ATOM 0 H GLY A 700 11.158 9.225 0.318 1.00 0.00 H new ATOM 0 HA2 GLY A 700 9.296 8.920 2.594 1.00 0.00 H new ATOM 0 HA3 GLY A 700 9.714 7.523 1.622 1.00 0.00 H new ATOM 151 N TRP A 701 11.548 7.189 3.298 1.00 0.00 N ATOM 152 CA TRP A 701 12.739 6.949 4.079 1.00 0.00 C ATOM 153 C TRP A 701 13.054 5.472 4.161 1.00 0.00 C ATOM 154 O TRP A 701 12.242 4.622 3.769 1.00 0.00 O ATOM 155 CB TRP A 701 12.606 7.539 5.511 1.00 0.00 C ATOM 156 CG TRP A 701 11.440 7.012 6.331 1.00 0.00 C ATOM 157 CD1 TRP A 701 10.583 6.003 6.007 1.00 0.00 C ATOM 158 CD2 TRP A 701 11.027 7.473 7.614 1.00 0.00 C ATOM 159 NE1 TRP A 701 9.664 5.830 7.001 1.00 0.00 N ATOM 160 CE2 TRP A 701 9.911 6.711 7.987 1.00 0.00 C ATOM 161 CE3 TRP A 701 11.483 8.460 8.478 1.00 0.00 C ATOM 162 CZ2 TRP A 701 9.244 6.889 9.170 1.00 0.00 C ATOM 163 CZ3 TRP A 701 10.819 8.647 9.676 1.00 0.00 C ATOM 164 CH2 TRP A 701 9.703 7.862 10.013 1.00 0.00 C ATOM 0 H TRP A 701 10.909 6.396 3.243 1.00 0.00 H new ATOM 0 HA TRP A 701 13.561 7.453 3.570 1.00 0.00 H new ATOM 0 HB2 TRP A 701 13.529 7.339 6.055 1.00 0.00 H new ATOM 0 HB3 TRP A 701 12.511 8.622 5.431 1.00 0.00 H new ATOM 0 HD1 TRP A 701 10.625 5.424 5.096 1.00 0.00 H new ATOM 0 HE1 TRP A 701 8.910 5.143 6.997 1.00 0.00 H new ATOM 0 HE3 TRP A 701 12.337 9.068 8.220 1.00 0.00 H new ATOM 0 HZ2 TRP A 701 8.388 6.283 9.427 1.00 0.00 H new ATOM 0 HZ3 TRP A 701 11.163 9.407 10.362 1.00 0.00 H new ATOM 0 HH2 TRP A 701 9.200 8.030 10.954 1.00 0.00 H new ATOM 175 N ALA A 702 14.189 5.190 4.700 1.00 0.00 N ATOM 176 CA ALA A 702 14.631 3.856 4.952 1.00 0.00 C ATOM 177 C ALA A 702 14.552 3.636 6.427 1.00 0.00 C ATOM 178 O ALA A 702 14.751 4.574 7.204 1.00 0.00 O ATOM 179 CB ALA A 702 16.066 3.671 4.484 1.00 0.00 C ATOM 0 H ALA A 702 14.860 5.903 4.988 1.00 0.00 H new ATOM 0 HA ALA A 702 14.008 3.143 4.412 1.00 0.00 H new ATOM 0 HB1 ALA A 702 16.385 2.648 4.684 1.00 0.00 H new ATOM 0 HB2 ALA A 702 16.128 3.867 3.414 1.00 0.00 H new ATOM 0 HB3 ALA A 702 16.715 4.365 5.018 1.00 0.00 H new ATOM 185 N GLN A 703 14.218 2.448 6.820 1.00 0.00 N ATOM 186 CA GLN A 703 14.170 2.118 8.208 1.00 0.00 C ATOM 187 C GLN A 703 15.576 1.987 8.794 1.00 0.00 C ATOM 188 O GLN A 703 16.082 2.933 9.383 1.00 0.00 O ATOM 189 CB GLN A 703 13.338 0.880 8.443 1.00 0.00 C ATOM 190 CG GLN A 703 11.862 1.112 8.193 1.00 0.00 C ATOM 191 CD GLN A 703 10.998 0.037 8.795 1.00 0.00 C ATOM 192 OE1 GLN A 703 9.926 -0.286 8.273 1.00 0.00 O ATOM 193 NE2 GLN A 703 11.407 -0.462 9.923 1.00 0.00 N ATOM 0 H GLN A 703 13.972 1.683 6.191 1.00 0.00 H new ATOM 0 HA GLN A 703 13.681 2.938 8.735 1.00 0.00 H new ATOM 0 HB2 GLN A 703 13.691 0.081 7.792 1.00 0.00 H new ATOM 0 HB3 GLN A 703 13.480 0.541 9.469 1.00 0.00 H new ATOM 0 HG2 GLN A 703 11.575 2.079 8.607 1.00 0.00 H new ATOM 0 HG3 GLN A 703 11.682 1.159 7.119 1.00 0.00 H new ATOM 0 HE21 GLN A 703 12.300 -0.166 10.318 1.00 0.00 H new ATOM 0 HE22 GLN A 703 10.835 -1.150 10.414 1.00 0.00 H new ATOM 202 N LEU A 704 16.212 0.845 8.563 1.00 0.00 N ATOM 203 CA LEU A 704 17.584 0.544 9.025 1.00 0.00 C ATOM 204 C LEU A 704 17.842 -0.905 8.710 1.00 0.00 C ATOM 205 O LEU A 704 17.006 -1.757 9.017 1.00 0.00 O ATOM 206 CB LEU A 704 17.754 0.815 10.562 1.00 0.00 C ATOM 207 CG LEU A 704 19.178 0.701 11.173 1.00 0.00 C ATOM 208 CD1 LEU A 704 19.231 1.451 12.487 1.00 0.00 C ATOM 209 CD2 LEU A 704 19.570 -0.755 11.429 1.00 0.00 C ATOM 0 H LEU A 704 15.789 0.079 8.039 1.00 0.00 H new ATOM 0 HA LEU A 704 18.300 1.192 8.520 1.00 0.00 H new ATOM 0 HB2 LEU A 704 17.383 1.819 10.766 1.00 0.00 H new ATOM 0 HB3 LEU A 704 17.105 0.121 11.097 1.00 0.00 H new ATOM 0 HG LEU A 704 19.877 1.130 10.455 1.00 0.00 H new ATOM 0 HD11 LEU A 704 20.231 1.369 12.913 1.00 0.00 H new ATOM 0 HD12 LEU A 704 18.994 2.501 12.316 1.00 0.00 H new ATOM 0 HD13 LEU A 704 18.506 1.024 13.179 1.00 0.00 H new ATOM 0 HD21 LEU A 704 20.572 -0.792 11.856 1.00 0.00 H new ATOM 0 HD22 LEU A 704 18.862 -1.206 12.125 1.00 0.00 H new ATOM 0 HD23 LEU A 704 19.556 -1.306 10.489 1.00 0.00 H new ATOM 221 N SER A 705 18.944 -1.197 8.086 1.00 0.00 N ATOM 222 CA SER A 705 19.235 -2.558 7.726 1.00 0.00 C ATOM 223 C SER A 705 20.656 -2.962 8.141 1.00 0.00 C ATOM 224 O SER A 705 20.900 -4.114 8.507 1.00 0.00 O ATOM 225 CB SER A 705 18.961 -2.780 6.236 1.00 0.00 C ATOM 226 OG SER A 705 19.090 -4.152 5.866 1.00 0.00 O ATOM 0 H SER A 705 19.655 -0.517 7.816 1.00 0.00 H new ATOM 0 HA SER A 705 18.568 -3.218 8.280 1.00 0.00 H new ATOM 0 HB2 SER A 705 17.956 -2.433 5.997 1.00 0.00 H new ATOM 0 HB3 SER A 705 19.654 -2.179 5.647 1.00 0.00 H new ATOM 0 HG SER A 705 18.236 -4.477 5.513 1.00 0.00 H new ATOM 232 N SER A 706 21.554 -1.998 8.103 1.00 0.00 N ATOM 233 CA SER A 706 22.962 -2.139 8.505 1.00 0.00 C ATOM 234 C SER A 706 23.798 -2.929 7.464 1.00 0.00 C ATOM 235 O SER A 706 23.459 -4.063 7.106 1.00 0.00 O ATOM 236 CB SER A 706 23.086 -2.757 9.925 1.00 0.00 C ATOM 237 OG SER A 706 24.440 -2.820 10.371 1.00 0.00 O ATOM 0 H SER A 706 21.327 -1.057 7.782 1.00 0.00 H new ATOM 0 HA SER A 706 23.381 -1.134 8.543 1.00 0.00 H new ATOM 0 HB2 SER A 706 22.501 -2.165 10.629 1.00 0.00 H new ATOM 0 HB3 SER A 706 22.660 -3.760 9.921 1.00 0.00 H new ATOM 0 HG SER A 706 24.471 -3.213 11.268 1.00 0.00 H new ATOM 243 N PRO A 707 24.905 -2.318 6.962 1.00 0.00 N ATOM 244 CA PRO A 707 25.835 -2.954 5.996 1.00 0.00 C ATOM 245 C PRO A 707 26.487 -4.222 6.587 1.00 0.00 C ATOM 246 O PRO A 707 26.285 -4.532 7.776 1.00 0.00 O ATOM 247 CB PRO A 707 26.871 -1.846 5.731 1.00 0.00 C ATOM 248 CG PRO A 707 26.790 -0.968 6.922 1.00 0.00 C ATOM 249 CD PRO A 707 25.345 -0.952 7.298 1.00 0.00 C ATOM 0 HA PRO A 707 25.341 -3.298 5.087 1.00 0.00 H new ATOM 0 HB2 PRO A 707 27.872 -2.260 5.611 1.00 0.00 H new ATOM 0 HB3 PRO A 707 26.641 -1.298 4.818 1.00 0.00 H new ATOM 0 HG2 PRO A 707 27.405 -1.351 7.736 1.00 0.00 H new ATOM 0 HG3 PRO A 707 27.150 0.036 6.696 1.00 0.00 H new ATOM 0 HD2 PRO A 707 25.205 -0.731 8.356 1.00 0.00 H new ATOM 0 HD3 PRO A 707 24.790 -0.199 6.739 1.00 0.00 H new ATOM 257 N PRO A 708 27.316 -4.971 5.818 1.00 0.00 N ATOM 258 CA PRO A 708 27.759 -4.633 4.431 1.00 0.00 C ATOM 259 C PRO A 708 26.697 -4.767 3.388 1.00 0.00 C ATOM 260 O PRO A 708 26.842 -4.215 2.305 1.00 0.00 O ATOM 261 CB PRO A 708 28.840 -5.654 4.141 1.00 0.00 C ATOM 262 CG PRO A 708 29.141 -6.293 5.446 1.00 0.00 C ATOM 263 CD PRO A 708 27.890 -6.231 6.244 1.00 0.00 C ATOM 0 HA PRO A 708 28.069 -3.589 4.390 1.00 0.00 H new ATOM 0 HB2 PRO A 708 28.500 -6.390 3.413 1.00 0.00 H new ATOM 0 HB3 PRO A 708 29.727 -5.178 3.723 1.00 0.00 H new ATOM 0 HG2 PRO A 708 29.462 -7.325 5.308 1.00 0.00 H new ATOM 0 HG3 PRO A 708 29.952 -5.772 5.955 1.00 0.00 H new ATOM 0 HD2 PRO A 708 27.230 -7.072 6.031 1.00 0.00 H new ATOM 0 HD3 PRO A 708 28.090 -6.246 7.315 1.00 0.00 H new ATOM 271 N TYR A 709 25.664 -5.507 3.719 1.00 0.00 N ATOM 272 CA TYR A 709 24.532 -5.779 2.842 1.00 0.00 C ATOM 273 C TYR A 709 24.836 -6.913 1.915 1.00 0.00 C ATOM 274 O TYR A 709 25.406 -6.739 0.823 1.00 0.00 O ATOM 275 CB TYR A 709 24.028 -4.547 2.089 1.00 0.00 C ATOM 276 CG TYR A 709 23.440 -3.498 2.992 1.00 0.00 C ATOM 277 CD1 TYR A 709 22.384 -3.810 3.804 1.00 0.00 C ATOM 278 CD2 TYR A 709 23.958 -2.210 3.054 1.00 0.00 C ATOM 279 CE1 TYR A 709 21.849 -2.893 4.642 1.00 0.00 C ATOM 280 CE2 TYR A 709 23.428 -1.275 3.907 1.00 0.00 C ATOM 281 CZ TYR A 709 22.368 -1.626 4.702 1.00 0.00 C ATOM 282 OH TYR A 709 21.817 -0.708 5.565 1.00 0.00 O ATOM 0 H TYR A 709 25.579 -5.953 4.632 1.00 0.00 H new ATOM 0 HA TYR A 709 23.707 -6.076 3.490 1.00 0.00 H new ATOM 0 HB2 TYR A 709 24.853 -4.111 1.526 1.00 0.00 H new ATOM 0 HB3 TYR A 709 23.275 -4.856 1.364 1.00 0.00 H new ATOM 0 HD1 TYR A 709 21.970 -4.807 3.775 1.00 0.00 H new ATOM 0 HD2 TYR A 709 24.791 -1.941 2.421 1.00 0.00 H new ATOM 0 HE1 TYR A 709 21.009 -3.160 5.266 1.00 0.00 H new ATOM 0 HE2 TYR A 709 23.840 -0.278 3.951 1.00 0.00 H new ATOM 0 HH TYR A 709 22.298 0.142 5.489 1.00 0.00 H new ATOM 292 N TYR A 710 24.505 -8.070 2.369 1.00 0.00 N ATOM 293 CA TYR A 710 24.721 -9.276 1.654 1.00 0.00 C ATOM 294 C TYR A 710 23.545 -9.629 0.835 1.00 0.00 C ATOM 295 O TYR A 710 22.499 -8.967 0.891 1.00 0.00 O ATOM 296 CB TYR A 710 25.043 -10.409 2.607 1.00 0.00 C ATOM 297 CG TYR A 710 26.485 -10.504 2.916 1.00 0.00 C ATOM 298 CD1 TYR A 710 27.122 -9.543 3.667 1.00 0.00 C ATOM 299 CD2 TYR A 710 27.217 -11.558 2.433 1.00 0.00 C ATOM 300 CE1 TYR A 710 28.458 -9.630 3.924 1.00 0.00 C ATOM 301 CE2 TYR A 710 28.551 -11.663 2.687 1.00 0.00 C ATOM 302 CZ TYR A 710 29.175 -10.690 3.435 1.00 0.00 C ATOM 303 OH TYR A 710 30.527 -10.776 3.690 1.00 0.00 O ATOM 0 H TYR A 710 24.062 -8.207 3.278 1.00 0.00 H new ATOM 0 HA TYR A 710 25.569 -9.118 0.988 1.00 0.00 H new ATOM 0 HB2 TYR A 710 24.486 -10.268 3.533 1.00 0.00 H new ATOM 0 HB3 TYR A 710 24.706 -11.350 2.172 1.00 0.00 H new ATOM 0 HD1 TYR A 710 26.557 -8.710 4.058 1.00 0.00 H new ATOM 0 HD2 TYR A 710 26.728 -12.318 1.841 1.00 0.00 H new ATOM 0 HE1 TYR A 710 28.949 -8.867 4.510 1.00 0.00 H new ATOM 0 HE2 TYR A 710 29.114 -12.502 2.305 1.00 0.00 H new ATOM 0 HH TYR A 710 30.887 -11.587 3.274 1.00 0.00 H new ATOM 313 N TYR A 711 23.687 -10.672 0.089 1.00 0.00 N ATOM 314 CA TYR A 711 22.627 -11.116 -0.729 1.00 0.00 C ATOM 315 C TYR A 711 21.580 -11.729 0.126 1.00 0.00 C ATOM 316 O TYR A 711 21.880 -12.425 1.101 1.00 0.00 O ATOM 317 CB TYR A 711 23.103 -12.064 -1.797 1.00 0.00 C ATOM 318 CG TYR A 711 23.987 -11.406 -2.805 1.00 0.00 C ATOM 319 CD1 TYR A 711 25.346 -11.239 -2.587 1.00 0.00 C ATOM 320 CD2 TYR A 711 23.459 -10.946 -3.982 1.00 0.00 C ATOM 321 CE1 TYR A 711 26.139 -10.632 -3.518 1.00 0.00 C ATOM 322 CE2 TYR A 711 24.252 -10.342 -4.924 1.00 0.00 C ATOM 323 CZ TYR A 711 25.592 -10.183 -4.686 1.00 0.00 C ATOM 324 OH TYR A 711 26.394 -9.599 -5.638 1.00 0.00 O ATOM 0 H TYR A 711 24.537 -11.232 0.034 1.00 0.00 H new ATOM 0 HA TYR A 711 22.201 -10.261 -1.254 1.00 0.00 H new ATOM 0 HB2 TYR A 711 23.643 -12.888 -1.330 1.00 0.00 H new ATOM 0 HB3 TYR A 711 22.240 -12.495 -2.304 1.00 0.00 H new ATOM 0 HD1 TYR A 711 25.784 -11.595 -1.666 1.00 0.00 H new ATOM 0 HD2 TYR A 711 22.402 -11.061 -4.171 1.00 0.00 H new ATOM 0 HE1 TYR A 711 27.195 -10.507 -3.331 1.00 0.00 H new ATOM 0 HE2 TYR A 711 23.821 -9.993 -5.851 1.00 0.00 H new ATOM 0 HH TYR A 711 25.911 -9.554 -6.490 1.00 0.00 H new ATOM 334 N GLY A 712 20.377 -11.411 -0.171 1.00 0.00 N ATOM 335 CA GLY A 712 19.296 -11.882 0.614 1.00 0.00 C ATOM 336 C GLY A 712 18.923 -10.885 1.702 1.00 0.00 C ATOM 337 O GLY A 712 17.880 -11.041 2.362 1.00 0.00 O ATOM 0 H GLY A 712 20.112 -10.821 -0.960 1.00 0.00 H new ATOM 0 HA2 GLY A 712 18.433 -12.065 -0.026 1.00 0.00 H new ATOM 0 HA3 GLY A 712 19.563 -12.836 1.069 1.00 0.00 H new ATOM 341 N ASP A 713 19.773 -9.858 1.909 1.00 0.00 N ATOM 342 CA ASP A 713 19.464 -8.799 2.870 1.00 0.00 C ATOM 343 C ASP A 713 18.368 -7.947 2.325 1.00 0.00 C ATOM 344 O ASP A 713 18.204 -7.829 1.096 1.00 0.00 O ATOM 345 CB ASP A 713 20.676 -7.908 3.259 1.00 0.00 C ATOM 346 CG ASP A 713 21.476 -8.433 4.444 1.00 0.00 C ATOM 347 OD1 ASP A 713 20.864 -8.761 5.497 1.00 0.00 O ATOM 348 OD2 ASP A 713 22.720 -8.478 4.389 1.00 0.00 O ATOM 0 H ASP A 713 20.665 -9.747 1.427 1.00 0.00 H new ATOM 0 HA ASP A 713 19.159 -9.300 3.789 1.00 0.00 H new ATOM 0 HB2 ASP A 713 21.338 -7.818 2.398 1.00 0.00 H new ATOM 0 HB3 ASP A 713 20.317 -6.905 3.492 1.00 0.00 H new ATOM 353 N SER A 714 17.598 -7.380 3.190 1.00 0.00 N ATOM 354 CA SER A 714 16.479 -6.591 2.786 1.00 0.00 C ATOM 355 C SER A 714 16.390 -5.360 3.648 1.00 0.00 C ATOM 356 O SER A 714 16.794 -5.373 4.811 1.00 0.00 O ATOM 357 CB SER A 714 15.212 -7.404 2.906 1.00 0.00 C ATOM 358 OG SER A 714 15.361 -8.670 2.257 1.00 0.00 O ATOM 0 H SER A 714 17.725 -7.449 4.200 1.00 0.00 H new ATOM 0 HA SER A 714 16.606 -6.287 1.747 1.00 0.00 H new ATOM 0 HB2 SER A 714 14.969 -7.555 3.958 1.00 0.00 H new ATOM 0 HB3 SER A 714 14.380 -6.858 2.462 1.00 0.00 H new ATOM 0 HG SER A 714 14.531 -9.183 2.347 1.00 0.00 H new ATOM 364 N VAL A 715 15.899 -4.302 3.092 1.00 0.00 N ATOM 365 CA VAL A 715 15.810 -3.049 3.798 1.00 0.00 C ATOM 366 C VAL A 715 14.420 -2.523 3.642 1.00 0.00 C ATOM 367 O VAL A 715 13.906 -2.478 2.532 1.00 0.00 O ATOM 368 CB VAL A 715 16.809 -2.023 3.237 1.00 0.00 C ATOM 369 CG1 VAL A 715 16.876 -0.767 4.097 1.00 0.00 C ATOM 370 CG2 VAL A 715 18.159 -2.646 3.090 1.00 0.00 C ATOM 0 H VAL A 715 15.546 -4.273 2.136 1.00 0.00 H new ATOM 0 HA VAL A 715 16.050 -3.213 4.849 1.00 0.00 H new ATOM 0 HB VAL A 715 16.456 -1.715 2.253 1.00 0.00 H new ATOM 0 HG11 VAL A 715 17.593 -0.069 3.666 1.00 0.00 H new ATOM 0 HG12 VAL A 715 15.892 -0.299 4.135 1.00 0.00 H new ATOM 0 HG13 VAL A 715 17.191 -1.033 5.106 1.00 0.00 H new ATOM 0 HG21 VAL A 715 18.858 -1.910 2.692 1.00 0.00 H new ATOM 0 HG22 VAL A 715 18.509 -2.990 4.063 1.00 0.00 H new ATOM 0 HG23 VAL A 715 18.096 -3.493 2.407 1.00 0.00 H new ATOM 380 N GLU A 716 13.821 -2.150 4.724 1.00 0.00 N ATOM 381 CA GLU A 716 12.472 -1.683 4.704 1.00 0.00 C ATOM 382 C GLU A 716 12.412 -0.180 4.485 1.00 0.00 C ATOM 383 O GLU A 716 13.197 0.586 5.068 1.00 0.00 O ATOM 384 CB GLU A 716 11.737 -2.119 5.968 1.00 0.00 C ATOM 385 CG GLU A 716 11.714 -3.629 6.131 1.00 0.00 C ATOM 386 CD GLU A 716 10.865 -4.108 7.274 1.00 0.00 C ATOM 387 OE1 GLU A 716 11.366 -4.198 8.421 1.00 0.00 O ATOM 388 OE2 GLU A 716 9.685 -4.456 7.042 1.00 0.00 O ATOM 0 H GLU A 716 14.252 -2.160 5.648 1.00 0.00 H new ATOM 0 HA GLU A 716 11.958 -2.139 3.857 1.00 0.00 H new ATOM 0 HB2 GLU A 716 12.216 -1.669 6.838 1.00 0.00 H new ATOM 0 HB3 GLU A 716 10.714 -1.744 5.938 1.00 0.00 H new ATOM 0 HG2 GLU A 716 11.349 -4.078 5.207 1.00 0.00 H new ATOM 0 HG3 GLU A 716 12.734 -3.984 6.276 1.00 0.00 H new ATOM 395 N PHE A 717 11.515 0.217 3.629 1.00 0.00 N ATOM 396 CA PHE A 717 11.314 1.589 3.233 1.00 0.00 C ATOM 397 C PHE A 717 9.851 1.908 3.299 1.00 0.00 C ATOM 398 O PHE A 717 9.018 1.153 2.801 1.00 0.00 O ATOM 399 CB PHE A 717 11.806 1.833 1.798 1.00 0.00 C ATOM 400 CG PHE A 717 13.290 1.969 1.612 1.00 0.00 C ATOM 401 CD1 PHE A 717 14.135 0.894 1.764 1.00 0.00 C ATOM 402 CD2 PHE A 717 13.830 3.189 1.245 1.00 0.00 C ATOM 403 CE1 PHE A 717 15.488 1.034 1.559 1.00 0.00 C ATOM 404 CE2 PHE A 717 15.182 3.333 1.043 1.00 0.00 C ATOM 405 CZ PHE A 717 16.013 2.253 1.200 1.00 0.00 C ATOM 0 H PHE A 717 10.876 -0.429 3.167 1.00 0.00 H new ATOM 0 HA PHE A 717 11.882 2.227 3.910 1.00 0.00 H new ATOM 0 HB2 PHE A 717 11.458 1.010 1.174 1.00 0.00 H new ATOM 0 HB3 PHE A 717 11.331 2.740 1.424 1.00 0.00 H new ATOM 0 HD1 PHE A 717 13.733 -0.068 2.047 1.00 0.00 H new ATOM 0 HD2 PHE A 717 13.179 4.041 1.115 1.00 0.00 H new ATOM 0 HE1 PHE A 717 16.141 0.182 1.681 1.00 0.00 H new ATOM 0 HE2 PHE A 717 15.589 4.293 0.762 1.00 0.00 H new ATOM 0 HZ PHE A 717 17.076 2.360 1.042 1.00 0.00 H new ATOM 415 N ASN A 718 9.537 3.007 3.901 1.00 0.00 N ATOM 416 CA ASN A 718 8.179 3.451 4.018 1.00 0.00 C ATOM 417 C ASN A 718 8.215 4.919 3.753 1.00 0.00 C ATOM 418 O ASN A 718 9.217 5.443 3.279 1.00 0.00 O ATOM 419 CB ASN A 718 7.609 3.258 5.439 1.00 0.00 C ATOM 420 CG ASN A 718 7.917 1.948 6.100 1.00 0.00 C ATOM 421 OD1 ASN A 718 7.239 0.944 5.890 1.00 0.00 O ATOM 422 ND2 ASN A 718 8.870 1.992 6.996 1.00 0.00 N ATOM 0 H ASN A 718 10.219 3.631 4.331 1.00 0.00 H new ATOM 0 HA ASN A 718 7.554 2.881 3.331 1.00 0.00 H new ATOM 0 HB2 ASN A 718 7.988 4.060 6.073 1.00 0.00 H new ATOM 0 HB3 ASN A 718 6.526 3.373 5.393 1.00 0.00 H new ATOM 0 HD21 ASN A 718 9.079 1.168 7.559 1.00 0.00 H new ATOM 0 HD22 ASN A 718 9.404 2.851 7.131 1.00 0.00 H new ATOM 429 N CYS A 719 7.197 5.594 4.129 1.00 0.00 N ATOM 430 CA CYS A 719 7.128 7.001 3.936 1.00 0.00 C ATOM 431 C CYS A 719 6.989 7.568 5.305 1.00 0.00 C ATOM 432 O CYS A 719 6.339 6.940 6.145 1.00 0.00 O ATOM 433 CB CYS A 719 5.929 7.340 3.046 1.00 0.00 C ATOM 434 SG CYS A 719 5.798 6.209 1.638 1.00 0.00 S ATOM 0 H CYS A 719 6.379 5.189 4.583 1.00 0.00 H new ATOM 0 HA CYS A 719 8.004 7.411 3.434 1.00 0.00 H new ATOM 0 HB2 CYS A 719 5.014 7.294 3.636 1.00 0.00 H new ATOM 0 HB3 CYS A 719 6.023 8.363 2.683 1.00 0.00 H new ATOM 439 N SER A 720 7.652 8.668 5.559 1.00 0.00 N ATOM 440 CA SER A 720 7.657 9.303 6.885 1.00 0.00 C ATOM 441 C SER A 720 6.222 9.484 7.413 1.00 0.00 C ATOM 442 O SER A 720 5.785 8.771 8.324 1.00 0.00 O ATOM 443 CB SER A 720 8.423 10.639 6.809 1.00 0.00 C ATOM 444 OG SER A 720 8.437 11.338 8.036 1.00 0.00 O ATOM 0 H SER A 720 8.209 9.162 4.862 1.00 0.00 H new ATOM 0 HA SER A 720 8.170 8.657 7.597 1.00 0.00 H new ATOM 0 HB2 SER A 720 9.449 10.446 6.496 1.00 0.00 H new ATOM 0 HB3 SER A 720 7.969 11.269 6.044 1.00 0.00 H new ATOM 0 HG SER A 720 8.936 12.175 7.930 1.00 0.00 H new ATOM 450 N GLU A 721 5.527 10.406 6.829 1.00 0.00 N ATOM 451 CA GLU A 721 4.144 10.678 7.047 1.00 0.00 C ATOM 452 C GLU A 721 3.788 11.698 6.034 1.00 0.00 C ATOM 453 O GLU A 721 4.712 12.261 5.442 1.00 0.00 O ATOM 454 CB GLU A 721 3.811 11.105 8.509 1.00 0.00 C ATOM 455 CG GLU A 721 4.657 12.223 9.141 1.00 0.00 C ATOM 456 CD GLU A 721 4.495 13.582 8.508 1.00 0.00 C ATOM 457 OE1 GLU A 721 3.370 14.130 8.515 1.00 0.00 O ATOM 458 OE2 GLU A 721 5.500 14.155 8.059 1.00 0.00 O ATOM 0 H GLU A 721 5.941 11.032 6.139 1.00 0.00 H new ATOM 0 HA GLU A 721 3.542 9.777 6.929 1.00 0.00 H new ATOM 0 HB2 GLU A 721 2.767 11.419 8.537 1.00 0.00 H new ATOM 0 HB3 GLU A 721 3.895 10.222 9.143 1.00 0.00 H new ATOM 0 HG2 GLU A 721 4.401 12.298 10.198 1.00 0.00 H new ATOM 0 HG3 GLU A 721 5.707 11.937 9.088 1.00 0.00 H new ATOM 465 N SER A 722 2.501 11.898 5.771 1.00 0.00 N ATOM 466 CA SER A 722 2.043 12.851 4.749 1.00 0.00 C ATOM 467 C SER A 722 2.428 12.384 3.341 1.00 0.00 C ATOM 468 O SER A 722 2.386 13.147 2.363 1.00 0.00 O ATOM 469 CB SER A 722 2.620 14.217 5.021 1.00 0.00 C ATOM 470 OG SER A 722 2.113 14.768 6.231 1.00 0.00 O ATOM 0 H SER A 722 1.745 11.411 6.253 1.00 0.00 H new ATOM 0 HA SER A 722 0.955 12.905 4.799 1.00 0.00 H new ATOM 0 HB2 SER A 722 3.706 14.149 5.079 1.00 0.00 H new ATOM 0 HB3 SER A 722 2.386 14.883 4.191 1.00 0.00 H new ATOM 0 HG SER A 722 2.503 14.294 6.995 1.00 0.00 H new ATOM 476 N PHE A 723 2.751 11.131 3.265 1.00 0.00 N ATOM 477 CA PHE A 723 3.172 10.456 2.107 1.00 0.00 C ATOM 478 C PHE A 723 2.684 9.035 2.203 1.00 0.00 C ATOM 479 O PHE A 723 2.540 8.495 3.304 1.00 0.00 O ATOM 480 CB PHE A 723 4.699 10.484 1.945 1.00 0.00 C ATOM 481 CG PHE A 723 5.262 11.842 1.621 1.00 0.00 C ATOM 482 CD1 PHE A 723 5.242 12.307 0.323 1.00 0.00 C ATOM 483 CD2 PHE A 723 5.804 12.646 2.603 1.00 0.00 C ATOM 484 CE1 PHE A 723 5.747 13.537 0.004 1.00 0.00 C ATOM 485 CE2 PHE A 723 6.318 13.882 2.296 1.00 0.00 C ATOM 486 CZ PHE A 723 6.291 14.330 0.990 1.00 0.00 C ATOM 0 H PHE A 723 2.720 10.519 4.081 1.00 0.00 H new ATOM 0 HA PHE A 723 2.757 10.954 1.231 1.00 0.00 H new ATOM 0 HB2 PHE A 723 5.157 10.124 2.866 1.00 0.00 H new ATOM 0 HB3 PHE A 723 4.982 9.788 1.155 1.00 0.00 H new ATOM 0 HD1 PHE A 723 4.820 11.689 -0.455 1.00 0.00 H new ATOM 0 HD2 PHE A 723 5.824 12.299 3.626 1.00 0.00 H new ATOM 0 HE1 PHE A 723 5.719 13.886 -1.018 1.00 0.00 H new ATOM 0 HE2 PHE A 723 6.742 14.501 3.073 1.00 0.00 H new ATOM 0 HZ PHE A 723 6.696 15.300 0.742 1.00 0.00 H new ATOM 496 N THR A 724 2.416 8.465 1.091 1.00 0.00 N ATOM 497 CA THR A 724 1.878 7.144 0.998 1.00 0.00 C ATOM 498 C THR A 724 2.855 6.213 0.260 1.00 0.00 C ATOM 499 O THR A 724 3.546 6.637 -0.663 1.00 0.00 O ATOM 500 CB THR A 724 0.450 7.168 0.336 1.00 0.00 C ATOM 501 OG1 THR A 724 -0.570 7.329 1.315 1.00 0.00 O ATOM 502 CG2 THR A 724 0.199 5.944 -0.473 1.00 0.00 C ATOM 0 H THR A 724 2.566 8.910 0.186 1.00 0.00 H new ATOM 0 HA THR A 724 1.752 6.742 2.003 1.00 0.00 H new ATOM 0 HB THR A 724 0.424 8.027 -0.334 1.00 0.00 H new ATOM 0 HG1 THR A 724 -0.974 6.458 1.513 1.00 0.00 H new ATOM 0 HG21 THR A 724 -0.796 5.997 -0.914 1.00 0.00 H new ATOM 0 HG22 THR A 724 0.944 5.873 -1.266 1.00 0.00 H new ATOM 0 HG23 THR A 724 0.266 5.065 0.167 1.00 0.00 H new ATOM 510 N MET A 725 2.894 4.971 0.681 1.00 0.00 N ATOM 511 CA MET A 725 3.778 3.984 0.148 1.00 0.00 C ATOM 512 C MET A 725 3.045 3.133 -0.845 1.00 0.00 C ATOM 513 O MET A 725 2.005 2.541 -0.531 1.00 0.00 O ATOM 514 CB MET A 725 4.270 3.067 1.255 1.00 0.00 C ATOM 515 CG MET A 725 5.233 1.994 0.771 1.00 0.00 C ATOM 516 SD MET A 725 4.975 0.430 1.617 1.00 0.00 S ATOM 517 CE MET A 725 3.339 -0.014 1.005 1.00 0.00 C ATOM 0 H MET A 725 2.292 4.618 1.425 1.00 0.00 H new ATOM 0 HA MET A 725 4.617 4.498 -0.322 1.00 0.00 H new ATOM 0 HB2 MET A 725 4.762 3.667 2.021 1.00 0.00 H new ATOM 0 HB3 MET A 725 3.412 2.588 1.727 1.00 0.00 H new ATOM 0 HG2 MET A 725 5.107 1.851 -0.302 1.00 0.00 H new ATOM 0 HG3 MET A 725 6.258 2.328 0.930 1.00 0.00 H new ATOM 0 HE1 MET A 725 3.227 -1.098 1.020 1.00 0.00 H new ATOM 0 HE2 MET A 725 2.578 0.439 1.640 1.00 0.00 H new ATOM 0 HE3 MET A 725 3.222 0.348 -0.016 1.00 0.00 H new ATOM 527 N ILE A 726 3.553 3.091 -2.011 1.00 0.00 N ATOM 528 CA ILE A 726 3.068 2.223 -3.045 1.00 0.00 C ATOM 529 C ILE A 726 4.223 1.325 -3.470 1.00 0.00 C ATOM 530 O ILE A 726 5.370 1.746 -3.417 1.00 0.00 O ATOM 531 CB ILE A 726 2.534 3.038 -4.268 1.00 0.00 C ATOM 532 CG1 ILE A 726 1.384 3.960 -3.836 1.00 0.00 C ATOM 533 CG2 ILE A 726 2.074 2.117 -5.395 1.00 0.00 C ATOM 534 CD1 ILE A 726 0.205 3.220 -3.217 1.00 0.00 C ATOM 0 H ILE A 726 4.342 3.670 -2.298 1.00 0.00 H new ATOM 0 HA ILE A 726 2.234 1.630 -2.669 1.00 0.00 H new ATOM 0 HB ILE A 726 3.356 3.646 -4.645 1.00 0.00 H new ATOM 0 HG12 ILE A 726 1.763 4.687 -3.117 1.00 0.00 H new ATOM 0 HG13 ILE A 726 1.035 4.521 -4.703 1.00 0.00 H new ATOM 0 HG21 ILE A 726 1.709 2.717 -6.229 1.00 0.00 H new ATOM 0 HG22 ILE A 726 2.911 1.504 -5.728 1.00 0.00 H new ATOM 0 HG23 ILE A 726 1.273 1.472 -5.034 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -0.568 3.936 -2.937 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -0.201 2.513 -3.940 1.00 0.00 H new ATOM 0 HD13 ILE A 726 0.539 2.681 -2.330 1.00 0.00 H new ATOM 546 N GLY A 727 3.934 0.097 -3.785 1.00 0.00 N ATOM 547 CA GLY A 727 4.937 -0.807 -4.272 1.00 0.00 C ATOM 548 C GLY A 727 5.174 -1.932 -3.312 1.00 0.00 C ATOM 549 O GLY A 727 4.508 -2.965 -3.375 1.00 0.00 O ATOM 0 H GLY A 727 3.000 -0.307 -3.712 1.00 0.00 H new ATOM 0 HA2 GLY A 727 4.628 -1.209 -5.237 1.00 0.00 H new ATOM 0 HA3 GLY A 727 5.868 -0.265 -4.436 1.00 0.00 H new ATOM 553 N HIS A 728 6.088 -1.719 -2.404 1.00 0.00 N ATOM 554 CA HIS A 728 6.457 -2.717 -1.398 1.00 0.00 C ATOM 555 C HIS A 728 7.308 -2.045 -0.398 1.00 0.00 C ATOM 556 O HIS A 728 8.166 -1.285 -0.755 1.00 0.00 O ATOM 557 CB HIS A 728 7.249 -3.846 -2.023 1.00 0.00 C ATOM 558 CG HIS A 728 7.390 -5.089 -1.188 1.00 0.00 C ATOM 559 ND1 HIS A 728 6.354 -5.969 -0.989 1.00 0.00 N ATOM 560 CD2 HIS A 728 8.450 -5.614 -0.532 1.00 0.00 C ATOM 561 CE1 HIS A 728 6.764 -6.973 -0.253 1.00 0.00 C ATOM 562 NE2 HIS A 728 8.028 -6.783 0.037 1.00 0.00 N ATOM 0 H HIS A 728 6.610 -0.846 -2.329 1.00 0.00 H new ATOM 0 HA HIS A 728 5.555 -3.133 -0.949 1.00 0.00 H new ATOM 0 HB2 HIS A 728 6.776 -4.117 -2.967 1.00 0.00 H new ATOM 0 HB3 HIS A 728 8.246 -3.476 -2.261 1.00 0.00 H new ATOM 0 HD2 HIS A 728 9.441 -5.190 -0.470 1.00 0.00 H new ATOM 0 HE1 HIS A 728 6.163 -7.814 0.061 1.00 0.00 H new ATOM 0 HE2 HIS A 728 8.606 -7.409 0.599 1.00 0.00 H new ATOM 571 N ARG A 729 7.132 -2.382 0.819 1.00 0.00 N ATOM 572 CA ARG A 729 7.816 -1.661 1.908 1.00 0.00 C ATOM 573 C ARG A 729 9.251 -2.126 2.161 1.00 0.00 C ATOM 574 O ARG A 729 9.801 -1.848 3.206 1.00 0.00 O ATOM 575 CB ARG A 729 7.013 -1.653 3.245 1.00 0.00 C ATOM 576 CG ARG A 729 6.940 -2.981 4.025 1.00 0.00 C ATOM 577 CD ARG A 729 6.170 -4.058 3.294 1.00 0.00 C ATOM 578 NE ARG A 729 4.777 -3.657 3.048 1.00 0.00 N ATOM 579 CZ ARG A 729 3.850 -4.359 2.378 1.00 0.00 C ATOM 580 NH1 ARG A 729 4.099 -5.602 1.962 1.00 0.00 N ATOM 581 NH2 ARG A 729 2.646 -3.828 2.202 1.00 0.00 N ATOM 0 H ARG A 729 6.529 -3.146 1.124 1.00 0.00 H new ATOM 0 HA ARG A 729 7.869 -0.637 1.539 1.00 0.00 H new ATOM 0 HB2 ARG A 729 7.452 -0.899 3.899 1.00 0.00 H new ATOM 0 HB3 ARG A 729 5.995 -1.332 3.027 1.00 0.00 H new ATOM 0 HG2 ARG A 729 7.952 -3.336 4.221 1.00 0.00 H new ATOM 0 HG3 ARG A 729 6.472 -2.802 4.993 1.00 0.00 H new ATOM 0 HD2 ARG A 729 6.660 -4.275 2.345 1.00 0.00 H new ATOM 0 HD3 ARG A 729 6.186 -4.978 3.879 1.00 0.00 H new ATOM 0 HE ARG A 729 4.486 -2.755 3.424 1.00 0.00 H new ATOM 0 HH11 ARG A 729 5.004 -6.032 2.152 1.00 0.00 H new ATOM 0 HH12 ARG A 729 3.384 -6.123 1.454 1.00 0.00 H new ATOM 0 HH21 ARG A 729 2.438 -2.901 2.573 1.00 0.00 H new ATOM 0 HH22 ARG A 729 1.929 -4.347 1.695 1.00 0.00 H new ATOM 595 N SER A 730 9.869 -2.770 1.208 1.00 0.00 N ATOM 596 CA SER A 730 11.209 -3.265 1.401 1.00 0.00 C ATOM 597 C SER A 730 11.887 -3.590 0.097 1.00 0.00 C ATOM 598 O SER A 730 11.227 -3.746 -0.941 1.00 0.00 O ATOM 599 CB SER A 730 11.224 -4.450 2.386 1.00 0.00 C ATOM 600 OG SER A 730 10.100 -5.300 2.189 1.00 0.00 O ATOM 0 H SER A 730 9.468 -2.965 0.290 1.00 0.00 H new ATOM 0 HA SER A 730 11.795 -2.464 1.852 1.00 0.00 H new ATOM 0 HB2 SER A 730 12.143 -5.022 2.256 1.00 0.00 H new ATOM 0 HB3 SER A 730 11.224 -4.075 3.409 1.00 0.00 H new ATOM 0 HG SER A 730 10.137 -6.044 2.826 1.00 0.00 H new ATOM 606 N ILE A 731 13.192 -3.632 0.150 1.00 0.00 N ATOM 607 CA ILE A 731 14.029 -3.923 -0.981 1.00 0.00 C ATOM 608 C ILE A 731 14.844 -5.153 -0.684 1.00 0.00 C ATOM 609 O ILE A 731 14.968 -5.538 0.470 1.00 0.00 O ATOM 610 CB ILE A 731 14.998 -2.759 -1.280 1.00 0.00 C ATOM 611 CG1 ILE A 731 15.879 -2.506 -0.056 1.00 0.00 C ATOM 612 CG2 ILE A 731 14.213 -1.529 -1.651 1.00 0.00 C ATOM 613 CD1 ILE A 731 16.939 -1.466 -0.237 1.00 0.00 C ATOM 0 H ILE A 731 13.716 -3.459 1.008 1.00 0.00 H new ATOM 0 HA ILE A 731 13.386 -4.076 -1.848 1.00 0.00 H new ATOM 0 HB ILE A 731 15.642 -3.016 -2.121 1.00 0.00 H new ATOM 0 HG12 ILE A 731 15.240 -2.210 0.776 1.00 0.00 H new ATOM 0 HG13 ILE A 731 16.357 -3.444 0.227 1.00 0.00 H new ATOM 0 HG21 ILE A 731 14.900 -0.709 -1.861 1.00 0.00 H new ATOM 0 HG22 ILE A 731 13.611 -1.735 -2.536 1.00 0.00 H new ATOM 0 HG23 ILE A 731 13.559 -1.252 -0.824 1.00 0.00 H new ATOM 0 HD11 ILE A 731 17.508 -1.362 0.687 1.00 0.00 H new ATOM 0 HD12 ILE A 731 17.608 -1.765 -1.044 1.00 0.00 H new ATOM 0 HD13 ILE A 731 16.474 -0.512 -0.486 1.00 0.00 H new ATOM 625 N THR A 732 15.406 -5.751 -1.695 1.00 0.00 N ATOM 626 CA THR A 732 16.210 -6.953 -1.496 1.00 0.00 C ATOM 627 C THR A 732 17.492 -6.888 -2.309 1.00 0.00 C ATOM 628 O THR A 732 17.483 -6.426 -3.429 1.00 0.00 O ATOM 629 CB THR A 732 15.417 -8.211 -1.900 1.00 0.00 C ATOM 630 OG1 THR A 732 14.122 -8.176 -1.267 1.00 0.00 O ATOM 631 CG2 THR A 732 16.138 -9.481 -1.456 1.00 0.00 C ATOM 0 H THR A 732 15.332 -5.440 -2.664 1.00 0.00 H new ATOM 0 HA THR A 732 16.461 -7.010 -0.437 1.00 0.00 H new ATOM 0 HB THR A 732 15.320 -8.220 -2.986 1.00 0.00 H new ATOM 0 HG1 THR A 732 13.612 -8.973 -1.521 1.00 0.00 H new ATOM 0 HG21 THR A 732 15.556 -10.353 -1.754 1.00 0.00 H new ATOM 0 HG22 THR A 732 17.121 -9.524 -1.924 1.00 0.00 H new ATOM 0 HG23 THR A 732 16.252 -9.474 -0.372 1.00 0.00 H new ATOM 639 N CYS A 733 18.581 -7.295 -1.711 1.00 0.00 N ATOM 640 CA CYS A 733 19.850 -7.350 -2.397 1.00 0.00 C ATOM 641 C CYS A 733 19.983 -8.661 -3.132 1.00 0.00 C ATOM 642 O CYS A 733 20.103 -9.736 -2.514 1.00 0.00 O ATOM 643 CB CYS A 733 21.007 -7.108 -1.424 1.00 0.00 C ATOM 644 SG CYS A 733 22.666 -7.646 -2.004 1.00 0.00 S ATOM 0 H CYS A 733 18.616 -7.597 -0.737 1.00 0.00 H new ATOM 0 HA CYS A 733 19.892 -6.551 -3.137 1.00 0.00 H new ATOM 0 HB2 CYS A 733 21.050 -6.043 -1.198 1.00 0.00 H new ATOM 0 HB3 CYS A 733 20.785 -7.623 -0.490 1.00 0.00 H new ATOM 649 N ILE A 734 19.896 -8.566 -4.433 1.00 0.00 N ATOM 650 CA ILE A 734 19.966 -9.677 -5.344 1.00 0.00 C ATOM 651 C ILE A 734 20.645 -9.238 -6.635 1.00 0.00 C ATOM 652 O ILE A 734 20.515 -8.104 -7.037 1.00 0.00 O ATOM 653 CB ILE A 734 18.551 -10.323 -5.620 1.00 0.00 C ATOM 654 CG1 ILE A 734 17.400 -9.275 -5.677 1.00 0.00 C ATOM 655 CG2 ILE A 734 18.233 -11.395 -4.591 1.00 0.00 C ATOM 656 CD1 ILE A 734 17.492 -8.244 -6.781 1.00 0.00 C ATOM 0 H ILE A 734 19.769 -7.672 -4.907 1.00 0.00 H new ATOM 0 HA ILE A 734 20.565 -10.459 -4.877 1.00 0.00 H new ATOM 0 HB ILE A 734 18.615 -10.779 -6.608 1.00 0.00 H new ATOM 0 HG12 ILE A 734 16.455 -9.808 -5.784 1.00 0.00 H new ATOM 0 HG13 ILE A 734 17.365 -8.752 -4.721 1.00 0.00 H new ATOM 0 HG21 ILE A 734 17.254 -11.824 -4.803 1.00 0.00 H new ATOM 0 HG22 ILE A 734 18.990 -12.178 -4.636 1.00 0.00 H new ATOM 0 HG23 ILE A 734 18.227 -10.953 -3.595 1.00 0.00 H new ATOM 0 HD11 ILE A 734 16.638 -7.569 -6.721 1.00 0.00 H new ATOM 0 HD12 ILE A 734 18.414 -7.673 -6.670 1.00 0.00 H new ATOM 0 HD13 ILE A 734 17.491 -8.746 -7.749 1.00 0.00 H new ATOM 668 N HIS A 735 21.441 -10.111 -7.227 1.00 0.00 N ATOM 669 CA HIS A 735 22.178 -9.819 -8.495 1.00 0.00 C ATOM 670 C HIS A 735 23.283 -8.769 -8.307 1.00 0.00 C ATOM 671 O HIS A 735 23.988 -8.435 -9.248 1.00 0.00 O ATOM 672 CB HIS A 735 21.229 -9.349 -9.621 1.00 0.00 C ATOM 673 CG HIS A 735 20.283 -10.379 -10.132 1.00 0.00 C ATOM 674 ND1 HIS A 735 20.514 -11.107 -11.267 1.00 0.00 N ATOM 675 CD2 HIS A 735 19.085 -10.785 -9.666 1.00 0.00 C ATOM 676 CE1 HIS A 735 19.505 -11.917 -11.479 1.00 0.00 C ATOM 677 NE2 HIS A 735 18.625 -11.742 -10.524 1.00 0.00 N ATOM 0 H HIS A 735 21.611 -11.048 -6.862 1.00 0.00 H new ATOM 0 HA HIS A 735 22.640 -10.763 -8.783 1.00 0.00 H new ATOM 0 HB2 HIS A 735 20.652 -8.500 -9.255 1.00 0.00 H new ATOM 0 HB3 HIS A 735 21.832 -8.989 -10.454 1.00 0.00 H new ATOM 0 HD2 HIS A 735 18.584 -10.422 -8.781 1.00 0.00 H new ATOM 0 HE1 HIS A 735 19.414 -12.611 -12.302 1.00 0.00 H new ATOM 0 HE2 HIS A 735 17.739 -12.240 -10.436 1.00 0.00 H new ATOM 686 N GLY A 736 23.416 -8.264 -7.098 1.00 0.00 N ATOM 687 CA GLY A 736 24.385 -7.237 -6.810 1.00 0.00 C ATOM 688 C GLY A 736 23.750 -5.882 -6.889 1.00 0.00 C ATOM 689 O GLY A 736 24.435 -4.856 -7.020 1.00 0.00 O ATOM 0 H GLY A 736 22.858 -8.554 -6.295 1.00 0.00 H new ATOM 0 HA2 GLY A 736 24.804 -7.392 -5.816 1.00 0.00 H new ATOM 0 HA3 GLY A 736 25.212 -7.300 -7.517 1.00 0.00 H new ATOM 693 N VAL A 737 22.438 -5.878 -6.797 1.00 0.00 N ATOM 694 CA VAL A 737 21.628 -4.720 -6.914 1.00 0.00 C ATOM 695 C VAL A 737 20.504 -4.874 -5.888 1.00 0.00 C ATOM 696 O VAL A 737 20.168 -5.987 -5.495 1.00 0.00 O ATOM 697 CB VAL A 737 20.959 -4.668 -8.340 1.00 0.00 C ATOM 698 CG1 VAL A 737 20.217 -3.369 -8.576 1.00 0.00 C ATOM 699 CG2 VAL A 737 21.944 -4.934 -9.475 1.00 0.00 C ATOM 0 H VAL A 737 21.898 -6.727 -6.631 1.00 0.00 H new ATOM 0 HA VAL A 737 22.226 -3.821 -6.760 1.00 0.00 H new ATOM 0 HB VAL A 737 20.234 -5.482 -8.347 1.00 0.00 H new ATOM 0 HG11 VAL A 737 19.773 -3.379 -9.571 1.00 0.00 H new ATOM 0 HG12 VAL A 737 19.431 -3.258 -7.829 1.00 0.00 H new ATOM 0 HG13 VAL A 737 20.912 -2.533 -8.498 1.00 0.00 H new ATOM 0 HG21 VAL A 737 21.421 -4.884 -10.430 1.00 0.00 H new ATOM 0 HG22 VAL A 737 22.734 -4.183 -9.454 1.00 0.00 H new ATOM 0 HG23 VAL A 737 22.381 -5.925 -9.352 1.00 0.00 H new ATOM 709 N TRP A 738 20.001 -3.806 -5.394 1.00 0.00 N ATOM 710 CA TRP A 738 18.791 -3.866 -4.611 1.00 0.00 C ATOM 711 C TRP A 738 17.586 -3.937 -5.536 1.00 0.00 C ATOM 712 O TRP A 738 17.710 -3.767 -6.750 1.00 0.00 O ATOM 713 CB TRP A 738 18.674 -2.678 -3.690 1.00 0.00 C ATOM 714 CG TRP A 738 19.730 -2.637 -2.662 1.00 0.00 C ATOM 715 CD1 TRP A 738 20.887 -1.935 -2.711 1.00 0.00 C ATOM 716 CD2 TRP A 738 19.727 -3.329 -1.437 1.00 0.00 C ATOM 717 NE1 TRP A 738 21.616 -2.153 -1.583 1.00 0.00 N ATOM 718 CE2 TRP A 738 20.916 -3.013 -0.781 1.00 0.00 C ATOM 719 CE3 TRP A 738 18.827 -4.189 -0.829 1.00 0.00 C ATOM 720 CZ2 TRP A 738 21.219 -3.527 0.451 1.00 0.00 C ATOM 721 CZ3 TRP A 738 19.124 -4.694 0.398 1.00 0.00 C ATOM 722 CH2 TRP A 738 20.312 -4.364 1.026 1.00 0.00 C ATOM 0 H TRP A 738 20.396 -2.872 -5.508 1.00 0.00 H new ATOM 0 HA TRP A 738 18.827 -4.763 -3.992 1.00 0.00 H new ATOM 0 HB2 TRP A 738 18.714 -1.763 -4.280 1.00 0.00 H new ATOM 0 HB3 TRP A 738 17.700 -2.699 -3.201 1.00 0.00 H new ATOM 0 HD1 TRP A 738 21.188 -1.295 -3.527 1.00 0.00 H new ATOM 0 HE1 TRP A 738 22.527 -1.746 -1.372 1.00 0.00 H new ATOM 0 HE3 TRP A 738 17.904 -4.454 -1.322 1.00 0.00 H new ATOM 0 HZ2 TRP A 738 22.144 -3.278 0.949 1.00 0.00 H new ATOM 0 HZ3 TRP A 738 18.427 -5.358 0.887 1.00 0.00 H new ATOM 0 HH2 TRP A 738 20.526 -4.782 1.999 1.00 0.00 H new ATOM 733 N THR A 739 16.441 -4.190 -4.987 1.00 0.00 N ATOM 734 CA THR A 739 15.252 -4.289 -5.766 1.00 0.00 C ATOM 735 C THR A 739 14.719 -2.913 -6.177 1.00 0.00 C ATOM 736 O THR A 739 15.392 -1.884 -6.020 1.00 0.00 O ATOM 737 CB THR A 739 14.196 -5.155 -5.059 1.00 0.00 C ATOM 738 OG1 THR A 739 13.956 -4.682 -3.759 1.00 0.00 O ATOM 739 CG2 THR A 739 14.630 -6.608 -5.009 1.00 0.00 C ATOM 0 H THR A 739 16.306 -4.333 -3.986 1.00 0.00 H new ATOM 0 HA THR A 739 15.504 -4.799 -6.696 1.00 0.00 H new ATOM 0 HB THR A 739 13.272 -5.089 -5.634 1.00 0.00 H new ATOM 0 HG1 THR A 739 13.756 -3.723 -3.791 1.00 0.00 H new ATOM 0 HG21 THR A 739 13.866 -7.199 -4.504 1.00 0.00 H new ATOM 0 HG22 THR A 739 14.766 -6.982 -6.024 1.00 0.00 H new ATOM 0 HG23 THR A 739 15.570 -6.688 -4.463 1.00 0.00 H new ATOM 747 N GLN A 740 13.518 -2.902 -6.643 1.00 0.00 N ATOM 748 CA GLN A 740 12.939 -1.755 -7.329 1.00 0.00 C ATOM 749 C GLN A 740 12.564 -0.588 -6.425 1.00 0.00 C ATOM 750 O GLN A 740 12.378 0.523 -6.928 1.00 0.00 O ATOM 751 CB GLN A 740 11.745 -2.165 -8.207 1.00 0.00 C ATOM 752 CG GLN A 740 10.472 -2.624 -7.472 1.00 0.00 C ATOM 753 CD GLN A 740 10.622 -3.879 -6.642 1.00 0.00 C ATOM 754 OE1 GLN A 740 10.460 -4.983 -7.141 1.00 0.00 O ATOM 755 NE2 GLN A 740 10.859 -3.716 -5.362 1.00 0.00 N ATOM 0 H GLN A 740 12.883 -3.696 -6.566 1.00 0.00 H new ATOM 0 HA GLN A 740 13.744 -1.384 -7.964 1.00 0.00 H new ATOM 0 HB2 GLN A 740 11.484 -1.319 -8.843 1.00 0.00 H new ATOM 0 HB3 GLN A 740 12.068 -2.972 -8.865 1.00 0.00 H new ATOM 0 HG2 GLN A 740 10.136 -1.816 -6.822 1.00 0.00 H new ATOM 0 HG3 GLN A 740 9.686 -2.787 -8.209 1.00 0.00 H new ATOM 0 HE21 GLN A 740 10.989 -2.778 -4.983 1.00 0.00 H new ATOM 0 HE22 GLN A 740 10.914 -4.527 -4.746 1.00 0.00 H new ATOM 764 N LEU A 741 12.490 -0.832 -5.109 1.00 0.00 N ATOM 765 CA LEU A 741 12.084 0.200 -4.116 1.00 0.00 C ATOM 766 C LEU A 741 10.600 0.598 -4.226 1.00 0.00 C ATOM 767 O LEU A 741 9.981 0.478 -5.292 1.00 0.00 O ATOM 768 CB LEU A 741 12.981 1.449 -4.217 1.00 0.00 C ATOM 769 CG LEU A 741 14.388 1.287 -3.691 1.00 0.00 C ATOM 770 CD1 LEU A 741 15.376 1.921 -4.636 1.00 0.00 C ATOM 771 CD2 LEU A 741 14.487 1.930 -2.319 1.00 0.00 C ATOM 0 H LEU A 741 12.706 -1.739 -4.695 1.00 0.00 H new ATOM 0 HA LEU A 741 12.216 -0.258 -3.136 1.00 0.00 H new ATOM 0 HB2 LEU A 741 13.036 1.751 -5.263 1.00 0.00 H new ATOM 0 HB3 LEU A 741 12.501 2.264 -3.675 1.00 0.00 H new ATOM 0 HG LEU A 741 14.623 0.226 -3.611 1.00 0.00 H new ATOM 0 HD11 LEU A 741 16.386 1.797 -4.244 1.00 0.00 H new ATOM 0 HD12 LEU A 741 15.304 1.442 -5.613 1.00 0.00 H new ATOM 0 HD13 LEU A 741 15.154 2.983 -4.736 1.00 0.00 H new ATOM 0 HD21 LEU A 741 15.501 1.815 -1.936 1.00 0.00 H new ATOM 0 HD22 LEU A 741 14.246 2.990 -2.396 1.00 0.00 H new ATOM 0 HD23 LEU A 741 13.785 1.447 -1.639 1.00 0.00 H new ATOM 783 N PRO A 742 9.995 1.022 -3.104 1.00 0.00 N ATOM 784 CA PRO A 742 8.633 1.533 -3.100 1.00 0.00 C ATOM 785 C PRO A 742 8.569 2.946 -3.667 1.00 0.00 C ATOM 786 O PRO A 742 9.582 3.532 -4.062 1.00 0.00 O ATOM 787 CB PRO A 742 8.256 1.565 -1.621 1.00 0.00 C ATOM 788 CG PRO A 742 9.544 1.698 -0.900 1.00 0.00 C ATOM 789 CD PRO A 742 10.578 1.007 -1.744 1.00 0.00 C ATOM 0 HA PRO A 742 7.969 0.920 -3.710 1.00 0.00 H new ATOM 0 HB2 PRO A 742 7.592 2.401 -1.401 1.00 0.00 H new ATOM 0 HB3 PRO A 742 7.731 0.656 -1.328 1.00 0.00 H new ATOM 0 HG2 PRO A 742 9.800 2.747 -0.754 1.00 0.00 H new ATOM 0 HG3 PRO A 742 9.484 1.244 0.089 1.00 0.00 H new ATOM 0 HD2 PRO A 742 11.534 1.530 -1.713 1.00 0.00 H new ATOM 0 HD3 PRO A 742 10.761 -0.011 -1.399 1.00 0.00 H new ATOM 797 N GLN A 743 7.402 3.470 -3.715 1.00 0.00 N ATOM 798 CA GLN A 743 7.173 4.791 -4.174 1.00 0.00 C ATOM 799 C GLN A 743 6.403 5.549 -3.118 1.00 0.00 C ATOM 800 O GLN A 743 5.276 5.175 -2.787 1.00 0.00 O ATOM 801 CB GLN A 743 6.370 4.742 -5.467 1.00 0.00 C ATOM 802 CG GLN A 743 6.067 6.102 -6.072 1.00 0.00 C ATOM 803 CD GLN A 743 5.220 6.013 -7.327 1.00 0.00 C ATOM 804 OE1 GLN A 743 4.351 5.032 -7.397 1.00 0.00 O flip ATOM 805 NE2 GLN A 743 5.335 6.844 -8.221 1.00 0.00 N flip ATOM 0 H GLN A 743 6.555 2.980 -3.429 1.00 0.00 H new ATOM 0 HA GLN A 743 8.122 5.293 -4.362 1.00 0.00 H new ATOM 0 HB2 GLN A 743 6.918 4.147 -6.198 1.00 0.00 H new ATOM 0 HB3 GLN A 743 5.429 4.225 -5.276 1.00 0.00 H new ATOM 0 HG2 GLN A 743 5.551 6.716 -5.334 1.00 0.00 H new ATOM 0 HG3 GLN A 743 7.004 6.607 -6.307 1.00 0.00 H new ATOM 0 HE21 GLN A 743 6.021 7.594 -8.135 1.00 0.00 H new ATOM 0 HE22 GLN A 743 4.745 6.785 -9.051 1.00 0.00 H new ATOM 814 N CYS A 744 7.020 6.552 -2.548 1.00 0.00 N ATOM 815 CA CYS A 744 6.349 7.395 -1.627 1.00 0.00 C ATOM 816 C CYS A 744 5.794 8.575 -2.323 1.00 0.00 C ATOM 817 O CYS A 744 6.514 9.402 -2.884 1.00 0.00 O ATOM 818 CB CYS A 744 7.217 7.799 -0.480 1.00 0.00 C ATOM 819 SG CYS A 744 7.551 6.447 0.650 1.00 0.00 S ATOM 0 H CYS A 744 7.996 6.796 -2.716 1.00 0.00 H new ATOM 0 HA CYS A 744 5.527 6.821 -1.200 1.00 0.00 H new ATOM 0 HB2 CYS A 744 8.161 8.187 -0.864 1.00 0.00 H new ATOM 0 HB3 CYS A 744 6.736 8.611 0.065 1.00 0.00 H new ATOM 824 N VAL A 745 4.534 8.610 -2.308 1.00 0.00 N ATOM 825 CA VAL A 745 3.760 9.601 -2.927 1.00 0.00 C ATOM 826 C VAL A 745 3.379 10.615 -1.915 1.00 0.00 C ATOM 827 O VAL A 745 3.325 10.334 -0.755 1.00 0.00 O ATOM 828 CB VAL A 745 2.504 8.962 -3.475 1.00 0.00 C ATOM 829 CG1 VAL A 745 1.662 8.478 -2.366 1.00 0.00 C ATOM 830 CG2 VAL A 745 1.775 9.836 -4.475 1.00 0.00 C ATOM 0 H VAL A 745 3.972 7.903 -1.833 1.00 0.00 H new ATOM 0 HA VAL A 745 4.325 10.072 -3.731 1.00 0.00 H new ATOM 0 HB VAL A 745 2.791 8.092 -4.065 1.00 0.00 H new ATOM 0 HG11 VAL A 745 0.759 8.019 -2.768 1.00 0.00 H new ATOM 0 HG12 VAL A 745 2.215 7.741 -1.784 1.00 0.00 H new ATOM 0 HG13 VAL A 745 1.388 9.316 -1.725 1.00 0.00 H new ATOM 0 HG21 VAL A 745 0.883 9.318 -4.829 1.00 0.00 H new ATOM 0 HG22 VAL A 745 1.485 10.772 -3.997 1.00 0.00 H new ATOM 0 HG23 VAL A 745 2.431 10.048 -5.319 1.00 0.00 H new ATOM 840 N ALA A 746 3.037 11.738 -2.379 1.00 0.00 N ATOM 841 CA ALA A 746 2.673 12.863 -1.520 1.00 0.00 C ATOM 842 C ALA A 746 1.250 12.777 -1.009 1.00 0.00 C ATOM 843 O ALA A 746 0.781 13.667 -0.320 1.00 0.00 O ATOM 844 CB ALA A 746 2.877 14.151 -2.247 1.00 0.00 C ATOM 0 H ALA A 746 2.989 11.945 -3.377 1.00 0.00 H new ATOM 0 HA ALA A 746 3.327 12.820 -0.649 1.00 0.00 H new ATOM 0 HB1 ALA A 746 2.603 14.983 -1.598 1.00 0.00 H new ATOM 0 HB2 ALA A 746 3.924 14.245 -2.534 1.00 0.00 H new ATOM 0 HB3 ALA A 746 2.253 14.167 -3.141 1.00 0.00 H new ATOM 850 N ILE A 747 0.564 11.742 -1.441 1.00 0.00 N ATOM 851 CA ILE A 747 -0.834 11.407 -1.052 1.00 0.00 C ATOM 852 C ILE A 747 -1.845 12.283 -1.777 1.00 0.00 C ATOM 853 O ILE A 747 -2.995 11.912 -2.015 1.00 0.00 O ATOM 854 CB ILE A 747 -0.974 11.543 0.475 1.00 0.00 C ATOM 855 CG1 ILE A 747 -0.427 10.344 1.201 1.00 0.00 C ATOM 856 CG2 ILE A 747 -2.360 11.972 0.974 1.00 0.00 C ATOM 857 CD1 ILE A 747 -0.486 10.439 2.706 1.00 0.00 C ATOM 0 H ILE A 747 0.959 11.070 -2.099 1.00 0.00 H new ATOM 0 HA ILE A 747 -1.046 10.379 -1.346 1.00 0.00 H new ATOM 0 HB ILE A 747 -0.344 12.394 0.734 1.00 0.00 H new ATOM 0 HG12 ILE A 747 -0.981 9.460 0.884 1.00 0.00 H new ATOM 0 HG13 ILE A 747 0.610 10.195 0.900 1.00 0.00 H new ATOM 0 HG21 ILE A 747 -2.351 12.038 2.062 1.00 0.00 H new ATOM 0 HG22 ILE A 747 -2.613 12.946 0.554 1.00 0.00 H new ATOM 0 HG23 ILE A 747 -3.103 11.238 0.661 1.00 0.00 H new ATOM 0 HD11 ILE A 747 -0.071 9.531 3.144 1.00 0.00 H new ATOM 0 HD12 ILE A 747 0.093 11.301 3.039 1.00 0.00 H new ATOM 0 HD13 ILE A 747 -1.523 10.554 3.023 1.00 0.00 H new ATOM 869 N ASP A 748 -1.353 13.345 -2.224 1.00 0.00 N ATOM 870 CA ASP A 748 -2.114 14.418 -2.798 1.00 0.00 C ATOM 871 C ASP A 748 -2.365 14.124 -4.249 1.00 0.00 C ATOM 872 O ASP A 748 -3.266 14.656 -4.880 1.00 0.00 O ATOM 873 CB ASP A 748 -1.308 15.680 -2.622 1.00 0.00 C ATOM 874 CG ASP A 748 -2.008 16.914 -3.123 1.00 0.00 C ATOM 875 OD1 ASP A 748 -2.940 17.391 -2.449 1.00 0.00 O ATOM 876 OD2 ASP A 748 -1.615 17.444 -4.176 1.00 0.00 O ATOM 0 H ASP A 748 -0.350 13.530 -2.213 1.00 0.00 H new ATOM 0 HA ASP A 748 -3.083 14.533 -2.313 1.00 0.00 H new ATOM 0 HB2 ASP A 748 -1.075 15.808 -1.565 1.00 0.00 H new ATOM 0 HB3 ASP A 748 -0.359 15.572 -3.147 1.00 0.00 H new ATOM 881 N LYS A 749 -1.560 13.244 -4.756 1.00 0.00 N ATOM 882 CA LYS A 749 -1.678 12.777 -6.095 1.00 0.00 C ATOM 883 C LYS A 749 -2.075 11.314 -6.131 1.00 0.00 C ATOM 884 O LYS A 749 -1.726 10.563 -7.056 1.00 0.00 O ATOM 885 CB LYS A 749 -0.406 13.017 -6.841 1.00 0.00 C ATOM 886 CG LYS A 749 0.819 12.855 -6.020 1.00 0.00 C ATOM 887 CD LYS A 749 2.054 13.290 -6.785 1.00 0.00 C ATOM 888 CE LYS A 749 2.044 14.785 -7.067 1.00 0.00 C ATOM 889 NZ LYS A 749 3.201 15.201 -7.877 1.00 0.00 N ATOM 0 H LYS A 749 -0.788 12.824 -4.238 1.00 0.00 H new ATOM 0 HA LYS A 749 -2.471 13.339 -6.588 1.00 0.00 H new ATOM 0 HB2 LYS A 749 -0.358 12.330 -7.685 1.00 0.00 H new ATOM 0 HB3 LYS A 749 -0.424 14.026 -7.252 1.00 0.00 H new ATOM 0 HG2 LYS A 749 0.728 13.443 -5.107 1.00 0.00 H new ATOM 0 HG3 LYS A 749 0.923 11.813 -5.719 1.00 0.00 H new ATOM 0 HD2 LYS A 749 2.946 13.034 -6.213 1.00 0.00 H new ATOM 0 HD3 LYS A 749 2.111 12.743 -7.726 1.00 0.00 H new ATOM 0 HE2 LYS A 749 1.123 15.050 -7.587 1.00 0.00 H new ATOM 0 HE3 LYS A 749 2.046 15.332 -6.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 749 3.156 16.226 -8.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 749 4.080 14.972 -7.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 749 3.186 14.699 -8.788 1.00 0.00 H new ATOM 903 N LEU A 750 -2.807 10.901 -5.129 1.00 0.00 N ATOM 904 CA LEU A 750 -3.290 9.587 -5.075 1.00 0.00 C ATOM 905 C LEU A 750 -4.620 9.492 -5.759 1.00 0.00 C ATOM 906 O LEU A 750 -5.071 10.442 -6.398 1.00 0.00 O ATOM 907 CB LEU A 750 -3.340 9.048 -3.638 1.00 0.00 C ATOM 908 CG LEU A 750 -2.031 8.941 -3.025 1.00 0.00 C ATOM 909 CD1 LEU A 750 -2.112 8.307 -1.719 1.00 0.00 C ATOM 910 CD2 LEU A 750 -1.169 8.188 -3.882 1.00 0.00 C ATOM 0 H LEU A 750 -3.074 11.484 -4.336 1.00 0.00 H new ATOM 0 HA LEU A 750 -2.589 8.949 -5.612 1.00 0.00 H new ATOM 0 HB2 LEU A 750 -3.966 9.703 -3.032 1.00 0.00 H new ATOM 0 HB3 LEU A 750 -3.815 8.067 -3.641 1.00 0.00 H new ATOM 0 HG LEU A 750 -1.629 9.944 -2.885 1.00 0.00 H new ATOM 0 HD11 LEU A 750 -1.115 8.241 -1.284 1.00 0.00 H new ATOM 0 HD12 LEU A 750 -2.754 8.899 -1.066 1.00 0.00 H new ATOM 0 HD13 LEU A 750 -2.528 7.305 -1.826 1.00 0.00 H new ATOM 0 HD21 LEU A 750 -0.183 8.105 -3.425 1.00 0.00 H new ATOM 0 HD22 LEU A 750 -1.585 7.191 -4.032 1.00 0.00 H new ATOM 0 HD23 LEU A 750 -1.081 8.693 -4.844 1.00 0.00 H new ATOM 922 N LYS A 751 -5.249 8.388 -5.607 1.00 0.00 N ATOM 923 CA LYS A 751 -6.469 8.115 -6.240 1.00 0.00 C ATOM 924 C LYS A 751 -7.445 7.668 -5.215 1.00 0.00 C ATOM 925 O LYS A 751 -7.073 7.121 -4.167 1.00 0.00 O ATOM 926 CB LYS A 751 -6.307 7.022 -7.279 1.00 0.00 C ATOM 927 CG LYS A 751 -5.467 7.387 -8.492 1.00 0.00 C ATOM 928 CD LYS A 751 -5.300 6.197 -9.430 1.00 0.00 C ATOM 929 CE LYS A 751 -6.639 5.673 -9.921 1.00 0.00 C ATOM 930 NZ LYS A 751 -6.482 4.543 -10.852 1.00 0.00 N ATOM 0 H LYS A 751 -4.912 7.628 -5.017 1.00 0.00 H new ATOM 0 HA LYS A 751 -6.818 9.019 -6.740 1.00 0.00 H new ATOM 0 HB2 LYS A 751 -5.859 6.152 -6.798 1.00 0.00 H new ATOM 0 HB3 LYS A 751 -7.297 6.722 -7.622 1.00 0.00 H new ATOM 0 HG2 LYS A 751 -5.937 8.212 -9.028 1.00 0.00 H new ATOM 0 HG3 LYS A 751 -4.487 7.736 -8.166 1.00 0.00 H new ATOM 0 HD2 LYS A 751 -4.689 6.490 -10.284 1.00 0.00 H new ATOM 0 HD3 LYS A 751 -4.765 5.400 -8.914 1.00 0.00 H new ATOM 0 HE2 LYS A 751 -7.240 5.359 -9.068 1.00 0.00 H new ATOM 0 HE3 LYS A 751 -7.184 6.477 -10.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 751 -7.419 4.216 -11.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 751 -5.930 4.849 -11.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 751 -5.985 3.765 -10.373 1.00 0.00 H new ATOM 944 N LYS A 752 -8.635 7.882 -5.524 1.00 0.00 N ATOM 945 CA LYS A 752 -9.749 7.532 -4.746 1.00 0.00 C ATOM 946 C LYS A 752 -10.353 6.298 -5.286 1.00 0.00 C ATOM 947 O LYS A 752 -10.352 6.043 -6.490 1.00 0.00 O ATOM 948 CB LYS A 752 -10.811 8.625 -4.716 1.00 0.00 C ATOM 949 CG LYS A 752 -10.451 9.838 -3.907 1.00 0.00 C ATOM 950 CD LYS A 752 -11.569 10.844 -3.971 1.00 0.00 C ATOM 951 CE LYS A 752 -11.372 11.953 -2.974 1.00 0.00 C ATOM 952 NZ LYS A 752 -12.439 12.965 -3.082 1.00 0.00 N ATOM 0 H LYS A 752 -8.894 8.344 -6.396 1.00 0.00 H new ATOM 0 HA LYS A 752 -9.396 7.384 -3.726 1.00 0.00 H new ATOM 0 HB2 LYS A 752 -11.018 8.938 -5.739 1.00 0.00 H new ATOM 0 HB3 LYS A 752 -11.734 8.203 -4.319 1.00 0.00 H new ATOM 0 HG2 LYS A 752 -10.264 9.553 -2.871 1.00 0.00 H new ATOM 0 HG3 LYS A 752 -9.530 10.280 -4.287 1.00 0.00 H new ATOM 0 HD2 LYS A 752 -11.626 11.263 -4.976 1.00 0.00 H new ATOM 0 HD3 LYS A 752 -12.519 10.346 -3.779 1.00 0.00 H new ATOM 0 HE2 LYS A 752 -11.360 11.540 -1.965 1.00 0.00 H new ATOM 0 HE3 LYS A 752 -10.403 12.424 -3.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 752 -12.335 13.662 -2.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 752 -12.370 13.446 -4.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 752 -13.367 12.501 -3.003 1.00 0.00 H new ATOM 966 N CYS A 753 -10.834 5.573 -4.409 1.00 0.00 N ATOM 967 CA CYS A 753 -11.490 4.327 -4.661 1.00 0.00 C ATOM 968 C CYS A 753 -12.957 4.545 -4.893 1.00 0.00 C ATOM 969 O CYS A 753 -13.518 5.565 -4.500 1.00 0.00 O ATOM 970 CB CYS A 753 -11.299 3.376 -3.503 1.00 0.00 C ATOM 971 SG CYS A 753 -9.574 2.876 -3.242 1.00 0.00 S ATOM 0 H CYS A 753 -10.799 5.813 -3.418 1.00 0.00 H new ATOM 0 HA CYS A 753 -11.045 3.889 -5.554 1.00 0.00 H new ATOM 0 HB2 CYS A 753 -11.673 3.846 -2.593 1.00 0.00 H new ATOM 0 HB3 CYS A 753 -11.904 2.485 -3.673 1.00 0.00 H new ATOM 976 N LYS A 754 -13.569 3.597 -5.506 1.00 0.00 N ATOM 977 CA LYS A 754 -14.953 3.664 -5.830 1.00 0.00 C ATOM 978 C LYS A 754 -15.691 2.549 -5.142 1.00 0.00 C ATOM 979 O LYS A 754 -15.202 1.410 -5.082 1.00 0.00 O ATOM 980 CB LYS A 754 -15.095 3.578 -7.362 1.00 0.00 C ATOM 981 CG LYS A 754 -16.507 3.464 -7.938 1.00 0.00 C ATOM 982 CD LYS A 754 -17.395 4.642 -7.588 1.00 0.00 C ATOM 983 CE LYS A 754 -18.712 4.575 -8.354 1.00 0.00 C ATOM 984 NZ LYS A 754 -19.442 3.302 -8.141 1.00 0.00 N ATOM 0 H LYS A 754 -13.115 2.734 -5.804 1.00 0.00 H new ATOM 0 HA LYS A 754 -15.386 4.603 -5.486 1.00 0.00 H new ATOM 0 HB2 LYS A 754 -14.627 4.463 -7.793 1.00 0.00 H new ATOM 0 HB3 LYS A 754 -14.522 2.716 -7.704 1.00 0.00 H new ATOM 0 HG2 LYS A 754 -16.443 3.376 -9.023 1.00 0.00 H new ATOM 0 HG3 LYS A 754 -16.969 2.548 -7.570 1.00 0.00 H new ATOM 0 HD2 LYS A 754 -17.593 4.648 -6.516 1.00 0.00 H new ATOM 0 HD3 LYS A 754 -16.880 5.574 -7.822 1.00 0.00 H new ATOM 0 HE2 LYS A 754 -19.347 5.407 -8.048 1.00 0.00 H new ATOM 0 HE3 LYS A 754 -18.514 4.700 -9.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 -20.458 3.498 -8.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 -19.292 2.675 -8.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 -19.089 2.839 -7.279 1.00 0.00 H new ATOM 998 N SER A 755 -16.792 2.898 -4.534 1.00 0.00 N ATOM 999 CA SER A 755 -17.714 1.916 -4.000 1.00 0.00 C ATOM 1000 C SER A 755 -18.183 1.020 -5.155 1.00 0.00 C ATOM 1001 O SER A 755 -18.782 1.511 -6.121 1.00 0.00 O ATOM 1002 CB SER A 755 -18.924 2.640 -3.378 1.00 0.00 C ATOM 1003 OG SER A 755 -19.855 1.738 -2.813 1.00 0.00 O ATOM 0 H SER A 755 -17.080 3.866 -4.392 1.00 0.00 H new ATOM 0 HA SER A 755 -17.228 1.313 -3.233 1.00 0.00 H new ATOM 0 HB2 SER A 755 -18.576 3.330 -2.609 1.00 0.00 H new ATOM 0 HB3 SER A 755 -19.419 3.239 -4.143 1.00 0.00 H new ATOM 0 HG SER A 755 -20.604 2.239 -2.429 1.00 0.00 H new ATOM 1009 N SER A 756 -17.860 -0.249 -5.096 1.00 0.00 N ATOM 1010 CA SER A 756 -18.267 -1.160 -6.106 1.00 0.00 C ATOM 1011 C SER A 756 -19.736 -1.557 -5.868 1.00 0.00 C ATOM 1012 O SER A 756 -20.126 -1.888 -4.757 1.00 0.00 O ATOM 1013 CB SER A 756 -17.341 -2.353 -6.046 1.00 0.00 C ATOM 1014 OG SER A 756 -15.988 -1.930 -6.114 1.00 0.00 O ATOM 0 H SER A 756 -17.310 -0.666 -4.345 1.00 0.00 H new ATOM 0 HA SER A 756 -18.207 -0.715 -7.099 1.00 0.00 H new ATOM 0 HB2 SER A 756 -17.510 -2.907 -5.123 1.00 0.00 H new ATOM 0 HB3 SER A 756 -17.559 -3.033 -6.870 1.00 0.00 H new ATOM 0 HG SER A 756 -15.407 -2.710 -6.233 1.00 0.00 H new ATOM 1020 N ASN A 757 -20.514 -1.564 -6.920 1.00 0.00 N ATOM 1021 CA ASN A 757 -21.976 -1.787 -6.855 1.00 0.00 C ATOM 1022 C ASN A 757 -22.324 -3.256 -6.632 1.00 0.00 C ATOM 1023 O ASN A 757 -23.494 -3.657 -6.646 1.00 0.00 O ATOM 1024 CB ASN A 757 -22.630 -1.288 -8.145 1.00 0.00 C ATOM 1025 CG ASN A 757 -22.403 0.194 -8.387 1.00 0.00 C ATOM 1026 OD1 ASN A 757 -22.328 0.995 -7.449 1.00 0.00 O ATOM 1027 ND2 ASN A 757 -22.250 0.571 -9.630 1.00 0.00 N ATOM 0 H ASN A 757 -20.167 -1.415 -7.868 1.00 0.00 H new ATOM 0 HA ASN A 757 -22.359 -1.227 -6.001 1.00 0.00 H new ATOM 0 HB2 ASN A 757 -22.235 -1.854 -8.989 1.00 0.00 H new ATOM 0 HB3 ASN A 757 -23.701 -1.484 -8.103 1.00 0.00 H new ATOM 0 HD21 ASN A 757 -22.063 1.550 -9.847 1.00 0.00 H new ATOM 0 HD22 ASN A 757 -22.318 -0.114 -10.383 1.00 0.00 H new ATOM 1034 N LEU A 758 -21.312 -4.055 -6.447 1.00 0.00 N ATOM 1035 CA LEU A 758 -21.487 -5.465 -6.203 1.00 0.00 C ATOM 1036 C LEU A 758 -21.185 -5.789 -4.752 1.00 0.00 C ATOM 1037 O LEU A 758 -21.543 -6.852 -4.255 1.00 0.00 O ATOM 1038 CB LEU A 758 -20.610 -6.331 -7.132 1.00 0.00 C ATOM 1039 CG LEU A 758 -20.918 -6.282 -8.642 1.00 0.00 C ATOM 1040 CD1 LEU A 758 -20.471 -4.975 -9.289 1.00 0.00 C ATOM 1041 CD2 LEU A 758 -20.300 -7.466 -9.343 1.00 0.00 C ATOM 0 H LEU A 758 -20.339 -3.750 -6.460 1.00 0.00 H new ATOM 0 HA LEU A 758 -22.528 -5.703 -6.420 1.00 0.00 H new ATOM 0 HB2 LEU A 758 -19.571 -6.033 -6.990 1.00 0.00 H new ATOM 0 HB3 LEU A 758 -20.692 -7.367 -6.804 1.00 0.00 H new ATOM 0 HG LEU A 758 -22.002 -6.330 -8.751 1.00 0.00 H new ATOM 0 HD11 LEU A 758 -20.712 -4.994 -10.352 1.00 0.00 H new ATOM 0 HD12 LEU A 758 -20.986 -4.140 -8.815 1.00 0.00 H new ATOM 0 HD13 LEU A 758 -19.395 -4.856 -9.163 1.00 0.00 H new ATOM 0 HD21 LEU A 758 -20.526 -7.417 -10.408 1.00 0.00 H new ATOM 0 HD22 LEU A 758 -19.219 -7.450 -9.201 1.00 0.00 H new ATOM 0 HD23 LEU A 758 -20.707 -8.388 -8.928 1.00 0.00 H new ATOM 1053 N ILE A 759 -20.556 -4.866 -4.074 1.00 0.00 N ATOM 1054 CA ILE A 759 -20.189 -5.058 -2.711 1.00 0.00 C ATOM 1055 C ILE A 759 -20.932 -4.125 -1.812 1.00 0.00 C ATOM 1056 O ILE A 759 -21.354 -3.047 -2.221 1.00 0.00 O ATOM 1057 CB ILE A 759 -18.648 -5.015 -2.481 1.00 0.00 C ATOM 1058 CG1 ILE A 759 -18.002 -3.875 -3.218 1.00 0.00 C ATOM 1059 CG2 ILE A 759 -17.999 -6.299 -2.936 1.00 0.00 C ATOM 1060 CD1 ILE A 759 -18.015 -2.584 -2.492 1.00 0.00 C ATOM 0 H ILE A 759 -20.287 -3.961 -4.459 1.00 0.00 H new ATOM 0 HA ILE A 759 -20.490 -6.071 -2.444 1.00 0.00 H new ATOM 0 HB ILE A 759 -18.501 -4.878 -1.410 1.00 0.00 H new ATOM 0 HG12 ILE A 759 -16.969 -4.142 -3.439 1.00 0.00 H new ATOM 0 HG13 ILE A 759 -18.509 -3.744 -4.174 1.00 0.00 H new ATOM 0 HG21 ILE A 759 -16.924 -6.244 -2.765 1.00 0.00 H new ATOM 0 HG22 ILE A 759 -18.414 -7.135 -2.373 1.00 0.00 H new ATOM 0 HG23 ILE A 759 -18.190 -6.447 -3.999 1.00 0.00 H new ATOM 0 HD11 ILE A 759 -17.528 -1.820 -3.099 1.00 0.00 H new ATOM 0 HD12 ILE A 759 -19.045 -2.288 -2.294 1.00 0.00 H new ATOM 0 HD13 ILE A 759 -17.481 -2.692 -1.548 1.00 0.00 H new ATOM 1072 N ILE A 760 -21.126 -4.560 -0.624 1.00 0.00 N ATOM 1073 CA ILE A 760 -21.831 -3.800 0.366 1.00 0.00 C ATOM 1074 C ILE A 760 -20.820 -3.363 1.365 1.00 0.00 C ATOM 1075 O ILE A 760 -19.967 -4.151 1.767 1.00 0.00 O ATOM 1076 CB ILE A 760 -22.958 -4.615 1.103 1.00 0.00 C ATOM 1077 CG1 ILE A 760 -24.049 -5.143 0.147 1.00 0.00 C ATOM 1078 CG2 ILE A 760 -23.607 -3.778 2.200 1.00 0.00 C ATOM 1079 CD1 ILE A 760 -23.635 -6.303 -0.724 1.00 0.00 C ATOM 0 H ILE A 760 -20.798 -5.468 -0.295 1.00 0.00 H new ATOM 0 HA ILE A 760 -22.333 -2.969 -0.129 1.00 0.00 H new ATOM 0 HB ILE A 760 -22.461 -5.480 1.542 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -24.913 -5.445 0.739 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -24.373 -4.325 -0.496 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -24.382 -4.364 2.694 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -22.852 -3.486 2.930 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -24.051 -2.885 1.761 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -24.471 -6.599 -1.358 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -22.793 -6.006 -1.349 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -23.341 -7.144 -0.095 1.00 0.00 H new ATOM 1091 N LEU A 761 -20.877 -2.138 1.726 1.00 0.00 N ATOM 1092 CA LEU A 761 -19.946 -1.593 2.650 1.00 0.00 C ATOM 1093 C LEU A 761 -20.666 -1.316 3.916 1.00 0.00 C ATOM 1094 O LEU A 761 -21.901 -1.445 3.961 1.00 0.00 O ATOM 1095 CB LEU A 761 -19.333 -0.280 2.121 1.00 0.00 C ATOM 1096 CG LEU A 761 -18.618 -0.331 0.773 1.00 0.00 C ATOM 1097 CD1 LEU A 761 -17.642 -1.451 0.718 1.00 0.00 C ATOM 1098 CD2 LEU A 761 -19.601 -0.334 -0.384 1.00 0.00 C ATOM 0 H LEU A 761 -21.575 -1.475 1.389 1.00 0.00 H new ATOM 0 HA LEU A 761 -19.136 -2.306 2.802 1.00 0.00 H new ATOM 0 HB2 LEU A 761 -20.130 0.460 2.051 1.00 0.00 H new ATOM 0 HB3 LEU A 761 -18.624 0.084 2.865 1.00 0.00 H new ATOM 0 HG LEU A 761 -18.036 0.584 0.667 1.00 0.00 H new ATOM 0 HD11 LEU A 761 -17.151 -1.458 -0.255 1.00 0.00 H new ATOM 0 HD12 LEU A 761 -16.895 -1.321 1.501 1.00 0.00 H new ATOM 0 HD13 LEU A 761 -18.164 -2.396 0.868 1.00 0.00 H new ATOM 0 HD21 LEU A 761 -19.054 -0.371 -1.326 1.00 0.00 H new ATOM 0 HD22 LEU A 761 -20.251 -1.206 -0.307 1.00 0.00 H new ATOM 0 HD23 LEU A 761 -20.205 0.573 -0.350 1.00 0.00 H new ATOM 1110 N GLU A 762 -19.917 -0.960 4.945 1.00 0.00 N ATOM 1111 CA GLU A 762 -20.494 -0.547 6.210 1.00 0.00 C ATOM 1112 C GLU A 762 -21.451 0.591 5.934 1.00 0.00 C ATOM 1113 O GLU A 762 -21.235 1.344 5.014 1.00 0.00 O ATOM 1114 CB GLU A 762 -19.405 -0.062 7.152 1.00 0.00 C ATOM 1115 CG GLU A 762 -18.393 -1.109 7.536 1.00 0.00 C ATOM 1116 CD GLU A 762 -17.343 -0.558 8.459 1.00 0.00 C ATOM 1117 OE1 GLU A 762 -17.580 -0.500 9.692 1.00 0.00 O ATOM 1118 OE2 GLU A 762 -16.262 -0.179 7.978 1.00 0.00 O ATOM 0 H GLU A 762 -18.897 -0.949 4.927 1.00 0.00 H new ATOM 0 HA GLU A 762 -21.009 -1.388 6.675 1.00 0.00 H new ATOM 0 HB2 GLU A 762 -18.884 0.773 6.684 1.00 0.00 H new ATOM 0 HB3 GLU A 762 -19.872 0.322 8.059 1.00 0.00 H new ATOM 0 HG2 GLU A 762 -18.900 -1.944 8.019 1.00 0.00 H new ATOM 0 HG3 GLU A 762 -17.917 -1.502 6.637 1.00 0.00 H new ATOM 1125 N GLU A 763 -22.438 0.773 6.751 1.00 0.00 N ATOM 1126 CA GLU A 763 -23.486 1.760 6.491 1.00 0.00 C ATOM 1127 C GLU A 763 -22.966 3.205 6.625 1.00 0.00 C ATOM 1128 O GLU A 763 -23.689 4.150 6.383 1.00 0.00 O ATOM 1129 CB GLU A 763 -24.675 1.503 7.400 1.00 0.00 C ATOM 1130 CG GLU A 763 -25.205 0.084 7.273 1.00 0.00 C ATOM 1131 CD GLU A 763 -26.379 -0.184 8.157 1.00 0.00 C ATOM 1132 OE1 GLU A 763 -26.209 -0.267 9.387 1.00 0.00 O ATOM 1133 OE2 GLU A 763 -27.488 -0.345 7.654 1.00 0.00 O ATOM 0 H GLU A 763 -22.558 0.253 7.620 1.00 0.00 H new ATOM 0 HA GLU A 763 -23.810 1.648 5.456 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -24.385 1.689 8.434 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -25.471 2.208 7.161 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -25.488 -0.100 6.237 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -24.407 -0.618 7.515 1.00 0.00 H new ATOM 1140 N HIS A 764 -21.700 3.347 7.006 1.00 0.00 N ATOM 1141 CA HIS A 764 -21.042 4.661 7.029 1.00 0.00 C ATOM 1142 C HIS A 764 -20.565 4.918 5.610 1.00 0.00 C ATOM 1143 O HIS A 764 -20.636 6.014 5.072 1.00 0.00 O ATOM 1144 CB HIS A 764 -19.756 4.666 7.894 1.00 0.00 C ATOM 1145 CG HIS A 764 -19.755 3.838 9.140 1.00 0.00 C ATOM 1146 ND1 HIS A 764 -20.542 4.090 10.224 1.00 0.00 N ATOM 1147 CD2 HIS A 764 -19.020 2.752 9.452 1.00 0.00 C ATOM 1148 CE1 HIS A 764 -20.299 3.201 11.160 1.00 0.00 C ATOM 1149 NE2 HIS A 764 -19.377 2.375 10.717 1.00 0.00 N ATOM 0 H HIS A 764 -21.105 2.573 7.304 1.00 0.00 H new ATOM 0 HA HIS A 764 -21.747 5.392 7.426 1.00 0.00 H new ATOM 0 HB2 HIS A 764 -18.929 4.331 7.268 1.00 0.00 H new ATOM 0 HB3 HIS A 764 -19.545 5.698 8.176 1.00 0.00 H new ATOM 0 HD2 HIS A 764 -18.287 2.270 8.822 1.00 0.00 H new ATOM 0 HE1 HIS A 764 -20.775 3.156 12.128 1.00 0.00 H new ATOM 0 HE2 HIS A 764 -18.992 1.583 11.232 1.00 0.00 H new ATOM 1158 N LEU A 765 -20.121 3.840 5.008 1.00 0.00 N ATOM 1159 CA LEU A 765 -19.477 3.818 3.723 1.00 0.00 C ATOM 1160 C LEU A 765 -20.454 3.566 2.623 1.00 0.00 C ATOM 1161 O LEU A 765 -20.166 3.777 1.461 1.00 0.00 O ATOM 1162 CB LEU A 765 -18.537 2.689 3.701 1.00 0.00 C ATOM 1163 CG LEU A 765 -17.398 2.705 4.629 1.00 0.00 C ATOM 1164 CD1 LEU A 765 -16.687 1.493 4.449 1.00 0.00 C ATOM 1165 CD2 LEU A 765 -16.567 4.002 4.602 1.00 0.00 C ATOM 0 H LEU A 765 -20.205 2.912 5.424 1.00 0.00 H new ATOM 0 HA LEU A 765 -18.993 4.783 3.574 1.00 0.00 H new ATOM 0 HB2 LEU A 765 -19.107 1.780 3.892 1.00 0.00 H new ATOM 0 HB3 LEU A 765 -18.139 2.609 2.689 1.00 0.00 H new ATOM 0 HG LEU A 765 -17.751 2.738 5.660 1.00 0.00 H new ATOM 0 HD11 LEU A 765 -15.831 1.469 5.124 1.00 0.00 H new ATOM 0 HD12 LEU A 765 -17.344 0.650 4.666 1.00 0.00 H new ATOM 0 HD13 LEU A 765 -16.338 1.425 3.419 1.00 0.00 H new ATOM 0 HD21 LEU A 765 -15.748 3.925 5.318 1.00 0.00 H new ATOM 0 HD22 LEU A 765 -16.161 4.153 3.602 1.00 0.00 H new ATOM 0 HD23 LEU A 765 -17.202 4.847 4.868 1.00 0.00 H new ATOM 1177 N LYS A 766 -21.604 3.089 2.983 1.00 0.00 N ATOM 1178 CA LYS A 766 -22.614 2.782 2.111 1.00 0.00 C ATOM 1179 C LYS A 766 -23.313 4.081 1.621 1.00 0.00 C ATOM 1180 O LYS A 766 -24.278 4.057 0.852 1.00 0.00 O ATOM 1181 CB LYS A 766 -23.516 1.830 2.867 1.00 0.00 C ATOM 1182 CG LYS A 766 -24.400 1.145 1.985 1.00 0.00 C ATOM 1183 CD LYS A 766 -25.145 -0.025 2.627 1.00 0.00 C ATOM 1184 CE LYS A 766 -26.155 0.428 3.671 1.00 0.00 C ATOM 1185 NZ LYS A 766 -27.197 1.298 3.089 1.00 0.00 N ATOM 0 H LYS A 766 -21.843 2.905 3.957 1.00 0.00 H new ATOM 0 HA LYS A 766 -22.271 2.301 1.195 1.00 0.00 H new ATOM 0 HB2 LYS A 766 -22.910 1.107 3.412 1.00 0.00 H new ATOM 0 HB3 LYS A 766 -24.094 2.383 3.607 1.00 0.00 H new ATOM 0 HG2 LYS A 766 -25.129 1.855 1.596 1.00 0.00 H new ATOM 0 HG3 LYS A 766 -23.830 0.774 1.133 1.00 0.00 H new ATOM 0 HD2 LYS A 766 -25.659 -0.593 1.852 1.00 0.00 H new ATOM 0 HD3 LYS A 766 -24.425 -0.699 3.091 1.00 0.00 H new ATOM 0 HE2 LYS A 766 -26.623 -0.445 4.126 1.00 0.00 H new ATOM 0 HE3 LYS A 766 -25.638 0.964 4.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 766 -27.993 1.378 3.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 766 -26.800 2.242 2.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 766 -27.532 0.887 2.194 1.00 0.00 H new ATOM 1199 N ASN A 767 -22.785 5.199 2.088 1.00 0.00 N ATOM 1200 CA ASN A 767 -23.179 6.524 1.664 1.00 0.00 C ATOM 1201 C ASN A 767 -21.946 7.224 1.071 1.00 0.00 C ATOM 1202 O ASN A 767 -21.974 8.415 0.753 1.00 0.00 O ATOM 1203 CB ASN A 767 -23.725 7.335 2.853 1.00 0.00 C ATOM 1204 CG ASN A 767 -24.962 6.716 3.491 1.00 0.00 C ATOM 1205 OD1 ASN A 767 -24.860 5.890 4.396 1.00 0.00 O ATOM 1206 ND2 ASN A 767 -26.129 7.104 3.043 1.00 0.00 N ATOM 0 H ASN A 767 -22.049 5.206 2.794 1.00 0.00 H new ATOM 0 HA ASN A 767 -23.970 6.452 0.917 1.00 0.00 H new ATOM 0 HB2 ASN A 767 -22.944 7.429 3.608 1.00 0.00 H new ATOM 0 HB3 ASN A 767 -23.965 8.343 2.516 1.00 0.00 H new ATOM 0 HD21 ASN A 767 -26.984 6.719 3.446 1.00 0.00 H new ATOM 0 HD22 ASN A 767 -26.184 7.791 2.291 1.00 0.00 H new ATOM 1213 N LYS A 768 -20.875 6.457 0.886 1.00 0.00 N ATOM 1214 CA LYS A 768 -19.627 6.931 0.356 1.00 0.00 C ATOM 1215 C LYS A 768 -19.601 6.462 -1.075 1.00 0.00 C ATOM 1216 O LYS A 768 -19.895 5.302 -1.350 1.00 0.00 O ATOM 1217 CB LYS A 768 -18.444 6.263 1.105 1.00 0.00 C ATOM 1218 CG LYS A 768 -17.074 6.832 0.794 1.00 0.00 C ATOM 1219 CD LYS A 768 -16.721 8.040 1.650 1.00 0.00 C ATOM 1220 CE LYS A 768 -16.515 7.639 3.109 1.00 0.00 C ATOM 1221 NZ LYS A 768 -16.078 8.782 3.942 1.00 0.00 N ATOM 0 H LYS A 768 -20.865 5.462 1.111 1.00 0.00 H new ATOM 0 HA LYS A 768 -19.537 8.013 0.455 1.00 0.00 H new ATOM 0 HB2 LYS A 768 -18.620 6.349 2.177 1.00 0.00 H new ATOM 0 HB3 LYS A 768 -18.440 5.199 0.867 1.00 0.00 H new ATOM 0 HG2 LYS A 768 -16.323 6.057 0.943 1.00 0.00 H new ATOM 0 HG3 LYS A 768 -17.035 7.116 -0.258 1.00 0.00 H new ATOM 0 HD2 LYS A 768 -15.814 8.508 1.267 1.00 0.00 H new ATOM 0 HD3 LYS A 768 -17.516 8.782 1.583 1.00 0.00 H new ATOM 0 HE2 LYS A 768 -17.445 7.234 3.508 1.00 0.00 H new ATOM 0 HE3 LYS A 768 -15.771 6.844 3.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 768 -15.950 8.466 4.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 768 -15.178 9.153 3.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 768 -16.799 9.531 3.910 1.00 0.00 H new ATOM 1235 N LYS A 769 -19.323 7.327 -1.970 1.00 0.00 N ATOM 1236 CA LYS A 769 -19.252 6.960 -3.359 1.00 0.00 C ATOM 1237 C LYS A 769 -17.807 6.682 -3.698 1.00 0.00 C ATOM 1238 O LYS A 769 -17.461 5.719 -4.404 1.00 0.00 O ATOM 1239 CB LYS A 769 -19.790 8.111 -4.203 1.00 0.00 C ATOM 1240 CG LYS A 769 -19.714 7.895 -5.702 1.00 0.00 C ATOM 1241 CD LYS A 769 -20.238 9.109 -6.451 1.00 0.00 C ATOM 1242 CE LYS A 769 -19.428 10.359 -6.122 1.00 0.00 C ATOM 1243 NZ LYS A 769 -19.959 11.553 -6.804 1.00 0.00 N ATOM 0 H LYS A 769 -19.136 8.311 -1.779 1.00 0.00 H new ATOM 0 HA LYS A 769 -19.849 6.071 -3.561 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -20.830 8.288 -3.929 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -19.236 9.016 -3.953 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -18.682 7.700 -5.994 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -20.295 7.014 -5.977 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -20.200 8.921 -7.524 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -21.284 9.273 -6.193 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -19.435 10.523 -5.044 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -18.389 10.206 -6.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -19.381 12.381 -6.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -19.929 11.407 -7.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -20.942 11.715 -6.506 1.00 0.00 H new ATOM 1257 N GLU A 770 -16.984 7.487 -3.119 1.00 0.00 N ATOM 1258 CA GLU A 770 -15.592 7.489 -3.335 1.00 0.00 C ATOM 1259 C GLU A 770 -14.885 7.455 -2.037 1.00 0.00 C ATOM 1260 O GLU A 770 -15.134 8.267 -1.145 1.00 0.00 O ATOM 1261 CB GLU A 770 -15.187 8.713 -4.093 1.00 0.00 C ATOM 1262 CG GLU A 770 -16.037 9.910 -3.772 1.00 0.00 C ATOM 1263 CD GLU A 770 -15.589 11.179 -4.424 1.00 0.00 C ATOM 1264 OE1 GLU A 770 -14.774 11.905 -3.831 1.00 0.00 O ATOM 1265 OE2 GLU A 770 -16.083 11.502 -5.525 1.00 0.00 O ATOM 0 H GLU A 770 -17.287 8.194 -2.450 1.00 0.00 H new ATOM 0 HA GLU A 770 -15.326 6.607 -3.918 1.00 0.00 H new ATOM 0 HB2 GLU A 770 -14.145 8.944 -3.870 1.00 0.00 H new ATOM 0 HB3 GLU A 770 -15.246 8.508 -5.162 1.00 0.00 H new ATOM 0 HG2 GLU A 770 -17.063 9.703 -4.075 1.00 0.00 H new ATOM 0 HG3 GLU A 770 -16.046 10.055 -2.692 1.00 0.00 H new ATOM 1272 N PHE A 771 -14.003 6.569 -1.951 1.00 0.00 N ATOM 1273 CA PHE A 771 -13.257 6.348 -0.751 1.00 0.00 C ATOM 1274 C PHE A 771 -11.879 6.885 -0.960 1.00 0.00 C ATOM 1275 O PHE A 771 -11.324 6.771 -2.047 1.00 0.00 O ATOM 1276 CB PHE A 771 -13.185 4.867 -0.402 1.00 0.00 C ATOM 1277 CG PHE A 771 -14.512 4.188 -0.138 1.00 0.00 C ATOM 1278 CD1 PHE A 771 -15.310 3.767 -1.184 1.00 0.00 C ATOM 1279 CD2 PHE A 771 -14.936 3.938 1.157 1.00 0.00 C ATOM 1280 CE1 PHE A 771 -16.499 3.121 -0.948 1.00 0.00 C ATOM 1281 CE2 PHE A 771 -16.134 3.280 1.396 1.00 0.00 C ATOM 1282 CZ PHE A 771 -16.912 2.875 0.338 1.00 0.00 C ATOM 0 H PHE A 771 -13.752 5.946 -2.718 1.00 0.00 H new ATOM 0 HA PHE A 771 -13.752 6.854 0.078 1.00 0.00 H new ATOM 0 HB2 PHE A 771 -12.687 4.344 -1.218 1.00 0.00 H new ATOM 0 HB3 PHE A 771 -12.557 4.751 0.481 1.00 0.00 H new ATOM 0 HD1 PHE A 771 -14.995 3.948 -2.201 1.00 0.00 H new ATOM 0 HD2 PHE A 771 -14.327 4.259 1.990 1.00 0.00 H new ATOM 0 HE1 PHE A 771 -17.112 2.805 -1.779 1.00 0.00 H new ATOM 0 HE2 PHE A 771 -16.454 3.087 2.409 1.00 0.00 H new ATOM 0 HZ PHE A 771 -17.846 2.364 0.518 1.00 0.00 H new ATOM 1292 N ASP A 772 -11.335 7.455 0.040 1.00 0.00 N ATOM 1293 CA ASP A 772 -10.040 8.059 -0.067 1.00 0.00 C ATOM 1294 C ASP A 772 -8.996 7.012 0.320 1.00 0.00 C ATOM 1295 O ASP A 772 -9.333 6.031 0.980 1.00 0.00 O ATOM 1296 CB ASP A 772 -9.986 9.276 0.859 1.00 0.00 C ATOM 1297 CG ASP A 772 -8.903 10.257 0.496 1.00 0.00 C ATOM 1298 OD1 ASP A 772 -7.771 10.106 0.956 1.00 0.00 O ATOM 1299 OD2 ASP A 772 -9.186 11.232 -0.250 1.00 0.00 O ATOM 0 H ASP A 772 -11.762 7.525 0.964 1.00 0.00 H new ATOM 0 HA ASP A 772 -9.838 8.398 -1.083 1.00 0.00 H new ATOM 0 HB2 ASP A 772 -10.950 9.785 0.834 1.00 0.00 H new ATOM 0 HB3 ASP A 772 -9.830 8.937 1.883 1.00 0.00 H new ATOM 1304 N HIS A 773 -7.771 7.161 -0.159 1.00 0.00 N ATOM 1305 CA HIS A 773 -6.659 6.260 0.141 1.00 0.00 C ATOM 1306 C HIS A 773 -6.529 6.001 1.664 1.00 0.00 C ATOM 1307 O HIS A 773 -6.915 6.843 2.477 1.00 0.00 O ATOM 1308 CB HIS A 773 -5.342 6.893 -0.371 1.00 0.00 C ATOM 1309 CG HIS A 773 -4.740 7.933 0.568 1.00 0.00 C ATOM 1310 ND1 HIS A 773 -5.450 8.973 1.120 1.00 0.00 N ATOM 1311 CD2 HIS A 773 -3.533 7.978 1.144 1.00 0.00 C ATOM 1312 CE1 HIS A 773 -4.716 9.587 1.997 1.00 0.00 C ATOM 1313 NE2 HIS A 773 -3.543 9.002 2.042 1.00 0.00 N ATOM 0 H HIS A 773 -7.512 7.927 -0.781 1.00 0.00 H new ATOM 0 HA HIS A 773 -6.852 5.308 -0.354 1.00 0.00 H new ATOM 0 HB2 HIS A 773 -4.611 6.101 -0.534 1.00 0.00 H new ATOM 0 HB3 HIS A 773 -5.528 7.359 -1.339 1.00 0.00 H new ATOM 0 HD1 HIS A 773 -6.408 9.224 0.877 1.00 0.00 H new ATOM 0 HD2 HIS A 773 -2.702 7.321 0.935 1.00 0.00 H new ATOM 0 HE1 HIS A 773 -5.020 10.437 2.590 1.00 0.00 H new ATOM 1322 N ASN A 774 -5.997 4.835 2.020 1.00 0.00 N ATOM 1323 CA ASN A 774 -5.681 4.468 3.422 1.00 0.00 C ATOM 1324 C ASN A 774 -6.950 4.302 4.253 1.00 0.00 C ATOM 1325 O ASN A 774 -6.898 4.034 5.451 1.00 0.00 O ATOM 1326 CB ASN A 774 -4.736 5.529 4.039 1.00 0.00 C ATOM 1327 CG ASN A 774 -4.162 5.221 5.428 1.00 0.00 C ATOM 1328 OD1 ASN A 774 -3.901 6.142 6.200 1.00 0.00 O ATOM 1329 ND2 ASN A 774 -3.912 3.968 5.741 1.00 0.00 N ATOM 0 H ASN A 774 -5.766 4.103 1.348 1.00 0.00 H new ATOM 0 HA ASN A 774 -5.172 3.504 3.425 1.00 0.00 H new ATOM 0 HB2 ASN A 774 -3.903 5.681 3.353 1.00 0.00 H new ATOM 0 HB3 ASN A 774 -5.277 6.473 4.097 1.00 0.00 H new ATOM 0 HD21 ASN A 774 -3.492 3.742 6.642 1.00 0.00 H new ATOM 0 HD22 ASN A 774 -4.138 3.223 5.082 1.00 0.00 H new ATOM 1336 N SER A 775 -8.086 4.401 3.612 1.00 0.00 N ATOM 1337 CA SER A 775 -9.301 4.304 4.302 1.00 0.00 C ATOM 1338 C SER A 775 -9.592 2.835 4.507 1.00 0.00 C ATOM 1339 O SER A 775 -9.756 2.080 3.538 1.00 0.00 O ATOM 1340 CB SER A 775 -10.432 5.005 3.533 1.00 0.00 C ATOM 1341 OG SER A 775 -11.580 5.220 4.342 1.00 0.00 O ATOM 0 H SER A 775 -8.172 4.550 2.607 1.00 0.00 H new ATOM 0 HA SER A 775 -9.232 4.806 5.267 1.00 0.00 H new ATOM 0 HB2 SER A 775 -10.072 5.962 3.154 1.00 0.00 H new ATOM 0 HB3 SER A 775 -10.708 4.403 2.667 1.00 0.00 H new ATOM 0 HG SER A 775 -12.273 5.669 3.814 1.00 0.00 H new ATOM 1347 N ASN A 776 -9.532 2.419 5.742 1.00 0.00 N ATOM 1348 CA ASN A 776 -9.821 1.057 6.103 1.00 0.00 C ATOM 1349 C ASN A 776 -11.307 0.904 6.206 1.00 0.00 C ATOM 1350 O ASN A 776 -11.955 1.509 7.073 1.00 0.00 O ATOM 1351 CB ASN A 776 -9.152 0.655 7.431 1.00 0.00 C ATOM 1352 CG ASN A 776 -7.630 0.531 7.367 1.00 0.00 C ATOM 1353 OD1 ASN A 776 -6.977 1.358 6.581 1.00 0.00 O flip ATOM 1354 ND2 ASN A 776 -7.046 -0.289 8.068 1.00 0.00 N flip ATOM 0 H ASN A 776 -9.281 3.016 6.530 1.00 0.00 H new ATOM 0 HA ASN A 776 -9.417 0.397 5.335 1.00 0.00 H new ATOM 0 HB2 ASN A 776 -9.411 1.392 8.191 1.00 0.00 H new ATOM 0 HB3 ASN A 776 -9.567 -0.298 7.757 1.00 0.00 H new ATOM 0 HD21 ASN A 776 -7.579 -0.918 8.668 1.00 0.00 H new ATOM 0 HD22 ASN A 776 -6.028 -0.342 8.051 1.00 0.00 H new ATOM 1361 N ILE A 777 -11.853 0.155 5.322 1.00 0.00 N ATOM 1362 CA ILE A 777 -13.265 -0.033 5.257 1.00 0.00 C ATOM 1363 C ILE A 777 -13.586 -1.500 5.343 1.00 0.00 C ATOM 1364 O ILE A 777 -12.687 -2.355 5.343 1.00 0.00 O ATOM 1365 CB ILE A 777 -13.837 0.478 3.931 1.00 0.00 C ATOM 1366 CG1 ILE A 777 -13.321 -0.294 2.735 1.00 0.00 C ATOM 1367 CG2 ILE A 777 -13.627 1.983 3.780 1.00 0.00 C ATOM 1368 CD1 ILE A 777 -14.364 -0.433 1.649 1.00 0.00 C ATOM 0 H ILE A 777 -11.330 -0.355 4.610 1.00 0.00 H new ATOM 0 HA ILE A 777 -13.704 0.521 6.087 1.00 0.00 H new ATOM 0 HB ILE A 777 -14.912 0.299 3.960 1.00 0.00 H new ATOM 0 HG12 ILE A 777 -12.443 0.211 2.331 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -12.999 -1.285 3.056 1.00 0.00 H new ATOM 0 HG21 ILE A 777 -14.044 2.315 2.829 1.00 0.00 H new ATOM 0 HG22 ILE A 777 -14.127 2.504 4.597 1.00 0.00 H new ATOM 0 HG23 ILE A 777 -12.560 2.206 3.806 1.00 0.00 H new ATOM 0 HD11 ILE A 777 -13.946 -0.994 0.813 1.00 0.00 H new ATOM 0 HD12 ILE A 777 -15.232 -0.962 2.043 1.00 0.00 H new ATOM 0 HD13 ILE A 777 -14.667 0.557 1.307 1.00 0.00 H new ATOM 1380 N ARG A 778 -14.838 -1.812 5.413 1.00 0.00 N ATOM 1381 CA ARG A 778 -15.259 -3.169 5.391 1.00 0.00 C ATOM 1382 C ARG A 778 -16.263 -3.331 4.302 1.00 0.00 C ATOM 1383 O ARG A 778 -17.199 -2.540 4.194 1.00 0.00 O ATOM 1384 CB ARG A 778 -15.887 -3.586 6.711 1.00 0.00 C ATOM 1385 CG ARG A 778 -15.035 -3.330 7.922 1.00 0.00 C ATOM 1386 CD ARG A 778 -15.754 -3.742 9.181 1.00 0.00 C ATOM 1387 NE ARG A 778 -15.007 -3.369 10.382 1.00 0.00 N ATOM 1388 CZ ARG A 778 -15.493 -3.413 11.633 1.00 0.00 C ATOM 1389 NH1 ARG A 778 -16.758 -3.745 11.850 1.00 0.00 N ATOM 1390 NH2 ARG A 778 -14.706 -3.094 12.657 1.00 0.00 N ATOM 0 H ARG A 778 -15.595 -1.133 5.487 1.00 0.00 H new ATOM 0 HA ARG A 778 -14.386 -3.800 5.222 1.00 0.00 H new ATOM 0 HB2 ARG A 778 -16.832 -3.057 6.831 1.00 0.00 H new ATOM 0 HB3 ARG A 778 -16.120 -4.650 6.666 1.00 0.00 H new ATOM 0 HG2 ARG A 778 -14.099 -3.881 7.836 1.00 0.00 H new ATOM 0 HG3 ARG A 778 -14.779 -2.272 7.974 1.00 0.00 H new ATOM 0 HD2 ARG A 778 -16.739 -3.275 9.206 1.00 0.00 H new ATOM 0 HD3 ARG A 778 -15.913 -4.820 9.172 1.00 0.00 H new ATOM 0 HE ARG A 778 -14.045 -3.052 10.260 1.00 0.00 H new ATOM 0 HH11 ARG A 778 -17.368 -3.969 11.064 1.00 0.00 H new ATOM 0 HH12 ARG A 778 -17.121 -3.777 12.803 1.00 0.00 H new ATOM 0 HH21 ARG A 778 -13.738 -2.818 12.490 1.00 0.00 H new ATOM 0 HH22 ARG A 778 -15.070 -3.126 13.609 1.00 0.00 H new ATOM 1404 N TYR A 779 -16.043 -4.298 3.473 1.00 0.00 N ATOM 1405 CA TYR A 779 -16.986 -4.634 2.460 1.00 0.00 C ATOM 1406 C TYR A 779 -17.389 -6.044 2.704 1.00 0.00 C ATOM 1407 O TYR A 779 -16.724 -6.763 3.485 1.00 0.00 O ATOM 1408 CB TYR A 779 -16.386 -4.517 1.037 1.00 0.00 C ATOM 1409 CG TYR A 779 -15.472 -5.652 0.632 1.00 0.00 C ATOM 1410 CD1 TYR A 779 -14.248 -5.852 1.240 1.00 0.00 C ATOM 1411 CD2 TYR A 779 -15.856 -6.526 -0.364 1.00 0.00 C ATOM 1412 CE1 TYR A 779 -13.430 -6.889 0.865 1.00 0.00 C ATOM 1413 CE2 TYR A 779 -15.056 -7.570 -0.744 1.00 0.00 C ATOM 1414 CZ TYR A 779 -13.830 -7.752 -0.124 1.00 0.00 C ATOM 1415 OH TYR A 779 -13.010 -8.806 -0.473 1.00 0.00 O ATOM 0 H TYR A 779 -15.203 -4.877 3.480 1.00 0.00 H new ATOM 0 HA TYR A 779 -17.829 -3.944 2.507 1.00 0.00 H new ATOM 0 HB2 TYR A 779 -17.203 -4.455 0.319 1.00 0.00 H new ATOM 0 HB3 TYR A 779 -15.831 -3.582 0.969 1.00 0.00 H new ATOM 0 HD1 TYR A 779 -13.929 -5.181 2.024 1.00 0.00 H new ATOM 0 HD2 TYR A 779 -16.808 -6.384 -0.854 1.00 0.00 H new ATOM 0 HE1 TYR A 779 -12.473 -7.025 1.348 1.00 0.00 H new ATOM 0 HE2 TYR A 779 -15.378 -8.247 -1.521 1.00 0.00 H new ATOM 0 HH TYR A 779 -13.433 -9.327 -1.187 1.00 0.00 H new ATOM 1425 N ARG A 780 -18.405 -6.431 2.053 1.00 0.00 N ATOM 1426 CA ARG A 780 -18.902 -7.743 2.098 1.00 0.00 C ATOM 1427 C ARG A 780 -19.483 -8.023 0.754 1.00 0.00 C ATOM 1428 O ARG A 780 -19.833 -7.081 0.010 1.00 0.00 O ATOM 1429 CB ARG A 780 -19.948 -7.919 3.190 1.00 0.00 C ATOM 1430 CG ARG A 780 -21.255 -7.230 2.919 1.00 0.00 C ATOM 1431 CD ARG A 780 -22.258 -7.529 4.001 1.00 0.00 C ATOM 1432 NE ARG A 780 -23.528 -6.827 3.800 1.00 0.00 N ATOM 1433 CZ ARG A 780 -24.410 -6.566 4.779 1.00 0.00 C ATOM 1434 NH1 ARG A 780 -24.276 -7.139 5.968 1.00 0.00 N ATOM 1435 NH2 ARG A 780 -25.467 -5.805 4.534 1.00 0.00 N ATOM 0 H ARG A 780 -18.941 -5.814 1.443 1.00 0.00 H new ATOM 0 HA ARG A 780 -18.101 -8.442 2.338 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -20.135 -8.984 3.328 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -19.541 -7.543 4.129 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -21.096 -6.154 2.853 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -21.648 -7.554 1.955 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -22.442 -8.603 4.035 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -21.840 -7.247 4.967 1.00 0.00 H new ATOM 0 HE ARG A 780 -23.757 -6.516 2.856 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -23.502 -7.780 6.141 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -24.947 -6.939 6.709 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -25.611 -5.417 3.602 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -26.136 -5.607 5.278 1.00 0.00 H new ATOM 1449 N CYS A 781 -19.577 -9.246 0.425 1.00 0.00 N ATOM 1450 CA CYS A 781 -20.071 -9.626 -0.833 1.00 0.00 C ATOM 1451 C CYS A 781 -21.542 -9.884 -0.721 1.00 0.00 C ATOM 1452 O CYS A 781 -22.017 -10.392 0.306 1.00 0.00 O ATOM 1453 CB CYS A 781 -19.392 -10.882 -1.302 1.00 0.00 C ATOM 1454 SG CYS A 781 -19.696 -11.252 -3.054 1.00 0.00 S ATOM 0 H CYS A 781 -19.310 -10.024 1.029 1.00 0.00 H new ATOM 0 HA CYS A 781 -19.877 -8.826 -1.548 1.00 0.00 H new ATOM 0 HB2 CYS A 781 -18.318 -10.789 -1.138 1.00 0.00 H new ATOM 0 HB3 CYS A 781 -19.735 -11.720 -0.696 1.00 0.00 H new ATOM 0 HG CYS A 781 -18.674 -11.885 -3.547 1.00 0.00 H new ATOM 1459 N ARG A 782 -22.253 -9.595 -1.780 1.00 0.00 N ATOM 1460 CA ARG A 782 -23.694 -9.788 -1.825 1.00 0.00 C ATOM 1461 C ARG A 782 -24.045 -11.263 -1.939 1.00 0.00 C ATOM 1462 O ARG A 782 -25.194 -11.651 -1.770 1.00 0.00 O ATOM 1463 CB ARG A 782 -24.319 -8.964 -2.961 1.00 0.00 C ATOM 1464 CG ARG A 782 -23.798 -9.281 -4.351 1.00 0.00 C ATOM 1465 CD ARG A 782 -24.231 -8.217 -5.347 1.00 0.00 C ATOM 1466 NE ARG A 782 -25.690 -8.115 -5.496 1.00 0.00 N ATOM 1467 CZ ARG A 782 -26.365 -6.973 -5.758 1.00 0.00 C ATOM 1468 NH1 ARG A 782 -25.715 -5.805 -5.820 1.00 0.00 N ATOM 1469 NH2 ARG A 782 -27.688 -7.009 -5.941 1.00 0.00 N ATOM 0 H ARG A 782 -21.856 -9.218 -2.641 1.00 0.00 H new ATOM 0 HA ARG A 782 -24.117 -9.428 -0.887 1.00 0.00 H new ATOM 0 HB2 ARG A 782 -25.398 -9.120 -2.950 1.00 0.00 H new ATOM 0 HB3 ARG A 782 -24.148 -7.907 -2.758 1.00 0.00 H new ATOM 0 HG2 ARG A 782 -22.710 -9.345 -4.330 1.00 0.00 H new ATOM 0 HG3 ARG A 782 -24.168 -10.255 -4.669 1.00 0.00 H new ATOM 0 HD2 ARG A 782 -23.837 -7.251 -5.030 1.00 0.00 H new ATOM 0 HD3 ARG A 782 -23.789 -8.438 -6.318 1.00 0.00 H new ATOM 0 HE ARG A 782 -26.235 -8.971 -5.394 1.00 0.00 H new ATOM 0 HH11 ARG A 782 -24.707 -5.774 -5.669 1.00 0.00 H new ATOM 0 HH12 ARG A 782 -26.228 -4.946 -6.018 1.00 0.00 H new ATOM 0 HH21 ARG A 782 -28.187 -7.897 -5.883 1.00 0.00 H new ATOM 0 HH22 ARG A 782 -28.199 -6.149 -6.139 1.00 0.00 H new ATOM 1483 N GLY A 783 -23.045 -12.077 -2.231 1.00 0.00 N ATOM 1484 CA GLY A 783 -23.260 -13.489 -2.319 1.00 0.00 C ATOM 1485 C GLY A 783 -22.560 -14.256 -1.232 1.00 0.00 C ATOM 1486 O GLY A 783 -22.629 -15.483 -1.196 1.00 0.00 O ATOM 0 H GLY A 783 -22.087 -11.776 -2.408 1.00 0.00 H new ATOM 0 HA2 GLY A 783 -24.330 -13.692 -2.269 1.00 0.00 H new ATOM 0 HA3 GLY A 783 -22.913 -13.845 -3.289 1.00 0.00 H new ATOM 1490 N LYS A 784 -21.866 -13.559 -0.348 1.00 0.00 N ATOM 1491 CA LYS A 784 -21.167 -14.241 0.727 1.00 0.00 C ATOM 1492 C LYS A 784 -21.662 -13.849 2.111 1.00 0.00 C ATOM 1493 O LYS A 784 -21.987 -14.732 2.912 1.00 0.00 O ATOM 1494 CB LYS A 784 -19.647 -14.071 0.647 1.00 0.00 C ATOM 1495 CG LYS A 784 -18.918 -14.919 -0.399 1.00 0.00 C ATOM 1496 CD LYS A 784 -19.231 -14.522 -1.829 1.00 0.00 C ATOM 1497 CE LYS A 784 -18.469 -15.382 -2.825 1.00 0.00 C ATOM 1498 NZ LYS A 784 -17.003 -15.270 -2.684 1.00 0.00 N ATOM 0 H LYS A 784 -21.772 -12.543 -0.351 1.00 0.00 H new ATOM 0 HA LYS A 784 -21.401 -15.295 0.579 1.00 0.00 H new ATOM 0 HB2 LYS A 784 -19.431 -13.022 0.446 1.00 0.00 H new ATOM 0 HB3 LYS A 784 -19.226 -14.301 1.626 1.00 0.00 H new ATOM 0 HG2 LYS A 784 -17.843 -14.838 -0.235 1.00 0.00 H new ATOM 0 HG3 LYS A 784 -19.184 -15.966 -0.255 1.00 0.00 H new ATOM 0 HD2 LYS A 784 -20.302 -14.618 -2.008 1.00 0.00 H new ATOM 0 HD3 LYS A 784 -18.975 -13.473 -1.981 1.00 0.00 H new ATOM 0 HE2 LYS A 784 -18.762 -16.424 -2.695 1.00 0.00 H new ATOM 0 HE3 LYS A 784 -18.754 -15.094 -3.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 784 -16.541 -15.694 -3.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 784 -16.737 -14.267 -2.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 784 -16.698 -15.770 -1.824 1.00 0.00 H new ATOM 1512 N GLU A 785 -21.737 -12.536 2.371 1.00 0.00 N ATOM 1513 CA GLU A 785 -22.076 -11.968 3.692 1.00 0.00 C ATOM 1514 C GLU A 785 -20.901 -12.143 4.682 1.00 0.00 C ATOM 1515 O GLU A 785 -20.239 -13.187 4.728 1.00 0.00 O ATOM 1516 CB GLU A 785 -23.412 -12.517 4.251 1.00 0.00 C ATOM 1517 CG GLU A 785 -23.802 -12.011 5.639 1.00 0.00 C ATOM 1518 CD GLU A 785 -23.982 -10.510 5.716 1.00 0.00 C ATOM 1519 OE1 GLU A 785 -22.990 -9.782 5.982 1.00 0.00 O ATOM 1520 OE2 GLU A 785 -25.122 -10.030 5.559 1.00 0.00 O ATOM 0 H GLU A 785 -21.562 -11.825 1.661 1.00 0.00 H new ATOM 0 HA GLU A 785 -22.235 -10.898 3.558 1.00 0.00 H new ATOM 0 HB2 GLU A 785 -24.210 -12.262 3.553 1.00 0.00 H new ATOM 0 HB3 GLU A 785 -23.352 -13.605 4.284 1.00 0.00 H new ATOM 0 HG2 GLU A 785 -24.730 -12.495 5.944 1.00 0.00 H new ATOM 0 HG3 GLU A 785 -23.036 -12.312 6.353 1.00 0.00 H new ATOM 1527 N GLY A 786 -20.676 -11.131 5.472 1.00 0.00 N ATOM 1528 CA GLY A 786 -19.546 -11.086 6.360 1.00 0.00 C ATOM 1529 C GLY A 786 -18.498 -10.184 5.797 1.00 0.00 C ATOM 1530 O GLY A 786 -18.259 -10.184 4.591 1.00 0.00 O ATOM 0 H GLY A 786 -21.276 -10.307 5.519 1.00 0.00 H new ATOM 0 HA2 GLY A 786 -19.857 -10.729 7.342 1.00 0.00 H new ATOM 0 HA3 GLY A 786 -19.140 -12.088 6.499 1.00 0.00 H new ATOM 1534 N TRP A 787 -17.872 -9.435 6.636 1.00 0.00 N ATOM 1535 CA TRP A 787 -16.969 -8.406 6.191 1.00 0.00 C ATOM 1536 C TRP A 787 -15.561 -8.936 6.040 1.00 0.00 C ATOM 1537 O TRP A 787 -15.120 -9.788 6.805 1.00 0.00 O ATOM 1538 CB TRP A 787 -16.998 -7.237 7.149 1.00 0.00 C ATOM 1539 CG TRP A 787 -18.387 -6.802 7.506 1.00 0.00 C ATOM 1540 CD1 TRP A 787 -19.122 -7.242 8.565 1.00 0.00 C ATOM 1541 CD2 TRP A 787 -19.220 -5.878 6.799 1.00 0.00 C ATOM 1542 NE1 TRP A 787 -20.334 -6.615 8.586 1.00 0.00 N ATOM 1543 CE2 TRP A 787 -20.429 -5.784 7.509 1.00 0.00 C ATOM 1544 CE3 TRP A 787 -19.060 -5.114 5.645 1.00 0.00 C ATOM 1545 CZ2 TRP A 787 -21.471 -4.964 7.105 1.00 0.00 C ATOM 1546 CZ3 TRP A 787 -20.094 -4.305 5.247 1.00 0.00 C ATOM 1547 CH2 TRP A 787 -21.286 -4.234 5.973 1.00 0.00 C ATOM 0 H TRP A 787 -17.964 -9.510 7.649 1.00 0.00 H new ATOM 0 HA TRP A 787 -17.300 -8.066 5.210 1.00 0.00 H new ATOM 0 HB2 TRP A 787 -16.464 -7.508 8.060 1.00 0.00 H new ATOM 0 HB3 TRP A 787 -16.464 -6.397 6.704 1.00 0.00 H new ATOM 0 HD1 TRP A 787 -18.794 -7.979 9.283 1.00 0.00 H new ATOM 0 HE1 TRP A 787 -21.055 -6.747 9.295 1.00 0.00 H new ATOM 0 HE3 TRP A 787 -18.143 -5.158 5.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 787 -22.392 -4.907 7.666 1.00 0.00 H new ATOM 0 HZ3 TRP A 787 -19.984 -3.710 4.353 1.00 0.00 H new ATOM 0 HH2 TRP A 787 -22.077 -3.585 5.627 1.00 0.00 H new ATOM 1558 N ILE A 788 -14.874 -8.450 5.034 1.00 0.00 N ATOM 1559 CA ILE A 788 -13.524 -8.911 4.740 1.00 0.00 C ATOM 1560 C ILE A 788 -12.448 -7.897 5.210 1.00 0.00 C ATOM 1561 O ILE A 788 -11.330 -8.290 5.525 1.00 0.00 O ATOM 1562 CB ILE A 788 -13.330 -9.231 3.207 1.00 0.00 C ATOM 1563 CG1 ILE A 788 -14.322 -10.294 2.680 1.00 0.00 C ATOM 1564 CG2 ILE A 788 -11.914 -9.672 2.897 1.00 0.00 C ATOM 1565 CD1 ILE A 788 -15.725 -9.788 2.416 1.00 0.00 C ATOM 0 H ILE A 788 -15.223 -7.732 4.399 1.00 0.00 H new ATOM 0 HA ILE A 788 -13.391 -9.835 5.302 1.00 0.00 H new ATOM 0 HB ILE A 788 -13.536 -8.293 2.692 1.00 0.00 H new ATOM 0 HG12 ILE A 788 -13.924 -10.714 1.756 1.00 0.00 H new ATOM 0 HG13 ILE A 788 -14.376 -11.108 3.403 1.00 0.00 H new ATOM 0 HG21 ILE A 788 -11.824 -9.882 1.831 1.00 0.00 H new ATOM 0 HG22 ILE A 788 -11.218 -8.879 3.171 1.00 0.00 H new ATOM 0 HG23 ILE A 788 -11.681 -10.572 3.466 1.00 0.00 H new ATOM 0 HD11 ILE A 788 -16.344 -10.607 2.050 1.00 0.00 H new ATOM 0 HD12 ILE A 788 -16.150 -9.396 3.340 1.00 0.00 H new ATOM 0 HD13 ILE A 788 -15.691 -8.996 1.668 1.00 0.00 H new ATOM 1577 N HIS A 789 -12.826 -6.596 5.284 1.00 0.00 N ATOM 1578 CA HIS A 789 -11.892 -5.460 5.660 1.00 0.00 C ATOM 1579 C HIS A 789 -10.909 -5.178 4.537 1.00 0.00 C ATOM 1580 O HIS A 789 -10.127 -6.035 4.182 1.00 0.00 O ATOM 1581 CB HIS A 789 -11.062 -5.719 6.949 1.00 0.00 C ATOM 1582 CG HIS A 789 -11.839 -5.853 8.205 1.00 0.00 C ATOM 1583 ND1 HIS A 789 -13.123 -6.161 8.407 1.00 0.00 N flip ATOM 1584 CD2 HIS A 789 -11.287 -5.677 9.444 1.00 0.00 C flip ATOM 1585 CE1 HIS A 789 -13.334 -6.170 9.750 1.00 0.00 C flip ATOM 1586 NE2 HIS A 789 -12.203 -5.873 10.360 1.00 0.00 N flip ATOM 0 H HIS A 789 -13.778 -6.287 5.089 1.00 0.00 H new ATOM 0 HA HIS A 789 -12.551 -4.611 5.844 1.00 0.00 H new ATOM 0 HB2 HIS A 789 -10.480 -6.629 6.806 1.00 0.00 H new ATOM 0 HB3 HIS A 789 -10.351 -4.902 7.070 1.00 0.00 H new ATOM 0 HD2 HIS A 789 -10.257 -5.417 9.637 1.00 0.00 H new ATOM 0 HE1 HIS A 789 -14.273 -6.385 10.237 1.00 0.00 H new ATOM 0 HE2 HIS A 789 -12.065 -5.807 11.369 1.00 0.00 H new ATOM 1595 N THR A 790 -10.933 -3.996 4.001 1.00 0.00 N ATOM 1596 CA THR A 790 -10.045 -3.655 2.922 1.00 0.00 C ATOM 1597 C THR A 790 -9.573 -2.200 3.049 1.00 0.00 C ATOM 1598 O THR A 790 -10.213 -1.393 3.736 1.00 0.00 O ATOM 1599 CB THR A 790 -10.735 -3.933 1.564 1.00 0.00 C ATOM 1600 OG1 THR A 790 -9.953 -3.492 0.471 1.00 0.00 O ATOM 1601 CG2 THR A 790 -12.106 -3.324 1.512 1.00 0.00 C ATOM 0 H THR A 790 -11.559 -3.245 4.292 1.00 0.00 H new ATOM 0 HA THR A 790 -9.154 -4.281 2.974 1.00 0.00 H new ATOM 0 HB THR A 790 -10.838 -5.015 1.480 1.00 0.00 H new ATOM 0 HG1 THR A 790 -9.717 -4.258 -0.093 1.00 0.00 H new ATOM 0 HG21 THR A 790 -12.563 -3.538 0.546 1.00 0.00 H new ATOM 0 HG22 THR A 790 -12.722 -3.746 2.306 1.00 0.00 H new ATOM 0 HG23 THR A 790 -12.030 -2.245 1.647 1.00 0.00 H new ATOM 1609 N VAL A 791 -8.448 -1.891 2.440 1.00 0.00 N ATOM 1610 CA VAL A 791 -7.854 -0.573 2.515 1.00 0.00 C ATOM 1611 C VAL A 791 -7.754 0.020 1.110 1.00 0.00 C ATOM 1612 O VAL A 791 -7.384 -0.680 0.172 1.00 0.00 O ATOM 1613 CB VAL A 791 -6.431 -0.655 3.136 1.00 0.00 C ATOM 1614 CG1 VAL A 791 -5.805 0.724 3.299 1.00 0.00 C ATOM 1615 CG2 VAL A 791 -6.454 -1.402 4.467 1.00 0.00 C ATOM 0 H VAL A 791 -7.916 -2.552 1.875 1.00 0.00 H new ATOM 0 HA VAL A 791 -8.481 0.059 3.144 1.00 0.00 H new ATOM 0 HB VAL A 791 -5.808 -1.217 2.441 1.00 0.00 H new ATOM 0 HG11 VAL A 791 -4.812 0.623 3.736 1.00 0.00 H new ATOM 0 HG12 VAL A 791 -5.726 1.205 2.324 1.00 0.00 H new ATOM 0 HG13 VAL A 791 -6.429 1.332 3.954 1.00 0.00 H new ATOM 0 HG21 VAL A 791 -5.445 -1.444 4.878 1.00 0.00 H new ATOM 0 HG22 VAL A 791 -7.109 -0.881 5.165 1.00 0.00 H new ATOM 0 HG23 VAL A 791 -6.824 -2.415 4.309 1.00 0.00 H new ATOM 1625 N CYS A 792 -8.125 1.283 0.965 1.00 0.00 N ATOM 1626 CA CYS A 792 -8.038 1.966 -0.327 1.00 0.00 C ATOM 1627 C CYS A 792 -6.588 2.260 -0.667 1.00 0.00 C ATOM 1628 O CYS A 792 -5.907 3.043 0.010 1.00 0.00 O ATOM 1629 CB CYS A 792 -8.836 3.266 -0.316 1.00 0.00 C ATOM 1630 SG CYS A 792 -8.860 4.205 -1.893 1.00 0.00 S ATOM 0 H CYS A 792 -8.490 1.860 1.723 1.00 0.00 H new ATOM 0 HA CYS A 792 -8.462 1.307 -1.085 1.00 0.00 H new ATOM 0 HB2 CYS A 792 -9.864 3.036 -0.037 1.00 0.00 H new ATOM 0 HB3 CYS A 792 -8.431 3.912 0.463 1.00 0.00 H new ATOM 1635 N ILE A 793 -6.130 1.633 -1.685 1.00 0.00 N ATOM 1636 CA ILE A 793 -4.802 1.765 -2.168 1.00 0.00 C ATOM 1637 C ILE A 793 -4.848 2.440 -3.515 1.00 0.00 C ATOM 1638 O ILE A 793 -4.908 1.770 -4.544 1.00 0.00 O ATOM 1639 CB ILE A 793 -4.094 0.388 -2.308 1.00 0.00 C ATOM 1640 CG1 ILE A 793 -4.119 -0.397 -0.974 1.00 0.00 C ATOM 1641 CG2 ILE A 793 -2.654 0.577 -2.787 1.00 0.00 C ATOM 1642 CD1 ILE A 793 -3.428 0.298 0.185 1.00 0.00 C ATOM 0 H ILE A 793 -6.695 0.983 -2.232 1.00 0.00 H new ATOM 0 HA ILE A 793 -4.233 2.357 -1.451 1.00 0.00 H new ATOM 0 HB ILE A 793 -4.640 -0.195 -3.050 1.00 0.00 H new ATOM 0 HG12 ILE A 793 -5.157 -0.587 -0.699 1.00 0.00 H new ATOM 0 HG13 ILE A 793 -3.648 -1.368 -1.131 1.00 0.00 H new ATOM 0 HG21 ILE A 793 -2.171 -0.396 -2.880 1.00 0.00 H new ATOM 0 HG22 ILE A 793 -2.655 1.076 -3.756 1.00 0.00 H new ATOM 0 HG23 ILE A 793 -2.108 1.186 -2.066 1.00 0.00 H new ATOM 0 HD11 ILE A 793 -3.496 -0.326 1.076 1.00 0.00 H new ATOM 0 HD12 ILE A 793 -2.380 0.463 -0.063 1.00 0.00 H new ATOM 0 HD13 ILE A 793 -3.911 1.256 0.375 1.00 0.00 H new ATOM 1654 N ASN A 794 -4.937 3.769 -3.486 1.00 0.00 N ATOM 1655 CA ASN A 794 -4.923 4.600 -4.701 1.00 0.00 C ATOM 1656 C ASN A 794 -5.946 4.117 -5.730 1.00 0.00 C ATOM 1657 O ASN A 794 -5.581 3.583 -6.783 1.00 0.00 O ATOM 1658 CB ASN A 794 -3.554 4.631 -5.398 1.00 0.00 C ATOM 1659 CG ASN A 794 -2.387 5.190 -4.650 1.00 0.00 C ATOM 1660 OD1 ASN A 794 -2.408 5.192 -3.334 1.00 0.00 O flip ATOM 1661 ND2 ASN A 794 -1.453 5.669 -5.285 1.00 0.00 N flip ATOM 0 H ASN A 794 -5.021 4.305 -2.622 1.00 0.00 H new ATOM 0 HA ASN A 794 -5.171 5.602 -4.350 1.00 0.00 H new ATOM 0 HB2 ASN A 794 -3.305 3.610 -5.686 1.00 0.00 H new ATOM 0 HB3 ASN A 794 -3.663 5.204 -6.319 1.00 0.00 H new ATOM 0 HD21 ASN A 794 -1.467 5.651 -6.305 1.00 0.00 H new ATOM 0 HD22 ASN A 794 -0.662 6.085 -4.793 1.00 0.00 H new ATOM 1668 N GLY A 795 -7.200 4.254 -5.421 1.00 0.00 N ATOM 1669 CA GLY A 795 -8.231 3.844 -6.352 1.00 0.00 C ATOM 1670 C GLY A 795 -8.491 2.347 -6.379 1.00 0.00 C ATOM 1671 O GLY A 795 -9.348 1.884 -7.132 1.00 0.00 O ATOM 0 H GLY A 795 -7.542 4.642 -4.542 1.00 0.00 H new ATOM 0 HA2 GLY A 795 -9.158 4.357 -6.098 1.00 0.00 H new ATOM 0 HA3 GLY A 795 -7.950 4.170 -7.353 1.00 0.00 H new ATOM 1675 N ARG A 796 -7.820 1.597 -5.535 1.00 0.00 N ATOM 1676 CA ARG A 796 -7.958 0.159 -5.537 1.00 0.00 C ATOM 1677 C ARG A 796 -8.119 -0.277 -4.116 1.00 0.00 C ATOM 1678 O ARG A 796 -7.882 0.479 -3.219 1.00 0.00 O ATOM 1679 CB ARG A 796 -6.713 -0.486 -6.115 1.00 0.00 C ATOM 1680 CG ARG A 796 -6.856 -1.940 -6.481 1.00 0.00 C ATOM 1681 CD ARG A 796 -5.550 -2.505 -6.958 1.00 0.00 C ATOM 1682 NE ARG A 796 -5.151 -1.973 -8.254 1.00 0.00 N ATOM 1683 CZ ARG A 796 -5.046 -2.713 -9.369 1.00 0.00 C ATOM 1684 NH1 ARG A 796 -5.406 -4.003 -9.354 1.00 0.00 N ATOM 1685 NH2 ARG A 796 -4.627 -2.154 -10.496 1.00 0.00 N ATOM 0 H ARG A 796 -7.171 1.960 -4.837 1.00 0.00 H new ATOM 0 HA ARG A 796 -8.815 -0.136 -6.142 1.00 0.00 H new ATOM 0 HB2 ARG A 796 -6.415 0.069 -7.005 1.00 0.00 H new ATOM 0 HB3 ARG A 796 -5.903 -0.388 -5.392 1.00 0.00 H new ATOM 0 HG2 ARG A 796 -7.206 -2.504 -5.616 1.00 0.00 H new ATOM 0 HG3 ARG A 796 -7.610 -2.050 -7.260 1.00 0.00 H new ATOM 0 HD2 ARG A 796 -4.774 -2.286 -6.225 1.00 0.00 H new ATOM 0 HD3 ARG A 796 -5.630 -3.590 -7.023 1.00 0.00 H new ATOM 0 HE ARG A 796 -4.938 -0.977 -8.318 1.00 0.00 H new ATOM 0 HH11 ARG A 796 -5.760 -4.424 -8.495 1.00 0.00 H new ATOM 0 HH12 ARG A 796 -5.326 -4.565 -10.202 1.00 0.00 H new ATOM 0 HH21 ARG A 796 -4.385 -1.163 -10.515 1.00 0.00 H new ATOM 0 HH22 ARG A 796 -4.547 -2.715 -11.344 1.00 0.00 H new ATOM 1699 N TRP A 797 -8.487 -1.466 -3.919 1.00 0.00 N ATOM 1700 CA TRP A 797 -8.704 -1.977 -2.621 1.00 0.00 C ATOM 1701 C TRP A 797 -7.689 -3.042 -2.316 1.00 0.00 C ATOM 1702 O TRP A 797 -7.074 -3.605 -3.235 1.00 0.00 O ATOM 1703 CB TRP A 797 -10.092 -2.558 -2.569 1.00 0.00 C ATOM 1704 CG TRP A 797 -11.160 -1.526 -2.649 1.00 0.00 C ATOM 1705 CD1 TRP A 797 -12.064 -1.331 -3.655 1.00 0.00 C ATOM 1706 CD2 TRP A 797 -11.403 -0.519 -1.685 1.00 0.00 C ATOM 1707 NE1 TRP A 797 -12.873 -0.262 -3.348 1.00 0.00 N ATOM 1708 CE2 TRP A 797 -12.476 0.252 -2.141 1.00 0.00 C ATOM 1709 CE3 TRP A 797 -10.812 -0.198 -0.464 1.00 0.00 C ATOM 1710 CZ2 TRP A 797 -12.961 1.320 -1.421 1.00 0.00 C ATOM 1711 CZ3 TRP A 797 -11.293 0.864 0.242 1.00 0.00 C ATOM 1712 CH2 TRP A 797 -12.351 1.609 -0.231 1.00 0.00 C ATOM 0 H TRP A 797 -8.654 -2.139 -4.667 1.00 0.00 H new ATOM 0 HA TRP A 797 -8.604 -1.182 -1.882 1.00 0.00 H new ATOM 0 HB2 TRP A 797 -10.215 -3.264 -3.390 1.00 0.00 H new ATOM 0 HB3 TRP A 797 -10.209 -3.122 -1.644 1.00 0.00 H new ATOM 0 HD1 TRP A 797 -12.133 -1.926 -4.554 1.00 0.00 H new ATOM 0 HE1 TRP A 797 -13.640 0.089 -3.922 1.00 0.00 H new ATOM 0 HE3 TRP A 797 -9.986 -0.781 -0.084 1.00 0.00 H new ATOM 0 HZ2 TRP A 797 -13.792 1.908 -1.782 1.00 0.00 H new ATOM 0 HZ3 TRP A 797 -10.838 1.125 1.186 1.00 0.00 H new ATOM 0 HH2 TRP A 797 -12.709 2.444 0.353 1.00 0.00 H new ATOM 1723 N ASP A 798 -7.483 -3.298 -1.062 1.00 0.00 N ATOM 1724 CA ASP A 798 -6.636 -4.382 -0.644 1.00 0.00 C ATOM 1725 C ASP A 798 -7.136 -4.923 0.669 1.00 0.00 C ATOM 1726 O ASP A 798 -7.023 -4.250 1.707 1.00 0.00 O ATOM 1727 CB ASP A 798 -5.193 -3.979 -0.500 1.00 0.00 C ATOM 1728 CG ASP A 798 -4.309 -5.200 -0.375 1.00 0.00 C ATOM 1729 OD1 ASP A 798 -3.961 -5.796 -1.432 1.00 0.00 O ATOM 1730 OD2 ASP A 798 -3.964 -5.608 0.760 1.00 0.00 O ATOM 0 H ASP A 798 -7.895 -2.765 -0.296 1.00 0.00 H new ATOM 0 HA ASP A 798 -6.679 -5.144 -1.423 1.00 0.00 H new ATOM 0 HB2 ASP A 798 -4.887 -3.389 -1.364 1.00 0.00 H new ATOM 0 HB3 ASP A 798 -5.073 -3.345 0.378 1.00 0.00 H new ATOM 1735 N PRO A 799 -7.737 -6.113 0.663 1.00 0.00 N ATOM 1736 CA PRO A 799 -7.938 -6.914 -0.550 1.00 0.00 C ATOM 1737 C PRO A 799 -8.989 -6.319 -1.480 1.00 0.00 C ATOM 1738 O PRO A 799 -9.977 -5.717 -1.018 1.00 0.00 O ATOM 1739 CB PRO A 799 -8.436 -8.254 -0.015 1.00 0.00 C ATOM 1740 CG PRO A 799 -9.027 -7.942 1.307 1.00 0.00 C ATOM 1741 CD PRO A 799 -8.258 -6.783 1.848 1.00 0.00 C ATOM 0 HA PRO A 799 -7.024 -6.975 -1.140 1.00 0.00 H new ATOM 0 HB2 PRO A 799 -9.175 -8.696 -0.683 1.00 0.00 H new ATOM 0 HB3 PRO A 799 -7.620 -8.971 0.077 1.00 0.00 H new ATOM 0 HG2 PRO A 799 -10.085 -7.696 1.212 1.00 0.00 H new ATOM 0 HG3 PRO A 799 -8.958 -8.800 1.976 1.00 0.00 H new ATOM 0 HD2 PRO A 799 -8.896 -6.120 2.432 1.00 0.00 H new ATOM 0 HD3 PRO A 799 -7.453 -7.112 2.506 1.00 0.00 H new ATOM 1749 N GLU A 800 -8.734 -6.419 -2.770 1.00 0.00 N ATOM 1750 CA GLU A 800 -9.684 -5.986 -3.784 1.00 0.00 C ATOM 1751 C GLU A 800 -11.029 -6.634 -3.564 1.00 0.00 C ATOM 1752 O GLU A 800 -11.129 -7.865 -3.418 1.00 0.00 O ATOM 1753 CB GLU A 800 -9.198 -6.277 -5.213 1.00 0.00 C ATOM 1754 CG GLU A 800 -8.110 -5.350 -5.716 1.00 0.00 C ATOM 1755 CD GLU A 800 -7.758 -5.590 -7.168 1.00 0.00 C ATOM 1756 OE1 GLU A 800 -8.678 -5.596 -8.029 1.00 0.00 O ATOM 1757 OE2 GLU A 800 -6.547 -5.733 -7.489 1.00 0.00 O ATOM 0 H GLU A 800 -7.867 -6.801 -3.147 1.00 0.00 H new ATOM 0 HA GLU A 800 -9.776 -4.905 -3.681 1.00 0.00 H new ATOM 0 HB2 GLU A 800 -8.830 -7.302 -5.255 1.00 0.00 H new ATOM 0 HB3 GLU A 800 -10.050 -6.216 -5.891 1.00 0.00 H new ATOM 0 HG2 GLU A 800 -8.434 -4.317 -5.592 1.00 0.00 H new ATOM 0 HG3 GLU A 800 -7.217 -5.480 -5.104 1.00 0.00 H new ATOM 1764 N VAL A 801 -12.045 -5.814 -3.498 1.00 0.00 N ATOM 1765 CA VAL A 801 -13.329 -6.226 -3.303 1.00 0.00 C ATOM 1766 C VAL A 801 -13.800 -6.940 -4.581 1.00 0.00 C ATOM 1767 O VAL A 801 -13.431 -6.533 -5.701 1.00 0.00 O ATOM 1768 CB VAL A 801 -14.184 -4.990 -2.950 1.00 0.00 C ATOM 1769 CG1 VAL A 801 -13.570 -4.162 -1.819 1.00 0.00 C ATOM 1770 CG2 VAL A 801 -14.516 -4.135 -4.130 1.00 0.00 C ATOM 0 H VAL A 801 -11.950 -4.802 -3.588 1.00 0.00 H new ATOM 0 HA VAL A 801 -13.420 -6.933 -2.478 1.00 0.00 H new ATOM 0 HB VAL A 801 -15.130 -5.394 -2.590 1.00 0.00 H new ATOM 0 HG11 VAL A 801 -14.209 -3.304 -1.608 1.00 0.00 H new ATOM 0 HG12 VAL A 801 -13.482 -4.778 -0.924 1.00 0.00 H new ATOM 0 HG13 VAL A 801 -12.582 -3.814 -2.118 1.00 0.00 H new ATOM 0 HG21 VAL A 801 -15.118 -3.286 -3.806 1.00 0.00 H new ATOM 0 HG22 VAL A 801 -13.595 -3.773 -4.588 1.00 0.00 H new ATOM 0 HG23 VAL A 801 -15.077 -4.721 -4.858 1.00 0.00 H new