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 -150:sc= -1.05 USER MOD Set 1.2: A 773 HIS : no HE2:sc= -4.79! C(o=-5.8!,f=-12!) USER MOD Set 1.3: A 774 ASN :FLIP amide:sc=-0.00137 F(o=-6.7,f=-5.8) USER MOD Set 2.1: A 714 SER OG : rot 180:sc= -0.0588 USER MOD Set 2.2: A 732 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 705 SER OG : rot 96:sc= -1.06! USER MOD Set 3.2: A 709 TYR OH : rot 43:sc= 0.657 USER MOD Set 4.1: A 703 GLN :FLIP amide:sc= 0.281 F(o=-1.1,f=-0.23) USER MOD Set 4.2: A 718 ASN :FLIP amide:sc= -0.507 F(o=-1.1,f=-0.23) USER MOD Single : A 690 THR OG1 : rot 102:sc= 1.24 USER MOD Single : A 699 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 706 SER OG : rot 41:sc= 0.0309 USER MOD Single : A 710 TYR OH : rot 180:sc= 0 USER MOD Single : A 711 TYR OH : rot 180:sc= 0 USER MOD Single : A 720 SER OG : rot 81:sc= 0.268 USER MOD Single : A 722 SER OG : rot 180:sc= 0 USER MOD Single : A 725 MET CE :methyl 168:sc= 0 (180deg=-0.0502) USER MOD Single : A 728 HIS :FLIP no HE2:sc= 0.258 F(o=-1.1,f=0.26) USER MOD Single : A 730 SER OG : rot 180:sc= -0.142 USER MOD Single : A 735 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 739 THR OG1 : rot 40:sc= -1.41! USER MOD Single : A 740 GLN :FLIP amide:sc= -2.78! C(o=-5.6!,f=-2.8!) USER MOD Single : A 743 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 749 LYS NZ :NH3+ -165:sc= 0.908 (180deg=0.33) USER MOD Single : A 751 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 752 LYS NZ :NH3+ 180:sc= 1.22 (180deg=1.22) USER MOD Single : A 754 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 755 SER OG : rot 41:sc= -0.363 USER MOD Single : A 756 SER OG : rot 180:sc= 0 USER MOD Single : A 757 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 764 HIS : no HD1:sc= -0.106 X(o=-0.11,f=0) USER MOD Single : A 766 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 767 ASN : amide:sc= 0 X(o=0,f=0) 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 775 SER OG : rot 170:sc= 0 USER MOD Single : A 776 ASN :FLIP amide:sc= -1.13 F(o=-2.5!,f=-1.1) USER MOD Single : A 779 TYR OH : rot 180:sc= 0 USER MOD Single : A 781 CYS SG : rot 180:sc= 0.0432 USER MOD Single : A 784 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 789 HIS :FLIP no HD1:sc= -0.714 F(o=-1.7!,f=-0.71) USER MOD Single : A 790 THR OG1 : rot 114:sc= -0.2 USER MOD Single : A 794 ASN : amide:sc= -8.15! C(o=-8.2!,f=-9!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 690 27.869 -9.384 -1.554 1.00 0.00 N ATOM 2 CA THR A 690 27.229 -8.278 -0.932 1.00 0.00 C ATOM 3 C THR A 690 26.808 -7.285 -1.984 1.00 0.00 C ATOM 4 O THR A 690 27.475 -7.140 -3.022 1.00 0.00 O ATOM 5 CB THR A 690 28.173 -7.583 0.118 1.00 0.00 C ATOM 6 OG1 THR A 690 27.661 -6.300 0.519 1.00 0.00 O ATOM 7 CG2 THR A 690 29.587 -7.407 -0.414 1.00 0.00 C ATOM 0 HA THR A 690 26.352 -8.645 -0.399 1.00 0.00 H new ATOM 0 HB THR A 690 28.204 -8.246 0.983 1.00 0.00 H new ATOM 0 HG1 THR A 690 27.238 -6.377 1.400 1.00 0.00 H new ATOM 0 HG21 THR A 690 30.203 -6.923 0.344 1.00 0.00 H new ATOM 0 HG22 THR A 690 30.009 -8.383 -0.656 1.00 0.00 H new ATOM 0 HG23 THR A 690 29.564 -6.789 -1.311 1.00 0.00 H new ATOM 15 N CYS A 691 25.676 -6.688 -1.772 1.00 0.00 N ATOM 16 CA CYS A 691 25.264 -5.577 -2.582 1.00 0.00 C ATOM 17 C CYS A 691 26.001 -4.361 -2.086 1.00 0.00 C ATOM 18 O CYS A 691 26.905 -3.844 -2.754 1.00 0.00 O ATOM 19 CB CYS A 691 23.741 -5.365 -2.542 1.00 0.00 C ATOM 20 SG CYS A 691 22.802 -6.560 -3.545 1.00 0.00 S ATOM 0 H CYS A 691 25.015 -6.951 -1.041 1.00 0.00 H new ATOM 0 HA CYS A 691 25.507 -5.772 -3.627 1.00 0.00 H new ATOM 0 HB2 CYS A 691 23.402 -5.428 -1.508 1.00 0.00 H new ATOM 0 HB3 CYS A 691 23.515 -4.357 -2.890 1.00 0.00 H new ATOM 25 N GLY A 692 25.682 -3.950 -0.883 1.00 0.00 N ATOM 26 CA GLY A 692 26.359 -2.861 -0.308 1.00 0.00 C ATOM 27 C GLY A 692 25.657 -1.589 -0.560 1.00 0.00 C ATOM 28 O GLY A 692 25.069 -1.402 -1.622 1.00 0.00 O ATOM 0 H GLY A 692 24.956 -4.366 -0.300 1.00 0.00 H new ATOM 0 HA2 GLY A 692 26.454 -3.018 0.766 1.00 0.00 H new ATOM 0 HA3 GLY A 692 27.370 -2.806 -0.713 1.00 0.00 H new ATOM 32 N ASP A 693 25.688 -0.757 0.441 1.00 0.00 N ATOM 33 CA ASP A 693 25.118 0.585 0.453 1.00 0.00 C ATOM 34 C ASP A 693 23.669 0.596 0.058 1.00 0.00 C ATOM 35 O ASP A 693 23.322 0.555 -1.124 1.00 0.00 O ATOM 36 CB ASP A 693 25.932 1.586 -0.381 1.00 0.00 C ATOM 37 CG ASP A 693 25.412 3.010 -0.252 1.00 0.00 C ATOM 38 OD1 ASP A 693 25.526 3.604 0.855 1.00 0.00 O ATOM 39 OD2 ASP A 693 24.922 3.581 -1.237 1.00 0.00 O ATOM 0 H ASP A 693 26.134 -0.998 1.326 1.00 0.00 H new ATOM 0 HA ASP A 693 25.174 0.918 1.489 1.00 0.00 H new ATOM 0 HB2 ASP A 693 26.975 1.553 -0.066 1.00 0.00 H new ATOM 0 HB3 ASP A 693 25.906 1.287 -1.429 1.00 0.00 H new ATOM 44 N ILE A 694 22.823 0.609 1.042 1.00 0.00 N ATOM 45 CA ILE A 694 21.414 0.650 0.791 1.00 0.00 C ATOM 46 C ILE A 694 21.013 1.937 0.089 1.00 0.00 C ATOM 47 O ILE A 694 21.658 2.984 0.264 1.00 0.00 O ATOM 48 CB ILE A 694 20.552 0.415 2.064 1.00 0.00 C ATOM 49 CG1 ILE A 694 21.107 1.106 3.325 1.00 0.00 C ATOM 50 CG2 ILE A 694 20.346 -1.047 2.294 1.00 0.00 C ATOM 51 CD1 ILE A 694 21.128 2.607 3.309 1.00 0.00 C ATOM 0 H ILE A 694 23.083 0.592 2.028 1.00 0.00 H new ATOM 0 HA ILE A 694 21.206 -0.187 0.124 1.00 0.00 H new ATOM 0 HB ILE A 694 19.588 0.886 1.873 1.00 0.00 H new ATOM 0 HG12 ILE A 694 20.515 0.782 4.181 1.00 0.00 H new ATOM 0 HG13 ILE A 694 22.125 0.752 3.489 1.00 0.00 H new ATOM 0 HG21 ILE A 694 19.741 -1.193 3.189 1.00 0.00 H new ATOM 0 HG22 ILE A 694 19.835 -1.482 1.435 1.00 0.00 H new ATOM 0 HG23 ILE A 694 21.312 -1.534 2.426 1.00 0.00 H new ATOM 0 HD11 ILE A 694 21.539 2.975 4.249 1.00 0.00 H new ATOM 0 HD12 ILE A 694 21.747 2.953 2.482 1.00 0.00 H new ATOM 0 HD13 ILE A 694 20.113 2.984 3.185 1.00 0.00 H new ATOM 63 N PRO A 695 20.014 1.870 -0.750 1.00 0.00 N ATOM 64 CA PRO A 695 19.513 3.028 -1.468 1.00 0.00 C ATOM 65 C PRO A 695 18.804 4.018 -0.542 1.00 0.00 C ATOM 66 O PRO A 695 18.814 3.881 0.693 1.00 0.00 O ATOM 67 CB PRO A 695 18.520 2.412 -2.458 1.00 0.00 C ATOM 68 CG PRO A 695 18.090 1.162 -1.805 1.00 0.00 C ATOM 69 CD PRO A 695 19.298 0.651 -1.115 1.00 0.00 C ATOM 0 HA PRO A 695 20.310 3.603 -1.940 1.00 0.00 H new ATOM 0 HB2 PRO A 695 17.676 3.077 -2.642 1.00 0.00 H new ATOM 0 HB3 PRO A 695 18.988 2.217 -3.423 1.00 0.00 H new ATOM 0 HG2 PRO A 695 17.280 1.345 -1.099 1.00 0.00 H new ATOM 0 HG3 PRO A 695 17.720 0.443 -2.536 1.00 0.00 H new ATOM 0 HD2 PRO A 695 19.040 0.058 -0.238 1.00 0.00 H new ATOM 0 HD3 PRO A 695 19.895 0.013 -1.767 1.00 0.00 H new ATOM 77 N GLU A 696 18.191 4.980 -1.128 1.00 0.00 N ATOM 78 CA GLU A 696 17.472 5.952 -0.436 1.00 0.00 C ATOM 79 C GLU A 696 16.086 5.866 -0.980 1.00 0.00 C ATOM 80 O GLU A 696 15.817 5.067 -1.889 1.00 0.00 O ATOM 81 CB GLU A 696 18.060 7.353 -0.682 1.00 0.00 C ATOM 82 CG GLU A 696 17.936 7.839 -2.121 1.00 0.00 C ATOM 83 CD GLU A 696 18.513 9.209 -2.329 1.00 0.00 C ATOM 84 OE1 GLU A 696 18.061 10.168 -1.670 1.00 0.00 O ATOM 85 OE2 GLU A 696 19.409 9.365 -3.179 1.00 0.00 O ATOM 0 H GLU A 696 18.184 5.105 -2.140 1.00 0.00 H new ATOM 0 HA GLU A 696 17.505 5.789 0.641 1.00 0.00 H new ATOM 0 HB2 GLU A 696 17.560 8.065 -0.026 1.00 0.00 H new ATOM 0 HB3 GLU A 696 19.113 7.347 -0.402 1.00 0.00 H new ATOM 0 HG2 GLU A 696 18.441 7.134 -2.782 1.00 0.00 H new ATOM 0 HG3 GLU A 696 16.884 7.847 -2.407 1.00 0.00 H new ATOM 92 N LEU A 697 15.240 6.646 -0.488 1.00 0.00 N ATOM 93 CA LEU A 697 13.901 6.648 -0.951 1.00 0.00 C ATOM 94 C LEU A 697 13.488 8.031 -1.407 1.00 0.00 C ATOM 95 O LEU A 697 13.690 9.026 -0.691 1.00 0.00 O ATOM 96 CB LEU A 697 12.961 6.061 0.097 1.00 0.00 C ATOM 97 CG LEU A 697 11.495 5.928 -0.295 1.00 0.00 C ATOM 98 CD1 LEU A 697 11.358 5.210 -1.623 1.00 0.00 C ATOM 99 CD2 LEU A 697 10.773 5.140 0.748 1.00 0.00 C ATOM 0 H LEU A 697 15.437 7.316 0.255 1.00 0.00 H new ATOM 0 HA LEU A 697 13.832 6.001 -1.825 1.00 0.00 H new ATOM 0 HB2 LEU A 697 13.331 5.073 0.370 1.00 0.00 H new ATOM 0 HB3 LEU A 697 13.019 6.681 0.991 1.00 0.00 H new ATOM 0 HG LEU A 697 11.070 6.928 -0.382 1.00 0.00 H new ATOM 0 HD11 LEU A 697 10.303 5.126 -1.884 1.00 0.00 H new ATOM 0 HD12 LEU A 697 11.879 5.774 -2.397 1.00 0.00 H new ATOM 0 HD13 LEU A 697 11.793 4.214 -1.544 1.00 0.00 H new ATOM 0 HD21 LEU A 697 9.724 5.044 0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 697 11.219 4.149 0.829 1.00 0.00 H new ATOM 0 HD23 LEU A 697 10.848 5.652 1.708 1.00 0.00 H new ATOM 111 N GLU A 698 12.943 8.057 -2.612 1.00 0.00 N ATOM 112 CA GLU A 698 12.467 9.242 -3.326 1.00 0.00 C ATOM 113 C GLU A 698 11.763 10.288 -2.442 1.00 0.00 C ATOM 114 O GLU A 698 12.087 11.462 -2.500 1.00 0.00 O ATOM 115 CB GLU A 698 11.535 8.806 -4.465 1.00 0.00 C ATOM 116 CG GLU A 698 10.507 7.764 -4.032 1.00 0.00 C ATOM 117 CD GLU A 698 9.422 7.529 -5.032 1.00 0.00 C ATOM 118 OE1 GLU A 698 9.695 7.032 -6.143 1.00 0.00 O ATOM 119 OE2 GLU A 698 8.272 7.854 -4.727 1.00 0.00 O ATOM 0 H GLU A 698 12.811 7.203 -3.155 1.00 0.00 H new ATOM 0 HA GLU A 698 13.356 9.741 -3.711 1.00 0.00 H new ATOM 0 HB2 GLU A 698 11.015 9.681 -4.856 1.00 0.00 H new ATOM 0 HB3 GLU A 698 12.133 8.400 -5.281 1.00 0.00 H new ATOM 0 HG2 GLU A 698 11.019 6.822 -3.839 1.00 0.00 H new ATOM 0 HG3 GLU A 698 10.057 8.081 -3.091 1.00 0.00 H new ATOM 126 N HIS A 699 10.793 9.863 -1.659 1.00 0.00 N ATOM 127 CA HIS A 699 10.034 10.790 -0.817 1.00 0.00 C ATOM 128 C HIS A 699 9.759 10.134 0.518 1.00 0.00 C ATOM 129 O HIS A 699 8.797 10.480 1.203 1.00 0.00 O ATOM 130 CB HIS A 699 8.675 11.162 -1.472 1.00 0.00 C ATOM 131 CG HIS A 699 8.743 11.826 -2.817 1.00 0.00 C ATOM 132 ND1 HIS A 699 8.792 13.183 -2.987 1.00 0.00 N ATOM 133 CD2 HIS A 699 8.734 11.295 -4.055 1.00 0.00 C ATOM 134 CE1 HIS A 699 8.801 13.460 -4.277 1.00 0.00 C ATOM 135 NE2 HIS A 699 8.768 12.328 -4.940 1.00 0.00 N ATOM 0 H HIS A 699 10.506 8.887 -1.582 1.00 0.00 H new ATOM 0 HA HIS A 699 10.624 11.698 -0.692 1.00 0.00 H new ATOM 0 HB2 HIS A 699 8.082 10.253 -1.569 1.00 0.00 H new ATOM 0 HB3 HIS A 699 8.137 11.822 -0.792 1.00 0.00 H new ATOM 0 HD2 HIS A 699 8.705 10.244 -4.300 1.00 0.00 H new ATOM 0 HE1 HIS A 699 8.830 14.448 -4.712 1.00 0.00 H new ATOM 0 HE2 HIS A 699 8.768 12.237 -5.956 1.00 0.00 H new ATOM 144 N GLY A 700 10.608 9.213 0.899 1.00 0.00 N ATOM 145 CA GLY A 700 10.384 8.471 2.114 1.00 0.00 C ATOM 146 C GLY A 700 11.649 8.258 2.902 1.00 0.00 C ATOM 147 O GLY A 700 12.560 9.095 2.865 1.00 0.00 O ATOM 0 H GLY A 700 11.455 8.960 0.390 1.00 0.00 H new ATOM 0 HA2 GLY A 700 9.660 9.002 2.732 1.00 0.00 H new ATOM 0 HA3 GLY A 700 9.945 7.504 1.869 1.00 0.00 H new ATOM 151 N TRP A 701 11.736 7.132 3.566 1.00 0.00 N ATOM 152 CA TRP A 701 12.845 6.840 4.451 1.00 0.00 C ATOM 153 C TRP A 701 13.065 5.336 4.526 1.00 0.00 C ATOM 154 O TRP A 701 12.301 4.561 3.940 1.00 0.00 O ATOM 155 CB TRP A 701 12.560 7.411 5.879 1.00 0.00 C ATOM 156 CG TRP A 701 11.322 6.844 6.568 1.00 0.00 C ATOM 157 CD1 TRP A 701 10.427 5.960 6.056 1.00 0.00 C ATOM 158 CD2 TRP A 701 10.855 7.133 7.889 1.00 0.00 C ATOM 159 NE1 TRP A 701 9.457 5.683 6.962 1.00 0.00 N ATOM 160 CE2 TRP A 701 9.690 6.379 8.084 1.00 0.00 C ATOM 161 CE3 TRP A 701 11.302 7.944 8.925 1.00 0.00 C ATOM 162 CZ2 TRP A 701 8.969 6.405 9.245 1.00 0.00 C ATOM 163 CZ3 TRP A 701 10.579 7.975 10.099 1.00 0.00 C ATOM 164 CH2 TRP A 701 9.421 7.203 10.252 1.00 0.00 C ATOM 0 H TRP A 701 11.040 6.388 3.510 1.00 0.00 H new ATOM 0 HA TRP A 701 13.745 7.312 4.057 1.00 0.00 H new ATOM 0 HB2 TRP A 701 13.428 7.219 6.510 1.00 0.00 H new ATOM 0 HB3 TRP A 701 12.452 8.493 5.806 1.00 0.00 H new ATOM 0 HD1 TRP A 701 10.481 5.536 5.064 1.00 0.00 H new ATOM 0 HE1 TRP A 701 8.674 5.046 6.814 1.00 0.00 H new ATOM 0 HE3 TRP A 701 12.197 8.538 8.813 1.00 0.00 H new ATOM 0 HZ2 TRP A 701 8.073 5.814 9.360 1.00 0.00 H new ATOM 0 HZ3 TRP A 701 10.911 8.604 10.912 1.00 0.00 H new ATOM 0 HH2 TRP A 701 8.877 7.241 11.184 1.00 0.00 H new ATOM 175 N ALA A 702 14.054 4.946 5.262 1.00 0.00 N ATOM 176 CA ALA A 702 14.358 3.565 5.507 1.00 0.00 C ATOM 177 C ALA A 702 14.106 3.295 6.968 1.00 0.00 C ATOM 178 O ALA A 702 14.337 4.172 7.804 1.00 0.00 O ATOM 179 CB ALA A 702 15.818 3.272 5.175 1.00 0.00 C ATOM 0 H ALA A 702 14.693 5.593 5.724 1.00 0.00 H new ATOM 0 HA ALA A 702 13.735 2.927 4.880 1.00 0.00 H new ATOM 0 HB1 ALA A 702 16.031 2.220 5.367 1.00 0.00 H new ATOM 0 HB2 ALA A 702 16.004 3.494 4.124 1.00 0.00 H new ATOM 0 HB3 ALA A 702 16.464 3.892 5.797 1.00 0.00 H new ATOM 185 N GLN A 703 13.616 2.123 7.275 1.00 0.00 N ATOM 186 CA GLN A 703 13.370 1.748 8.648 1.00 0.00 C ATOM 187 C GLN A 703 14.679 1.462 9.370 1.00 0.00 C ATOM 188 O GLN A 703 15.050 2.162 10.307 1.00 0.00 O ATOM 189 CB GLN A 703 12.437 0.551 8.713 1.00 0.00 C ATOM 190 CG GLN A 703 11.008 0.917 8.397 1.00 0.00 C ATOM 191 CD GLN A 703 10.397 1.900 9.407 1.00 0.00 C ATOM 192 OE1 GLN A 703 10.753 1.777 10.670 1.00 0.00 O flip ATOM 193 NE2 GLN A 703 9.566 2.729 9.047 1.00 0.00 N flip ATOM 0 H GLN A 703 13.377 1.406 6.590 1.00 0.00 H new ATOM 0 HA GLN A 703 12.885 2.583 9.153 1.00 0.00 H new ATOM 0 HB2 GLN A 703 12.778 -0.210 8.011 1.00 0.00 H new ATOM 0 HB3 GLN A 703 12.485 0.111 9.709 1.00 0.00 H new ATOM 0 HG2 GLN A 703 10.964 1.356 7.400 1.00 0.00 H new ATOM 0 HG3 GLN A 703 10.404 0.010 8.372 1.00 0.00 H new ATOM 0 HE21 GLN A 703 9.311 2.801 8.062 1.00 0.00 H new ATOM 0 HE22 GLN A 703 9.131 3.346 9.733 1.00 0.00 H new ATOM 202 N LEU A 704 15.383 0.454 8.897 1.00 0.00 N ATOM 203 CA LEU A 704 16.670 0.062 9.425 1.00 0.00 C ATOM 204 C LEU A 704 17.278 -0.888 8.416 1.00 0.00 C ATOM 205 O LEU A 704 16.574 -1.749 7.877 1.00 0.00 O ATOM 206 CB LEU A 704 16.514 -0.598 10.835 1.00 0.00 C ATOM 207 CG LEU A 704 17.801 -0.890 11.657 1.00 0.00 C ATOM 208 CD1 LEU A 704 17.439 -1.090 13.116 1.00 0.00 C ATOM 209 CD2 LEU A 704 18.525 -2.140 11.160 1.00 0.00 C ATOM 0 H LEU A 704 15.069 -0.126 8.119 1.00 0.00 H new ATOM 0 HA LEU A 704 17.322 0.924 9.570 1.00 0.00 H new ATOM 0 HB2 LEU A 704 15.875 0.049 11.436 1.00 0.00 H new ATOM 0 HB3 LEU A 704 15.982 -1.540 10.704 1.00 0.00 H new ATOM 0 HG LEU A 704 18.466 -0.035 11.536 1.00 0.00 H new ATOM 0 HD11 LEU A 704 18.343 -1.295 13.690 1.00 0.00 H new ATOM 0 HD12 LEU A 704 16.962 -0.188 13.499 1.00 0.00 H new ATOM 0 HD13 LEU A 704 16.752 -1.931 13.208 1.00 0.00 H new ATOM 0 HD21 LEU A 704 19.418 -2.307 11.762 1.00 0.00 H new ATOM 0 HD22 LEU A 704 17.863 -3.002 11.246 1.00 0.00 H new ATOM 0 HD23 LEU A 704 18.811 -2.004 10.117 1.00 0.00 H new ATOM 221 N SER A 705 18.532 -0.704 8.126 1.00 0.00 N ATOM 222 CA SER A 705 19.222 -1.483 7.172 1.00 0.00 C ATOM 223 C SER A 705 20.515 -1.992 7.757 1.00 0.00 C ATOM 224 O SER A 705 21.406 -1.213 8.129 1.00 0.00 O ATOM 225 CB SER A 705 19.446 -0.643 5.938 1.00 0.00 C ATOM 226 OG SER A 705 19.972 0.643 6.262 1.00 0.00 O ATOM 0 H SER A 705 19.108 0.014 8.565 1.00 0.00 H new ATOM 0 HA SER A 705 18.635 -2.358 6.892 1.00 0.00 H new ATOM 0 HB2 SER A 705 20.133 -1.158 5.267 1.00 0.00 H new ATOM 0 HB3 SER A 705 18.504 -0.526 5.402 1.00 0.00 H new ATOM 0 HG SER A 705 20.949 0.627 6.181 1.00 0.00 H new ATOM 232 N SER A 706 20.630 -3.262 7.802 1.00 0.00 N ATOM 233 CA SER A 706 21.745 -3.901 8.444 1.00 0.00 C ATOM 234 C SER A 706 22.706 -4.541 7.436 1.00 0.00 C ATOM 235 O SER A 706 22.330 -5.464 6.721 1.00 0.00 O ATOM 236 CB SER A 706 21.215 -4.918 9.459 1.00 0.00 C ATOM 237 OG SER A 706 20.201 -5.746 8.877 1.00 0.00 O ATOM 0 H SER A 706 19.954 -3.908 7.395 1.00 0.00 H new ATOM 0 HA SER A 706 22.332 -3.146 8.968 1.00 0.00 H new ATOM 0 HB2 SER A 706 22.035 -5.540 9.818 1.00 0.00 H new ATOM 0 HB3 SER A 706 20.809 -4.395 10.325 1.00 0.00 H new ATOM 0 HG SER A 706 20.461 -5.989 7.964 1.00 0.00 H new ATOM 243 N PRO A 707 23.943 -4.011 7.322 1.00 0.00 N ATOM 244 CA PRO A 707 24.976 -4.580 6.447 1.00 0.00 C ATOM 245 C PRO A 707 25.466 -5.929 6.998 1.00 0.00 C ATOM 246 O PRO A 707 25.107 -6.305 8.129 1.00 0.00 O ATOM 247 CB PRO A 707 26.073 -3.514 6.461 1.00 0.00 C ATOM 248 CG PRO A 707 25.901 -2.811 7.758 1.00 0.00 C ATOM 249 CD PRO A 707 24.432 -2.822 8.047 1.00 0.00 C ATOM 0 HA PRO A 707 24.628 -4.797 5.437 1.00 0.00 H new ATOM 0 HB2 PRO A 707 27.063 -3.964 6.383 1.00 0.00 H new ATOM 0 HB3 PRO A 707 25.968 -2.827 5.621 1.00 0.00 H new ATOM 0 HG2 PRO A 707 26.457 -3.313 8.550 1.00 0.00 H new ATOM 0 HG3 PRO A 707 26.279 -1.790 7.701 1.00 0.00 H new ATOM 0 HD2 PRO A 707 24.235 -2.896 9.116 1.00 0.00 H new ATOM 0 HD3 PRO A 707 23.948 -1.911 7.695 1.00 0.00 H new ATOM 257 N PRO A 708 26.291 -6.702 6.256 1.00 0.00 N ATOM 258 CA PRO A 708 26.858 -6.356 4.915 1.00 0.00 C ATOM 259 C PRO A 708 25.878 -6.206 3.770 1.00 0.00 C ATOM 260 O PRO A 708 26.301 -5.848 2.685 1.00 0.00 O ATOM 261 CB PRO A 708 27.761 -7.532 4.591 1.00 0.00 C ATOM 262 CG PRO A 708 27.324 -8.628 5.474 1.00 0.00 C ATOM 263 CD PRO A 708 26.786 -8.003 6.709 1.00 0.00 C ATOM 0 HA PRO A 708 27.325 -5.374 4.994 1.00 0.00 H new ATOM 0 HB2 PRO A 708 27.673 -7.816 3.542 1.00 0.00 H new ATOM 0 HB3 PRO A 708 28.807 -7.282 4.766 1.00 0.00 H new ATOM 0 HG2 PRO A 708 26.562 -9.236 4.986 1.00 0.00 H new ATOM 0 HG3 PRO A 708 28.158 -9.290 5.709 1.00 0.00 H new ATOM 0 HD2 PRO A 708 25.989 -8.604 7.147 1.00 0.00 H new ATOM 0 HD3 PRO A 708 27.558 -7.894 7.471 1.00 0.00 H new ATOM 271 N TYR A 709 24.607 -6.483 3.996 1.00 0.00 N ATOM 272 CA TYR A 709 23.594 -6.420 2.954 1.00 0.00 C ATOM 273 C TYR A 709 23.861 -7.547 1.969 1.00 0.00 C ATOM 274 O TYR A 709 24.307 -7.329 0.819 1.00 0.00 O ATOM 275 CB TYR A 709 23.558 -5.052 2.228 1.00 0.00 C ATOM 276 CG TYR A 709 23.301 -3.845 3.115 1.00 0.00 C ATOM 277 CD1 TYR A 709 22.187 -3.767 3.937 1.00 0.00 C ATOM 278 CD2 TYR A 709 24.197 -2.789 3.138 1.00 0.00 C ATOM 279 CE1 TYR A 709 21.988 -2.680 4.757 1.00 0.00 C ATOM 280 CE2 TYR A 709 23.993 -1.697 3.951 1.00 0.00 C ATOM 281 CZ TYR A 709 22.894 -1.653 4.758 1.00 0.00 C ATOM 282 OH TYR A 709 22.707 -0.577 5.585 1.00 0.00 O ATOM 0 H TYR A 709 24.245 -6.759 4.909 1.00 0.00 H new ATOM 0 HA TYR A 709 22.613 -6.534 3.416 1.00 0.00 H new ATOM 0 HB2 TYR A 709 24.509 -4.908 1.715 1.00 0.00 H new ATOM 0 HB3 TYR A 709 22.784 -5.088 1.461 1.00 0.00 H new ATOM 0 HD1 TYR A 709 21.465 -4.571 3.934 1.00 0.00 H new ATOM 0 HD2 TYR A 709 25.072 -2.823 2.506 1.00 0.00 H new ATOM 0 HE1 TYR A 709 21.120 -2.637 5.398 1.00 0.00 H new ATOM 0 HE2 TYR A 709 24.699 -0.880 3.950 1.00 0.00 H new ATOM 0 HH TYR A 709 22.417 -0.889 6.468 1.00 0.00 H new ATOM 292 N TYR A 710 23.704 -8.745 2.478 1.00 0.00 N ATOM 293 CA TYR A 710 23.922 -9.964 1.732 1.00 0.00 C ATOM 294 C TYR A 710 22.876 -10.176 0.680 1.00 0.00 C ATOM 295 O TYR A 710 21.877 -9.460 0.614 1.00 0.00 O ATOM 296 CB TYR A 710 23.899 -11.168 2.659 1.00 0.00 C ATOM 297 CG TYR A 710 25.152 -11.413 3.429 1.00 0.00 C ATOM 298 CD1 TYR A 710 26.344 -11.494 2.772 1.00 0.00 C ATOM 299 CD2 TYR A 710 25.137 -11.608 4.797 1.00 0.00 C ATOM 300 CE1 TYR A 710 27.499 -11.754 3.420 1.00 0.00 C ATOM 301 CE2 TYR A 710 26.301 -11.884 5.479 1.00 0.00 C ATOM 302 CZ TYR A 710 27.489 -11.958 4.783 1.00 0.00 C ATOM 303 OH TYR A 710 28.665 -12.232 5.451 1.00 0.00 O ATOM 0 H TYR A 710 23.415 -8.905 3.443 1.00 0.00 H new ATOM 0 HA TYR A 710 24.896 -9.862 1.254 1.00 0.00 H new ATOM 0 HB2 TYR A 710 23.078 -11.044 3.365 1.00 0.00 H new ATOM 0 HB3 TYR A 710 23.679 -12.056 2.066 1.00 0.00 H new ATOM 0 HD1 TYR A 710 26.365 -11.346 1.702 1.00 0.00 H new ATOM 0 HD2 TYR A 710 24.204 -11.543 5.336 1.00 0.00 H new ATOM 0 HE1 TYR A 710 28.428 -11.802 2.872 1.00 0.00 H new ATOM 0 HE2 TYR A 710 26.284 -12.041 6.547 1.00 0.00 H new ATOM 0 HH TYR A 710 28.479 -12.347 6.406 1.00 0.00 H new ATOM 313 N TYR A 711 23.084 -11.174 -0.130 1.00 0.00 N ATOM 314 CA TYR A 711 22.087 -11.510 -1.117 1.00 0.00 C ATOM 315 C TYR A 711 20.907 -12.135 -0.454 1.00 0.00 C ATOM 316 O TYR A 711 21.044 -13.037 0.384 1.00 0.00 O ATOM 317 CB TYR A 711 22.601 -12.406 -2.214 1.00 0.00 C ATOM 318 CG TYR A 711 23.529 -11.724 -3.157 1.00 0.00 C ATOM 319 CD1 TYR A 711 24.813 -11.404 -2.788 1.00 0.00 C ATOM 320 CD2 TYR A 711 23.113 -11.402 -4.430 1.00 0.00 C ATOM 321 CE1 TYR A 711 25.660 -10.783 -3.660 1.00 0.00 C ATOM 322 CE2 TYR A 711 23.957 -10.778 -5.310 1.00 0.00 C ATOM 323 CZ TYR A 711 25.232 -10.471 -4.917 1.00 0.00 C ATOM 324 OH TYR A 711 26.096 -9.860 -5.792 1.00 0.00 O ATOM 0 H TYR A 711 23.917 -11.762 -0.132 1.00 0.00 H new ATOM 0 HA TYR A 711 21.799 -10.575 -1.597 1.00 0.00 H new ATOM 0 HB2 TYR A 711 23.113 -13.257 -1.766 1.00 0.00 H new ATOM 0 HB3 TYR A 711 21.754 -12.802 -2.774 1.00 0.00 H new ATOM 0 HD1 TYR A 711 25.157 -11.647 -1.794 1.00 0.00 H new ATOM 0 HD2 TYR A 711 22.107 -11.645 -4.739 1.00 0.00 H new ATOM 0 HE1 TYR A 711 26.667 -10.539 -3.355 1.00 0.00 H new ATOM 0 HE2 TYR A 711 23.620 -10.530 -6.306 1.00 0.00 H new ATOM 0 HH TYR A 711 25.641 -9.705 -6.646 1.00 0.00 H new ATOM 334 N GLY A 712 19.765 -11.654 -0.811 1.00 0.00 N ATOM 335 CA GLY A 712 18.563 -12.100 -0.217 1.00 0.00 C ATOM 336 C GLY A 712 18.139 -11.173 0.899 1.00 0.00 C ATOM 337 O GLY A 712 17.051 -11.325 1.455 1.00 0.00 O ATOM 0 H GLY A 712 19.644 -10.937 -1.527 1.00 0.00 H new ATOM 0 HA2 GLY A 712 17.777 -12.152 -0.971 1.00 0.00 H new ATOM 0 HA3 GLY A 712 18.698 -13.109 0.174 1.00 0.00 H new ATOM 341 N ASP A 713 19.001 -10.198 1.226 1.00 0.00 N ATOM 342 CA ASP A 713 18.709 -9.240 2.299 1.00 0.00 C ATOM 343 C ASP A 713 17.590 -8.364 1.849 1.00 0.00 C ATOM 344 O ASP A 713 17.366 -8.192 0.634 1.00 0.00 O ATOM 345 CB ASP A 713 19.888 -8.325 2.599 1.00 0.00 C ATOM 346 CG ASP A 713 20.009 -7.991 4.071 1.00 0.00 C ATOM 347 OD1 ASP A 713 19.198 -7.196 4.595 1.00 0.00 O ATOM 348 OD2 ASP A 713 20.914 -8.548 4.728 1.00 0.00 O ATOM 0 H ASP A 713 19.900 -10.054 0.765 1.00 0.00 H new ATOM 0 HA ASP A 713 18.470 -9.814 3.194 1.00 0.00 H new ATOM 0 HB2 ASP A 713 20.808 -8.803 2.262 1.00 0.00 H new ATOM 0 HB3 ASP A 713 19.781 -7.402 2.029 1.00 0.00 H new ATOM 353 N SER A 714 16.893 -7.813 2.762 1.00 0.00 N ATOM 354 CA SER A 714 15.792 -6.974 2.457 1.00 0.00 C ATOM 355 C SER A 714 15.683 -5.895 3.495 1.00 0.00 C ATOM 356 O SER A 714 15.969 -6.121 4.674 1.00 0.00 O ATOM 357 CB SER A 714 14.515 -7.774 2.408 1.00 0.00 C ATOM 358 OG SER A 714 14.643 -8.884 1.512 1.00 0.00 O ATOM 0 H SER A 714 17.069 -7.930 3.760 1.00 0.00 H new ATOM 0 HA SER A 714 15.952 -6.522 1.478 1.00 0.00 H new ATOM 0 HB2 SER A 714 14.268 -8.134 3.407 1.00 0.00 H new ATOM 0 HB3 SER A 714 13.693 -7.135 2.087 1.00 0.00 H new ATOM 0 HG SER A 714 13.804 -9.390 1.496 1.00 0.00 H new ATOM 364 N VAL A 715 15.278 -4.736 3.075 1.00 0.00 N ATOM 365 CA VAL A 715 15.203 -3.601 3.960 1.00 0.00 C ATOM 366 C VAL A 715 13.868 -2.917 3.805 1.00 0.00 C ATOM 367 O VAL A 715 13.418 -2.714 2.687 1.00 0.00 O ATOM 368 CB VAL A 715 16.312 -2.579 3.630 1.00 0.00 C ATOM 369 CG1 VAL A 715 16.296 -1.419 4.611 1.00 0.00 C ATOM 370 CG2 VAL A 715 17.671 -3.245 3.605 1.00 0.00 C ATOM 0 H VAL A 715 14.990 -4.544 2.115 1.00 0.00 H new ATOM 0 HA VAL A 715 15.329 -3.961 4.981 1.00 0.00 H new ATOM 0 HB VAL A 715 16.113 -2.180 2.636 1.00 0.00 H new ATOM 0 HG11 VAL A 715 17.087 -0.715 4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 715 15.331 -0.914 4.562 1.00 0.00 H new ATOM 0 HG13 VAL A 715 16.458 -1.795 5.621 1.00 0.00 H new ATOM 0 HG21 VAL A 715 18.435 -2.504 3.370 1.00 0.00 H new ATOM 0 HG22 VAL A 715 17.879 -3.684 4.581 1.00 0.00 H new ATOM 0 HG23 VAL A 715 17.679 -4.027 2.846 1.00 0.00 H new ATOM 380 N GLU A 716 13.248 -2.582 4.914 1.00 0.00 N ATOM 381 CA GLU A 716 11.995 -1.864 4.902 1.00 0.00 C ATOM 382 C GLU A 716 12.203 -0.374 4.670 1.00 0.00 C ATOM 383 O GLU A 716 13.065 0.264 5.294 1.00 0.00 O ATOM 384 CB GLU A 716 11.202 -2.086 6.180 1.00 0.00 C ATOM 385 CG GLU A 716 10.641 -3.480 6.329 1.00 0.00 C ATOM 386 CD GLU A 716 9.828 -3.624 7.585 1.00 0.00 C ATOM 387 OE1 GLU A 716 8.672 -3.188 7.614 1.00 0.00 O ATOM 388 OE2 GLU A 716 10.328 -4.192 8.570 1.00 0.00 O ATOM 0 H GLU A 716 13.598 -2.799 5.847 1.00 0.00 H new ATOM 0 HA GLU A 716 11.418 -2.265 4.069 1.00 0.00 H new ATOM 0 HB2 GLU A 716 11.845 -1.872 7.034 1.00 0.00 H new ATOM 0 HB3 GLU A 716 10.380 -1.371 6.213 1.00 0.00 H new ATOM 0 HG2 GLU A 716 10.020 -3.716 5.465 1.00 0.00 H new ATOM 0 HG3 GLU A 716 11.458 -4.201 6.340 1.00 0.00 H new ATOM 395 N PHE A 717 11.407 0.151 3.790 1.00 0.00 N ATOM 396 CA PHE A 717 11.393 1.545 3.398 1.00 0.00 C ATOM 397 C PHE A 717 9.950 1.962 3.279 1.00 0.00 C ATOM 398 O PHE A 717 9.176 1.279 2.634 1.00 0.00 O ATOM 399 CB PHE A 717 12.060 1.729 2.030 1.00 0.00 C ATOM 400 CG PHE A 717 13.561 1.803 1.994 1.00 0.00 C ATOM 401 CD1 PHE A 717 14.345 0.687 2.171 1.00 0.00 C ATOM 402 CD2 PHE A 717 14.179 3.012 1.740 1.00 0.00 C ATOM 403 CE1 PHE A 717 15.722 0.781 2.102 1.00 0.00 C ATOM 404 CE2 PHE A 717 15.549 3.111 1.662 1.00 0.00 C ATOM 405 CZ PHE A 717 16.322 1.992 1.844 1.00 0.00 C ATOM 0 H PHE A 717 10.709 -0.403 3.294 1.00 0.00 H new ATOM 0 HA PHE A 717 11.932 2.140 4.135 1.00 0.00 H new ATOM 0 HB2 PHE A 717 11.749 0.903 1.390 1.00 0.00 H new ATOM 0 HB3 PHE A 717 11.667 2.643 1.585 1.00 0.00 H new ATOM 0 HD1 PHE A 717 13.882 -0.269 2.365 1.00 0.00 H new ATOM 0 HD2 PHE A 717 13.575 3.896 1.600 1.00 0.00 H new ATOM 0 HE1 PHE A 717 16.329 -0.099 2.251 1.00 0.00 H new ATOM 0 HE2 PHE A 717 16.014 4.064 1.459 1.00 0.00 H new ATOM 0 HZ PHE A 717 17.398 2.062 1.785 1.00 0.00 H new ATOM 415 N ASN A 718 9.585 3.047 3.890 1.00 0.00 N ATOM 416 CA ASN A 718 8.215 3.508 3.837 1.00 0.00 C ATOM 417 C ASN A 718 8.244 4.997 3.636 1.00 0.00 C ATOM 418 O ASN A 718 9.276 5.569 3.300 1.00 0.00 O ATOM 419 CB ASN A 718 7.447 3.223 5.147 1.00 0.00 C ATOM 420 CG ASN A 718 7.566 1.824 5.692 1.00 0.00 C ATOM 421 OD1 ASN A 718 8.403 1.683 6.670 1.00 0.00 O flip ATOM 422 ND2 ASN A 718 6.843 0.919 5.309 1.00 0.00 N flip ATOM 0 H ASN A 718 10.213 3.638 4.435 1.00 0.00 H new ATOM 0 HA ASN A 718 7.709 2.982 3.027 1.00 0.00 H new ATOM 0 HB2 ASN A 718 7.797 3.919 5.909 1.00 0.00 H new ATOM 0 HB3 ASN A 718 6.392 3.438 4.980 1.00 0.00 H new ATOM 0 HD21 ASN A 718 6.198 1.075 4.534 1.00 0.00 H new ATOM 0 HD22 ASN A 718 6.883 0.007 5.764 1.00 0.00 H new ATOM 429 N CYS A 719 7.168 5.635 3.925 1.00 0.00 N ATOM 430 CA CYS A 719 7.065 7.051 3.755 1.00 0.00 C ATOM 431 C CYS A 719 6.806 7.586 5.117 1.00 0.00 C ATOM 432 O CYS A 719 5.953 7.048 5.835 1.00 0.00 O ATOM 433 CB CYS A 719 5.938 7.380 2.773 1.00 0.00 C ATOM 434 SG CYS A 719 6.007 6.310 1.303 1.00 0.00 S ATOM 0 H CYS A 719 6.324 5.192 4.289 1.00 0.00 H new ATOM 0 HA CYS A 719 7.965 7.497 3.332 1.00 0.00 H new ATOM 0 HB2 CYS A 719 4.975 7.259 3.268 1.00 0.00 H new ATOM 0 HB3 CYS A 719 6.011 8.424 2.469 1.00 0.00 H new ATOM 439 N SER A 720 7.537 8.585 5.482 1.00 0.00 N ATOM 440 CA SER A 720 7.533 9.082 6.839 1.00 0.00 C ATOM 441 C SER A 720 6.179 9.706 7.183 1.00 0.00 C ATOM 442 O SER A 720 5.339 9.083 7.852 1.00 0.00 O ATOM 443 CB SER A 720 8.684 10.090 7.032 1.00 0.00 C ATOM 444 OG SER A 720 8.852 10.454 8.393 1.00 0.00 O ATOM 0 H SER A 720 8.161 9.090 4.853 1.00 0.00 H new ATOM 0 HA SER A 720 7.691 8.248 7.523 1.00 0.00 H new ATOM 0 HB2 SER A 720 9.611 9.657 6.656 1.00 0.00 H new ATOM 0 HB3 SER A 720 8.486 10.984 6.440 1.00 0.00 H new ATOM 0 HG SER A 720 9.367 9.760 8.856 1.00 0.00 H new ATOM 450 N GLU A 721 5.949 10.885 6.675 1.00 0.00 N ATOM 451 CA GLU A 721 4.748 11.637 6.910 1.00 0.00 C ATOM 452 C GLU A 721 4.508 12.455 5.681 1.00 0.00 C ATOM 453 O GLU A 721 5.462 12.703 4.942 1.00 0.00 O ATOM 454 CB GLU A 721 4.915 12.563 8.130 1.00 0.00 C ATOM 455 CG GLU A 721 5.061 11.831 9.457 1.00 0.00 C ATOM 456 CD GLU A 721 5.359 12.744 10.603 1.00 0.00 C ATOM 457 OE1 GLU A 721 4.476 13.524 10.998 1.00 0.00 O ATOM 458 OE2 GLU A 721 6.473 12.683 11.158 1.00 0.00 O ATOM 0 H GLU A 721 6.613 11.364 6.067 1.00 0.00 H new ATOM 0 HA GLU A 721 3.911 10.970 7.117 1.00 0.00 H new ATOM 0 HB2 GLU A 721 5.792 13.192 7.977 1.00 0.00 H new ATOM 0 HB3 GLU A 721 4.053 13.227 8.188 1.00 0.00 H new ATOM 0 HG2 GLU A 721 4.142 11.284 9.666 1.00 0.00 H new ATOM 0 HG3 GLU A 721 5.859 11.093 9.372 1.00 0.00 H new ATOM 465 N SER A 722 3.240 12.789 5.413 1.00 0.00 N ATOM 466 CA SER A 722 2.834 13.644 4.284 1.00 0.00 C ATOM 467 C SER A 722 2.945 12.935 2.936 1.00 0.00 C ATOM 468 O SER A 722 2.683 13.519 1.875 1.00 0.00 O ATOM 469 CB SER A 722 3.658 14.905 4.273 1.00 0.00 C ATOM 470 OG SER A 722 3.424 15.697 5.437 1.00 0.00 O ATOM 0 H SER A 722 2.454 12.470 5.980 1.00 0.00 H new ATOM 0 HA SER A 722 1.782 13.888 4.429 1.00 0.00 H new ATOM 0 HB2 SER A 722 4.716 14.648 4.214 1.00 0.00 H new ATOM 0 HB3 SER A 722 3.421 15.487 3.383 1.00 0.00 H new ATOM 0 HG SER A 722 3.975 16.506 5.398 1.00 0.00 H new ATOM 476 N PHE A 723 3.318 11.699 2.992 1.00 0.00 N ATOM 477 CA PHE A 723 3.501 10.886 1.868 1.00 0.00 C ATOM 478 C PHE A 723 2.941 9.539 2.173 1.00 0.00 C ATOM 479 O PHE A 723 3.032 9.043 3.310 1.00 0.00 O ATOM 480 CB PHE A 723 4.979 10.768 1.478 1.00 0.00 C ATOM 481 CG PHE A 723 5.619 12.068 1.090 1.00 0.00 C ATOM 482 CD1 PHE A 723 5.457 12.577 -0.177 1.00 0.00 C ATOM 483 CD2 PHE A 723 6.376 12.778 1.998 1.00 0.00 C ATOM 484 CE1 PHE A 723 6.042 13.776 -0.535 1.00 0.00 C ATOM 485 CE2 PHE A 723 6.964 13.970 1.654 1.00 0.00 C ATOM 486 CZ PHE A 723 6.797 14.474 0.383 1.00 0.00 C ATOM 0 H PHE A 723 3.509 11.220 3.872 1.00 0.00 H new ATOM 0 HA PHE A 723 2.986 11.336 1.019 1.00 0.00 H new ATOM 0 HB2 PHE A 723 5.531 10.340 2.315 1.00 0.00 H new ATOM 0 HB3 PHE A 723 5.069 10.069 0.646 1.00 0.00 H new ATOM 0 HD1 PHE A 723 4.866 12.034 -0.900 1.00 0.00 H new ATOM 0 HD2 PHE A 723 6.509 12.390 2.997 1.00 0.00 H new ATOM 0 HE1 PHE A 723 5.908 14.166 -1.533 1.00 0.00 H new ATOM 0 HE2 PHE A 723 7.556 14.511 2.378 1.00 0.00 H new ATOM 0 HZ PHE A 723 7.256 15.412 0.107 1.00 0.00 H new ATOM 496 N THR A 724 2.406 8.979 1.185 1.00 0.00 N ATOM 497 CA THR A 724 1.763 7.722 1.221 1.00 0.00 C ATOM 498 C THR A 724 2.631 6.659 0.524 1.00 0.00 C ATOM 499 O THR A 724 3.209 6.916 -0.551 1.00 0.00 O ATOM 500 CB THR A 724 0.340 7.832 0.573 1.00 0.00 C ATOM 501 OG1 THR A 724 -0.655 8.147 1.540 1.00 0.00 O ATOM 502 CG2 THR A 724 -0.024 6.601 -0.166 1.00 0.00 C ATOM 0 H THR A 724 2.396 9.403 0.257 1.00 0.00 H new ATOM 0 HA THR A 724 1.634 7.409 2.257 1.00 0.00 H new ATOM 0 HB THR A 724 0.385 8.652 -0.144 1.00 0.00 H new ATOM 0 HG1 THR A 724 -1.512 7.760 1.265 1.00 0.00 H new ATOM 0 HG21 THR A 724 -1.017 6.717 -0.600 1.00 0.00 H new ATOM 0 HG22 THR A 724 0.701 6.426 -0.961 1.00 0.00 H new ATOM 0 HG23 THR A 724 -0.024 5.753 0.518 1.00 0.00 H new ATOM 510 N MET A 725 2.717 5.499 1.156 1.00 0.00 N ATOM 511 CA MET A 725 3.480 4.377 0.684 1.00 0.00 C ATOM 512 C MET A 725 2.665 3.591 -0.298 1.00 0.00 C ATOM 513 O MET A 725 1.586 3.073 0.035 1.00 0.00 O ATOM 514 CB MET A 725 3.839 3.452 1.839 1.00 0.00 C ATOM 515 CG MET A 725 4.733 2.284 1.448 1.00 0.00 C ATOM 516 SD MET A 725 4.303 0.773 2.331 1.00 0.00 S ATOM 517 CE MET A 725 2.799 0.299 1.472 1.00 0.00 C ATOM 0 H MET A 725 2.239 5.317 2.038 1.00 0.00 H new ATOM 0 HA MET A 725 4.388 4.757 0.216 1.00 0.00 H new ATOM 0 HB2 MET A 725 4.338 4.034 2.614 1.00 0.00 H new ATOM 0 HB3 MET A 725 2.920 3.061 2.276 1.00 0.00 H new ATOM 0 HG2 MET A 725 4.653 2.111 0.375 1.00 0.00 H new ATOM 0 HG3 MET A 725 5.773 2.540 1.653 1.00 0.00 H new ATOM 0 HE1 MET A 725 2.526 -0.718 1.752 1.00 0.00 H new ATOM 0 HE2 MET A 725 1.993 0.980 1.747 1.00 0.00 H new ATOM 0 HE3 MET A 725 2.964 0.348 0.396 1.00 0.00 H new ATOM 527 N ILE A 726 3.157 3.520 -1.474 1.00 0.00 N ATOM 528 CA ILE A 726 2.541 2.772 -2.539 1.00 0.00 C ATOM 529 C ILE A 726 3.557 1.811 -3.159 1.00 0.00 C ATOM 530 O ILE A 726 4.753 2.119 -3.240 1.00 0.00 O ATOM 531 CB ILE A 726 1.966 3.733 -3.638 1.00 0.00 C ATOM 532 CG1 ILE A 726 0.910 4.662 -3.033 1.00 0.00 C ATOM 533 CG2 ILE A 726 1.376 2.965 -4.825 1.00 0.00 C ATOM 534 CD1 ILE A 726 -0.282 3.929 -2.431 1.00 0.00 C ATOM 0 H ILE A 726 4.022 3.987 -1.747 1.00 0.00 H new ATOM 0 HA ILE A 726 1.714 2.198 -2.122 1.00 0.00 H new ATOM 0 HB ILE A 726 2.798 4.328 -4.015 1.00 0.00 H new ATOM 0 HG12 ILE A 726 1.377 5.273 -2.260 1.00 0.00 H new ATOM 0 HG13 ILE A 726 0.553 5.343 -3.806 1.00 0.00 H new ATOM 0 HG21 ILE A 726 0.990 3.671 -5.560 1.00 0.00 H new ATOM 0 HG22 ILE A 726 2.152 2.352 -5.283 1.00 0.00 H new ATOM 0 HG23 ILE A 726 0.565 2.325 -4.477 1.00 0.00 H new ATOM 0 HD11 ILE A 726 -0.986 4.654 -2.023 1.00 0.00 H new ATOM 0 HD12 ILE A 726 -0.775 3.340 -3.204 1.00 0.00 H new ATOM 0 HD13 ILE A 726 0.061 3.268 -1.635 1.00 0.00 H new ATOM 546 N GLY A 727 3.096 0.633 -3.506 1.00 0.00 N ATOM 547 CA GLY A 727 3.904 -0.307 -4.245 1.00 0.00 C ATOM 548 C GLY A 727 4.388 -1.461 -3.413 1.00 0.00 C ATOM 549 O GLY A 727 3.960 -2.602 -3.602 1.00 0.00 O ATOM 0 H GLY A 727 2.157 0.301 -3.286 1.00 0.00 H new ATOM 0 HA2 GLY A 727 3.325 -0.692 -5.084 1.00 0.00 H new ATOM 0 HA3 GLY A 727 4.764 0.215 -4.664 1.00 0.00 H new ATOM 553 N HIS A 728 5.236 -1.166 -2.478 1.00 0.00 N ATOM 554 CA HIS A 728 5.874 -2.166 -1.641 1.00 0.00 C ATOM 555 C HIS A 728 6.464 -1.374 -0.513 1.00 0.00 C ATOM 556 O HIS A 728 6.258 -0.175 -0.480 1.00 0.00 O ATOM 557 CB HIS A 728 6.983 -2.862 -2.479 1.00 0.00 C ATOM 558 CG HIS A 728 7.397 -4.252 -2.069 1.00 0.00 C ATOM 559 ND1 HIS A 728 8.548 -4.708 -1.542 1.00 0.00 N flip ATOM 560 CD2 HIS A 728 6.607 -5.364 -2.247 1.00 0.00 C flip ATOM 561 CE1 HIS A 728 8.433 -6.059 -1.414 1.00 0.00 C flip ATOM 562 NE2 HIS A 728 7.255 -6.431 -1.843 1.00 0.00 N flip ATOM 0 H HIS A 728 5.518 -0.210 -2.261 1.00 0.00 H new ATOM 0 HA HIS A 728 5.201 -2.941 -1.275 1.00 0.00 H new ATOM 0 HB2 HIS A 728 6.646 -2.903 -3.515 1.00 0.00 H new ATOM 0 HB3 HIS A 728 7.869 -2.227 -2.457 1.00 0.00 H new ATOM 0 HD1 HIS A 728 9.359 -4.145 -1.285 1.00 0.00 H new ATOM 0 HD2 HIS A 728 5.608 -5.359 -2.656 1.00 0.00 H new ATOM 0 HE1 HIS A 728 9.193 -6.718 -1.021 1.00 0.00 H new ATOM 571 N ARG A 729 7.156 -1.993 0.399 1.00 0.00 N ATOM 572 CA ARG A 729 7.812 -1.235 1.476 1.00 0.00 C ATOM 573 C ARG A 729 9.138 -1.847 1.824 1.00 0.00 C ATOM 574 O ARG A 729 9.644 -1.684 2.921 1.00 0.00 O ATOM 575 CB ARG A 729 6.943 -1.087 2.763 1.00 0.00 C ATOM 576 CG ARG A 729 6.534 -2.370 3.477 1.00 0.00 C ATOM 577 CD ARG A 729 5.456 -3.091 2.722 1.00 0.00 C ATOM 578 NE ARG A 729 5.140 -4.391 3.313 1.00 0.00 N ATOM 579 CZ ARG A 729 3.984 -5.047 3.174 1.00 0.00 C ATOM 580 NH1 ARG A 729 3.012 -4.549 2.418 1.00 0.00 N ATOM 581 NH2 ARG A 729 3.820 -6.228 3.760 1.00 0.00 N ATOM 0 H ARG A 729 7.292 -3.003 0.438 1.00 0.00 H new ATOM 0 HA ARG A 729 7.957 -0.229 1.081 1.00 0.00 H new ATOM 0 HB2 ARG A 729 7.491 -0.466 3.471 1.00 0.00 H new ATOM 0 HB3 ARG A 729 6.036 -0.544 2.498 1.00 0.00 H new ATOM 0 HG2 ARG A 729 7.402 -3.020 3.587 1.00 0.00 H new ATOM 0 HG3 ARG A 729 6.183 -2.134 4.482 1.00 0.00 H new ATOM 0 HD2 ARG A 729 4.557 -2.476 2.701 1.00 0.00 H new ATOM 0 HD3 ARG A 729 5.771 -3.231 1.688 1.00 0.00 H new ATOM 0 HE ARG A 729 5.863 -4.835 3.879 1.00 0.00 H new ATOM 0 HH11 ARG A 729 3.145 -3.659 1.938 1.00 0.00 H new ATOM 0 HH12 ARG A 729 2.133 -5.057 2.318 1.00 0.00 H new ATOM 0 HH21 ARG A 729 4.575 -6.632 4.314 1.00 0.00 H new ATOM 0 HH22 ARG A 729 2.939 -6.731 3.656 1.00 0.00 H new ATOM 595 N SER A 730 9.723 -2.530 0.898 1.00 0.00 N ATOM 596 CA SER A 730 10.982 -3.181 1.153 1.00 0.00 C ATOM 597 C SER A 730 11.751 -3.309 -0.119 1.00 0.00 C ATOM 598 O SER A 730 11.199 -3.121 -1.212 1.00 0.00 O ATOM 599 CB SER A 730 10.767 -4.572 1.791 1.00 0.00 C ATOM 600 OG SER A 730 9.915 -4.490 2.935 1.00 0.00 O ATOM 0 H SER A 730 9.357 -2.657 -0.045 1.00 0.00 H new ATOM 0 HA SER A 730 11.550 -2.572 1.856 1.00 0.00 H new ATOM 0 HB2 SER A 730 10.330 -5.248 1.056 1.00 0.00 H new ATOM 0 HB3 SER A 730 11.729 -4.995 2.080 1.00 0.00 H new ATOM 0 HG SER A 730 9.795 -5.384 3.318 1.00 0.00 H new ATOM 606 N ILE A 731 13.008 -3.568 0.023 1.00 0.00 N ATOM 607 CA ILE A 731 13.874 -3.791 -1.088 1.00 0.00 C ATOM 608 C ILE A 731 14.558 -5.113 -0.908 1.00 0.00 C ATOM 609 O ILE A 731 14.559 -5.639 0.189 1.00 0.00 O ATOM 610 CB ILE A 731 14.933 -2.691 -1.229 1.00 0.00 C ATOM 611 CG1 ILE A 731 15.780 -2.595 0.035 1.00 0.00 C ATOM 612 CG2 ILE A 731 14.269 -1.371 -1.521 1.00 0.00 C ATOM 613 CD1 ILE A 731 16.865 -1.569 -0.040 1.00 0.00 C ATOM 0 H ILE A 731 13.471 -3.632 0.930 1.00 0.00 H new ATOM 0 HA ILE A 731 13.268 -3.782 -1.994 1.00 0.00 H new ATOM 0 HB ILE A 731 15.591 -2.945 -2.060 1.00 0.00 H new ATOM 0 HG12 ILE A 731 15.131 -2.362 0.879 1.00 0.00 H new ATOM 0 HG13 ILE A 731 16.227 -3.569 0.236 1.00 0.00 H new ATOM 0 HG21 ILE A 731 15.029 -0.596 -1.620 1.00 0.00 H new ATOM 0 HG22 ILE A 731 13.704 -1.446 -2.450 1.00 0.00 H new ATOM 0 HG23 ILE A 731 13.593 -1.115 -0.705 1.00 0.00 H new ATOM 0 HD11 ILE A 731 17.423 -1.561 0.896 1.00 0.00 H new ATOM 0 HD12 ILE A 731 17.539 -1.811 -0.862 1.00 0.00 H new ATOM 0 HD13 ILE A 731 16.425 -0.586 -0.209 1.00 0.00 H new ATOM 625 N THR A 732 15.124 -5.641 -1.952 1.00 0.00 N ATOM 626 CA THR A 732 15.804 -6.923 -1.868 1.00 0.00 C ATOM 627 C THR A 732 17.125 -6.894 -2.629 1.00 0.00 C ATOM 628 O THR A 732 17.192 -6.380 -3.723 1.00 0.00 O ATOM 629 CB THR A 732 14.910 -8.060 -2.418 1.00 0.00 C ATOM 630 OG1 THR A 732 13.589 -7.958 -1.824 1.00 0.00 O ATOM 631 CG2 THR A 732 15.494 -9.417 -2.051 1.00 0.00 C ATOM 0 H THR A 732 15.135 -5.213 -2.878 1.00 0.00 H new ATOM 0 HA THR A 732 16.011 -7.115 -0.815 1.00 0.00 H new ATOM 0 HB THR A 732 14.854 -7.967 -3.503 1.00 0.00 H new ATOM 0 HG1 THR A 732 13.018 -8.675 -2.170 1.00 0.00 H new ATOM 0 HG21 THR A 732 14.854 -10.207 -2.445 1.00 0.00 H new ATOM 0 HG22 THR A 732 16.492 -9.511 -2.479 1.00 0.00 H new ATOM 0 HG23 THR A 732 15.554 -9.506 -0.966 1.00 0.00 H new ATOM 639 N CYS A 733 18.161 -7.403 -2.017 1.00 0.00 N ATOM 640 CA CYS A 733 19.455 -7.496 -2.655 1.00 0.00 C ATOM 641 C CYS A 733 19.543 -8.777 -3.439 1.00 0.00 C ATOM 642 O CYS A 733 19.626 -9.867 -2.867 1.00 0.00 O ATOM 643 CB CYS A 733 20.589 -7.390 -1.628 1.00 0.00 C ATOM 644 SG CYS A 733 22.231 -7.968 -2.208 1.00 0.00 S ATOM 0 H CYS A 733 18.136 -7.765 -1.064 1.00 0.00 H new ATOM 0 HA CYS A 733 19.568 -6.658 -3.343 1.00 0.00 H new ATOM 0 HB2 CYS A 733 20.678 -6.349 -1.316 1.00 0.00 H new ATOM 0 HB3 CYS A 733 20.311 -7.965 -0.744 1.00 0.00 H new ATOM 649 N ILE A 734 19.463 -8.644 -4.728 1.00 0.00 N ATOM 650 CA ILE A 734 19.515 -9.746 -5.642 1.00 0.00 C ATOM 651 C ILE A 734 20.315 -9.359 -6.879 1.00 0.00 C ATOM 652 O ILE A 734 20.265 -8.234 -7.314 1.00 0.00 O ATOM 653 CB ILE A 734 18.078 -10.299 -6.011 1.00 0.00 C ATOM 654 CG1 ILE A 734 16.995 -9.186 -6.108 1.00 0.00 C ATOM 655 CG2 ILE A 734 17.637 -11.384 -5.041 1.00 0.00 C ATOM 656 CD1 ILE A 734 17.207 -8.164 -7.198 1.00 0.00 C ATOM 0 H ILE A 734 19.357 -7.739 -5.187 1.00 0.00 H new ATOM 0 HA ILE A 734 20.027 -10.570 -5.144 1.00 0.00 H new ATOM 0 HB ILE A 734 18.175 -10.731 -7.007 1.00 0.00 H new ATOM 0 HG12 ILE A 734 16.025 -9.660 -6.262 1.00 0.00 H new ATOM 0 HG13 ILE A 734 16.947 -8.666 -5.151 1.00 0.00 H new ATOM 0 HG21 ILE A 734 16.647 -11.743 -5.322 1.00 0.00 H new ATOM 0 HG22 ILE A 734 18.346 -12.212 -5.074 1.00 0.00 H new ATOM 0 HG23 ILE A 734 17.602 -10.977 -4.031 1.00 0.00 H new ATOM 0 HD11 ILE A 734 16.396 -7.436 -7.177 1.00 0.00 H new ATOM 0 HD12 ILE A 734 18.157 -7.654 -7.039 1.00 0.00 H new ATOM 0 HD13 ILE A 734 17.221 -8.663 -8.167 1.00 0.00 H new ATOM 668 N HIS A 735 21.114 -10.274 -7.379 1.00 0.00 N ATOM 669 CA HIS A 735 21.956 -10.057 -8.588 1.00 0.00 C ATOM 670 C HIS A 735 22.969 -8.916 -8.444 1.00 0.00 C ATOM 671 O HIS A 735 23.567 -8.469 -9.430 1.00 0.00 O ATOM 672 CB HIS A 735 21.095 -9.871 -9.844 1.00 0.00 C ATOM 673 CG HIS A 735 20.546 -11.151 -10.382 1.00 0.00 C ATOM 674 ND1 HIS A 735 20.916 -11.680 -11.595 1.00 0.00 N ATOM 675 CD2 HIS A 735 19.635 -12.005 -9.870 1.00 0.00 C ATOM 676 CE1 HIS A 735 20.265 -12.796 -11.801 1.00 0.00 C ATOM 677 NE2 HIS A 735 19.480 -13.018 -10.773 1.00 0.00 N ATOM 0 H HIS A 735 21.216 -11.204 -6.973 1.00 0.00 H new ATOM 0 HA HIS A 735 22.545 -10.968 -8.698 1.00 0.00 H new ATOM 0 HB2 HIS A 735 20.269 -9.199 -9.613 1.00 0.00 H new ATOM 0 HB3 HIS A 735 21.693 -9.387 -10.617 1.00 0.00 H new ATOM 0 HD2 HIS A 735 19.124 -11.906 -8.924 1.00 0.00 H new ATOM 0 HE1 HIS A 735 20.358 -13.429 -12.671 1.00 0.00 H new ATOM 0 HE2 HIS A 735 18.855 -13.817 -10.666 1.00 0.00 H new ATOM 686 N GLY A 736 23.179 -8.473 -7.230 1.00 0.00 N ATOM 687 CA GLY A 736 24.128 -7.431 -6.970 1.00 0.00 C ATOM 688 C GLY A 736 23.508 -6.073 -7.064 1.00 0.00 C ATOM 689 O GLY A 736 24.189 -5.088 -7.342 1.00 0.00 O ATOM 0 H GLY A 736 22.698 -8.825 -6.402 1.00 0.00 H new ATOM 0 HA2 GLY A 736 24.553 -7.568 -5.976 1.00 0.00 H new ATOM 0 HA3 GLY A 736 24.951 -7.504 -7.681 1.00 0.00 H new ATOM 693 N VAL A 737 22.231 -6.012 -6.850 1.00 0.00 N ATOM 694 CA VAL A 737 21.514 -4.790 -6.884 1.00 0.00 C ATOM 695 C VAL A 737 20.300 -4.923 -5.982 1.00 0.00 C ATOM 696 O VAL A 737 19.781 -6.025 -5.793 1.00 0.00 O ATOM 697 CB VAL A 737 21.087 -4.424 -8.363 1.00 0.00 C ATOM 698 CG1 VAL A 737 20.194 -5.485 -8.986 1.00 0.00 C ATOM 699 CG2 VAL A 737 20.431 -3.049 -8.448 1.00 0.00 C ATOM 0 H VAL A 737 21.654 -6.827 -6.644 1.00 0.00 H new ATOM 0 HA VAL A 737 22.150 -3.980 -6.527 1.00 0.00 H new ATOM 0 HB VAL A 737 22.010 -4.389 -8.942 1.00 0.00 H new ATOM 0 HG11 VAL A 737 19.929 -5.187 -10.000 1.00 0.00 H new ATOM 0 HG12 VAL A 737 20.725 -6.437 -9.014 1.00 0.00 H new ATOM 0 HG13 VAL A 737 19.287 -5.593 -8.391 1.00 0.00 H new ATOM 0 HG21 VAL A 737 20.155 -2.841 -9.482 1.00 0.00 H new ATOM 0 HG22 VAL A 737 19.538 -3.033 -7.823 1.00 0.00 H new ATOM 0 HG23 VAL A 737 21.131 -2.290 -8.100 1.00 0.00 H new ATOM 709 N TRP A 738 19.938 -3.864 -5.332 1.00 0.00 N ATOM 710 CA TRP A 738 18.689 -3.840 -4.622 1.00 0.00 C ATOM 711 C TRP A 738 17.512 -3.759 -5.619 1.00 0.00 C ATOM 712 O TRP A 738 17.701 -3.733 -6.842 1.00 0.00 O ATOM 713 CB TRP A 738 18.635 -2.699 -3.621 1.00 0.00 C ATOM 714 CG TRP A 738 19.627 -2.802 -2.514 1.00 0.00 C ATOM 715 CD1 TRP A 738 20.827 -2.172 -2.442 1.00 0.00 C ATOM 716 CD2 TRP A 738 19.504 -3.566 -1.322 1.00 0.00 C ATOM 717 NE1 TRP A 738 21.454 -2.480 -1.276 1.00 0.00 N ATOM 718 CE2 TRP A 738 20.661 -3.342 -0.571 1.00 0.00 C ATOM 719 CE3 TRP A 738 18.523 -4.417 -0.812 1.00 0.00 C ATOM 720 CZ2 TRP A 738 20.859 -3.927 0.650 1.00 0.00 C ATOM 721 CZ3 TRP A 738 18.724 -5.003 0.415 1.00 0.00 C ATOM 722 CH2 TRP A 738 19.888 -4.751 1.133 1.00 0.00 C ATOM 0 H TRP A 738 20.484 -3.004 -5.275 1.00 0.00 H new ATOM 0 HA TRP A 738 18.605 -4.767 -4.056 1.00 0.00 H new ATOM 0 HB2 TRP A 738 18.796 -1.760 -4.150 1.00 0.00 H new ATOM 0 HB3 TRP A 738 17.634 -2.655 -3.192 1.00 0.00 H new ATOM 0 HD1 TRP A 738 21.227 -1.519 -3.203 1.00 0.00 H new ATOM 0 HE1 TRP A 738 22.363 -2.127 -0.977 1.00 0.00 H new ATOM 0 HE3 TRP A 738 17.620 -4.612 -1.372 1.00 0.00 H new ATOM 0 HZ2 TRP A 738 21.760 -3.741 1.215 1.00 0.00 H new ATOM 0 HZ3 TRP A 738 17.973 -5.663 0.824 1.00 0.00 H new ATOM 0 HH2 TRP A 738 20.025 -5.220 2.096 1.00 0.00 H new ATOM 733 N THR A 739 16.326 -3.717 -5.115 1.00 0.00 N ATOM 734 CA THR A 739 15.165 -3.738 -5.943 1.00 0.00 C ATOM 735 C THR A 739 14.676 -2.333 -6.345 1.00 0.00 C ATOM 736 O THR A 739 15.453 -1.373 -6.418 1.00 0.00 O ATOM 737 CB THR A 739 14.085 -4.592 -5.276 1.00 0.00 C ATOM 738 OG1 THR A 739 13.905 -4.176 -3.947 1.00 0.00 O ATOM 739 CG2 THR A 739 14.483 -6.056 -5.308 1.00 0.00 C ATOM 0 H THR A 739 16.132 -3.667 -4.115 1.00 0.00 H new ATOM 0 HA THR A 739 15.428 -4.201 -6.894 1.00 0.00 H new ATOM 0 HB THR A 739 13.149 -4.469 -5.821 1.00 0.00 H new ATOM 0 HG1 THR A 739 13.948 -3.198 -3.902 1.00 0.00 H new ATOM 0 HG21 THR A 739 13.707 -6.654 -4.831 1.00 0.00 H new ATOM 0 HG22 THR A 739 14.604 -6.378 -6.342 1.00 0.00 H new ATOM 0 HG23 THR A 739 15.424 -6.189 -4.774 1.00 0.00 H new ATOM 747 N GLN A 740 13.410 -2.239 -6.597 1.00 0.00 N ATOM 748 CA GLN A 740 12.781 -1.086 -7.205 1.00 0.00 C ATOM 749 C GLN A 740 12.489 0.034 -6.239 1.00 0.00 C ATOM 750 O GLN A 740 12.198 1.143 -6.685 1.00 0.00 O ATOM 751 CB GLN A 740 11.465 -1.499 -7.899 1.00 0.00 C ATOM 752 CG GLN A 740 10.368 -2.017 -6.949 1.00 0.00 C ATOM 753 CD GLN A 740 10.626 -3.386 -6.329 1.00 0.00 C ATOM 754 OE1 GLN A 740 11.300 -4.256 -7.043 1.00 0.00 O flip ATOM 755 NE2 GLN A 740 10.211 -3.657 -5.205 1.00 0.00 N flip ATOM 0 H GLN A 740 12.751 -2.987 -6.381 1.00 0.00 H new ATOM 0 HA GLN A 740 13.504 -0.706 -7.927 1.00 0.00 H new ATOM 0 HB2 GLN A 740 11.075 -0.641 -8.448 1.00 0.00 H new ATOM 0 HB3 GLN A 740 11.686 -2.274 -8.633 1.00 0.00 H new ATOM 0 HG2 GLN A 740 10.237 -1.293 -6.145 1.00 0.00 H new ATOM 0 HG3 GLN A 740 9.427 -2.058 -7.498 1.00 0.00 H new ATOM 0 HE21 GLN A 740 9.690 -2.961 -4.672 1.00 0.00 H new ATOM 0 HE22 GLN A 740 10.388 -4.578 -4.804 1.00 0.00 H new ATOM 764 N LEU A 741 12.544 -0.256 -4.934 1.00 0.00 N ATOM 765 CA LEU A 741 12.174 0.724 -3.874 1.00 0.00 C ATOM 766 C LEU A 741 10.650 0.962 -3.855 1.00 0.00 C ATOM 767 O LEU A 741 9.960 0.773 -4.876 1.00 0.00 O ATOM 768 CB LEU A 741 12.914 2.105 -4.024 1.00 0.00 C ATOM 769 CG LEU A 741 14.368 2.241 -3.533 1.00 0.00 C ATOM 770 CD1 LEU A 741 14.446 2.062 -2.031 1.00 0.00 C ATOM 771 CD2 LEU A 741 15.310 1.287 -4.255 1.00 0.00 C ATOM 0 H LEU A 741 12.841 -1.162 -4.573 1.00 0.00 H new ATOM 0 HA LEU A 741 12.494 0.280 -2.931 1.00 0.00 H new ATOM 0 HB2 LEU A 741 12.899 2.371 -5.081 1.00 0.00 H new ATOM 0 HB3 LEU A 741 12.320 2.853 -3.499 1.00 0.00 H new ATOM 0 HG LEU A 741 14.700 3.251 -3.774 1.00 0.00 H new ATOM 0 HD11 LEU A 741 15.482 2.162 -1.706 1.00 0.00 H new ATOM 0 HD12 LEU A 741 13.837 2.822 -1.542 1.00 0.00 H new ATOM 0 HD13 LEU A 741 14.075 1.073 -1.763 1.00 0.00 H new ATOM 0 HD21 LEU A 741 16.323 1.419 -3.875 1.00 0.00 H new ATOM 0 HD22 LEU A 741 14.989 0.260 -4.083 1.00 0.00 H new ATOM 0 HD23 LEU A 741 15.293 1.498 -5.324 1.00 0.00 H new ATOM 783 N PRO A 742 10.083 1.307 -2.699 1.00 0.00 N ATOM 784 CA PRO A 742 8.683 1.699 -2.612 1.00 0.00 C ATOM 785 C PRO A 742 8.464 3.074 -3.251 1.00 0.00 C ATOM 786 O PRO A 742 9.414 3.721 -3.719 1.00 0.00 O ATOM 787 CB PRO A 742 8.417 1.775 -1.116 1.00 0.00 C ATOM 788 CG PRO A 742 9.737 1.971 -0.496 1.00 0.00 C ATOM 789 CD PRO A 742 10.738 1.305 -1.384 1.00 0.00 C ATOM 0 HA PRO A 742 8.023 1.004 -3.131 1.00 0.00 H new ATOM 0 HB2 PRO A 742 7.744 2.599 -0.878 1.00 0.00 H new ATOM 0 HB3 PRO A 742 7.944 0.862 -0.754 1.00 0.00 H new ATOM 0 HG2 PRO A 742 9.960 3.033 -0.391 1.00 0.00 H new ATOM 0 HG3 PRO A 742 9.761 1.540 0.505 1.00 0.00 H new ATOM 0 HD2 PRO A 742 11.682 1.850 -1.405 1.00 0.00 H new ATOM 0 HD3 PRO A 742 10.962 0.292 -1.048 1.00 0.00 H new ATOM 797 N GLN A 743 7.256 3.514 -3.280 1.00 0.00 N ATOM 798 CA GLN A 743 6.946 4.775 -3.861 1.00 0.00 C ATOM 799 C GLN A 743 6.214 5.613 -2.853 1.00 0.00 C ATOM 800 O GLN A 743 5.282 5.140 -2.198 1.00 0.00 O ATOM 801 CB GLN A 743 6.132 4.582 -5.139 1.00 0.00 C ATOM 802 CG GLN A 743 5.821 5.861 -5.890 1.00 0.00 C ATOM 803 CD GLN A 743 5.243 5.575 -7.245 1.00 0.00 C ATOM 804 OE1 GLN A 743 5.983 5.432 -8.223 1.00 0.00 O ATOM 805 NE2 GLN A 743 3.946 5.492 -7.329 1.00 0.00 N ATOM 0 H GLN A 743 6.453 3.011 -2.902 1.00 0.00 H new ATOM 0 HA GLN A 743 7.863 5.294 -4.139 1.00 0.00 H new ATOM 0 HB2 GLN A 743 6.676 3.910 -5.803 1.00 0.00 H new ATOM 0 HB3 GLN A 743 5.194 4.088 -4.885 1.00 0.00 H new ATOM 0 HG2 GLN A 743 5.118 6.462 -5.313 1.00 0.00 H new ATOM 0 HG3 GLN A 743 6.731 6.451 -5.998 1.00 0.00 H new ATOM 0 HE21 GLN A 743 3.372 5.617 -6.495 1.00 0.00 H new ATOM 0 HE22 GLN A 743 3.504 5.302 -8.229 1.00 0.00 H new ATOM 814 N CYS A 744 6.631 6.829 -2.720 1.00 0.00 N ATOM 815 CA CYS A 744 6.046 7.716 -1.772 1.00 0.00 C ATOM 816 C CYS A 744 5.410 8.846 -2.471 1.00 0.00 C ATOM 817 O CYS A 744 6.083 9.723 -3.026 1.00 0.00 O ATOM 818 CB CYS A 744 7.065 8.210 -0.771 1.00 0.00 C ATOM 819 SG CYS A 744 7.676 6.922 0.329 1.00 0.00 S ATOM 0 H CYS A 744 7.389 7.236 -3.268 1.00 0.00 H new ATOM 0 HA CYS A 744 5.286 7.168 -1.216 1.00 0.00 H new ATOM 0 HB2 CYS A 744 7.907 8.648 -1.308 1.00 0.00 H new ATOM 0 HB3 CYS A 744 6.619 9.005 -0.174 1.00 0.00 H new ATOM 824 N VAL A 745 4.125 8.828 -2.486 1.00 0.00 N ATOM 825 CA VAL A 745 3.401 9.844 -3.133 1.00 0.00 C ATOM 826 C VAL A 745 2.981 10.831 -2.110 1.00 0.00 C ATOM 827 O VAL A 745 2.624 10.467 -1.013 1.00 0.00 O ATOM 828 CB VAL A 745 2.178 9.316 -3.920 1.00 0.00 C ATOM 829 CG1 VAL A 745 1.546 10.427 -4.761 1.00 0.00 C ATOM 830 CG2 VAL A 745 2.549 8.119 -4.791 1.00 0.00 C ATOM 0 H VAL A 745 3.553 8.106 -2.048 1.00 0.00 H new ATOM 0 HA VAL A 745 4.049 10.306 -3.878 1.00 0.00 H new ATOM 0 HB VAL A 745 1.440 8.979 -3.192 1.00 0.00 H new ATOM 0 HG11 VAL A 745 0.689 10.029 -5.304 1.00 0.00 H new ATOM 0 HG12 VAL A 745 1.218 11.236 -4.108 1.00 0.00 H new ATOM 0 HG13 VAL A 745 2.280 10.808 -5.471 1.00 0.00 H new ATOM 0 HG21 VAL A 745 1.667 7.774 -5.330 1.00 0.00 H new ATOM 0 HG22 VAL A 745 3.318 8.413 -5.505 1.00 0.00 H new ATOM 0 HG23 VAL A 745 2.928 7.314 -4.161 1.00 0.00 H new ATOM 840 N ALA A 746 3.004 12.063 -2.490 1.00 0.00 N ATOM 841 CA ALA A 746 2.703 13.224 -1.632 1.00 0.00 C ATOM 842 C ALA A 746 1.268 13.273 -1.172 1.00 0.00 C ATOM 843 O ALA A 746 0.836 14.249 -0.553 1.00 0.00 O ATOM 844 CB ALA A 746 3.005 14.472 -2.387 1.00 0.00 C ATOM 0 H ALA A 746 3.241 12.331 -3.445 1.00 0.00 H new ATOM 0 HA ALA A 746 3.323 13.130 -0.740 1.00 0.00 H new ATOM 0 HB1 ALA A 746 2.786 15.338 -1.762 1.00 0.00 H new ATOM 0 HB2 ALA A 746 4.059 14.483 -2.665 1.00 0.00 H new ATOM 0 HB3 ALA A 746 2.392 14.510 -3.287 1.00 0.00 H new ATOM 850 N ILE A 747 0.531 12.269 -1.568 1.00 0.00 N ATOM 851 CA ILE A 747 -0.857 12.056 -1.214 1.00 0.00 C ATOM 852 C ILE A 747 -1.785 12.938 -2.065 1.00 0.00 C ATOM 853 O ILE A 747 -2.942 12.613 -2.305 1.00 0.00 O ATOM 854 CB ILE A 747 -1.023 12.277 0.294 1.00 0.00 C ATOM 855 CG1 ILE A 747 -0.484 11.106 1.098 1.00 0.00 C ATOM 856 CG2 ILE A 747 -2.418 12.689 0.721 1.00 0.00 C ATOM 857 CD1 ILE A 747 -0.512 11.306 2.605 1.00 0.00 C ATOM 0 H ILE A 747 0.897 11.538 -2.178 1.00 0.00 H new ATOM 0 HA ILE A 747 -1.150 11.029 -1.434 1.00 0.00 H new ATOM 0 HB ILE A 747 -0.406 13.145 0.527 1.00 0.00 H new ATOM 0 HG12 ILE A 747 -1.063 10.216 0.852 1.00 0.00 H new ATOM 0 HG13 ILE A 747 0.543 10.913 0.789 1.00 0.00 H new ATOM 0 HG21 ILE A 747 -2.443 12.823 1.802 1.00 0.00 H new ATOM 0 HG22 ILE A 747 -2.686 13.626 0.233 1.00 0.00 H new ATOM 0 HG23 ILE A 747 -3.130 11.915 0.435 1.00 0.00 H new ATOM 0 HD11 ILE A 747 -0.109 10.421 3.097 1.00 0.00 H new ATOM 0 HD12 ILE A 747 0.092 12.174 2.868 1.00 0.00 H new ATOM 0 HD13 ILE A 747 -1.539 11.467 2.932 1.00 0.00 H new ATOM 869 N ASP A 748 -1.196 13.956 -2.621 1.00 0.00 N ATOM 870 CA ASP A 748 -1.857 14.942 -3.438 1.00 0.00 C ATOM 871 C ASP A 748 -2.212 14.331 -4.748 1.00 0.00 C ATOM 872 O ASP A 748 -3.267 14.576 -5.321 1.00 0.00 O ATOM 873 CB ASP A 748 -0.870 16.080 -3.667 1.00 0.00 C ATOM 874 CG ASP A 748 -1.262 17.016 -4.790 1.00 0.00 C ATOM 875 OD1 ASP A 748 -2.100 17.900 -4.575 1.00 0.00 O ATOM 876 OD2 ASP A 748 -0.692 16.889 -5.910 1.00 0.00 O ATOM 0 H ASP A 748 -0.197 14.133 -2.515 1.00 0.00 H new ATOM 0 HA ASP A 748 -2.764 15.305 -2.954 1.00 0.00 H new ATOM 0 HB2 ASP A 748 -0.773 16.654 -2.746 1.00 0.00 H new ATOM 0 HB3 ASP A 748 0.111 15.658 -3.885 1.00 0.00 H new ATOM 881 N LYS A 749 -1.345 13.458 -5.158 1.00 0.00 N ATOM 882 CA LYS A 749 -1.395 12.842 -6.463 1.00 0.00 C ATOM 883 C LYS A 749 -2.027 11.488 -6.353 1.00 0.00 C ATOM 884 O LYS A 749 -1.900 10.639 -7.234 1.00 0.00 O ATOM 885 CB LYS A 749 0.024 12.745 -6.980 1.00 0.00 C ATOM 886 CG LYS A 749 0.838 13.901 -6.473 1.00 0.00 C ATOM 887 CD LYS A 749 2.078 14.165 -7.298 1.00 0.00 C ATOM 888 CE LYS A 749 2.675 15.524 -6.958 1.00 0.00 C ATOM 889 NZ LYS A 749 1.715 16.625 -7.240 1.00 0.00 N ATOM 0 H LYS A 749 -0.561 13.141 -4.587 1.00 0.00 H new ATOM 0 HA LYS A 749 -1.995 13.432 -7.156 1.00 0.00 H new ATOM 0 HB2 LYS A 749 0.473 11.805 -6.659 1.00 0.00 H new ATOM 0 HB3 LYS A 749 0.023 12.741 -8.070 1.00 0.00 H new ATOM 0 HG2 LYS A 749 0.218 14.797 -6.464 1.00 0.00 H new ATOM 0 HG3 LYS A 749 1.131 13.706 -5.441 1.00 0.00 H new ATOM 0 HD2 LYS A 749 2.815 13.383 -7.115 1.00 0.00 H new ATOM 0 HD3 LYS A 749 1.829 14.127 -8.359 1.00 0.00 H new ATOM 0 HE2 LYS A 749 2.957 15.546 -5.905 1.00 0.00 H new ATOM 0 HE3 LYS A 749 3.587 15.677 -7.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 749 2.221 17.534 -7.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 749 1.272 16.470 -8.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 749 0.980 16.641 -6.505 1.00 0.00 H new ATOM 903 N LEU A 750 -2.707 11.298 -5.258 1.00 0.00 N ATOM 904 CA LEU A 750 -3.413 10.114 -5.015 1.00 0.00 C ATOM 905 C LEU A 750 -4.753 10.150 -5.695 1.00 0.00 C ATOM 906 O LEU A 750 -5.083 11.086 -6.422 1.00 0.00 O ATOM 907 CB LEU A 750 -3.543 9.814 -3.512 1.00 0.00 C ATOM 908 CG LEU A 750 -2.598 8.775 -2.992 1.00 0.00 C ATOM 909 CD1 LEU A 750 -1.244 8.924 -3.511 1.00 0.00 C ATOM 910 CD2 LEU A 750 -2.530 8.797 -1.546 1.00 0.00 C ATOM 0 H LEU A 750 -2.775 11.986 -4.508 1.00 0.00 H new ATOM 0 HA LEU A 750 -2.839 9.292 -5.443 1.00 0.00 H new ATOM 0 HB2 LEU A 750 -3.385 10.739 -2.957 1.00 0.00 H new ATOM 0 HB3 LEU A 750 -4.564 9.491 -3.308 1.00 0.00 H new ATOM 0 HG LEU A 750 -3.002 7.824 -3.339 1.00 0.00 H new ATOM 0 HD11 LEU A 750 -0.608 8.142 -3.097 1.00 0.00 H new ATOM 0 HD12 LEU A 750 -1.260 8.842 -4.598 1.00 0.00 H new ATOM 0 HD13 LEU A 750 -0.851 9.900 -3.227 1.00 0.00 H new ATOM 0 HD21 LEU A 750 -1.835 8.030 -1.203 1.00 0.00 H new ATOM 0 HD22 LEU A 750 -2.184 9.776 -1.213 1.00 0.00 H new ATOM 0 HD23 LEU A 750 -3.519 8.602 -1.132 1.00 0.00 H new ATOM 922 N LYS A 751 -5.518 9.167 -5.436 1.00 0.00 N ATOM 923 CA LYS A 751 -6.768 8.973 -6.054 1.00 0.00 C ATOM 924 C LYS A 751 -7.752 8.569 -4.989 1.00 0.00 C ATOM 925 O LYS A 751 -7.393 8.442 -3.800 1.00 0.00 O ATOM 926 CB LYS A 751 -6.649 7.851 -7.116 1.00 0.00 C ATOM 927 CG LYS A 751 -5.698 8.146 -8.284 1.00 0.00 C ATOM 928 CD LYS A 751 -6.398 8.690 -9.533 1.00 0.00 C ATOM 929 CE LYS A 751 -7.418 9.757 -9.218 1.00 0.00 C ATOM 930 NZ LYS A 751 -7.834 10.498 -10.421 1.00 0.00 N ATOM 0 H LYS A 751 -5.282 8.442 -4.758 1.00 0.00 H new ATOM 0 HA LYS A 751 -7.100 9.887 -6.547 1.00 0.00 H new ATOM 0 HB2 LYS A 751 -6.316 6.939 -6.620 1.00 0.00 H new ATOM 0 HB3 LYS A 751 -7.641 7.650 -7.520 1.00 0.00 H new ATOM 0 HG2 LYS A 751 -4.949 8.867 -7.956 1.00 0.00 H new ATOM 0 HG3 LYS A 751 -5.167 7.231 -8.547 1.00 0.00 H new ATOM 0 HD2 LYS A 751 -5.651 9.099 -10.213 1.00 0.00 H new ATOM 0 HD3 LYS A 751 -6.889 7.868 -10.055 1.00 0.00 H new ATOM 0 HE2 LYS A 751 -8.292 9.298 -8.756 1.00 0.00 H new ATOM 0 HE3 LYS A 751 -7.001 10.453 -8.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 751 -8.535 11.220 -10.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 751 -7.005 10.958 -10.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 751 -8.256 9.839 -11.106 1.00 0.00 H new ATOM 944 N LYS A 752 -8.914 8.305 -5.422 1.00 0.00 N ATOM 945 CA LYS A 752 -10.015 7.935 -4.625 1.00 0.00 C ATOM 946 C LYS A 752 -10.621 6.714 -5.246 1.00 0.00 C ATOM 947 O LYS A 752 -10.616 6.546 -6.469 1.00 0.00 O ATOM 948 CB LYS A 752 -11.075 9.046 -4.527 1.00 0.00 C ATOM 949 CG LYS A 752 -10.562 10.371 -3.967 1.00 0.00 C ATOM 950 CD LYS A 752 -11.688 11.374 -3.813 1.00 0.00 C ATOM 951 CE LYS A 752 -12.727 10.876 -2.822 1.00 0.00 C ATOM 952 NZ LYS A 752 -13.875 11.790 -2.706 1.00 0.00 N ATOM 0 H LYS A 752 -9.143 8.343 -6.415 1.00 0.00 H new ATOM 0 HA LYS A 752 -9.669 7.747 -3.609 1.00 0.00 H new ATOM 0 HB2 LYS A 752 -11.489 9.223 -5.520 1.00 0.00 H new ATOM 0 HB3 LYS A 752 -11.893 8.694 -3.899 1.00 0.00 H new ATOM 0 HG2 LYS A 752 -10.088 10.201 -3.000 1.00 0.00 H new ATOM 0 HG3 LYS A 752 -9.798 10.777 -4.630 1.00 0.00 H new ATOM 0 HD2 LYS A 752 -11.286 12.329 -3.475 1.00 0.00 H new ATOM 0 HD3 LYS A 752 -12.158 11.551 -4.781 1.00 0.00 H new ATOM 0 HE2 LYS A 752 -13.079 9.892 -3.132 1.00 0.00 H new ATOM 0 HE3 LYS A 752 -12.263 10.754 -1.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 752 -14.556 11.407 -2.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 752 -13.545 12.722 -2.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 752 -14.336 11.887 -3.633 1.00 0.00 H new ATOM 966 N CYS A 753 -11.074 5.892 -4.426 1.00 0.00 N ATOM 967 CA CYS A 753 -11.644 4.627 -4.789 1.00 0.00 C ATOM 968 C CYS A 753 -13.134 4.730 -4.960 1.00 0.00 C ATOM 969 O CYS A 753 -13.747 5.701 -4.534 1.00 0.00 O ATOM 970 CB CYS A 753 -11.334 3.630 -3.718 1.00 0.00 C ATOM 971 SG CYS A 753 -9.550 3.432 -3.438 1.00 0.00 S ATOM 0 H CYS A 753 -11.073 6.060 -3.420 1.00 0.00 H new ATOM 0 HA CYS A 753 -11.214 4.311 -5.740 1.00 0.00 H new ATOM 0 HB2 CYS A 753 -11.811 3.941 -2.789 1.00 0.00 H new ATOM 0 HB3 CYS A 753 -11.764 2.666 -3.990 1.00 0.00 H new ATOM 976 N LYS A 754 -13.702 3.714 -5.537 1.00 0.00 N ATOM 977 CA LYS A 754 -15.105 3.660 -5.825 1.00 0.00 C ATOM 978 C LYS A 754 -15.708 2.398 -5.227 1.00 0.00 C ATOM 979 O LYS A 754 -15.094 1.318 -5.273 1.00 0.00 O ATOM 980 CB LYS A 754 -15.278 3.665 -7.344 1.00 0.00 C ATOM 981 CG LYS A 754 -16.697 3.519 -7.857 1.00 0.00 C ATOM 982 CD LYS A 754 -16.688 3.469 -9.370 1.00 0.00 C ATOM 983 CE LYS A 754 -18.068 3.248 -9.943 1.00 0.00 C ATOM 984 NZ LYS A 754 -18.039 3.232 -11.420 1.00 0.00 N ATOM 0 H LYS A 754 -13.192 2.880 -5.828 1.00 0.00 H new ATOM 0 HA LYS A 754 -15.616 4.519 -5.390 1.00 0.00 H new ATOM 0 HB2 LYS A 754 -14.868 4.597 -7.732 1.00 0.00 H new ATOM 0 HB3 LYS A 754 -14.678 2.855 -7.760 1.00 0.00 H new ATOM 0 HG2 LYS A 754 -17.148 2.611 -7.456 1.00 0.00 H new ATOM 0 HG3 LYS A 754 -17.306 4.356 -7.514 1.00 0.00 H new ATOM 0 HD2 LYS A 754 -16.280 4.401 -9.760 1.00 0.00 H new ATOM 0 HD3 LYS A 754 -16.027 2.668 -9.701 1.00 0.00 H new ATOM 0 HE2 LYS A 754 -18.470 2.304 -9.575 1.00 0.00 H new ATOM 0 HE3 LYS A 754 -18.738 4.036 -9.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 -19.001 3.078 -11.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 -17.677 4.142 -11.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 -17.418 2.464 -11.747 1.00 0.00 H new ATOM 998 N SER A 755 -16.846 2.543 -4.613 1.00 0.00 N ATOM 999 CA SER A 755 -17.592 1.405 -4.114 1.00 0.00 C ATOM 1000 C SER A 755 -18.129 0.519 -5.275 1.00 0.00 C ATOM 1001 O SER A 755 -18.890 0.989 -6.135 1.00 0.00 O ATOM 1002 CB SER A 755 -18.749 1.875 -3.216 1.00 0.00 C ATOM 1003 OG SER A 755 -19.473 2.954 -3.788 1.00 0.00 O ATOM 0 H SER A 755 -17.289 3.445 -4.440 1.00 0.00 H new ATOM 0 HA SER A 755 -16.910 0.795 -3.521 1.00 0.00 H new ATOM 0 HB2 SER A 755 -19.427 1.041 -3.035 1.00 0.00 H new ATOM 0 HB3 SER A 755 -18.353 2.180 -2.247 1.00 0.00 H new ATOM 0 HG SER A 755 -19.592 2.796 -4.748 1.00 0.00 H new ATOM 1009 N SER A 756 -17.693 -0.737 -5.320 1.00 0.00 N ATOM 1010 CA SER A 756 -18.203 -1.693 -6.298 1.00 0.00 C ATOM 1011 C SER A 756 -19.681 -1.972 -6.009 1.00 0.00 C ATOM 1012 O SER A 756 -20.099 -2.031 -4.848 1.00 0.00 O ATOM 1013 CB SER A 756 -17.368 -3.000 -6.261 1.00 0.00 C ATOM 1014 OG SER A 756 -17.937 -4.042 -7.063 1.00 0.00 O ATOM 0 H SER A 756 -16.987 -1.117 -4.690 1.00 0.00 H new ATOM 0 HA SER A 756 -18.115 -1.273 -7.300 1.00 0.00 H new ATOM 0 HB2 SER A 756 -16.357 -2.790 -6.609 1.00 0.00 H new ATOM 0 HB3 SER A 756 -17.285 -3.344 -5.230 1.00 0.00 H new ATOM 0 HG SER A 756 -17.374 -4.842 -7.008 1.00 0.00 H new ATOM 1020 N ASN A 757 -20.465 -2.140 -7.046 1.00 0.00 N ATOM 1021 CA ASN A 757 -21.908 -2.354 -6.902 1.00 0.00 C ATOM 1022 C ASN A 757 -22.236 -3.780 -6.488 1.00 0.00 C ATOM 1023 O ASN A 757 -23.382 -4.093 -6.181 1.00 0.00 O ATOM 1024 CB ASN A 757 -22.656 -2.016 -8.204 1.00 0.00 C ATOM 1025 CG ASN A 757 -22.436 -3.013 -9.343 1.00 0.00 C ATOM 1026 OD1 ASN A 757 -23.191 -3.976 -9.500 1.00 0.00 O ATOM 1027 ND2 ASN A 757 -21.429 -2.785 -10.147 1.00 0.00 N ATOM 0 H ASN A 757 -20.137 -2.135 -8.012 1.00 0.00 H new ATOM 0 HA ASN A 757 -22.241 -1.681 -6.112 1.00 0.00 H new ATOM 0 HB2 ASN A 757 -23.723 -1.959 -7.990 1.00 0.00 H new ATOM 0 HB3 ASN A 757 -22.345 -1.027 -8.540 1.00 0.00 H new ATOM 0 HD21 ASN A 757 -21.250 -3.413 -10.931 1.00 0.00 H new ATOM 0 HD22 ASN A 757 -20.823 -1.980 -9.990 1.00 0.00 H new ATOM 1034 N LEU A 758 -21.238 -4.638 -6.457 1.00 0.00 N ATOM 1035 CA LEU A 758 -21.481 -6.026 -6.132 1.00 0.00 C ATOM 1036 C LEU A 758 -21.019 -6.336 -4.739 1.00 0.00 C ATOM 1037 O LEU A 758 -21.351 -7.375 -4.176 1.00 0.00 O ATOM 1038 CB LEU A 758 -20.829 -6.953 -7.157 1.00 0.00 C ATOM 1039 CG LEU A 758 -21.413 -6.883 -8.571 1.00 0.00 C ATOM 1040 CD1 LEU A 758 -20.667 -7.808 -9.501 1.00 0.00 C ATOM 1041 CD2 LEU A 758 -22.893 -7.237 -8.554 1.00 0.00 C ATOM 0 H LEU A 758 -20.264 -4.403 -6.650 1.00 0.00 H new ATOM 0 HA LEU A 758 -22.556 -6.201 -6.171 1.00 0.00 H new ATOM 0 HB2 LEU A 758 -19.766 -6.718 -7.209 1.00 0.00 H new ATOM 0 HB3 LEU A 758 -20.912 -7.979 -6.798 1.00 0.00 H new ATOM 0 HG LEU A 758 -21.302 -5.862 -8.936 1.00 0.00 H new ATOM 0 HD11 LEU A 758 -21.097 -7.744 -10.500 1.00 0.00 H new ATOM 0 HD12 LEU A 758 -19.617 -7.517 -9.538 1.00 0.00 H new ATOM 0 HD13 LEU A 758 -20.747 -8.832 -9.137 1.00 0.00 H new ATOM 0 HD21 LEU A 758 -23.292 -7.182 -9.567 1.00 0.00 H new ATOM 0 HD22 LEU A 758 -23.021 -8.248 -8.168 1.00 0.00 H new ATOM 0 HD23 LEU A 758 -23.428 -6.534 -7.915 1.00 0.00 H new ATOM 1053 N ILE A 759 -20.287 -5.421 -4.164 1.00 0.00 N ATOM 1054 CA ILE A 759 -19.808 -5.610 -2.840 1.00 0.00 C ATOM 1055 C ILE A 759 -20.729 -4.924 -1.860 1.00 0.00 C ATOM 1056 O ILE A 759 -21.559 -4.086 -2.253 1.00 0.00 O ATOM 1057 CB ILE A 759 -18.305 -5.190 -2.657 1.00 0.00 C ATOM 1058 CG1 ILE A 759 -18.008 -3.736 -3.056 1.00 0.00 C ATOM 1059 CG2 ILE A 759 -17.387 -6.129 -3.409 1.00 0.00 C ATOM 1060 CD1 ILE A 759 -18.435 -2.680 -2.066 1.00 0.00 C ATOM 0 H ILE A 759 -20.014 -4.540 -4.599 1.00 0.00 H new ATOM 0 HA ILE A 759 -19.820 -6.680 -2.632 1.00 0.00 H new ATOM 0 HB ILE A 759 -18.113 -5.262 -1.586 1.00 0.00 H new ATOM 0 HG12 ILE A 759 -16.935 -3.637 -3.223 1.00 0.00 H new ATOM 0 HG13 ILE A 759 -18.499 -3.533 -4.008 1.00 0.00 H new ATOM 0 HG21 ILE A 759 -16.352 -5.817 -3.267 1.00 0.00 H new ATOM 0 HG22 ILE A 759 -17.516 -7.143 -3.032 1.00 0.00 H new ATOM 0 HG23 ILE A 759 -17.631 -6.103 -4.471 1.00 0.00 H new ATOM 0 HD11 ILE A 759 -18.176 -1.694 -2.451 1.00 0.00 H new ATOM 0 HD12 ILE A 759 -19.513 -2.738 -1.914 1.00 0.00 H new ATOM 0 HD13 ILE A 759 -17.925 -2.844 -1.117 1.00 0.00 H new ATOM 1072 N ILE A 760 -20.631 -5.294 -0.630 1.00 0.00 N ATOM 1073 CA ILE A 760 -21.454 -4.722 0.398 1.00 0.00 C ATOM 1074 C ILE A 760 -20.557 -4.054 1.404 1.00 0.00 C ATOM 1075 O ILE A 760 -19.695 -4.698 1.987 1.00 0.00 O ATOM 1076 CB ILE A 760 -22.378 -5.779 1.118 1.00 0.00 C ATOM 1077 CG1 ILE A 760 -23.381 -6.451 0.151 1.00 0.00 C ATOM 1078 CG2 ILE A 760 -23.142 -5.144 2.280 1.00 0.00 C ATOM 1079 CD1 ILE A 760 -22.792 -7.478 -0.802 1.00 0.00 C ATOM 0 H ILE A 760 -19.978 -6.004 -0.300 1.00 0.00 H new ATOM 0 HA ILE A 760 -22.126 -4.004 -0.073 1.00 0.00 H new ATOM 0 HB ILE A 760 -21.710 -6.552 1.499 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -24.158 -6.935 0.742 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -23.867 -5.673 -0.438 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -23.770 -5.896 2.757 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -22.434 -4.748 3.008 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -23.767 -4.334 1.905 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -23.583 -7.885 -1.433 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -22.037 -7.002 -1.428 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -22.333 -8.284 -0.230 1.00 0.00 H new ATOM 1091 N LEU A 761 -20.700 -2.774 1.537 1.00 0.00 N ATOM 1092 CA LEU A 761 -19.941 -2.020 2.492 1.00 0.00 C ATOM 1093 C LEU A 761 -20.735 -1.907 3.759 1.00 0.00 C ATOM 1094 O LEU A 761 -21.835 -2.468 3.867 1.00 0.00 O ATOM 1095 CB LEU A 761 -19.712 -0.637 1.927 1.00 0.00 C ATOM 1096 CG LEU A 761 -18.930 -0.590 0.639 1.00 0.00 C ATOM 1097 CD1 LEU A 761 -19.026 0.755 0.037 1.00 0.00 C ATOM 1098 CD2 LEU A 761 -17.489 -0.949 0.897 1.00 0.00 C ATOM 0 H LEU A 761 -21.350 -2.216 0.984 1.00 0.00 H new ATOM 0 HA LEU A 761 -18.988 -2.508 2.697 1.00 0.00 H new ATOM 0 HB2 LEU A 761 -20.680 -0.164 1.763 1.00 0.00 H new ATOM 0 HB3 LEU A 761 -19.188 -0.039 2.673 1.00 0.00 H new ATOM 0 HG LEU A 761 -19.350 -1.314 -0.059 1.00 0.00 H new ATOM 0 HD11 LEU A 761 -18.458 0.779 -0.893 1.00 0.00 H new ATOM 0 HD12 LEU A 761 -20.071 0.987 -0.170 1.00 0.00 H new ATOM 0 HD13 LEU A 761 -18.620 1.493 0.729 1.00 0.00 H new ATOM 0 HD21 LEU A 761 -16.932 -0.912 -0.039 1.00 0.00 H new ATOM 0 HD22 LEU A 761 -17.058 -0.240 1.604 1.00 0.00 H new ATOM 0 HD23 LEU A 761 -17.434 -1.955 1.313 1.00 0.00 H new ATOM 1110 N GLU A 762 -20.191 -1.191 4.716 1.00 0.00 N ATOM 1111 CA GLU A 762 -20.896 -0.915 5.941 1.00 0.00 C ATOM 1112 C GLU A 762 -22.141 -0.102 5.653 1.00 0.00 C ATOM 1113 O GLU A 762 -22.308 0.442 4.575 1.00 0.00 O ATOM 1114 CB GLU A 762 -20.068 -0.080 6.872 1.00 0.00 C ATOM 1115 CG GLU A 762 -18.785 -0.660 7.336 1.00 0.00 C ATOM 1116 CD GLU A 762 -18.298 0.116 8.516 1.00 0.00 C ATOM 1117 OE1 GLU A 762 -17.599 1.126 8.348 1.00 0.00 O ATOM 1118 OE2 GLU A 762 -18.654 -0.267 9.649 1.00 0.00 O ATOM 0 H GLU A 762 -19.255 -0.788 4.666 1.00 0.00 H new ATOM 0 HA GLU A 762 -21.131 -1.880 6.390 1.00 0.00 H new ATOM 0 HB2 GLU A 762 -19.852 0.867 6.377 1.00 0.00 H new ATOM 0 HB3 GLU A 762 -20.673 0.150 7.749 1.00 0.00 H new ATOM 0 HG2 GLU A 762 -18.921 -1.708 7.605 1.00 0.00 H new ATOM 0 HG3 GLU A 762 -18.047 -0.630 6.535 1.00 0.00 H new ATOM 1125 N GLU A 763 -22.898 0.157 6.675 1.00 0.00 N ATOM 1126 CA GLU A 763 -24.142 0.919 6.517 1.00 0.00 C ATOM 1127 C GLU A 763 -23.787 2.384 6.594 1.00 0.00 C ATOM 1128 O GLU A 763 -24.573 3.284 6.324 1.00 0.00 O ATOM 1129 CB GLU A 763 -25.159 0.509 7.572 1.00 0.00 C ATOM 1130 CG GLU A 763 -24.630 0.507 8.991 1.00 0.00 C ATOM 1131 CD GLU A 763 -25.672 0.075 9.969 1.00 0.00 C ATOM 1132 OE1 GLU A 763 -25.854 -1.147 10.160 1.00 0.00 O ATOM 1133 OE2 GLU A 763 -26.352 0.955 10.551 1.00 0.00 O ATOM 0 H GLU A 763 -22.695 -0.137 7.630 1.00 0.00 H new ATOM 0 HA GLU A 763 -24.610 0.714 5.554 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -26.012 1.185 7.517 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -25.527 -0.489 7.334 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -23.770 -0.159 9.058 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -24.280 1.506 9.250 1.00 0.00 H new ATOM 1140 N HIS A 764 -22.547 2.536 6.897 1.00 0.00 N ATOM 1141 CA HIS A 764 -21.822 3.728 7.033 1.00 0.00 C ATOM 1142 C HIS A 764 -21.252 4.091 5.680 1.00 0.00 C ATOM 1143 O HIS A 764 -21.290 5.227 5.241 1.00 0.00 O ATOM 1144 CB HIS A 764 -20.670 3.347 7.947 1.00 0.00 C ATOM 1145 CG HIS A 764 -19.667 4.363 8.235 1.00 0.00 C ATOM 1146 ND1 HIS A 764 -19.920 5.597 8.767 1.00 0.00 N ATOM 1147 CD2 HIS A 764 -18.380 4.289 8.026 1.00 0.00 C ATOM 1148 CE1 HIS A 764 -18.790 6.254 8.865 1.00 0.00 C ATOM 1149 NE2 HIS A 764 -17.828 5.477 8.418 1.00 0.00 N ATOM 0 H HIS A 764 -21.956 1.724 7.074 1.00 0.00 H new ATOM 0 HA HIS A 764 -22.418 4.559 7.409 1.00 0.00 H new ATOM 0 HB2 HIS A 764 -21.091 3.014 8.896 1.00 0.00 H new ATOM 0 HB3 HIS A 764 -20.161 2.490 7.505 1.00 0.00 H new ATOM 0 HD2 HIS A 764 -17.848 3.443 7.617 1.00 0.00 H new ATOM 0 HE1 HIS A 764 -18.670 7.257 9.246 1.00 0.00 H new ATOM 0 HE2 HIS A 764 -16.838 5.719 8.372 1.00 0.00 H new ATOM 1158 N LEU A 765 -20.748 3.083 5.029 1.00 0.00 N ATOM 1159 CA LEU A 765 -20.008 3.228 3.823 1.00 0.00 C ATOM 1160 C LEU A 765 -20.827 3.032 2.581 1.00 0.00 C ATOM 1161 O LEU A 765 -20.383 3.354 1.510 1.00 0.00 O ATOM 1162 CB LEU A 765 -18.886 2.270 3.834 1.00 0.00 C ATOM 1163 CG LEU A 765 -17.756 2.561 4.737 1.00 0.00 C ATOM 1164 CD1 LEU A 765 -16.829 1.525 4.594 1.00 0.00 C ATOM 1165 CD2 LEU A 765 -17.234 3.994 4.617 1.00 0.00 C ATOM 0 H LEU A 765 -20.847 2.115 5.336 1.00 0.00 H new ATOM 0 HA LEU A 765 -19.651 4.257 3.791 1.00 0.00 H new ATOM 0 HB2 LEU A 765 -19.283 1.289 4.096 1.00 0.00 H new ATOM 0 HB3 LEU A 765 -18.496 2.196 2.819 1.00 0.00 H new ATOM 0 HG LEU A 765 -18.070 2.563 5.781 1.00 0.00 H new ATOM 0 HD11 LEU A 765 -15.977 1.706 5.249 1.00 0.00 H new ATOM 0 HD12 LEU A 765 -17.297 0.578 4.862 1.00 0.00 H new ATOM 0 HD13 LEU A 765 -16.489 1.481 3.559 1.00 0.00 H new ATOM 0 HD21 LEU A 765 -16.404 4.138 5.309 1.00 0.00 H new ATOM 0 HD22 LEU A 765 -16.892 4.172 3.598 1.00 0.00 H new ATOM 0 HD23 LEU A 765 -18.034 4.694 4.859 1.00 0.00 H new ATOM 1177 N LYS A 766 -22.011 2.501 2.710 1.00 0.00 N ATOM 1178 CA LYS A 766 -22.884 2.346 1.549 1.00 0.00 C ATOM 1179 C LYS A 766 -23.316 3.703 0.975 1.00 0.00 C ATOM 1180 O LYS A 766 -23.779 3.794 -0.164 1.00 0.00 O ATOM 1181 CB LYS A 766 -24.080 1.459 1.844 1.00 0.00 C ATOM 1182 CG LYS A 766 -23.731 -0.015 1.923 1.00 0.00 C ATOM 1183 CD LYS A 766 -24.962 -0.875 2.135 1.00 0.00 C ATOM 1184 CE LYS A 766 -25.575 -0.651 3.504 1.00 0.00 C ATOM 1185 NZ LYS A 766 -26.835 -1.395 3.669 1.00 0.00 N ATOM 0 H LYS A 766 -22.403 2.168 3.591 1.00 0.00 H new ATOM 0 HA LYS A 766 -22.296 1.841 0.782 1.00 0.00 H new ATOM 0 HB2 LYS A 766 -24.530 1.770 2.787 1.00 0.00 H new ATOM 0 HB3 LYS A 766 -24.832 1.606 1.069 1.00 0.00 H new ATOM 0 HG2 LYS A 766 -23.229 -0.319 1.005 1.00 0.00 H new ATOM 0 HG3 LYS A 766 -23.028 -0.179 2.740 1.00 0.00 H new ATOM 0 HD2 LYS A 766 -25.700 -0.650 1.365 1.00 0.00 H new ATOM 0 HD3 LYS A 766 -24.695 -1.926 2.024 1.00 0.00 H new ATOM 0 HE2 LYS A 766 -24.868 -0.960 4.274 1.00 0.00 H new ATOM 0 HE3 LYS A 766 -25.760 0.413 3.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 766 -27.222 -1.216 4.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 766 -27.519 -1.083 2.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 766 -26.654 -2.413 3.556 1.00 0.00 H new ATOM 1199 N ASN A 767 -23.133 4.751 1.760 1.00 0.00 N ATOM 1200 CA ASN A 767 -23.386 6.116 1.308 1.00 0.00 C ATOM 1201 C ASN A 767 -22.131 6.714 0.690 1.00 0.00 C ATOM 1202 O ASN A 767 -22.126 7.866 0.255 1.00 0.00 O ATOM 1203 CB ASN A 767 -23.854 7.024 2.457 1.00 0.00 C ATOM 1204 CG ASN A 767 -25.274 6.772 2.894 1.00 0.00 C ATOM 1205 OD1 ASN A 767 -25.539 5.968 3.796 1.00 0.00 O ATOM 1206 ND2 ASN A 767 -26.195 7.472 2.296 1.00 0.00 N ATOM 0 H ASN A 767 -22.807 4.685 2.724 1.00 0.00 H new ATOM 0 HA ASN A 767 -24.180 6.060 0.563 1.00 0.00 H new ATOM 0 HB2 ASN A 767 -23.191 6.884 3.311 1.00 0.00 H new ATOM 0 HB3 ASN A 767 -23.759 8.065 2.147 1.00 0.00 H new ATOM 0 HD21 ASN A 767 -27.173 7.367 2.568 1.00 0.00 H new ATOM 0 HD22 ASN A 767 -25.939 8.126 1.556 1.00 0.00 H new ATOM 1213 N LYS A 768 -21.083 5.937 0.632 1.00 0.00 N ATOM 1214 CA LYS A 768 -19.829 6.386 0.133 1.00 0.00 C ATOM 1215 C LYS A 768 -19.674 5.815 -1.267 1.00 0.00 C ATOM 1216 O LYS A 768 -19.544 4.599 -1.446 1.00 0.00 O ATOM 1217 CB LYS A 768 -18.706 5.842 1.019 1.00 0.00 C ATOM 1218 CG LYS A 768 -17.370 6.539 0.878 1.00 0.00 C ATOM 1219 CD LYS A 768 -17.307 7.852 1.647 1.00 0.00 C ATOM 1220 CE LYS A 768 -17.375 7.623 3.159 1.00 0.00 C ATOM 1221 NZ LYS A 768 -17.215 8.883 3.908 1.00 0.00 N ATOM 0 H LYS A 768 -21.085 4.963 0.936 1.00 0.00 H new ATOM 0 HA LYS A 768 -19.781 7.475 0.124 1.00 0.00 H new ATOM 0 HB2 LYS A 768 -19.023 5.909 2.060 1.00 0.00 H new ATOM 0 HB3 LYS A 768 -18.570 4.784 0.795 1.00 0.00 H new ATOM 0 HG2 LYS A 768 -16.580 5.877 1.233 1.00 0.00 H new ATOM 0 HG3 LYS A 768 -17.175 6.731 -0.177 1.00 0.00 H new ATOM 0 HD2 LYS A 768 -16.384 8.376 1.399 1.00 0.00 H new ATOM 0 HD3 LYS A 768 -18.131 8.495 1.338 1.00 0.00 H new ATOM 0 HE2 LYS A 768 -18.331 7.166 3.415 1.00 0.00 H new ATOM 0 HE3 LYS A 768 -16.596 6.921 3.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 768 -17.266 8.689 4.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 768 -16.292 9.306 3.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 768 -17.973 9.543 3.642 1.00 0.00 H new ATOM 1235 N LYS A 769 -19.745 6.655 -2.240 1.00 0.00 N ATOM 1236 CA LYS A 769 -19.569 6.234 -3.601 1.00 0.00 C ATOM 1237 C LYS A 769 -18.085 6.176 -3.879 1.00 0.00 C ATOM 1238 O LYS A 769 -17.581 5.289 -4.567 1.00 0.00 O ATOM 1239 CB LYS A 769 -20.234 7.226 -4.548 1.00 0.00 C ATOM 1240 CG LYS A 769 -20.057 6.884 -6.013 1.00 0.00 C ATOM 1241 CD LYS A 769 -20.603 7.970 -6.923 1.00 0.00 C ATOM 1242 CE LYS A 769 -19.855 9.282 -6.732 1.00 0.00 C ATOM 1243 NZ LYS A 769 -20.307 10.316 -7.680 1.00 0.00 N ATOM 0 H LYS A 769 -19.926 7.652 -2.124 1.00 0.00 H new ATOM 0 HA LYS A 769 -20.026 5.256 -3.755 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -21.299 7.273 -4.321 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -19.825 8.220 -4.364 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -18.998 6.733 -6.224 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -20.563 5.943 -6.229 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -20.522 7.651 -7.962 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -21.663 8.120 -6.718 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -20.000 9.637 -5.712 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -18.786 9.113 -6.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -19.773 11.194 -7.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -20.146 9.988 -8.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -21.321 10.497 -7.539 1.00 0.00 H new ATOM 1257 N GLU A 770 -17.401 7.108 -3.295 1.00 0.00 N ATOM 1258 CA GLU A 770 -16.015 7.264 -3.449 1.00 0.00 C ATOM 1259 C GLU A 770 -15.351 7.392 -2.123 1.00 0.00 C ATOM 1260 O GLU A 770 -15.776 8.154 -1.260 1.00 0.00 O ATOM 1261 CB GLU A 770 -15.723 8.462 -4.296 1.00 0.00 C ATOM 1262 CG GLU A 770 -16.683 9.595 -4.075 1.00 0.00 C ATOM 1263 CD GLU A 770 -16.441 10.764 -4.966 1.00 0.00 C ATOM 1264 OE1 GLU A 770 -15.430 11.457 -4.796 1.00 0.00 O ATOM 1265 OE2 GLU A 770 -17.258 11.021 -5.861 1.00 0.00 O ATOM 0 H GLU A 770 -17.822 7.801 -2.677 1.00 0.00 H new ATOM 0 HA GLU A 770 -15.619 6.378 -3.945 1.00 0.00 H new ATOM 0 HB2 GLU A 770 -14.710 8.807 -4.088 1.00 0.00 H new ATOM 0 HB3 GLU A 770 -15.751 8.171 -5.346 1.00 0.00 H new ATOM 0 HG2 GLU A 770 -17.700 9.234 -4.231 1.00 0.00 H new ATOM 0 HG3 GLU A 770 -16.616 9.920 -3.037 1.00 0.00 H new ATOM 1272 N PHE A 771 -14.310 6.683 -1.988 1.00 0.00 N ATOM 1273 CA PHE A 771 -13.544 6.639 -0.772 1.00 0.00 C ATOM 1274 C PHE A 771 -12.221 7.281 -1.036 1.00 0.00 C ATOM 1275 O PHE A 771 -11.668 7.118 -2.105 1.00 0.00 O ATOM 1276 CB PHE A 771 -13.293 5.204 -0.327 1.00 0.00 C ATOM 1277 CG PHE A 771 -14.503 4.393 0.051 1.00 0.00 C ATOM 1278 CD1 PHE A 771 -15.291 3.782 -0.912 1.00 0.00 C ATOM 1279 CD2 PHE A 771 -14.811 4.181 1.382 1.00 0.00 C ATOM 1280 CE1 PHE A 771 -16.353 2.990 -0.544 1.00 0.00 C ATOM 1281 CE2 PHE A 771 -15.887 3.389 1.740 1.00 0.00 C ATOM 1282 CZ PHE A 771 -16.640 2.801 0.781 1.00 0.00 C ATOM 0 H PHE A 771 -13.937 6.091 -2.730 1.00 0.00 H new ATOM 0 HA PHE A 771 -14.099 7.156 0.011 1.00 0.00 H new ATOM 0 HB2 PHE A 771 -12.773 4.684 -1.131 1.00 0.00 H new ATOM 0 HB3 PHE A 771 -12.617 5.226 0.528 1.00 0.00 H new ATOM 0 HD1 PHE A 771 -15.069 3.929 -1.959 1.00 0.00 H new ATOM 0 HD2 PHE A 771 -14.205 4.639 2.150 1.00 0.00 H new ATOM 0 HE1 PHE A 771 -16.961 2.517 -1.301 1.00 0.00 H new ATOM 0 HE2 PHE A 771 -16.126 3.240 2.783 1.00 0.00 H new ATOM 0 HZ PHE A 771 -17.475 2.177 1.064 1.00 0.00 H new ATOM 1292 N ASP A 772 -11.709 7.981 -0.095 1.00 0.00 N ATOM 1293 CA ASP A 772 -10.431 8.625 -0.279 1.00 0.00 C ATOM 1294 C ASP A 772 -9.326 7.670 0.167 1.00 0.00 C ATOM 1295 O ASP A 772 -9.588 6.740 0.934 1.00 0.00 O ATOM 1296 CB ASP A 772 -10.386 9.968 0.481 1.00 0.00 C ATOM 1297 CG ASP A 772 -9.097 10.749 0.274 1.00 0.00 C ATOM 1298 OD1 ASP A 772 -8.419 10.575 -0.768 1.00 0.00 O ATOM 1299 OD2 ASP A 772 -8.730 11.562 1.135 1.00 0.00 O ATOM 0 H ASP A 772 -12.142 8.133 0.816 1.00 0.00 H new ATOM 0 HA ASP A 772 -10.277 8.858 -1.333 1.00 0.00 H new ATOM 0 HB2 ASP A 772 -11.227 10.583 0.162 1.00 0.00 H new ATOM 0 HB3 ASP A 772 -10.516 9.776 1.546 1.00 0.00 H new ATOM 1304 N HIS A 773 -8.129 7.850 -0.383 1.00 0.00 N ATOM 1305 CA HIS A 773 -6.936 7.068 -0.067 1.00 0.00 C ATOM 1306 C HIS A 773 -6.793 6.836 1.470 1.00 0.00 C ATOM 1307 O HIS A 773 -7.131 7.714 2.278 1.00 0.00 O ATOM 1308 CB HIS A 773 -5.682 7.822 -0.595 1.00 0.00 C ATOM 1309 CG HIS A 773 -5.284 9.016 0.258 1.00 0.00 C ATOM 1310 ND1 HIS A 773 -6.054 10.130 0.420 1.00 0.00 N ATOM 1311 CD2 HIS A 773 -4.218 9.183 1.059 1.00 0.00 C ATOM 1312 CE1 HIS A 773 -5.493 10.922 1.291 1.00 0.00 C ATOM 1313 NE2 HIS A 773 -4.378 10.369 1.704 1.00 0.00 N ATOM 0 H HIS A 773 -7.956 8.569 -1.085 1.00 0.00 H new ATOM 0 HA HIS A 773 -7.027 6.093 -0.547 1.00 0.00 H new ATOM 0 HB2 HIS A 773 -4.844 7.126 -0.644 1.00 0.00 H new ATOM 0 HB3 HIS A 773 -5.875 8.162 -1.613 1.00 0.00 H new ATOM 0 HD1 HIS A 773 -6.932 10.315 -0.065 1.00 0.00 H new ATOM 0 HD2 HIS A 773 -3.388 8.501 1.170 1.00 0.00 H new ATOM 0 HE1 HIS A 773 -5.882 11.875 1.618 1.00 0.00 H new ATOM 1322 N ASN A 774 -6.311 5.661 1.833 1.00 0.00 N ATOM 1323 CA ASN A 774 -6.057 5.267 3.223 1.00 0.00 C ATOM 1324 C ASN A 774 -7.327 5.100 4.047 1.00 0.00 C ATOM 1325 O ASN A 774 -7.266 4.968 5.263 1.00 0.00 O ATOM 1326 CB ASN A 774 -5.060 6.200 3.925 1.00 0.00 C ATOM 1327 CG ASN A 774 -3.623 6.083 3.423 1.00 0.00 C ATOM 1328 OD1 ASN A 774 -3.174 4.879 3.113 1.00 0.00 O flip ATOM 1329 ND2 ASN A 774 -2.906 7.073 3.376 1.00 0.00 N flip ATOM 0 H ASN A 774 -6.077 4.931 1.160 1.00 0.00 H new ATOM 0 HA ASN A 774 -5.597 4.281 3.158 1.00 0.00 H new ATOM 0 HB2 ASN A 774 -5.393 7.230 3.797 1.00 0.00 H new ATOM 0 HB3 ASN A 774 -5.076 5.990 4.994 1.00 0.00 H new ATOM 0 HD21 ASN A 774 -3.283 7.988 3.622 1.00 0.00 H new ATOM 0 HD22 ASN A 774 -1.931 6.983 3.091 1.00 0.00 H new ATOM 1336 N SER A 775 -8.475 5.074 3.397 1.00 0.00 N ATOM 1337 CA SER A 775 -9.698 4.817 4.093 1.00 0.00 C ATOM 1338 C SER A 775 -9.770 3.325 4.346 1.00 0.00 C ATOM 1339 O SER A 775 -9.863 2.536 3.397 1.00 0.00 O ATOM 1340 CB SER A 775 -10.908 5.300 3.266 1.00 0.00 C ATOM 1341 OG SER A 775 -12.142 5.081 3.936 1.00 0.00 O ATOM 0 H SER A 775 -8.575 5.228 2.394 1.00 0.00 H new ATOM 0 HA SER A 775 -9.724 5.360 5.038 1.00 0.00 H new ATOM 0 HB2 SER A 775 -10.797 6.363 3.051 1.00 0.00 H new ATOM 0 HB3 SER A 775 -10.921 4.781 2.308 1.00 0.00 H new ATOM 0 HG SER A 775 -12.861 5.542 3.456 1.00 0.00 H new ATOM 1347 N ASN A 776 -9.641 2.942 5.597 1.00 0.00 N ATOM 1348 CA ASN A 776 -9.717 1.553 5.982 1.00 0.00 C ATOM 1349 C ASN A 776 -11.154 1.217 6.213 1.00 0.00 C ATOM 1350 O ASN A 776 -11.737 1.601 7.221 1.00 0.00 O ATOM 1351 CB ASN A 776 -8.889 1.225 7.250 1.00 0.00 C ATOM 1352 CG ASN A 776 -7.370 1.380 7.103 1.00 0.00 C ATOM 1353 OD1 ASN A 776 -6.924 2.398 6.416 1.00 0.00 O flip ATOM 1354 ND2 ASN A 776 -6.600 0.597 7.665 1.00 0.00 N flip ATOM 0 H ASN A 776 -9.481 3.584 6.373 1.00 0.00 H new ATOM 0 HA ASN A 776 -9.290 0.954 5.178 1.00 0.00 H new ATOM 0 HB2 ASN A 776 -9.226 1.871 8.061 1.00 0.00 H new ATOM 0 HB3 ASN A 776 -9.105 0.199 7.549 1.00 0.00 H new ATOM 0 HD21 ASN A 776 -6.971 -0.191 8.196 1.00 0.00 H new ATOM 0 HD22 ASN A 776 -5.592 0.737 7.599 1.00 0.00 H new ATOM 1361 N ILE A 777 -11.731 0.584 5.260 1.00 0.00 N ATOM 1362 CA ILE A 777 -13.116 0.225 5.292 1.00 0.00 C ATOM 1363 C ILE A 777 -13.239 -1.269 5.347 1.00 0.00 C ATOM 1364 O ILE A 777 -12.240 -1.989 5.439 1.00 0.00 O ATOM 1365 CB ILE A 777 -13.815 0.669 4.013 1.00 0.00 C ATOM 1366 CG1 ILE A 777 -13.229 0.015 2.770 1.00 0.00 C ATOM 1367 CG2 ILE A 777 -13.805 2.174 3.909 1.00 0.00 C ATOM 1368 CD1 ILE A 777 -14.265 -0.207 1.702 1.00 0.00 C ATOM 0 H ILE A 777 -11.249 0.290 4.411 1.00 0.00 H new ATOM 0 HA ILE A 777 -13.566 0.703 6.162 1.00 0.00 H new ATOM 0 HB ILE A 777 -14.850 0.332 4.069 1.00 0.00 H new ATOM 0 HG12 ILE A 777 -12.430 0.642 2.374 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -12.779 -0.940 3.042 1.00 0.00 H new ATOM 0 HG21 ILE A 777 -14.307 2.479 2.991 1.00 0.00 H new ATOM 0 HG22 ILE A 777 -14.325 2.601 4.766 1.00 0.00 H new ATOM 0 HG23 ILE A 777 -12.775 2.531 3.895 1.00 0.00 H new ATOM 0 HD11 ILE A 777 -13.799 -0.676 0.835 1.00 0.00 H new ATOM 0 HD12 ILE A 777 -15.051 -0.856 2.087 1.00 0.00 H new ATOM 0 HD13 ILE A 777 -14.696 0.750 1.409 1.00 0.00 H new ATOM 1380 N ARG A 778 -14.438 -1.739 5.253 1.00 0.00 N ATOM 1381 CA ARG A 778 -14.702 -3.114 5.174 1.00 0.00 C ATOM 1382 C ARG A 778 -15.837 -3.345 4.229 1.00 0.00 C ATOM 1383 O ARG A 778 -16.888 -2.721 4.334 1.00 0.00 O ATOM 1384 CB ARG A 778 -14.974 -3.728 6.547 1.00 0.00 C ATOM 1385 CG ARG A 778 -15.928 -2.943 7.395 1.00 0.00 C ATOM 1386 CD ARG A 778 -16.282 -3.663 8.673 1.00 0.00 C ATOM 1387 NE ARG A 778 -17.229 -2.890 9.465 1.00 0.00 N ATOM 1388 CZ ARG A 778 -17.881 -3.318 10.537 1.00 0.00 C ATOM 1389 NH1 ARG A 778 -17.585 -4.486 11.094 1.00 0.00 N ATOM 1390 NH2 ARG A 778 -18.795 -2.537 11.082 1.00 0.00 N ATOM 0 H ARG A 778 -15.273 -1.153 5.229 1.00 0.00 H new ATOM 0 HA ARG A 778 -13.814 -3.617 4.792 1.00 0.00 H new ATOM 0 HB2 ARG A 778 -15.371 -4.734 6.410 1.00 0.00 H new ATOM 0 HB3 ARG A 778 -14.029 -3.828 7.081 1.00 0.00 H new ATOM 0 HG2 ARG A 778 -15.486 -1.976 7.636 1.00 0.00 H new ATOM 0 HG3 ARG A 778 -16.838 -2.746 6.828 1.00 0.00 H new ATOM 0 HD2 ARG A 778 -16.710 -4.638 8.438 1.00 0.00 H new ATOM 0 HD3 ARG A 778 -15.378 -3.843 9.255 1.00 0.00 H new ATOM 0 HE ARG A 778 -17.407 -1.931 9.167 1.00 0.00 H new ATOM 0 HH11 ARG A 778 -16.847 -5.068 10.697 1.00 0.00 H new ATOM 0 HH12 ARG A 778 -18.096 -4.802 11.919 1.00 0.00 H new ATOM 0 HH21 ARG A 778 -18.990 -1.621 10.678 1.00 0.00 H new ATOM 0 HH22 ARG A 778 -19.307 -2.850 11.907 1.00 0.00 H new ATOM 1404 N TYR A 779 -15.584 -4.162 3.268 1.00 0.00 N ATOM 1405 CA TYR A 779 -16.576 -4.572 2.332 1.00 0.00 C ATOM 1406 C TYR A 779 -16.764 -6.045 2.558 1.00 0.00 C ATOM 1407 O TYR A 779 -15.982 -6.673 3.320 1.00 0.00 O ATOM 1408 CB TYR A 779 -16.087 -4.355 0.873 1.00 0.00 C ATOM 1409 CG TYR A 779 -15.052 -5.386 0.420 1.00 0.00 C ATOM 1410 CD1 TYR A 779 -13.805 -5.475 1.015 1.00 0.00 C ATOM 1411 CD2 TYR A 779 -15.368 -6.311 -0.563 1.00 0.00 C ATOM 1412 CE1 TYR A 779 -12.905 -6.441 0.639 1.00 0.00 C ATOM 1413 CE2 TYR A 779 -14.481 -7.293 -0.934 1.00 0.00 C ATOM 1414 CZ TYR A 779 -13.245 -7.354 -0.328 1.00 0.00 C ATOM 1415 OH TYR A 779 -12.359 -8.352 -0.652 1.00 0.00 O ATOM 0 H TYR A 779 -14.665 -4.573 3.105 1.00 0.00 H new ATOM 0 HA TYR A 779 -17.493 -3.999 2.468 1.00 0.00 H new ATOM 0 HB2 TYR A 779 -16.944 -4.392 0.201 1.00 0.00 H new ATOM 0 HB3 TYR A 779 -15.657 -3.357 0.786 1.00 0.00 H new ATOM 0 HD1 TYR A 779 -13.535 -4.772 1.789 1.00 0.00 H new ATOM 0 HD2 TYR A 779 -16.332 -6.259 -1.048 1.00 0.00 H new ATOM 0 HE1 TYR A 779 -11.931 -6.483 1.103 1.00 0.00 H new ATOM 0 HE2 TYR A 779 -14.751 -8.011 -1.694 1.00 0.00 H new ATOM 0 HH TYR A 779 -12.746 -8.918 -1.352 1.00 0.00 H new ATOM 1425 N ARG A 780 -17.721 -6.585 1.918 1.00 0.00 N ATOM 1426 CA ARG A 780 -17.960 -7.976 1.936 1.00 0.00 C ATOM 1427 C ARG A 780 -18.595 -8.353 0.611 1.00 0.00 C ATOM 1428 O ARG A 780 -18.843 -7.474 -0.230 1.00 0.00 O ATOM 1429 CB ARG A 780 -18.836 -8.367 3.115 1.00 0.00 C ATOM 1430 CG ARG A 780 -20.299 -8.088 2.941 1.00 0.00 C ATOM 1431 CD ARG A 780 -21.090 -8.584 4.128 1.00 0.00 C ATOM 1432 NE ARG A 780 -22.528 -8.502 3.899 1.00 0.00 N ATOM 1433 CZ ARG A 780 -23.470 -8.509 4.848 1.00 0.00 C ATOM 1434 NH1 ARG A 780 -23.145 -8.662 6.124 1.00 0.00 N ATOM 1435 NH2 ARG A 780 -24.738 -8.426 4.499 1.00 0.00 N ATOM 0 H ARG A 780 -18.383 -6.059 1.348 1.00 0.00 H new ATOM 0 HA ARG A 780 -17.024 -8.520 2.061 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -18.705 -9.432 3.307 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -18.484 -7.838 4.000 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -20.456 -7.017 2.817 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -20.659 -8.570 2.032 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -20.815 -9.617 4.341 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -20.829 -7.997 5.009 1.00 0.00 H new ATOM 0 HE ARG A 780 -22.842 -8.433 2.931 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -22.167 -8.776 6.391 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -23.873 -8.666 6.839 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -24.992 -8.357 3.514 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -25.465 -8.430 5.214 1.00 0.00 H new ATOM 1449 N CYS A 781 -18.867 -9.603 0.420 1.00 0.00 N ATOM 1450 CA CYS A 781 -19.421 -10.070 -0.818 1.00 0.00 C ATOM 1451 C CYS A 781 -20.825 -10.605 -0.541 1.00 0.00 C ATOM 1452 O CYS A 781 -21.175 -10.877 0.607 1.00 0.00 O ATOM 1453 CB CYS A 781 -18.508 -11.175 -1.388 1.00 0.00 C ATOM 1454 SG CYS A 781 -18.934 -11.821 -3.053 1.00 0.00 S ATOM 0 H CYS A 781 -18.713 -10.333 1.116 1.00 0.00 H new ATOM 0 HA CYS A 781 -19.485 -9.266 -1.551 1.00 0.00 H new ATOM 0 HB2 CYS A 781 -17.489 -10.790 -1.423 1.00 0.00 H new ATOM 0 HB3 CYS A 781 -18.509 -12.011 -0.689 1.00 0.00 H new ATOM 0 HG CYS A 781 -18.078 -12.738 -3.395 1.00 0.00 H new ATOM 1459 N ARG A 782 -21.620 -10.757 -1.570 1.00 0.00 N ATOM 1460 CA ARG A 782 -22.963 -11.285 -1.426 1.00 0.00 C ATOM 1461 C ARG A 782 -22.912 -12.790 -1.181 1.00 0.00 C ATOM 1462 O ARG A 782 -23.853 -13.385 -0.647 1.00 0.00 O ATOM 1463 CB ARG A 782 -23.835 -10.923 -2.640 1.00 0.00 C ATOM 1464 CG ARG A 782 -23.290 -11.378 -3.988 1.00 0.00 C ATOM 1465 CD ARG A 782 -24.164 -10.871 -5.116 1.00 0.00 C ATOM 1466 NE ARG A 782 -23.660 -11.252 -6.440 1.00 0.00 N ATOM 1467 CZ ARG A 782 -24.167 -10.819 -7.599 1.00 0.00 C ATOM 1468 NH1 ARG A 782 -25.153 -9.930 -7.602 1.00 0.00 N ATOM 1469 NH2 ARG A 782 -23.665 -11.256 -8.750 1.00 0.00 N ATOM 0 H ARG A 782 -21.361 -10.521 -2.528 1.00 0.00 H new ATOM 0 HA ARG A 782 -23.431 -10.823 -0.557 1.00 0.00 H new ATOM 0 HB2 ARG A 782 -24.824 -11.359 -2.500 1.00 0.00 H new ATOM 0 HB3 ARG A 782 -23.964 -9.841 -2.665 1.00 0.00 H new ATOM 0 HG2 ARG A 782 -22.272 -11.011 -4.117 1.00 0.00 H new ATOM 0 HG3 ARG A 782 -23.243 -12.467 -4.018 1.00 0.00 H new ATOM 0 HD2 ARG A 782 -25.174 -11.261 -4.991 1.00 0.00 H new ATOM 0 HD3 ARG A 782 -24.232 -9.785 -5.057 1.00 0.00 H new ATOM 0 HE ARG A 782 -22.867 -11.892 -6.479 1.00 0.00 H new ATOM 0 HH11 ARG A 782 -25.524 -9.577 -6.720 1.00 0.00 H new ATOM 0 HH12 ARG A 782 -25.539 -9.600 -8.486 1.00 0.00 H new ATOM 0 HH21 ARG A 782 -22.893 -11.922 -8.749 1.00 0.00 H new ATOM 0 HH22 ARG A 782 -24.052 -10.925 -9.634 1.00 0.00 H new ATOM 1483 N GLY A 783 -21.803 -13.401 -1.571 1.00 0.00 N ATOM 1484 CA GLY A 783 -21.607 -14.804 -1.307 1.00 0.00 C ATOM 1485 C GLY A 783 -20.721 -15.037 -0.108 1.00 0.00 C ATOM 1486 O GLY A 783 -20.579 -16.163 0.362 1.00 0.00 O ATOM 0 H GLY A 783 -21.036 -12.946 -2.066 1.00 0.00 H new ATOM 0 HA2 GLY A 783 -22.574 -15.280 -1.141 1.00 0.00 H new ATOM 0 HA3 GLY A 783 -21.164 -15.279 -2.182 1.00 0.00 H new ATOM 1490 N LYS A 784 -20.124 -13.973 0.397 1.00 0.00 N ATOM 1491 CA LYS A 784 -19.224 -14.068 1.536 1.00 0.00 C ATOM 1492 C LYS A 784 -19.618 -13.094 2.607 1.00 0.00 C ATOM 1493 O LYS A 784 -19.404 -11.879 2.459 1.00 0.00 O ATOM 1494 CB LYS A 784 -17.752 -13.792 1.177 1.00 0.00 C ATOM 1495 CG LYS A 784 -17.001 -14.863 0.400 1.00 0.00 C ATOM 1496 CD LYS A 784 -17.488 -15.003 -1.015 1.00 0.00 C ATOM 1497 CE LYS A 784 -16.606 -15.941 -1.792 1.00 0.00 C ATOM 1498 NZ LYS A 784 -17.045 -16.071 -3.181 1.00 0.00 N ATOM 0 H LYS A 784 -20.246 -13.027 0.035 1.00 0.00 H new ATOM 0 HA LYS A 784 -19.310 -15.097 1.884 1.00 0.00 H new ATOM 0 HB2 LYS A 784 -17.715 -12.869 0.598 1.00 0.00 H new ATOM 0 HB3 LYS A 784 -17.209 -13.608 2.104 1.00 0.00 H new ATOM 0 HG2 LYS A 784 -15.938 -14.622 0.392 1.00 0.00 H new ATOM 0 HG3 LYS A 784 -17.107 -15.819 0.912 1.00 0.00 H new ATOM 0 HD2 LYS A 784 -18.513 -15.375 -1.017 1.00 0.00 H new ATOM 0 HD3 LYS A 784 -17.502 -14.026 -1.498 1.00 0.00 H new ATOM 0 HE2 LYS A 784 -15.578 -15.578 -1.768 1.00 0.00 H new ATOM 0 HE3 LYS A 784 -16.609 -16.922 -1.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 784 -16.413 -16.725 -3.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 784 -18.017 -16.441 -3.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 784 -17.018 -15.139 -3.642 1.00 0.00 H new ATOM 1512 N GLU A 785 -20.216 -13.591 3.648 1.00 0.00 N ATOM 1513 CA GLU A 785 -20.525 -12.766 4.779 1.00 0.00 C ATOM 1514 C GLU A 785 -19.264 -12.579 5.627 1.00 0.00 C ATOM 1515 O GLU A 785 -18.248 -13.251 5.402 1.00 0.00 O ATOM 1516 CB GLU A 785 -21.687 -13.334 5.590 1.00 0.00 C ATOM 1517 CG GLU A 785 -21.486 -14.750 6.078 1.00 0.00 C ATOM 1518 CD GLU A 785 -22.642 -15.216 6.905 1.00 0.00 C ATOM 1519 OE1 GLU A 785 -22.642 -14.961 8.130 1.00 0.00 O ATOM 1520 OE2 GLU A 785 -23.579 -15.824 6.351 1.00 0.00 O ATOM 0 H GLU A 785 -20.501 -14.566 3.738 1.00 0.00 H new ATOM 0 HA GLU A 785 -20.854 -11.788 4.428 1.00 0.00 H new ATOM 0 HB2 GLU A 785 -21.860 -12.689 6.451 1.00 0.00 H new ATOM 0 HB3 GLU A 785 -22.589 -13.300 4.979 1.00 0.00 H new ATOM 0 HG2 GLU A 785 -21.357 -15.415 5.224 1.00 0.00 H new ATOM 0 HG3 GLU A 785 -20.570 -14.806 6.667 1.00 0.00 H new ATOM 1527 N GLY A 786 -19.327 -11.693 6.577 1.00 0.00 N ATOM 1528 CA GLY A 786 -18.157 -11.343 7.323 1.00 0.00 C ATOM 1529 C GLY A 786 -17.599 -10.087 6.725 1.00 0.00 C ATOM 1530 O GLY A 786 -18.295 -9.433 5.947 1.00 0.00 O ATOM 0 H GLY A 786 -20.176 -11.200 6.853 1.00 0.00 H new ATOM 0 HA2 GLY A 786 -18.404 -11.190 8.374 1.00 0.00 H new ATOM 0 HA3 GLY A 786 -17.422 -12.147 7.282 1.00 0.00 H new ATOM 1534 N TRP A 787 -16.409 -9.704 7.080 1.00 0.00 N ATOM 1535 CA TRP A 787 -15.810 -8.520 6.483 1.00 0.00 C ATOM 1536 C TRP A 787 -14.372 -8.776 6.194 1.00 0.00 C ATOM 1537 O TRP A 787 -13.686 -9.449 6.953 1.00 0.00 O ATOM 1538 CB TRP A 787 -15.942 -7.278 7.363 1.00 0.00 C ATOM 1539 CG TRP A 787 -17.347 -6.946 7.729 1.00 0.00 C ATOM 1540 CD1 TRP A 787 -17.998 -7.343 8.850 1.00 0.00 C ATOM 1541 CD2 TRP A 787 -18.286 -6.170 6.968 1.00 0.00 C ATOM 1542 NE1 TRP A 787 -19.273 -6.885 8.834 1.00 0.00 N ATOM 1543 CE2 TRP A 787 -19.483 -6.156 7.699 1.00 0.00 C ATOM 1544 CE3 TRP A 787 -18.235 -5.488 5.746 1.00 0.00 C ATOM 1545 CZ2 TRP A 787 -20.622 -5.495 7.254 1.00 0.00 C ATOM 1546 CZ3 TRP A 787 -19.366 -4.833 5.311 1.00 0.00 C ATOM 1547 CH2 TRP A 787 -20.543 -4.841 6.061 1.00 0.00 C ATOM 0 H TRP A 787 -15.829 -10.180 7.771 1.00 0.00 H new ATOM 0 HA TRP A 787 -16.355 -8.319 5.561 1.00 0.00 H new ATOM 0 HB2 TRP A 787 -15.365 -7.428 8.275 1.00 0.00 H new ATOM 0 HB3 TRP A 787 -15.501 -6.427 6.843 1.00 0.00 H new ATOM 0 HD1 TRP A 787 -17.564 -7.937 9.640 1.00 0.00 H new ATOM 0 HE1 TRP A 787 -19.969 -7.058 9.559 1.00 0.00 H new ATOM 0 HE3 TRP A 787 -17.329 -5.476 5.158 1.00 0.00 H new ATOM 0 HZ2 TRP A 787 -21.535 -5.500 7.832 1.00 0.00 H new ATOM 0 HZ3 TRP A 787 -19.341 -4.303 4.371 1.00 0.00 H new ATOM 0 HH2 TRP A 787 -21.411 -4.317 5.688 1.00 0.00 H new ATOM 1558 N ILE A 788 -13.912 -8.251 5.108 1.00 0.00 N ATOM 1559 CA ILE A 788 -12.548 -8.477 4.705 1.00 0.00 C ATOM 1560 C ILE A 788 -11.633 -7.358 5.209 1.00 0.00 C ATOM 1561 O ILE A 788 -10.554 -7.632 5.725 1.00 0.00 O ATOM 1562 CB ILE A 788 -12.401 -8.651 3.151 1.00 0.00 C ATOM 1563 CG1 ILE A 788 -13.221 -9.855 2.616 1.00 0.00 C ATOM 1564 CG2 ILE A 788 -10.940 -8.808 2.748 1.00 0.00 C ATOM 1565 CD1 ILE A 788 -14.724 -9.650 2.526 1.00 0.00 C ATOM 0 H ILE A 788 -14.454 -7.661 4.477 1.00 0.00 H new ATOM 0 HA ILE A 788 -12.239 -9.416 5.165 1.00 0.00 H new ATOM 0 HB ILE A 788 -12.800 -7.742 2.701 1.00 0.00 H new ATOM 0 HG12 ILE A 788 -12.849 -10.110 1.624 1.00 0.00 H new ATOM 0 HG13 ILE A 788 -13.029 -10.714 3.259 1.00 0.00 H new ATOM 0 HG21 ILE A 788 -10.872 -8.926 1.667 1.00 0.00 H new ATOM 0 HG22 ILE A 788 -10.382 -7.923 3.052 1.00 0.00 H new ATOM 0 HG23 ILE A 788 -10.520 -9.687 3.237 1.00 0.00 H new ATOM 0 HD11 ILE A 788 -15.192 -10.555 2.140 1.00 0.00 H new ATOM 0 HD12 ILE A 788 -15.121 -9.430 3.517 1.00 0.00 H new ATOM 0 HD13 ILE A 788 -14.938 -8.817 1.856 1.00 0.00 H new ATOM 1577 N HIS A 789 -12.135 -6.110 5.132 1.00 0.00 N ATOM 1578 CA HIS A 789 -11.374 -4.867 5.455 1.00 0.00 C ATOM 1579 C HIS A 789 -10.404 -4.561 4.338 1.00 0.00 C ATOM 1580 O HIS A 789 -9.675 -5.428 3.893 1.00 0.00 O ATOM 1581 CB HIS A 789 -10.608 -4.877 6.813 1.00 0.00 C ATOM 1582 CG HIS A 789 -11.444 -4.970 8.050 1.00 0.00 C ATOM 1583 ND1 HIS A 789 -12.668 -5.476 8.256 1.00 0.00 N flip ATOM 1584 CD2 HIS A 789 -11.009 -4.529 9.272 1.00 0.00 C flip ATOM 1585 CE1 HIS A 789 -12.946 -5.335 9.586 1.00 0.00 C flip ATOM 1586 NE2 HIS A 789 -11.925 -4.759 10.176 1.00 0.00 N flip ATOM 0 H HIS A 789 -13.095 -5.924 4.840 1.00 0.00 H new ATOM 0 HA HIS A 789 -12.133 -4.092 5.558 1.00 0.00 H new ATOM 0 HB2 HIS A 789 -9.913 -5.717 6.807 1.00 0.00 H new ATOM 0 HB3 HIS A 789 -10.009 -3.968 6.874 1.00 0.00 H new ATOM 0 HD2 HIS A 789 -10.054 -4.062 9.460 1.00 0.00 H new ATOM 0 HE1 HIS A 789 -13.858 -5.647 10.073 1.00 0.00 H new ATOM 0 HE2 HIS A 789 -11.858 -4.530 11.168 1.00 0.00 H new ATOM 1595 N THR A 790 -10.433 -3.361 3.861 1.00 0.00 N ATOM 1596 CA THR A 790 -9.575 -2.963 2.787 1.00 0.00 C ATOM 1597 C THR A 790 -9.275 -1.474 2.874 1.00 0.00 C ATOM 1598 O THR A 790 -10.043 -0.706 3.474 1.00 0.00 O ATOM 1599 CB THR A 790 -10.199 -3.350 1.424 1.00 0.00 C ATOM 1600 OG1 THR A 790 -9.454 -2.833 0.335 1.00 0.00 O ATOM 1601 CG2 THR A 790 -11.644 -2.918 1.339 1.00 0.00 C ATOM 0 H THR A 790 -11.052 -2.626 4.203 1.00 0.00 H new ATOM 0 HA THR A 790 -8.627 -3.494 2.873 1.00 0.00 H new ATOM 0 HB THR A 790 -10.165 -4.437 1.357 1.00 0.00 H new ATOM 0 HG1 THR A 790 -9.055 -3.573 -0.169 1.00 0.00 H new ATOM 0 HG21 THR A 790 -12.053 -3.204 0.370 1.00 0.00 H new ATOM 0 HG22 THR A 790 -12.216 -3.401 2.131 1.00 0.00 H new ATOM 0 HG23 THR A 790 -11.708 -1.836 1.454 1.00 0.00 H new ATOM 1609 N VAL A 791 -8.158 -1.085 2.320 1.00 0.00 N ATOM 1610 CA VAL A 791 -7.694 0.268 2.370 1.00 0.00 C ATOM 1611 C VAL A 791 -7.654 0.840 0.963 1.00 0.00 C ATOM 1612 O VAL A 791 -7.195 0.179 0.042 1.00 0.00 O ATOM 1613 CB VAL A 791 -6.270 0.308 2.971 1.00 0.00 C ATOM 1614 CG1 VAL A 791 -5.766 1.733 3.123 1.00 0.00 C ATOM 1615 CG2 VAL A 791 -6.230 -0.426 4.301 1.00 0.00 C ATOM 0 H VAL A 791 -7.536 -1.715 1.813 1.00 0.00 H new ATOM 0 HA VAL A 791 -8.370 0.857 2.990 1.00 0.00 H new ATOM 0 HB VAL A 791 -5.603 -0.201 2.276 1.00 0.00 H new ATOM 0 HG11 VAL A 791 -4.762 1.721 3.548 1.00 0.00 H new ATOM 0 HG12 VAL A 791 -5.740 2.216 2.146 1.00 0.00 H new ATOM 0 HG13 VAL A 791 -6.433 2.286 3.784 1.00 0.00 H new ATOM 0 HG21 VAL A 791 -5.220 -0.387 4.708 1.00 0.00 H new ATOM 0 HG22 VAL A 791 -6.921 0.047 4.999 1.00 0.00 H new ATOM 0 HG23 VAL A 791 -6.521 -1.466 4.152 1.00 0.00 H new ATOM 1625 N CYS A 792 -8.173 2.038 0.798 1.00 0.00 N ATOM 1626 CA CYS A 792 -8.137 2.707 -0.494 1.00 0.00 C ATOM 1627 C CYS A 792 -6.701 3.108 -0.841 1.00 0.00 C ATOM 1628 O CYS A 792 -6.096 3.971 -0.203 1.00 0.00 O ATOM 1629 CB CYS A 792 -9.038 3.931 -0.496 1.00 0.00 C ATOM 1630 SG CYS A 792 -9.096 4.851 -2.066 1.00 0.00 S ATOM 0 H CYS A 792 -8.626 2.572 1.540 1.00 0.00 H new ATOM 0 HA CYS A 792 -8.504 2.012 -1.249 1.00 0.00 H new ATOM 0 HB2 CYS A 792 -10.050 3.617 -0.240 1.00 0.00 H new ATOM 0 HB3 CYS A 792 -8.705 4.608 0.291 1.00 0.00 H new ATOM 1635 N ILE A 793 -6.185 2.485 -1.827 1.00 0.00 N ATOM 1636 CA ILE A 793 -4.851 2.671 -2.291 1.00 0.00 C ATOM 1637 C ILE A 793 -4.895 3.312 -3.659 1.00 0.00 C ATOM 1638 O ILE A 793 -4.886 2.637 -4.680 1.00 0.00 O ATOM 1639 CB ILE A 793 -4.084 1.324 -2.359 1.00 0.00 C ATOM 1640 CG1 ILE A 793 -3.986 0.676 -0.969 1.00 0.00 C ATOM 1641 CG2 ILE A 793 -2.693 1.501 -2.969 1.00 0.00 C ATOM 1642 CD1 ILE A 793 -3.238 1.506 0.066 1.00 0.00 C ATOM 0 H ILE A 793 -6.702 1.792 -2.368 1.00 0.00 H new ATOM 0 HA ILE A 793 -4.321 3.317 -1.591 1.00 0.00 H new ATOM 0 HB ILE A 793 -4.651 0.658 -3.010 1.00 0.00 H new ATOM 0 HG12 ILE A 793 -4.994 0.482 -0.601 1.00 0.00 H new ATOM 0 HG13 ILE A 793 -3.491 -0.290 -1.067 1.00 0.00 H new ATOM 0 HG21 ILE A 793 -2.184 0.537 -3.001 1.00 0.00 H new ATOM 0 HG22 ILE A 793 -2.787 1.896 -3.981 1.00 0.00 H new ATOM 0 HG23 ILE A 793 -2.115 2.196 -2.361 1.00 0.00 H new ATOM 0 HD11 ILE A 793 -3.218 0.972 1.016 1.00 0.00 H new ATOM 0 HD12 ILE A 793 -2.217 1.678 -0.275 1.00 0.00 H new ATOM 0 HD13 ILE A 793 -3.743 2.463 0.199 1.00 0.00 H new ATOM 1654 N ASN A 794 -5.066 4.617 -3.642 1.00 0.00 N ATOM 1655 CA ASN A 794 -5.072 5.472 -4.835 1.00 0.00 C ATOM 1656 C ASN A 794 -6.038 4.945 -5.892 1.00 0.00 C ATOM 1657 O ASN A 794 -5.611 4.487 -6.954 1.00 0.00 O ATOM 1658 CB ASN A 794 -3.689 5.635 -5.524 1.00 0.00 C ATOM 1659 CG ASN A 794 -2.479 5.609 -4.644 1.00 0.00 C ATOM 1660 OD1 ASN A 794 -1.413 5.248 -5.101 1.00 0.00 O ATOM 1661 ND2 ASN A 794 -2.611 5.955 -3.390 1.00 0.00 N ATOM 0 H ASN A 794 -5.210 5.138 -2.777 1.00 0.00 H new ATOM 0 HA ASN A 794 -5.381 6.445 -4.453 1.00 0.00 H new ATOM 0 HB2 ASN A 794 -3.585 4.842 -6.265 1.00 0.00 H new ATOM 0 HB3 ASN A 794 -3.691 6.580 -6.067 1.00 0.00 H new ATOM 0 HD21 ASN A 794 -1.805 5.926 -2.765 1.00 0.00 H new ATOM 0 HD22 ASN A 794 -3.520 6.254 -3.036 1.00 0.00 H new ATOM 1668 N GLY A 795 -7.311 4.966 -5.598 1.00 0.00 N ATOM 1669 CA GLY A 795 -8.285 4.510 -6.569 1.00 0.00 C ATOM 1670 C GLY A 795 -8.305 2.988 -6.740 1.00 0.00 C ATOM 1671 O GLY A 795 -8.807 2.476 -7.750 1.00 0.00 O ATOM 0 H GLY A 795 -7.699 5.287 -4.711 1.00 0.00 H new ATOM 0 HA2 GLY A 795 -9.276 4.847 -6.265 1.00 0.00 H new ATOM 0 HA3 GLY A 795 -8.072 4.974 -7.532 1.00 0.00 H new ATOM 1675 N ARG A 796 -7.790 2.267 -5.759 1.00 0.00 N ATOM 1676 CA ARG A 796 -7.748 0.830 -5.798 1.00 0.00 C ATOM 1677 C ARG A 796 -7.896 0.386 -4.386 1.00 0.00 C ATOM 1678 O ARG A 796 -7.692 1.165 -3.492 1.00 0.00 O ATOM 1679 CB ARG A 796 -6.397 0.380 -6.267 1.00 0.00 C ATOM 1680 CG ARG A 796 -6.303 -1.060 -6.718 1.00 0.00 C ATOM 1681 CD ARG A 796 -4.870 -1.409 -6.932 1.00 0.00 C ATOM 1682 NE ARG A 796 -4.671 -2.756 -7.427 1.00 0.00 N ATOM 1683 CZ ARG A 796 -3.473 -3.290 -7.662 1.00 0.00 C ATOM 1684 NH1 ARG A 796 -2.387 -2.522 -7.706 1.00 0.00 N ATOM 1685 NH2 ARG A 796 -3.372 -4.575 -7.903 1.00 0.00 N ATOM 0 H ARG A 796 -7.389 2.671 -4.913 1.00 0.00 H new ATOM 0 HA ARG A 796 -8.517 0.431 -6.459 1.00 0.00 H new ATOM 0 HB2 ARG A 796 -6.088 1.021 -7.093 1.00 0.00 H new ATOM 0 HB3 ARG A 796 -5.682 0.535 -5.459 1.00 0.00 H new ATOM 0 HG2 ARG A 796 -6.743 -1.719 -5.969 1.00 0.00 H new ATOM 0 HG3 ARG A 796 -6.867 -1.203 -7.640 1.00 0.00 H new ATOM 0 HD2 ARG A 796 -4.434 -0.703 -7.638 1.00 0.00 H new ATOM 0 HD3 ARG A 796 -4.332 -1.293 -5.991 1.00 0.00 H new ATOM 0 HE ARG A 796 -5.496 -3.329 -7.606 1.00 0.00 H new ATOM 0 HH11 ARG A 796 -2.468 -1.516 -7.559 1.00 0.00 H new ATOM 0 HH12 ARG A 796 -1.474 -2.940 -7.886 1.00 0.00 H new ATOM 0 HH21 ARG A 796 -4.208 -5.160 -7.910 1.00 0.00 H new ATOM 0 HH22 ARG A 796 -2.458 -4.990 -8.084 1.00 0.00 H new ATOM 1699 N TRP A 797 -8.197 -0.817 -4.174 1.00 0.00 N ATOM 1700 CA TRP A 797 -8.353 -1.294 -2.840 1.00 0.00 C ATOM 1701 C TRP A 797 -7.213 -2.207 -2.464 1.00 0.00 C ATOM 1702 O TRP A 797 -6.481 -2.695 -3.336 1.00 0.00 O ATOM 1703 CB TRP A 797 -9.667 -2.008 -2.738 1.00 0.00 C ATOM 1704 CG TRP A 797 -10.821 -1.088 -2.827 1.00 0.00 C ATOM 1705 CD1 TRP A 797 -11.700 -0.961 -3.854 1.00 0.00 C ATOM 1706 CD2 TRP A 797 -11.193 -0.132 -1.852 1.00 0.00 C ATOM 1707 NE1 TRP A 797 -12.623 0.009 -3.560 1.00 0.00 N ATOM 1708 CE2 TRP A 797 -12.322 0.536 -2.333 1.00 0.00 C ATOM 1709 CE3 TRP A 797 -10.677 0.219 -0.606 1.00 0.00 C ATOM 1710 CZ2 TRP A 797 -12.940 1.532 -1.612 1.00 0.00 C ATOM 1711 CZ3 TRP A 797 -11.289 1.213 0.105 1.00 0.00 C ATOM 1712 CH2 TRP A 797 -12.403 1.857 -0.397 1.00 0.00 C ATOM 0 H TRP A 797 -8.347 -1.515 -4.903 1.00 0.00 H new ATOM 0 HA TRP A 797 -8.340 -0.455 -2.145 1.00 0.00 H new ATOM 0 HB2 TRP A 797 -9.736 -2.750 -3.533 1.00 0.00 H new ATOM 0 HB3 TRP A 797 -9.710 -2.549 -1.793 1.00 0.00 H new ATOM 0 HD1 TRP A 797 -11.676 -1.538 -4.767 1.00 0.00 H new ATOM 0 HE1 TRP A 797 -13.402 0.290 -4.155 1.00 0.00 H new ATOM 0 HE3 TRP A 797 -9.809 -0.286 -0.209 1.00 0.00 H new ATOM 0 HZ2 TRP A 797 -13.816 2.038 -1.991 1.00 0.00 H new ATOM 0 HZ3 TRP A 797 -10.897 1.498 1.070 1.00 0.00 H new ATOM 0 HH2 TRP A 797 -12.863 2.640 0.187 1.00 0.00 H new ATOM 1723 N ASP A 798 -7.036 -2.420 -1.187 1.00 0.00 N ATOM 1724 CA ASP A 798 -6.019 -3.325 -0.693 1.00 0.00 C ATOM 1725 C ASP A 798 -6.473 -3.926 0.612 1.00 0.00 C ATOM 1726 O ASP A 798 -6.442 -3.252 1.652 1.00 0.00 O ATOM 1727 CB ASP A 798 -4.698 -2.611 -0.505 1.00 0.00 C ATOM 1728 CG ASP A 798 -3.552 -3.532 -0.156 1.00 0.00 C ATOM 1729 OD1 ASP A 798 -3.093 -4.275 -1.039 1.00 0.00 O ATOM 1730 OD2 ASP A 798 -3.058 -3.506 0.988 1.00 0.00 O ATOM 0 H ASP A 798 -7.590 -1.974 -0.456 1.00 0.00 H new ATOM 0 HA ASP A 798 -5.871 -4.116 -1.429 1.00 0.00 H new ATOM 0 HB2 ASP A 798 -4.453 -2.072 -1.420 1.00 0.00 H new ATOM 0 HB3 ASP A 798 -4.807 -1.867 0.284 1.00 0.00 H new ATOM 1735 N PRO A 799 -6.948 -5.181 0.593 1.00 0.00 N ATOM 1736 CA PRO A 799 -7.063 -6.002 -0.633 1.00 0.00 C ATOM 1737 C PRO A 799 -8.164 -5.529 -1.591 1.00 0.00 C ATOM 1738 O PRO A 799 -9.227 -5.062 -1.158 1.00 0.00 O ATOM 1739 CB PRO A 799 -7.412 -7.388 -0.102 1.00 0.00 C ATOM 1740 CG PRO A 799 -8.047 -7.143 1.217 1.00 0.00 C ATOM 1741 CD PRO A 799 -7.391 -5.921 1.781 1.00 0.00 C ATOM 0 HA PRO A 799 -6.144 -5.953 -1.217 1.00 0.00 H new ATOM 0 HB2 PRO A 799 -8.091 -7.910 -0.776 1.00 0.00 H new ATOM 0 HB3 PRO A 799 -6.522 -8.009 -0.003 1.00 0.00 H new ATOM 0 HG2 PRO A 799 -9.121 -6.992 1.109 1.00 0.00 H new ATOM 0 HG3 PRO A 799 -7.910 -7.998 1.879 1.00 0.00 H new ATOM 0 HD2 PRO A 799 -8.087 -5.335 2.381 1.00 0.00 H new ATOM 0 HD3 PRO A 799 -6.552 -6.179 2.427 1.00 0.00 H new ATOM 1749 N GLU A 800 -7.856 -5.587 -2.874 1.00 0.00 N ATOM 1750 CA GLU A 800 -8.793 -5.265 -3.953 1.00 0.00 C ATOM 1751 C GLU A 800 -10.099 -5.996 -3.789 1.00 0.00 C ATOM 1752 O GLU A 800 -10.122 -7.226 -3.699 1.00 0.00 O ATOM 1753 CB GLU A 800 -8.210 -5.649 -5.283 1.00 0.00 C ATOM 1754 CG GLU A 800 -7.042 -4.830 -5.663 1.00 0.00 C ATOM 1755 CD GLU A 800 -6.418 -5.299 -6.934 1.00 0.00 C ATOM 1756 OE1 GLU A 800 -5.516 -6.168 -6.899 1.00 0.00 O ATOM 1757 OE2 GLU A 800 -6.783 -4.794 -7.996 1.00 0.00 O ATOM 0 H GLU A 800 -6.933 -5.863 -3.209 1.00 0.00 H new ATOM 0 HA GLU A 800 -8.972 -4.191 -3.908 1.00 0.00 H new ATOM 0 HB2 GLU A 800 -7.916 -6.698 -5.255 1.00 0.00 H new ATOM 0 HB3 GLU A 800 -8.978 -5.554 -6.051 1.00 0.00 H new ATOM 0 HG2 GLU A 800 -7.349 -3.790 -5.773 1.00 0.00 H new ATOM 0 HG3 GLU A 800 -6.302 -4.861 -4.863 1.00 0.00 H new ATOM 1764 N VAL A 801 -11.169 -5.256 -3.747 1.00 0.00 N ATOM 1765 CA VAL A 801 -12.427 -5.778 -3.568 1.00 0.00 C ATOM 1766 C VAL A 801 -12.948 -6.421 -4.863 1.00 0.00 C ATOM 1767 O VAL A 801 -12.827 -5.855 -5.962 1.00 0.00 O ATOM 1768 CB VAL A 801 -13.372 -4.667 -3.064 1.00 0.00 C ATOM 1769 CG1 VAL A 801 -12.774 -3.866 -1.931 1.00 0.00 C ATOM 1770 CG2 VAL A 801 -13.967 -3.782 -4.137 1.00 0.00 C ATOM 0 H VAL A 801 -11.153 -4.241 -3.843 1.00 0.00 H new ATOM 0 HA VAL A 801 -12.386 -6.568 -2.818 1.00 0.00 H new ATOM 0 HB VAL A 801 -14.226 -5.216 -2.667 1.00 0.00 H new ATOM 0 HG11 VAL A 801 -13.481 -3.099 -1.615 1.00 0.00 H new ATOM 0 HG12 VAL A 801 -12.558 -4.528 -1.092 1.00 0.00 H new ATOM 0 HG13 VAL A 801 -11.851 -3.393 -2.267 1.00 0.00 H new ATOM 0 HG21 VAL A 801 -14.615 -3.036 -3.676 1.00 0.00 H new ATOM 0 HG22 VAL A 801 -13.166 -3.281 -4.681 1.00 0.00 H new ATOM 0 HG23 VAL A 801 -14.550 -4.390 -4.829 1.00 0.00 H new