USER MOD reduce.3.24.130724 H: found=0, std=0, add=1085, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1081 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 714 HIS : no HE2:sc= -19.2! C(o=-40!,f=-55!) USER MOD Set 1.2: A 717 CYS SG : rot 69:sc= -21.1! USER MOD Set 2.1: A 652 HIS : no HE2:sc= -11.5! C(o=-10!,f=-20!) USER MOD Set 2.2: A 667 SER OG : rot 103:sc= 1.28 USER MOD Set 3.1: A 665 SER OG : rot 13:sc= -1.43! USER MOD Set 3.2: A 670 HIS : no HE2:sc= -2.06! K(o=-3.5!,f=-4.4) USER MOD Set 4.1: A 640 CYS SG : rot 140:sc= -0.653! USER MOD Set 4.2: A 643 CYS SG : rot 64:sc= -1.43! USER MOD Set 4.3: A 666 CYS SG : rot -177:sc= -6.72! USER MOD Set 4.4: A 669 CYS SG : rot 103:sc= 0.392 USER MOD Set 5.1: A 628 CYS SG : rot -105:sc= -2.67! USER MOD Set 5.2: A 631 CYS SG : rot 180:sc= 1.07 USER MOD Set 5.3: A 648 HIS :FLIP no HE2:sc= -6.85! C(o=-12!,f=-9.5!) USER MOD Set 5.4: A 651 CYS SG : rot -166:sc= -1 USER MOD Single : A 626 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 632 GLN : amide:sc= 0.0741 X(o=0.074,f=0) USER MOD Single : A 633 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 639 MET CE :methyl 159:sc= -0.518 (180deg=-1.96!) USER MOD Single : A 641 ASN : amide:sc= -2.54! C(o=-2.5!,f=-3.9!) USER MOD Single : A 642 GLN : amide:sc= -2.45 K(o=-2.4,f=-5.2!) USER MOD Single : A 646 CYS SG : rot 15:sc= -1.99 USER MOD Single : A 657 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 695 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 697 SER OG : rot 48:sc= 1.24 USER MOD Single : A 700 ASN : amide:sc= -2.34 K(o=-2.3,f=-5.8!) USER MOD Single : A 701 GLN :FLIP amide:sc= -1.65 F(o=-4.9!,f=-1.7) USER MOD Single : A 703 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 704 CYS SG : rot -51:sc= -23.4! USER MOD Single : A 713 CYS SG : rot -55:sc= -0.0368 USER MOD Single : A 721 HIS : no HD1:sc= -14.9! C(o=-15!,f=-15!) USER MOD Single : A 722 GLN :FLIP amide:sc= -3.64! C(o=-5.1!,f=-3.6!) USER MOD Single : A 725 THR OG1 : rot 180:sc= 0 USER MOD Single : A 737 THR OG1 : rot 180:sc= 0 USER MOD Single : A 741 THR OG1 : rot -44:sc= 1.19 USER MOD Single : A 748 GLN : amide:sc= -3.02! C(o=-3!,f=-3.1!) USER MOD Single : A 750 LYS NZ :NH3+ 162:sc= -0.0799 (180deg=-0.415) USER MOD Single : A 752 SER OG : rot -49:sc= 0.143 USER MOD Single : A 755 TYR OH : rot -160:sc= -14.4! USER MOD Single : A 756 SER OG : rot -59:sc= 1.16 USER MOD Single : A 757 SER OG : rot 57:sc= -4.67! USER MOD Single : A 759 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 763 GLN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 768 MET CE :methyl 150:sc= -19.9! (180deg=-24.9!) USER MOD Single : A 770 LYS NZ :NH3+ 144:sc= -0.0311 (180deg=-1.64!) USER MOD Single : A 771 GLN : amide:sc= -1.52 X(o=-1.5,f=-1.4) USER MOD Single : A 773 ASN : amide:sc= -4.86! C(o=-4.9!,f=-5.1!) USER MOD Single : A 774 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0119) USER MOD Single : A 783 GLN :FLIP amide:sc= -0.612 F(o=-5.8!,f=-0.61) USER MOD Single : A 784 SER OG : rot 180:sc= -0.0325 USER MOD Single : A 789 GLN :FLIP amide:sc= -1.85 F(o=-9.4!,f=-1.9) USER MOD Single : A 794 THR OG1 : rot 180:sc= 0 USER MOD Single : A 796 MET CE :methyl 165:sc= -8.63! (180deg=-10.3!) USER MOD Single : A 797 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 14 N ALA A 625 10.078 -16.477 8.247 1.00 0.00 N ATOM 15 CA ALA A 625 10.974 -16.796 7.143 1.00 0.00 C ATOM 16 C ALA A 625 11.271 -15.584 6.285 1.00 0.00 C ATOM 17 O ALA A 625 11.933 -15.715 5.255 1.00 0.00 O ATOM 18 CB ALA A 625 10.387 -17.873 6.269 1.00 0.00 C ATOM 0 HA ALA A 625 11.904 -17.146 7.591 1.00 0.00 H new ATOM 0 HB1 ALA A 625 11.074 -18.094 5.452 1.00 0.00 H new ATOM 0 HB2 ALA A 625 10.226 -18.774 6.861 1.00 0.00 H new ATOM 0 HB3 ALA A 625 9.436 -17.532 5.861 1.00 0.00 H new ATOM 24 N THR A 626 10.795 -14.411 6.707 1.00 0.00 N ATOM 25 CA THR A 626 11.001 -13.191 5.933 1.00 0.00 C ATOM 26 C THR A 626 10.063 -13.155 4.756 1.00 0.00 C ATOM 27 O THR A 626 9.285 -12.224 4.603 1.00 0.00 O ATOM 28 CB THR A 626 12.441 -13.059 5.478 1.00 0.00 C ATOM 29 OG1 THR A 626 13.339 -13.580 6.464 1.00 0.00 O ATOM 30 CG2 THR A 626 12.759 -11.618 5.195 1.00 0.00 C ATOM 0 H THR A 626 10.270 -14.283 7.572 1.00 0.00 H new ATOM 0 HA THR A 626 10.783 -12.341 6.580 1.00 0.00 H new ATOM 0 HB THR A 626 12.568 -13.639 4.564 1.00 0.00 H new ATOM 0 HG1 THR A 626 14.262 -13.486 6.148 1.00 0.00 H new ATOM 0 HG21 THR A 626 13.795 -11.531 4.869 1.00 0.00 H new ATOM 0 HG22 THR A 626 12.099 -11.247 4.411 1.00 0.00 H new ATOM 0 HG23 THR A 626 12.613 -11.029 6.100 1.00 0.00 H new ATOM 38 N ILE A 627 10.126 -14.206 3.973 1.00 0.00 N ATOM 39 CA ILE A 627 9.296 -14.403 2.803 1.00 0.00 C ATOM 40 C ILE A 627 8.499 -13.193 2.390 1.00 0.00 C ATOM 41 O ILE A 627 7.563 -12.753 3.058 1.00 0.00 O ATOM 42 CB ILE A 627 8.424 -15.569 3.080 1.00 0.00 C ATOM 43 CG1 ILE A 627 7.731 -15.347 4.349 1.00 0.00 C ATOM 44 CG2 ILE A 627 9.316 -16.701 3.204 1.00 0.00 C ATOM 45 CD1 ILE A 627 6.277 -15.315 4.151 1.00 0.00 C ATOM 0 H ILE A 627 10.777 -14.974 4.136 1.00 0.00 H new ATOM 0 HA ILE A 627 9.944 -14.584 1.945 1.00 0.00 H new ATOM 0 HB ILE A 627 7.680 -15.728 2.300 1.00 0.00 H new ATOM 0 HG12 ILE A 627 7.989 -16.138 5.053 1.00 0.00 H new ATOM 0 HG13 ILE A 627 8.063 -14.407 4.790 1.00 0.00 H new ATOM 0 HG21 ILE A 627 8.736 -17.601 3.410 1.00 0.00 H new ATOM 0 HG22 ILE A 627 9.870 -16.831 2.274 1.00 0.00 H new ATOM 0 HG23 ILE A 627 10.015 -16.525 4.021 1.00 0.00 H new ATOM 0 HD11 ILE A 627 5.783 -15.149 5.108 1.00 0.00 H new ATOM 0 HD12 ILE A 627 6.021 -14.507 3.465 1.00 0.00 H new ATOM 0 HD13 ILE A 627 5.946 -16.265 3.732 1.00 0.00 H new ATOM 57 N CYS A 628 8.893 -12.703 1.246 1.00 0.00 N ATOM 58 CA CYS A 628 8.324 -11.522 0.643 1.00 0.00 C ATOM 59 C CYS A 628 6.819 -11.433 0.817 1.00 0.00 C ATOM 60 O CYS A 628 6.074 -11.967 0.039 1.00 0.00 O ATOM 61 CB CYS A 628 8.739 -11.478 -0.804 1.00 0.00 C ATOM 62 SG CYS A 628 7.459 -11.338 -2.047 1.00 0.00 S ATOM 0 H CYS A 628 9.638 -13.123 0.691 1.00 0.00 H new ATOM 0 HA CYS A 628 8.711 -10.643 1.158 1.00 0.00 H new ATOM 0 HB2 CYS A 628 9.419 -10.635 -0.930 1.00 0.00 H new ATOM 0 HB3 CYS A 628 9.310 -12.382 -1.014 1.00 0.00 H new ATOM 0 HG CYS A 628 7.295 -12.487 -2.632 1.00 0.00 H new ATOM 67 N ARG A 629 6.412 -10.717 1.849 1.00 0.00 N ATOM 68 CA ARG A 629 5.003 -10.511 2.197 1.00 0.00 C ATOM 69 C ARG A 629 4.062 -10.756 1.019 1.00 0.00 C ATOM 70 O ARG A 629 3.004 -11.365 1.168 1.00 0.00 O ATOM 71 CB ARG A 629 4.815 -9.077 2.678 1.00 0.00 C ATOM 72 CG ARG A 629 3.398 -8.759 3.122 1.00 0.00 C ATOM 73 CD ARG A 629 3.154 -9.208 4.551 1.00 0.00 C ATOM 74 NE ARG A 629 1.846 -9.839 4.712 1.00 0.00 N ATOM 75 CZ ARG A 629 1.597 -10.808 5.588 1.00 0.00 C ATOM 76 NH1 ARG A 629 2.558 -11.246 6.391 1.00 0.00 N ATOM 77 NH2 ARG A 629 0.385 -11.341 5.663 1.00 0.00 N ATOM 0 H ARG A 629 7.058 -10.250 2.486 1.00 0.00 H new ATOM 0 HA ARG A 629 4.754 -11.231 2.977 1.00 0.00 H new ATOM 0 HB2 ARG A 629 5.496 -8.890 3.508 1.00 0.00 H new ATOM 0 HB3 ARG A 629 5.096 -8.395 1.875 1.00 0.00 H new ATOM 0 HG2 ARG A 629 3.221 -7.687 3.040 1.00 0.00 H new ATOM 0 HG3 ARG A 629 2.687 -9.251 2.458 1.00 0.00 H new ATOM 0 HD2 ARG A 629 3.934 -9.909 4.849 1.00 0.00 H new ATOM 0 HD3 ARG A 629 3.226 -8.349 5.218 1.00 0.00 H new ATOM 0 HE ARG A 629 1.081 -9.518 4.119 1.00 0.00 H new ATOM 0 HH11 ARG A 629 3.492 -10.839 6.338 1.00 0.00 H new ATOM 0 HH12 ARG A 629 2.363 -11.989 7.062 1.00 0.00 H new ATOM 0 HH21 ARG A 629 -0.358 -11.008 5.048 1.00 0.00 H new ATOM 0 HH22 ARG A 629 0.195 -12.084 6.335 1.00 0.00 H new ATOM 91 N VAL A 630 4.463 -10.270 -0.148 1.00 0.00 N ATOM 92 CA VAL A 630 3.707 -10.404 -1.351 1.00 0.00 C ATOM 93 C VAL A 630 3.469 -11.830 -1.711 1.00 0.00 C ATOM 94 O VAL A 630 2.361 -12.350 -1.593 1.00 0.00 O ATOM 95 CB VAL A 630 4.497 -9.757 -2.452 1.00 0.00 C ATOM 96 CG1 VAL A 630 4.189 -10.328 -3.803 1.00 0.00 C ATOM 97 CG2 VAL A 630 4.189 -8.311 -2.448 1.00 0.00 C ATOM 0 H VAL A 630 5.341 -9.765 -0.270 1.00 0.00 H new ATOM 0 HA VAL A 630 2.734 -9.934 -1.208 1.00 0.00 H new ATOM 0 HB VAL A 630 5.555 -9.944 -2.266 1.00 0.00 H new ATOM 0 HG11 VAL A 630 4.790 -9.821 -4.558 1.00 0.00 H new ATOM 0 HG12 VAL A 630 4.421 -11.393 -3.809 1.00 0.00 H new ATOM 0 HG13 VAL A 630 3.131 -10.186 -4.026 1.00 0.00 H new ATOM 0 HG21 VAL A 630 4.751 -7.817 -3.240 1.00 0.00 H new ATOM 0 HG22 VAL A 630 3.122 -8.166 -2.616 1.00 0.00 H new ATOM 0 HG23 VAL A 630 4.466 -7.883 -1.485 1.00 0.00 H new ATOM 107 N CYS A 631 4.535 -12.455 -2.143 1.00 0.00 N ATOM 108 CA CYS A 631 4.439 -13.813 -2.599 1.00 0.00 C ATOM 109 C CYS A 631 4.817 -14.783 -1.490 1.00 0.00 C ATOM 110 O CYS A 631 4.729 -16.002 -1.624 1.00 0.00 O ATOM 111 CB CYS A 631 5.252 -13.956 -3.870 1.00 0.00 C ATOM 112 SG CYS A 631 6.967 -14.495 -3.693 1.00 0.00 S ATOM 0 H CYS A 631 5.469 -12.048 -2.188 1.00 0.00 H new ATOM 0 HA CYS A 631 3.410 -14.071 -2.850 1.00 0.00 H new ATOM 0 HB2 CYS A 631 4.740 -14.665 -4.521 1.00 0.00 H new ATOM 0 HB3 CYS A 631 5.251 -12.994 -4.382 1.00 0.00 H new ATOM 0 HG CYS A 631 7.522 -14.569 -4.866 1.00 0.00 H new ATOM 117 N GLN A 632 5.240 -14.180 -0.394 1.00 0.00 N ATOM 118 CA GLN A 632 5.597 -14.861 0.834 1.00 0.00 C ATOM 119 C GLN A 632 6.608 -15.953 0.636 1.00 0.00 C ATOM 120 O GLN A 632 6.482 -17.038 1.206 1.00 0.00 O ATOM 121 CB GLN A 632 4.367 -15.401 1.548 1.00 0.00 C ATOM 122 CG GLN A 632 3.483 -14.317 2.134 1.00 0.00 C ATOM 123 CD GLN A 632 2.095 -14.814 2.483 1.00 0.00 C ATOM 124 OE1 GLN A 632 1.851 -15.280 3.597 1.00 0.00 O ATOM 125 NE2 GLN A 632 1.174 -14.715 1.532 1.00 0.00 N ATOM 0 H GLN A 632 5.348 -13.167 -0.334 1.00 0.00 H new ATOM 0 HA GLN A 632 6.068 -14.106 1.463 1.00 0.00 H new ATOM 0 HB2 GLN A 632 3.782 -15.996 0.847 1.00 0.00 H new ATOM 0 HB3 GLN A 632 4.685 -16.071 2.347 1.00 0.00 H new ATOM 0 HG2 GLN A 632 3.955 -13.915 3.030 1.00 0.00 H new ATOM 0 HG3 GLN A 632 3.401 -13.497 1.421 1.00 0.00 H new ATOM 0 HE21 GLN A 632 1.420 -14.322 0.623 1.00 0.00 H new ATOM 0 HE22 GLN A 632 0.221 -15.031 1.710 1.00 0.00 H new ATOM 134 N LYS A 633 7.602 -15.682 -0.179 1.00 0.00 N ATOM 135 CA LYS A 633 8.671 -16.615 -0.343 1.00 0.00 C ATOM 136 C LYS A 633 9.964 -16.013 0.165 1.00 0.00 C ATOM 137 O LYS A 633 10.188 -14.813 0.071 1.00 0.00 O ATOM 138 CB LYS A 633 8.804 -17.026 -1.764 1.00 0.00 C ATOM 139 CG LYS A 633 7.577 -17.722 -2.261 1.00 0.00 C ATOM 140 CD LYS A 633 7.592 -19.182 -1.895 1.00 0.00 C ATOM 141 CE LYS A 633 6.184 -19.751 -1.869 1.00 0.00 C ATOM 142 NZ LYS A 633 6.067 -20.910 -0.940 1.00 0.00 N ATOM 0 H LYS A 633 7.684 -14.828 -0.731 1.00 0.00 H new ATOM 0 HA LYS A 633 8.446 -17.508 0.241 1.00 0.00 H new ATOM 0 HB2 LYS A 633 8.997 -16.147 -2.379 1.00 0.00 H new ATOM 0 HB3 LYS A 633 9.665 -17.686 -1.872 1.00 0.00 H new ATOM 0 HG2 LYS A 633 6.691 -17.248 -1.839 1.00 0.00 H new ATOM 0 HG3 LYS A 633 7.510 -17.617 -3.344 1.00 0.00 H new ATOM 0 HD2 LYS A 633 8.198 -19.734 -2.613 1.00 0.00 H new ATOM 0 HD3 LYS A 633 8.058 -19.311 -0.918 1.00 0.00 H new ATOM 0 HE2 LYS A 633 5.484 -18.972 -1.567 1.00 0.00 H new ATOM 0 HE3 LYS A 633 5.900 -20.062 -2.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 633 5.091 -21.268 -0.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 633 6.716 -21.664 -1.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 633 6.313 -20.608 0.024 1.00 0.00 H new ATOM 156 N PRO A 634 10.832 -16.855 0.689 1.00 0.00 N ATOM 157 CA PRO A 634 12.079 -16.438 1.281 1.00 0.00 C ATOM 158 C PRO A 634 13.148 -16.136 0.261 1.00 0.00 C ATOM 159 O PRO A 634 13.245 -16.783 -0.783 1.00 0.00 O ATOM 160 CB PRO A 634 12.483 -17.627 2.158 1.00 0.00 C ATOM 161 CG PRO A 634 11.457 -18.699 1.927 1.00 0.00 C ATOM 162 CD PRO A 634 10.654 -18.289 0.724 1.00 0.00 C ATOM 0 HA PRO A 634 11.963 -15.506 1.835 1.00 0.00 H new ATOM 0 HB2 PRO A 634 13.480 -17.981 1.895 1.00 0.00 H new ATOM 0 HB3 PRO A 634 12.514 -17.340 3.209 1.00 0.00 H new ATOM 0 HG2 PRO A 634 11.938 -19.663 1.759 1.00 0.00 H new ATOM 0 HG3 PRO A 634 10.814 -18.811 2.800 1.00 0.00 H new ATOM 0 HD2 PRO A 634 11.020 -18.764 -0.187 1.00 0.00 H new ATOM 0 HD3 PRO A 634 9.604 -18.563 0.827 1.00 0.00 H new ATOM 170 N GLY A 635 13.950 -15.142 0.584 1.00 0.00 N ATOM 171 CA GLY A 635 15.023 -14.739 -0.306 1.00 0.00 C ATOM 172 C GLY A 635 15.651 -13.431 0.107 1.00 0.00 C ATOM 173 O GLY A 635 15.725 -13.118 1.296 1.00 0.00 O ATOM 0 H GLY A 635 13.882 -14.602 1.447 1.00 0.00 H new ATOM 0 HA2 GLY A 635 15.787 -15.516 -0.325 1.00 0.00 H new ATOM 0 HA3 GLY A 635 14.635 -14.649 -1.321 1.00 0.00 H new ATOM 177 N ASP A 636 16.139 -12.680 -0.874 1.00 0.00 N ATOM 178 CA ASP A 636 16.712 -11.384 -0.611 1.00 0.00 C ATOM 179 C ASP A 636 15.593 -10.377 -0.458 1.00 0.00 C ATOM 180 O ASP A 636 15.489 -9.399 -1.201 1.00 0.00 O ATOM 181 CB ASP A 636 17.629 -10.941 -1.725 1.00 0.00 C ATOM 182 CG ASP A 636 19.035 -11.492 -1.587 1.00 0.00 C ATOM 183 OD1 ASP A 636 19.872 -10.828 -0.941 1.00 0.00 O ATOM 184 OD2 ASP A 636 19.298 -12.588 -2.125 1.00 0.00 O ATOM 0 H ASP A 636 16.145 -12.955 -1.856 1.00 0.00 H new ATOM 0 HA ASP A 636 17.303 -11.451 0.303 1.00 0.00 H new ATOM 0 HB2 ASP A 636 17.212 -11.259 -2.680 1.00 0.00 H new ATOM 0 HB3 ASP A 636 17.671 -9.852 -1.743 1.00 0.00 H new ATOM 189 N LEU A 637 14.764 -10.645 0.517 1.00 0.00 N ATOM 190 CA LEU A 637 13.612 -9.851 0.813 1.00 0.00 C ATOM 191 C LEU A 637 13.943 -8.583 1.545 1.00 0.00 C ATOM 192 O LEU A 637 14.853 -8.524 2.373 1.00 0.00 O ATOM 193 CB LEU A 637 12.684 -10.681 1.650 1.00 0.00 C ATOM 194 CG LEU A 637 12.772 -12.154 1.328 1.00 0.00 C ATOM 195 CD1 LEU A 637 11.982 -12.961 2.261 1.00 0.00 C ATOM 196 CD2 LEU A 637 12.254 -12.328 -0.026 1.00 0.00 C ATOM 0 H LEU A 637 14.879 -11.444 1.141 1.00 0.00 H new ATOM 0 HA LEU A 637 13.154 -9.554 -0.130 1.00 0.00 H new ATOM 0 HB2 LEU A 637 12.917 -10.529 2.704 1.00 0.00 H new ATOM 0 HB3 LEU A 637 11.660 -10.340 1.497 1.00 0.00 H new ATOM 0 HG LEU A 637 13.807 -12.486 1.412 1.00 0.00 H new ATOM 0 HD11 LEU A 637 12.071 -14.015 1.996 1.00 0.00 H new ATOM 0 HD12 LEU A 637 12.351 -12.809 3.276 1.00 0.00 H new ATOM 0 HD13 LEU A 637 10.936 -12.660 2.206 1.00 0.00 H new ATOM 0 HD21 LEU A 637 12.299 -13.382 -0.300 1.00 0.00 H new ATOM 0 HD22 LEU A 637 11.220 -11.987 -0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 637 12.856 -11.745 -0.723 1.00 0.00 H new ATOM 208 N VAL A 638 13.180 -7.576 1.218 1.00 0.00 N ATOM 209 CA VAL A 638 13.311 -6.284 1.846 1.00 0.00 C ATOM 210 C VAL A 638 12.330 -6.190 2.961 1.00 0.00 C ATOM 211 O VAL A 638 11.131 -6.080 2.725 1.00 0.00 O ATOM 212 CB VAL A 638 13.017 -5.132 0.930 1.00 0.00 C ATOM 213 CG1 VAL A 638 14.237 -4.489 0.442 1.00 0.00 C ATOM 214 CG2 VAL A 638 12.226 -5.529 -0.235 1.00 0.00 C ATOM 0 H VAL A 638 12.449 -7.625 0.509 1.00 0.00 H new ATOM 0 HA VAL A 638 14.349 -6.213 2.171 1.00 0.00 H new ATOM 0 HB VAL A 638 12.445 -4.431 1.538 1.00 0.00 H new ATOM 0 HG11 VAL A 638 13.974 -3.662 -0.217 1.00 0.00 H new ATOM 0 HG12 VAL A 638 14.812 -4.111 1.287 1.00 0.00 H new ATOM 0 HG13 VAL A 638 14.836 -5.215 -0.109 1.00 0.00 H new ATOM 0 HG21 VAL A 638 12.042 -4.658 -0.864 1.00 0.00 H new ATOM 0 HG22 VAL A 638 12.771 -6.280 -0.806 1.00 0.00 H new ATOM 0 HG23 VAL A 638 11.274 -5.945 0.096 1.00 0.00 H new ATOM 224 N MET A 639 12.831 -6.160 4.157 1.00 0.00 N ATOM 225 CA MET A 639 11.967 -6.095 5.301 1.00 0.00 C ATOM 226 C MET A 639 11.568 -4.662 5.521 1.00 0.00 C ATOM 227 O MET A 639 12.352 -3.873 6.048 1.00 0.00 O ATOM 228 CB MET A 639 12.656 -6.654 6.536 1.00 0.00 C ATOM 229 CG MET A 639 11.685 -7.265 7.522 1.00 0.00 C ATOM 230 SD MET A 639 12.003 -6.761 9.228 1.00 0.00 S ATOM 231 CE MET A 639 12.099 -4.970 9.073 1.00 0.00 C ATOM 0 H MET A 639 13.829 -6.179 4.369 1.00 0.00 H new ATOM 0 HA MET A 639 11.080 -6.702 5.120 1.00 0.00 H new ATOM 0 HB2 MET A 639 13.381 -7.409 6.232 1.00 0.00 H new ATOM 0 HB3 MET A 639 13.213 -5.857 7.028 1.00 0.00 H new ATOM 0 HG2 MET A 639 10.669 -6.980 7.248 1.00 0.00 H new ATOM 0 HG3 MET A 639 11.741 -8.351 7.453 1.00 0.00 H new ATOM 0 HE1 MET A 639 11.918 -4.510 10.045 1.00 0.00 H new ATOM 0 HE2 MET A 639 13.090 -4.688 8.718 1.00 0.00 H new ATOM 0 HE3 MET A 639 11.347 -4.625 8.363 1.00 0.00 H new ATOM 241 N CYS A 640 10.353 -4.330 5.087 1.00 0.00 N ATOM 242 CA CYS A 640 9.843 -2.981 5.224 1.00 0.00 C ATOM 243 C CYS A 640 10.351 -2.392 6.514 1.00 0.00 C ATOM 244 O CYS A 640 9.854 -2.719 7.593 1.00 0.00 O ATOM 245 CB CYS A 640 8.315 -2.968 5.205 1.00 0.00 C ATOM 246 SG CYS A 640 7.570 -1.300 5.146 1.00 0.00 S ATOM 0 H CYS A 640 9.709 -4.982 4.639 1.00 0.00 H new ATOM 0 HA CYS A 640 10.192 -2.383 4.382 1.00 0.00 H new ATOM 0 HB2 CYS A 640 7.970 -3.536 4.341 1.00 0.00 H new ATOM 0 HB3 CYS A 640 7.949 -3.484 6.093 1.00 0.00 H new ATOM 0 HG CYS A 640 6.542 -1.312 4.351 1.00 0.00 H new ATOM 251 N ASN A 641 11.373 -1.551 6.403 1.00 0.00 N ATOM 252 CA ASN A 641 11.959 -0.922 7.567 1.00 0.00 C ATOM 253 C ASN A 641 10.862 -0.336 8.437 1.00 0.00 C ATOM 254 O ASN A 641 11.081 0.004 9.600 1.00 0.00 O ATOM 255 CB ASN A 641 12.951 0.160 7.162 1.00 0.00 C ATOM 256 CG ASN A 641 12.515 1.557 7.573 1.00 0.00 C ATOM 257 OD1 ASN A 641 12.658 1.946 8.732 1.00 0.00 O ATOM 258 ND2 ASN A 641 12.001 2.329 6.623 1.00 0.00 N ATOM 0 H ASN A 641 11.808 -1.293 5.517 1.00 0.00 H new ATOM 0 HA ASN A 641 12.503 -1.677 8.134 1.00 0.00 H new ATOM 0 HB2 ASN A 641 13.920 -0.058 7.611 1.00 0.00 H new ATOM 0 HB3 ASN A 641 13.087 0.132 6.081 1.00 0.00 H new ATOM 0 HD21 ASN A 641 11.709 3.281 6.842 1.00 0.00 H new ATOM 0 HD22 ASN A 641 11.899 1.970 5.674 1.00 0.00 H new ATOM 265 N GLN A 642 9.670 -0.234 7.854 1.00 0.00 N ATOM 266 CA GLN A 642 8.536 0.317 8.549 1.00 0.00 C ATOM 267 C GLN A 642 7.520 -0.731 8.997 1.00 0.00 C ATOM 268 O GLN A 642 6.935 -0.582 10.070 1.00 0.00 O ATOM 269 CB GLN A 642 7.841 1.340 7.687 1.00 0.00 C ATOM 270 CG GLN A 642 8.768 2.432 7.207 1.00 0.00 C ATOM 271 CD GLN A 642 8.071 3.456 6.335 1.00 0.00 C ATOM 272 OE1 GLN A 642 7.088 3.150 5.660 1.00 0.00 O ATOM 273 NE2 GLN A 642 8.581 4.682 6.342 1.00 0.00 N ATOM 0 H GLN A 642 9.476 -0.530 6.898 1.00 0.00 H new ATOM 0 HA GLN A 642 8.937 0.780 9.451 1.00 0.00 H new ATOM 0 HB2 GLN A 642 7.399 0.841 6.825 1.00 0.00 H new ATOM 0 HB3 GLN A 642 7.022 1.787 8.251 1.00 0.00 H new ATOM 0 HG2 GLN A 642 9.206 2.935 8.069 1.00 0.00 H new ATOM 0 HG3 GLN A 642 9.589 1.984 6.647 1.00 0.00 H new ATOM 0 HE21 GLN A 642 9.397 4.892 6.917 1.00 0.00 H new ATOM 0 HE22 GLN A 642 8.157 5.414 5.773 1.00 0.00 H new ATOM 282 N CYS A 643 7.290 -1.792 8.211 1.00 0.00 N ATOM 283 CA CYS A 643 6.267 -2.765 8.637 1.00 0.00 C ATOM 284 C CYS A 643 6.577 -4.222 8.307 1.00 0.00 C ATOM 285 O CYS A 643 5.665 -4.999 8.022 1.00 0.00 O ATOM 286 CB CYS A 643 4.901 -2.368 8.069 1.00 0.00 C ATOM 287 SG CYS A 643 4.544 -2.952 6.384 1.00 0.00 S ATOM 0 H CYS A 643 7.763 -1.995 7.330 1.00 0.00 H new ATOM 0 HA CYS A 643 6.261 -2.720 9.726 1.00 0.00 H new ATOM 0 HB2 CYS A 643 4.127 -2.747 8.736 1.00 0.00 H new ATOM 0 HB3 CYS A 643 4.826 -1.281 8.080 1.00 0.00 H new ATOM 0 HG CYS A 643 4.500 -4.251 6.375 1.00 0.00 H new ATOM 292 N GLU A 644 7.843 -4.605 8.416 1.00 0.00 N ATOM 293 CA GLU A 644 8.273 -5.967 8.163 1.00 0.00 C ATOM 294 C GLU A 644 8.046 -6.434 6.720 1.00 0.00 C ATOM 295 O GLU A 644 8.830 -7.237 6.221 1.00 0.00 O ATOM 296 CB GLU A 644 7.598 -6.911 9.140 1.00 0.00 C ATOM 297 CG GLU A 644 7.466 -6.348 10.548 1.00 0.00 C ATOM 298 CD GLU A 644 6.697 -7.271 11.473 1.00 0.00 C ATOM 299 OE1 GLU A 644 7.290 -8.259 11.955 1.00 0.00 O ATOM 300 OE2 GLU A 644 5.501 -7.004 11.717 1.00 0.00 O ATOM 0 H GLU A 644 8.600 -3.975 8.683 1.00 0.00 H new ATOM 0 HA GLU A 644 9.353 -5.982 8.312 1.00 0.00 H new ATOM 0 HB2 GLU A 644 6.606 -7.159 8.764 1.00 0.00 H new ATOM 0 HB3 GLU A 644 8.165 -7.841 9.182 1.00 0.00 H new ATOM 0 HG2 GLU A 644 8.460 -6.172 10.960 1.00 0.00 H new ATOM 0 HG3 GLU A 644 6.963 -5.382 10.504 1.00 0.00 H new ATOM 307 N PHE A 645 6.980 -5.960 6.055 1.00 0.00 N ATOM 308 CA PHE A 645 6.702 -6.328 4.682 1.00 0.00 C ATOM 309 C PHE A 645 7.969 -6.639 3.891 1.00 0.00 C ATOM 310 O PHE A 645 8.620 -5.733 3.373 1.00 0.00 O ATOM 311 CB PHE A 645 5.967 -5.188 4.076 1.00 0.00 C ATOM 312 CG PHE A 645 4.505 -5.307 4.306 1.00 0.00 C ATOM 313 CD1 PHE A 645 3.979 -5.805 5.494 1.00 0.00 C ATOM 314 CD2 PHE A 645 3.665 -4.905 3.336 1.00 0.00 C ATOM 315 CE1 PHE A 645 2.612 -5.882 5.672 1.00 0.00 C ATOM 316 CE2 PHE A 645 2.326 -4.969 3.492 1.00 0.00 C ATOM 317 CZ PHE A 645 1.777 -5.459 4.661 1.00 0.00 C ATOM 0 H PHE A 645 6.300 -5.317 6.461 1.00 0.00 H new ATOM 0 HA PHE A 645 6.111 -7.244 4.658 1.00 0.00 H new ATOM 0 HB2 PHE A 645 6.329 -4.252 4.501 1.00 0.00 H new ATOM 0 HB3 PHE A 645 6.167 -5.151 3.005 1.00 0.00 H new ATOM 0 HD1 PHE A 645 4.643 -6.133 6.280 1.00 0.00 H new ATOM 0 HD2 PHE A 645 4.071 -4.522 2.411 1.00 0.00 H new ATOM 0 HE1 PHE A 645 2.202 -6.269 6.593 1.00 0.00 H new ATOM 0 HE2 PHE A 645 1.678 -4.634 2.696 1.00 0.00 H new ATOM 0 HZ PHE A 645 0.705 -5.510 4.781 1.00 0.00 H new ATOM 327 N CYS A 646 8.310 -7.924 3.789 1.00 0.00 N ATOM 328 CA CYS A 646 9.476 -8.349 3.087 1.00 0.00 C ATOM 329 C CYS A 646 9.168 -8.455 1.630 1.00 0.00 C ATOM 330 O CYS A 646 8.049 -8.760 1.240 1.00 0.00 O ATOM 331 CB CYS A 646 9.938 -9.676 3.636 1.00 0.00 C ATOM 332 SG CYS A 646 10.235 -9.660 5.419 1.00 0.00 S ATOM 0 H CYS A 646 7.770 -8.686 4.199 1.00 0.00 H new ATOM 0 HA CYS A 646 10.276 -7.621 3.220 1.00 0.00 H new ATOM 0 HB2 CYS A 646 9.189 -10.434 3.408 1.00 0.00 H new ATOM 0 HB3 CYS A 646 10.855 -9.971 3.126 1.00 0.00 H new ATOM 0 HG CYS A 646 9.700 -8.595 5.938 1.00 0.00 H new ATOM 338 N PHE A 647 10.146 -8.154 0.823 1.00 0.00 N ATOM 339 CA PHE A 647 9.945 -8.190 -0.604 1.00 0.00 C ATOM 340 C PHE A 647 11.159 -8.639 -1.400 1.00 0.00 C ATOM 341 O PHE A 647 12.270 -8.157 -1.243 1.00 0.00 O ATOM 342 CB PHE A 647 9.540 -6.812 -1.087 1.00 0.00 C ATOM 343 CG PHE A 647 8.122 -6.460 -0.846 1.00 0.00 C ATOM 344 CD1 PHE A 647 7.655 -6.153 0.419 1.00 0.00 C ATOM 345 CD2 PHE A 647 7.267 -6.397 -1.898 1.00 0.00 C ATOM 346 CE1 PHE A 647 6.341 -5.800 0.610 1.00 0.00 C ATOM 347 CE2 PHE A 647 5.967 -6.037 -1.720 1.00 0.00 C ATOM 348 CZ PHE A 647 5.494 -5.739 -0.463 1.00 0.00 C ATOM 0 H PHE A 647 11.083 -7.883 1.122 1.00 0.00 H new ATOM 0 HA PHE A 647 9.165 -8.932 -0.775 1.00 0.00 H new ATOM 0 HB2 PHE A 647 10.172 -6.071 -0.597 1.00 0.00 H new ATOM 0 HB3 PHE A 647 9.740 -6.744 -2.156 1.00 0.00 H new ATOM 0 HD1 PHE A 647 8.328 -6.191 1.263 1.00 0.00 H new ATOM 0 HD2 PHE A 647 7.623 -6.636 -2.889 1.00 0.00 H new ATOM 0 HE1 PHE A 647 5.979 -5.572 1.601 1.00 0.00 H new ATOM 0 HE2 PHE A 647 5.303 -5.985 -2.570 1.00 0.00 H new ATOM 0 HZ PHE A 647 4.460 -5.459 -0.324 1.00 0.00 H new ATOM 358 N HIS A 648 10.907 -9.568 -2.281 1.00 0.00 N ATOM 359 CA HIS A 648 11.901 -10.070 -3.214 1.00 0.00 C ATOM 360 C HIS A 648 12.395 -8.994 -4.119 1.00 0.00 C ATOM 361 O HIS A 648 13.153 -9.254 -5.053 1.00 0.00 O ATOM 362 CB HIS A 648 11.222 -11.075 -4.082 1.00 0.00 C ATOM 363 CG HIS A 648 11.269 -12.412 -3.485 1.00 0.00 C ATOM 364 ND1 HIS A 648 12.313 -13.085 -2.989 1.00 0.00 N flip ATOM 365 CD2 HIS A 648 10.154 -13.147 -3.202 1.00 0.00 C flip ATOM 366 CE1 HIS A 648 11.820 -14.219 -2.407 1.00 0.00 C flip ATOM 367 NE2 HIS A 648 10.508 -14.221 -2.538 1.00 0.00 N flip ATOM 0 H HIS A 648 9.993 -10.010 -2.379 1.00 0.00 H new ATOM 0 HA HIS A 648 12.738 -10.478 -2.647 1.00 0.00 H new ATOM 0 HB2 HIS A 648 10.184 -10.781 -4.239 1.00 0.00 H new ATOM 0 HB3 HIS A 648 11.700 -11.095 -5.062 1.00 0.00 H new ATOM 0 HD1 HIS A 648 13.293 -12.805 -3.036 1.00 0.00 H new ATOM 0 HD2 HIS A 648 9.144 -12.886 -3.480 1.00 0.00 H new ATOM 0 HE1 HIS A 648 12.407 -14.985 -1.921 1.00 0.00 H new ATOM 375 N LEU A 649 11.945 -7.808 -3.819 1.00 0.00 N ATOM 376 CA LEU A 649 12.227 -6.634 -4.607 1.00 0.00 C ATOM 377 C LEU A 649 11.379 -6.687 -5.834 1.00 0.00 C ATOM 378 O LEU A 649 10.535 -5.861 -6.065 1.00 0.00 O ATOM 379 CB LEU A 649 13.646 -6.588 -5.051 1.00 0.00 C ATOM 380 CG LEU A 649 14.688 -6.223 -4.041 1.00 0.00 C ATOM 381 CD1 LEU A 649 14.178 -6.275 -2.669 1.00 0.00 C ATOM 382 CD2 LEU A 649 15.864 -7.061 -4.247 1.00 0.00 C ATOM 0 H LEU A 649 11.360 -7.623 -3.004 1.00 0.00 H new ATOM 0 HA LEU A 649 12.023 -5.757 -3.992 1.00 0.00 H new ATOM 0 HB2 LEU A 649 13.901 -7.568 -5.455 1.00 0.00 H new ATOM 0 HB3 LEU A 649 13.715 -5.877 -5.874 1.00 0.00 H new ATOM 0 HG LEU A 649 14.978 -5.183 -4.188 1.00 0.00 H new ATOM 0 HD11 LEU A 649 14.973 -6.002 -1.975 1.00 0.00 H new ATOM 0 HD12 LEU A 649 13.348 -5.577 -2.563 1.00 0.00 H new ATOM 0 HD13 LEU A 649 13.834 -7.285 -2.447 1.00 0.00 H new ATOM 0 HD21 LEU A 649 16.629 -6.801 -3.515 1.00 0.00 H new ATOM 0 HD22 LEU A 649 15.589 -8.109 -4.129 1.00 0.00 H new ATOM 0 HD23 LEU A 649 16.254 -6.900 -5.252 1.00 0.00 H new ATOM 394 N ASP A 650 11.612 -7.711 -6.608 1.00 0.00 N ATOM 395 CA ASP A 650 10.876 -7.897 -7.846 1.00 0.00 C ATOM 396 C ASP A 650 9.378 -7.933 -7.589 1.00 0.00 C ATOM 397 O ASP A 650 8.613 -7.262 -8.282 1.00 0.00 O ATOM 398 CB ASP A 650 11.346 -9.163 -8.539 1.00 0.00 C ATOM 399 CG ASP A 650 10.641 -10.413 -8.047 1.00 0.00 C ATOM 400 OD1 ASP A 650 9.520 -10.689 -8.522 1.00 0.00 O ATOM 401 OD2 ASP A 650 11.214 -11.118 -7.191 1.00 0.00 O ATOM 0 H ASP A 650 12.304 -8.434 -6.411 1.00 0.00 H new ATOM 0 HA ASP A 650 11.072 -7.049 -8.502 1.00 0.00 H new ATOM 0 HB2 ASP A 650 11.186 -9.062 -9.612 1.00 0.00 H new ATOM 0 HB3 ASP A 650 12.419 -9.276 -8.386 1.00 0.00 H new ATOM 406 N CYS A 651 8.952 -8.710 -6.598 1.00 0.00 N ATOM 407 CA CYS A 651 7.552 -8.776 -6.273 1.00 0.00 C ATOM 408 C CYS A 651 7.081 -7.409 -5.784 1.00 0.00 C ATOM 409 O CYS A 651 5.880 -7.137 -5.775 1.00 0.00 O ATOM 410 CB CYS A 651 7.269 -9.862 -5.241 1.00 0.00 C ATOM 411 SG CYS A 651 8.084 -11.466 -5.578 1.00 0.00 S ATOM 0 H CYS A 651 9.557 -9.292 -6.018 1.00 0.00 H new ATOM 0 HA CYS A 651 6.995 -9.043 -7.171 1.00 0.00 H new ATOM 0 HB2 CYS A 651 7.588 -9.506 -4.262 1.00 0.00 H new ATOM 0 HB3 CYS A 651 6.192 -10.021 -5.187 1.00 0.00 H new ATOM 0 HG CYS A 651 7.558 -12.387 -4.826 1.00 0.00 H new ATOM 416 N HIS A 652 8.028 -6.546 -5.356 1.00 0.00 N ATOM 417 CA HIS A 652 7.656 -5.198 -4.940 1.00 0.00 C ATOM 418 C HIS A 652 6.832 -4.580 -6.053 1.00 0.00 C ATOM 419 O HIS A 652 7.120 -4.803 -7.229 1.00 0.00 O ATOM 420 CB HIS A 652 8.889 -4.324 -4.638 1.00 0.00 C ATOM 421 CG HIS A 652 8.550 -2.911 -4.303 1.00 0.00 C ATOM 422 ND1 HIS A 652 9.453 -1.871 -4.379 1.00 0.00 N ATOM 423 CD2 HIS A 652 7.390 -2.363 -3.895 1.00 0.00 C ATOM 424 CE1 HIS A 652 8.851 -0.747 -4.028 1.00 0.00 C ATOM 425 NE2 HIS A 652 7.604 -1.020 -3.722 1.00 0.00 N ATOM 0 H HIS A 652 9.024 -6.759 -5.294 1.00 0.00 H new ATOM 0 HA HIS A 652 7.081 -5.255 -4.016 1.00 0.00 H new ATOM 0 HB2 HIS A 652 9.441 -4.763 -3.807 1.00 0.00 H new ATOM 0 HB3 HIS A 652 9.552 -4.335 -5.503 1.00 0.00 H new ATOM 0 HD1 HIS A 652 10.430 -1.955 -4.661 1.00 0.00 H new ATOM 0 HD2 HIS A 652 6.459 -2.887 -3.733 1.00 0.00 H new ATOM 0 HE1 HIS A 652 9.308 0.231 -3.998 1.00 0.00 H new ATOM 434 N LEU A 653 5.800 -3.832 -5.683 1.00 0.00 N ATOM 435 CA LEU A 653 4.925 -3.216 -6.659 1.00 0.00 C ATOM 436 C LEU A 653 5.664 -2.797 -7.919 1.00 0.00 C ATOM 437 O LEU A 653 5.419 -3.350 -8.982 1.00 0.00 O ATOM 438 CB LEU A 653 4.117 -2.065 -6.059 1.00 0.00 C ATOM 439 CG LEU A 653 2.652 -2.106 -6.449 1.00 0.00 C ATOM 440 CD1 LEU A 653 1.926 -0.880 -5.971 1.00 0.00 C ATOM 441 CD2 LEU A 653 2.553 -2.234 -7.944 1.00 0.00 C ATOM 0 H LEU A 653 5.553 -3.640 -4.712 1.00 0.00 H new ATOM 0 HA LEU A 653 4.211 -3.982 -6.960 1.00 0.00 H new ATOM 0 HB2 LEU A 653 4.200 -2.097 -4.973 1.00 0.00 H new ATOM 0 HB3 LEU A 653 4.548 -1.118 -6.383 1.00 0.00 H new ATOM 0 HG LEU A 653 2.179 -2.965 -5.974 1.00 0.00 H new ATOM 0 HD11 LEU A 653 0.878 -0.939 -6.266 1.00 0.00 H new ATOM 0 HD12 LEU A 653 1.994 -0.817 -4.885 1.00 0.00 H new ATOM 0 HD13 LEU A 653 2.378 0.007 -6.415 1.00 0.00 H new ATOM 0 HD21 LEU A 653 1.504 -2.265 -8.238 1.00 0.00 H new ATOM 0 HD22 LEU A 653 3.037 -1.379 -8.415 1.00 0.00 H new ATOM 0 HD23 LEU A 653 3.046 -3.152 -8.264 1.00 0.00 H new ATOM 453 N PRO A 654 6.584 -1.853 -7.869 1.00 0.00 N ATOM 454 CA PRO A 654 7.288 -1.471 -9.045 1.00 0.00 C ATOM 455 C PRO A 654 8.599 -2.216 -9.128 1.00 0.00 C ATOM 456 O PRO A 654 9.441 -1.972 -9.994 1.00 0.00 O ATOM 457 CB PRO A 654 7.488 -0.001 -8.822 1.00 0.00 C ATOM 458 CG PRO A 654 7.592 0.169 -7.341 1.00 0.00 C ATOM 459 CD PRO A 654 7.060 -1.094 -6.718 1.00 0.00 C ATOM 0 HA PRO A 654 6.773 -1.693 -9.980 1.00 0.00 H new ATOM 0 HB2 PRO A 654 8.390 0.352 -9.322 1.00 0.00 H new ATOM 0 HB3 PRO A 654 6.654 0.574 -9.225 1.00 0.00 H new ATOM 0 HG2 PRO A 654 8.627 0.340 -7.044 1.00 0.00 H new ATOM 0 HG3 PRO A 654 7.018 1.034 -7.010 1.00 0.00 H new ATOM 0 HD2 PRO A 654 7.835 -1.632 -6.172 1.00 0.00 H new ATOM 0 HD3 PRO A 654 6.257 -0.888 -6.011 1.00 0.00 H new ATOM 467 N ALA A 655 8.731 -3.130 -8.184 1.00 0.00 N ATOM 468 CA ALA A 655 9.892 -3.981 -8.052 1.00 0.00 C ATOM 469 C ALA A 655 11.113 -3.184 -7.654 1.00 0.00 C ATOM 470 O ALA A 655 11.452 -2.212 -8.330 1.00 0.00 O ATOM 471 CB ALA A 655 10.146 -4.720 -9.344 1.00 0.00 C ATOM 0 H ALA A 655 8.018 -3.302 -7.475 1.00 0.00 H new ATOM 0 HA ALA A 655 9.692 -4.705 -7.262 1.00 0.00 H new ATOM 0 HB1 ALA A 655 11.023 -5.358 -9.232 1.00 0.00 H new ATOM 0 HB2 ALA A 655 9.279 -5.334 -9.588 1.00 0.00 H new ATOM 0 HB3 ALA A 655 10.319 -4.002 -10.146 1.00 0.00 H new ATOM 477 N LEU A 656 11.769 -3.548 -6.539 1.00 0.00 N ATOM 478 CA LEU A 656 12.958 -2.846 -6.161 1.00 0.00 C ATOM 479 C LEU A 656 13.929 -2.837 -7.314 1.00 0.00 C ATOM 480 O LEU A 656 13.619 -3.264 -8.427 1.00 0.00 O ATOM 481 CB LEU A 656 13.657 -3.455 -4.950 1.00 0.00 C ATOM 482 CG LEU A 656 13.714 -2.585 -3.692 1.00 0.00 C ATOM 483 CD1 LEU A 656 13.224 -1.217 -3.917 1.00 0.00 C ATOM 484 CD2 LEU A 656 12.917 -3.165 -2.559 1.00 0.00 C ATOM 0 H LEU A 656 11.489 -4.304 -5.915 1.00 0.00 H new ATOM 0 HA LEU A 656 12.647 -1.836 -5.893 1.00 0.00 H new ATOM 0 HB2 LEU A 656 13.154 -4.388 -4.698 1.00 0.00 H new ATOM 0 HB3 LEU A 656 14.677 -3.710 -5.236 1.00 0.00 H new ATOM 0 HG LEU A 656 14.772 -2.556 -3.433 1.00 0.00 H new ATOM 0 HD11 LEU A 656 13.290 -0.650 -2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 656 13.833 -0.734 -4.681 1.00 0.00 H new ATOM 0 HD13 LEU A 656 12.186 -1.252 -4.248 1.00 0.00 H new ATOM 0 HD21 LEU A 656 12.990 -2.511 -1.690 1.00 0.00 H new ATOM 0 HD22 LEU A 656 11.873 -3.256 -2.858 1.00 0.00 H new ATOM 0 HD23 LEU A 656 13.309 -4.150 -2.305 1.00 0.00 H new ATOM 496 N GLN A 657 15.117 -2.388 -7.036 1.00 0.00 N ATOM 497 CA GLN A 657 16.131 -2.323 -8.036 1.00 0.00 C ATOM 498 C GLN A 657 17.250 -3.234 -7.668 1.00 0.00 C ATOM 499 O GLN A 657 18.093 -3.602 -8.486 1.00 0.00 O ATOM 500 CB GLN A 657 16.631 -0.918 -8.090 1.00 0.00 C ATOM 501 CG GLN A 657 15.568 0.029 -8.508 1.00 0.00 C ATOM 502 CD GLN A 657 15.787 1.448 -8.023 1.00 0.00 C ATOM 503 OE1 GLN A 657 16.921 1.885 -7.829 1.00 0.00 O ATOM 504 NE2 GLN A 657 14.693 2.178 -7.830 1.00 0.00 N ATOM 0 H GLN A 657 15.406 -2.059 -6.115 1.00 0.00 H new ATOM 0 HA GLN A 657 15.733 -2.625 -9.005 1.00 0.00 H new ATOM 0 HB2 GLN A 657 17.010 -0.629 -7.110 1.00 0.00 H new ATOM 0 HB3 GLN A 657 17.467 -0.856 -8.786 1.00 0.00 H new ATOM 0 HG2 GLN A 657 15.505 0.033 -9.596 1.00 0.00 H new ATOM 0 HG3 GLN A 657 14.608 -0.329 -8.134 1.00 0.00 H new ATOM 0 HE21 GLN A 657 13.773 1.774 -8.004 1.00 0.00 H new ATOM 0 HE22 GLN A 657 14.774 3.142 -7.508 1.00 0.00 H new ATOM 513 N ASP A 658 17.190 -3.587 -6.411 1.00 0.00 N ATOM 514 CA ASP A 658 18.153 -4.412 -5.741 1.00 0.00 C ATOM 515 C ASP A 658 18.278 -3.842 -4.378 1.00 0.00 C ATOM 516 O ASP A 658 18.938 -2.831 -4.155 1.00 0.00 O ATOM 517 CB ASP A 658 19.503 -4.450 -6.380 1.00 0.00 C ATOM 518 CG ASP A 658 19.712 -5.664 -7.266 1.00 0.00 C ATOM 519 OD1 ASP A 658 19.749 -6.791 -6.728 1.00 0.00 O ATOM 520 OD2 ASP A 658 19.838 -5.489 -8.496 1.00 0.00 O ATOM 0 H ASP A 658 16.430 -3.291 -5.799 1.00 0.00 H new ATOM 0 HA ASP A 658 17.803 -5.444 -5.768 1.00 0.00 H new ATOM 0 HB2 ASP A 658 19.642 -3.547 -6.974 1.00 0.00 H new ATOM 0 HB3 ASP A 658 20.266 -4.441 -5.602 1.00 0.00 H new ATOM 525 N VAL A 659 17.633 -4.528 -3.510 1.00 0.00 N ATOM 526 CA VAL A 659 17.463 -4.158 -2.152 1.00 0.00 C ATOM 527 C VAL A 659 17.938 -2.749 -1.766 1.00 0.00 C ATOM 528 O VAL A 659 19.110 -2.388 -1.874 1.00 0.00 O ATOM 529 CB VAL A 659 17.961 -5.177 -1.165 1.00 0.00 C ATOM 530 CG1 VAL A 659 16.832 -6.108 -0.916 1.00 0.00 C ATOM 531 CG2 VAL A 659 19.198 -5.883 -1.667 1.00 0.00 C ATOM 0 H VAL A 659 17.183 -5.414 -3.740 1.00 0.00 H new ATOM 0 HA VAL A 659 16.376 -4.127 -2.080 1.00 0.00 H new ATOM 0 HB VAL A 659 18.270 -4.704 -0.233 1.00 0.00 H new ATOM 0 HG11 VAL A 659 17.141 -6.872 -0.203 1.00 0.00 H new ATOM 0 HG12 VAL A 659 15.986 -5.553 -0.510 1.00 0.00 H new ATOM 0 HG13 VAL A 659 16.539 -6.583 -1.852 1.00 0.00 H new ATOM 0 HG21 VAL A 659 19.527 -6.611 -0.926 1.00 0.00 H new ATOM 0 HG22 VAL A 659 18.971 -6.394 -2.602 1.00 0.00 H new ATOM 0 HG23 VAL A 659 19.990 -5.153 -1.836 1.00 0.00 H new ATOM 541 N PRO A 660 16.976 -1.980 -1.258 1.00 0.00 N ATOM 542 CA PRO A 660 17.119 -0.597 -0.789 1.00 0.00 C ATOM 543 C PRO A 660 18.141 -0.463 0.319 1.00 0.00 C ATOM 544 O PRO A 660 18.443 0.629 0.798 1.00 0.00 O ATOM 545 CB PRO A 660 15.707 -0.248 -0.291 1.00 0.00 C ATOM 546 CG PRO A 660 14.820 -1.271 -0.910 1.00 0.00 C ATOM 547 CD PRO A 660 15.637 -2.462 -1.096 1.00 0.00 C ATOM 0 HA PRO A 660 17.481 0.069 -1.572 1.00 0.00 H new ATOM 0 HB2 PRO A 660 15.652 -0.283 0.797 1.00 0.00 H new ATOM 0 HB3 PRO A 660 15.419 0.759 -0.592 1.00 0.00 H new ATOM 0 HG2 PRO A 660 13.964 -1.483 -0.269 1.00 0.00 H new ATOM 0 HG3 PRO A 660 14.425 -0.918 -1.863 1.00 0.00 H new ATOM 0 HD2 PRO A 660 15.560 -3.130 -0.238 1.00 0.00 H new ATOM 0 HD3 PRO A 660 15.314 -3.028 -1.970 1.00 0.00 H new ATOM 555 N GLY A 661 18.656 -1.600 0.691 1.00 0.00 N ATOM 556 CA GLY A 661 19.680 -1.697 1.716 1.00 0.00 C ATOM 557 C GLY A 661 19.320 -1.078 3.042 1.00 0.00 C ATOM 558 O GLY A 661 18.852 -1.748 3.961 1.00 0.00 O ATOM 0 H GLY A 661 18.381 -2.498 0.294 1.00 0.00 H new ATOM 0 HA2 GLY A 661 19.913 -2.750 1.876 1.00 0.00 H new ATOM 0 HA3 GLY A 661 20.588 -1.222 1.346 1.00 0.00 H new ATOM 562 N GLU A 662 19.558 0.208 3.111 1.00 0.00 N ATOM 563 CA GLU A 662 19.346 1.006 4.305 1.00 0.00 C ATOM 564 C GLU A 662 18.055 0.671 5.044 1.00 0.00 C ATOM 565 O GLU A 662 18.041 -0.188 5.927 1.00 0.00 O ATOM 566 CB GLU A 662 19.368 2.487 3.937 1.00 0.00 C ATOM 567 CG GLU A 662 20.678 3.181 4.273 1.00 0.00 C ATOM 568 CD GLU A 662 20.985 3.162 5.757 1.00 0.00 C ATOM 569 OE1 GLU A 662 20.381 3.965 6.499 1.00 0.00 O ATOM 570 OE2 GLU A 662 21.830 2.344 6.178 1.00 0.00 O ATOM 0 H GLU A 662 19.913 0.748 2.322 1.00 0.00 H new ATOM 0 HA GLU A 662 20.159 0.768 4.991 1.00 0.00 H new ATOM 0 HB2 GLU A 662 19.176 2.590 2.869 1.00 0.00 H new ATOM 0 HB3 GLU A 662 18.555 2.994 4.457 1.00 0.00 H new ATOM 0 HG2 GLU A 662 21.491 2.696 3.732 1.00 0.00 H new ATOM 0 HG3 GLU A 662 20.636 4.214 3.928 1.00 0.00 H new ATOM 577 N GLU A 663 16.973 1.352 4.679 1.00 0.00 N ATOM 578 CA GLU A 663 15.701 1.184 5.333 1.00 0.00 C ATOM 579 C GLU A 663 14.587 1.437 4.363 1.00 0.00 C ATOM 580 O GLU A 663 14.118 2.564 4.203 1.00 0.00 O ATOM 581 CB GLU A 663 15.567 2.137 6.478 1.00 0.00 C ATOM 582 CG GLU A 663 16.789 2.188 7.354 1.00 0.00 C ATOM 583 CD GLU A 663 16.980 3.533 8.028 1.00 0.00 C ATOM 584 OE1 GLU A 663 17.650 4.405 7.435 1.00 0.00 O ATOM 585 OE2 GLU A 663 16.459 3.716 9.149 1.00 0.00 O ATOM 0 H GLU A 663 16.964 2.034 3.920 1.00 0.00 H new ATOM 0 HA GLU A 663 15.645 0.161 5.705 1.00 0.00 H new ATOM 0 HB2 GLU A 663 15.365 3.135 6.090 1.00 0.00 H new ATOM 0 HB3 GLU A 663 14.707 1.850 7.082 1.00 0.00 H new ATOM 0 HG2 GLU A 663 16.715 1.413 8.117 1.00 0.00 H new ATOM 0 HG3 GLU A 663 17.670 1.961 6.753 1.00 0.00 H new ATOM 592 N TRP A 664 14.173 0.388 3.719 1.00 0.00 N ATOM 593 CA TRP A 664 13.127 0.469 2.761 1.00 0.00 C ATOM 594 C TRP A 664 11.804 0.555 3.449 1.00 0.00 C ATOM 595 O TRP A 664 11.684 0.492 4.661 1.00 0.00 O ATOM 596 CB TRP A 664 13.146 -0.760 1.898 1.00 0.00 C ATOM 597 CG TRP A 664 12.193 -0.766 0.755 1.00 0.00 C ATOM 598 CD1 TRP A 664 12.113 0.098 -0.295 1.00 0.00 C ATOM 599 CD2 TRP A 664 11.226 -1.751 0.541 1.00 0.00 C ATOM 600 NE1 TRP A 664 11.149 -0.338 -1.178 1.00 0.00 N ATOM 601 CE2 TRP A 664 10.581 -1.480 -0.670 1.00 0.00 C ATOM 602 CE3 TRP A 664 10.864 -2.844 1.281 1.00 0.00 C ATOM 603 CZ2 TRP A 664 9.573 -2.306 -1.160 1.00 0.00 C ATOM 604 CZ3 TRP A 664 9.870 -3.659 0.811 1.00 0.00 C ATOM 605 CH2 TRP A 664 9.236 -3.392 -0.408 1.00 0.00 C ATOM 0 H TRP A 664 14.556 -0.548 3.848 1.00 0.00 H new ATOM 0 HA TRP A 664 13.276 1.360 2.151 1.00 0.00 H new ATOM 0 HB2 TRP A 664 14.155 -0.889 1.506 1.00 0.00 H new ATOM 0 HB3 TRP A 664 12.935 -1.625 2.527 1.00 0.00 H new ATOM 0 HD1 TRP A 664 12.713 0.988 -0.417 1.00 0.00 H new ATOM 0 HE1 TRP A 664 10.900 0.111 -2.059 1.00 0.00 H new ATOM 0 HE3 TRP A 664 11.354 -3.059 2.219 1.00 0.00 H new ATOM 0 HZ2 TRP A 664 9.079 -2.095 -2.097 1.00 0.00 H new ATOM 0 HZ3 TRP A 664 9.570 -4.521 1.389 1.00 0.00 H new ATOM 0 HH2 TRP A 664 8.464 -4.060 -0.760 1.00 0.00 H new ATOM 616 N SER A 665 10.837 0.716 2.638 1.00 0.00 N ATOM 617 CA SER A 665 9.461 0.763 3.073 1.00 0.00 C ATOM 618 C SER A 665 8.584 0.268 1.941 1.00 0.00 C ATOM 619 O SER A 665 8.550 0.854 0.868 1.00 0.00 O ATOM 620 CB SER A 665 9.076 2.167 3.537 1.00 0.00 C ATOM 621 OG SER A 665 9.414 3.139 2.573 1.00 0.00 O ATOM 0 H SER A 665 10.958 0.823 1.631 1.00 0.00 H new ATOM 0 HA SER A 665 9.319 0.114 3.937 1.00 0.00 H new ATOM 0 HB2 SER A 665 8.005 2.205 3.734 1.00 0.00 H new ATOM 0 HB3 SER A 665 9.581 2.393 4.476 1.00 0.00 H new ATOM 0 HG SER A 665 9.640 2.697 1.728 1.00 0.00 H new ATOM 627 N CYS A 666 7.934 -0.860 2.172 1.00 0.00 N ATOM 628 CA CYS A 666 7.069 -1.471 1.171 1.00 0.00 C ATOM 629 C CYS A 666 6.125 -0.440 0.537 1.00 0.00 C ATOM 630 O CYS A 666 5.430 0.269 1.238 1.00 0.00 O ATOM 631 CB CYS A 666 6.325 -2.649 1.799 1.00 0.00 C ATOM 632 SG CYS A 666 4.867 -2.211 2.791 1.00 0.00 S ATOM 0 H CYS A 666 7.988 -1.376 3.050 1.00 0.00 H new ATOM 0 HA CYS A 666 7.677 -1.854 0.352 1.00 0.00 H new ATOM 0 HB2 CYS A 666 6.012 -3.325 1.003 1.00 0.00 H new ATOM 0 HB3 CYS A 666 7.021 -3.201 2.431 1.00 0.00 H new ATOM 0 HG CYS A 666 4.367 -3.285 3.326 1.00 0.00 H new ATOM 637 N SER A 667 6.122 -0.377 -0.804 1.00 0.00 N ATOM 638 CA SER A 667 5.317 0.600 -1.567 1.00 0.00 C ATOM 639 C SER A 667 4.007 1.013 -0.895 1.00 0.00 C ATOM 640 O SER A 667 3.712 2.203 -0.831 1.00 0.00 O ATOM 641 CB SER A 667 5.031 0.107 -2.982 1.00 0.00 C ATOM 642 OG SER A 667 5.741 0.871 -3.942 1.00 0.00 O ATOM 0 H SER A 667 6.676 -1.000 -1.393 1.00 0.00 H new ATOM 0 HA SER A 667 5.941 1.493 -1.602 1.00 0.00 H new ATOM 0 HB2 SER A 667 5.312 -0.943 -3.068 1.00 0.00 H new ATOM 0 HB3 SER A 667 3.961 0.169 -3.183 1.00 0.00 H new ATOM 0 HG SER A 667 6.515 0.360 -4.259 1.00 0.00 H new ATOM 648 N LEU A 668 3.207 0.072 -0.388 1.00 0.00 N ATOM 649 CA LEU A 668 1.959 0.455 0.249 1.00 0.00 C ATOM 650 C LEU A 668 2.228 1.092 1.640 1.00 0.00 C ATOM 651 O LEU A 668 1.365 1.203 2.509 1.00 0.00 O ATOM 652 CB LEU A 668 0.930 -0.695 0.180 1.00 0.00 C ATOM 653 CG LEU A 668 1.129 -1.895 1.074 1.00 0.00 C ATOM 654 CD1 LEU A 668 2.544 -2.329 1.108 1.00 0.00 C ATOM 655 CD2 LEU A 668 0.654 -1.490 2.386 1.00 0.00 C ATOM 0 H LEU A 668 3.398 -0.930 -0.407 1.00 0.00 H new ATOM 0 HA LEU A 668 1.468 1.256 -0.303 1.00 0.00 H new ATOM 0 HB2 LEU A 668 -0.051 -0.275 0.402 1.00 0.00 H new ATOM 0 HB3 LEU A 668 0.899 -1.051 -0.850 1.00 0.00 H new ATOM 0 HG LEU A 668 0.578 -2.760 0.704 1.00 0.00 H new ATOM 0 HD11 LEU A 668 2.643 -3.195 1.763 1.00 0.00 H new ATOM 0 HD12 LEU A 668 2.867 -2.596 0.102 1.00 0.00 H new ATOM 0 HD13 LEU A 668 3.165 -1.516 1.485 1.00 0.00 H new ATOM 0 HD21 LEU A 668 0.770 -2.317 3.086 1.00 0.00 H new ATOM 0 HD22 LEU A 668 1.234 -0.635 2.735 1.00 0.00 H new ATOM 0 HD23 LEU A 668 -0.398 -1.213 2.322 1.00 0.00 H new ATOM 667 N CYS A 669 3.469 1.581 1.749 1.00 0.00 N ATOM 668 CA CYS A 669 4.028 2.324 2.896 1.00 0.00 C ATOM 669 C CYS A 669 4.846 3.451 2.291 1.00 0.00 C ATOM 670 O CYS A 669 4.893 4.573 2.796 1.00 0.00 O ATOM 671 CB CYS A 669 5.032 1.523 3.741 1.00 0.00 C ATOM 672 SG CYS A 669 4.383 0.502 5.090 1.00 0.00 S ATOM 0 H CYS A 669 4.152 1.465 1.000 1.00 0.00 H new ATOM 0 HA CYS A 669 3.195 2.613 3.537 1.00 0.00 H new ATOM 0 HB2 CYS A 669 5.590 0.872 3.068 1.00 0.00 H new ATOM 0 HB3 CYS A 669 5.746 2.227 4.169 1.00 0.00 H new ATOM 0 HG CYS A 669 4.367 -0.745 4.722 1.00 0.00 H new ATOM 677 N HIS A 670 5.504 3.093 1.183 1.00 0.00 N ATOM 678 CA HIS A 670 6.378 4.004 0.442 1.00 0.00 C ATOM 679 C HIS A 670 5.626 4.776 -0.601 1.00 0.00 C ATOM 680 O HIS A 670 5.435 5.987 -0.501 1.00 0.00 O ATOM 681 CB HIS A 670 7.488 3.228 -0.254 1.00 0.00 C ATOM 682 CG HIS A 670 8.855 3.786 -0.036 1.00 0.00 C ATOM 683 ND1 HIS A 670 10.007 3.047 -0.209 1.00 0.00 N ATOM 684 CD2 HIS A 670 9.252 5.016 0.347 1.00 0.00 C ATOM 685 CE1 HIS A 670 11.057 3.802 0.063 1.00 0.00 C ATOM 686 NE2 HIS A 670 10.625 5.005 0.402 1.00 0.00 N ATOM 0 H HIS A 670 5.444 2.160 0.775 1.00 0.00 H new ATOM 0 HA HIS A 670 6.794 4.700 1.170 1.00 0.00 H new ATOM 0 HB2 HIS A 670 7.469 2.196 0.096 1.00 0.00 H new ATOM 0 HB3 HIS A 670 7.284 3.205 -1.324 1.00 0.00 H new ATOM 0 HD1 HIS A 670 10.043 2.070 -0.501 1.00 0.00 H new ATOM 0 HD2 HIS A 670 8.610 5.855 0.570 1.00 0.00 H new ATOM 0 HE1 HIS A 670 12.090 3.490 0.016 1.00 0.00 H new ATOM 1011 N ALA A 694 1.185 13.121 -14.589 1.00 0.00 N ATOM 1012 CA ALA A 694 0.039 13.915 -14.201 1.00 0.00 C ATOM 1013 C ALA A 694 -1.154 13.625 -15.077 1.00 0.00 C ATOM 1014 O ALA A 694 -1.974 14.499 -15.364 1.00 0.00 O ATOM 1015 CB ALA A 694 0.409 15.366 -14.229 1.00 0.00 C ATOM 0 HA ALA A 694 -0.251 13.648 -13.185 1.00 0.00 H new ATOM 0 HB1 ALA A 694 -0.452 15.967 -13.937 1.00 0.00 H new ATOM 0 HB2 ALA A 694 1.229 15.546 -13.534 1.00 0.00 H new ATOM 0 HB3 ALA A 694 0.720 15.643 -15.236 1.00 0.00 H new ATOM 1021 N LYS A 695 -1.226 12.382 -15.502 1.00 0.00 N ATOM 1022 CA LYS A 695 -2.327 11.929 -16.329 1.00 0.00 C ATOM 1023 C LYS A 695 -3.580 12.093 -15.521 1.00 0.00 C ATOM 1024 O LYS A 695 -4.455 12.913 -15.800 1.00 0.00 O ATOM 1025 CB LYS A 695 -2.144 10.487 -16.738 1.00 0.00 C ATOM 1026 CG LYS A 695 -0.888 10.256 -17.537 1.00 0.00 C ATOM 1027 CD LYS A 695 -1.146 9.302 -18.679 1.00 0.00 C ATOM 1028 CE LYS A 695 -1.933 9.956 -19.794 1.00 0.00 C ATOM 1029 NZ LYS A 695 -1.860 9.175 -21.060 1.00 0.00 N ATOM 0 H LYS A 695 -0.534 11.664 -15.288 1.00 0.00 H new ATOM 0 HA LYS A 695 -2.377 12.513 -17.248 1.00 0.00 H new ATOM 0 HB2 LYS A 695 -2.120 9.862 -15.845 1.00 0.00 H new ATOM 0 HB3 LYS A 695 -3.005 10.170 -17.326 1.00 0.00 H new ATOM 0 HG2 LYS A 695 -0.520 11.205 -17.926 1.00 0.00 H new ATOM 0 HG3 LYS A 695 -0.109 9.853 -16.890 1.00 0.00 H new ATOM 0 HD2 LYS A 695 -0.196 8.939 -19.070 1.00 0.00 H new ATOM 0 HD3 LYS A 695 -1.692 8.434 -18.310 1.00 0.00 H new ATOM 0 HE2 LYS A 695 -2.975 10.058 -19.491 1.00 0.00 H new ATOM 0 HE3 LYS A 695 -1.551 10.962 -19.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 695 -2.412 9.657 -21.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 695 -0.868 9.099 -21.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 695 -2.248 8.223 -20.904 1.00 0.00 H new ATOM 1043 N LEU A 696 -3.614 11.274 -14.512 1.00 0.00 N ATOM 1044 CA LEU A 696 -4.633 11.259 -13.516 1.00 0.00 C ATOM 1045 C LEU A 696 -4.227 12.186 -12.392 1.00 0.00 C ATOM 1046 O LEU A 696 -4.801 13.257 -12.186 1.00 0.00 O ATOM 1047 CB LEU A 696 -4.664 9.900 -12.919 1.00 0.00 C ATOM 1048 CG LEU A 696 -5.501 8.831 -13.579 1.00 0.00 C ATOM 1049 CD1 LEU A 696 -4.628 7.676 -13.887 1.00 0.00 C ATOM 1050 CD2 LEU A 696 -6.572 8.420 -12.620 1.00 0.00 C ATOM 0 H LEU A 696 -2.896 10.566 -14.358 1.00 0.00 H new ATOM 0 HA LEU A 696 -5.586 11.548 -13.958 1.00 0.00 H new ATOM 0 HB2 LEU A 696 -3.638 9.535 -12.877 1.00 0.00 H new ATOM 0 HB3 LEU A 696 -5.009 10.000 -11.890 1.00 0.00 H new ATOM 0 HG LEU A 696 -5.954 9.198 -14.500 1.00 0.00 H new ATOM 0 HD11 LEU A 696 -5.216 6.893 -14.365 1.00 0.00 H new ATOM 0 HD12 LEU A 696 -3.830 7.992 -14.559 1.00 0.00 H new ATOM 0 HD13 LEU A 696 -4.194 7.292 -12.964 1.00 0.00 H new ATOM 0 HD21 LEU A 696 -7.191 7.647 -13.075 1.00 0.00 H new ATOM 0 HD22 LEU A 696 -6.116 8.030 -11.710 1.00 0.00 H new ATOM 0 HD23 LEU A 696 -7.191 9.283 -12.375 1.00 0.00 H new ATOM 1062 N SER A 697 -3.196 11.725 -11.668 1.00 0.00 N ATOM 1063 CA SER A 697 -2.655 12.444 -10.531 1.00 0.00 C ATOM 1064 C SER A 697 -1.403 11.763 -10.004 1.00 0.00 C ATOM 1065 O SER A 697 -1.385 10.566 -9.753 1.00 0.00 O ATOM 1066 CB SER A 697 -3.711 12.544 -9.434 1.00 0.00 C ATOM 1067 OG SER A 697 -4.478 13.728 -9.570 1.00 0.00 O ATOM 0 H SER A 697 -2.722 10.843 -11.863 1.00 0.00 H new ATOM 0 HA SER A 697 -2.379 13.448 -10.853 1.00 0.00 H new ATOM 0 HB2 SER A 697 -4.367 11.675 -9.477 1.00 0.00 H new ATOM 0 HB3 SER A 697 -3.227 12.531 -8.457 1.00 0.00 H new ATOM 0 HG SER A 697 -4.772 13.822 -10.500 1.00 0.00 H new ATOM 1073 N PRO A 698 -0.339 12.544 -9.814 1.00 0.00 N ATOM 1074 CA PRO A 698 0.946 12.052 -9.294 1.00 0.00 C ATOM 1075 C PRO A 698 0.740 11.467 -7.944 1.00 0.00 C ATOM 1076 O PRO A 698 1.462 10.592 -7.466 1.00 0.00 O ATOM 1077 CB PRO A 698 1.741 13.336 -9.134 1.00 0.00 C ATOM 1078 CG PRO A 698 0.670 14.315 -8.906 1.00 0.00 C ATOM 1079 CD PRO A 698 -0.300 13.994 -9.982 1.00 0.00 C ATOM 0 HA PRO A 698 1.414 11.298 -9.927 1.00 0.00 H new ATOM 0 HB2 PRO A 698 2.437 13.286 -8.296 1.00 0.00 H new ATOM 0 HB3 PRO A 698 2.328 13.569 -10.023 1.00 0.00 H new ATOM 0 HG2 PRO A 698 0.227 14.207 -7.916 1.00 0.00 H new ATOM 0 HG3 PRO A 698 1.035 15.339 -8.982 1.00 0.00 H new ATOM 0 HD2 PRO A 698 -1.272 14.464 -9.829 1.00 0.00 H new ATOM 0 HD3 PRO A 698 0.049 14.296 -10.970 1.00 0.00 H new ATOM 1087 N ALA A 699 -0.297 11.992 -7.362 1.00 0.00 N ATOM 1088 CA ALA A 699 -0.698 11.650 -6.031 1.00 0.00 C ATOM 1089 C ALA A 699 -1.709 10.535 -6.018 1.00 0.00 C ATOM 1090 O ALA A 699 -1.595 9.617 -5.223 1.00 0.00 O ATOM 1091 CB ALA A 699 -1.287 12.834 -5.390 1.00 0.00 C ATOM 0 H ALA A 699 -0.899 12.684 -7.809 1.00 0.00 H new ATOM 0 HA ALA A 699 0.186 11.311 -5.490 1.00 0.00 H new ATOM 0 HB1 ALA A 699 -1.596 12.583 -4.375 1.00 0.00 H new ATOM 0 HB2 ALA A 699 -0.549 13.635 -5.357 1.00 0.00 H new ATOM 0 HB3 ALA A 699 -2.154 13.164 -5.962 1.00 0.00 H new ATOM 1097 N ASN A 700 -2.728 10.603 -6.876 1.00 0.00 N ATOM 1098 CA ASN A 700 -3.693 9.544 -6.874 1.00 0.00 C ATOM 1099 C ASN A 700 -2.904 8.286 -7.114 1.00 0.00 C ATOM 1100 O ASN A 700 -3.091 7.287 -6.428 1.00 0.00 O ATOM 1101 CB ASN A 700 -4.790 9.766 -7.913 1.00 0.00 C ATOM 1102 CG ASN A 700 -5.868 10.715 -7.426 1.00 0.00 C ATOM 1103 OD1 ASN A 700 -6.132 10.812 -6.227 1.00 0.00 O ATOM 1104 ND2 ASN A 700 -6.502 11.418 -8.357 1.00 0.00 N ATOM 0 H ASN A 700 -2.890 11.353 -7.548 1.00 0.00 H new ATOM 0 HA ASN A 700 -4.232 9.490 -5.928 1.00 0.00 H new ATOM 0 HB2 ASN A 700 -4.346 10.163 -8.826 1.00 0.00 H new ATOM 0 HB3 ASN A 700 -5.243 8.808 -8.169 1.00 0.00 H new ATOM 0 HD21 ASN A 700 -7.240 12.070 -8.090 1.00 0.00 H new ATOM 0 HD22 ASN A 700 -6.251 11.306 -9.339 1.00 0.00 H new ATOM 1111 N GLN A 701 -1.977 8.369 -8.071 1.00 0.00 N ATOM 1112 CA GLN A 701 -1.090 7.275 -8.350 1.00 0.00 C ATOM 1113 C GLN A 701 -0.388 6.897 -7.076 1.00 0.00 C ATOM 1114 O GLN A 701 -0.304 5.743 -6.701 1.00 0.00 O ATOM 1115 CB GLN A 701 -0.061 7.662 -9.391 1.00 0.00 C ATOM 1116 CG GLN A 701 0.857 6.514 -9.771 1.00 0.00 C ATOM 1117 CD GLN A 701 1.285 6.560 -11.221 1.00 0.00 C ATOM 1118 OE1 GLN A 701 0.648 5.743 -12.048 1.00 0.00 O flip ATOM 1119 NE2 GLN A 701 2.197 7.301 -11.588 1.00 0.00 N flip ATOM 0 H GLN A 701 -1.834 9.191 -8.658 1.00 0.00 H new ATOM 0 HA GLN A 701 -1.669 6.437 -8.738 1.00 0.00 H new ATOM 0 HB2 GLN A 701 -0.573 8.022 -10.284 1.00 0.00 H new ATOM 0 HB3 GLN A 701 0.539 8.489 -9.012 1.00 0.00 H new ATOM 0 HG2 GLN A 701 1.742 6.537 -9.135 1.00 0.00 H new ATOM 0 HG3 GLN A 701 0.349 5.569 -9.577 1.00 0.00 H new ATOM 0 HE21 GLN A 701 2.659 7.913 -10.915 1.00 0.00 H new ATOM 0 HE22 GLN A 701 2.491 7.303 -12.565 1.00 0.00 H new ATOM 1128 N ARG A 702 0.148 7.893 -6.416 1.00 0.00 N ATOM 1129 CA ARG A 702 0.800 7.655 -5.155 1.00 0.00 C ATOM 1130 C ARG A 702 -0.065 6.694 -4.333 1.00 0.00 C ATOM 1131 O ARG A 702 0.376 5.631 -3.896 1.00 0.00 O ATOM 1132 CB ARG A 702 0.996 8.977 -4.427 1.00 0.00 C ATOM 1133 CG ARG A 702 2.362 9.587 -4.660 1.00 0.00 C ATOM 1134 CD ARG A 702 3.012 10.007 -3.359 1.00 0.00 C ATOM 1135 NE ARG A 702 2.394 11.203 -2.792 1.00 0.00 N ATOM 1136 CZ ARG A 702 2.373 11.476 -1.490 1.00 0.00 C ATOM 1137 NH1 ARG A 702 2.923 10.638 -0.622 1.00 0.00 N ATOM 1138 NH2 ARG A 702 1.797 12.589 -1.055 1.00 0.00 N ATOM 0 H ARG A 702 0.146 8.865 -6.727 1.00 0.00 H new ATOM 0 HA ARG A 702 1.781 7.206 -5.308 1.00 0.00 H new ATOM 0 HB2 ARG A 702 0.230 9.681 -4.752 1.00 0.00 H new ATOM 0 HB3 ARG A 702 0.852 8.821 -3.358 1.00 0.00 H new ATOM 0 HG2 ARG A 702 3.001 8.867 -5.171 1.00 0.00 H new ATOM 0 HG3 ARG A 702 2.268 10.452 -5.317 1.00 0.00 H new ATOM 0 HD2 ARG A 702 2.944 9.190 -2.641 1.00 0.00 H new ATOM 0 HD3 ARG A 702 4.072 10.194 -3.529 1.00 0.00 H new ATOM 0 HE ARG A 702 1.954 11.866 -3.430 1.00 0.00 H new ATOM 0 HH11 ARG A 702 3.365 9.780 -0.951 1.00 0.00 H new ATOM 0 HH12 ARG A 702 2.904 10.852 0.375 1.00 0.00 H new ATOM 0 HH21 ARG A 702 1.370 13.235 -1.719 1.00 0.00 H new ATOM 0 HH22 ARG A 702 1.781 12.798 -0.057 1.00 0.00 H new ATOM 1152 N LYS A 703 -1.331 7.048 -4.213 1.00 0.00 N ATOM 1153 CA LYS A 703 -2.301 6.269 -3.465 1.00 0.00 C ATOM 1154 C LYS A 703 -2.637 4.927 -4.137 1.00 0.00 C ATOM 1155 O LYS A 703 -3.130 3.991 -3.506 1.00 0.00 O ATOM 1156 CB LYS A 703 -3.534 7.091 -3.353 1.00 0.00 C ATOM 1157 CG LYS A 703 -3.248 8.518 -2.986 1.00 0.00 C ATOM 1158 CD LYS A 703 -4.474 9.282 -3.220 1.00 0.00 C ATOM 1159 CE LYS A 703 -4.150 10.632 -3.758 1.00 0.00 C ATOM 1160 NZ LYS A 703 -3.794 11.601 -2.685 1.00 0.00 N ATOM 0 H LYS A 703 -1.719 7.892 -4.636 1.00 0.00 H new ATOM 0 HA LYS A 703 -1.878 6.027 -2.490 1.00 0.00 H new ATOM 0 HB2 LYS A 703 -4.071 7.065 -4.301 1.00 0.00 H new ATOM 0 HB3 LYS A 703 -4.191 6.652 -2.603 1.00 0.00 H new ATOM 0 HG2 LYS A 703 -2.942 8.592 -1.942 1.00 0.00 H new ATOM 0 HG3 LYS A 703 -2.429 8.913 -3.587 1.00 0.00 H new ATOM 0 HD2 LYS A 703 -5.114 8.748 -3.922 1.00 0.00 H new ATOM 0 HD3 LYS A 703 -5.033 9.379 -2.289 1.00 0.00 H new ATOM 0 HE2 LYS A 703 -3.320 10.551 -4.460 1.00 0.00 H new ATOM 0 HE3 LYS A 703 -5.005 11.012 -4.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 703 -3.577 12.525 -3.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 703 -4.594 11.701 -2.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 703 -2.962 11.254 -2.166 1.00 0.00 H new ATOM 1174 N CYS A 704 -2.393 4.869 -5.428 1.00 0.00 N ATOM 1175 CA CYS A 704 -2.642 3.698 -6.245 1.00 0.00 C ATOM 1176 C CYS A 704 -1.583 2.653 -5.965 1.00 0.00 C ATOM 1177 O CYS A 704 -1.889 1.489 -5.726 1.00 0.00 O ATOM 1178 CB CYS A 704 -2.578 4.146 -7.703 1.00 0.00 C ATOM 1179 SG CYS A 704 -0.932 4.125 -8.429 1.00 0.00 S ATOM 0 H CYS A 704 -2.006 5.653 -5.953 1.00 0.00 H new ATOM 0 HA CYS A 704 -3.615 3.260 -6.025 1.00 0.00 H new ATOM 0 HB2 CYS A 704 -3.229 3.502 -8.295 1.00 0.00 H new ATOM 0 HB3 CYS A 704 -2.979 5.157 -7.775 1.00 0.00 H new ATOM 0 HG CYS A 704 -0.106 4.759 -7.651 1.00 0.00 H new ATOM 1185 N GLU A 705 -0.329 3.079 -6.014 1.00 0.00 N ATOM 1186 CA GLU A 705 0.768 2.193 -5.722 1.00 0.00 C ATOM 1187 C GLU A 705 0.526 1.637 -4.336 1.00 0.00 C ATOM 1188 O GLU A 705 0.971 0.551 -3.975 1.00 0.00 O ATOM 1189 CB GLU A 705 2.095 2.939 -5.812 1.00 0.00 C ATOM 1190 CG GLU A 705 2.659 2.945 -7.220 1.00 0.00 C ATOM 1191 CD GLU A 705 4.002 3.643 -7.313 1.00 0.00 C ATOM 1192 OE1 GLU A 705 5.030 2.991 -7.035 1.00 0.00 O ATOM 1193 OE2 GLU A 705 4.025 4.842 -7.664 1.00 0.00 O ATOM 0 H GLU A 705 -0.055 4.032 -6.253 1.00 0.00 H new ATOM 0 HA GLU A 705 0.825 1.379 -6.445 1.00 0.00 H new ATOM 0 HB2 GLU A 705 1.955 3.966 -5.475 1.00 0.00 H new ATOM 0 HB3 GLU A 705 2.815 2.477 -5.137 1.00 0.00 H new ATOM 0 HG2 GLU A 705 2.764 1.918 -7.569 1.00 0.00 H new ATOM 0 HG3 GLU A 705 1.952 3.437 -7.887 1.00 0.00 H new ATOM 1200 N ARG A 706 -0.210 2.411 -3.561 1.00 0.00 N ATOM 1201 CA ARG A 706 -0.593 1.990 -2.242 1.00 0.00 C ATOM 1202 C ARG A 706 -1.454 0.751 -2.388 1.00 0.00 C ATOM 1203 O ARG A 706 -1.270 -0.231 -1.684 1.00 0.00 O ATOM 1204 CB ARG A 706 -1.396 3.099 -1.574 1.00 0.00 C ATOM 1205 CG ARG A 706 -0.729 3.760 -0.413 1.00 0.00 C ATOM 1206 CD ARG A 706 -1.433 3.422 0.891 1.00 0.00 C ATOM 1207 NE ARG A 706 -1.434 1.988 1.160 1.00 0.00 N ATOM 1208 CZ ARG A 706 -1.983 1.448 2.242 1.00 0.00 C ATOM 1209 NH1 ARG A 706 -2.562 2.221 3.149 1.00 0.00 N ATOM 1210 NH2 ARG A 706 -1.955 0.135 2.420 1.00 0.00 N ATOM 0 H ARG A 706 -0.551 3.334 -3.829 1.00 0.00 H new ATOM 0 HA ARG A 706 0.284 1.774 -1.632 1.00 0.00 H new ATOM 0 HB2 ARG A 706 -1.626 3.859 -2.321 1.00 0.00 H new ATOM 0 HB3 ARG A 706 -2.347 2.685 -1.238 1.00 0.00 H new ATOM 0 HG2 ARG A 706 0.313 3.443 -0.360 1.00 0.00 H new ATOM 0 HG3 ARG A 706 -0.726 4.840 -0.558 1.00 0.00 H new ATOM 0 HD2 ARG A 706 -0.943 3.944 1.713 1.00 0.00 H new ATOM 0 HD3 ARG A 706 -2.461 3.783 0.852 1.00 0.00 H new ATOM 0 HE ARG A 706 -0.990 1.368 0.482 1.00 0.00 H new ATOM 0 HH11 ARG A 706 -2.586 3.232 3.017 1.00 0.00 H new ATOM 0 HH12 ARG A 706 -2.983 1.805 3.980 1.00 0.00 H new ATOM 0 HH21 ARG A 706 -1.511 -0.465 1.725 1.00 0.00 H new ATOM 0 HH22 ARG A 706 -2.378 -0.276 3.252 1.00 0.00 H new ATOM 1224 N VAL A 707 -2.384 0.812 -3.344 1.00 0.00 N ATOM 1225 CA VAL A 707 -3.293 -0.268 -3.610 1.00 0.00 C ATOM 1226 C VAL A 707 -2.629 -1.518 -4.191 1.00 0.00 C ATOM 1227 O VAL A 707 -2.631 -2.522 -3.530 1.00 0.00 O ATOM 1228 CB VAL A 707 -4.452 0.195 -4.484 1.00 0.00 C ATOM 1229 CG1 VAL A 707 -4.706 1.638 -4.329 1.00 0.00 C ATOM 1230 CG2 VAL A 707 -4.331 -0.157 -5.907 1.00 0.00 C ATOM 0 H VAL A 707 -2.515 1.622 -3.949 1.00 0.00 H new ATOM 0 HA VAL A 707 -3.681 -0.570 -2.637 1.00 0.00 H new ATOM 0 HB VAL A 707 -5.311 -0.364 -4.114 1.00 0.00 H new ATOM 0 HG11 VAL A 707 -5.539 1.931 -4.968 1.00 0.00 H new ATOM 0 HG12 VAL A 707 -4.952 1.855 -3.289 1.00 0.00 H new ATOM 0 HG13 VAL A 707 -3.815 2.197 -4.615 1.00 0.00 H new ATOM 0 HG21 VAL A 707 -5.201 0.214 -6.449 1.00 0.00 H new ATOM 0 HG22 VAL A 707 -3.428 0.295 -6.318 1.00 0.00 H new ATOM 0 HG23 VAL A 707 -4.274 -1.241 -6.010 1.00 0.00 H new ATOM 1240 N LEU A 708 -2.027 -1.471 -5.391 1.00 0.00 N ATOM 1241 CA LEU A 708 -1.441 -2.660 -5.977 1.00 0.00 C ATOM 1242 C LEU A 708 -0.628 -3.369 -4.985 1.00 0.00 C ATOM 1243 O LEU A 708 -0.735 -4.565 -4.848 1.00 0.00 O ATOM 1244 CB LEU A 708 -0.558 -2.358 -7.166 1.00 0.00 C ATOM 1245 CG LEU A 708 -1.054 -2.813 -8.517 1.00 0.00 C ATOM 1246 CD1 LEU A 708 -2.509 -3.181 -8.509 1.00 0.00 C ATOM 1247 CD2 LEU A 708 -0.787 -1.697 -9.422 1.00 0.00 C ATOM 0 H LEU A 708 -1.940 -0.628 -5.958 1.00 0.00 H new ATOM 0 HA LEU A 708 -2.278 -3.272 -6.313 1.00 0.00 H new ATOM 0 HB2 LEU A 708 -0.401 -1.280 -7.207 1.00 0.00 H new ATOM 0 HB3 LEU A 708 0.416 -2.815 -6.990 1.00 0.00 H new ATOM 0 HG LEU A 708 -0.545 -3.725 -8.830 1.00 0.00 H new ATOM 0 HD11 LEU A 708 -2.809 -3.500 -9.507 1.00 0.00 H new ATOM 0 HD12 LEU A 708 -2.675 -3.995 -7.803 1.00 0.00 H new ATOM 0 HD13 LEU A 708 -3.101 -2.316 -8.211 1.00 0.00 H new ATOM 0 HD21 LEU A 708 -1.122 -1.955 -10.427 1.00 0.00 H new ATOM 0 HD22 LEU A 708 -1.323 -0.813 -9.077 1.00 0.00 H new ATOM 0 HD23 LEU A 708 0.283 -1.490 -9.438 1.00 0.00 H new ATOM 1259 N LEU A 709 0.209 -2.651 -4.294 1.00 0.00 N ATOM 1260 CA LEU A 709 0.993 -3.314 -3.345 1.00 0.00 C ATOM 1261 C LEU A 709 0.139 -3.847 -2.222 1.00 0.00 C ATOM 1262 O LEU A 709 0.155 -5.041 -1.959 1.00 0.00 O ATOM 1263 CB LEU A 709 2.099 -2.487 -2.768 1.00 0.00 C ATOM 1264 CG LEU A 709 3.030 -3.366 -1.994 1.00 0.00 C ATOM 1265 CD1 LEU A 709 3.401 -4.575 -2.796 1.00 0.00 C ATOM 1266 CD2 LEU A 709 4.256 -2.632 -1.635 1.00 0.00 C ATOM 0 H LEU A 709 0.350 -1.644 -4.377 1.00 0.00 H new ATOM 0 HA LEU A 709 1.464 -4.131 -3.892 1.00 0.00 H new ATOM 0 HB2 LEU A 709 2.641 -1.979 -3.565 1.00 0.00 H new ATOM 0 HB3 LEU A 709 1.688 -1.714 -2.119 1.00 0.00 H new ATOM 0 HG LEU A 709 2.516 -3.679 -1.085 1.00 0.00 H new ATOM 0 HD11 LEU A 709 4.079 -5.202 -2.217 1.00 0.00 H new ATOM 0 HD12 LEU A 709 2.501 -5.141 -3.039 1.00 0.00 H new ATOM 0 HD13 LEU A 709 3.893 -4.263 -3.717 1.00 0.00 H new ATOM 0 HD21 LEU A 709 4.921 -3.287 -1.073 1.00 0.00 H new ATOM 0 HD22 LEU A 709 4.759 -2.297 -2.542 1.00 0.00 H new ATOM 0 HD23 LEU A 709 3.997 -1.767 -1.024 1.00 0.00 H new ATOM 1278 N ALA A 710 -0.593 -2.960 -1.541 1.00 0.00 N ATOM 1279 CA ALA A 710 -1.456 -3.394 -0.464 1.00 0.00 C ATOM 1280 C ALA A 710 -2.096 -4.710 -0.855 1.00 0.00 C ATOM 1281 O ALA A 710 -2.177 -5.656 -0.076 1.00 0.00 O ATOM 1282 CB ALA A 710 -2.541 -2.401 -0.218 1.00 0.00 C ATOM 0 H ALA A 710 -0.599 -1.956 -1.720 1.00 0.00 H new ATOM 0 HA ALA A 710 -0.858 -3.499 0.441 1.00 0.00 H new ATOM 0 HB1 ALA A 710 -3.176 -2.750 0.596 1.00 0.00 H new ATOM 0 HB2 ALA A 710 -2.101 -1.441 0.051 1.00 0.00 H new ATOM 0 HB3 ALA A 710 -3.140 -2.285 -1.121 1.00 0.00 H new ATOM 1288 N LEU A 711 -2.559 -4.730 -2.105 1.00 0.00 N ATOM 1289 CA LEU A 711 -3.163 -5.857 -2.706 1.00 0.00 C ATOM 1290 C LEU A 711 -2.192 -7.017 -2.702 1.00 0.00 C ATOM 1291 O LEU A 711 -2.377 -8.029 -2.030 1.00 0.00 O ATOM 1292 CB LEU A 711 -3.495 -5.396 -4.102 1.00 0.00 C ATOM 1293 CG LEU A 711 -4.598 -4.363 -4.141 1.00 0.00 C ATOM 1294 CD1 LEU A 711 -4.726 -3.851 -5.516 1.00 0.00 C ATOM 1295 CD2 LEU A 711 -5.865 -4.992 -3.704 1.00 0.00 C ATOM 0 H LEU A 711 -2.509 -3.921 -2.724 1.00 0.00 H new ATOM 0 HA LEU A 711 -4.053 -6.210 -2.184 1.00 0.00 H new ATOM 0 HB2 LEU A 711 -2.599 -4.979 -4.563 1.00 0.00 H new ATOM 0 HB3 LEU A 711 -3.791 -6.257 -4.701 1.00 0.00 H new ATOM 0 HG LEU A 711 -4.366 -3.534 -3.473 1.00 0.00 H new ATOM 0 HD11 LEU A 711 -5.520 -3.105 -5.554 1.00 0.00 H new ATOM 0 HD12 LEU A 711 -3.785 -3.396 -5.824 1.00 0.00 H new ATOM 0 HD13 LEU A 711 -4.968 -4.673 -6.189 1.00 0.00 H new ATOM 0 HD21 LEU A 711 -6.666 -4.253 -3.729 1.00 0.00 H new ATOM 0 HD22 LEU A 711 -6.111 -5.817 -4.373 1.00 0.00 H new ATOM 0 HD23 LEU A 711 -5.752 -5.370 -2.688 1.00 0.00 H new ATOM 1307 N PHE A 712 -1.150 -6.804 -3.453 1.00 0.00 N ATOM 1308 CA PHE A 712 -0.042 -7.747 -3.612 1.00 0.00 C ATOM 1309 C PHE A 712 0.336 -8.420 -2.295 1.00 0.00 C ATOM 1310 O PHE A 712 0.220 -9.632 -2.129 1.00 0.00 O ATOM 1311 CB PHE A 712 1.166 -6.979 -4.117 1.00 0.00 C ATOM 1312 CG PHE A 712 1.429 -7.156 -5.575 1.00 0.00 C ATOM 1313 CD1 PHE A 712 2.251 -8.169 -6.033 1.00 0.00 C ATOM 1314 CD2 PHE A 712 0.861 -6.297 -6.487 1.00 0.00 C ATOM 1315 CE1 PHE A 712 2.493 -8.321 -7.383 1.00 0.00 C ATOM 1316 CE2 PHE A 712 1.097 -6.434 -7.823 1.00 0.00 C ATOM 1317 CZ PHE A 712 1.915 -7.451 -8.281 1.00 0.00 C ATOM 0 H PHE A 712 -1.029 -5.948 -3.995 1.00 0.00 H new ATOM 0 HA PHE A 712 -0.355 -8.523 -4.311 1.00 0.00 H new ATOM 0 HB2 PHE A 712 1.023 -5.919 -3.910 1.00 0.00 H new ATOM 0 HB3 PHE A 712 2.046 -7.297 -3.558 1.00 0.00 H new ATOM 0 HD1 PHE A 712 2.708 -8.847 -5.328 1.00 0.00 H new ATOM 0 HD2 PHE A 712 0.218 -5.502 -6.139 1.00 0.00 H new ATOM 0 HE1 PHE A 712 3.132 -9.118 -7.734 1.00 0.00 H new ATOM 0 HE2 PHE A 712 0.645 -5.748 -8.524 1.00 0.00 H new ATOM 0 HZ PHE A 712 2.100 -7.563 -9.339 1.00 0.00 H new ATOM 1327 N CYS A 713 0.796 -7.593 -1.369 1.00 0.00 N ATOM 1328 CA CYS A 713 1.226 -8.025 -0.050 1.00 0.00 C ATOM 1329 C CYS A 713 0.275 -9.042 0.566 1.00 0.00 C ATOM 1330 O CYS A 713 0.724 -9.972 1.236 1.00 0.00 O ATOM 1331 CB CYS A 713 1.330 -6.808 0.877 1.00 0.00 C ATOM 1332 SG CYS A 713 -0.186 -6.436 1.789 1.00 0.00 S ATOM 0 H CYS A 713 0.882 -6.587 -1.516 1.00 0.00 H new ATOM 0 HA CYS A 713 2.197 -8.507 -0.165 1.00 0.00 H new ATOM 0 HB2 CYS A 713 2.137 -6.977 1.590 1.00 0.00 H new ATOM 0 HB3 CYS A 713 1.606 -5.936 0.284 1.00 0.00 H new ATOM 0 HG CYS A 713 -1.173 -6.301 0.954 1.00 0.00 H new ATOM 1338 N HIS A 714 -1.032 -8.888 0.357 1.00 0.00 N ATOM 1339 CA HIS A 714 -1.960 -9.827 0.925 1.00 0.00 C ATOM 1340 C HIS A 714 -2.111 -11.051 0.057 1.00 0.00 C ATOM 1341 O HIS A 714 -1.750 -11.039 -1.119 1.00 0.00 O ATOM 1342 CB HIS A 714 -3.285 -9.165 1.238 1.00 0.00 C ATOM 1343 CG HIS A 714 -4.155 -8.733 0.116 1.00 0.00 C ATOM 1344 ND1 HIS A 714 -4.421 -7.410 -0.108 1.00 0.00 N ATOM 1345 CD2 HIS A 714 -4.975 -9.420 -0.709 1.00 0.00 C ATOM 1346 CE1 HIS A 714 -5.373 -7.305 -1.003 1.00 0.00 C ATOM 1347 NE2 HIS A 714 -5.727 -8.504 -1.381 1.00 0.00 N ATOM 0 H HIS A 714 -1.452 -8.136 -0.190 1.00 0.00 H new ATOM 0 HA HIS A 714 -1.551 -10.174 1.874 1.00 0.00 H new ATOM 0 HB2 HIS A 714 -3.861 -9.856 1.854 1.00 0.00 H new ATOM 0 HB3 HIS A 714 -3.078 -8.288 1.851 1.00 0.00 H new ATOM 0 HD1 HIS A 714 -3.952 -6.628 0.349 1.00 0.00 H new ATOM 0 HD2 HIS A 714 -5.025 -10.494 -0.816 1.00 0.00 H new ATOM 0 HE1 HIS A 714 -5.795 -6.380 -1.368 1.00 0.00 H new ATOM 1356 N GLU A 715 -2.647 -12.113 0.637 1.00 0.00 N ATOM 1357 CA GLU A 715 -2.751 -13.355 -0.091 1.00 0.00 C ATOM 1358 C GLU A 715 -3.867 -13.383 -1.127 1.00 0.00 C ATOM 1359 O GLU A 715 -3.645 -13.805 -2.255 1.00 0.00 O ATOM 1360 CB GLU A 715 -2.885 -14.546 0.840 1.00 0.00 C ATOM 1361 CG GLU A 715 -2.771 -15.858 0.094 1.00 0.00 C ATOM 1362 CD GLU A 715 -1.954 -16.893 0.841 1.00 0.00 C ATOM 1363 OE1 GLU A 715 -0.709 -16.843 0.755 1.00 0.00 O ATOM 1364 OE2 GLU A 715 -2.560 -17.755 1.512 1.00 0.00 O ATOM 0 H GLU A 715 -3.008 -12.136 1.591 1.00 0.00 H new ATOM 0 HA GLU A 715 -1.812 -13.427 -0.640 1.00 0.00 H new ATOM 0 HB2 GLU A 715 -2.113 -14.496 1.608 1.00 0.00 H new ATOM 0 HB3 GLU A 715 -3.846 -14.501 1.352 1.00 0.00 H new ATOM 0 HG2 GLU A 715 -3.770 -16.254 -0.089 1.00 0.00 H new ATOM 0 HG3 GLU A 715 -2.316 -15.678 -0.880 1.00 0.00 H new ATOM 1371 N PRO A 716 -5.103 -13.036 -0.759 1.00 0.00 N ATOM 1372 CA PRO A 716 -6.190 -12.998 -1.720 1.00 0.00 C ATOM 1373 C PRO A 716 -5.664 -12.506 -3.064 1.00 0.00 C ATOM 1374 O PRO A 716 -6.028 -13.003 -4.144 1.00 0.00 O ATOM 1375 CB PRO A 716 -7.141 -12.006 -1.069 1.00 0.00 C ATOM 1376 CG PRO A 716 -6.986 -12.269 0.395 1.00 0.00 C ATOM 1377 CD PRO A 716 -5.552 -12.709 0.598 1.00 0.00 C ATOM 0 HA PRO A 716 -6.663 -13.957 -1.931 1.00 0.00 H new ATOM 0 HB2 PRO A 716 -6.880 -10.978 -1.320 1.00 0.00 H new ATOM 0 HB3 PRO A 716 -8.169 -12.163 -1.397 1.00 0.00 H new ATOM 0 HG2 PRO A 716 -7.204 -11.373 0.976 1.00 0.00 H new ATOM 0 HG3 PRO A 716 -7.680 -13.041 0.727 1.00 0.00 H new ATOM 0 HD2 PRO A 716 -4.948 -11.918 1.042 1.00 0.00 H new ATOM 0 HD3 PRO A 716 -5.486 -13.571 1.262 1.00 0.00 H new ATOM 1385 N CYS A 717 -4.772 -11.530 -3.010 1.00 0.00 N ATOM 1386 CA CYS A 717 -4.186 -11.057 -4.227 1.00 0.00 C ATOM 1387 C CYS A 717 -3.265 -12.115 -4.752 1.00 0.00 C ATOM 1388 O CYS A 717 -3.261 -12.337 -5.921 1.00 0.00 O ATOM 1389 CB CYS A 717 -3.460 -9.738 -4.092 1.00 0.00 C ATOM 1390 SG CYS A 717 -4.520 -8.289 -4.171 1.00 0.00 S ATOM 0 H CYS A 717 -4.453 -11.069 -2.158 1.00 0.00 H new ATOM 0 HA CYS A 717 -4.999 -10.862 -4.926 1.00 0.00 H new ATOM 0 HB2 CYS A 717 -2.924 -9.729 -3.143 1.00 0.00 H new ATOM 0 HB3 CYS A 717 -2.711 -9.668 -4.881 1.00 0.00 H new ATOM 0 HG CYS A 717 -5.261 -8.235 -3.104 1.00 0.00 H new ATOM 1396 N ARG A 718 -2.481 -12.776 -3.894 1.00 0.00 N ATOM 1397 CA ARG A 718 -1.592 -13.837 -4.374 1.00 0.00 C ATOM 1398 C ARG A 718 -2.139 -14.388 -5.691 1.00 0.00 C ATOM 1399 O ARG A 718 -1.448 -14.343 -6.707 1.00 0.00 O ATOM 1400 CB ARG A 718 -1.410 -14.947 -3.339 1.00 0.00 C ATOM 1401 CG ARG A 718 -0.385 -14.634 -2.284 1.00 0.00 C ATOM 1402 CD ARG A 718 0.948 -14.767 -2.918 1.00 0.00 C ATOM 1403 NE ARG A 718 1.681 -15.935 -2.435 1.00 0.00 N ATOM 1404 CZ ARG A 718 2.315 -16.793 -3.230 1.00 0.00 C ATOM 1405 NH1 ARG A 718 2.312 -16.616 -4.544 1.00 0.00 N ATOM 1406 NH2 ARG A 718 2.950 -17.835 -2.708 1.00 0.00 N ATOM 0 H ARG A 718 -2.443 -12.601 -2.890 1.00 0.00 H new ATOM 0 HA ARG A 718 -0.602 -13.413 -4.542 1.00 0.00 H new ATOM 0 HB2 ARG A 718 -2.368 -15.140 -2.855 1.00 0.00 H new ATOM 0 HB3 ARG A 718 -1.121 -15.865 -3.852 1.00 0.00 H new ATOM 0 HG2 ARG A 718 -0.528 -13.626 -1.895 1.00 0.00 H new ATOM 0 HG3 ARG A 718 -0.480 -15.317 -1.440 1.00 0.00 H new ATOM 0 HD2 ARG A 718 0.828 -14.839 -3.999 1.00 0.00 H new ATOM 0 HD3 ARG A 718 1.532 -13.868 -2.721 1.00 0.00 H new ATOM 0 HE ARG A 718 1.708 -16.102 -1.429 1.00 0.00 H new ATOM 0 HH11 ARG A 718 1.822 -15.819 -4.950 1.00 0.00 H new ATOM 0 HH12 ARG A 718 2.800 -17.277 -5.149 1.00 0.00 H new ATOM 0 HH21 ARG A 718 2.952 -17.978 -1.698 1.00 0.00 H new ATOM 0 HH22 ARG A 718 3.436 -18.493 -3.317 1.00 0.00 H new ATOM 1420 N PRO A 719 -3.385 -14.931 -5.711 1.00 0.00 N ATOM 1421 CA PRO A 719 -3.999 -15.356 -6.972 1.00 0.00 C ATOM 1422 C PRO A 719 -4.102 -14.182 -7.943 1.00 0.00 C ATOM 1423 O PRO A 719 -3.690 -14.281 -9.098 1.00 0.00 O ATOM 1424 CB PRO A 719 -5.404 -15.800 -6.571 1.00 0.00 C ATOM 1425 CG PRO A 719 -5.314 -16.139 -5.137 1.00 0.00 C ATOM 1426 CD PRO A 719 -4.235 -15.269 -4.555 1.00 0.00 C ATOM 0 HA PRO A 719 -3.421 -16.137 -7.467 1.00 0.00 H new ATOM 0 HB2 PRO A 719 -6.131 -15.006 -6.742 1.00 0.00 H new ATOM 0 HB3 PRO A 719 -5.727 -16.660 -7.158 1.00 0.00 H new ATOM 0 HG2 PRO A 719 -6.266 -15.962 -4.637 1.00 0.00 H new ATOM 0 HG3 PRO A 719 -5.075 -17.194 -5.003 1.00 0.00 H new ATOM 0 HD2 PRO A 719 -4.651 -14.375 -4.091 1.00 0.00 H new ATOM 0 HD3 PRO A 719 -3.671 -15.795 -3.785 1.00 0.00 H new ATOM 1434 N LEU A 720 -4.654 -13.062 -7.453 1.00 0.00 N ATOM 1435 CA LEU A 720 -4.805 -11.852 -8.251 1.00 0.00 C ATOM 1436 C LEU A 720 -3.522 -11.375 -8.904 1.00 0.00 C ATOM 1437 O LEU A 720 -3.553 -10.812 -9.996 1.00 0.00 O ATOM 1438 CB LEU A 720 -5.276 -10.763 -7.370 1.00 0.00 C ATOM 1439 CG LEU A 720 -5.652 -9.541 -8.102 1.00 0.00 C ATOM 1440 CD1 LEU A 720 -6.630 -9.851 -9.175 1.00 0.00 C ATOM 1441 CD2 LEU A 720 -6.219 -8.609 -7.108 1.00 0.00 C ATOM 0 H LEU A 720 -5.004 -12.977 -6.499 1.00 0.00 H new ATOM 0 HA LEU A 720 -5.508 -12.099 -9.046 1.00 0.00 H new ATOM 0 HB2 LEU A 720 -6.135 -11.114 -6.798 1.00 0.00 H new ATOM 0 HB3 LEU A 720 -4.492 -10.521 -6.652 1.00 0.00 H new ATOM 0 HG LEU A 720 -4.787 -9.095 -8.593 1.00 0.00 H new ATOM 0 HD11 LEU A 720 -6.894 -8.934 -9.703 1.00 0.00 H new ATOM 0 HD12 LEU A 720 -6.189 -10.559 -9.876 1.00 0.00 H new ATOM 0 HD13 LEU A 720 -7.527 -10.287 -8.735 1.00 0.00 H new ATOM 0 HD21 LEU A 720 -6.514 -7.684 -7.603 1.00 0.00 H new ATOM 0 HD22 LEU A 720 -7.091 -9.064 -6.639 1.00 0.00 H new ATOM 0 HD23 LEU A 720 -5.471 -8.390 -6.346 1.00 0.00 H new ATOM 1453 N HIS A 721 -2.413 -11.572 -8.214 1.00 0.00 N ATOM 1454 CA HIS A 721 -1.121 -11.152 -8.675 1.00 0.00 C ATOM 1455 C HIS A 721 -0.998 -11.382 -10.161 1.00 0.00 C ATOM 1456 O HIS A 721 -0.412 -10.592 -10.890 1.00 0.00 O ATOM 1457 CB HIS A 721 -0.054 -11.931 -7.912 1.00 0.00 C ATOM 1458 CG HIS A 721 0.118 -11.447 -6.513 1.00 0.00 C ATOM 1459 ND1 HIS A 721 1.305 -11.510 -5.823 1.00 0.00 N ATOM 1460 CD2 HIS A 721 -0.778 -10.904 -5.663 1.00 0.00 C ATOM 1461 CE1 HIS A 721 1.123 -11.026 -4.607 1.00 0.00 C ATOM 1462 NE2 HIS A 721 -0.132 -10.653 -4.489 1.00 0.00 N ATOM 0 H HIS A 721 -2.394 -12.036 -7.306 1.00 0.00 H new ATOM 0 HA HIS A 721 -0.988 -10.086 -8.493 1.00 0.00 H new ATOM 0 HB2 HIS A 721 -0.322 -12.987 -7.897 1.00 0.00 H new ATOM 0 HB3 HIS A 721 0.896 -11.851 -8.440 1.00 0.00 H new ATOM 0 HD2 HIS A 721 -1.818 -10.704 -5.874 1.00 0.00 H new ATOM 0 HE1 HIS A 721 1.878 -10.950 -3.839 1.00 0.00 H new ATOM 0 HE2 HIS A 721 -0.553 -10.243 -3.656 1.00 0.00 H new ATOM 1471 N GLN A 722 -1.634 -12.445 -10.593 1.00 0.00 N ATOM 1472 CA GLN A 722 -1.628 -12.857 -11.973 1.00 0.00 C ATOM 1473 C GLN A 722 -2.915 -13.610 -12.296 1.00 0.00 C ATOM 1474 O GLN A 722 -3.189 -14.667 -11.726 1.00 0.00 O ATOM 1475 CB GLN A 722 -0.422 -13.721 -12.232 1.00 0.00 C ATOM 1476 CG GLN A 722 0.896 -13.048 -11.907 1.00 0.00 C ATOM 1477 CD GLN A 722 1.456 -13.466 -10.561 1.00 0.00 C ATOM 1478 OE1 GLN A 722 2.256 -12.595 -9.957 1.00 0.00 O flip ATOM 1479 NE2 GLN A 722 1.181 -14.563 -10.075 1.00 0.00 N flip ATOM 0 H GLN A 722 -2.178 -13.056 -9.984 1.00 0.00 H new ATOM 0 HA GLN A 722 -1.575 -11.980 -12.618 1.00 0.00 H new ATOM 0 HB2 GLN A 722 -0.508 -14.634 -11.643 1.00 0.00 H new ATOM 0 HB3 GLN A 722 -0.418 -14.018 -13.281 1.00 0.00 H new ATOM 0 HG2 GLN A 722 1.621 -13.285 -12.686 1.00 0.00 H new ATOM 0 HG3 GLN A 722 0.758 -11.967 -11.918 1.00 0.00 H new ATOM 0 HE21 GLN A 722 0.561 -15.201 -10.574 1.00 0.00 H new ATOM 0 HE22 GLN A 722 1.573 -14.834 -9.173 1.00 0.00 H new ATOM 1488 N LEU A 723 -3.693 -13.060 -13.217 1.00 0.00 N ATOM 1489 CA LEU A 723 -4.972 -13.646 -13.599 1.00 0.00 C ATOM 1490 C LEU A 723 -5.044 -13.878 -15.083 1.00 0.00 C ATOM 1491 O LEU A 723 -5.578 -14.882 -15.554 1.00 0.00 O ATOM 1492 CB LEU A 723 -6.103 -12.698 -13.226 1.00 0.00 C ATOM 1493 CG LEU A 723 -6.165 -12.282 -11.795 1.00 0.00 C ATOM 1494 CD1 LEU A 723 -7.464 -11.592 -11.581 1.00 0.00 C ATOM 1495 CD2 LEU A 723 -6.054 -13.437 -10.845 1.00 0.00 C ATOM 0 H LEU A 723 -3.459 -12.202 -13.717 1.00 0.00 H new ATOM 0 HA LEU A 723 -5.066 -14.597 -13.075 1.00 0.00 H new ATOM 0 HB2 LEU A 723 -6.016 -11.802 -13.840 1.00 0.00 H new ATOM 0 HB3 LEU A 723 -7.049 -13.173 -13.487 1.00 0.00 H new ATOM 0 HG LEU A 723 -5.317 -11.628 -11.592 1.00 0.00 H new ATOM 0 HD11 LEU A 723 -7.540 -11.274 -10.541 1.00 0.00 H new ATOM 0 HD12 LEU A 723 -7.524 -10.720 -12.232 1.00 0.00 H new ATOM 0 HD13 LEU A 723 -8.281 -12.275 -11.813 1.00 0.00 H new ATOM 0 HD21 LEU A 723 -6.106 -13.071 -9.820 1.00 0.00 H new ATOM 0 HD22 LEU A 723 -6.873 -14.134 -11.023 1.00 0.00 H new ATOM 0 HD23 LEU A 723 -5.103 -13.946 -11.001 1.00 0.00 H new ATOM 1507 N ALA A 724 -4.494 -12.934 -15.807 1.00 0.00 N ATOM 1508 CA ALA A 724 -4.526 -12.978 -17.243 1.00 0.00 C ATOM 1509 C ALA A 724 -3.410 -13.849 -17.802 1.00 0.00 C ATOM 1510 O ALA A 724 -2.832 -14.677 -17.097 1.00 0.00 O ATOM 1511 CB ALA A 724 -4.432 -11.573 -17.786 1.00 0.00 C ATOM 0 H ALA A 724 -4.016 -12.121 -15.419 1.00 0.00 H new ATOM 0 HA ALA A 724 -5.469 -13.427 -17.557 1.00 0.00 H new ATOM 0 HB1 ALA A 724 -4.456 -11.602 -18.875 1.00 0.00 H new ATOM 0 HB2 ALA A 724 -5.273 -10.984 -17.420 1.00 0.00 H new ATOM 0 HB3 ALA A 724 -3.499 -11.117 -17.455 1.00 0.00 H new ATOM 1517 N THR A 725 -3.121 -13.649 -19.075 1.00 0.00 N ATOM 1518 CA THR A 725 -2.064 -14.367 -19.764 1.00 0.00 C ATOM 1519 C THR A 725 -1.247 -13.330 -20.486 1.00 0.00 C ATOM 1520 O THR A 725 -0.522 -13.606 -21.443 1.00 0.00 O ATOM 1521 CB THR A 725 -2.617 -15.394 -20.766 1.00 0.00 C ATOM 1522 OG1 THR A 725 -3.150 -14.733 -21.919 1.00 0.00 O ATOM 1523 CG2 THR A 725 -3.689 -16.233 -20.112 1.00 0.00 C ATOM 0 H THR A 725 -3.616 -12.979 -19.664 1.00 0.00 H new ATOM 0 HA THR A 725 -1.469 -14.931 -19.046 1.00 0.00 H new ATOM 0 HB THR A 725 -1.800 -16.043 -21.082 1.00 0.00 H new ATOM 0 HG1 THR A 725 -3.496 -15.400 -22.548 1.00 0.00 H new ATOM 0 HG21 THR A 725 -4.074 -16.957 -20.831 1.00 0.00 H new ATOM 0 HG22 THR A 725 -3.267 -16.760 -19.256 1.00 0.00 H new ATOM 0 HG23 THR A 725 -4.501 -15.588 -19.776 1.00 0.00 H new ATOM 1675 N THR A 737 -8.141 -10.445 -19.317 1.00 0.00 N ATOM 1676 CA THR A 737 -8.276 -10.377 -17.903 1.00 0.00 C ATOM 1677 C THR A 737 -7.240 -9.465 -17.329 1.00 0.00 C ATOM 1678 O THR A 737 -6.178 -9.240 -17.904 1.00 0.00 O ATOM 1679 CB THR A 737 -8.114 -11.760 -17.295 1.00 0.00 C ATOM 1680 OG1 THR A 737 -9.271 -12.567 -17.537 1.00 0.00 O ATOM 1681 CG2 THR A 737 -7.833 -11.663 -15.828 1.00 0.00 C ATOM 0 HA THR A 737 -9.268 -9.991 -17.670 1.00 0.00 H new ATOM 0 HB THR A 737 -7.263 -12.241 -17.776 1.00 0.00 H new ATOM 0 HG1 THR A 737 -9.142 -13.452 -17.138 1.00 0.00 H new ATOM 0 HG21 THR A 737 -7.720 -12.664 -15.412 1.00 0.00 H new ATOM 0 HG22 THR A 737 -6.914 -11.099 -15.670 1.00 0.00 H new ATOM 0 HG23 THR A 737 -8.660 -11.155 -15.332 1.00 0.00 H new ATOM 1689 N LEU A 738 -7.594 -8.915 -16.208 1.00 0.00 N ATOM 1690 CA LEU A 738 -6.740 -8.059 -15.486 1.00 0.00 C ATOM 1691 C LEU A 738 -6.209 -8.740 -14.281 1.00 0.00 C ATOM 1692 O LEU A 738 -6.838 -9.630 -13.711 1.00 0.00 O ATOM 1693 CB LEU A 738 -7.480 -6.852 -15.070 1.00 0.00 C ATOM 1694 CG LEU A 738 -7.194 -5.701 -15.961 1.00 0.00 C ATOM 1695 CD1 LEU A 738 -8.393 -4.850 -16.008 1.00 0.00 C ATOM 1696 CD2 LEU A 738 -6.037 -4.982 -15.390 1.00 0.00 C ATOM 0 H LEU A 738 -8.505 -9.059 -15.772 1.00 0.00 H new ATOM 0 HA LEU A 738 -5.907 -7.782 -16.133 1.00 0.00 H new ATOM 0 HB2 LEU A 738 -8.550 -7.060 -15.076 1.00 0.00 H new ATOM 0 HB3 LEU A 738 -7.211 -6.595 -14.045 1.00 0.00 H new ATOM 0 HG LEU A 738 -6.955 -6.009 -16.979 1.00 0.00 H new ATOM 0 HD11 LEU A 738 -8.207 -3.995 -16.658 1.00 0.00 H new ATOM 0 HD12 LEU A 738 -9.233 -5.426 -16.397 1.00 0.00 H new ATOM 0 HD13 LEU A 738 -8.629 -4.498 -15.004 1.00 0.00 H new ATOM 0 HD21 LEU A 738 -5.794 -4.125 -16.019 1.00 0.00 H new ATOM 0 HD22 LEU A 738 -6.283 -4.637 -14.386 1.00 0.00 H new ATOM 0 HD23 LEU A 738 -5.179 -5.652 -15.343 1.00 0.00 H new ATOM 1708 N ASP A 739 -5.052 -8.313 -13.899 1.00 0.00 N ATOM 1709 CA ASP A 739 -4.439 -8.835 -12.730 1.00 0.00 C ATOM 1710 C ASP A 739 -3.568 -7.752 -12.150 1.00 0.00 C ATOM 1711 O ASP A 739 -3.585 -6.617 -12.623 1.00 0.00 O ATOM 1712 CB ASP A 739 -3.680 -10.135 -12.975 1.00 0.00 C ATOM 1713 CG ASP A 739 -2.523 -9.980 -13.943 1.00 0.00 C ATOM 1714 OD1 ASP A 739 -1.425 -9.590 -13.495 1.00 0.00 O ATOM 1715 OD2 ASP A 739 -2.717 -10.247 -15.147 1.00 0.00 O ATOM 0 H ASP A 739 -4.511 -7.598 -14.385 1.00 0.00 H new ATOM 0 HA ASP A 739 -5.210 -9.116 -12.013 1.00 0.00 H new ATOM 0 HB2 ASP A 739 -3.302 -10.512 -12.025 1.00 0.00 H new ATOM 0 HB3 ASP A 739 -4.371 -10.884 -13.362 1.00 0.00 H new ATOM 1720 N LEU A 740 -2.830 -8.075 -11.131 1.00 0.00 N ATOM 1721 CA LEU A 740 -2.029 -7.101 -10.461 1.00 0.00 C ATOM 1722 C LEU A 740 -0.869 -6.705 -11.274 1.00 0.00 C ATOM 1723 O LEU A 740 -0.808 -5.608 -11.755 1.00 0.00 O ATOM 1724 CB LEU A 740 -1.567 -7.705 -9.192 1.00 0.00 C ATOM 1725 CG LEU A 740 -2.632 -7.685 -8.166 1.00 0.00 C ATOM 1726 CD1 LEU A 740 -2.297 -8.546 -7.032 1.00 0.00 C ATOM 1727 CD2 LEU A 740 -2.788 -6.293 -7.666 1.00 0.00 C ATOM 0 H LEU A 740 -2.767 -9.017 -10.744 1.00 0.00 H new ATOM 0 HA LEU A 740 -2.620 -6.203 -10.281 1.00 0.00 H new ATOM 0 HB2 LEU A 740 -1.251 -8.733 -9.370 1.00 0.00 H new ATOM 0 HB3 LEU A 740 -0.696 -7.162 -8.825 1.00 0.00 H new ATOM 0 HG LEU A 740 -3.553 -8.049 -8.622 1.00 0.00 H new ATOM 0 HD11 LEU A 740 -3.101 -8.508 -6.297 1.00 0.00 H new ATOM 0 HD12 LEU A 740 -2.170 -9.572 -7.379 1.00 0.00 H new ATOM 0 HD13 LEU A 740 -1.370 -8.201 -6.574 1.00 0.00 H new ATOM 0 HD21 LEU A 740 -3.571 -6.264 -6.908 1.00 0.00 H new ATOM 0 HD22 LEU A 740 -1.848 -5.956 -7.229 1.00 0.00 H new ATOM 0 HD23 LEU A 740 -3.060 -5.637 -8.493 1.00 0.00 H new ATOM 1739 N THR A 741 0.027 -7.632 -11.449 1.00 0.00 N ATOM 1740 CA THR A 741 1.225 -7.380 -12.217 1.00 0.00 C ATOM 1741 C THR A 741 0.853 -6.685 -13.514 1.00 0.00 C ATOM 1742 O THR A 741 1.647 -5.961 -14.109 1.00 0.00 O ATOM 1743 CB THR A 741 1.971 -8.680 -12.508 1.00 0.00 C ATOM 1744 OG1 THR A 741 1.331 -9.417 -13.556 1.00 0.00 O ATOM 1745 CG2 THR A 741 2.011 -9.490 -11.257 1.00 0.00 C ATOM 0 H THR A 741 -0.044 -8.576 -11.071 1.00 0.00 H new ATOM 0 HA THR A 741 1.887 -6.738 -11.636 1.00 0.00 H new ATOM 0 HB THR A 741 2.983 -8.450 -12.840 1.00 0.00 H new ATOM 0 HG1 THR A 741 0.362 -9.418 -13.411 1.00 0.00 H new ATOM 0 HG21 THR A 741 2.541 -10.424 -11.445 1.00 0.00 H new ATOM 0 HG22 THR A 741 2.528 -8.930 -10.477 1.00 0.00 H new ATOM 0 HG23 THR A 741 0.994 -9.709 -10.933 1.00 0.00 H new ATOM 1753 N LEU A 742 -0.382 -6.933 -13.930 1.00 0.00 N ATOM 1754 CA LEU A 742 -0.953 -6.329 -15.112 1.00 0.00 C ATOM 1755 C LEU A 742 -1.075 -4.829 -14.910 1.00 0.00 C ATOM 1756 O LEU A 742 -0.351 -4.018 -15.486 1.00 0.00 O ATOM 1757 CB LEU A 742 -2.327 -6.907 -15.314 1.00 0.00 C ATOM 1758 CG LEU A 742 -3.016 -6.629 -16.646 1.00 0.00 C ATOM 1759 CD1 LEU A 742 -2.050 -6.061 -17.653 1.00 0.00 C ATOM 1760 CD2 LEU A 742 -3.640 -7.903 -17.158 1.00 0.00 C ATOM 0 H LEU A 742 -1.017 -7.567 -13.446 1.00 0.00 H new ATOM 0 HA LEU A 742 -0.319 -6.526 -15.977 1.00 0.00 H new ATOM 0 HB2 LEU A 742 -2.260 -7.988 -15.189 1.00 0.00 H new ATOM 0 HB3 LEU A 742 -2.970 -6.533 -14.517 1.00 0.00 H new ATOM 0 HG LEU A 742 -3.796 -5.883 -16.492 1.00 0.00 H new ATOM 0 HD11 LEU A 742 -2.571 -5.874 -18.592 1.00 0.00 H new ATOM 0 HD12 LEU A 742 -1.637 -5.126 -17.274 1.00 0.00 H new ATOM 0 HD13 LEU A 742 -1.241 -6.772 -17.823 1.00 0.00 H new ATOM 0 HD21 LEU A 742 -4.134 -7.709 -18.110 1.00 0.00 H new ATOM 0 HD22 LEU A 742 -2.865 -8.657 -17.298 1.00 0.00 H new ATOM 0 HD23 LEU A 742 -4.372 -8.265 -16.436 1.00 0.00 H new ATOM 1772 N ILE A 743 -2.008 -4.506 -14.050 1.00 0.00 N ATOM 1773 CA ILE A 743 -2.306 -3.159 -13.654 1.00 0.00 C ATOM 1774 C ILE A 743 -1.059 -2.428 -13.166 1.00 0.00 C ATOM 1775 O ILE A 743 -0.832 -1.250 -13.436 1.00 0.00 O ATOM 1776 CB ILE A 743 -3.281 -3.278 -12.516 1.00 0.00 C ATOM 1777 CG1 ILE A 743 -4.688 -3.059 -12.978 1.00 0.00 C ATOM 1778 CG2 ILE A 743 -2.973 -2.317 -11.450 1.00 0.00 C ATOM 1779 CD1 ILE A 743 -5.658 -3.550 -11.976 1.00 0.00 C ATOM 0 H ILE A 743 -2.599 -5.200 -13.593 1.00 0.00 H new ATOM 0 HA ILE A 743 -2.702 -2.592 -14.497 1.00 0.00 H new ATOM 0 HB ILE A 743 -3.187 -4.291 -12.125 1.00 0.00 H new ATOM 0 HG12 ILE A 743 -4.854 -1.997 -13.160 1.00 0.00 H new ATOM 0 HG13 ILE A 743 -4.847 -3.573 -13.926 1.00 0.00 H new ATOM 0 HG21 ILE A 743 -3.695 -2.427 -10.641 1.00 0.00 H new ATOM 0 HG22 ILE A 743 -1.969 -2.506 -11.069 1.00 0.00 H new ATOM 0 HG23 ILE A 743 -3.025 -1.303 -11.848 1.00 0.00 H new ATOM 0 HD11 ILE A 743 -6.672 -3.379 -12.337 1.00 0.00 H new ATOM 0 HD12 ILE A 743 -5.506 -4.617 -11.815 1.00 0.00 H new ATOM 0 HD13 ILE A 743 -5.512 -3.017 -11.037 1.00 0.00 H new ATOM 1791 N ARG A 744 -0.284 -3.191 -12.437 1.00 0.00 N ATOM 1792 CA ARG A 744 0.944 -2.772 -11.809 1.00 0.00 C ATOM 1793 C ARG A 744 1.946 -2.417 -12.844 1.00 0.00 C ATOM 1794 O ARG A 744 2.804 -1.562 -12.655 1.00 0.00 O ATOM 1795 CB ARG A 744 1.451 -3.909 -10.942 1.00 0.00 C ATOM 1796 CG ARG A 744 2.949 -4.089 -10.989 1.00 0.00 C ATOM 1797 CD ARG A 744 3.404 -5.002 -9.884 1.00 0.00 C ATOM 1798 NE ARG A 744 4.260 -6.079 -10.377 1.00 0.00 N ATOM 1799 CZ ARG A 744 5.140 -6.728 -9.624 1.00 0.00 C ATOM 1800 NH1 ARG A 744 5.280 -6.414 -8.344 1.00 0.00 N ATOM 1801 NH2 ARG A 744 5.880 -7.694 -10.149 1.00 0.00 N ATOM 0 H ARG A 744 -0.504 -4.171 -12.256 1.00 0.00 H new ATOM 0 HA ARG A 744 0.771 -1.891 -11.191 1.00 0.00 H new ATOM 0 HB2 ARG A 744 1.148 -3.730 -9.910 1.00 0.00 H new ATOM 0 HB3 ARG A 744 0.973 -4.836 -11.258 1.00 0.00 H new ATOM 0 HG2 ARG A 744 3.242 -4.502 -11.954 1.00 0.00 H new ATOM 0 HG3 ARG A 744 3.441 -3.121 -10.895 1.00 0.00 H new ATOM 0 HD2 ARG A 744 3.946 -4.423 -9.136 1.00 0.00 H new ATOM 0 HD3 ARG A 744 2.534 -5.430 -9.387 1.00 0.00 H new ATOM 0 HE ARG A 744 4.176 -6.348 -11.357 1.00 0.00 H new ATOM 0 HH11 ARG A 744 4.711 -5.672 -7.936 1.00 0.00 H new ATOM 0 HH12 ARG A 744 5.957 -6.914 -7.767 1.00 0.00 H new ATOM 0 HH21 ARG A 744 5.774 -7.940 -11.133 1.00 0.00 H new ATOM 0 HH22 ARG A 744 6.556 -8.191 -9.569 1.00 0.00 H new ATOM 1815 N ALA A 745 1.825 -3.116 -13.926 1.00 0.00 N ATOM 1816 CA ALA A 745 2.687 -2.894 -15.054 1.00 0.00 C ATOM 1817 C ALA A 745 2.451 -1.501 -15.579 1.00 0.00 C ATOM 1818 O ALA A 745 3.370 -0.808 -15.979 1.00 0.00 O ATOM 1819 CB ALA A 745 2.376 -3.862 -16.133 1.00 0.00 C ATOM 0 H ALA A 745 1.133 -3.853 -14.058 1.00 0.00 H new ATOM 0 HA ALA A 745 3.724 -3.019 -14.742 1.00 0.00 H new ATOM 0 HB1 ALA A 745 3.035 -3.684 -16.983 1.00 0.00 H new ATOM 0 HB2 ALA A 745 2.524 -4.877 -15.765 1.00 0.00 H new ATOM 0 HB3 ALA A 745 1.339 -3.737 -16.446 1.00 0.00 H new ATOM 1825 N ARG A 746 1.179 -1.119 -15.593 1.00 0.00 N ATOM 1826 CA ARG A 746 0.772 0.196 -16.057 1.00 0.00 C ATOM 1827 C ARG A 746 1.500 1.215 -15.200 1.00 0.00 C ATOM 1828 O ARG A 746 2.146 2.145 -15.684 1.00 0.00 O ATOM 1829 CB ARG A 746 -0.757 0.337 -15.924 1.00 0.00 C ATOM 1830 CG ARG A 746 -1.437 1.033 -17.081 1.00 0.00 C ATOM 1831 CD ARG A 746 -2.716 0.317 -17.470 1.00 0.00 C ATOM 1832 NE ARG A 746 -3.450 1.029 -18.511 1.00 0.00 N ATOM 1833 CZ ARG A 746 -4.582 0.586 -19.052 1.00 0.00 C ATOM 1834 NH1 ARG A 746 -5.102 -0.568 -18.657 1.00 0.00 N ATOM 1835 NH2 ARG A 746 -5.192 1.298 -19.989 1.00 0.00 N ATOM 0 H ARG A 746 0.407 -1.710 -15.284 1.00 0.00 H new ATOM 0 HA ARG A 746 1.023 0.350 -17.106 1.00 0.00 H new ATOM 0 HB2 ARG A 746 -1.190 -0.657 -15.812 1.00 0.00 H new ATOM 0 HB3 ARG A 746 -0.978 0.886 -15.009 1.00 0.00 H new ATOM 0 HG2 ARG A 746 -1.662 2.064 -16.808 1.00 0.00 H new ATOM 0 HG3 ARG A 746 -0.762 1.069 -17.936 1.00 0.00 H new ATOM 0 HD2 ARG A 746 -2.477 -0.688 -17.819 1.00 0.00 H new ATOM 0 HD3 ARG A 746 -3.351 0.207 -16.591 1.00 0.00 H new ATOM 0 HE ARG A 746 -3.074 1.917 -18.843 1.00 0.00 H new ATOM 0 HH11 ARG A 746 -4.634 -1.118 -17.937 1.00 0.00 H new ATOM 0 HH12 ARG A 746 -5.970 -0.905 -19.073 1.00 0.00 H new ATOM 0 HH21 ARG A 746 -4.794 2.186 -20.295 1.00 0.00 H new ATOM 0 HH22 ARG A 746 -6.060 0.958 -20.404 1.00 0.00 H new ATOM 1849 N LEU A 747 1.360 0.994 -13.907 1.00 0.00 N ATOM 1850 CA LEU A 747 2.000 1.763 -12.863 1.00 0.00 C ATOM 1851 C LEU A 747 3.473 1.773 -13.063 1.00 0.00 C ATOM 1852 O LEU A 747 4.169 2.769 -12.867 1.00 0.00 O ATOM 1853 CB LEU A 747 1.682 1.037 -11.607 1.00 0.00 C ATOM 1854 CG LEU A 747 0.629 1.634 -10.785 1.00 0.00 C ATOM 1855 CD1 LEU A 747 0.666 1.146 -9.414 1.00 0.00 C ATOM 1856 CD2 LEU A 747 0.636 3.114 -10.761 1.00 0.00 C ATOM 0 H LEU A 747 0.773 0.243 -13.543 1.00 0.00 H new ATOM 0 HA LEU A 747 1.659 2.798 -12.852 1.00 0.00 H new ATOM 0 HB2 LEU A 747 1.388 0.019 -11.861 1.00 0.00 H new ATOM 0 HB3 LEU A 747 2.590 0.966 -11.008 1.00 0.00 H new ATOM 0 HG LEU A 747 -0.293 1.318 -11.272 1.00 0.00 H new ATOM 0 HD11 LEU A 747 -0.133 1.615 -8.839 1.00 0.00 H new ATOM 0 HD12 LEU A 747 0.530 0.065 -9.409 1.00 0.00 H new ATOM 0 HD13 LEU A 747 1.629 1.393 -8.966 1.00 0.00 H new ATOM 0 HD21 LEU A 747 -0.177 3.471 -10.129 1.00 0.00 H new ATOM 0 HD22 LEU A 747 1.587 3.467 -10.363 1.00 0.00 H new ATOM 0 HD23 LEU A 747 0.502 3.495 -11.773 1.00 0.00 H new ATOM 1868 N GLN A 748 3.918 0.613 -13.465 1.00 0.00 N ATOM 1869 CA GLN A 748 5.308 0.368 -13.689 1.00 0.00 C ATOM 1870 C GLN A 748 5.772 0.888 -15.036 1.00 0.00 C ATOM 1871 O GLN A 748 6.966 1.086 -15.260 1.00 0.00 O ATOM 1872 CB GLN A 748 5.567 -1.130 -13.638 1.00 0.00 C ATOM 1873 CG GLN A 748 5.894 -1.630 -12.257 1.00 0.00 C ATOM 1874 CD GLN A 748 7.130 -2.509 -12.228 1.00 0.00 C ATOM 1875 OE1 GLN A 748 8.065 -2.310 -13.004 1.00 0.00 O ATOM 1876 NE2 GLN A 748 7.136 -3.493 -11.335 1.00 0.00 N ATOM 0 H GLN A 748 3.318 -0.191 -13.646 1.00 0.00 H new ATOM 0 HA GLN A 748 5.862 0.893 -12.911 1.00 0.00 H new ATOM 0 HB2 GLN A 748 4.688 -1.657 -14.009 1.00 0.00 H new ATOM 0 HB3 GLN A 748 6.391 -1.373 -14.309 1.00 0.00 H new ATOM 0 HG2 GLN A 748 6.044 -0.779 -11.593 1.00 0.00 H new ATOM 0 HG3 GLN A 748 5.045 -2.192 -11.868 1.00 0.00 H new ATOM 0 HE21 GLN A 748 6.339 -3.621 -10.712 1.00 0.00 H new ATOM 0 HE22 GLN A 748 7.938 -4.121 -11.273 1.00 0.00 H new ATOM 1885 N GLU A 749 4.810 1.088 -15.925 1.00 0.00 N ATOM 1886 CA GLU A 749 5.088 1.502 -17.289 1.00 0.00 C ATOM 1887 C GLU A 749 5.654 0.294 -17.993 1.00 0.00 C ATOM 1888 O GLU A 749 6.106 0.349 -19.137 1.00 0.00 O ATOM 1889 CB GLU A 749 6.049 2.696 -17.357 1.00 0.00 C ATOM 1890 CG GLU A 749 6.167 3.309 -18.744 1.00 0.00 C ATOM 1891 CD GLU A 749 7.260 4.355 -18.829 1.00 0.00 C ATOM 1892 OE1 GLU A 749 8.414 3.985 -19.138 1.00 0.00 O ATOM 1893 OE2 GLU A 749 6.965 5.544 -18.586 1.00 0.00 O ATOM 0 H GLU A 749 3.818 0.968 -15.720 1.00 0.00 H new ATOM 0 HA GLU A 749 4.174 1.849 -17.772 1.00 0.00 H new ATOM 0 HB2 GLU A 749 5.712 3.462 -16.659 1.00 0.00 H new ATOM 0 HB3 GLU A 749 7.037 2.375 -17.026 1.00 0.00 H new ATOM 0 HG2 GLU A 749 6.367 2.521 -19.470 1.00 0.00 H new ATOM 0 HG3 GLU A 749 5.214 3.761 -19.019 1.00 0.00 H new ATOM 1900 N LYS A 750 5.602 -0.809 -17.259 1.00 0.00 N ATOM 1901 CA LYS A 750 6.022 -2.072 -17.698 1.00 0.00 C ATOM 1902 C LYS A 750 5.126 -2.488 -18.806 1.00 0.00 C ATOM 1903 O LYS A 750 5.528 -3.027 -19.838 1.00 0.00 O ATOM 1904 CB LYS A 750 5.817 -2.999 -16.532 1.00 0.00 C ATOM 1905 CG LYS A 750 6.546 -4.255 -16.722 1.00 0.00 C ATOM 1906 CD LYS A 750 6.530 -5.122 -15.476 1.00 0.00 C ATOM 1907 CE LYS A 750 5.156 -5.718 -15.225 1.00 0.00 C ATOM 1908 NZ LYS A 750 4.740 -6.638 -16.321 1.00 0.00 N ATOM 0 H LYS A 750 5.245 -0.816 -16.303 1.00 0.00 H new ATOM 0 HA LYS A 750 7.057 -2.076 -18.039 1.00 0.00 H new ATOM 0 HB2 LYS A 750 6.153 -2.515 -15.615 1.00 0.00 H new ATOM 0 HB3 LYS A 750 4.754 -3.207 -16.411 1.00 0.00 H new ATOM 0 HG2 LYS A 750 6.105 -4.807 -17.552 1.00 0.00 H new ATOM 0 HG3 LYS A 750 7.578 -4.036 -16.997 1.00 0.00 H new ATOM 0 HD2 LYS A 750 7.261 -5.924 -15.581 1.00 0.00 H new ATOM 0 HD3 LYS A 750 6.832 -4.527 -14.614 1.00 0.00 H new ATOM 0 HE2 LYS A 750 5.163 -6.260 -14.279 1.00 0.00 H new ATOM 0 HE3 LYS A 750 4.425 -4.916 -15.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 750 3.966 -7.248 -15.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 750 4.415 -6.081 -17.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 750 5.548 -7.228 -16.604 1.00 0.00 H new ATOM 1922 N LEU A 751 3.885 -2.212 -18.529 1.00 0.00 N ATOM 1923 CA LEU A 751 2.800 -2.507 -19.413 1.00 0.00 C ATOM 1924 C LEU A 751 2.950 -1.854 -20.776 1.00 0.00 C ATOM 1925 O LEU A 751 3.658 -2.370 -21.641 1.00 0.00 O ATOM 1926 CB LEU A 751 1.555 -2.074 -18.709 1.00 0.00 C ATOM 1927 CG LEU A 751 0.403 -3.024 -18.744 1.00 0.00 C ATOM 1928 CD1 LEU A 751 -0.617 -2.401 -17.881 1.00 0.00 C ATOM 1929 CD2 LEU A 751 -0.073 -3.237 -20.163 1.00 0.00 C ATOM 0 H LEU A 751 3.594 -1.764 -17.660 1.00 0.00 H new ATOM 0 HA LEU A 751 2.772 -3.574 -19.634 1.00 0.00 H new ATOM 0 HB2 LEU A 751 1.804 -1.878 -17.666 1.00 0.00 H new ATOM 0 HB3 LEU A 751 1.230 -1.128 -19.142 1.00 0.00 H new ATOM 0 HG LEU A 751 0.659 -4.021 -18.386 1.00 0.00 H new ATOM 0 HD11 LEU A 751 -1.503 -3.035 -17.849 1.00 0.00 H new ATOM 0 HD12 LEU A 751 -0.218 -2.283 -16.873 1.00 0.00 H new ATOM 0 HD13 LEU A 751 -0.885 -1.423 -18.282 1.00 0.00 H new ATOM 0 HD21 LEU A 751 -0.912 -3.932 -20.165 1.00 0.00 H new ATOM 0 HD22 LEU A 751 -0.390 -2.284 -20.587 1.00 0.00 H new ATOM 0 HD23 LEU A 751 0.740 -3.648 -20.762 1.00 0.00 H new ATOM 1941 N SER A 752 2.308 -0.715 -20.958 1.00 0.00 N ATOM 1942 CA SER A 752 2.351 -0.030 -22.275 1.00 0.00 C ATOM 1943 C SER A 752 1.708 1.337 -22.318 1.00 0.00 C ATOM 1944 O SER A 752 2.303 2.305 -22.792 1.00 0.00 O ATOM 1945 CB SER A 752 1.577 -0.818 -23.316 1.00 0.00 C ATOM 1946 OG SER A 752 1.743 -2.218 -23.179 1.00 0.00 O ATOM 0 H SER A 752 1.759 -0.239 -20.242 1.00 0.00 H new ATOM 0 HA SER A 752 3.421 0.054 -22.466 1.00 0.00 H new ATOM 0 HB2 SER A 752 0.518 -0.573 -23.237 1.00 0.00 H new ATOM 0 HB3 SER A 752 1.902 -0.514 -24.311 1.00 0.00 H new ATOM 0 HG SER A 752 2.697 -2.428 -23.094 1.00 0.00 H new ATOM 1952 N PRO A 753 0.474 1.424 -21.826 1.00 0.00 N ATOM 1953 CA PRO A 753 -0.361 2.633 -21.918 1.00 0.00 C ATOM 1954 C PRO A 753 -0.466 3.582 -20.690 1.00 0.00 C ATOM 1955 O PRO A 753 -1.422 4.352 -20.616 1.00 0.00 O ATOM 1956 CB PRO A 753 -1.672 1.918 -22.029 1.00 0.00 C ATOM 1957 CG PRO A 753 -1.541 1.013 -20.866 1.00 0.00 C ATOM 1958 CD PRO A 753 -0.260 0.340 -21.134 1.00 0.00 C ATOM 0 HA PRO A 753 0.010 3.312 -22.685 1.00 0.00 H new ATOM 0 HB2 PRO A 753 -2.526 2.590 -21.946 1.00 0.00 H new ATOM 0 HB3 PRO A 753 -1.780 1.380 -22.971 1.00 0.00 H new ATOM 0 HG2 PRO A 753 -1.523 1.561 -19.924 1.00 0.00 H new ATOM 0 HG3 PRO A 753 -2.368 0.305 -20.807 1.00 0.00 H new ATOM 0 HD2 PRO A 753 0.239 0.019 -20.220 1.00 0.00 H new ATOM 0 HD3 PRO A 753 -0.379 -0.545 -21.759 1.00 0.00 H new ATOM 1966 N PRO A 754 0.471 3.546 -19.735 1.00 0.00 N ATOM 1967 CA PRO A 754 0.481 4.333 -18.520 1.00 0.00 C ATOM 1968 C PRO A 754 -0.461 5.505 -18.411 1.00 0.00 C ATOM 1969 O PRO A 754 -0.602 6.362 -19.283 1.00 0.00 O ATOM 1970 CB PRO A 754 1.915 4.812 -18.454 1.00 0.00 C ATOM 1971 CG PRO A 754 2.685 3.769 -19.229 1.00 0.00 C ATOM 1972 CD PRO A 754 1.664 2.755 -19.717 1.00 0.00 C ATOM 0 HA PRO A 754 0.123 3.710 -17.701 1.00 0.00 H new ATOM 0 HB2 PRO A 754 2.026 5.801 -18.898 1.00 0.00 H new ATOM 0 HB3 PRO A 754 2.265 4.883 -17.424 1.00 0.00 H new ATOM 0 HG2 PRO A 754 3.215 4.221 -20.068 1.00 0.00 H new ATOM 0 HG3 PRO A 754 3.435 3.292 -18.598 1.00 0.00 H new ATOM 0 HD2 PRO A 754 1.913 2.363 -20.703 1.00 0.00 H new ATOM 0 HD3 PRO A 754 1.580 1.900 -19.046 1.00 0.00 H new ATOM 1980 N TYR A 755 -1.069 5.467 -17.264 1.00 0.00 N ATOM 1981 CA TYR A 755 -1.973 6.444 -16.731 1.00 0.00 C ATOM 1982 C TYR A 755 -1.148 7.363 -15.878 1.00 0.00 C ATOM 1983 O TYR A 755 -0.157 7.935 -16.316 1.00 0.00 O ATOM 1984 CB TYR A 755 -2.893 5.672 -15.833 1.00 0.00 C ATOM 1985 CG TYR A 755 -2.150 4.655 -14.987 1.00 0.00 C ATOM 1986 CD1 TYR A 755 -0.795 4.724 -14.672 1.00 0.00 C ATOM 1987 CD2 TYR A 755 -2.812 3.582 -14.580 1.00 0.00 C ATOM 1988 CE1 TYR A 755 -0.213 3.717 -13.962 1.00 0.00 C ATOM 1989 CE2 TYR A 755 -2.252 2.598 -13.911 1.00 0.00 C ATOM 1990 CZ TYR A 755 -0.992 2.647 -13.597 1.00 0.00 C ATOM 1991 OH TYR A 755 -0.516 1.583 -12.951 1.00 0.00 O ATOM 0 H TYR A 755 -0.934 4.686 -16.622 1.00 0.00 H new ATOM 0 HA TYR A 755 -2.516 7.003 -17.493 1.00 0.00 H new ATOM 0 HB2 TYR A 755 -3.426 6.364 -15.181 1.00 0.00 H new ATOM 0 HB3 TYR A 755 -3.643 5.161 -16.437 1.00 0.00 H new ATOM 0 HD1 TYR A 755 -0.208 5.573 -14.989 1.00 0.00 H new ATOM 0 HD2 TYR A 755 -3.865 3.512 -14.809 1.00 0.00 H new ATOM 0 HE1 TYR A 755 0.832 3.759 -13.694 1.00 0.00 H new ATOM 0 HE2 TYR A 755 -2.844 1.743 -13.620 1.00 0.00 H new ATOM 0 HH TYR A 755 -1.127 0.826 -13.072 1.00 0.00 H new ATOM 2001 N SER A 756 -1.512 7.379 -14.617 1.00 0.00 N ATOM 2002 CA SER A 756 -0.832 8.109 -13.637 1.00 0.00 C ATOM 2003 C SER A 756 -1.566 8.008 -12.327 1.00 0.00 C ATOM 2004 O SER A 756 -1.421 8.898 -11.503 1.00 0.00 O ATOM 2005 CB SER A 756 -0.693 9.543 -14.033 1.00 0.00 C ATOM 2006 OG SER A 756 -0.094 10.324 -13.014 1.00 0.00 O ATOM 0 H SER A 756 -2.315 6.862 -14.260 1.00 0.00 H new ATOM 0 HA SER A 756 0.168 7.688 -13.529 1.00 0.00 H new ATOM 0 HB2 SER A 756 -0.093 9.611 -14.941 1.00 0.00 H new ATOM 0 HB3 SER A 756 -1.676 9.950 -14.270 1.00 0.00 H new ATOM 0 HG SER A 756 -0.635 10.269 -12.199 1.00 0.00 H new ATOM 2012 N SER A 757 -2.438 6.985 -12.158 1.00 0.00 N ATOM 2013 CA SER A 757 -3.124 6.849 -10.882 1.00 0.00 C ATOM 2014 C SER A 757 -3.959 5.579 -10.775 1.00 0.00 C ATOM 2015 O SER A 757 -3.954 4.752 -11.687 1.00 0.00 O ATOM 2016 CB SER A 757 -3.969 8.075 -10.678 1.00 0.00 C ATOM 2017 OG SER A 757 -3.257 9.093 -10.025 1.00 0.00 O ATOM 0 H SER A 757 -2.666 6.281 -12.860 1.00 0.00 H new ATOM 0 HA SER A 757 -2.375 6.760 -10.095 1.00 0.00 H new ATOM 0 HB2 SER A 757 -4.321 8.439 -11.643 1.00 0.00 H new ATOM 0 HB3 SER A 757 -4.852 7.816 -10.093 1.00 0.00 H new ATOM 0 HG SER A 757 -2.454 9.313 -10.541 1.00 0.00 H new ATOM 2023 N PRO A 758 -4.695 5.400 -9.653 1.00 0.00 N ATOM 2024 CA PRO A 758 -5.495 4.220 -9.443 1.00 0.00 C ATOM 2025 C PRO A 758 -6.773 4.249 -10.228 1.00 0.00 C ATOM 2026 O PRO A 758 -7.033 3.359 -10.992 1.00 0.00 O ATOM 2027 CB PRO A 758 -5.803 4.249 -7.955 1.00 0.00 C ATOM 2028 CG PRO A 758 -5.803 5.680 -7.612 1.00 0.00 C ATOM 2029 CD PRO A 758 -4.822 6.332 -8.519 1.00 0.00 C ATOM 0 HA PRO A 758 -4.971 3.321 -9.768 1.00 0.00 H new ATOM 0 HB2 PRO A 758 -6.767 3.788 -7.739 1.00 0.00 H new ATOM 0 HB3 PRO A 758 -5.053 3.703 -7.383 1.00 0.00 H new ATOM 0 HG2 PRO A 758 -6.796 6.110 -7.742 1.00 0.00 H new ATOM 0 HG3 PRO A 758 -5.525 5.829 -6.569 1.00 0.00 H new ATOM 0 HD2 PRO A 758 -5.173 7.311 -8.846 1.00 0.00 H new ATOM 0 HD3 PRO A 758 -3.864 6.487 -8.023 1.00 0.00 H new ATOM 2037 N GLN A 759 -7.540 5.312 -10.120 1.00 0.00 N ATOM 2038 CA GLN A 759 -8.817 5.334 -10.805 1.00 0.00 C ATOM 2039 C GLN A 759 -8.692 4.599 -12.122 1.00 0.00 C ATOM 2040 O GLN A 759 -9.563 3.838 -12.509 1.00 0.00 O ATOM 2041 CB GLN A 759 -9.306 6.750 -10.997 1.00 0.00 C ATOM 2042 CG GLN A 759 -10.388 6.886 -12.051 1.00 0.00 C ATOM 2043 CD GLN A 759 -10.912 8.304 -12.178 1.00 0.00 C ATOM 2044 OE1 GLN A 759 -10.920 9.064 -11.212 1.00 0.00 O ATOM 2045 NE2 GLN A 759 -11.353 8.664 -13.378 1.00 0.00 N ATOM 0 H GLN A 759 -7.314 6.149 -9.583 1.00 0.00 H new ATOM 0 HA GLN A 759 -9.562 4.825 -10.194 1.00 0.00 H new ATOM 0 HB2 GLN A 759 -9.688 7.125 -10.047 1.00 0.00 H new ATOM 0 HB3 GLN A 759 -8.462 7.382 -11.273 1.00 0.00 H new ATOM 0 HG2 GLN A 759 -9.993 6.562 -13.014 1.00 0.00 H new ATOM 0 HG3 GLN A 759 -11.214 6.219 -11.805 1.00 0.00 H new ATOM 0 HE21 GLN A 759 -11.327 7.999 -14.151 1.00 0.00 H new ATOM 0 HE22 GLN A 759 -11.717 9.605 -13.526 1.00 0.00 H new ATOM 2054 N GLU A 760 -7.572 4.792 -12.783 1.00 0.00 N ATOM 2055 CA GLU A 760 -7.304 4.087 -13.989 1.00 0.00 C ATOM 2056 C GLU A 760 -7.196 2.595 -13.696 1.00 0.00 C ATOM 2057 O GLU A 760 -8.034 1.780 -14.095 1.00 0.00 O ATOM 2058 CB GLU A 760 -5.986 4.536 -14.546 1.00 0.00 C ATOM 2059 CG GLU A 760 -5.666 3.800 -15.797 1.00 0.00 C ATOM 2060 CD GLU A 760 -6.701 3.977 -16.892 1.00 0.00 C ATOM 2061 OE1 GLU A 760 -6.587 4.951 -17.665 1.00 0.00 O ATOM 2062 OE2 GLU A 760 -7.625 3.140 -16.976 1.00 0.00 O ATOM 0 H GLU A 760 -6.837 5.437 -12.493 1.00 0.00 H new ATOM 0 HA GLU A 760 -8.110 4.282 -14.697 1.00 0.00 H new ATOM 0 HB2 GLU A 760 -6.016 5.607 -14.746 1.00 0.00 H new ATOM 0 HB3 GLU A 760 -5.199 4.371 -13.810 1.00 0.00 H new ATOM 0 HG2 GLU A 760 -4.697 4.136 -16.168 1.00 0.00 H new ATOM 0 HG3 GLU A 760 -5.570 2.739 -15.569 1.00 0.00 H new ATOM 2069 N PHE A 761 -6.159 2.272 -12.940 1.00 0.00 N ATOM 2070 CA PHE A 761 -5.836 0.929 -12.591 1.00 0.00 C ATOM 2071 C PHE A 761 -6.724 0.388 -11.490 1.00 0.00 C ATOM 2072 O PHE A 761 -7.209 -0.703 -11.622 1.00 0.00 O ATOM 2073 CB PHE A 761 -4.354 0.906 -12.329 1.00 0.00 C ATOM 2074 CG PHE A 761 -3.875 0.833 -10.946 1.00 0.00 C ATOM 2075 CD1 PHE A 761 -4.343 -0.104 -10.118 1.00 0.00 C ATOM 2076 CD2 PHE A 761 -2.907 1.683 -10.505 1.00 0.00 C ATOM 2077 CE1 PHE A 761 -3.895 -0.230 -8.872 1.00 0.00 C ATOM 2078 CE2 PHE A 761 -2.443 1.566 -9.233 1.00 0.00 C ATOM 2079 CZ PHE A 761 -2.936 0.606 -8.412 1.00 0.00 C ATOM 0 H PHE A 761 -5.515 2.962 -12.552 1.00 0.00 H new ATOM 0 HA PHE A 761 -6.047 0.228 -13.398 1.00 0.00 H new ATOM 0 HB2 PHE A 761 -3.939 0.053 -12.866 1.00 0.00 H new ATOM 0 HB3 PHE A 761 -3.927 1.803 -12.777 1.00 0.00 H new ATOM 0 HD1 PHE A 761 -5.108 -0.780 -10.470 1.00 0.00 H new ATOM 0 HD2 PHE A 761 -2.511 2.444 -11.161 1.00 0.00 H new ATOM 0 HE1 PHE A 761 -4.296 -0.999 -8.228 1.00 0.00 H new ATOM 0 HE2 PHE A 761 -1.679 2.240 -8.875 1.00 0.00 H new ATOM 0 HZ PHE A 761 -2.567 0.510 -7.402 1.00 0.00 H new ATOM 2089 N ALA A 762 -6.890 1.125 -10.402 1.00 0.00 N ATOM 2090 CA ALA A 762 -7.790 0.747 -9.336 1.00 0.00 C ATOM 2091 C ALA A 762 -9.051 0.200 -9.937 1.00 0.00 C ATOM 2092 O ALA A 762 -9.576 -0.804 -9.478 1.00 0.00 O ATOM 2093 CB ALA A 762 -8.131 1.941 -8.506 1.00 0.00 C ATOM 0 H ALA A 762 -6.400 2.004 -10.238 1.00 0.00 H new ATOM 0 HA ALA A 762 -7.309 -0.003 -8.708 1.00 0.00 H new ATOM 0 HB1 ALA A 762 -8.810 1.646 -7.706 1.00 0.00 H new ATOM 0 HB2 ALA A 762 -7.220 2.357 -8.075 1.00 0.00 H new ATOM 0 HB3 ALA A 762 -8.613 2.693 -9.131 1.00 0.00 H new ATOM 2099 N GLN A 763 -9.570 0.897 -10.944 1.00 0.00 N ATOM 2100 CA GLN A 763 -10.731 0.438 -11.612 1.00 0.00 C ATOM 2101 C GLN A 763 -10.435 -0.856 -12.348 1.00 0.00 C ATOM 2102 O GLN A 763 -11.286 -1.737 -12.475 1.00 0.00 O ATOM 2103 CB GLN A 763 -11.189 1.498 -12.557 1.00 0.00 C ATOM 2104 CG GLN A 763 -11.853 2.642 -11.840 1.00 0.00 C ATOM 2105 CD GLN A 763 -12.632 3.553 -12.769 1.00 0.00 C ATOM 2106 OE1 GLN A 763 -12.182 3.656 -14.016 1.00 0.00 O flip ATOM 2107 NE2 GLN A 763 -13.628 4.158 -12.372 1.00 0.00 N flip ATOM 0 H GLN A 763 -9.189 1.775 -11.296 1.00 0.00 H new ATOM 0 HA GLN A 763 -11.522 0.235 -10.890 1.00 0.00 H new ATOM 0 HB2 GLN A 763 -10.336 1.871 -13.124 1.00 0.00 H new ATOM 0 HB3 GLN A 763 -11.886 1.067 -13.276 1.00 0.00 H new ATOM 0 HG2 GLN A 763 -12.527 2.245 -11.080 1.00 0.00 H new ATOM 0 HG3 GLN A 763 -11.094 3.226 -11.319 1.00 0.00 H new ATOM 0 HE21 GLN A 763 -13.939 4.050 -11.407 1.00 0.00 H new ATOM 0 HE22 GLN A 763 -14.142 4.767 -13.009 1.00 0.00 H new ATOM 2116 N ASP A 764 -9.205 -0.944 -12.830 1.00 0.00 N ATOM 2117 CA ASP A 764 -8.731 -2.121 -13.541 1.00 0.00 C ATOM 2118 C ASP A 764 -8.507 -3.260 -12.565 1.00 0.00 C ATOM 2119 O ASP A 764 -8.343 -4.407 -12.972 1.00 0.00 O ATOM 2120 CB ASP A 764 -7.443 -1.824 -14.306 1.00 0.00 C ATOM 2121 CG ASP A 764 -7.702 -1.237 -15.679 1.00 0.00 C ATOM 2122 OD1 ASP A 764 -8.473 -0.259 -15.772 1.00 0.00 O ATOM 2123 OD2 ASP A 764 -7.138 -1.759 -16.664 1.00 0.00 O ATOM 0 H ASP A 764 -8.509 -0.204 -12.740 1.00 0.00 H new ATOM 0 HA ASP A 764 -9.493 -2.410 -14.265 1.00 0.00 H new ATOM 0 HB2 ASP A 764 -6.833 -1.130 -13.728 1.00 0.00 H new ATOM 0 HB3 ASP A 764 -6.867 -2.743 -14.411 1.00 0.00 H new ATOM 2128 N VAL A 765 -8.428 -2.933 -11.276 1.00 0.00 N ATOM 2129 CA VAL A 765 -8.277 -3.920 -10.270 1.00 0.00 C ATOM 2130 C VAL A 765 -9.614 -4.271 -9.715 1.00 0.00 C ATOM 2131 O VAL A 765 -9.851 -5.380 -9.278 1.00 0.00 O ATOM 2132 CB VAL A 765 -7.295 -3.528 -9.212 1.00 0.00 C ATOM 2133 CG1 VAL A 765 -6.980 -2.111 -9.176 1.00 0.00 C ATOM 2134 CG2 VAL A 765 -7.678 -4.002 -7.884 1.00 0.00 C ATOM 0 H VAL A 765 -8.469 -1.976 -10.926 1.00 0.00 H new ATOM 0 HA VAL A 765 -7.848 -4.812 -10.727 1.00 0.00 H new ATOM 0 HB VAL A 765 -6.378 -4.037 -9.508 1.00 0.00 H new ATOM 0 HG11 VAL A 765 -6.261 -1.918 -8.380 1.00 0.00 H new ATOM 0 HG12 VAL A 765 -6.552 -1.809 -10.132 1.00 0.00 H new ATOM 0 HG13 VAL A 765 -7.890 -1.541 -8.989 1.00 0.00 H new ATOM 0 HG21 VAL A 765 -6.930 -3.689 -7.156 1.00 0.00 H new ATOM 0 HG22 VAL A 765 -8.646 -3.581 -7.613 1.00 0.00 H new ATOM 0 HG23 VAL A 765 -7.744 -5.090 -7.891 1.00 0.00 H new ATOM 2144 N GLY A 766 -10.490 -3.310 -9.704 1.00 0.00 N ATOM 2145 CA GLY A 766 -11.829 -3.623 -9.327 1.00 0.00 C ATOM 2146 C GLY A 766 -12.288 -4.604 -10.367 1.00 0.00 C ATOM 2147 O GLY A 766 -13.167 -5.432 -10.161 1.00 0.00 O ATOM 0 H GLY A 766 -10.308 -2.335 -9.944 1.00 0.00 H new ATOM 0 HA2 GLY A 766 -11.870 -4.055 -8.327 1.00 0.00 H new ATOM 0 HA3 GLY A 766 -12.457 -2.732 -9.315 1.00 0.00 H new ATOM 2151 N ARG A 767 -11.581 -4.488 -11.492 1.00 0.00 N ATOM 2152 CA ARG A 767 -11.715 -5.327 -12.649 1.00 0.00 C ATOM 2153 C ARG A 767 -11.049 -6.624 -12.375 1.00 0.00 C ATOM 2154 O ARG A 767 -11.570 -7.695 -12.655 1.00 0.00 O ATOM 2155 CB ARG A 767 -10.948 -4.707 -13.734 1.00 0.00 C ATOM 2156 CG ARG A 767 -11.746 -4.481 -14.978 1.00 0.00 C ATOM 2157 CD ARG A 767 -11.110 -3.448 -15.818 1.00 0.00 C ATOM 2158 NE ARG A 767 -11.130 -3.778 -17.240 1.00 0.00 N ATOM 2159 CZ ARG A 767 -11.182 -2.866 -18.207 1.00 0.00 C ATOM 2160 NH1 ARG A 767 -11.226 -1.575 -17.906 1.00 0.00 N ATOM 2161 NH2 ARG A 767 -11.192 -3.247 -19.477 1.00 0.00 N ATOM 0 H ARG A 767 -10.869 -3.767 -11.611 1.00 0.00 H new ATOM 0 HA ARG A 767 -12.768 -5.459 -12.897 1.00 0.00 H new ATOM 0 HB2 ARG A 767 -10.552 -3.752 -13.388 1.00 0.00 H new ATOM 0 HB3 ARG A 767 -10.093 -5.340 -13.971 1.00 0.00 H new ATOM 0 HG2 ARG A 767 -11.830 -5.413 -15.538 1.00 0.00 H new ATOM 0 HG3 ARG A 767 -12.759 -4.173 -14.717 1.00 0.00 H new ATOM 0 HD2 ARG A 767 -11.620 -2.497 -15.664 1.00 0.00 H new ATOM 0 HD3 ARG A 767 -10.077 -3.311 -15.497 1.00 0.00 H new ATOM 0 HE ARG A 767 -11.103 -4.762 -17.507 1.00 0.00 H new ATOM 0 HH11 ARG A 767 -11.220 -1.278 -16.930 1.00 0.00 H new ATOM 0 HH12 ARG A 767 -11.266 -0.879 -18.650 1.00 0.00 H new ATOM 0 HH21 ARG A 767 -11.160 -4.239 -19.712 1.00 0.00 H new ATOM 0 HH22 ARG A 767 -11.232 -2.548 -20.219 1.00 0.00 H new ATOM 2175 N MET A 768 -9.809 -6.480 -11.934 1.00 0.00 N ATOM 2176 CA MET A 768 -9.022 -7.597 -11.530 1.00 0.00 C ATOM 2177 C MET A 768 -9.963 -8.488 -10.823 1.00 0.00 C ATOM 2178 O MET A 768 -10.407 -9.466 -11.336 1.00 0.00 O ATOM 2179 CB MET A 768 -7.978 -7.120 -10.567 1.00 0.00 C ATOM 2180 CG MET A 768 -6.733 -6.650 -11.232 1.00 0.00 C ATOM 2181 SD MET A 768 -5.269 -6.969 -10.257 1.00 0.00 S ATOM 2182 CE MET A 768 -5.759 -6.278 -8.714 1.00 0.00 C ATOM 0 H MET A 768 -9.335 -5.580 -11.852 1.00 0.00 H new ATOM 0 HA MET A 768 -8.530 -8.094 -12.366 1.00 0.00 H new ATOM 0 HB2 MET A 768 -8.390 -6.308 -9.968 1.00 0.00 H new ATOM 0 HB3 MET A 768 -7.731 -7.929 -9.880 1.00 0.00 H new ATOM 0 HG2 MET A 768 -6.635 -7.142 -12.200 1.00 0.00 H new ATOM 0 HG3 MET A 768 -6.810 -5.580 -11.425 1.00 0.00 H new ATOM 0 HE1 MET A 768 -5.268 -6.815 -7.903 1.00 0.00 H new ATOM 0 HE2 MET A 768 -5.473 -5.227 -8.679 1.00 0.00 H new ATOM 0 HE3 MET A 768 -6.840 -6.364 -8.604 1.00 0.00 H new ATOM 2192 N PHE A 769 -10.358 -7.973 -9.697 1.00 0.00 N ATOM 2193 CA PHE A 769 -11.310 -8.589 -8.805 1.00 0.00 C ATOM 2194 C PHE A 769 -12.475 -9.128 -9.603 1.00 0.00 C ATOM 2195 O PHE A 769 -13.011 -10.181 -9.297 1.00 0.00 O ATOM 2196 CB PHE A 769 -11.851 -7.570 -7.800 1.00 0.00 C ATOM 2197 CG PHE A 769 -10.818 -6.771 -7.039 1.00 0.00 C ATOM 2198 CD1 PHE A 769 -9.605 -7.312 -6.686 1.00 0.00 C ATOM 2199 CD2 PHE A 769 -11.072 -5.472 -6.672 1.00 0.00 C ATOM 2200 CE1 PHE A 769 -8.669 -6.605 -6.003 1.00 0.00 C ATOM 2201 CE2 PHE A 769 -10.133 -4.756 -5.978 1.00 0.00 C ATOM 2202 CZ PHE A 769 -8.927 -5.347 -5.650 1.00 0.00 C ATOM 0 H PHE A 769 -10.015 -7.075 -9.356 1.00 0.00 H new ATOM 0 HA PHE A 769 -10.803 -9.393 -8.271 1.00 0.00 H new ATOM 0 HB2 PHE A 769 -12.499 -6.874 -8.333 1.00 0.00 H new ATOM 0 HB3 PHE A 769 -12.475 -8.098 -7.079 1.00 0.00 H new ATOM 0 HD1 PHE A 769 -9.389 -8.334 -6.961 1.00 0.00 H new ATOM 0 HD2 PHE A 769 -12.015 -5.014 -6.931 1.00 0.00 H new ATOM 0 HE1 PHE A 769 -7.723 -7.059 -5.748 1.00 0.00 H new ATOM 0 HE2 PHE A 769 -10.334 -3.735 -5.689 1.00 0.00 H new ATOM 0 HZ PHE A 769 -8.187 -4.783 -5.102 1.00 0.00 H new ATOM 2212 N LYS A 770 -12.866 -8.383 -10.627 1.00 0.00 N ATOM 2213 CA LYS A 770 -13.983 -8.778 -11.464 1.00 0.00 C ATOM 2214 C LYS A 770 -13.755 -10.109 -12.159 1.00 0.00 C ATOM 2215 O LYS A 770 -14.559 -11.022 -12.022 1.00 0.00 O ATOM 2216 CB LYS A 770 -14.317 -7.718 -12.484 1.00 0.00 C ATOM 2217 CG LYS A 770 -15.699 -7.196 -12.328 1.00 0.00 C ATOM 2218 CD LYS A 770 -15.709 -5.980 -11.438 1.00 0.00 C ATOM 2219 CE LYS A 770 -15.369 -4.728 -12.220 1.00 0.00 C ATOM 2220 NZ LYS A 770 -15.130 -3.558 -11.332 1.00 0.00 N ATOM 0 H LYS A 770 -12.425 -7.503 -10.896 1.00 0.00 H new ATOM 0 HA LYS A 770 -14.830 -8.898 -10.789 1.00 0.00 H new ATOM 0 HB2 LYS A 770 -13.608 -6.895 -12.393 1.00 0.00 H new ATOM 0 HB3 LYS A 770 -14.199 -8.132 -13.486 1.00 0.00 H new ATOM 0 HG2 LYS A 770 -16.110 -6.942 -13.305 1.00 0.00 H new ATOM 0 HG3 LYS A 770 -16.340 -7.969 -11.904 1.00 0.00 H new ATOM 0 HD2 LYS A 770 -16.691 -5.870 -10.979 1.00 0.00 H new ATOM 0 HD3 LYS A 770 -14.992 -6.113 -10.628 1.00 0.00 H new ATOM 0 HE2 LYS A 770 -14.481 -4.910 -12.825 1.00 0.00 H new ATOM 0 HE3 LYS A 770 -16.183 -4.499 -12.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 770 -14.374 -2.966 -11.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 770 -16.003 -2.998 -11.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 770 -14.845 -3.891 -10.389 1.00 0.00 H new ATOM 2234 N GLN A 771 -12.667 -10.233 -12.908 1.00 0.00 N ATOM 2235 CA GLN A 771 -12.398 -11.487 -13.580 1.00 0.00 C ATOM 2236 C GLN A 771 -11.910 -12.397 -12.502 1.00 0.00 C ATOM 2237 O GLN A 771 -12.335 -13.520 -12.361 1.00 0.00 O ATOM 2238 CB GLN A 771 -11.343 -11.343 -14.677 1.00 0.00 C ATOM 2239 CG GLN A 771 -10.986 -9.901 -15.008 1.00 0.00 C ATOM 2240 CD GLN A 771 -12.153 -9.133 -15.595 1.00 0.00 C ATOM 2241 OE1 GLN A 771 -13.019 -9.704 -16.257 1.00 0.00 O ATOM 2242 NE2 GLN A 771 -12.183 -7.827 -15.353 1.00 0.00 N ATOM 0 H GLN A 771 -11.976 -9.499 -13.060 1.00 0.00 H new ATOM 0 HA GLN A 771 -13.289 -11.863 -14.083 1.00 0.00 H new ATOM 0 HB2 GLN A 771 -10.439 -11.869 -14.369 1.00 0.00 H new ATOM 0 HB3 GLN A 771 -11.704 -11.834 -15.581 1.00 0.00 H new ATOM 0 HG2 GLN A 771 -10.643 -9.399 -14.104 1.00 0.00 H new ATOM 0 HG3 GLN A 771 -10.156 -9.889 -15.714 1.00 0.00 H new ATOM 0 HE21 GLN A 771 -11.444 -7.394 -14.799 1.00 0.00 H new ATOM 0 HE22 GLN A 771 -12.945 -7.257 -15.721 1.00 0.00 H new ATOM 2251 N PHE A 772 -11.029 -11.828 -11.721 1.00 0.00 N ATOM 2252 CA PHE A 772 -10.450 -12.458 -10.571 1.00 0.00 C ATOM 2253 C PHE A 772 -11.473 -13.383 -9.938 1.00 0.00 C ATOM 2254 O PHE A 772 -11.198 -14.550 -9.659 1.00 0.00 O ATOM 2255 CB PHE A 772 -10.004 -11.381 -9.558 1.00 0.00 C ATOM 2256 CG PHE A 772 -9.201 -11.922 -8.436 1.00 0.00 C ATOM 2257 CD1 PHE A 772 -8.681 -13.156 -8.569 1.00 0.00 C ATOM 2258 CD2 PHE A 772 -9.006 -11.237 -7.251 1.00 0.00 C ATOM 2259 CE1 PHE A 772 -7.975 -13.744 -7.568 1.00 0.00 C ATOM 2260 CE2 PHE A 772 -8.281 -11.821 -6.230 1.00 0.00 C ATOM 2261 CZ PHE A 772 -7.769 -13.082 -6.395 1.00 0.00 C ATOM 0 H PHE A 772 -10.685 -10.880 -11.877 1.00 0.00 H new ATOM 0 HA PHE A 772 -9.578 -13.040 -10.870 1.00 0.00 H new ATOM 0 HB2 PHE A 772 -9.420 -10.622 -10.079 1.00 0.00 H new ATOM 0 HB3 PHE A 772 -10.887 -10.884 -9.156 1.00 0.00 H new ATOM 0 HD1 PHE A 772 -8.829 -13.692 -9.495 1.00 0.00 H new ATOM 0 HD2 PHE A 772 -9.420 -10.247 -7.124 1.00 0.00 H new ATOM 0 HE1 PHE A 772 -7.576 -14.739 -7.702 1.00 0.00 H new ATOM 0 HE2 PHE A 772 -8.118 -11.286 -5.306 1.00 0.00 H new ATOM 0 HZ PHE A 772 -7.206 -13.548 -5.600 1.00 0.00 H new ATOM 2271 N ASN A 773 -12.669 -12.842 -9.753 1.00 0.00 N ATOM 2272 CA ASN A 773 -13.762 -13.549 -9.166 1.00 0.00 C ATOM 2273 C ASN A 773 -14.509 -14.393 -10.194 1.00 0.00 C ATOM 2274 O ASN A 773 -14.886 -15.523 -9.916 1.00 0.00 O ATOM 2275 CB ASN A 773 -14.651 -12.501 -8.539 1.00 0.00 C ATOM 2276 CG ASN A 773 -15.743 -11.988 -9.436 1.00 0.00 C ATOM 2277 OD1 ASN A 773 -16.693 -12.693 -9.778 1.00 0.00 O ATOM 2278 ND2 ASN A 773 -15.604 -10.729 -9.798 1.00 0.00 N ATOM 0 H ASN A 773 -12.895 -11.883 -10.016 1.00 0.00 H new ATOM 0 HA ASN A 773 -13.412 -14.260 -8.417 1.00 0.00 H new ATOM 0 HB2 ASN A 773 -15.104 -12.918 -7.640 1.00 0.00 H new ATOM 0 HB3 ASN A 773 -14.033 -11.660 -8.224 1.00 0.00 H new ATOM 0 HD21 ASN A 773 -16.306 -10.289 -10.393 1.00 0.00 H new ATOM 0 HD22 ASN A 773 -14.795 -10.194 -9.483 1.00 0.00 H new ATOM 2285 N LYS A 774 -14.722 -13.836 -11.377 1.00 0.00 N ATOM 2286 CA LYS A 774 -15.417 -14.548 -12.449 1.00 0.00 C ATOM 2287 C LYS A 774 -14.665 -15.796 -12.878 1.00 0.00 C ATOM 2288 O LYS A 774 -15.214 -16.680 -13.536 1.00 0.00 O ATOM 2289 CB LYS A 774 -15.649 -13.638 -13.602 1.00 0.00 C ATOM 2290 CG LYS A 774 -16.572 -12.535 -13.250 1.00 0.00 C ATOM 2291 CD LYS A 774 -18.006 -12.947 -13.313 1.00 0.00 C ATOM 2292 CE LYS A 774 -18.909 -11.769 -13.021 1.00 0.00 C ATOM 2293 NZ LYS A 774 -19.030 -10.855 -14.189 1.00 0.00 N ATOM 0 H LYS A 774 -14.425 -12.892 -11.623 1.00 0.00 H new ATOM 0 HA LYS A 774 -16.382 -14.877 -12.064 1.00 0.00 H new ATOM 0 HB2 LYS A 774 -14.698 -13.224 -13.937 1.00 0.00 H new ATOM 0 HB3 LYS A 774 -16.061 -14.205 -14.437 1.00 0.00 H new ATOM 0 HG2 LYS A 774 -16.343 -12.181 -12.245 1.00 0.00 H new ATOM 0 HG3 LYS A 774 -16.408 -11.698 -13.928 1.00 0.00 H new ATOM 0 HD2 LYS A 774 -18.232 -13.350 -14.300 1.00 0.00 H new ATOM 0 HD3 LYS A 774 -18.194 -13.744 -12.593 1.00 0.00 H new ATOM 0 HE2 LYS A 774 -19.898 -12.131 -12.741 1.00 0.00 H new ATOM 0 HE3 LYS A 774 -18.518 -11.216 -12.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 -19.710 -10.099 -13.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 -18.102 -10.436 -14.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 -19.363 -11.391 -15.016 1.00 0.00 H new ATOM 2307 N LEU A 775 -13.403 -15.848 -12.498 1.00 0.00 N ATOM 2308 CA LEU A 775 -12.553 -16.954 -12.755 1.00 0.00 C ATOM 2309 C LEU A 775 -13.097 -18.063 -11.938 1.00 0.00 C ATOM 2310 O LEU A 775 -13.226 -19.211 -12.364 1.00 0.00 O ATOM 2311 CB LEU A 775 -11.179 -16.576 -12.283 1.00 0.00 C ATOM 2312 CG LEU A 775 -10.307 -15.927 -13.337 1.00 0.00 C ATOM 2313 CD1 LEU A 775 -11.109 -15.088 -14.301 1.00 0.00 C ATOM 2314 CD2 LEU A 775 -9.217 -15.088 -12.693 1.00 0.00 C ATOM 0 H LEU A 775 -12.945 -15.092 -11.989 1.00 0.00 H new ATOM 0 HA LEU A 775 -12.501 -17.238 -13.806 1.00 0.00 H new ATOM 0 HB2 LEU A 775 -11.274 -15.894 -11.438 1.00 0.00 H new ATOM 0 HB3 LEU A 775 -10.677 -17.471 -11.915 1.00 0.00 H new ATOM 0 HG LEU A 775 -9.845 -16.733 -13.907 1.00 0.00 H new ATOM 0 HD11 LEU A 775 -10.441 -14.643 -15.038 1.00 0.00 H new ATOM 0 HD12 LEU A 775 -11.842 -15.716 -14.807 1.00 0.00 H new ATOM 0 HD13 LEU A 775 -11.624 -14.298 -13.754 1.00 0.00 H new ATOM 0 HD21 LEU A 775 -8.603 -14.631 -13.469 1.00 0.00 H new ATOM 0 HD22 LEU A 775 -9.671 -14.307 -12.083 1.00 0.00 H new ATOM 0 HD23 LEU A 775 -8.593 -15.723 -12.063 1.00 0.00 H new ATOM 2411 N VAL A 782 -14.263 -16.618 -3.362 1.00 0.00 N ATOM 2412 CA VAL A 782 -14.498 -15.387 -4.079 1.00 0.00 C ATOM 2413 C VAL A 782 -14.502 -14.300 -3.092 1.00 0.00 C ATOM 2414 O VAL A 782 -14.608 -13.138 -3.422 1.00 0.00 O ATOM 2415 CB VAL A 782 -15.811 -15.421 -4.805 1.00 0.00 C ATOM 2416 CG1 VAL A 782 -15.770 -14.594 -6.078 1.00 0.00 C ATOM 2417 CG2 VAL A 782 -16.135 -16.853 -5.072 1.00 0.00 C ATOM 0 HA VAL A 782 -13.718 -15.240 -4.826 1.00 0.00 H new ATOM 0 HB VAL A 782 -16.595 -14.972 -4.195 1.00 0.00 H new ATOM 0 HG11 VAL A 782 -16.739 -14.643 -6.575 1.00 0.00 H new ATOM 0 HG12 VAL A 782 -15.541 -13.557 -5.831 1.00 0.00 H new ATOM 0 HG13 VAL A 782 -15.000 -14.987 -6.743 1.00 0.00 H new ATOM 0 HG21 VAL A 782 -17.086 -16.918 -5.600 1.00 0.00 H new ATOM 0 HG22 VAL A 782 -15.349 -17.296 -5.684 1.00 0.00 H new ATOM 0 HG23 VAL A 782 -16.207 -17.392 -4.127 1.00 0.00 H new ATOM 2427 N GLN A 783 -14.406 -14.722 -1.860 1.00 0.00 N ATOM 2428 CA GLN A 783 -14.356 -13.811 -0.765 1.00 0.00 C ATOM 2429 C GLN A 783 -12.917 -13.429 -0.537 1.00 0.00 C ATOM 2430 O GLN A 783 -12.576 -12.709 0.400 1.00 0.00 O ATOM 2431 CB GLN A 783 -15.006 -14.425 0.436 1.00 0.00 C ATOM 2432 CG GLN A 783 -16.434 -14.812 0.134 1.00 0.00 C ATOM 2433 CD GLN A 783 -17.398 -13.648 0.300 1.00 0.00 C ATOM 2434 OE1 GLN A 783 -16.897 -12.420 0.138 1.00 0.00 O flip ATOM 2435 NE2 GLN A 783 -18.580 -13.845 0.579 1.00 0.00 N flip ATOM 0 H GLN A 783 -14.361 -15.706 -1.595 1.00 0.00 H new ATOM 0 HA GLN A 783 -14.913 -12.899 -0.977 1.00 0.00 H new ATOM 0 HB2 GLN A 783 -14.444 -15.305 0.749 1.00 0.00 H new ATOM 0 HB3 GLN A 783 -14.983 -13.720 1.267 1.00 0.00 H new ATOM 0 HG2 GLN A 783 -16.497 -15.190 -0.887 1.00 0.00 H new ATOM 0 HG3 GLN A 783 -16.734 -15.626 0.794 1.00 0.00 H new ATOM 0 HE21 GLN A 783 -18.925 -14.798 0.695 1.00 0.00 H new ATOM 0 HE22 GLN A 783 -19.215 -13.055 0.695 1.00 0.00 H new ATOM 2444 N SER A 784 -12.072 -13.960 -1.421 1.00 0.00 N ATOM 2445 CA SER A 784 -10.676 -13.631 -1.427 1.00 0.00 C ATOM 2446 C SER A 784 -10.621 -12.515 -2.419 1.00 0.00 C ATOM 2447 O SER A 784 -9.874 -11.552 -2.282 1.00 0.00 O ATOM 2448 CB SER A 784 -9.793 -14.807 -1.849 1.00 0.00 C ATOM 2449 OG SER A 784 -9.919 -15.083 -3.233 1.00 0.00 O ATOM 0 H SER A 784 -12.349 -14.625 -2.143 1.00 0.00 H new ATOM 0 HA SER A 784 -10.297 -13.366 -0.440 1.00 0.00 H new ATOM 0 HB2 SER A 784 -8.752 -14.584 -1.615 1.00 0.00 H new ATOM 0 HB3 SER A 784 -10.066 -15.692 -1.274 1.00 0.00 H new ATOM 0 HG SER A 784 -9.341 -15.838 -3.470 1.00 0.00 H new ATOM 2455 N ILE A 785 -11.478 -12.673 -3.432 1.00 0.00 N ATOM 2456 CA ILE A 785 -11.665 -11.684 -4.411 1.00 0.00 C ATOM 2457 C ILE A 785 -12.278 -10.504 -3.726 1.00 0.00 C ATOM 2458 O ILE A 785 -11.853 -9.373 -3.883 1.00 0.00 O ATOM 2459 CB ILE A 785 -12.594 -12.121 -5.505 1.00 0.00 C ATOM 2460 CG1 ILE A 785 -12.309 -13.545 -5.899 1.00 0.00 C ATOM 2461 CG2 ILE A 785 -12.372 -11.172 -6.622 1.00 0.00 C ATOM 2462 CD1 ILE A 785 -11.149 -13.673 -6.774 1.00 0.00 C ATOM 0 H ILE A 785 -12.049 -13.508 -3.566 1.00 0.00 H new ATOM 0 HA ILE A 785 -10.701 -11.462 -4.869 1.00 0.00 H new ATOM 0 HB ILE A 785 -13.638 -12.105 -5.193 1.00 0.00 H new ATOM 0 HG12 ILE A 785 -12.146 -14.139 -5.000 1.00 0.00 H new ATOM 0 HG13 ILE A 785 -13.183 -13.959 -6.401 1.00 0.00 H new ATOM 0 HG21 ILE A 785 -13.022 -11.435 -7.457 1.00 0.00 H new ATOM 0 HG22 ILE A 785 -12.600 -10.159 -6.290 1.00 0.00 H new ATOM 0 HG23 ILE A 785 -11.331 -11.223 -6.942 1.00 0.00 H new ATOM 0 HD11 ILE A 785 -10.995 -14.723 -7.023 1.00 0.00 H new ATOM 0 HD12 ILE A 785 -11.318 -13.104 -7.688 1.00 0.00 H new ATOM 0 HD13 ILE A 785 -10.265 -13.287 -6.265 1.00 0.00 H new ATOM 2474 N ILE A 786 -13.343 -10.779 -2.997 1.00 0.00 N ATOM 2475 CA ILE A 786 -13.971 -9.765 -2.228 1.00 0.00 C ATOM 2476 C ILE A 786 -13.028 -9.307 -1.143 1.00 0.00 C ATOM 2477 O ILE A 786 -13.049 -8.160 -0.716 1.00 0.00 O ATOM 2478 CB ILE A 786 -15.268 -10.262 -1.672 1.00 0.00 C ATOM 2479 CG1 ILE A 786 -16.259 -9.891 -2.701 1.00 0.00 C ATOM 2480 CG2 ILE A 786 -15.566 -9.607 -0.384 1.00 0.00 C ATOM 2481 CD1 ILE A 786 -16.371 -10.920 -3.756 1.00 0.00 C ATOM 0 H ILE A 786 -13.778 -11.699 -2.932 1.00 0.00 H new ATOM 0 HA ILE A 786 -14.202 -8.908 -2.861 1.00 0.00 H new ATOM 0 HB ILE A 786 -15.261 -11.333 -1.468 1.00 0.00 H new ATOM 0 HG12 ILE A 786 -17.232 -9.745 -2.232 1.00 0.00 H new ATOM 0 HG13 ILE A 786 -15.976 -8.939 -3.151 1.00 0.00 H new ATOM 0 HG21 ILE A 786 -16.513 -9.982 0.004 1.00 0.00 H new ATOM 0 HG22 ILE A 786 -14.770 -9.825 0.328 1.00 0.00 H new ATOM 0 HG23 ILE A 786 -15.635 -8.529 -0.531 1.00 0.00 H new ATOM 0 HD11 ILE A 786 -17.111 -10.607 -4.493 1.00 0.00 H new ATOM 0 HD12 ILE A 786 -15.405 -11.048 -4.244 1.00 0.00 H new ATOM 0 HD13 ILE A 786 -16.680 -11.866 -3.311 1.00 0.00 H new ATOM 2493 N GLY A 787 -12.177 -10.225 -0.737 1.00 0.00 N ATOM 2494 CA GLY A 787 -11.205 -9.933 0.283 1.00 0.00 C ATOM 2495 C GLY A 787 -10.357 -8.756 -0.092 1.00 0.00 C ATOM 2496 O GLY A 787 -10.133 -7.879 0.737 1.00 0.00 O ATOM 0 H GLY A 787 -12.142 -11.178 -1.100 1.00 0.00 H new ATOM 0 HA2 GLY A 787 -11.714 -9.731 1.226 1.00 0.00 H new ATOM 0 HA3 GLY A 787 -10.570 -10.805 0.443 1.00 0.00 H new ATOM 2500 N LEU A 788 -9.863 -8.722 -1.330 1.00 0.00 N ATOM 2501 CA LEU A 788 -9.097 -7.583 -1.756 1.00 0.00 C ATOM 2502 C LEU A 788 -10.056 -6.532 -2.147 1.00 0.00 C ATOM 2503 O LEU A 788 -9.904 -5.398 -1.785 1.00 0.00 O ATOM 2504 CB LEU A 788 -8.240 -7.880 -2.934 1.00 0.00 C ATOM 2505 CG LEU A 788 -8.252 -9.310 -3.279 1.00 0.00 C ATOM 2506 CD1 LEU A 788 -9.236 -9.551 -4.356 1.00 0.00 C ATOM 2507 CD2 LEU A 788 -6.928 -9.728 -3.713 1.00 0.00 C ATOM 0 H LEU A 788 -9.982 -9.456 -2.029 1.00 0.00 H new ATOM 0 HA LEU A 788 -8.444 -7.282 -0.937 1.00 0.00 H new ATOM 0 HB2 LEU A 788 -8.585 -7.298 -3.789 1.00 0.00 H new ATOM 0 HB3 LEU A 788 -7.217 -7.566 -2.726 1.00 0.00 H new ATOM 0 HG LEU A 788 -8.533 -9.889 -2.399 1.00 0.00 H new ATOM 0 HD11 LEU A 788 -9.244 -10.611 -4.611 1.00 0.00 H new ATOM 0 HD12 LEU A 788 -10.228 -9.252 -4.016 1.00 0.00 H new ATOM 0 HD13 LEU A 788 -8.963 -8.968 -5.236 1.00 0.00 H new ATOM 0 HD21 LEU A 788 -6.946 -10.788 -3.966 1.00 0.00 H new ATOM 0 HD22 LEU A 788 -6.633 -9.150 -4.589 1.00 0.00 H new ATOM 0 HD23 LEU A 788 -6.211 -9.559 -2.909 1.00 0.00 H new ATOM 2519 N GLN A 789 -11.092 -6.912 -2.876 1.00 0.00 N ATOM 2520 CA GLN A 789 -12.040 -5.931 -3.277 1.00 0.00 C ATOM 2521 C GLN A 789 -12.239 -4.953 -2.101 1.00 0.00 C ATOM 2522 O GLN A 789 -12.324 -3.735 -2.286 1.00 0.00 O ATOM 2523 CB GLN A 789 -13.305 -6.656 -3.679 1.00 0.00 C ATOM 2524 CG GLN A 789 -13.296 -7.138 -5.108 1.00 0.00 C ATOM 2525 CD GLN A 789 -14.537 -7.928 -5.471 1.00 0.00 C ATOM 2526 OE1 GLN A 789 -14.466 -9.243 -5.335 1.00 0.00 O flip ATOM 2527 NE2 GLN A 789 -15.548 -7.358 -5.881 1.00 0.00 N flip ATOM 0 H GLN A 789 -11.281 -7.865 -3.186 1.00 0.00 H new ATOM 0 HA GLN A 789 -11.711 -5.342 -4.133 1.00 0.00 H new ATOM 0 HB2 GLN A 789 -13.451 -7.510 -3.017 1.00 0.00 H new ATOM 0 HB3 GLN A 789 -14.157 -5.991 -3.534 1.00 0.00 H new ATOM 0 HG2 GLN A 789 -13.209 -6.280 -5.775 1.00 0.00 H new ATOM 0 HG3 GLN A 789 -12.415 -7.759 -5.271 1.00 0.00 H new ATOM 0 HE21 GLN A 789 -15.560 -6.342 -5.971 1.00 0.00 H new ATOM 0 HE22 GLN A 789 -16.374 -7.902 -6.131 1.00 0.00 H new ATOM 2536 N ARG A 790 -12.240 -5.518 -0.879 1.00 0.00 N ATOM 2537 CA ARG A 790 -12.333 -4.745 0.351 1.00 0.00 C ATOM 2538 C ARG A 790 -10.948 -4.233 0.776 1.00 0.00 C ATOM 2539 O ARG A 790 -10.790 -3.058 1.109 1.00 0.00 O ATOM 2540 CB ARG A 790 -12.924 -5.629 1.429 1.00 0.00 C ATOM 2541 CG ARG A 790 -14.232 -6.238 1.005 1.00 0.00 C ATOM 2542 CD ARG A 790 -14.557 -7.490 1.790 1.00 0.00 C ATOM 2543 NE ARG A 790 -14.065 -7.435 3.165 1.00 0.00 N ATOM 2544 CZ ARG A 790 -13.875 -8.511 3.921 1.00 0.00 C ATOM 2545 NH1 ARG A 790 -14.128 -9.721 3.437 1.00 0.00 N ATOM 2546 NH2 ARG A 790 -13.429 -8.380 5.163 1.00 0.00 N ATOM 0 H ARG A 790 -12.176 -6.525 -0.728 1.00 0.00 H new ATOM 0 HA ARG A 790 -12.972 -3.876 0.191 1.00 0.00 H new ATOM 0 HB2 ARG A 790 -12.218 -6.422 1.675 1.00 0.00 H new ATOM 0 HB3 ARG A 790 -13.074 -5.043 2.336 1.00 0.00 H new ATOM 0 HG2 ARG A 790 -15.031 -5.509 1.139 1.00 0.00 H new ATOM 0 HG3 ARG A 790 -14.193 -6.477 -0.058 1.00 0.00 H new ATOM 0 HD2 ARG A 790 -15.637 -7.638 1.800 1.00 0.00 H new ATOM 0 HD3 ARG A 790 -14.122 -8.353 1.287 1.00 0.00 H new ATOM 0 HE ARG A 790 -13.856 -6.521 3.566 1.00 0.00 H new ATOM 0 HH11 ARG A 790 -14.469 -9.827 2.482 1.00 0.00 H new ATOM 0 HH12 ARG A 790 -13.981 -10.545 4.020 1.00 0.00 H new ATOM 0 HH21 ARG A 790 -13.231 -7.453 5.539 1.00 0.00 H new ATOM 0 HH22 ARG A 790 -13.284 -9.207 5.742 1.00 0.00 H new ATOM 2560 N PHE A 791 -9.951 -5.131 0.767 1.00 0.00 N ATOM 2561 CA PHE A 791 -8.573 -4.780 1.107 1.00 0.00 C ATOM 2562 C PHE A 791 -8.182 -3.630 0.211 1.00 0.00 C ATOM 2563 O PHE A 791 -7.885 -2.533 0.674 1.00 0.00 O ATOM 2564 CB PHE A 791 -7.698 -6.025 0.950 1.00 0.00 C ATOM 2565 CG PHE A 791 -6.427 -5.988 1.740 1.00 0.00 C ATOM 2566 CD1 PHE A 791 -5.417 -5.122 1.393 1.00 0.00 C ATOM 2567 CD2 PHE A 791 -6.241 -6.830 2.825 1.00 0.00 C ATOM 2568 CE1 PHE A 791 -4.236 -5.090 2.101 1.00 0.00 C ATOM 2569 CE2 PHE A 791 -5.062 -6.803 3.544 1.00 0.00 C ATOM 2570 CZ PHE A 791 -4.056 -5.932 3.180 1.00 0.00 C ATOM 0 H PHE A 791 -10.081 -6.113 0.525 1.00 0.00 H new ATOM 0 HA PHE A 791 -8.449 -4.455 2.140 1.00 0.00 H new ATOM 0 HB2 PHE A 791 -8.274 -6.900 1.251 1.00 0.00 H new ATOM 0 HB3 PHE A 791 -7.453 -6.152 -0.105 1.00 0.00 H new ATOM 0 HD1 PHE A 791 -5.552 -4.457 0.553 1.00 0.00 H new ATOM 0 HD2 PHE A 791 -7.026 -7.514 3.111 1.00 0.00 H new ATOM 0 HE1 PHE A 791 -3.451 -4.407 1.812 1.00 0.00 H new ATOM 0 HE2 PHE A 791 -4.928 -7.462 4.389 1.00 0.00 H new ATOM 0 HZ PHE A 791 -3.131 -5.909 3.737 1.00 0.00 H new ATOM 2580 N PHE A 792 -8.197 -3.911 -1.067 1.00 0.00 N ATOM 2581 CA PHE A 792 -8.027 -2.927 -2.097 1.00 0.00 C ATOM 2582 C PHE A 792 -8.554 -1.599 -1.673 1.00 0.00 C ATOM 2583 O PHE A 792 -7.817 -0.698 -1.337 1.00 0.00 O ATOM 2584 CB PHE A 792 -8.919 -3.336 -3.261 1.00 0.00 C ATOM 2585 CG PHE A 792 -8.853 -2.334 -4.341 1.00 0.00 C ATOM 2586 CD1 PHE A 792 -7.713 -2.269 -4.982 1.00 0.00 C ATOM 2587 CD2 PHE A 792 -9.869 -1.470 -4.671 1.00 0.00 C ATOM 2588 CE1 PHE A 792 -7.479 -1.370 -5.964 1.00 0.00 C ATOM 2589 CE2 PHE A 792 -9.682 -0.539 -5.675 1.00 0.00 C ATOM 2590 CZ PHE A 792 -8.462 -0.491 -6.321 1.00 0.00 C ATOM 0 H PHE A 792 -8.332 -4.856 -1.426 1.00 0.00 H new ATOM 0 HA PHE A 792 -6.965 -2.863 -2.336 1.00 0.00 H new ATOM 0 HB2 PHE A 792 -8.608 -4.309 -3.641 1.00 0.00 H new ATOM 0 HB3 PHE A 792 -9.948 -3.442 -2.918 1.00 0.00 H new ATOM 0 HD1 PHE A 792 -6.928 -2.961 -4.715 1.00 0.00 H new ATOM 0 HD2 PHE A 792 -10.812 -1.518 -4.147 1.00 0.00 H new ATOM 0 HE1 PHE A 792 -6.521 -1.347 -6.463 1.00 0.00 H new ATOM 0 HE2 PHE A 792 -10.476 0.139 -5.950 1.00 0.00 H new ATOM 0 HZ PHE A 792 -8.287 0.235 -7.101 1.00 0.00 H new ATOM 2600 N GLU A 793 -9.864 -1.533 -1.665 1.00 0.00 N ATOM 2601 CA GLU A 793 -10.569 -0.331 -1.388 1.00 0.00 C ATOM 2602 C GLU A 793 -10.181 0.352 -0.091 1.00 0.00 C ATOM 2603 O GLU A 793 -10.172 1.574 -0.018 1.00 0.00 O ATOM 2604 CB GLU A 793 -12.026 -0.642 -1.389 1.00 0.00 C ATOM 2605 CG GLU A 793 -12.602 -0.603 -2.781 1.00 0.00 C ATOM 2606 CD GLU A 793 -13.048 0.785 -3.199 1.00 0.00 C ATOM 2607 OE1 GLU A 793 -12.218 1.528 -3.765 1.00 0.00 O ATOM 2608 OE2 GLU A 793 -14.225 1.127 -2.962 1.00 0.00 O ATOM 0 H GLU A 793 -10.468 -2.333 -1.855 1.00 0.00 H new ATOM 0 HA GLU A 793 -10.302 0.383 -2.167 1.00 0.00 H new ATOM 0 HB2 GLU A 793 -12.188 -1.629 -0.955 1.00 0.00 H new ATOM 0 HB3 GLU A 793 -12.552 0.074 -0.757 1.00 0.00 H new ATOM 0 HG2 GLU A 793 -11.856 -0.967 -3.487 1.00 0.00 H new ATOM 0 HG3 GLU A 793 -13.452 -1.284 -2.836 1.00 0.00 H new ATOM 2615 N THR A 794 -9.836 -0.427 0.918 1.00 0.00 N ATOM 2616 CA THR A 794 -9.501 0.124 2.206 1.00 0.00 C ATOM 2617 C THR A 794 -8.118 0.728 2.184 1.00 0.00 C ATOM 2618 O THR A 794 -7.886 1.721 2.831 1.00 0.00 O ATOM 2619 CB THR A 794 -9.585 -0.953 3.292 1.00 0.00 C ATOM 2620 OG1 THR A 794 -10.553 -0.605 4.287 1.00 0.00 O ATOM 2621 CG2 THR A 794 -8.242 -1.165 3.922 1.00 0.00 C ATOM 0 H THR A 794 -9.782 -1.444 0.864 1.00 0.00 H new ATOM 0 HA THR A 794 -10.221 0.909 2.435 1.00 0.00 H new ATOM 0 HB THR A 794 -9.903 -1.884 2.822 1.00 0.00 H new ATOM 0 HG1 THR A 794 -10.589 -1.309 4.968 1.00 0.00 H new ATOM 0 HG21 THR A 794 -8.318 -1.933 4.692 1.00 0.00 H new ATOM 0 HG22 THR A 794 -7.529 -1.483 3.161 1.00 0.00 H new ATOM 0 HG23 THR A 794 -7.900 -0.233 4.372 1.00 0.00 H new ATOM 2629 N ARG A 795 -7.203 0.109 1.446 1.00 0.00 N ATOM 2630 CA ARG A 795 -5.840 0.601 1.354 1.00 0.00 C ATOM 2631 C ARG A 795 -5.861 1.773 0.425 1.00 0.00 C ATOM 2632 O ARG A 795 -5.244 2.801 0.661 1.00 0.00 O ATOM 2633 CB ARG A 795 -4.930 -0.495 0.831 1.00 0.00 C ATOM 2634 CG ARG A 795 -5.147 -1.810 1.560 1.00 0.00 C ATOM 2635 CD ARG A 795 -4.469 -1.810 2.919 1.00 0.00 C ATOM 2636 NE ARG A 795 -5.113 -2.732 3.851 1.00 0.00 N ATOM 2637 CZ ARG A 795 -4.788 -2.830 5.137 1.00 0.00 C ATOM 2638 NH1 ARG A 795 -3.831 -2.064 5.644 1.00 0.00 N ATOM 2639 NH2 ARG A 795 -5.423 -3.692 5.919 1.00 0.00 N ATOM 0 H ARG A 795 -7.384 -0.735 0.903 1.00 0.00 H new ATOM 0 HA ARG A 795 -5.458 0.901 2.330 1.00 0.00 H new ATOM 0 HB2 ARG A 795 -5.109 -0.637 -0.235 1.00 0.00 H new ATOM 0 HB3 ARG A 795 -3.890 -0.187 0.941 1.00 0.00 H new ATOM 0 HG2 ARG A 795 -6.215 -1.986 1.685 1.00 0.00 H new ATOM 0 HG3 ARG A 795 -4.757 -2.630 0.957 1.00 0.00 H new ATOM 0 HD2 ARG A 795 -3.421 -2.086 2.802 1.00 0.00 H new ATOM 0 HD3 ARG A 795 -4.488 -0.802 3.334 1.00 0.00 H new ATOM 0 HE ARG A 795 -5.855 -3.335 3.495 1.00 0.00 H new ATOM 0 HH11 ARG A 795 -3.342 -1.397 5.047 1.00 0.00 H new ATOM 0 HH12 ARG A 795 -3.584 -2.142 6.631 1.00 0.00 H new ATOM 0 HH21 ARG A 795 -6.162 -4.281 5.535 1.00 0.00 H new ATOM 0 HH22 ARG A 795 -5.173 -3.766 6.905 1.00 0.00 H new ATOM 2653 N MET A 796 -6.573 1.565 -0.659 1.00 0.00 N ATOM 2654 CA MET A 796 -6.820 2.573 -1.626 1.00 0.00 C ATOM 2655 C MET A 796 -7.548 3.723 -0.917 1.00 0.00 C ATOM 2656 O MET A 796 -7.578 4.853 -1.396 1.00 0.00 O ATOM 2657 CB MET A 796 -7.653 1.931 -2.745 1.00 0.00 C ATOM 2658 CG MET A 796 -8.917 2.679 -3.098 1.00 0.00 C ATOM 2659 SD MET A 796 -8.610 4.182 -4.048 1.00 0.00 S ATOM 2660 CE MET A 796 -7.043 3.779 -4.814 1.00 0.00 C ATOM 0 H MET A 796 -6.999 0.666 -0.884 1.00 0.00 H new ATOM 0 HA MET A 796 -5.913 2.981 -2.073 1.00 0.00 H new ATOM 0 HB2 MET A 796 -7.034 1.848 -3.638 1.00 0.00 H new ATOM 0 HB3 MET A 796 -7.918 0.917 -2.446 1.00 0.00 H new ATOM 0 HG2 MET A 796 -9.572 2.022 -3.670 1.00 0.00 H new ATOM 0 HG3 MET A 796 -9.447 2.938 -2.181 1.00 0.00 H new ATOM 0 HE1 MET A 796 -6.846 4.476 -5.629 1.00 0.00 H new ATOM 0 HE2 MET A 796 -6.247 3.852 -4.073 1.00 0.00 H new ATOM 0 HE3 MET A 796 -7.081 2.763 -5.207 1.00 0.00 H new ATOM 2670 N ASN A 797 -8.121 3.403 0.255 1.00 0.00 N ATOM 2671 CA ASN A 797 -8.823 4.388 1.078 1.00 0.00 C ATOM 2672 C ASN A 797 -7.838 4.996 2.063 1.00 0.00 C ATOM 2673 O ASN A 797 -7.861 6.193 2.349 1.00 0.00 O ATOM 2674 CB ASN A 797 -9.964 3.719 1.849 1.00 0.00 C ATOM 2675 CG ASN A 797 -10.906 4.714 2.490 1.00 0.00 C ATOM 2676 OD1 ASN A 797 -11.834 5.210 1.852 1.00 0.00 O ATOM 2677 ND2 ASN A 797 -10.677 5.002 3.765 1.00 0.00 N ATOM 0 H ASN A 797 -8.109 2.463 0.651 1.00 0.00 H new ATOM 0 HA ASN A 797 -9.241 5.163 0.435 1.00 0.00 H new ATOM 0 HB2 ASN A 797 -10.527 3.079 1.170 1.00 0.00 H new ATOM 0 HB3 ASN A 797 -9.545 3.074 2.621 1.00 0.00 H new ATOM 0 HD21 ASN A 797 -11.283 5.659 4.256 1.00 0.00 H new ATOM 0 HD22 ASN A 797 -9.895 4.566 4.254 1.00 0.00 H new ATOM 2684 N GLU A 798 -6.975 4.129 2.573 1.00 0.00 N ATOM 2685 CA GLU A 798 -5.939 4.504 3.520 1.00 0.00 C ATOM 2686 C GLU A 798 -4.918 5.389 2.825 1.00 0.00 C ATOM 2687 O GLU A 798 -4.130 6.098 3.451 1.00 0.00 O ATOM 2688 CB GLU A 798 -5.273 3.246 4.047 1.00 0.00 C ATOM 2689 CG GLU A 798 -6.172 2.378 4.919 1.00 0.00 C ATOM 2690 CD GLU A 798 -5.581 1.012 5.205 1.00 0.00 C ATOM 2691 OE1 GLU A 798 -4.457 0.741 4.735 1.00 0.00 O ATOM 2692 OE2 GLU A 798 -6.241 0.214 5.902 1.00 0.00 O ATOM 0 H GLU A 798 -6.976 3.137 2.338 1.00 0.00 H new ATOM 0 HA GLU A 798 -6.374 5.056 4.353 1.00 0.00 H new ATOM 0 HB2 GLU A 798 -4.924 2.653 3.202 1.00 0.00 H new ATOM 0 HB3 GLU A 798 -4.392 3.529 4.623 1.00 0.00 H new ATOM 0 HG2 GLU A 798 -6.359 2.891 5.862 1.00 0.00 H new ATOM 0 HG3 GLU A 798 -7.137 2.254 4.427 1.00 0.00 H new ATOM 2699 N ALA A 799 -4.968 5.317 1.508 1.00 0.00 N ATOM 2700 CA ALA A 799 -4.098 6.069 0.617 1.00 0.00 C ATOM 2701 C ALA A 799 -4.711 7.415 0.296 1.00 0.00 C ATOM 2702 O ALA A 799 -4.076 8.459 0.447 1.00 0.00 O ATOM 2703 CB ALA A 799 -3.872 5.289 -0.659 1.00 0.00 C ATOM 0 H ALA A 799 -5.631 4.720 1.014 1.00 0.00 H new ATOM 0 HA ALA A 799 -3.141 6.230 1.114 1.00 0.00 H new ATOM 0 HB1 ALA A 799 -3.220 5.857 -1.322 1.00 0.00 H new ATOM 0 HB2 ALA A 799 -3.405 4.333 -0.423 1.00 0.00 H new ATOM 0 HB3 ALA A 799 -4.828 5.114 -1.153 1.00 0.00 H new ATOM 2709 N PHE A 800 -5.960 7.377 -0.154 1.00 0.00 N ATOM 2710 CA PHE A 800 -6.692 8.586 -0.480 1.00 0.00 C ATOM 2711 C PHE A 800 -7.020 9.351 0.797 1.00 0.00 C ATOM 2712 O PHE A 800 -7.778 10.321 0.785 1.00 0.00 O ATOM 2713 CB PHE A 800 -7.961 8.239 -1.267 1.00 0.00 C ATOM 2714 CG PHE A 800 -7.705 8.020 -2.727 1.00 0.00 C ATOM 2715 CD1 PHE A 800 -6.827 7.044 -3.121 1.00 0.00 C ATOM 2716 CD2 PHE A 800 -8.321 8.797 -3.692 1.00 0.00 C ATOM 2717 CE1 PHE A 800 -6.547 6.825 -4.457 1.00 0.00 C ATOM 2718 CE2 PHE A 800 -8.059 8.590 -5.034 1.00 0.00 C ATOM 2719 CZ PHE A 800 -7.170 7.602 -5.418 1.00 0.00 C ATOM 0 H PHE A 800 -6.485 6.515 -0.301 1.00 0.00 H new ATOM 0 HA PHE A 800 -6.074 9.226 -1.110 1.00 0.00 H new ATOM 0 HB2 PHE A 800 -8.409 7.340 -0.844 1.00 0.00 H new ATOM 0 HB3 PHE A 800 -8.687 9.044 -1.148 1.00 0.00 H new ATOM 0 HD1 PHE A 800 -6.344 6.434 -2.372 1.00 0.00 H new ATOM 0 HD2 PHE A 800 -9.012 9.572 -3.395 1.00 0.00 H new ATOM 0 HE1 PHE A 800 -5.848 6.055 -4.748 1.00 0.00 H new ATOM 0 HE2 PHE A 800 -8.547 9.198 -5.781 1.00 0.00 H new ATOM 0 HZ PHE A 800 -6.963 7.437 -6.465 1.00 0.00 H new