USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 673 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 817 SER OG : rot -150:sc= -3.13 USER MOD Set 1.2: A 820 ASN : amide:sc= -1.04 X(o=-4.2,f=-4.3) USER MOD Set 2.1: A 794 HIS : no HD1:sc= -3.85 K(o=-7,f=-3.1) USER MOD Set 2.2: A 798 SER OG : rot 80:sc= -3.13! USER MOD Single : A 729 SER OG : rot 180:sc= 0 USER MOD Single : A 736 SER OG : rot -60:sc= 1.11 USER MOD Single : A 757 THR OG1 : rot -26:sc= 0.74 USER MOD Single : A 759 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.021) USER MOD Single : A 761 HIS : no HD1:sc= -0.384 X(o=-0.38,f=-0.082) USER MOD Single : A 763 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0609) USER MOD Single : A 768 GLN : amide:sc= -2.58! C(o=-2.6!,f=-5.7!) USER MOD Single : A 769 THR OG1 : rot 180:sc= 0.0183 USER MOD Single : A 771 SER OG : rot -19:sc= 0.186 USER MOD Single : A 774 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 777 SER OG : rot 42:sc= -0.173 USER MOD Single : A 780 THR OG1 : rot 61:sc= 1.16 USER MOD Single : A 784 THR OG1 : rot 180:sc= -0.0436 USER MOD Single : A 787 THR OG1 : rot -56:sc= 0.768 USER MOD Single : A 789 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 790 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 795 SER OG : rot 110:sc= -2.11! USER MOD Single : A 797 ASN : amide:sc= 0.142 K(o=0.14,f=-0.92) USER MOD Single : A 799 ASN : amide:sc= -1.1 K(o=-1.1,f=-5.2!) USER MOD Single : A 800 SER OG : rot 10:sc= -2.04! USER MOD Single : A 805 LYS NZ :NH3+ -150:sc= -0.115 (180deg=-1) USER MOD Single : A 819 SER OG : rot 180:sc= 0 USER MOD Single : A 830 MET CE :methyl -109:sc= -2.03 (180deg=-5.85!) USER MOD Single : A 831 LYS NZ :NH3+ 151:sc= -0.213 (180deg=-1.51!) USER MOD Single : A 840 SER OG : rot 180:sc= 0 USER MOD Single : A 841 THR OG1 : rot 180:sc= 0.0885 USER MOD ----------------------------------------------------------------- ATOM 39 N VAL A 728 37.390 1.718 -35.927 1.00 0.00 N ATOM 40 CA VAL A 728 36.464 1.426 -34.795 1.00 0.00 C ATOM 41 C VAL A 728 37.070 1.910 -33.477 1.00 0.00 C ATOM 42 O VAL A 728 37.954 1.287 -32.924 1.00 0.00 O ATOM 43 CB VAL A 728 36.311 -0.092 -34.789 1.00 0.00 C ATOM 44 CG1 VAL A 728 37.688 -0.744 -34.663 1.00 0.00 C ATOM 45 CG2 VAL A 728 35.441 -0.508 -33.600 1.00 0.00 C ATOM 0 HA VAL A 728 35.505 1.931 -34.907 1.00 0.00 H new ATOM 0 HB VAL A 728 35.841 -0.414 -35.718 1.00 0.00 H new ATOM 0 HG11 VAL A 728 37.578 -1.828 -34.659 1.00 0.00 H new ATOM 0 HG12 VAL A 728 38.310 -0.446 -35.507 1.00 0.00 H new ATOM 0 HG13 VAL A 728 38.159 -0.423 -33.734 1.00 0.00 H new ATOM 0 HG21 VAL A 728 35.329 -1.592 -33.593 1.00 0.00 H new ATOM 0 HG22 VAL A 728 35.914 -0.185 -32.673 1.00 0.00 H new ATOM 0 HG23 VAL A 728 34.459 -0.043 -33.687 1.00 0.00 H new ATOM 55 N SER A 729 36.606 3.016 -32.970 1.00 0.00 N ATOM 56 CA SER A 729 37.159 3.534 -31.688 1.00 0.00 C ATOM 57 C SER A 729 36.796 2.588 -30.542 1.00 0.00 C ATOM 58 O SER A 729 35.958 1.719 -30.682 1.00 0.00 O ATOM 59 CB SER A 729 36.494 4.892 -31.489 1.00 0.00 C ATOM 60 OG SER A 729 37.334 5.712 -30.684 1.00 0.00 O ATOM 0 H SER A 729 35.868 3.584 -33.387 1.00 0.00 H new ATOM 0 HA SER A 729 38.246 3.613 -31.708 1.00 0.00 H new ATOM 0 HB2 SER A 729 36.317 5.368 -32.453 1.00 0.00 H new ATOM 0 HB3 SER A 729 35.522 4.768 -31.012 1.00 0.00 H new ATOM 0 HG SER A 729 36.911 6.587 -30.555 1.00 0.00 H new ATOM 66 N GLY A 730 37.419 2.748 -29.410 1.00 0.00 N ATOM 67 CA GLY A 730 37.109 1.859 -28.255 1.00 0.00 C ATOM 68 C GLY A 730 37.197 2.668 -26.964 1.00 0.00 C ATOM 69 O GLY A 730 38.149 3.392 -26.740 1.00 0.00 O ATOM 0 H GLY A 730 38.131 3.457 -29.233 1.00 0.00 H new ATOM 0 HA2 GLY A 730 36.111 1.434 -28.365 1.00 0.00 H new ATOM 0 HA3 GLY A 730 37.810 1.024 -28.224 1.00 0.00 H new ATOM 73 N VAL A 731 36.220 2.557 -26.106 1.00 0.00 N ATOM 74 CA VAL A 731 36.267 3.330 -24.836 1.00 0.00 C ATOM 75 C VAL A 731 35.517 2.594 -23.722 1.00 0.00 C ATOM 76 O VAL A 731 34.325 2.370 -23.803 1.00 0.00 O ATOM 77 CB VAL A 731 35.571 4.651 -25.158 1.00 0.00 C ATOM 78 CG1 VAL A 731 36.418 5.446 -26.152 1.00 0.00 C ATOM 79 CG2 VAL A 731 34.198 4.369 -25.771 1.00 0.00 C ATOM 0 H VAL A 731 35.397 1.968 -26.229 1.00 0.00 H new ATOM 0 HA VAL A 731 37.289 3.472 -24.483 1.00 0.00 H new ATOM 0 HB VAL A 731 35.449 5.228 -24.242 1.00 0.00 H new ATOM 0 HG11 VAL A 731 35.921 6.389 -26.381 1.00 0.00 H new ATOM 0 HG12 VAL A 731 37.396 5.648 -25.716 1.00 0.00 H new ATOM 0 HG13 VAL A 731 36.542 4.869 -27.068 1.00 0.00 H new ATOM 0 HG21 VAL A 731 33.701 5.312 -26.001 1.00 0.00 H new ATOM 0 HG22 VAL A 731 34.320 3.791 -26.687 1.00 0.00 H new ATOM 0 HG23 VAL A 731 33.593 3.803 -25.063 1.00 0.00 H new ATOM 89 N CYS A 732 36.209 2.216 -22.682 1.00 0.00 N ATOM 90 CA CYS A 732 35.540 1.499 -21.562 1.00 0.00 C ATOM 91 C CYS A 732 35.466 2.421 -20.343 1.00 0.00 C ATOM 92 O CYS A 732 36.433 3.065 -19.984 1.00 0.00 O ATOM 93 CB CYS A 732 36.421 0.275 -21.276 1.00 0.00 C ATOM 94 SG CYS A 732 37.941 0.788 -20.430 1.00 0.00 S ATOM 0 H CYS A 732 37.209 2.373 -22.560 1.00 0.00 H new ATOM 0 HA CYS A 732 34.520 1.199 -21.803 1.00 0.00 H new ATOM 0 HB2 CYS A 732 35.876 -0.440 -20.660 1.00 0.00 H new ATOM 0 HB3 CYS A 732 36.668 -0.232 -22.209 1.00 0.00 H new ATOM 99 N ALA A 733 34.334 2.495 -19.704 1.00 0.00 N ATOM 100 CA ALA A 733 34.217 3.384 -18.512 1.00 0.00 C ATOM 101 C ALA A 733 34.108 2.556 -17.229 1.00 0.00 C ATOM 102 O ALA A 733 33.233 1.726 -17.084 1.00 0.00 O ATOM 103 CB ALA A 733 32.936 4.182 -18.746 1.00 0.00 C ATOM 0 H ALA A 733 33.488 1.982 -19.952 1.00 0.00 H new ATOM 0 HA ALA A 733 35.088 4.028 -18.392 1.00 0.00 H new ATOM 0 HB1 ALA A 733 32.775 4.864 -17.911 1.00 0.00 H new ATOM 0 HB2 ALA A 733 33.027 4.754 -19.669 1.00 0.00 H new ATOM 0 HB3 ALA A 733 32.091 3.498 -18.825 1.00 0.00 H new ATOM 109 N ASP A 734 34.993 2.780 -16.297 1.00 0.00 N ATOM 110 CA ASP A 734 34.943 2.009 -15.022 1.00 0.00 C ATOM 111 C ASP A 734 34.556 2.932 -13.863 1.00 0.00 C ATOM 112 O ASP A 734 35.285 3.837 -13.506 1.00 0.00 O ATOM 113 CB ASP A 734 36.359 1.467 -14.828 1.00 0.00 C ATOM 114 CG ASP A 734 36.305 0.186 -13.994 1.00 0.00 C ATOM 115 OD1 ASP A 734 35.294 -0.035 -13.347 1.00 0.00 O ATOM 116 OD2 ASP A 734 37.275 -0.554 -14.018 1.00 0.00 O ATOM 0 H ASP A 734 35.748 3.463 -16.363 1.00 0.00 H new ATOM 0 HA ASP A 734 34.204 1.209 -15.052 1.00 0.00 H new ATOM 0 HB2 ASP A 734 36.818 1.265 -15.796 1.00 0.00 H new ATOM 0 HB3 ASP A 734 36.980 2.212 -14.330 1.00 0.00 H new ATOM 121 N VAL A 735 33.414 2.711 -13.273 1.00 0.00 N ATOM 122 CA VAL A 735 32.980 3.577 -12.136 1.00 0.00 C ATOM 123 C VAL A 735 32.710 2.725 -10.890 1.00 0.00 C ATOM 124 O VAL A 735 32.416 1.551 -10.982 1.00 0.00 O ATOM 125 CB VAL A 735 31.688 4.240 -12.614 1.00 0.00 C ATOM 126 CG1 VAL A 735 31.282 5.338 -11.630 1.00 0.00 C ATOM 127 CG2 VAL A 735 31.910 4.853 -13.998 1.00 0.00 C ATOM 0 H VAL A 735 32.762 1.969 -13.527 1.00 0.00 H new ATOM 0 HA VAL A 735 33.741 4.308 -11.864 1.00 0.00 H new ATOM 0 HB VAL A 735 30.897 3.492 -12.670 1.00 0.00 H new ATOM 0 HG11 VAL A 735 30.361 5.810 -11.971 1.00 0.00 H new ATOM 0 HG12 VAL A 735 31.122 4.902 -10.644 1.00 0.00 H new ATOM 0 HG13 VAL A 735 32.073 6.086 -11.572 1.00 0.00 H new ATOM 0 HG21 VAL A 735 30.989 5.326 -14.339 1.00 0.00 H new ATOM 0 HG22 VAL A 735 32.702 5.600 -13.942 1.00 0.00 H new ATOM 0 HG23 VAL A 735 32.198 4.071 -14.700 1.00 0.00 H new ATOM 137 N SER A 736 32.807 3.310 -9.727 1.00 0.00 N ATOM 138 CA SER A 736 32.556 2.532 -8.477 1.00 0.00 C ATOM 139 C SER A 736 31.198 2.929 -7.881 1.00 0.00 C ATOM 140 O SER A 736 31.047 3.992 -7.310 1.00 0.00 O ATOM 141 CB SER A 736 33.695 2.915 -7.534 1.00 0.00 C ATOM 142 OG SER A 736 33.164 3.229 -6.252 1.00 0.00 O ATOM 0 H SER A 736 33.049 4.291 -9.587 1.00 0.00 H new ATOM 0 HA SER A 736 32.526 1.457 -8.653 1.00 0.00 H new ATOM 0 HB2 SER A 736 34.407 2.093 -7.453 1.00 0.00 H new ATOM 0 HB3 SER A 736 34.240 3.770 -7.933 1.00 0.00 H new ATOM 0 HG SER A 736 32.545 3.985 -6.330 1.00 0.00 H new ATOM 148 N GLU A 737 30.213 2.081 -8.015 1.00 0.00 N ATOM 149 CA GLU A 737 28.859 2.396 -7.462 1.00 0.00 C ATOM 150 C GLU A 737 28.974 3.098 -6.104 1.00 0.00 C ATOM 151 O GLU A 737 29.785 2.743 -5.274 1.00 0.00 O ATOM 152 CB GLU A 737 28.175 1.041 -7.300 1.00 0.00 C ATOM 153 CG GLU A 737 26.901 1.004 -8.144 1.00 0.00 C ATOM 154 CD GLU A 737 25.749 1.638 -7.362 1.00 0.00 C ATOM 155 OE1 GLU A 737 25.609 2.849 -7.427 1.00 0.00 O ATOM 156 OE2 GLU A 737 25.026 0.903 -6.712 1.00 0.00 O ATOM 0 H GLU A 737 30.286 1.179 -8.486 1.00 0.00 H new ATOM 0 HA GLU A 737 28.301 3.068 -8.115 1.00 0.00 H new ATOM 0 HB2 GLU A 737 28.850 0.243 -7.608 1.00 0.00 H new ATOM 0 HB3 GLU A 737 27.933 0.868 -6.251 1.00 0.00 H new ATOM 0 HG2 GLU A 737 27.057 1.540 -9.080 1.00 0.00 H new ATOM 0 HG3 GLU A 737 26.654 -0.026 -8.404 1.00 0.00 H new ATOM 479 N THR A 757 23.117 9.103 -6.456 1.00 0.00 N ATOM 480 CA THR A 757 23.520 7.878 -7.207 1.00 0.00 C ATOM 481 C THR A 757 24.691 8.188 -8.145 1.00 0.00 C ATOM 482 O THR A 757 24.957 9.329 -8.466 1.00 0.00 O ATOM 483 CB THR A 757 22.282 7.483 -8.011 1.00 0.00 C ATOM 484 OG1 THR A 757 21.669 8.652 -8.539 1.00 0.00 O ATOM 485 CG2 THR A 757 21.293 6.752 -7.105 1.00 0.00 C ATOM 0 HA THR A 757 23.850 7.079 -6.543 1.00 0.00 H new ATOM 0 HB THR A 757 22.576 6.825 -8.829 1.00 0.00 H new ATOM 0 HG1 THR A 757 21.881 9.419 -7.967 1.00 0.00 H new ATOM 0 HG21 THR A 757 20.411 6.471 -7.681 1.00 0.00 H new ATOM 0 HG22 THR A 757 21.763 5.855 -6.702 1.00 0.00 H new ATOM 0 HG23 THR A 757 20.998 7.407 -6.285 1.00 0.00 H new ATOM 493 N ALA A 758 25.391 7.178 -8.586 1.00 0.00 N ATOM 494 CA ALA A 758 26.544 7.412 -9.503 1.00 0.00 C ATOM 495 C ALA A 758 26.060 7.439 -10.956 1.00 0.00 C ATOM 496 O ALA A 758 24.929 7.106 -11.248 1.00 0.00 O ATOM 497 CB ALA A 758 27.483 6.229 -9.270 1.00 0.00 C ATOM 0 H ALA A 758 25.215 6.201 -8.351 1.00 0.00 H new ATOM 0 HA ALA A 758 27.039 8.365 -9.314 1.00 0.00 H new ATOM 0 HB1 ALA A 758 28.359 6.328 -9.911 1.00 0.00 H new ATOM 0 HB2 ALA A 758 27.797 6.214 -8.226 1.00 0.00 H new ATOM 0 HB3 ALA A 758 26.964 5.300 -9.507 1.00 0.00 H new ATOM 503 N LYS A 759 26.905 7.832 -11.871 1.00 0.00 N ATOM 504 CA LYS A 759 26.483 7.877 -13.303 1.00 0.00 C ATOM 505 C LYS A 759 27.608 7.373 -14.212 1.00 0.00 C ATOM 506 O LYS A 759 28.771 7.416 -13.863 1.00 0.00 O ATOM 507 CB LYS A 759 26.193 9.350 -13.585 1.00 0.00 C ATOM 508 CG LYS A 759 24.806 9.485 -14.217 1.00 0.00 C ATOM 509 CD LYS A 759 23.830 10.057 -13.189 1.00 0.00 C ATOM 510 CE LYS A 759 23.003 11.172 -13.834 1.00 0.00 C ATOM 511 NZ LYS A 759 21.985 10.467 -14.661 1.00 0.00 N ATOM 0 H LYS A 759 27.866 8.123 -11.691 1.00 0.00 H new ATOM 0 HA LYS A 759 25.617 7.243 -13.492 1.00 0.00 H new ATOM 0 HB2 LYS A 759 26.240 9.925 -12.660 1.00 0.00 H new ATOM 0 HB3 LYS A 759 26.950 9.759 -14.254 1.00 0.00 H new ATOM 0 HG2 LYS A 759 24.854 10.136 -15.090 1.00 0.00 H new ATOM 0 HG3 LYS A 759 24.457 8.513 -14.564 1.00 0.00 H new ATOM 0 HD2 LYS A 759 23.173 9.270 -12.819 1.00 0.00 H new ATOM 0 HD3 LYS A 759 24.377 10.446 -12.330 1.00 0.00 H new ATOM 0 HE2 LYS A 759 22.531 11.801 -13.079 1.00 0.00 H new ATOM 0 HE3 LYS A 759 23.627 11.823 -14.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 759 21.327 11.162 -15.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 759 22.459 9.949 -15.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 759 21.457 9.797 -14.065 1.00 0.00 H new ATOM 525 N VAL A 760 27.265 6.897 -15.376 1.00 0.00 N ATOM 526 CA VAL A 760 28.302 6.388 -16.319 1.00 0.00 C ATOM 527 C VAL A 760 28.430 7.348 -17.506 1.00 0.00 C ATOM 528 O VAL A 760 27.447 7.849 -18.015 1.00 0.00 O ATOM 529 CB VAL A 760 27.781 5.027 -16.776 1.00 0.00 C ATOM 530 CG1 VAL A 760 28.608 4.533 -17.967 1.00 0.00 C ATOM 531 CG2 VAL A 760 27.896 4.026 -15.619 1.00 0.00 C ATOM 0 H VAL A 760 26.306 6.838 -15.717 1.00 0.00 H new ATOM 0 HA VAL A 760 29.288 6.308 -15.862 1.00 0.00 H new ATOM 0 HB VAL A 760 26.737 5.118 -17.077 1.00 0.00 H new ATOM 0 HG11 VAL A 760 28.235 3.562 -18.291 1.00 0.00 H new ATOM 0 HG12 VAL A 760 28.526 5.246 -18.788 1.00 0.00 H new ATOM 0 HG13 VAL A 760 29.653 4.439 -17.671 1.00 0.00 H new ATOM 0 HG21 VAL A 760 27.525 3.053 -15.941 1.00 0.00 H new ATOM 0 HG22 VAL A 760 28.940 3.935 -15.319 1.00 0.00 H new ATOM 0 HG23 VAL A 760 27.305 4.378 -14.773 1.00 0.00 H new ATOM 541 N HIS A 761 29.628 7.609 -17.952 1.00 0.00 N ATOM 542 CA HIS A 761 29.798 8.539 -19.106 1.00 0.00 C ATOM 543 C HIS A 761 30.357 7.803 -20.330 1.00 0.00 C ATOM 544 O HIS A 761 31.493 7.373 -20.348 1.00 0.00 O ATOM 545 CB HIS A 761 30.788 9.597 -18.619 1.00 0.00 C ATOM 546 CG HIS A 761 30.031 10.804 -18.137 1.00 0.00 C ATOM 547 ND1 HIS A 761 30.437 11.540 -17.034 1.00 0.00 N ATOM 548 CD2 HIS A 761 28.892 11.415 -18.597 1.00 0.00 C ATOM 549 CE1 HIS A 761 29.554 12.544 -16.870 1.00 0.00 C ATOM 550 NE2 HIS A 761 28.592 12.513 -17.796 1.00 0.00 N ATOM 0 H HIS A 761 30.491 7.222 -17.571 1.00 0.00 H new ATOM 0 HA HIS A 761 28.848 8.974 -19.417 1.00 0.00 H new ATOM 0 HB2 HIS A 761 31.402 9.193 -17.814 1.00 0.00 H new ATOM 0 HB3 HIS A 761 31.465 9.877 -19.426 1.00 0.00 H new ATOM 0 HD2 HIS A 761 28.315 11.093 -19.451 1.00 0.00 H new ATOM 0 HE1 HIS A 761 29.616 13.284 -16.086 1.00 0.00 H new ATOM 0 HE2 HIS A 761 27.806 13.156 -17.895 1.00 0.00 H new ATOM 558 N LEU A 762 29.557 7.657 -21.349 1.00 0.00 N ATOM 559 CA LEU A 762 30.018 6.953 -22.582 1.00 0.00 C ATOM 560 C LEU A 762 29.702 7.827 -23.798 1.00 0.00 C ATOM 561 O LEU A 762 28.557 8.104 -24.084 1.00 0.00 O ATOM 562 CB LEU A 762 29.216 5.652 -22.628 1.00 0.00 C ATOM 563 CG LEU A 762 30.014 4.537 -21.954 1.00 0.00 C ATOM 564 CD1 LEU A 762 29.052 3.531 -21.322 1.00 0.00 C ATOM 565 CD2 LEU A 762 30.879 3.828 -22.998 1.00 0.00 C ATOM 0 H LEU A 762 28.596 7.997 -21.382 1.00 0.00 H new ATOM 0 HA LEU A 762 31.090 6.755 -22.583 1.00 0.00 H new ATOM 0 HB2 LEU A 762 28.259 5.784 -22.124 1.00 0.00 H new ATOM 0 HB3 LEU A 762 28.997 5.384 -23.662 1.00 0.00 H new ATOM 0 HG LEU A 762 30.653 4.964 -21.181 1.00 0.00 H new ATOM 0 HD11 LEU A 762 29.621 2.736 -20.841 1.00 0.00 H new ATOM 0 HD12 LEU A 762 28.435 4.035 -20.579 1.00 0.00 H new ATOM 0 HD13 LEU A 762 28.413 3.104 -22.095 1.00 0.00 H new ATOM 0 HD21 LEU A 762 31.449 3.032 -22.519 1.00 0.00 H new ATOM 0 HD22 LEU A 762 30.240 3.401 -23.771 1.00 0.00 H new ATOM 0 HD23 LEU A 762 31.565 4.545 -23.449 1.00 0.00 H new ATOM 577 N LYS A 763 30.698 8.259 -24.520 1.00 0.00 N ATOM 578 CA LYS A 763 30.422 9.115 -25.711 1.00 0.00 C ATOM 579 C LYS A 763 31.376 8.791 -26.862 1.00 0.00 C ATOM 580 O LYS A 763 32.374 8.121 -26.695 1.00 0.00 O ATOM 581 CB LYS A 763 30.642 10.549 -25.221 1.00 0.00 C ATOM 582 CG LYS A 763 32.072 10.698 -24.686 1.00 0.00 C ATOM 583 CD LYS A 763 32.114 10.289 -23.211 1.00 0.00 C ATOM 584 CE LYS A 763 33.184 11.103 -22.483 1.00 0.00 C ATOM 585 NZ LYS A 763 33.754 10.168 -21.476 1.00 0.00 N ATOM 0 H LYS A 763 31.682 8.060 -24.341 1.00 0.00 H new ATOM 0 HA LYS A 763 29.415 8.955 -26.097 1.00 0.00 H new ATOM 0 HB2 LYS A 763 30.473 11.252 -26.036 1.00 0.00 H new ATOM 0 HB3 LYS A 763 29.923 10.790 -24.438 1.00 0.00 H new ATOM 0 HG2 LYS A 763 32.754 10.076 -25.266 1.00 0.00 H new ATOM 0 HG3 LYS A 763 32.407 11.729 -24.798 1.00 0.00 H new ATOM 0 HD2 LYS A 763 31.140 10.454 -22.750 1.00 0.00 H new ATOM 0 HD3 LYS A 763 32.331 9.224 -23.124 1.00 0.00 H new ATOM 0 HE2 LYS A 763 33.950 11.456 -23.173 1.00 0.00 H new ATOM 0 HE3 LYS A 763 32.754 11.984 -22.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 763 34.331 10.701 -20.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 763 32.982 9.686 -20.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 763 34.348 9.462 -21.955 1.00 0.00 H new ATOM 599 N CYS A 764 31.062 9.273 -28.034 1.00 0.00 N ATOM 600 CA CYS A 764 31.925 9.016 -29.218 1.00 0.00 C ATOM 601 C CYS A 764 31.987 10.278 -30.089 1.00 0.00 C ATOM 602 O CYS A 764 31.004 10.967 -30.264 1.00 0.00 O ATOM 603 CB CYS A 764 31.235 7.880 -29.970 1.00 0.00 C ATOM 604 SG CYS A 764 31.917 6.292 -29.435 1.00 0.00 S ATOM 0 H CYS A 764 30.235 9.840 -28.222 1.00 0.00 H new ATOM 0 HA CYS A 764 32.948 8.757 -28.946 1.00 0.00 H new ATOM 0 HB2 CYS A 764 30.161 7.907 -29.784 1.00 0.00 H new ATOM 0 HB3 CYS A 764 31.375 8.004 -31.044 1.00 0.00 H new ATOM 609 N ALA A 765 33.130 10.585 -30.634 1.00 0.00 N ATOM 610 CA ALA A 765 33.242 11.805 -31.491 1.00 0.00 C ATOM 611 C ALA A 765 32.047 11.894 -32.452 1.00 0.00 C ATOM 612 O ALA A 765 31.376 10.912 -32.699 1.00 0.00 O ATOM 613 CB ALA A 765 34.544 11.623 -32.269 1.00 0.00 C ATOM 0 H ALA A 765 33.991 10.048 -30.526 1.00 0.00 H new ATOM 0 HA ALA A 765 33.243 12.723 -30.903 1.00 0.00 H new ATOM 0 HB1 ALA A 765 34.699 12.480 -32.924 1.00 0.00 H new ATOM 0 HB2 ALA A 765 35.377 11.544 -31.571 1.00 0.00 H new ATOM 0 HB3 ALA A 765 34.486 10.714 -32.868 1.00 0.00 H new ATOM 619 N PRO A 766 31.827 13.079 -32.964 1.00 0.00 N ATOM 620 CA PRO A 766 30.707 13.303 -33.905 1.00 0.00 C ATOM 621 C PRO A 766 31.010 12.640 -35.249 1.00 0.00 C ATOM 622 O PRO A 766 31.784 13.139 -36.041 1.00 0.00 O ATOM 623 CB PRO A 766 30.646 14.818 -34.045 1.00 0.00 C ATOM 624 CG PRO A 766 32.028 15.291 -33.708 1.00 0.00 C ATOM 625 CD PRO A 766 32.600 14.300 -32.721 1.00 0.00 C ATOM 0 HA PRO A 766 29.764 12.880 -33.559 1.00 0.00 H new ATOM 0 HB2 PRO A 766 30.364 15.110 -35.056 1.00 0.00 H new ATOM 0 HB3 PRO A 766 29.906 15.248 -33.370 1.00 0.00 H new ATOM 0 HG2 PRO A 766 32.647 15.346 -34.604 1.00 0.00 H new ATOM 0 HG3 PRO A 766 32.000 16.292 -33.278 1.00 0.00 H new ATOM 0 HD2 PRO A 766 33.665 14.139 -32.887 1.00 0.00 H new ATOM 0 HD3 PRO A 766 32.487 14.647 -31.694 1.00 0.00 H new ATOM 633 N GLY A 767 30.403 11.519 -35.511 1.00 0.00 N ATOM 634 CA GLY A 767 30.649 10.818 -36.800 1.00 0.00 C ATOM 635 C GLY A 767 30.637 9.313 -36.553 1.00 0.00 C ATOM 636 O GLY A 767 30.298 8.530 -37.418 1.00 0.00 O ATOM 0 H GLY A 767 29.744 11.056 -34.885 1.00 0.00 H new ATOM 0 HA2 GLY A 767 29.883 11.087 -37.528 1.00 0.00 H new ATOM 0 HA3 GLY A 767 31.608 11.124 -37.219 1.00 0.00 H new ATOM 640 N GLN A 768 31.010 8.900 -35.373 1.00 0.00 N ATOM 641 CA GLN A 768 31.024 7.446 -35.057 1.00 0.00 C ATOM 642 C GLN A 768 29.968 7.142 -33.993 1.00 0.00 C ATOM 643 O GLN A 768 30.057 7.597 -32.869 1.00 0.00 O ATOM 644 CB GLN A 768 32.424 7.171 -34.519 1.00 0.00 C ATOM 645 CG GLN A 768 33.448 7.400 -35.631 1.00 0.00 C ATOM 646 CD GLN A 768 34.408 6.212 -35.687 1.00 0.00 C ATOM 647 OE1 GLN A 768 34.583 5.606 -36.726 1.00 0.00 O ATOM 648 NE2 GLN A 768 35.045 5.854 -34.607 1.00 0.00 N ATOM 0 H GLN A 768 31.307 9.511 -34.612 1.00 0.00 H new ATOM 0 HA GLN A 768 30.798 6.826 -35.924 1.00 0.00 H new ATOM 0 HB2 GLN A 768 32.636 7.826 -33.674 1.00 0.00 H new ATOM 0 HB3 GLN A 768 32.491 6.146 -34.153 1.00 0.00 H new ATOM 0 HG2 GLN A 768 32.941 7.518 -36.589 1.00 0.00 H new ATOM 0 HG3 GLN A 768 34.001 8.321 -35.447 1.00 0.00 H new ATOM 0 HE21 GLN A 768 34.898 6.363 -33.736 1.00 0.00 H new ATOM 0 HE22 GLN A 768 35.691 5.065 -34.634 1.00 0.00 H new ATOM 657 N THR A 769 28.973 6.378 -34.333 1.00 0.00 N ATOM 658 CA THR A 769 27.914 6.050 -33.336 1.00 0.00 C ATOM 659 C THR A 769 28.151 4.659 -32.736 1.00 0.00 C ATOM 660 O THR A 769 28.627 3.759 -33.398 1.00 0.00 O ATOM 661 CB THR A 769 26.608 6.076 -34.128 1.00 0.00 C ATOM 662 OG1 THR A 769 26.696 5.153 -35.207 1.00 0.00 O ATOM 663 CG2 THR A 769 26.367 7.483 -34.676 1.00 0.00 C ATOM 0 H THR A 769 28.844 5.965 -35.257 1.00 0.00 H new ATOM 0 HA THR A 769 27.904 6.752 -32.502 1.00 0.00 H new ATOM 0 HB THR A 769 25.780 5.799 -33.475 1.00 0.00 H new ATOM 0 HG1 THR A 769 25.859 5.165 -35.717 1.00 0.00 H new ATOM 0 HG21 THR A 769 25.435 7.499 -35.241 1.00 0.00 H new ATOM 0 HG22 THR A 769 26.302 8.190 -33.849 1.00 0.00 H new ATOM 0 HG23 THR A 769 27.192 7.765 -35.330 1.00 0.00 H new ATOM 671 N ILE A 770 27.820 4.480 -31.484 1.00 0.00 N ATOM 672 CA ILE A 770 28.027 3.145 -30.843 1.00 0.00 C ATOM 673 C ILE A 770 27.204 2.094 -31.592 1.00 0.00 C ATOM 674 O ILE A 770 25.989 2.117 -31.577 1.00 0.00 O ATOM 675 CB ILE A 770 27.529 3.308 -29.404 1.00 0.00 C ATOM 676 CG1 ILE A 770 28.300 4.444 -28.724 1.00 0.00 C ATOM 677 CG2 ILE A 770 27.762 2.009 -28.630 1.00 0.00 C ATOM 678 CD1 ILE A 770 27.486 4.979 -27.547 1.00 0.00 C ATOM 0 H ILE A 770 27.417 5.196 -30.879 1.00 0.00 H new ATOM 0 HA ILE A 770 29.067 2.820 -30.865 1.00 0.00 H new ATOM 0 HB ILE A 770 26.464 3.540 -29.415 1.00 0.00 H new ATOM 0 HG12 ILE A 770 29.268 4.084 -28.376 1.00 0.00 H new ATOM 0 HG13 ILE A 770 28.495 5.244 -29.438 1.00 0.00 H new ATOM 0 HG21 ILE A 770 27.407 2.127 -27.606 1.00 0.00 H new ATOM 0 HG22 ILE A 770 27.218 1.196 -29.111 1.00 0.00 H new ATOM 0 HG23 ILE A 770 28.827 1.777 -28.620 1.00 0.00 H new ATOM 0 HD11 ILE A 770 28.034 5.787 -27.063 1.00 0.00 H new ATOM 0 HD12 ILE A 770 26.529 5.355 -27.908 1.00 0.00 H new ATOM 0 HD13 ILE A 770 27.314 4.177 -26.829 1.00 0.00 H new ATOM 690 N SER A 771 27.855 1.172 -32.246 1.00 0.00 N ATOM 691 CA SER A 771 27.105 0.123 -32.998 1.00 0.00 C ATOM 692 C SER A 771 26.851 -1.118 -32.130 1.00 0.00 C ATOM 693 O SER A 771 26.132 -2.015 -32.524 1.00 0.00 O ATOM 694 CB SER A 771 28.008 -0.231 -34.176 1.00 0.00 C ATOM 695 OG SER A 771 27.362 -1.206 -34.986 1.00 0.00 O ATOM 0 H SER A 771 28.871 1.098 -32.293 1.00 0.00 H new ATOM 0 HA SER A 771 26.124 0.479 -33.312 1.00 0.00 H new ATOM 0 HB2 SER A 771 28.225 0.661 -34.764 1.00 0.00 H new ATOM 0 HB3 SER A 771 28.962 -0.615 -33.815 1.00 0.00 H new ATOM 0 HG SER A 771 26.660 -1.650 -34.466 1.00 0.00 H new ATOM 701 N ALA A 772 27.419 -1.184 -30.956 1.00 0.00 N ATOM 702 CA ALA A 772 27.183 -2.387 -30.099 1.00 0.00 C ATOM 703 C ALA A 772 27.934 -2.284 -28.770 1.00 0.00 C ATOM 704 O ALA A 772 29.016 -1.736 -28.694 1.00 0.00 O ATOM 705 CB ALA A 772 27.733 -3.558 -30.912 1.00 0.00 C ATOM 0 H ALA A 772 28.028 -0.470 -30.556 1.00 0.00 H new ATOM 0 HA ALA A 772 26.127 -2.497 -29.852 1.00 0.00 H new ATOM 0 HB1 ALA A 772 27.599 -4.484 -30.353 1.00 0.00 H new ATOM 0 HB2 ALA A 772 27.199 -3.626 -31.860 1.00 0.00 H new ATOM 0 HB3 ALA A 772 28.794 -3.401 -31.104 1.00 0.00 H new ATOM 711 N ILE A 773 27.361 -2.814 -27.720 1.00 0.00 N ATOM 712 CA ILE A 773 28.030 -2.757 -26.390 1.00 0.00 C ATOM 713 C ILE A 773 28.951 -3.968 -26.240 1.00 0.00 C ATOM 714 O ILE A 773 28.582 -5.081 -26.555 1.00 0.00 O ATOM 715 CB ILE A 773 26.892 -2.810 -25.370 1.00 0.00 C ATOM 716 CG1 ILE A 773 25.843 -1.756 -25.728 1.00 0.00 C ATOM 717 CG2 ILE A 773 27.444 -2.529 -23.972 1.00 0.00 C ATOM 718 CD1 ILE A 773 26.465 -0.361 -25.628 1.00 0.00 C ATOM 0 H ILE A 773 26.456 -3.285 -27.729 1.00 0.00 H new ATOM 0 HA ILE A 773 28.640 -1.864 -26.258 1.00 0.00 H new ATOM 0 HB ILE A 773 26.435 -3.799 -25.384 1.00 0.00 H new ATOM 0 HG12 ILE A 773 25.470 -1.928 -26.738 1.00 0.00 H new ATOM 0 HG13 ILE A 773 24.989 -1.834 -25.055 1.00 0.00 H new ATOM 0 HG21 ILE A 773 26.632 -2.567 -23.246 1.00 0.00 H new ATOM 0 HG22 ILE A 773 28.193 -3.280 -23.719 1.00 0.00 H new ATOM 0 HG23 ILE A 773 27.901 -1.540 -23.953 1.00 0.00 H new ATOM 0 HD11 ILE A 773 25.717 0.390 -25.883 1.00 0.00 H new ATOM 0 HD12 ILE A 773 26.817 -0.192 -24.610 1.00 0.00 H new ATOM 0 HD13 ILE A 773 27.305 -0.287 -26.319 1.00 0.00 H new ATOM 730 N LYS A 774 30.142 -3.766 -25.758 1.00 0.00 N ATOM 731 CA LYS A 774 31.080 -4.915 -25.594 1.00 0.00 C ATOM 732 C LYS A 774 30.728 -5.730 -24.344 1.00 0.00 C ATOM 733 O LYS A 774 30.853 -6.938 -24.332 1.00 0.00 O ATOM 734 CB LYS A 774 32.462 -4.277 -25.455 1.00 0.00 C ATOM 735 CG LYS A 774 33.498 -5.352 -25.100 1.00 0.00 C ATOM 736 CD LYS A 774 33.952 -6.067 -26.376 1.00 0.00 C ATOM 737 CE LYS A 774 35.255 -5.437 -26.881 1.00 0.00 C ATOM 738 NZ LYS A 774 36.340 -6.297 -26.330 1.00 0.00 N ATOM 0 H LYS A 774 30.509 -2.859 -25.470 1.00 0.00 H new ATOM 0 HA LYS A 774 31.031 -5.607 -26.435 1.00 0.00 H new ATOM 0 HB2 LYS A 774 32.740 -3.784 -26.387 1.00 0.00 H new ATOM 0 HB3 LYS A 774 32.442 -3.509 -24.682 1.00 0.00 H new ATOM 0 HG2 LYS A 774 34.354 -4.897 -24.602 1.00 0.00 H new ATOM 0 HG3 LYS A 774 33.068 -6.070 -24.402 1.00 0.00 H new ATOM 0 HD2 LYS A 774 34.102 -7.128 -26.177 1.00 0.00 H new ATOM 0 HD3 LYS A 774 33.179 -5.993 -27.141 1.00 0.00 H new ATOM 0 HE2 LYS A 774 35.285 -5.413 -27.970 1.00 0.00 H new ATOM 0 HE3 LYS A 774 35.355 -4.408 -26.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 37.264 -5.928 -26.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 36.291 -6.295 -25.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 36.224 -7.269 -26.680 1.00 0.00 H new ATOM 752 N PHE A 775 30.282 -5.085 -23.297 1.00 0.00 N ATOM 753 CA PHE A 775 29.927 -5.846 -22.055 1.00 0.00 C ATOM 754 C PHE A 775 29.519 -4.891 -20.926 1.00 0.00 C ATOM 755 O PHE A 775 29.966 -3.762 -20.855 1.00 0.00 O ATOM 756 CB PHE A 775 31.206 -6.601 -21.674 1.00 0.00 C ATOM 757 CG PHE A 775 31.058 -7.184 -20.286 1.00 0.00 C ATOM 758 CD1 PHE A 775 30.493 -8.454 -20.114 1.00 0.00 C ATOM 759 CD2 PHE A 775 31.488 -6.454 -19.171 1.00 0.00 C ATOM 760 CE1 PHE A 775 30.359 -8.993 -18.829 1.00 0.00 C ATOM 761 CE2 PHE A 775 31.353 -6.994 -17.886 1.00 0.00 C ATOM 762 CZ PHE A 775 30.790 -8.264 -17.715 1.00 0.00 C ATOM 0 H PHE A 775 30.148 -4.075 -23.245 1.00 0.00 H new ATOM 0 HA PHE A 775 29.082 -6.515 -22.219 1.00 0.00 H new ATOM 0 HB2 PHE A 775 31.399 -7.396 -22.394 1.00 0.00 H new ATOM 0 HB3 PHE A 775 32.062 -5.927 -21.707 1.00 0.00 H new ATOM 0 HD1 PHE A 775 30.161 -9.018 -20.973 1.00 0.00 H new ATOM 0 HD2 PHE A 775 31.924 -5.475 -19.302 1.00 0.00 H new ATOM 0 HE1 PHE A 775 29.923 -9.972 -18.697 1.00 0.00 H new ATOM 0 HE2 PHE A 775 31.684 -6.430 -17.026 1.00 0.00 H new ATOM 0 HZ PHE A 775 30.688 -8.681 -16.724 1.00 0.00 H new ATOM 772 N ALA A 776 28.669 -5.343 -20.047 1.00 0.00 N ATOM 773 CA ALA A 776 28.217 -4.487 -18.913 1.00 0.00 C ATOM 774 C ALA A 776 28.042 -5.360 -17.671 1.00 0.00 C ATOM 775 O ALA A 776 27.657 -6.507 -17.767 1.00 0.00 O ATOM 776 CB ALA A 776 26.876 -3.902 -19.358 1.00 0.00 C ATOM 0 H ALA A 776 28.264 -6.279 -20.066 1.00 0.00 H new ATOM 0 HA ALA A 776 28.928 -3.699 -18.666 1.00 0.00 H new ATOM 0 HB1 ALA A 776 26.481 -3.259 -18.572 1.00 0.00 H new ATOM 0 HB2 ALA A 776 27.018 -3.318 -20.267 1.00 0.00 H new ATOM 0 HB3 ALA A 776 26.172 -4.712 -19.552 1.00 0.00 H new ATOM 782 N SER A 777 28.319 -4.843 -16.508 1.00 0.00 N ATOM 783 CA SER A 777 28.156 -5.679 -15.282 1.00 0.00 C ATOM 784 C SER A 777 27.896 -4.817 -14.043 1.00 0.00 C ATOM 785 O SER A 777 28.704 -3.995 -13.662 1.00 0.00 O ATOM 786 CB SER A 777 29.479 -6.423 -15.144 1.00 0.00 C ATOM 787 OG SER A 777 30.541 -5.480 -15.071 1.00 0.00 O ATOM 0 H SER A 777 28.647 -3.890 -16.351 1.00 0.00 H new ATOM 0 HA SER A 777 27.302 -6.351 -15.365 1.00 0.00 H new ATOM 0 HB2 SER A 777 29.468 -7.046 -14.250 1.00 0.00 H new ATOM 0 HB3 SER A 777 29.626 -7.089 -15.994 1.00 0.00 H new ATOM 0 HG SER A 777 30.276 -4.733 -14.494 1.00 0.00 H new ATOM 793 N PHE A 778 26.765 -5.004 -13.415 1.00 0.00 N ATOM 794 CA PHE A 778 26.441 -4.202 -12.197 1.00 0.00 C ATOM 795 C PHE A 778 26.598 -5.078 -10.952 1.00 0.00 C ATOM 796 O PHE A 778 25.936 -6.089 -10.808 1.00 0.00 O ATOM 797 CB PHE A 778 24.982 -3.773 -12.372 1.00 0.00 C ATOM 798 CG PHE A 778 24.454 -3.229 -11.062 1.00 0.00 C ATOM 799 CD1 PHE A 778 23.467 -3.928 -10.355 1.00 0.00 C ATOM 800 CD2 PHE A 778 24.953 -2.022 -10.555 1.00 0.00 C ATOM 801 CE1 PHE A 778 22.980 -3.419 -9.142 1.00 0.00 C ATOM 802 CE2 PHE A 778 24.466 -1.515 -9.344 1.00 0.00 C ATOM 803 CZ PHE A 778 23.480 -2.214 -8.638 1.00 0.00 C ATOM 0 H PHE A 778 26.051 -5.677 -13.692 1.00 0.00 H new ATOM 0 HA PHE A 778 27.099 -3.341 -12.076 1.00 0.00 H new ATOM 0 HB2 PHE A 778 24.906 -3.013 -13.150 1.00 0.00 H new ATOM 0 HB3 PHE A 778 24.379 -4.621 -12.695 1.00 0.00 H new ATOM 0 HD1 PHE A 778 23.081 -4.859 -10.744 1.00 0.00 H new ATOM 0 HD2 PHE A 778 25.714 -1.482 -11.099 1.00 0.00 H new ATOM 0 HE1 PHE A 778 22.219 -3.958 -8.597 1.00 0.00 H new ATOM 0 HE2 PHE A 778 24.851 -0.584 -8.955 1.00 0.00 H new ATOM 0 HZ PHE A 778 23.105 -1.823 -7.704 1.00 0.00 H new ATOM 813 N GLY A 779 27.462 -4.707 -10.046 1.00 0.00 N ATOM 814 CA GLY A 779 27.643 -5.532 -8.822 1.00 0.00 C ATOM 815 C GLY A 779 29.135 -5.738 -8.548 1.00 0.00 C ATOM 816 O GLY A 779 29.801 -4.875 -8.007 1.00 0.00 O ATOM 0 H GLY A 779 28.046 -3.873 -10.101 1.00 0.00 H new ATOM 0 HA2 GLY A 779 27.172 -5.042 -7.970 1.00 0.00 H new ATOM 0 HA3 GLY A 779 27.151 -6.496 -8.947 1.00 0.00 H new ATOM 820 N THR A 780 29.670 -6.878 -8.913 1.00 0.00 N ATOM 821 CA THR A 780 31.122 -7.135 -8.669 1.00 0.00 C ATOM 822 C THR A 780 31.768 -7.788 -9.897 1.00 0.00 C ATOM 823 O THR A 780 31.733 -8.992 -10.050 1.00 0.00 O ATOM 824 CB THR A 780 31.150 -8.089 -7.480 1.00 0.00 C ATOM 825 OG1 THR A 780 30.599 -9.340 -7.868 1.00 0.00 O ATOM 826 CG2 THR A 780 30.327 -7.501 -6.335 1.00 0.00 C ATOM 0 H THR A 780 29.165 -7.639 -9.368 1.00 0.00 H new ATOM 0 HA THR A 780 31.677 -6.217 -8.477 1.00 0.00 H new ATOM 0 HB THR A 780 32.179 -8.231 -7.150 1.00 0.00 H new ATOM 0 HG1 THR A 780 31.134 -9.721 -8.595 1.00 0.00 H new ATOM 0 HG21 THR A 780 30.347 -8.183 -5.485 1.00 0.00 H new ATOM 0 HG22 THR A 780 30.749 -6.540 -6.040 1.00 0.00 H new ATOM 0 HG23 THR A 780 29.297 -7.360 -6.662 1.00 0.00 H new ATOM 834 N PRO A 781 32.335 -6.961 -10.735 1.00 0.00 N ATOM 835 CA PRO A 781 32.996 -7.454 -11.958 1.00 0.00 C ATOM 836 C PRO A 781 34.413 -7.947 -11.644 1.00 0.00 C ATOM 837 O PRO A 781 35.011 -7.562 -10.658 1.00 0.00 O ATOM 838 CB PRO A 781 33.047 -6.231 -12.858 1.00 0.00 C ATOM 839 CG PRO A 781 33.015 -5.048 -11.927 1.00 0.00 C ATOM 840 CD PRO A 781 32.392 -5.506 -10.621 1.00 0.00 C ATOM 0 HA PRO A 781 32.472 -8.295 -12.412 1.00 0.00 H new ATOM 0 HB2 PRO A 781 33.952 -6.228 -13.466 1.00 0.00 H new ATOM 0 HB3 PRO A 781 32.201 -6.213 -13.545 1.00 0.00 H new ATOM 0 HG2 PRO A 781 34.022 -4.667 -11.758 1.00 0.00 H new ATOM 0 HG3 PRO A 781 32.436 -4.234 -12.363 1.00 0.00 H new ATOM 0 HD2 PRO A 781 32.992 -5.198 -9.765 1.00 0.00 H new ATOM 0 HD3 PRO A 781 31.399 -5.079 -10.484 1.00 0.00 H new ATOM 848 N LEU A 782 34.954 -8.793 -12.477 1.00 0.00 N ATOM 849 CA LEU A 782 36.330 -9.310 -12.228 1.00 0.00 C ATOM 850 C LEU A 782 37.293 -8.787 -13.305 1.00 0.00 C ATOM 851 O LEU A 782 36.996 -8.816 -14.482 1.00 0.00 O ATOM 852 CB LEU A 782 36.201 -10.830 -12.313 1.00 0.00 C ATOM 853 CG LEU A 782 36.652 -11.451 -10.991 1.00 0.00 C ATOM 854 CD1 LEU A 782 36.497 -12.971 -11.061 1.00 0.00 C ATOM 855 CD2 LEU A 782 38.118 -11.099 -10.741 1.00 0.00 C ATOM 0 H LEU A 782 34.503 -9.149 -13.320 1.00 0.00 H new ATOM 0 HA LEU A 782 36.727 -8.989 -11.265 1.00 0.00 H new ATOM 0 HB2 LEU A 782 35.168 -11.107 -12.525 1.00 0.00 H new ATOM 0 HB3 LEU A 782 36.808 -11.213 -13.133 1.00 0.00 H new ATOM 0 HG LEU A 782 36.039 -11.062 -10.178 1.00 0.00 H new ATOM 0 HD11 LEU A 782 36.819 -13.413 -10.118 1.00 0.00 H new ATOM 0 HD12 LEU A 782 35.452 -13.222 -11.242 1.00 0.00 H new ATOM 0 HD13 LEU A 782 37.110 -13.362 -11.873 1.00 0.00 H new ATOM 0 HD21 LEU A 782 38.443 -11.540 -9.799 1.00 0.00 H new ATOM 0 HD22 LEU A 782 38.730 -11.489 -11.554 1.00 0.00 H new ATOM 0 HD23 LEU A 782 38.229 -10.016 -10.691 1.00 0.00 H new ATOM 867 N GLY A 783 38.442 -8.310 -12.906 1.00 0.00 N ATOM 868 CA GLY A 783 39.421 -7.787 -13.905 1.00 0.00 C ATOM 869 C GLY A 783 39.084 -6.333 -14.249 1.00 0.00 C ATOM 870 O GLY A 783 38.255 -5.711 -13.614 1.00 0.00 O ATOM 0 H GLY A 783 38.745 -8.260 -11.933 1.00 0.00 H new ATOM 0 HA2 GLY A 783 40.433 -7.850 -13.504 1.00 0.00 H new ATOM 0 HA3 GLY A 783 39.396 -8.399 -14.807 1.00 0.00 H new ATOM 874 N THR A 784 39.724 -5.785 -15.250 1.00 0.00 N ATOM 875 CA THR A 784 39.441 -4.369 -15.636 1.00 0.00 C ATOM 876 C THR A 784 39.121 -4.273 -17.136 1.00 0.00 C ATOM 877 O THR A 784 38.470 -5.131 -17.697 1.00 0.00 O ATOM 878 CB THR A 784 40.727 -3.609 -15.311 1.00 0.00 C ATOM 879 OG1 THR A 784 41.766 -4.045 -16.179 1.00 0.00 O ATOM 880 CG2 THR A 784 41.126 -3.874 -13.859 1.00 0.00 C ATOM 0 H THR A 784 40.430 -6.256 -15.816 1.00 0.00 H new ATOM 0 HA THR A 784 38.579 -3.963 -15.107 1.00 0.00 H new ATOM 0 HB THR A 784 40.563 -2.540 -15.450 1.00 0.00 H new ATOM 0 HG1 THR A 784 42.591 -3.557 -15.973 1.00 0.00 H new ATOM 0 HG21 THR A 784 42.043 -3.332 -13.629 1.00 0.00 H new ATOM 0 HG22 THR A 784 40.329 -3.538 -13.196 1.00 0.00 H new ATOM 0 HG23 THR A 784 41.291 -4.942 -13.716 1.00 0.00 H new ATOM 888 N CYS A 785 39.578 -3.233 -17.786 1.00 0.00 N ATOM 889 CA CYS A 785 39.300 -3.080 -19.248 1.00 0.00 C ATOM 890 C CYS A 785 40.237 -3.978 -20.067 1.00 0.00 C ATOM 891 O CYS A 785 41.383 -3.650 -20.293 1.00 0.00 O ATOM 892 CB CYS A 785 39.577 -1.607 -19.554 1.00 0.00 C ATOM 893 SG CYS A 785 38.189 -0.596 -18.977 1.00 0.00 S ATOM 0 H CYS A 785 40.131 -2.484 -17.369 1.00 0.00 H new ATOM 0 HA CYS A 785 38.280 -3.368 -19.502 1.00 0.00 H new ATOM 0 HB2 CYS A 785 40.499 -1.291 -19.065 1.00 0.00 H new ATOM 0 HB3 CYS A 785 39.721 -1.468 -20.626 1.00 0.00 H new ATOM 898 N GLY A 786 39.754 -5.109 -20.513 1.00 0.00 N ATOM 899 CA GLY A 786 40.622 -6.021 -21.315 1.00 0.00 C ATOM 900 C GLY A 786 40.356 -7.476 -20.923 1.00 0.00 C ATOM 901 O GLY A 786 40.766 -8.395 -21.606 1.00 0.00 O ATOM 0 H GLY A 786 38.801 -5.439 -20.357 1.00 0.00 H new ATOM 0 HA2 GLY A 786 40.427 -5.881 -22.378 1.00 0.00 H new ATOM 0 HA3 GLY A 786 41.671 -5.777 -21.149 1.00 0.00 H new ATOM 905 N THR A 787 39.676 -7.700 -19.831 1.00 0.00 N ATOM 906 CA THR A 787 39.394 -9.107 -19.411 1.00 0.00 C ATOM 907 C THR A 787 38.205 -9.159 -18.445 1.00 0.00 C ATOM 908 O THR A 787 38.182 -9.945 -17.519 1.00 0.00 O ATOM 909 CB THR A 787 40.670 -9.572 -18.710 1.00 0.00 C ATOM 910 OG1 THR A 787 40.530 -10.936 -18.335 1.00 0.00 O ATOM 911 CG2 THR A 787 40.908 -8.720 -17.464 1.00 0.00 C ATOM 0 H THR A 787 39.305 -6.977 -19.214 1.00 0.00 H new ATOM 0 HA THR A 787 39.134 -9.740 -20.259 1.00 0.00 H new ATOM 0 HB THR A 787 41.518 -9.465 -19.387 1.00 0.00 H new ATOM 0 HG1 THR A 787 39.732 -11.041 -17.776 1.00 0.00 H new ATOM 0 HG21 THR A 787 41.818 -9.052 -16.965 1.00 0.00 H new ATOM 0 HG22 THR A 787 41.014 -7.674 -17.753 1.00 0.00 H new ATOM 0 HG23 THR A 787 40.062 -8.825 -16.784 1.00 0.00 H new ATOM 919 N PHE A 788 37.217 -8.332 -18.651 1.00 0.00 N ATOM 920 CA PHE A 788 36.037 -8.346 -17.737 1.00 0.00 C ATOM 921 C PHE A 788 35.353 -9.716 -17.789 1.00 0.00 C ATOM 922 O PHE A 788 35.509 -10.461 -18.735 1.00 0.00 O ATOM 923 CB PHE A 788 35.105 -7.259 -18.273 1.00 0.00 C ATOM 924 CG PHE A 788 35.513 -5.921 -17.705 1.00 0.00 C ATOM 925 CD1 PHE A 788 35.864 -4.874 -18.565 1.00 0.00 C ATOM 926 CD2 PHE A 788 35.539 -5.726 -16.318 1.00 0.00 C ATOM 927 CE1 PHE A 788 36.240 -3.632 -18.039 1.00 0.00 C ATOM 928 CE2 PHE A 788 35.916 -4.485 -15.792 1.00 0.00 C ATOM 929 CZ PHE A 788 36.266 -3.437 -16.652 1.00 0.00 C ATOM 0 H PHE A 788 37.174 -7.650 -19.408 1.00 0.00 H new ATOM 0 HA PHE A 788 36.314 -8.165 -16.698 1.00 0.00 H new ATOM 0 HB2 PHE A 788 35.148 -7.232 -19.362 1.00 0.00 H new ATOM 0 HB3 PHE A 788 34.074 -7.483 -18.000 1.00 0.00 H new ATOM 0 HD1 PHE A 788 35.845 -5.024 -19.634 1.00 0.00 H new ATOM 0 HD2 PHE A 788 35.268 -6.534 -15.654 1.00 0.00 H new ATOM 0 HE1 PHE A 788 36.510 -2.824 -18.703 1.00 0.00 H new ATOM 0 HE2 PHE A 788 35.937 -4.336 -14.723 1.00 0.00 H new ATOM 0 HZ PHE A 788 36.556 -2.479 -16.246 1.00 0.00 H new ATOM 939 N GLN A 789 34.596 -10.054 -16.780 1.00 0.00 N ATOM 940 CA GLN A 789 33.905 -11.377 -16.777 1.00 0.00 C ATOM 941 C GLN A 789 33.097 -11.549 -15.488 1.00 0.00 C ATOM 942 O GLN A 789 33.368 -10.917 -14.485 1.00 0.00 O ATOM 943 CB GLN A 789 35.029 -12.410 -16.846 1.00 0.00 C ATOM 944 CG GLN A 789 34.450 -13.812 -16.647 1.00 0.00 C ATOM 945 CD GLN A 789 35.586 -14.835 -16.645 1.00 0.00 C ATOM 946 OE1 GLN A 789 36.012 -15.286 -15.599 1.00 0.00 O ATOM 947 NE2 GLN A 789 36.100 -15.224 -17.779 1.00 0.00 N ATOM 0 H GLN A 789 34.426 -9.473 -15.959 1.00 0.00 H new ATOM 0 HA GLN A 789 33.205 -11.479 -17.606 1.00 0.00 H new ATOM 0 HB2 GLN A 789 35.535 -12.348 -17.809 1.00 0.00 H new ATOM 0 HB3 GLN A 789 35.776 -12.202 -16.080 1.00 0.00 H new ATOM 0 HG2 GLN A 789 33.901 -13.860 -15.707 1.00 0.00 H new ATOM 0 HG3 GLN A 789 33.741 -14.041 -17.443 1.00 0.00 H new ATOM 0 HE21 GLN A 789 35.743 -14.846 -18.657 1.00 0.00 H new ATOM 0 HE22 GLN A 789 36.859 -15.906 -17.788 1.00 0.00 H new ATOM 956 N GLN A 790 32.108 -12.397 -15.506 1.00 0.00 N ATOM 957 CA GLN A 790 31.283 -12.609 -14.281 1.00 0.00 C ATOM 958 C GLN A 790 32.183 -12.922 -13.079 1.00 0.00 C ATOM 959 O GLN A 790 33.132 -13.674 -13.181 1.00 0.00 O ATOM 960 CB GLN A 790 30.391 -13.806 -14.610 1.00 0.00 C ATOM 961 CG GLN A 790 28.964 -13.321 -14.878 1.00 0.00 C ATOM 962 CD GLN A 790 28.613 -13.553 -16.348 1.00 0.00 C ATOM 963 OE1 GLN A 790 29.250 -13.013 -17.230 1.00 0.00 O ATOM 964 NE2 GLN A 790 27.616 -14.339 -16.652 1.00 0.00 N ATOM 0 H GLN A 790 31.834 -12.954 -16.315 1.00 0.00 H new ATOM 0 HA GLN A 790 30.702 -11.726 -14.017 1.00 0.00 H new ATOM 0 HB2 GLN A 790 30.778 -14.332 -15.483 1.00 0.00 H new ATOM 0 HB3 GLN A 790 30.396 -14.515 -13.782 1.00 0.00 H new ATOM 0 HG2 GLN A 790 28.261 -13.854 -14.237 1.00 0.00 H new ATOM 0 HG3 GLN A 790 28.877 -12.262 -14.635 1.00 0.00 H new ATOM 0 HE21 GLN A 790 27.080 -14.793 -15.912 1.00 0.00 H new ATOM 0 HE22 GLN A 790 27.373 -14.499 -17.629 1.00 0.00 H new ATOM 973 N GLY A 791 31.889 -12.350 -11.942 1.00 0.00 N ATOM 974 CA GLY A 791 32.726 -12.613 -10.734 1.00 0.00 C ATOM 975 C GLY A 791 31.915 -13.415 -9.715 1.00 0.00 C ATOM 976 O GLY A 791 31.653 -14.587 -9.901 1.00 0.00 O ATOM 0 H GLY A 791 31.106 -11.712 -11.797 1.00 0.00 H new ATOM 0 HA2 GLY A 791 33.624 -13.163 -11.014 1.00 0.00 H new ATOM 0 HA3 GLY A 791 33.054 -11.671 -10.294 1.00 0.00 H new ATOM 980 N GLU A 792 31.514 -12.795 -8.638 1.00 0.00 N ATOM 981 CA GLU A 792 30.718 -13.528 -7.610 1.00 0.00 C ATOM 982 C GLU A 792 29.222 -13.400 -7.907 1.00 0.00 C ATOM 983 O GLU A 792 28.511 -14.381 -7.995 1.00 0.00 O ATOM 984 CB GLU A 792 31.060 -12.850 -6.283 1.00 0.00 C ATOM 985 CG GLU A 792 30.097 -13.342 -5.196 1.00 0.00 C ATOM 986 CD GLU A 792 30.253 -14.854 -5.021 1.00 0.00 C ATOM 987 OE1 GLU A 792 29.332 -15.468 -4.505 1.00 0.00 O ATOM 988 OE2 GLU A 792 31.287 -15.373 -5.407 1.00 0.00 O ATOM 0 H GLU A 792 31.702 -11.815 -8.425 1.00 0.00 H new ATOM 0 HA GLU A 792 30.949 -14.593 -7.594 1.00 0.00 H new ATOM 0 HB2 GLU A 792 32.089 -13.075 -6.002 1.00 0.00 H new ATOM 0 HB3 GLU A 792 30.987 -11.767 -6.386 1.00 0.00 H new ATOM 0 HG2 GLU A 792 30.304 -12.833 -4.255 1.00 0.00 H new ATOM 0 HG3 GLU A 792 29.070 -13.101 -5.469 1.00 0.00 H new ATOM 995 N CYS A 793 28.740 -12.197 -8.068 1.00 0.00 N ATOM 996 CA CYS A 793 27.289 -12.010 -8.360 1.00 0.00 C ATOM 997 C CYS A 793 27.106 -10.974 -9.470 1.00 0.00 C ATOM 998 O CYS A 793 27.472 -9.825 -9.326 1.00 0.00 O ATOM 999 CB CYS A 793 26.683 -11.501 -7.050 1.00 0.00 C ATOM 1000 SG CYS A 793 25.100 -12.327 -6.751 1.00 0.00 S ATOM 0 H CYS A 793 29.286 -11.338 -8.010 1.00 0.00 H new ATOM 0 HA CYS A 793 26.814 -12.930 -8.699 1.00 0.00 H new ATOM 0 HB2 CYS A 793 27.367 -11.693 -6.223 1.00 0.00 H new ATOM 0 HB3 CYS A 793 26.538 -10.422 -7.100 1.00 0.00 H new ATOM 1005 N HIS A 794 26.546 -11.372 -10.579 1.00 0.00 N ATOM 1006 CA HIS A 794 26.343 -10.405 -11.695 1.00 0.00 C ATOM 1007 C HIS A 794 24.852 -10.287 -12.035 1.00 0.00 C ATOM 1008 O HIS A 794 24.089 -11.217 -11.863 1.00 0.00 O ATOM 1009 CB HIS A 794 27.116 -10.992 -12.882 1.00 0.00 C ATOM 1010 CG HIS A 794 26.645 -10.341 -14.160 1.00 0.00 C ATOM 1011 ND1 HIS A 794 26.914 -9.016 -14.456 1.00 0.00 N ATOM 1012 CD2 HIS A 794 25.903 -10.819 -15.216 1.00 0.00 C ATOM 1013 CE1 HIS A 794 26.341 -8.742 -15.645 1.00 0.00 C ATOM 1014 NE2 HIS A 794 25.715 -9.808 -16.150 1.00 0.00 N ATOM 0 H HIS A 794 26.221 -12.322 -10.761 1.00 0.00 H new ATOM 0 HA HIS A 794 26.691 -9.405 -11.436 1.00 0.00 H new ATOM 0 HB2 HIS A 794 28.185 -10.828 -12.750 1.00 0.00 H new ATOM 0 HB3 HIS A 794 26.963 -12.070 -12.932 1.00 0.00 H new ATOM 0 HD2 HIS A 794 25.525 -11.827 -15.305 1.00 0.00 H new ATOM 0 HE1 HIS A 794 26.383 -7.778 -16.130 1.00 0.00 H new ATOM 0 HE2 HIS A 794 25.207 -9.867 -17.033 1.00 0.00 H new ATOM 1022 N SER A 795 24.437 -9.146 -12.513 1.00 0.00 N ATOM 1023 CA SER A 795 23.001 -8.960 -12.868 1.00 0.00 C ATOM 1024 C SER A 795 22.803 -9.241 -14.363 1.00 0.00 C ATOM 1025 O SER A 795 23.347 -8.560 -15.209 1.00 0.00 O ATOM 1026 CB SER A 795 22.701 -7.497 -12.550 1.00 0.00 C ATOM 1027 OG SER A 795 22.302 -7.383 -11.189 1.00 0.00 O ATOM 0 H SER A 795 25.031 -8.333 -12.673 1.00 0.00 H new ATOM 0 HA SER A 795 22.341 -9.633 -12.321 1.00 0.00 H new ATOM 0 HB2 SER A 795 23.584 -6.885 -12.735 1.00 0.00 H new ATOM 0 HB3 SER A 795 21.913 -7.125 -13.204 1.00 0.00 H new ATOM 0 HG SER A 795 23.004 -6.927 -10.679 1.00 0.00 H new ATOM 1033 N ILE A 796 22.025 -10.235 -14.694 1.00 0.00 N ATOM 1034 CA ILE A 796 21.797 -10.555 -16.138 1.00 0.00 C ATOM 1035 C ILE A 796 21.208 -9.346 -16.877 1.00 0.00 C ATOM 1036 O ILE A 796 21.176 -9.308 -18.091 1.00 0.00 O ATOM 1037 CB ILE A 796 20.807 -11.719 -16.141 1.00 0.00 C ATOM 1038 CG1 ILE A 796 21.325 -12.835 -15.223 1.00 0.00 C ATOM 1039 CG2 ILE A 796 20.665 -12.256 -17.567 1.00 0.00 C ATOM 1040 CD1 ILE A 796 20.552 -14.128 -15.496 1.00 0.00 C ATOM 0 H ILE A 796 21.538 -10.839 -14.032 1.00 0.00 H new ATOM 0 HA ILE A 796 22.727 -10.809 -16.647 1.00 0.00 H new ATOM 0 HB ILE A 796 19.837 -11.376 -15.781 1.00 0.00 H new ATOM 0 HG12 ILE A 796 22.390 -12.994 -15.393 1.00 0.00 H new ATOM 0 HG13 ILE A 796 21.209 -12.544 -14.179 1.00 0.00 H new ATOM 0 HG21 ILE A 796 19.960 -13.087 -17.574 1.00 0.00 H new ATOM 0 HG22 ILE A 796 20.299 -11.463 -18.220 1.00 0.00 H new ATOM 0 HG23 ILE A 796 21.635 -12.601 -17.924 1.00 0.00 H new ATOM 0 HD11 ILE A 796 20.922 -14.918 -14.843 1.00 0.00 H new ATOM 0 HD12 ILE A 796 19.491 -13.965 -15.304 1.00 0.00 H new ATOM 0 HD13 ILE A 796 20.691 -14.422 -16.536 1.00 0.00 H new ATOM 1052 N ASN A 797 20.744 -8.361 -16.161 1.00 0.00 N ATOM 1053 CA ASN A 797 20.162 -7.160 -16.833 1.00 0.00 C ATOM 1054 C ASN A 797 21.250 -6.110 -17.088 1.00 0.00 C ATOM 1055 O ASN A 797 20.969 -4.940 -17.259 1.00 0.00 O ATOM 1056 CB ASN A 797 19.122 -6.622 -15.849 1.00 0.00 C ATOM 1057 CG ASN A 797 17.783 -7.323 -16.082 1.00 0.00 C ATOM 1058 OD1 ASN A 797 17.744 -8.495 -16.399 1.00 0.00 O ATOM 1059 ND2 ASN A 797 16.673 -6.649 -15.937 1.00 0.00 N ATOM 0 H ASN A 797 20.741 -8.333 -15.141 1.00 0.00 H new ATOM 0 HA ASN A 797 19.724 -7.403 -17.801 1.00 0.00 H new ATOM 0 HB2 ASN A 797 19.457 -6.787 -14.825 1.00 0.00 H new ATOM 0 HB3 ASN A 797 19.008 -5.546 -15.978 1.00 0.00 H new ATOM 0 HD21 ASN A 797 15.775 -7.107 -16.090 1.00 0.00 H new ATOM 0 HD22 ASN A 797 16.705 -5.665 -15.671 1.00 0.00 H new ATOM 1066 N SER A 798 22.491 -6.519 -17.117 1.00 0.00 N ATOM 1067 CA SER A 798 23.592 -5.542 -17.361 1.00 0.00 C ATOM 1068 C SER A 798 23.563 -5.039 -18.810 1.00 0.00 C ATOM 1069 O SER A 798 23.894 -3.904 -19.087 1.00 0.00 O ATOM 1070 CB SER A 798 24.866 -6.320 -17.100 1.00 0.00 C ATOM 1071 OG SER A 798 25.377 -5.953 -15.826 1.00 0.00 O ATOM 0 H SER A 798 22.789 -7.485 -16.983 1.00 0.00 H new ATOM 0 HA SER A 798 23.504 -4.662 -16.724 1.00 0.00 H new ATOM 0 HB2 SER A 798 24.667 -7.391 -17.132 1.00 0.00 H new ATOM 0 HB3 SER A 798 25.602 -6.110 -17.876 1.00 0.00 H new ATOM 0 HG SER A 798 24.885 -6.431 -15.126 1.00 0.00 H new ATOM 1077 N ASN A 799 23.173 -5.876 -19.734 1.00 0.00 N ATOM 1078 CA ASN A 799 23.128 -5.441 -21.165 1.00 0.00 C ATOM 1079 C ASN A 799 21.708 -5.028 -21.570 1.00 0.00 C ATOM 1080 O ASN A 799 21.441 -4.751 -22.723 1.00 0.00 O ATOM 1081 CB ASN A 799 23.568 -6.666 -21.959 1.00 0.00 C ATOM 1082 CG ASN A 799 25.092 -6.713 -22.023 1.00 0.00 C ATOM 1083 OD1 ASN A 799 25.766 -6.163 -21.175 1.00 0.00 O ATOM 1084 ND2 ASN A 799 25.669 -7.352 -23.001 1.00 0.00 N ATOM 0 H ASN A 799 22.884 -6.839 -19.563 1.00 0.00 H new ATOM 0 HA ASN A 799 23.766 -4.575 -21.345 1.00 0.00 H new ATOM 0 HB2 ASN A 799 23.185 -7.573 -21.490 1.00 0.00 H new ATOM 0 HB3 ASN A 799 23.152 -6.628 -22.966 1.00 0.00 H new ATOM 0 HD21 ASN A 799 26.687 -7.391 -23.055 1.00 0.00 H new ATOM 0 HD22 ASN A 799 25.103 -7.814 -23.713 1.00 0.00 H new ATOM 1091 N SER A 800 20.796 -4.984 -20.642 1.00 0.00 N ATOM 1092 CA SER A 800 19.402 -4.587 -20.997 1.00 0.00 C ATOM 1093 C SER A 800 19.225 -3.073 -20.852 1.00 0.00 C ATOM 1094 O SER A 800 18.434 -2.463 -21.544 1.00 0.00 O ATOM 1095 CB SER A 800 18.514 -5.326 -19.999 1.00 0.00 C ATOM 1096 OG SER A 800 19.079 -5.220 -18.697 1.00 0.00 O ATOM 0 H SER A 800 20.951 -5.204 -19.658 1.00 0.00 H new ATOM 0 HA SER A 800 19.154 -4.837 -22.029 1.00 0.00 H new ATOM 0 HB2 SER A 800 17.509 -4.904 -20.007 1.00 0.00 H new ATOM 0 HB3 SER A 800 18.422 -6.374 -20.284 1.00 0.00 H new ATOM 0 HG SER A 800 19.809 -4.566 -18.709 1.00 0.00 H new ATOM 1102 N VAL A 801 19.958 -2.463 -19.963 1.00 0.00 N ATOM 1103 CA VAL A 801 19.831 -0.987 -19.776 1.00 0.00 C ATOM 1104 C VAL A 801 20.770 -0.240 -20.730 1.00 0.00 C ATOM 1105 O VAL A 801 20.590 0.929 -21.004 1.00 0.00 O ATOM 1106 CB VAL A 801 20.237 -0.739 -18.325 1.00 0.00 C ATOM 1107 CG1 VAL A 801 19.903 0.702 -17.938 1.00 0.00 C ATOM 1108 CG2 VAL A 801 19.476 -1.700 -17.407 1.00 0.00 C ATOM 0 H VAL A 801 20.639 -2.920 -19.357 1.00 0.00 H new ATOM 0 HA VAL A 801 18.822 -0.632 -19.988 1.00 0.00 H new ATOM 0 HB VAL A 801 21.309 -0.906 -18.218 1.00 0.00 H new ATOM 0 HG11 VAL A 801 20.193 0.877 -16.902 1.00 0.00 H new ATOM 0 HG12 VAL A 801 20.446 1.388 -18.588 1.00 0.00 H new ATOM 0 HG13 VAL A 801 18.831 0.869 -18.048 1.00 0.00 H new ATOM 0 HG21 VAL A 801 19.767 -1.522 -16.372 1.00 0.00 H new ATOM 0 HG22 VAL A 801 18.404 -1.535 -17.516 1.00 0.00 H new ATOM 0 HG23 VAL A 801 19.714 -2.728 -17.679 1.00 0.00 H new ATOM 1118 N LEU A 802 21.771 -0.905 -21.238 1.00 0.00 N ATOM 1119 CA LEU A 802 22.720 -0.225 -22.173 1.00 0.00 C ATOM 1120 C LEU A 802 22.249 -0.379 -23.626 1.00 0.00 C ATOM 1121 O LEU A 802 22.195 0.577 -24.373 1.00 0.00 O ATOM 1122 CB LEU A 802 24.060 -0.936 -21.964 1.00 0.00 C ATOM 1123 CG LEU A 802 24.889 -0.173 -20.926 1.00 0.00 C ATOM 1124 CD1 LEU A 802 25.416 1.124 -21.543 1.00 0.00 C ATOM 1125 CD2 LEU A 802 24.012 0.161 -19.715 1.00 0.00 C ATOM 0 H LEU A 802 21.975 -1.886 -21.049 1.00 0.00 H new ATOM 0 HA LEU A 802 22.790 0.845 -21.979 1.00 0.00 H new ATOM 0 HB2 LEU A 802 23.892 -1.960 -21.629 1.00 0.00 H new ATOM 0 HB3 LEU A 802 24.603 -0.994 -22.907 1.00 0.00 H new ATOM 0 HG LEU A 802 25.728 -0.792 -20.609 1.00 0.00 H new ATOM 0 HD11 LEU A 802 26.006 1.666 -20.803 1.00 0.00 H new ATOM 0 HD12 LEU A 802 26.041 0.889 -22.404 1.00 0.00 H new ATOM 0 HD13 LEU A 802 24.577 1.742 -21.862 1.00 0.00 H new ATOM 0 HD21 LEU A 802 24.602 0.704 -18.977 1.00 0.00 H new ATOM 0 HD22 LEU A 802 23.172 0.779 -20.033 1.00 0.00 H new ATOM 0 HD23 LEU A 802 23.637 -0.762 -19.272 1.00 0.00 H new ATOM 1137 N GLU A 803 21.910 -1.574 -24.031 1.00 0.00 N ATOM 1138 CA GLU A 803 21.446 -1.781 -25.438 1.00 0.00 C ATOM 1139 C GLU A 803 20.209 -0.918 -25.743 1.00 0.00 C ATOM 1140 O GLU A 803 19.964 -0.556 -26.876 1.00 0.00 O ATOM 1141 CB GLU A 803 21.099 -3.266 -25.523 1.00 0.00 C ATOM 1142 CG GLU A 803 22.387 -4.081 -25.666 1.00 0.00 C ATOM 1143 CD GLU A 803 22.061 -5.452 -26.259 1.00 0.00 C ATOM 1144 OE1 GLU A 803 22.140 -5.586 -27.469 1.00 0.00 O ATOM 1145 OE2 GLU A 803 21.737 -6.346 -25.494 1.00 0.00 O ATOM 0 H GLU A 803 21.933 -2.414 -23.453 1.00 0.00 H new ATOM 0 HA GLU A 803 22.207 -1.493 -26.163 1.00 0.00 H new ATOM 0 HB2 GLU A 803 20.557 -3.576 -24.630 1.00 0.00 H new ATOM 0 HB3 GLU A 803 20.443 -3.449 -26.374 1.00 0.00 H new ATOM 0 HG2 GLU A 803 23.094 -3.554 -26.308 1.00 0.00 H new ATOM 0 HG3 GLU A 803 22.865 -4.198 -24.694 1.00 0.00 H new ATOM 1152 N ARG A 804 19.431 -0.586 -24.748 1.00 0.00 N ATOM 1153 CA ARG A 804 18.217 0.251 -25.008 1.00 0.00 C ATOM 1154 C ARG A 804 18.567 1.747 -24.976 1.00 0.00 C ATOM 1155 O ARG A 804 17.930 2.554 -25.624 1.00 0.00 O ATOM 1156 CB ARG A 804 17.243 -0.091 -23.881 1.00 0.00 C ATOM 1157 CG ARG A 804 15.873 0.514 -24.199 1.00 0.00 C ATOM 1158 CD ARG A 804 14.830 -0.024 -23.217 1.00 0.00 C ATOM 1159 NE ARG A 804 13.581 -0.148 -24.017 1.00 0.00 N ATOM 1160 CZ ARG A 804 12.754 0.861 -24.103 1.00 0.00 C ATOM 1161 NH1 ARG A 804 11.475 0.672 -23.931 1.00 0.00 N ATOM 1162 NH2 ARG A 804 13.208 2.058 -24.364 1.00 0.00 N ATOM 0 H ARG A 804 19.578 -0.853 -23.775 1.00 0.00 H new ATOM 0 HA ARG A 804 17.793 0.050 -25.992 1.00 0.00 H new ATOM 0 HB2 ARG A 804 17.160 -1.172 -23.772 1.00 0.00 H new ATOM 0 HB3 ARG A 804 17.614 0.298 -22.933 1.00 0.00 H new ATOM 0 HG2 ARG A 804 15.921 1.601 -24.134 1.00 0.00 H new ATOM 0 HG3 ARG A 804 15.585 0.268 -25.221 1.00 0.00 H new ATOM 0 HD2 ARG A 804 15.134 -0.987 -22.806 1.00 0.00 H new ATOM 0 HD3 ARG A 804 14.694 0.654 -22.374 1.00 0.00 H new ATOM 0 HE ARG A 804 13.370 -1.022 -24.499 1.00 0.00 H new ATOM 0 HH11 ARG A 804 11.120 -0.263 -23.729 1.00 0.00 H new ATOM 0 HH12 ARG A 804 10.830 1.459 -23.998 1.00 0.00 H new ATOM 0 HH21 ARG A 804 14.208 2.206 -24.501 1.00 0.00 H new ATOM 0 HH22 ARG A 804 12.562 2.845 -24.431 1.00 0.00 H new ATOM 1176 N LYS A 805 19.571 2.124 -24.229 1.00 0.00 N ATOM 1177 CA LYS A 805 19.950 3.572 -24.166 1.00 0.00 C ATOM 1178 C LYS A 805 21.409 3.767 -24.593 1.00 0.00 C ATOM 1179 O LYS A 805 22.090 4.653 -24.116 1.00 0.00 O ATOM 1180 CB LYS A 805 19.772 3.963 -22.699 1.00 0.00 C ATOM 1181 CG LYS A 805 18.481 4.769 -22.533 1.00 0.00 C ATOM 1182 CD LYS A 805 17.775 4.338 -21.243 1.00 0.00 C ATOM 1183 CE LYS A 805 16.593 5.272 -20.968 1.00 0.00 C ATOM 1184 NZ LYS A 805 17.210 6.577 -20.601 1.00 0.00 N ATOM 0 H LYS A 805 20.144 1.499 -23.662 1.00 0.00 H new ATOM 0 HA LYS A 805 19.341 4.182 -24.834 1.00 0.00 H new ATOM 0 HB2 LYS A 805 19.737 3.069 -22.076 1.00 0.00 H new ATOM 0 HB3 LYS A 805 20.626 4.552 -22.363 1.00 0.00 H new ATOM 0 HG2 LYS A 805 18.706 5.835 -22.499 1.00 0.00 H new ATOM 0 HG3 LYS A 805 17.827 4.609 -23.390 1.00 0.00 H new ATOM 0 HD2 LYS A 805 17.425 3.310 -21.334 1.00 0.00 H new ATOM 0 HD3 LYS A 805 18.474 4.364 -20.407 1.00 0.00 H new ATOM 0 HE2 LYS A 805 15.955 5.370 -21.846 1.00 0.00 H new ATOM 0 HE3 LYS A 805 15.968 4.890 -20.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 805 16.585 7.084 -19.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 805 18.130 6.410 -20.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 805 17.347 7.150 -21.458 1.00 0.00 H new ATOM 1198 N CYS A 806 21.894 2.950 -25.486 1.00 0.00 N ATOM 1199 CA CYS A 806 23.311 3.098 -25.935 1.00 0.00 C ATOM 1200 C CYS A 806 23.532 2.358 -27.259 1.00 0.00 C ATOM 1201 O CYS A 806 24.539 1.708 -27.456 1.00 0.00 O ATOM 1202 CB CYS A 806 24.143 2.464 -24.821 1.00 0.00 C ATOM 1203 SG CYS A 806 25.574 3.512 -24.463 1.00 0.00 S ATOM 0 H CYS A 806 21.375 2.189 -25.924 1.00 0.00 H new ATOM 0 HA CYS A 806 23.583 4.139 -26.108 1.00 0.00 H new ATOM 0 HB2 CYS A 806 23.536 2.341 -23.924 1.00 0.00 H new ATOM 0 HB3 CYS A 806 24.473 1.469 -25.121 1.00 0.00 H new ATOM 1208 N ILE A 807 22.600 2.453 -28.166 1.00 0.00 N ATOM 1209 CA ILE A 807 22.762 1.754 -29.472 1.00 0.00 C ATOM 1210 C ILE A 807 22.246 2.634 -30.618 1.00 0.00 C ATOM 1211 O ILE A 807 21.118 2.506 -31.052 1.00 0.00 O ATOM 1212 CB ILE A 807 21.913 0.492 -29.338 1.00 0.00 C ATOM 1213 CG1 ILE A 807 22.662 -0.538 -28.488 1.00 0.00 C ATOM 1214 CG2 ILE A 807 21.637 -0.097 -30.724 1.00 0.00 C ATOM 1215 CD1 ILE A 807 23.857 -1.081 -29.274 1.00 0.00 C ATOM 0 H ILE A 807 21.735 2.983 -28.060 1.00 0.00 H new ATOM 0 HA ILE A 807 23.804 1.529 -29.698 1.00 0.00 H new ATOM 0 HB ILE A 807 20.967 0.745 -28.859 1.00 0.00 H new ATOM 0 HG12 ILE A 807 23.003 -0.080 -27.560 1.00 0.00 H new ATOM 0 HG13 ILE A 807 21.993 -1.354 -28.214 1.00 0.00 H new ATOM 0 HG21 ILE A 807 21.031 -0.997 -30.623 1.00 0.00 H new ATOM 0 HG22 ILE A 807 21.102 0.634 -31.330 1.00 0.00 H new ATOM 0 HG23 ILE A 807 22.581 -0.348 -31.207 1.00 0.00 H new ATOM 0 HD11 ILE A 807 24.389 -1.814 -28.667 1.00 0.00 H new ATOM 0 HD12 ILE A 807 23.505 -1.555 -30.190 1.00 0.00 H new ATOM 0 HD13 ILE A 807 24.530 -0.261 -29.525 1.00 0.00 H new ATOM 1227 N GLY A 808 23.062 3.526 -31.111 1.00 0.00 N ATOM 1228 CA GLY A 808 22.614 4.409 -32.226 1.00 0.00 C ATOM 1229 C GLY A 808 22.638 5.868 -31.771 1.00 0.00 C ATOM 1230 O GLY A 808 21.835 6.674 -32.197 1.00 0.00 O ATOM 0 H GLY A 808 24.018 3.681 -30.791 1.00 0.00 H new ATOM 0 HA2 GLY A 808 23.265 4.277 -33.091 1.00 0.00 H new ATOM 0 HA3 GLY A 808 21.607 4.132 -32.539 1.00 0.00 H new ATOM 1234 N LEU A 809 23.551 6.216 -30.906 1.00 0.00 N ATOM 1235 CA LEU A 809 23.620 7.629 -30.426 1.00 0.00 C ATOM 1236 C LEU A 809 25.078 8.100 -30.365 1.00 0.00 C ATOM 1237 O LEU A 809 25.956 7.376 -29.939 1.00 0.00 O ATOM 1238 CB LEU A 809 23.015 7.603 -29.020 1.00 0.00 C ATOM 1239 CG LEU A 809 21.546 7.180 -29.092 1.00 0.00 C ATOM 1240 CD1 LEU A 809 21.128 6.558 -27.758 1.00 0.00 C ATOM 1241 CD2 LEU A 809 20.675 8.407 -29.374 1.00 0.00 C ATOM 0 H LEU A 809 24.250 5.587 -30.511 1.00 0.00 H new ATOM 0 HA LEU A 809 23.089 8.312 -31.089 1.00 0.00 H new ATOM 0 HB2 LEU A 809 23.571 6.910 -28.388 1.00 0.00 H new ATOM 0 HB3 LEU A 809 23.097 8.588 -28.561 1.00 0.00 H new ATOM 0 HG LEU A 809 21.418 6.450 -29.891 1.00 0.00 H new ATOM 0 HD11 LEU A 809 20.082 6.257 -27.809 1.00 0.00 H new ATOM 0 HD12 LEU A 809 21.748 5.685 -27.554 1.00 0.00 H new ATOM 0 HD13 LEU A 809 21.257 7.289 -26.960 1.00 0.00 H new ATOM 0 HD21 LEU A 809 19.629 8.106 -29.425 1.00 0.00 H new ATOM 0 HD22 LEU A 809 20.804 9.136 -28.574 1.00 0.00 H new ATOM 0 HD23 LEU A 809 20.971 8.853 -30.323 1.00 0.00 H new ATOM 1253 N GLU A 810 25.346 9.310 -30.788 1.00 0.00 N ATOM 1254 CA GLU A 810 26.749 9.813 -30.747 1.00 0.00 C ATOM 1255 C GLU A 810 27.223 9.818 -29.301 1.00 0.00 C ATOM 1256 O GLU A 810 28.378 9.598 -29.007 1.00 0.00 O ATOM 1257 CB GLU A 810 26.682 11.238 -31.300 1.00 0.00 C ATOM 1258 CG GLU A 810 26.259 11.196 -32.769 1.00 0.00 C ATOM 1259 CD GLU A 810 24.757 11.469 -32.876 1.00 0.00 C ATOM 1260 OE1 GLU A 810 24.238 12.161 -32.015 1.00 0.00 O ATOM 1261 OE2 GLU A 810 24.152 10.981 -33.816 1.00 0.00 O ATOM 0 H GLU A 810 24.658 9.966 -31.157 1.00 0.00 H new ATOM 0 HA GLU A 810 27.441 9.199 -31.324 1.00 0.00 H new ATOM 0 HB2 GLU A 810 25.972 11.830 -30.723 1.00 0.00 H new ATOM 0 HB3 GLU A 810 27.654 11.723 -31.204 1.00 0.00 H new ATOM 0 HG2 GLU A 810 26.816 11.939 -33.340 1.00 0.00 H new ATOM 0 HG3 GLU A 810 26.494 10.222 -33.198 1.00 0.00 H new ATOM 1268 N ARG A 811 26.322 10.068 -28.396 1.00 0.00 N ATOM 1269 CA ARG A 811 26.680 10.093 -26.952 1.00 0.00 C ATOM 1270 C ARG A 811 25.759 9.134 -26.198 1.00 0.00 C ATOM 1271 O ARG A 811 24.771 8.671 -26.729 1.00 0.00 O ATOM 1272 CB ARG A 811 26.450 11.535 -26.504 1.00 0.00 C ATOM 1273 CG ARG A 811 27.053 11.737 -25.113 1.00 0.00 C ATOM 1274 CD ARG A 811 26.870 13.195 -24.685 1.00 0.00 C ATOM 1275 NE ARG A 811 28.102 13.888 -25.151 1.00 0.00 N ATOM 1276 CZ ARG A 811 28.408 15.065 -24.677 1.00 0.00 C ATOM 1277 NH1 ARG A 811 29.516 15.231 -24.007 1.00 0.00 N ATOM 1278 NH2 ARG A 811 27.608 16.077 -24.876 1.00 0.00 N ATOM 0 H ARG A 811 25.340 10.259 -28.597 1.00 0.00 H new ATOM 0 HA ARG A 811 27.708 9.783 -26.762 1.00 0.00 H new ATOM 0 HB2 ARG A 811 26.906 12.225 -27.214 1.00 0.00 H new ATOM 0 HB3 ARG A 811 25.383 11.756 -26.485 1.00 0.00 H new ATOM 0 HG2 ARG A 811 26.571 11.073 -24.396 1.00 0.00 H new ATOM 0 HG3 ARG A 811 28.112 11.480 -25.123 1.00 0.00 H new ATOM 0 HD2 ARG A 811 25.978 13.630 -25.135 1.00 0.00 H new ATOM 0 HD3 ARG A 811 26.755 13.278 -23.604 1.00 0.00 H new ATOM 0 HE ARG A 811 28.707 13.443 -25.841 1.00 0.00 H new ATOM 0 HH11 ARG A 811 30.143 14.441 -23.854 1.00 0.00 H new ATOM 0 HH12 ARG A 811 29.755 16.151 -23.637 1.00 0.00 H new ATOM 0 HH21 ARG A 811 26.744 15.948 -25.402 1.00 0.00 H new ATOM 0 HH22 ARG A 811 27.847 16.997 -24.506 1.00 0.00 H new ATOM 1292 N CYS A 812 26.062 8.826 -24.972 1.00 0.00 N ATOM 1293 CA CYS A 812 25.179 7.891 -24.219 1.00 0.00 C ATOM 1294 C CYS A 812 25.495 7.922 -22.723 1.00 0.00 C ATOM 1295 O CYS A 812 26.576 7.566 -22.296 1.00 0.00 O ATOM 1296 CB CYS A 812 25.486 6.514 -24.808 1.00 0.00 C ATOM 1297 SG CYS A 812 24.770 5.225 -23.756 1.00 0.00 S ATOM 0 H CYS A 812 26.873 9.175 -24.461 1.00 0.00 H new ATOM 0 HA CYS A 812 24.126 8.157 -24.311 1.00 0.00 H new ATOM 0 HB2 CYS A 812 25.080 6.441 -25.817 1.00 0.00 H new ATOM 0 HB3 CYS A 812 26.564 6.374 -24.888 1.00 0.00 H new ATOM 1302 N VAL A 813 24.556 8.347 -21.927 1.00 0.00 N ATOM 1303 CA VAL A 813 24.786 8.406 -20.457 1.00 0.00 C ATOM 1304 C VAL A 813 23.803 7.469 -19.751 1.00 0.00 C ATOM 1305 O VAL A 813 22.641 7.400 -20.101 1.00 0.00 O ATOM 1306 CB VAL A 813 24.524 9.858 -20.070 1.00 0.00 C ATOM 1307 CG1 VAL A 813 24.590 9.997 -18.548 1.00 0.00 C ATOM 1308 CG2 VAL A 813 25.586 10.754 -20.713 1.00 0.00 C ATOM 0 H VAL A 813 23.634 8.658 -22.233 1.00 0.00 H new ATOM 0 HA VAL A 813 25.792 8.094 -20.174 1.00 0.00 H new ATOM 0 HB VAL A 813 23.536 10.158 -20.419 1.00 0.00 H new ATOM 0 HG11 VAL A 813 24.403 11.034 -18.269 1.00 0.00 H new ATOM 0 HG12 VAL A 813 23.836 9.357 -18.091 1.00 0.00 H new ATOM 0 HG13 VAL A 813 25.579 9.700 -18.198 1.00 0.00 H new ATOM 0 HG21 VAL A 813 25.401 11.792 -20.438 1.00 0.00 H new ATOM 0 HG22 VAL A 813 26.574 10.456 -20.362 1.00 0.00 H new ATOM 0 HG23 VAL A 813 25.540 10.652 -21.797 1.00 0.00 H new ATOM 1318 N VAL A 814 24.252 6.747 -18.764 1.00 0.00 N ATOM 1319 CA VAL A 814 23.329 5.818 -18.048 1.00 0.00 C ATOM 1320 C VAL A 814 23.345 6.098 -16.544 1.00 0.00 C ATOM 1321 O VAL A 814 24.277 6.669 -16.017 1.00 0.00 O ATOM 1322 CB VAL A 814 23.874 4.420 -18.337 1.00 0.00 C ATOM 1323 CG1 VAL A 814 22.815 3.375 -17.983 1.00 0.00 C ATOM 1324 CG2 VAL A 814 24.225 4.305 -19.823 1.00 0.00 C ATOM 0 H VAL A 814 25.213 6.758 -18.422 1.00 0.00 H new ATOM 0 HA VAL A 814 22.296 5.933 -18.377 1.00 0.00 H new ATOM 0 HB VAL A 814 24.768 4.249 -17.737 1.00 0.00 H new ATOM 0 HG11 VAL A 814 23.204 2.378 -18.189 1.00 0.00 H new ATOM 0 HG12 VAL A 814 22.564 3.455 -16.925 1.00 0.00 H new ATOM 0 HG13 VAL A 814 21.920 3.546 -18.582 1.00 0.00 H new ATOM 0 HG21 VAL A 814 24.614 3.308 -20.029 1.00 0.00 H new ATOM 0 HG22 VAL A 814 23.331 4.477 -20.422 1.00 0.00 H new ATOM 0 HG23 VAL A 814 24.981 5.048 -20.077 1.00 0.00 H new ATOM 1334 N ALA A 815 22.313 5.703 -15.850 1.00 0.00 N ATOM 1335 CA ALA A 815 22.265 5.945 -14.380 1.00 0.00 C ATOM 1336 C ALA A 815 22.217 4.610 -13.627 1.00 0.00 C ATOM 1337 O ALA A 815 21.481 3.711 -13.984 1.00 0.00 O ATOM 1338 CB ALA A 815 20.979 6.733 -14.151 1.00 0.00 C ATOM 0 H ALA A 815 21.501 5.223 -16.237 1.00 0.00 H new ATOM 0 HA ALA A 815 23.142 6.483 -14.021 1.00 0.00 H new ATOM 0 HB1 ALA A 815 20.870 6.951 -13.089 1.00 0.00 H new ATOM 0 HB2 ALA A 815 21.020 7.667 -14.711 1.00 0.00 H new ATOM 0 HB3 ALA A 815 20.126 6.144 -14.489 1.00 0.00 H new ATOM 1344 N ILE A 816 22.997 4.475 -12.590 1.00 0.00 N ATOM 1345 CA ILE A 816 22.995 3.198 -11.818 1.00 0.00 C ATOM 1346 C ILE A 816 22.302 3.396 -10.466 1.00 0.00 C ATOM 1347 O ILE A 816 22.508 4.386 -9.792 1.00 0.00 O ATOM 1348 CB ILE A 816 24.471 2.851 -11.617 1.00 0.00 C ATOM 1349 CG1 ILE A 816 25.188 2.858 -12.971 1.00 0.00 C ATOM 1350 CG2 ILE A 816 24.587 1.461 -10.990 1.00 0.00 C ATOM 1351 CD1 ILE A 816 26.640 3.297 -12.775 1.00 0.00 C ATOM 0 H ILE A 816 23.635 5.192 -12.243 1.00 0.00 H new ATOM 0 HA ILE A 816 22.457 2.405 -12.337 1.00 0.00 H new ATOM 0 HB ILE A 816 24.930 3.589 -10.958 1.00 0.00 H new ATOM 0 HG12 ILE A 816 25.154 1.864 -13.418 1.00 0.00 H new ATOM 0 HG13 ILE A 816 24.682 3.535 -13.659 1.00 0.00 H new ATOM 0 HG21 ILE A 816 25.639 1.213 -10.847 1.00 0.00 H new ATOM 0 HG22 ILE A 816 24.078 1.453 -10.026 1.00 0.00 H new ATOM 0 HG23 ILE A 816 24.127 0.725 -11.650 1.00 0.00 H new ATOM 0 HD11 ILE A 816 27.152 3.302 -13.737 1.00 0.00 H new ATOM 0 HD12 ILE A 816 26.662 4.299 -12.346 1.00 0.00 H new ATOM 0 HD13 ILE A 816 27.142 2.603 -12.101 1.00 0.00 H new ATOM 1363 N SER A 817 21.481 2.464 -10.066 1.00 0.00 N ATOM 1364 CA SER A 817 20.774 2.598 -8.756 1.00 0.00 C ATOM 1365 C SER A 817 20.245 1.233 -8.303 1.00 0.00 C ATOM 1366 O SER A 817 20.428 0.240 -8.978 1.00 0.00 O ATOM 1367 CB SER A 817 19.616 3.565 -9.014 1.00 0.00 C ATOM 1368 OG SER A 817 19.651 4.006 -10.368 1.00 0.00 O ATOM 0 H SER A 817 21.268 1.614 -10.588 1.00 0.00 H new ATOM 0 HA SER A 817 21.434 2.964 -7.969 1.00 0.00 H new ATOM 0 HB2 SER A 817 18.666 3.073 -8.806 1.00 0.00 H new ATOM 0 HB3 SER A 817 19.686 4.420 -8.341 1.00 0.00 H new ATOM 0 HG SER A 817 19.277 4.910 -10.427 1.00 0.00 H new ATOM 1374 N PRO A 818 19.604 1.236 -7.166 1.00 0.00 N ATOM 1375 CA PRO A 818 19.040 -0.014 -6.609 1.00 0.00 C ATOM 1376 C PRO A 818 17.766 -0.413 -7.365 1.00 0.00 C ATOM 1377 O PRO A 818 17.518 -1.577 -7.611 1.00 0.00 O ATOM 1378 CB PRO A 818 18.723 0.345 -5.165 1.00 0.00 C ATOM 1379 CG PRO A 818 18.532 1.834 -5.162 1.00 0.00 C ATOM 1380 CD PRO A 818 19.352 2.393 -6.305 1.00 0.00 C ATOM 0 HA PRO A 818 19.720 -0.862 -6.692 1.00 0.00 H new ATOM 0 HB2 PRO A 818 17.825 -0.168 -4.820 1.00 0.00 H new ATOM 0 HB3 PRO A 818 19.534 0.051 -4.499 1.00 0.00 H new ATOM 0 HG2 PRO A 818 17.479 2.087 -5.284 1.00 0.00 H new ATOM 0 HG3 PRO A 818 18.854 2.261 -4.212 1.00 0.00 H new ATOM 0 HD2 PRO A 818 18.811 3.175 -6.838 1.00 0.00 H new ATOM 0 HD3 PRO A 818 20.283 2.835 -5.949 1.00 0.00 H new ATOM 1388 N SER A 819 16.959 0.543 -7.734 1.00 0.00 N ATOM 1389 CA SER A 819 15.703 0.215 -8.471 1.00 0.00 C ATOM 1390 C SER A 819 15.738 0.822 -9.877 1.00 0.00 C ATOM 1391 O SER A 819 14.792 1.442 -10.321 1.00 0.00 O ATOM 1392 CB SER A 819 14.583 0.842 -7.643 1.00 0.00 C ATOM 1393 OG SER A 819 13.624 -0.156 -7.317 1.00 0.00 O ATOM 0 H SER A 819 17.113 1.536 -7.558 1.00 0.00 H new ATOM 0 HA SER A 819 15.566 -0.859 -8.594 1.00 0.00 H new ATOM 0 HB2 SER A 819 14.991 1.282 -6.733 1.00 0.00 H new ATOM 0 HB3 SER A 819 14.109 1.649 -8.203 1.00 0.00 H new ATOM 0 HG SER A 819 12.905 0.243 -6.784 1.00 0.00 H new ATOM 1399 N ASN A 820 16.823 0.648 -10.582 1.00 0.00 N ATOM 1400 CA ASN A 820 16.921 1.214 -11.961 1.00 0.00 C ATOM 1401 C ASN A 820 17.384 0.136 -12.943 1.00 0.00 C ATOM 1402 O ASN A 820 17.546 0.384 -14.121 1.00 0.00 O ATOM 1403 CB ASN A 820 17.965 2.325 -11.861 1.00 0.00 C ATOM 1404 CG ASN A 820 17.264 3.678 -11.739 1.00 0.00 C ATOM 1405 OD1 ASN A 820 16.629 3.958 -10.742 1.00 0.00 O ATOM 1406 ND2 ASN A 820 17.354 4.536 -12.718 1.00 0.00 N ATOM 0 H ASN A 820 17.647 0.138 -10.264 1.00 0.00 H new ATOM 0 HA ASN A 820 15.962 1.585 -12.322 1.00 0.00 H new ATOM 0 HB2 ASN A 820 18.607 2.158 -10.996 1.00 0.00 H new ATOM 0 HB3 ASN A 820 18.607 2.315 -12.742 1.00 0.00 H new ATOM 0 HD21 ASN A 820 16.891 5.442 -12.646 1.00 0.00 H new ATOM 0 HD22 ASN A 820 17.887 4.301 -13.555 1.00 0.00 H new ATOM 1413 N PHE A 821 17.599 -1.059 -12.467 1.00 0.00 N ATOM 1414 CA PHE A 821 18.053 -2.153 -13.373 1.00 0.00 C ATOM 1415 C PHE A 821 17.109 -3.356 -13.267 1.00 0.00 C ATOM 1416 O PHE A 821 16.797 -4.000 -14.249 1.00 0.00 O ATOM 1417 CB PHE A 821 19.450 -2.521 -12.875 1.00 0.00 C ATOM 1418 CG PHE A 821 20.491 -1.873 -13.758 1.00 0.00 C ATOM 1419 CD1 PHE A 821 21.389 -2.668 -14.480 1.00 0.00 C ATOM 1420 CD2 PHE A 821 20.561 -0.477 -13.851 1.00 0.00 C ATOM 1421 CE1 PHE A 821 22.356 -2.070 -15.297 1.00 0.00 C ATOM 1422 CE2 PHE A 821 21.528 0.122 -14.669 1.00 0.00 C ATOM 1423 CZ PHE A 821 22.425 -0.674 -15.391 1.00 0.00 C ATOM 0 H PHE A 821 17.480 -1.326 -11.490 1.00 0.00 H new ATOM 0 HA PHE A 821 18.059 -1.848 -14.419 1.00 0.00 H new ATOM 0 HB2 PHE A 821 19.578 -2.192 -11.844 1.00 0.00 H new ATOM 0 HB3 PHE A 821 19.576 -3.604 -12.882 1.00 0.00 H new ATOM 0 HD1 PHE A 821 21.336 -3.744 -14.407 1.00 0.00 H new ATOM 0 HD2 PHE A 821 19.870 0.137 -13.293 1.00 0.00 H new ATOM 0 HE1 PHE A 821 23.048 -2.684 -15.854 1.00 0.00 H new ATOM 0 HE2 PHE A 821 21.581 1.198 -14.743 1.00 0.00 H new ATOM 0 HZ PHE A 821 23.171 -0.212 -16.021 1.00 0.00 H new ATOM 1433 N GLY A 822 16.653 -3.664 -12.083 1.00 0.00 N ATOM 1434 CA GLY A 822 15.731 -4.824 -11.917 1.00 0.00 C ATOM 1435 C GLY A 822 15.046 -4.747 -10.549 1.00 0.00 C ATOM 1436 O GLY A 822 13.837 -4.812 -10.446 1.00 0.00 O ATOM 0 H GLY A 822 16.879 -3.163 -11.224 1.00 0.00 H new ATOM 0 HA2 GLY A 822 14.983 -4.823 -12.710 1.00 0.00 H new ATOM 0 HA3 GLY A 822 16.286 -5.758 -12.004 1.00 0.00 H new ATOM 1440 N GLY A 823 15.808 -4.609 -9.496 1.00 0.00 N ATOM 1441 CA GLY A 823 15.196 -4.530 -8.139 1.00 0.00 C ATOM 1442 C GLY A 823 16.236 -4.905 -7.081 1.00 0.00 C ATOM 1443 O GLY A 823 16.672 -4.077 -6.306 1.00 0.00 O ATOM 0 H GLY A 823 16.826 -4.548 -9.518 1.00 0.00 H new ATOM 0 HA2 GLY A 823 14.824 -3.522 -7.956 1.00 0.00 H new ATOM 0 HA3 GLY A 823 14.340 -5.202 -8.076 1.00 0.00 H new ATOM 1447 N ASP A 824 16.637 -6.147 -7.042 1.00 0.00 N ATOM 1448 CA ASP A 824 17.650 -6.571 -6.031 1.00 0.00 C ATOM 1449 C ASP A 824 18.122 -8.000 -6.314 1.00 0.00 C ATOM 1450 O ASP A 824 17.562 -8.951 -5.808 1.00 0.00 O ATOM 1451 CB ASP A 824 16.921 -6.511 -4.691 1.00 0.00 C ATOM 1452 CG ASP A 824 17.888 -6.042 -3.601 1.00 0.00 C ATOM 1453 OD1 ASP A 824 18.099 -6.793 -2.662 1.00 0.00 O ATOM 1454 OD2 ASP A 824 18.399 -4.942 -3.725 1.00 0.00 O ATOM 0 H ASP A 824 16.308 -6.885 -7.664 1.00 0.00 H new ATOM 0 HA ASP A 824 18.535 -5.935 -6.047 1.00 0.00 H new ATOM 0 HB2 ASP A 824 16.073 -5.829 -4.757 1.00 0.00 H new ATOM 0 HB3 ASP A 824 16.521 -7.493 -4.439 1.00 0.00 H new ATOM 1459 N PRO A 825 19.141 -8.100 -7.121 1.00 0.00 N ATOM 1460 CA PRO A 825 19.698 -9.423 -7.478 1.00 0.00 C ATOM 1461 C PRO A 825 20.511 -9.992 -6.308 1.00 0.00 C ATOM 1462 O PRO A 825 20.183 -11.023 -5.754 1.00 0.00 O ATOM 1463 CB PRO A 825 20.594 -9.128 -8.674 1.00 0.00 C ATOM 1464 CG PRO A 825 20.969 -7.679 -8.538 1.00 0.00 C ATOM 1465 CD PRO A 825 19.857 -6.999 -7.769 1.00 0.00 C ATOM 0 HA PRO A 825 18.932 -10.164 -7.704 1.00 0.00 H new ATOM 0 HB2 PRO A 825 21.478 -9.765 -8.670 1.00 0.00 H new ATOM 0 HB3 PRO A 825 20.072 -9.313 -9.613 1.00 0.00 H new ATOM 0 HG2 PRO A 825 21.919 -7.575 -8.013 1.00 0.00 H new ATOM 0 HG3 PRO A 825 21.095 -7.220 -9.519 1.00 0.00 H new ATOM 0 HD2 PRO A 825 20.252 -6.295 -7.036 1.00 0.00 H new ATOM 0 HD3 PRO A 825 19.202 -6.434 -8.432 1.00 0.00 H new ATOM 1473 N CYS A 826 21.566 -9.328 -5.932 1.00 0.00 N ATOM 1474 CA CYS A 826 22.402 -9.826 -4.800 1.00 0.00 C ATOM 1475 C CYS A 826 22.371 -8.808 -3.648 1.00 0.00 C ATOM 1476 O CYS A 826 22.786 -7.678 -3.809 1.00 0.00 O ATOM 1477 CB CYS A 826 23.814 -9.954 -5.377 1.00 0.00 C ATOM 1478 SG CYS A 826 24.482 -11.589 -4.976 1.00 0.00 S ATOM 0 H CYS A 826 21.888 -8.460 -6.359 1.00 0.00 H new ATOM 0 HA CYS A 826 22.046 -10.775 -4.398 1.00 0.00 H new ATOM 0 HB2 CYS A 826 23.791 -9.813 -6.458 1.00 0.00 H new ATOM 0 HB3 CYS A 826 24.458 -9.176 -4.968 1.00 0.00 H new ATOM 1483 N PRO A 827 21.878 -9.250 -2.520 1.00 0.00 N ATOM 1484 CA PRO A 827 21.789 -8.370 -1.333 1.00 0.00 C ATOM 1485 C PRO A 827 23.169 -8.176 -0.692 1.00 0.00 C ATOM 1486 O PRO A 827 23.964 -9.092 -0.611 1.00 0.00 O ATOM 1487 CB PRO A 827 20.858 -9.122 -0.393 1.00 0.00 C ATOM 1488 CG PRO A 827 20.980 -10.563 -0.789 1.00 0.00 C ATOM 1489 CD PRO A 827 21.367 -10.597 -2.252 1.00 0.00 C ATOM 0 HA PRO A 827 21.428 -7.371 -1.576 1.00 0.00 H new ATOM 0 HB2 PRO A 827 21.146 -8.974 0.648 1.00 0.00 H new ATOM 0 HB3 PRO A 827 19.831 -8.772 -0.493 1.00 0.00 H new ATOM 0 HG2 PRO A 827 21.732 -11.066 -0.181 1.00 0.00 H new ATOM 0 HG3 PRO A 827 20.038 -11.087 -0.629 1.00 0.00 H new ATOM 0 HD2 PRO A 827 22.125 -11.356 -2.446 1.00 0.00 H new ATOM 0 HD3 PRO A 827 20.511 -10.832 -2.885 1.00 0.00 H new ATOM 1497 N GLU A 828 23.452 -6.984 -0.236 1.00 0.00 N ATOM 1498 CA GLU A 828 24.775 -6.712 0.403 1.00 0.00 C ATOM 1499 C GLU A 828 25.915 -7.022 -0.571 1.00 0.00 C ATOM 1500 O GLU A 828 27.064 -7.115 -0.185 1.00 0.00 O ATOM 1501 CB GLU A 828 24.833 -7.643 1.614 1.00 0.00 C ATOM 1502 CG GLU A 828 24.324 -6.902 2.853 1.00 0.00 C ATOM 1503 CD GLU A 828 25.341 -7.041 3.989 1.00 0.00 C ATOM 1504 OE1 GLU A 828 24.944 -7.450 5.067 1.00 0.00 O ATOM 1505 OE2 GLU A 828 26.499 -6.734 3.760 1.00 0.00 O ATOM 0 H GLU A 828 22.821 -6.183 -0.279 1.00 0.00 H new ATOM 0 HA GLU A 828 24.883 -5.666 0.689 1.00 0.00 H new ATOM 0 HB2 GLU A 828 24.226 -8.530 1.433 1.00 0.00 H new ATOM 0 HB3 GLU A 828 25.856 -7.984 1.776 1.00 0.00 H new ATOM 0 HG2 GLU A 828 24.166 -5.849 2.620 1.00 0.00 H new ATOM 0 HG3 GLU A 828 23.361 -7.308 3.162 1.00 0.00 H new ATOM 1512 N VAL A 829 25.611 -7.181 -1.828 1.00 0.00 N ATOM 1513 CA VAL A 829 26.680 -7.485 -2.819 1.00 0.00 C ATOM 1514 C VAL A 829 26.465 -6.671 -4.094 1.00 0.00 C ATOM 1515 O VAL A 829 25.916 -7.158 -5.065 1.00 0.00 O ATOM 1516 CB VAL A 829 26.530 -8.970 -3.109 1.00 0.00 C ATOM 1517 CG1 VAL A 829 27.397 -9.350 -4.313 1.00 0.00 C ATOM 1518 CG2 VAL A 829 26.974 -9.771 -1.886 1.00 0.00 C ATOM 0 H VAL A 829 24.669 -7.114 -2.212 1.00 0.00 H new ATOM 0 HA VAL A 829 27.673 -7.236 -2.446 1.00 0.00 H new ATOM 0 HB VAL A 829 25.487 -9.193 -3.333 1.00 0.00 H new ATOM 0 HG11 VAL A 829 27.288 -10.415 -4.519 1.00 0.00 H new ATOM 0 HG12 VAL A 829 27.080 -8.778 -5.185 1.00 0.00 H new ATOM 0 HG13 VAL A 829 28.441 -9.128 -4.094 1.00 0.00 H new ATOM 0 HG21 VAL A 829 26.868 -10.836 -2.091 1.00 0.00 H new ATOM 0 HG22 VAL A 829 28.017 -9.547 -1.663 1.00 0.00 H new ATOM 0 HG23 VAL A 829 26.354 -9.502 -1.030 1.00 0.00 H new ATOM 1528 N MET A 830 26.887 -5.435 -4.111 1.00 0.00 N ATOM 1529 CA MET A 830 26.692 -4.618 -5.338 1.00 0.00 C ATOM 1530 C MET A 830 27.334 -3.232 -5.194 1.00 0.00 C ATOM 1531 O MET A 830 26.847 -2.383 -4.474 1.00 0.00 O ATOM 1532 CB MET A 830 25.176 -4.494 -5.487 1.00 0.00 C ATOM 1533 CG MET A 830 24.770 -4.882 -6.911 1.00 0.00 C ATOM 1534 SD MET A 830 23.152 -5.693 -6.880 1.00 0.00 S ATOM 1535 CE MET A 830 22.208 -4.294 -6.227 1.00 0.00 C ATOM 0 H MET A 830 27.353 -4.962 -3.337 1.00 0.00 H new ATOM 0 HA MET A 830 27.160 -5.079 -6.208 1.00 0.00 H new ATOM 0 HB2 MET A 830 24.675 -5.140 -4.766 1.00 0.00 H new ATOM 0 HB3 MET A 830 24.861 -3.473 -5.273 1.00 0.00 H new ATOM 0 HG2 MET A 830 24.732 -3.995 -7.544 1.00 0.00 H new ATOM 0 HG3 MET A 830 25.515 -5.550 -7.343 1.00 0.00 H new ATOM 0 HE1 MET A 830 21.910 -4.504 -5.200 1.00 0.00 H new ATOM 0 HE2 MET A 830 22.825 -3.396 -6.250 1.00 0.00 H new ATOM 0 HE3 MET A 830 21.319 -4.138 -6.838 1.00 0.00 H new ATOM 1545 N LYS A 831 28.428 -2.998 -5.877 1.00 0.00 N ATOM 1546 CA LYS A 831 29.096 -1.669 -5.778 1.00 0.00 C ATOM 1547 C LYS A 831 30.214 -1.544 -6.821 1.00 0.00 C ATOM 1548 O LYS A 831 31.345 -1.231 -6.502 1.00 0.00 O ATOM 1549 CB LYS A 831 29.671 -1.600 -4.364 1.00 0.00 C ATOM 1550 CG LYS A 831 29.852 -0.133 -3.964 1.00 0.00 C ATOM 1551 CD LYS A 831 30.345 -0.048 -2.519 1.00 0.00 C ATOM 1552 CE LYS A 831 31.743 -0.669 -2.415 1.00 0.00 C ATOM 1553 NZ LYS A 831 32.587 0.123 -3.353 1.00 0.00 N ATOM 0 H LYS A 831 28.884 -3.669 -6.496 1.00 0.00 H new ATOM 0 HA LYS A 831 28.397 -0.855 -5.969 1.00 0.00 H new ATOM 0 HB2 LYS A 831 29.004 -2.101 -3.663 1.00 0.00 H new ATOM 0 HB3 LYS A 831 30.627 -2.121 -4.322 1.00 0.00 H new ATOM 0 HG2 LYS A 831 30.566 0.350 -4.631 1.00 0.00 H new ATOM 0 HG3 LYS A 831 28.908 0.401 -4.068 1.00 0.00 H new ATOM 0 HD2 LYS A 831 30.373 0.992 -2.194 1.00 0.00 H new ATOM 0 HD3 LYS A 831 29.654 -0.570 -1.857 1.00 0.00 H new ATOM 0 HE2 LYS A 831 32.125 -0.612 -1.396 1.00 0.00 H new ATOM 0 HE3 LYS A 831 31.728 -1.723 -2.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 831 33.571 0.127 -3.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 831 32.548 -0.304 -4.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 831 32.232 1.100 -3.399 1.00 0.00 H new ATOM 1567 N ARG A 832 29.904 -1.787 -8.064 1.00 0.00 N ATOM 1568 CA ARG A 832 30.944 -1.683 -9.132 1.00 0.00 C ATOM 1569 C ARG A 832 30.293 -1.843 -10.509 1.00 0.00 C ATOM 1570 O ARG A 832 29.900 -2.924 -10.898 1.00 0.00 O ATOM 1571 CB ARG A 832 31.915 -2.830 -8.856 1.00 0.00 C ATOM 1572 CG ARG A 832 33.165 -2.280 -8.168 1.00 0.00 C ATOM 1573 CD ARG A 832 34.397 -3.046 -8.650 1.00 0.00 C ATOM 1574 NE ARG A 832 35.445 -2.762 -7.631 1.00 0.00 N ATOM 1575 CZ ARG A 832 36.701 -2.715 -7.982 1.00 0.00 C ATOM 1576 NH1 ARG A 832 37.275 -1.563 -8.197 1.00 0.00 N ATOM 1577 NH2 ARG A 832 37.382 -3.819 -8.118 1.00 0.00 N ATOM 0 H ARG A 832 28.975 -2.054 -8.389 1.00 0.00 H new ATOM 0 HA ARG A 832 31.451 -0.718 -9.128 1.00 0.00 H new ATOM 0 HB2 ARG A 832 31.439 -3.581 -8.225 1.00 0.00 H new ATOM 0 HB3 ARG A 832 32.187 -3.324 -9.789 1.00 0.00 H new ATOM 0 HG2 ARG A 832 33.276 -1.218 -8.388 1.00 0.00 H new ATOM 0 HG3 ARG A 832 33.067 -2.373 -7.086 1.00 0.00 H new ATOM 0 HD2 ARG A 832 34.195 -4.115 -8.722 1.00 0.00 H new ATOM 0 HD3 ARG A 832 34.708 -2.713 -9.640 1.00 0.00 H new ATOM 0 HE ARG A 832 35.181 -2.604 -6.658 1.00 0.00 H new ATOM 0 HH11 ARG A 832 36.742 -0.700 -8.091 1.00 0.00 H new ATOM 0 HH12 ARG A 832 38.257 -1.526 -8.471 1.00 0.00 H new ATOM 0 HH21 ARG A 832 36.933 -4.719 -7.950 1.00 0.00 H new ATOM 0 HH22 ARG A 832 38.364 -3.782 -8.392 1.00 0.00 H new ATOM 1591 N VAL A 833 30.179 -0.776 -11.253 1.00 0.00 N ATOM 1592 CA VAL A 833 29.551 -0.874 -12.605 1.00 0.00 C ATOM 1593 C VAL A 833 30.608 -0.744 -13.708 1.00 0.00 C ATOM 1594 O VAL A 833 31.158 0.313 -13.935 1.00 0.00 O ATOM 1595 CB VAL A 833 28.575 0.300 -12.673 1.00 0.00 C ATOM 1596 CG1 VAL A 833 27.594 0.082 -13.826 1.00 0.00 C ATOM 1597 CG2 VAL A 833 27.801 0.399 -11.358 1.00 0.00 C ATOM 0 H VAL A 833 30.492 0.157 -10.985 1.00 0.00 H new ATOM 0 HA VAL A 833 29.058 -1.835 -12.753 1.00 0.00 H new ATOM 0 HB VAL A 833 29.130 1.223 -12.837 1.00 0.00 H new ATOM 0 HG11 VAL A 833 26.898 0.919 -13.875 1.00 0.00 H new ATOM 0 HG12 VAL A 833 28.145 0.013 -14.764 1.00 0.00 H new ATOM 0 HG13 VAL A 833 27.039 -0.842 -13.662 1.00 0.00 H new ATOM 0 HG21 VAL A 833 27.105 1.237 -11.408 1.00 0.00 H new ATOM 0 HG22 VAL A 833 27.246 -0.524 -11.192 1.00 0.00 H new ATOM 0 HG23 VAL A 833 28.499 0.555 -10.536 1.00 0.00 H new ATOM 1607 N ALA A 834 30.892 -1.817 -14.391 1.00 0.00 N ATOM 1608 CA ALA A 834 31.909 -1.765 -15.480 1.00 0.00 C ATOM 1609 C ALA A 834 31.209 -1.907 -16.835 1.00 0.00 C ATOM 1610 O ALA A 834 30.330 -2.728 -17.001 1.00 0.00 O ATOM 1611 CB ALA A 834 32.832 -2.955 -15.223 1.00 0.00 C ATOM 0 H ALA A 834 30.463 -2.730 -14.242 1.00 0.00 H new ATOM 0 HA ALA A 834 32.463 -0.826 -15.495 1.00 0.00 H new ATOM 0 HB1 ALA A 834 33.609 -2.984 -15.986 1.00 0.00 H new ATOM 0 HB2 ALA A 834 33.292 -2.853 -14.240 1.00 0.00 H new ATOM 0 HB3 ALA A 834 32.254 -3.878 -15.259 1.00 0.00 H new ATOM 1617 N VAL A 835 31.585 -1.116 -17.805 1.00 0.00 N ATOM 1618 CA VAL A 835 30.926 -1.223 -19.140 1.00 0.00 C ATOM 1619 C VAL A 835 31.915 -0.901 -20.267 1.00 0.00 C ATOM 1620 O VAL A 835 32.906 -0.227 -20.072 1.00 0.00 O ATOM 1621 CB VAL A 835 29.806 -0.184 -19.108 1.00 0.00 C ATOM 1622 CG1 VAL A 835 29.285 0.052 -20.527 1.00 0.00 C ATOM 1623 CG2 VAL A 835 28.663 -0.691 -18.225 1.00 0.00 C ATOM 0 H VAL A 835 32.314 -0.406 -17.732 1.00 0.00 H new ATOM 0 HA VAL A 835 30.556 -2.231 -19.329 1.00 0.00 H new ATOM 0 HB VAL A 835 30.193 0.751 -18.703 1.00 0.00 H new ATOM 0 HG11 VAL A 835 28.486 0.793 -20.503 1.00 0.00 H new ATOM 0 HG12 VAL A 835 30.097 0.414 -21.157 1.00 0.00 H new ATOM 0 HG13 VAL A 835 28.900 -0.883 -20.933 1.00 0.00 H new ATOM 0 HG21 VAL A 835 27.864 0.050 -18.202 1.00 0.00 H new ATOM 0 HG22 VAL A 835 28.278 -1.627 -18.630 1.00 0.00 H new ATOM 0 HG23 VAL A 835 29.032 -0.858 -17.213 1.00 0.00 H new ATOM 1633 N GLU A 836 31.641 -1.386 -21.447 1.00 0.00 N ATOM 1634 CA GLU A 836 32.544 -1.122 -22.605 1.00 0.00 C ATOM 1635 C GLU A 836 31.692 -0.743 -23.822 1.00 0.00 C ATOM 1636 O GLU A 836 30.519 -1.052 -23.881 1.00 0.00 O ATOM 1637 CB GLU A 836 33.286 -2.438 -22.841 1.00 0.00 C ATOM 1638 CG GLU A 836 34.324 -2.646 -21.737 1.00 0.00 C ATOM 1639 CD GLU A 836 33.749 -3.567 -20.661 1.00 0.00 C ATOM 1640 OE1 GLU A 836 33.323 -3.058 -19.639 1.00 0.00 O ATOM 1641 OE2 GLU A 836 33.745 -4.768 -20.879 1.00 0.00 O ATOM 0 H GLU A 836 30.824 -1.958 -21.661 1.00 0.00 H new ATOM 0 HA GLU A 836 33.243 -0.305 -22.427 1.00 0.00 H new ATOM 0 HB2 GLU A 836 32.580 -3.268 -22.852 1.00 0.00 H new ATOM 0 HB3 GLU A 836 33.774 -2.422 -23.815 1.00 0.00 H new ATOM 0 HG2 GLU A 836 35.232 -3.080 -22.155 1.00 0.00 H new ATOM 0 HG3 GLU A 836 34.602 -1.687 -21.299 1.00 0.00 H new ATOM 1648 N ALA A 837 32.258 -0.082 -24.793 1.00 0.00 N ATOM 1649 CA ALA A 837 31.440 0.300 -25.985 1.00 0.00 C ATOM 1650 C ALA A 837 32.217 0.096 -27.289 1.00 0.00 C ATOM 1651 O ALA A 837 33.433 0.121 -27.316 1.00 0.00 O ATOM 1652 CB ALA A 837 31.125 1.781 -25.780 1.00 0.00 C ATOM 0 H ALA A 837 33.236 0.208 -24.817 1.00 0.00 H new ATOM 0 HA ALA A 837 30.543 -0.314 -26.070 1.00 0.00 H new ATOM 0 HB1 ALA A 837 30.524 2.144 -26.614 1.00 0.00 H new ATOM 0 HB2 ALA A 837 30.571 1.910 -24.850 1.00 0.00 H new ATOM 0 HB3 ALA A 837 32.055 2.347 -25.729 1.00 0.00 H new ATOM 1658 N VAL A 838 31.510 -0.106 -28.370 1.00 0.00 N ATOM 1659 CA VAL A 838 32.177 -0.312 -29.686 1.00 0.00 C ATOM 1660 C VAL A 838 31.691 0.754 -30.675 1.00 0.00 C ATOM 1661 O VAL A 838 30.557 0.734 -31.112 1.00 0.00 O ATOM 1662 CB VAL A 838 31.745 -1.704 -30.143 1.00 0.00 C ATOM 1663 CG1 VAL A 838 32.539 -2.099 -31.389 1.00 0.00 C ATOM 1664 CG2 VAL A 838 32.014 -2.718 -29.027 1.00 0.00 C ATOM 0 H VAL A 838 30.491 -0.137 -28.396 1.00 0.00 H new ATOM 0 HA VAL A 838 33.262 -0.231 -29.623 1.00 0.00 H new ATOM 0 HB VAL A 838 30.680 -1.694 -30.375 1.00 0.00 H new ATOM 0 HG11 VAL A 838 32.232 -3.092 -31.716 1.00 0.00 H new ATOM 0 HG12 VAL A 838 32.348 -1.379 -32.185 1.00 0.00 H new ATOM 0 HG13 VAL A 838 33.603 -2.107 -31.155 1.00 0.00 H new ATOM 0 HG21 VAL A 838 31.705 -3.711 -29.355 1.00 0.00 H new ATOM 0 HG22 VAL A 838 33.079 -2.728 -28.793 1.00 0.00 H new ATOM 0 HG23 VAL A 838 31.450 -2.438 -28.137 1.00 0.00 H new ATOM 1674 N CYS A 839 32.534 1.680 -31.033 1.00 0.00 N ATOM 1675 CA CYS A 839 32.105 2.739 -31.993 1.00 0.00 C ATOM 1676 C CYS A 839 32.767 2.527 -33.357 1.00 0.00 C ATOM 1677 O CYS A 839 33.968 2.366 -33.459 1.00 0.00 O ATOM 1678 CB CYS A 839 32.568 4.055 -31.364 1.00 0.00 C ATOM 1679 SG CYS A 839 31.133 4.958 -30.732 1.00 0.00 S ATOM 0 H CYS A 839 33.497 1.752 -30.706 1.00 0.00 H new ATOM 0 HA CYS A 839 31.029 2.727 -32.165 1.00 0.00 H new ATOM 0 HB2 CYS A 839 33.271 3.856 -30.555 1.00 0.00 H new ATOM 0 HB3 CYS A 839 33.094 4.659 -32.103 1.00 0.00 H new ATOM 1684 N SER A 840 31.989 2.529 -34.411 1.00 0.00 N ATOM 1685 CA SER A 840 32.571 2.328 -35.770 1.00 0.00 C ATOM 1686 C SER A 840 32.164 3.479 -36.696 1.00 0.00 C ATOM 1687 O SER A 840 31.768 4.537 -36.249 1.00 0.00 O ATOM 1688 CB SER A 840 31.977 1.008 -36.262 1.00 0.00 C ATOM 1689 OG SER A 840 30.613 1.206 -36.615 1.00 0.00 O ATOM 0 H SER A 840 30.978 2.661 -34.387 1.00 0.00 H new ATOM 0 HA SER A 840 33.661 2.305 -35.754 1.00 0.00 H new ATOM 0 HB2 SER A 840 32.537 0.643 -37.123 1.00 0.00 H new ATOM 0 HB3 SER A 840 32.056 0.249 -35.484 1.00 0.00 H new ATOM 0 HG SER A 840 30.231 0.361 -36.932 1.00 0.00 H new ATOM 1695 N THR A 841 32.259 3.280 -37.981 1.00 0.00 N ATOM 1696 CA THR A 841 31.877 4.365 -38.930 1.00 0.00 C ATOM 1697 C THR A 841 30.500 4.087 -39.535 1.00 0.00 C ATOM 1698 O THR A 841 30.063 4.754 -40.452 1.00 0.00 O ATOM 1699 CB THR A 841 32.953 4.345 -40.012 1.00 0.00 C ATOM 1700 OG1 THR A 841 33.522 3.046 -40.089 1.00 0.00 O ATOM 1701 CG2 THR A 841 34.045 5.364 -39.672 1.00 0.00 C ATOM 0 H THR A 841 32.584 2.416 -38.415 1.00 0.00 H new ATOM 0 HA THR A 841 31.813 5.335 -38.438 1.00 0.00 H new ATOM 0 HB THR A 841 32.506 4.604 -40.972 1.00 0.00 H new ATOM 0 HG1 THR A 841 34.212 3.032 -40.785 1.00 0.00 H new ATOM 0 HG21 THR A 841 34.812 5.347 -40.446 1.00 0.00 H new ATOM 0 HG22 THR A 841 33.608 6.361 -39.616 1.00 0.00 H new ATOM 0 HG23 THR A 841 34.494 5.110 -38.712 1.00 0.00 H new