USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=18 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 777 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 794 HIS : no HD1:sc= -7.83! C(o=-17!,f=-11!) USER MOD Set 1.3: A 795 SER OG : rot -174:sc= -0.47 USER MOD Set 1.4: A 797 ASN : amide:sc= -5.74! C(o=-17!,f=-16!) USER MOD Set 1.5: A 798 SER OG : rot 45:sc= -2.66! USER MOD Single : A 729 SER OG : rot 180:sc= 0 USER MOD Single : A 736 SER OG : rot 180:sc= 0 USER MOD Single : A 757 THR OG1 : rot 35:sc= 0.621 USER MOD Single : A 759 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 761 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 763 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 768 GLN : amide:sc= -1.54 K(o=-1.5,f=-7.3!) USER MOD Single : A 769 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 SER OG : rot -65:sc= 0.197 USER MOD Single : A 774 LYS NZ :NH3+ -177:sc= 0.732 (180deg=0.727) USER MOD Single : A 780 THR OG1 : rot 2:sc= -1.48! USER MOD Single : A 784 THR OG1 : rot 180:sc= -0.0659 USER MOD Single : A 787 THR OG1 : rot 180:sc= 0 USER MOD Single : A 789 GLN : amide:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 790 GLN : amide:sc= -2.42 K(o=-2.4,f=-3!) USER MOD Single : A 799 ASN : amide:sc= -0.555 X(o=-0.56,f=-0.55) USER MOD Single : A 800 SER OG : rot 180:sc= 0 USER MOD Single : A 805 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 817 SER OG : rot -160:sc= -3.94! USER MOD Single : A 819 SER OG : rot 180:sc= 0 USER MOD Single : A 820 ASN : amide:sc= -1.46 K(o=-1.5,f=-2.3!) USER MOD Single : A 830 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 831 LYS NZ :NH3+ -173:sc= -0.551 (180deg=-0.717) USER MOD Single : A 840 SER OG : rot 180:sc=-0.000326 USER MOD Single : A 841 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 39 N VAL A 728 36.966 1.543 -35.231 1.00 0.00 N ATOM 40 CA VAL A 728 37.903 2.663 -34.963 1.00 0.00 C ATOM 41 C VAL A 728 37.953 2.956 -33.454 1.00 0.00 C ATOM 42 O VAL A 728 37.089 3.611 -32.909 1.00 0.00 O ATOM 43 CB VAL A 728 37.322 3.845 -35.762 1.00 0.00 C ATOM 44 CG1 VAL A 728 37.503 5.164 -34.995 1.00 0.00 C ATOM 45 CG2 VAL A 728 38.044 3.944 -37.108 1.00 0.00 C ATOM 0 HA VAL A 728 38.930 2.449 -35.260 1.00 0.00 H new ATOM 0 HB VAL A 728 36.256 3.673 -35.915 1.00 0.00 H new ATOM 0 HG11 VAL A 728 37.085 5.984 -35.578 1.00 0.00 H new ATOM 0 HG12 VAL A 728 36.988 5.101 -34.037 1.00 0.00 H new ATOM 0 HG13 VAL A 728 38.565 5.343 -34.825 1.00 0.00 H new ATOM 0 HG21 VAL A 728 37.637 4.779 -37.679 1.00 0.00 H new ATOM 0 HG22 VAL A 728 39.109 4.105 -36.939 1.00 0.00 H new ATOM 0 HG23 VAL A 728 37.901 3.019 -37.667 1.00 0.00 H new ATOM 55 N SER A 729 38.962 2.467 -32.785 1.00 0.00 N ATOM 56 CA SER A 729 39.080 2.713 -31.318 1.00 0.00 C ATOM 57 C SER A 729 37.845 2.190 -30.578 1.00 0.00 C ATOM 58 O SER A 729 36.846 1.842 -31.178 1.00 0.00 O ATOM 59 CB SER A 729 39.175 4.226 -31.182 1.00 0.00 C ATOM 60 OG SER A 729 40.541 4.621 -31.264 1.00 0.00 O ATOM 0 H SER A 729 39.711 1.907 -33.191 1.00 0.00 H new ATOM 0 HA SER A 729 39.942 2.202 -30.888 1.00 0.00 H new ATOM 0 HB2 SER A 729 38.597 4.710 -31.969 1.00 0.00 H new ATOM 0 HB3 SER A 729 38.749 4.545 -30.231 1.00 0.00 H new ATOM 0 HG SER A 729 40.606 5.595 -31.178 1.00 0.00 H new ATOM 66 N GLY A 730 37.913 2.132 -29.275 1.00 0.00 N ATOM 67 CA GLY A 730 36.753 1.636 -28.483 1.00 0.00 C ATOM 68 C GLY A 730 36.468 2.618 -27.346 1.00 0.00 C ATOM 69 O GLY A 730 36.896 3.754 -27.377 1.00 0.00 O ATOM 0 H GLY A 730 38.726 2.408 -28.724 1.00 0.00 H new ATOM 0 HA2 GLY A 730 35.876 1.536 -29.123 1.00 0.00 H new ATOM 0 HA3 GLY A 730 36.968 0.646 -28.080 1.00 0.00 H new ATOM 73 N VAL A 731 35.754 2.193 -26.340 1.00 0.00 N ATOM 74 CA VAL A 731 35.449 3.115 -25.205 1.00 0.00 C ATOM 75 C VAL A 731 35.286 2.323 -23.906 1.00 0.00 C ATOM 76 O VAL A 731 34.667 1.277 -23.875 1.00 0.00 O ATOM 77 CB VAL A 731 34.138 3.796 -25.583 1.00 0.00 C ATOM 78 CG1 VAL A 731 33.921 5.015 -24.688 1.00 0.00 C ATOM 79 CG2 VAL A 731 34.195 4.244 -27.045 1.00 0.00 C ATOM 0 H VAL A 731 35.369 1.252 -26.253 1.00 0.00 H new ATOM 0 HA VAL A 731 36.248 3.837 -25.038 1.00 0.00 H new ATOM 0 HB VAL A 731 33.315 3.094 -25.450 1.00 0.00 H new ATOM 0 HG11 VAL A 731 32.984 5.502 -24.958 1.00 0.00 H new ATOM 0 HG12 VAL A 731 33.878 4.698 -23.646 1.00 0.00 H new ATOM 0 HG13 VAL A 731 34.746 5.715 -24.821 1.00 0.00 H new ATOM 0 HG21 VAL A 731 33.257 4.730 -27.313 1.00 0.00 H new ATOM 0 HG22 VAL A 731 35.019 4.945 -27.179 1.00 0.00 H new ATOM 0 HG23 VAL A 731 34.350 3.376 -27.686 1.00 0.00 H new ATOM 89 N CYS A 732 35.838 2.816 -22.832 1.00 0.00 N ATOM 90 CA CYS A 732 35.720 2.100 -21.531 1.00 0.00 C ATOM 91 C CYS A 732 35.206 3.060 -20.453 1.00 0.00 C ATOM 92 O CYS A 732 35.545 4.227 -20.439 1.00 0.00 O ATOM 93 CB CYS A 732 37.141 1.643 -21.209 1.00 0.00 C ATOM 94 SG CYS A 732 37.516 0.137 -22.138 1.00 0.00 S ATOM 0 H CYS A 732 36.368 3.687 -22.799 1.00 0.00 H new ATOM 0 HA CYS A 732 35.022 1.264 -21.573 1.00 0.00 H new ATOM 0 HB2 CYS A 732 37.853 2.427 -21.465 1.00 0.00 H new ATOM 0 HB3 CYS A 732 37.241 1.458 -20.140 1.00 0.00 H new ATOM 99 N ALA A 733 34.392 2.585 -19.548 1.00 0.00 N ATOM 100 CA ALA A 733 33.866 3.485 -18.480 1.00 0.00 C ATOM 101 C ALA A 733 33.631 2.705 -17.179 1.00 0.00 C ATOM 102 O ALA A 733 32.683 1.956 -17.055 1.00 0.00 O ATOM 103 CB ALA A 733 32.545 4.017 -19.032 1.00 0.00 C ATOM 0 H ALA A 733 34.070 1.618 -19.502 1.00 0.00 H new ATOM 0 HA ALA A 733 34.565 4.286 -18.239 1.00 0.00 H new ATOM 0 HB1 ALA A 733 32.091 4.690 -18.304 1.00 0.00 H new ATOM 0 HB2 ALA A 733 32.730 4.558 -19.960 1.00 0.00 H new ATOM 0 HB3 ALA A 733 31.870 3.184 -19.226 1.00 0.00 H new ATOM 109 N ASP A 734 34.491 2.879 -16.211 1.00 0.00 N ATOM 110 CA ASP A 734 34.319 2.150 -14.916 1.00 0.00 C ATOM 111 C ASP A 734 33.930 3.137 -13.806 1.00 0.00 C ATOM 112 O ASP A 734 34.751 3.879 -13.305 1.00 0.00 O ATOM 113 CB ASP A 734 35.685 1.513 -14.620 1.00 0.00 C ATOM 114 CG ASP A 734 36.806 2.509 -14.933 1.00 0.00 C ATOM 115 OD1 ASP A 734 36.817 3.570 -14.332 1.00 0.00 O ATOM 116 OD2 ASP A 734 37.637 2.191 -15.768 1.00 0.00 O ATOM 0 H ASP A 734 35.304 3.493 -16.259 1.00 0.00 H new ATOM 0 HA ASP A 734 33.531 1.399 -14.968 1.00 0.00 H new ATOM 0 HB2 ASP A 734 35.736 1.212 -13.574 1.00 0.00 H new ATOM 0 HB3 ASP A 734 35.812 0.610 -15.218 1.00 0.00 H new ATOM 121 N VAL A 735 32.681 3.152 -13.420 1.00 0.00 N ATOM 122 CA VAL A 735 32.240 4.091 -12.344 1.00 0.00 C ATOM 123 C VAL A 735 31.453 3.333 -11.268 1.00 0.00 C ATOM 124 O VAL A 735 30.467 2.687 -11.549 1.00 0.00 O ATOM 125 CB VAL A 735 31.336 5.103 -13.049 1.00 0.00 C ATOM 126 CG1 VAL A 735 30.708 6.036 -12.011 1.00 0.00 C ATOM 127 CG2 VAL A 735 32.165 5.926 -14.039 1.00 0.00 C ATOM 0 H VAL A 735 31.947 2.556 -13.802 1.00 0.00 H new ATOM 0 HA VAL A 735 33.082 4.570 -11.845 1.00 0.00 H new ATOM 0 HB VAL A 735 30.549 4.574 -13.586 1.00 0.00 H new ATOM 0 HG11 VAL A 735 30.064 6.758 -12.513 1.00 0.00 H new ATOM 0 HG12 VAL A 735 30.117 5.451 -11.306 1.00 0.00 H new ATOM 0 HG13 VAL A 735 31.495 6.565 -11.474 1.00 0.00 H new ATOM 0 HG21 VAL A 735 31.521 6.647 -14.542 1.00 0.00 H new ATOM 0 HG22 VAL A 735 32.953 6.455 -13.502 1.00 0.00 H new ATOM 0 HG23 VAL A 735 32.613 5.262 -14.779 1.00 0.00 H new ATOM 137 N SER A 736 31.882 3.407 -10.038 1.00 0.00 N ATOM 138 CA SER A 736 31.151 2.686 -8.954 1.00 0.00 C ATOM 139 C SER A 736 29.978 3.532 -8.448 1.00 0.00 C ATOM 140 O SER A 736 29.948 4.734 -8.616 1.00 0.00 O ATOM 141 CB SER A 736 32.180 2.481 -7.846 1.00 0.00 C ATOM 142 OG SER A 736 32.189 3.622 -6.998 1.00 0.00 O ATOM 0 H SER A 736 32.703 3.932 -9.736 1.00 0.00 H new ATOM 0 HA SER A 736 30.733 1.741 -9.301 1.00 0.00 H new ATOM 0 HB2 SER A 736 31.939 1.587 -7.270 1.00 0.00 H new ATOM 0 HB3 SER A 736 33.169 2.325 -8.276 1.00 0.00 H new ATOM 0 HG SER A 736 32.848 3.494 -6.284 1.00 0.00 H new ATOM 148 N GLU A 737 29.009 2.909 -7.832 1.00 0.00 N ATOM 149 CA GLU A 737 27.834 3.672 -7.312 1.00 0.00 C ATOM 150 C GLU A 737 28.132 4.197 -5.902 1.00 0.00 C ATOM 151 O GLU A 737 28.782 3.543 -5.111 1.00 0.00 O ATOM 152 CB GLU A 737 26.689 2.656 -7.281 1.00 0.00 C ATOM 153 CG GLU A 737 25.566 3.173 -6.379 1.00 0.00 C ATOM 154 CD GLU A 737 24.337 2.275 -6.526 1.00 0.00 C ATOM 155 OE1 GLU A 737 24.502 1.067 -6.468 1.00 0.00 O ATOM 156 OE2 GLU A 737 23.253 2.809 -6.693 1.00 0.00 O ATOM 0 H GLU A 737 28.979 1.903 -7.666 1.00 0.00 H new ATOM 0 HA GLU A 737 27.592 4.538 -7.928 1.00 0.00 H new ATOM 0 HB2 GLU A 737 26.311 2.489 -8.290 1.00 0.00 H new ATOM 0 HB3 GLU A 737 27.051 1.696 -6.913 1.00 0.00 H new ATOM 0 HG2 GLU A 737 25.897 3.187 -5.341 1.00 0.00 H new ATOM 0 HG3 GLU A 737 25.314 4.199 -6.647 1.00 0.00 H new ATOM 479 N THR A 757 23.844 7.135 -5.653 1.00 0.00 N ATOM 480 CA THR A 757 23.618 6.794 -7.090 1.00 0.00 C ATOM 481 C THR A 757 24.514 7.654 -7.986 1.00 0.00 C ATOM 482 O THR A 757 24.454 8.867 -7.963 1.00 0.00 O ATOM 483 CB THR A 757 22.142 7.109 -7.344 1.00 0.00 C ATOM 484 OG1 THR A 757 21.885 8.467 -7.012 1.00 0.00 O ATOM 485 CG2 THR A 757 21.267 6.196 -6.484 1.00 0.00 C ATOM 0 HA THR A 757 23.856 5.753 -7.310 1.00 0.00 H new ATOM 0 HB THR A 757 21.911 6.942 -8.396 1.00 0.00 H new ATOM 0 HG1 THR A 757 22.670 9.011 -7.230 1.00 0.00 H new ATOM 0 HG21 THR A 757 20.216 6.422 -6.666 1.00 0.00 H new ATOM 0 HG22 THR A 757 21.464 5.155 -6.741 1.00 0.00 H new ATOM 0 HG23 THR A 757 21.496 6.359 -5.431 1.00 0.00 H new ATOM 493 N ALA A 758 25.344 7.031 -8.778 1.00 0.00 N ATOM 494 CA ALA A 758 26.245 7.806 -9.678 1.00 0.00 C ATOM 495 C ALA A 758 25.840 7.597 -11.142 1.00 0.00 C ATOM 496 O ALA A 758 25.202 6.622 -11.486 1.00 0.00 O ATOM 497 CB ALA A 758 27.640 7.238 -9.423 1.00 0.00 C ATOM 0 H ALA A 758 25.437 6.017 -8.841 1.00 0.00 H new ATOM 0 HA ALA A 758 26.198 8.878 -9.486 1.00 0.00 H new ATOM 0 HB1 ALA A 758 28.365 7.757 -10.050 1.00 0.00 H new ATOM 0 HB2 ALA A 758 27.903 7.376 -8.374 1.00 0.00 H new ATOM 0 HB3 ALA A 758 27.649 6.175 -9.663 1.00 0.00 H new ATOM 503 N LYS A 759 26.209 8.506 -12.004 1.00 0.00 N ATOM 504 CA LYS A 759 25.846 8.362 -13.445 1.00 0.00 C ATOM 505 C LYS A 759 27.109 8.145 -14.282 1.00 0.00 C ATOM 506 O LYS A 759 28.193 8.536 -13.899 1.00 0.00 O ATOM 507 CB LYS A 759 25.175 9.683 -13.822 1.00 0.00 C ATOM 508 CG LYS A 759 23.829 9.403 -14.491 1.00 0.00 C ATOM 509 CD LYS A 759 23.222 10.718 -14.984 1.00 0.00 C ATOM 510 CE LYS A 759 22.078 11.132 -14.054 1.00 0.00 C ATOM 511 NZ LYS A 759 21.477 12.336 -14.696 1.00 0.00 N ATOM 0 H LYS A 759 26.746 9.342 -11.774 1.00 0.00 H new ATOM 0 HA LYS A 759 25.191 7.510 -13.624 1.00 0.00 H new ATOM 0 HB2 LYS A 759 25.030 10.295 -12.932 1.00 0.00 H new ATOM 0 HB3 LYS A 759 25.817 10.249 -14.497 1.00 0.00 H new ATOM 0 HG2 LYS A 759 23.962 8.716 -15.326 1.00 0.00 H new ATOM 0 HG3 LYS A 759 23.153 8.920 -13.785 1.00 0.00 H new ATOM 0 HD2 LYS A 759 23.985 11.496 -15.009 1.00 0.00 H new ATOM 0 HD3 LYS A 759 22.853 10.601 -16.003 1.00 0.00 H new ATOM 0 HE2 LYS A 759 21.345 10.332 -13.950 1.00 0.00 H new ATOM 0 HE3 LYS A 759 22.445 11.360 -13.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 759 20.685 12.679 -14.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 759 22.197 13.083 -14.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 759 21.130 12.087 -15.644 1.00 0.00 H new ATOM 525 N VAL A 760 26.978 7.523 -15.420 1.00 0.00 N ATOM 526 CA VAL A 760 28.174 7.285 -16.278 1.00 0.00 C ATOM 527 C VAL A 760 28.105 8.176 -17.518 1.00 0.00 C ATOM 528 O VAL A 760 27.066 8.320 -18.132 1.00 0.00 O ATOM 529 CB VAL A 760 28.096 5.810 -16.668 1.00 0.00 C ATOM 530 CG1 VAL A 760 29.403 5.392 -17.348 1.00 0.00 C ATOM 531 CG2 VAL A 760 27.879 4.963 -15.410 1.00 0.00 C ATOM 0 H VAL A 760 26.097 7.169 -15.793 1.00 0.00 H new ATOM 0 HA VAL A 760 29.108 7.517 -15.767 1.00 0.00 H new ATOM 0 HB VAL A 760 27.265 5.658 -17.357 1.00 0.00 H new ATOM 0 HG11 VAL A 760 29.348 4.340 -17.626 1.00 0.00 H new ATOM 0 HG12 VAL A 760 29.558 5.996 -18.242 1.00 0.00 H new ATOM 0 HG13 VAL A 760 30.235 5.542 -16.660 1.00 0.00 H new ATOM 0 HG21 VAL A 760 27.823 3.910 -15.686 1.00 0.00 H new ATOM 0 HG22 VAL A 760 28.711 5.114 -14.722 1.00 0.00 H new ATOM 0 HG23 VAL A 760 26.949 5.261 -14.926 1.00 0.00 H new ATOM 541 N HIS A 761 29.198 8.777 -17.893 1.00 0.00 N ATOM 542 CA HIS A 761 29.181 9.656 -19.095 1.00 0.00 C ATOM 543 C HIS A 761 29.955 9.007 -20.243 1.00 0.00 C ATOM 544 O HIS A 761 31.166 8.933 -20.230 1.00 0.00 O ATOM 545 CB HIS A 761 29.852 10.954 -18.654 1.00 0.00 C ATOM 546 CG HIS A 761 28.800 11.929 -18.200 1.00 0.00 C ATOM 547 ND1 HIS A 761 28.663 12.306 -16.874 1.00 0.00 N ATOM 548 CD2 HIS A 761 27.822 12.608 -18.885 1.00 0.00 C ATOM 549 CE1 HIS A 761 27.637 13.176 -16.804 1.00 0.00 C ATOM 550 NE2 HIS A 761 27.090 13.394 -18.002 1.00 0.00 N ATOM 0 H HIS A 761 30.099 8.699 -17.422 1.00 0.00 H new ATOM 0 HA HIS A 761 28.169 9.830 -19.460 1.00 0.00 H new ATOM 0 HB2 HIS A 761 30.555 10.757 -17.844 1.00 0.00 H new ATOM 0 HB3 HIS A 761 30.426 11.378 -19.478 1.00 0.00 H new ATOM 0 HD2 HIS A 761 27.648 12.541 -19.949 1.00 0.00 H new ATOM 0 HE1 HIS A 761 27.298 13.641 -15.890 1.00 0.00 H new ATOM 0 HE2 HIS A 761 26.304 14.006 -18.222 1.00 0.00 H new ATOM 558 N LEU A 762 29.254 8.538 -21.231 1.00 0.00 N ATOM 559 CA LEU A 762 29.923 7.890 -22.393 1.00 0.00 C ATOM 560 C LEU A 762 29.800 8.793 -23.622 1.00 0.00 C ATOM 561 O LEU A 762 28.834 9.510 -23.779 1.00 0.00 O ATOM 562 CB LEU A 762 29.160 6.581 -22.611 1.00 0.00 C ATOM 563 CG LEU A 762 29.942 5.416 -21.998 1.00 0.00 C ATOM 564 CD1 LEU A 762 28.985 4.263 -21.691 1.00 0.00 C ATOM 565 CD2 LEU A 762 31.007 4.944 -22.991 1.00 0.00 C ATOM 0 H LEU A 762 28.236 8.575 -21.286 1.00 0.00 H new ATOM 0 HA LEU A 762 30.985 7.714 -22.222 1.00 0.00 H new ATOM 0 HB2 LEU A 762 28.171 6.646 -22.157 1.00 0.00 H new ATOM 0 HB3 LEU A 762 29.011 6.410 -23.677 1.00 0.00 H new ATOM 0 HG LEU A 762 30.421 5.744 -21.075 1.00 0.00 H new ATOM 0 HD11 LEU A 762 29.542 3.434 -21.255 1.00 0.00 H new ATOM 0 HD12 LEU A 762 28.224 4.599 -20.987 1.00 0.00 H new ATOM 0 HD13 LEU A 762 28.506 3.933 -22.613 1.00 0.00 H new ATOM 0 HD21 LEU A 762 31.566 4.114 -22.558 1.00 0.00 H new ATOM 0 HD22 LEU A 762 30.526 4.616 -23.912 1.00 0.00 H new ATOM 0 HD23 LEU A 762 31.689 5.765 -23.211 1.00 0.00 H new ATOM 577 N LYS A 763 30.767 8.768 -24.491 1.00 0.00 N ATOM 578 CA LYS A 763 30.693 9.630 -25.705 1.00 0.00 C ATOM 579 C LYS A 763 31.603 9.074 -26.800 1.00 0.00 C ATOM 580 O LYS A 763 32.795 8.931 -26.614 1.00 0.00 O ATOM 581 CB LYS A 763 31.184 11.003 -25.247 1.00 0.00 C ATOM 582 CG LYS A 763 30.396 12.096 -25.970 1.00 0.00 C ATOM 583 CD LYS A 763 31.081 13.447 -25.754 1.00 0.00 C ATOM 584 CE LYS A 763 31.848 13.840 -27.019 1.00 0.00 C ATOM 585 NZ LYS A 763 32.462 15.158 -26.701 1.00 0.00 N ATOM 0 H LYS A 763 31.605 8.191 -24.416 1.00 0.00 H new ATOM 0 HA LYS A 763 29.686 9.676 -26.119 1.00 0.00 H new ATOM 0 HB2 LYS A 763 31.060 11.104 -24.169 1.00 0.00 H new ATOM 0 HB3 LYS A 763 32.248 11.109 -25.457 1.00 0.00 H new ATOM 0 HG2 LYS A 763 30.337 11.872 -27.035 1.00 0.00 H new ATOM 0 HG3 LYS A 763 29.373 12.131 -25.594 1.00 0.00 H new ATOM 0 HD2 LYS A 763 30.339 14.209 -25.515 1.00 0.00 H new ATOM 0 HD3 LYS A 763 31.763 13.389 -24.906 1.00 0.00 H new ATOM 0 HE2 LYS A 763 32.609 13.099 -27.266 1.00 0.00 H new ATOM 0 HE3 LYS A 763 31.182 13.912 -27.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 763 33.006 15.495 -27.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 763 31.714 15.844 -26.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 763 33.096 15.057 -25.883 1.00 0.00 H new ATOM 599 N CYS A 764 31.054 8.760 -27.939 1.00 0.00 N ATOM 600 CA CYS A 764 31.901 8.214 -29.040 1.00 0.00 C ATOM 601 C CYS A 764 32.591 9.358 -29.786 1.00 0.00 C ATOM 602 O CYS A 764 32.147 10.490 -29.750 1.00 0.00 O ATOM 603 CB CYS A 764 30.933 7.471 -29.961 1.00 0.00 C ATOM 604 SG CYS A 764 31.868 6.421 -31.091 1.00 0.00 S ATOM 0 H CYS A 764 30.062 8.856 -28.157 1.00 0.00 H new ATOM 0 HA CYS A 764 32.687 7.556 -28.670 1.00 0.00 H new ATOM 0 HB2 CYS A 764 30.244 6.866 -29.371 1.00 0.00 H new ATOM 0 HB3 CYS A 764 30.330 8.183 -30.524 1.00 0.00 H new ATOM 609 N ALA A 765 33.676 9.076 -30.458 1.00 0.00 N ATOM 610 CA ALA A 765 34.394 10.153 -31.206 1.00 0.00 C ATOM 611 C ALA A 765 33.390 11.071 -31.912 1.00 0.00 C ATOM 612 O ALA A 765 32.244 10.714 -32.096 1.00 0.00 O ATOM 613 CB ALA A 765 35.258 9.418 -32.229 1.00 0.00 C ATOM 0 H ALA A 765 34.096 8.149 -30.522 1.00 0.00 H new ATOM 0 HA ALA A 765 34.990 10.784 -30.547 1.00 0.00 H new ATOM 0 HB1 ALA A 765 35.818 10.143 -32.820 1.00 0.00 H new ATOM 0 HB2 ALA A 765 35.953 8.757 -31.711 1.00 0.00 H new ATOM 0 HB3 ALA A 765 34.620 8.829 -32.888 1.00 0.00 H new ATOM 619 N PRO A 766 33.863 12.227 -32.286 1.00 0.00 N ATOM 620 CA PRO A 766 33.002 13.210 -32.978 1.00 0.00 C ATOM 621 C PRO A 766 32.733 12.757 -34.416 1.00 0.00 C ATOM 622 O PRO A 766 33.551 12.934 -35.297 1.00 0.00 O ATOM 623 CB PRO A 766 33.825 14.492 -32.958 1.00 0.00 C ATOM 624 CG PRO A 766 35.249 14.036 -32.842 1.00 0.00 C ATOM 625 CD PRO A 766 35.230 12.717 -32.104 1.00 0.00 C ATOM 0 HA PRO A 766 32.027 13.333 -32.506 1.00 0.00 H new ATOM 0 HB2 PRO A 766 33.670 15.075 -33.866 1.00 0.00 H new ATOM 0 HB3 PRO A 766 33.544 15.128 -32.119 1.00 0.00 H new ATOM 0 HG2 PRO A 766 35.699 13.920 -33.828 1.00 0.00 H new ATOM 0 HG3 PRO A 766 35.847 14.771 -32.303 1.00 0.00 H new ATOM 0 HD2 PRO A 766 35.961 12.020 -32.514 1.00 0.00 H new ATOM 0 HD3 PRO A 766 35.470 12.847 -31.049 1.00 0.00 H new ATOM 633 N GLY A 767 31.592 12.175 -34.659 1.00 0.00 N ATOM 634 CA GLY A 767 31.272 11.711 -36.038 1.00 0.00 C ATOM 635 C GLY A 767 31.090 10.190 -36.036 1.00 0.00 C ATOM 636 O GLY A 767 30.840 9.583 -37.058 1.00 0.00 O ATOM 0 H GLY A 767 30.867 12.001 -33.963 1.00 0.00 H new ATOM 0 HA2 GLY A 767 30.363 12.196 -36.395 1.00 0.00 H new ATOM 0 HA3 GLY A 767 32.073 11.991 -36.722 1.00 0.00 H new ATOM 640 N GLN A 768 31.214 9.569 -34.892 1.00 0.00 N ATOM 641 CA GLN A 768 31.047 8.088 -34.823 1.00 0.00 C ATOM 642 C GLN A 768 29.841 7.730 -33.949 1.00 0.00 C ATOM 643 O GLN A 768 29.452 8.479 -33.075 1.00 0.00 O ATOM 644 CB GLN A 768 32.340 7.579 -34.190 1.00 0.00 C ATOM 645 CG GLN A 768 33.375 7.317 -35.285 1.00 0.00 C ATOM 646 CD GLN A 768 34.204 8.581 -35.521 1.00 0.00 C ATOM 647 OE1 GLN A 768 33.873 9.641 -35.026 1.00 0.00 O ATOM 648 NE2 GLN A 768 35.277 8.515 -36.262 1.00 0.00 N ATOM 0 H GLN A 768 31.424 10.024 -34.003 1.00 0.00 H new ATOM 0 HA GLN A 768 30.868 7.644 -35.802 1.00 0.00 H new ATOM 0 HB2 GLN A 768 32.723 8.312 -33.480 1.00 0.00 H new ATOM 0 HB3 GLN A 768 32.148 6.664 -33.630 1.00 0.00 H new ATOM 0 HG2 GLN A 768 34.026 6.492 -34.994 1.00 0.00 H new ATOM 0 HG3 GLN A 768 32.876 7.020 -36.207 1.00 0.00 H new ATOM 0 HE21 GLN A 768 35.556 7.626 -36.678 1.00 0.00 H new ATOM 0 HE22 GLN A 768 35.836 9.352 -36.425 1.00 0.00 H new ATOM 657 N THR A 769 29.249 6.589 -34.174 1.00 0.00 N ATOM 658 CA THR A 769 28.069 6.185 -33.356 1.00 0.00 C ATOM 659 C THR A 769 28.266 4.773 -32.798 1.00 0.00 C ATOM 660 O THR A 769 28.885 3.930 -33.418 1.00 0.00 O ATOM 661 CB THR A 769 26.888 6.209 -34.325 1.00 0.00 C ATOM 662 OG1 THR A 769 27.048 5.176 -35.288 1.00 0.00 O ATOM 663 CG2 THR A 769 26.828 7.564 -35.032 1.00 0.00 C ATOM 0 H THR A 769 29.531 5.918 -34.889 1.00 0.00 H new ATOM 0 HA THR A 769 27.916 6.847 -32.504 1.00 0.00 H new ATOM 0 HB THR A 769 25.962 6.052 -33.772 1.00 0.00 H new ATOM 0 HG1 THR A 769 26.291 5.188 -35.910 1.00 0.00 H new ATOM 0 HG21 THR A 769 25.984 7.577 -35.722 1.00 0.00 H new ATOM 0 HG22 THR A 769 26.704 8.355 -34.292 1.00 0.00 H new ATOM 0 HG23 THR A 769 27.753 7.727 -35.586 1.00 0.00 H new ATOM 671 N ILE A 770 27.742 4.509 -31.633 1.00 0.00 N ATOM 672 CA ILE A 770 27.899 3.152 -31.038 1.00 0.00 C ATOM 673 C ILE A 770 27.299 2.103 -31.977 1.00 0.00 C ATOM 674 O ILE A 770 26.202 2.258 -32.476 1.00 0.00 O ATOM 675 CB ILE A 770 27.132 3.208 -29.717 1.00 0.00 C ATOM 676 CG1 ILE A 770 27.795 4.232 -28.791 1.00 0.00 C ATOM 677 CG2 ILE A 770 27.155 1.831 -29.050 1.00 0.00 C ATOM 678 CD1 ILE A 770 26.766 4.767 -27.796 1.00 0.00 C ATOM 0 H ILE A 770 27.213 5.173 -31.068 1.00 0.00 H new ATOM 0 HA ILE A 770 28.943 2.878 -30.883 1.00 0.00 H new ATOM 0 HB ILE A 770 26.099 3.499 -29.909 1.00 0.00 H new ATOM 0 HG12 ILE A 770 28.626 3.770 -28.257 1.00 0.00 H new ATOM 0 HG13 ILE A 770 28.209 5.052 -29.377 1.00 0.00 H new ATOM 0 HG21 ILE A 770 26.608 1.874 -28.108 1.00 0.00 H new ATOM 0 HG22 ILE A 770 26.687 1.100 -29.709 1.00 0.00 H new ATOM 0 HG23 ILE A 770 28.187 1.538 -28.857 1.00 0.00 H new ATOM 0 HD11 ILE A 770 27.240 5.495 -27.138 1.00 0.00 H new ATOM 0 HD12 ILE A 770 25.950 5.245 -28.338 1.00 0.00 H new ATOM 0 HD13 ILE A 770 26.373 3.943 -27.201 1.00 0.00 H new ATOM 690 N SER A 771 28.007 1.039 -32.221 1.00 0.00 N ATOM 691 CA SER A 771 27.476 -0.015 -33.129 1.00 0.00 C ATOM 692 C SER A 771 27.086 -1.269 -32.340 1.00 0.00 C ATOM 693 O SER A 771 26.363 -2.116 -32.831 1.00 0.00 O ATOM 694 CB SER A 771 28.627 -0.322 -34.083 1.00 0.00 C ATOM 695 OG SER A 771 29.606 -1.103 -33.406 1.00 0.00 O ATOM 0 H SER A 771 28.931 0.852 -31.832 1.00 0.00 H new ATOM 0 HA SER A 771 26.578 0.312 -33.653 1.00 0.00 H new ATOM 0 HB2 SER A 771 28.257 -0.860 -34.956 1.00 0.00 H new ATOM 0 HB3 SER A 771 29.072 0.605 -34.444 1.00 0.00 H new ATOM 0 HG SER A 771 29.999 -0.576 -32.679 1.00 0.00 H new ATOM 701 N ALA A 772 27.553 -1.407 -31.127 1.00 0.00 N ATOM 702 CA ALA A 772 27.187 -2.620 -30.339 1.00 0.00 C ATOM 703 C ALA A 772 27.786 -2.569 -28.930 1.00 0.00 C ATOM 704 O ALA A 772 28.574 -1.707 -28.606 1.00 0.00 O ATOM 705 CB ALA A 772 27.790 -3.781 -31.124 1.00 0.00 C ATOM 0 H ALA A 772 28.164 -0.742 -30.653 1.00 0.00 H new ATOM 0 HA ALA A 772 26.108 -2.709 -30.211 1.00 0.00 H new ATOM 0 HB1 ALA A 772 27.569 -4.719 -30.614 1.00 0.00 H new ATOM 0 HB2 ALA A 772 27.363 -3.803 -32.126 1.00 0.00 H new ATOM 0 HB3 ALA A 772 28.870 -3.652 -31.193 1.00 0.00 H new ATOM 711 N ILE A 773 27.400 -3.495 -28.094 1.00 0.00 N ATOM 712 CA ILE A 773 27.931 -3.530 -26.699 1.00 0.00 C ATOM 713 C ILE A 773 28.567 -4.896 -26.446 1.00 0.00 C ATOM 714 O ILE A 773 27.968 -5.924 -26.696 1.00 0.00 O ATOM 715 CB ILE A 773 26.714 -3.319 -25.799 1.00 0.00 C ATOM 716 CG1 ILE A 773 26.120 -1.933 -26.060 1.00 0.00 C ATOM 717 CG2 ILE A 773 27.141 -3.417 -24.333 1.00 0.00 C ATOM 718 CD1 ILE A 773 27.145 -0.864 -25.685 1.00 0.00 C ATOM 0 H ILE A 773 26.735 -4.235 -28.319 1.00 0.00 H new ATOM 0 HA ILE A 773 28.692 -2.772 -26.513 1.00 0.00 H new ATOM 0 HB ILE A 773 25.967 -4.083 -26.015 1.00 0.00 H new ATOM 0 HG12 ILE A 773 25.844 -1.835 -27.110 1.00 0.00 H new ATOM 0 HG13 ILE A 773 25.209 -1.800 -25.477 1.00 0.00 H new ATOM 0 HG21 ILE A 773 26.273 -3.267 -23.691 1.00 0.00 H new ATOM 0 HG22 ILE A 773 27.567 -4.402 -24.143 1.00 0.00 H new ATOM 0 HG23 ILE A 773 27.888 -2.652 -24.120 1.00 0.00 H new ATOM 0 HD11 ILE A 773 26.724 0.124 -25.870 1.00 0.00 H new ATOM 0 HD12 ILE A 773 27.399 -0.958 -24.629 1.00 0.00 H new ATOM 0 HD13 ILE A 773 28.044 -0.994 -26.288 1.00 0.00 H new ATOM 730 N LYS A 774 29.770 -4.924 -25.954 1.00 0.00 N ATOM 731 CA LYS A 774 30.429 -6.233 -25.695 1.00 0.00 C ATOM 732 C LYS A 774 30.242 -6.679 -24.241 1.00 0.00 C ATOM 733 O LYS A 774 30.098 -7.854 -23.966 1.00 0.00 O ATOM 734 CB LYS A 774 31.903 -5.995 -26.002 1.00 0.00 C ATOM 735 CG LYS A 774 32.187 -6.398 -27.452 1.00 0.00 C ATOM 736 CD LYS A 774 33.437 -5.672 -27.954 1.00 0.00 C ATOM 737 CE LYS A 774 34.684 -6.418 -27.476 1.00 0.00 C ATOM 738 NZ LYS A 774 35.693 -5.354 -27.214 1.00 0.00 N ATOM 0 H LYS A 774 30.326 -4.101 -25.720 1.00 0.00 H new ATOM 0 HA LYS A 774 30.000 -7.027 -26.306 1.00 0.00 H new ATOM 0 HB2 LYS A 774 32.154 -4.946 -25.848 1.00 0.00 H new ATOM 0 HB3 LYS A 774 32.527 -6.575 -25.322 1.00 0.00 H new ATOM 0 HG2 LYS A 774 32.330 -7.477 -27.518 1.00 0.00 H new ATOM 0 HG3 LYS A 774 31.333 -6.150 -28.082 1.00 0.00 H new ATOM 0 HD2 LYS A 774 33.427 -5.618 -29.043 1.00 0.00 H new ATOM 0 HD3 LYS A 774 33.449 -4.647 -27.584 1.00 0.00 H new ATOM 0 HE2 LYS A 774 34.477 -6.996 -26.575 1.00 0.00 H new ATOM 0 HE3 LYS A 774 35.038 -7.120 -28.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 36.593 -5.791 -26.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 35.837 -4.792 -28.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 35.354 -4.734 -26.451 1.00 0.00 H new ATOM 752 N PHE A 775 30.237 -5.770 -23.304 1.00 0.00 N ATOM 753 CA PHE A 775 30.056 -6.199 -21.882 1.00 0.00 C ATOM 754 C PHE A 775 29.338 -5.124 -21.059 1.00 0.00 C ATOM 755 O PHE A 775 29.100 -4.022 -21.512 1.00 0.00 O ATOM 756 CB PHE A 775 31.474 -6.423 -21.349 1.00 0.00 C ATOM 757 CG PHE A 775 31.401 -7.029 -19.965 1.00 0.00 C ATOM 758 CD1 PHE A 775 31.306 -8.419 -19.811 1.00 0.00 C ATOM 759 CD2 PHE A 775 31.429 -6.201 -18.836 1.00 0.00 C ATOM 760 CE1 PHE A 775 31.237 -8.978 -18.529 1.00 0.00 C ATOM 761 CE2 PHE A 775 31.362 -6.761 -17.554 1.00 0.00 C ATOM 762 CZ PHE A 775 31.265 -8.149 -17.401 1.00 0.00 C ATOM 0 H PHE A 775 30.348 -4.767 -23.453 1.00 0.00 H new ATOM 0 HA PHE A 775 29.440 -7.096 -21.813 1.00 0.00 H new ATOM 0 HB2 PHE A 775 32.026 -7.083 -22.018 1.00 0.00 H new ATOM 0 HB3 PHE A 775 32.015 -5.478 -21.316 1.00 0.00 H new ATOM 0 HD1 PHE A 775 31.286 -9.059 -20.681 1.00 0.00 H new ATOM 0 HD2 PHE A 775 31.502 -5.130 -18.954 1.00 0.00 H new ATOM 0 HE1 PHE A 775 31.162 -10.049 -18.410 1.00 0.00 H new ATOM 0 HE2 PHE A 775 31.385 -6.122 -16.684 1.00 0.00 H new ATOM 0 HZ PHE A 775 31.212 -8.581 -16.412 1.00 0.00 H new ATOM 772 N ALA A 776 28.991 -5.458 -19.843 1.00 0.00 N ATOM 773 CA ALA A 776 28.286 -4.493 -18.950 1.00 0.00 C ATOM 774 C ALA A 776 27.776 -5.235 -17.709 1.00 0.00 C ATOM 775 O ALA A 776 26.997 -6.161 -17.809 1.00 0.00 O ATOM 776 CB ALA A 776 27.118 -3.958 -19.779 1.00 0.00 C ATOM 0 H ALA A 776 29.169 -6.372 -19.426 1.00 0.00 H new ATOM 0 HA ALA A 776 28.932 -3.685 -18.607 1.00 0.00 H new ATOM 0 HB1 ALA A 776 26.551 -3.240 -19.187 1.00 0.00 H new ATOM 0 HB2 ALA A 776 27.501 -3.468 -20.674 1.00 0.00 H new ATOM 0 HB3 ALA A 776 26.468 -4.784 -20.068 1.00 0.00 H new ATOM 782 N SER A 777 28.212 -4.846 -16.540 1.00 0.00 N ATOM 783 CA SER A 777 27.738 -5.548 -15.309 1.00 0.00 C ATOM 784 C SER A 777 27.563 -4.566 -14.144 1.00 0.00 C ATOM 785 O SER A 777 28.380 -3.694 -13.921 1.00 0.00 O ATOM 786 CB SER A 777 28.837 -6.561 -14.993 1.00 0.00 C ATOM 787 OG SER A 777 28.500 -7.268 -13.804 1.00 0.00 O ATOM 0 H SER A 777 28.869 -4.081 -16.384 1.00 0.00 H new ATOM 0 HA SER A 777 26.766 -6.019 -15.459 1.00 0.00 H new ATOM 0 HB2 SER A 777 28.954 -7.258 -15.823 1.00 0.00 H new ATOM 0 HB3 SER A 777 29.792 -6.051 -14.868 1.00 0.00 H new ATOM 0 HG SER A 777 29.203 -7.920 -13.600 1.00 0.00 H new ATOM 793 N PHE A 778 26.491 -4.702 -13.405 1.00 0.00 N ATOM 794 CA PHE A 778 26.248 -3.786 -12.250 1.00 0.00 C ATOM 795 C PHE A 778 26.478 -4.541 -10.932 1.00 0.00 C ATOM 796 O PHE A 778 25.548 -4.861 -10.217 1.00 0.00 O ATOM 797 CB PHE A 778 24.780 -3.363 -12.386 1.00 0.00 C ATOM 798 CG PHE A 778 24.277 -2.805 -11.071 1.00 0.00 C ATOM 799 CD1 PHE A 778 25.138 -2.077 -10.242 1.00 0.00 C ATOM 800 CD2 PHE A 778 22.945 -3.014 -10.685 1.00 0.00 C ATOM 801 CE1 PHE A 778 24.671 -1.559 -9.028 1.00 0.00 C ATOM 802 CE2 PHE A 778 22.479 -2.496 -9.469 1.00 0.00 C ATOM 803 CZ PHE A 778 23.342 -1.768 -8.642 1.00 0.00 C ATOM 0 H PHE A 778 25.772 -5.410 -13.553 1.00 0.00 H new ATOM 0 HA PHE A 778 26.917 -2.926 -12.246 1.00 0.00 H new ATOM 0 HB2 PHE A 778 24.680 -2.613 -13.170 1.00 0.00 H new ATOM 0 HB3 PHE A 778 24.173 -4.218 -12.684 1.00 0.00 H new ATOM 0 HD1 PHE A 778 26.164 -1.915 -10.539 1.00 0.00 H new ATOM 0 HD2 PHE A 778 22.279 -3.574 -11.325 1.00 0.00 H new ATOM 0 HE1 PHE A 778 25.337 -0.998 -8.389 1.00 0.00 H new ATOM 0 HE2 PHE A 778 21.454 -2.659 -9.170 1.00 0.00 H new ATOM 0 HZ PHE A 778 22.982 -1.367 -7.706 1.00 0.00 H new ATOM 813 N GLY A 779 27.709 -4.828 -10.609 1.00 0.00 N ATOM 814 CA GLY A 779 27.992 -5.560 -9.340 1.00 0.00 C ATOM 815 C GLY A 779 29.504 -5.651 -9.115 1.00 0.00 C ATOM 816 O GLY A 779 30.190 -4.652 -9.023 1.00 0.00 O ATOM 0 H GLY A 779 28.529 -4.589 -11.166 1.00 0.00 H new ATOM 0 HA2 GLY A 779 27.521 -5.047 -8.502 1.00 0.00 H new ATOM 0 HA3 GLY A 779 27.561 -6.560 -9.384 1.00 0.00 H new ATOM 820 N THR A 780 30.031 -6.846 -9.026 1.00 0.00 N ATOM 821 CA THR A 780 31.501 -7.003 -8.807 1.00 0.00 C ATOM 822 C THR A 780 32.149 -7.722 -9.997 1.00 0.00 C ATOM 823 O THR A 780 32.382 -8.914 -9.949 1.00 0.00 O ATOM 824 CB THR A 780 31.621 -7.858 -7.543 1.00 0.00 C ATOM 825 OG1 THR A 780 31.236 -9.194 -7.839 1.00 0.00 O ATOM 826 CG2 THR A 780 30.712 -7.294 -6.451 1.00 0.00 C ATOM 0 H THR A 780 29.508 -7.719 -9.095 1.00 0.00 H new ATOM 0 HA THR A 780 32.004 -6.041 -8.706 1.00 0.00 H new ATOM 0 HB THR A 780 32.653 -7.845 -7.193 1.00 0.00 H new ATOM 0 HG1 THR A 780 31.015 -9.267 -8.791 1.00 0.00 H new ATOM 0 HG21 THR A 780 30.800 -7.905 -5.553 1.00 0.00 H new ATOM 0 HG22 THR A 780 31.009 -6.270 -6.224 1.00 0.00 H new ATOM 0 HG23 THR A 780 29.678 -7.304 -6.797 1.00 0.00 H new ATOM 834 N PRO A 781 32.415 -6.967 -11.026 1.00 0.00 N ATOM 835 CA PRO A 781 33.038 -7.536 -12.234 1.00 0.00 C ATOM 836 C PRO A 781 34.552 -7.681 -12.032 1.00 0.00 C ATOM 837 O PRO A 781 35.182 -6.865 -11.389 1.00 0.00 O ATOM 838 CB PRO A 781 32.731 -6.511 -13.315 1.00 0.00 C ATOM 839 CG PRO A 781 32.528 -5.209 -12.588 1.00 0.00 C ATOM 840 CD PRO A 781 32.152 -5.536 -11.155 1.00 0.00 C ATOM 0 HA PRO A 781 32.665 -8.530 -12.482 1.00 0.00 H new ATOM 0 HB2 PRO A 781 33.550 -6.438 -14.030 1.00 0.00 H new ATOM 0 HB3 PRO A 781 31.840 -6.789 -13.878 1.00 0.00 H new ATOM 0 HG2 PRO A 781 33.437 -4.608 -12.618 1.00 0.00 H new ATOM 0 HG3 PRO A 781 31.743 -4.623 -13.065 1.00 0.00 H new ATOM 0 HD2 PRO A 781 32.746 -4.958 -10.447 1.00 0.00 H new ATOM 0 HD3 PRO A 781 31.105 -5.305 -10.957 1.00 0.00 H new ATOM 848 N LEU A 782 35.139 -8.712 -12.575 1.00 0.00 N ATOM 849 CA LEU A 782 36.610 -8.903 -12.410 1.00 0.00 C ATOM 850 C LEU A 782 37.301 -8.921 -13.777 1.00 0.00 C ATOM 851 O LEU A 782 36.734 -9.341 -14.765 1.00 0.00 O ATOM 852 CB LEU A 782 36.755 -10.257 -11.717 1.00 0.00 C ATOM 853 CG LEU A 782 36.383 -10.117 -10.240 1.00 0.00 C ATOM 854 CD1 LEU A 782 36.096 -11.498 -9.650 1.00 0.00 C ATOM 855 CD2 LEU A 782 37.544 -9.468 -9.481 1.00 0.00 C ATOM 0 H LEU A 782 34.666 -9.429 -13.125 1.00 0.00 H new ATOM 0 HA LEU A 782 37.069 -8.098 -11.836 1.00 0.00 H new ATOM 0 HB2 LEU A 782 36.111 -10.994 -12.197 1.00 0.00 H new ATOM 0 HB3 LEU A 782 37.779 -10.618 -11.812 1.00 0.00 H new ATOM 0 HG LEU A 782 35.494 -9.493 -10.148 1.00 0.00 H new ATOM 0 HD11 LEU A 782 35.831 -11.396 -8.598 1.00 0.00 H new ATOM 0 HD12 LEU A 782 35.269 -11.959 -10.189 1.00 0.00 H new ATOM 0 HD13 LEU A 782 36.983 -12.124 -9.742 1.00 0.00 H new ATOM 0 HD21 LEU A 782 37.280 -9.368 -8.428 1.00 0.00 H new ATOM 0 HD22 LEU A 782 38.433 -10.091 -9.574 1.00 0.00 H new ATOM 0 HD23 LEU A 782 37.747 -8.482 -9.900 1.00 0.00 H new ATOM 867 N GLY A 783 38.524 -8.466 -13.840 1.00 0.00 N ATOM 868 CA GLY A 783 39.248 -8.457 -15.142 1.00 0.00 C ATOM 869 C GLY A 783 39.464 -7.014 -15.597 1.00 0.00 C ATOM 870 O GLY A 783 39.776 -6.145 -14.809 1.00 0.00 O ATOM 0 H GLY A 783 39.051 -8.101 -13.047 1.00 0.00 H new ATOM 0 HA2 GLY A 783 40.207 -8.964 -15.040 1.00 0.00 H new ATOM 0 HA3 GLY A 783 38.676 -9.004 -15.892 1.00 0.00 H new ATOM 874 N THR A 784 39.298 -6.751 -16.864 1.00 0.00 N ATOM 875 CA THR A 784 39.495 -5.359 -17.369 1.00 0.00 C ATOM 876 C THR A 784 38.812 -5.190 -18.729 1.00 0.00 C ATOM 877 O THR A 784 38.116 -6.068 -19.198 1.00 0.00 O ATOM 878 CB THR A 784 41.009 -5.195 -17.506 1.00 0.00 C ATOM 879 OG1 THR A 784 41.306 -3.859 -17.887 1.00 0.00 O ATOM 880 CG2 THR A 784 41.536 -6.160 -18.567 1.00 0.00 C ATOM 0 H THR A 784 39.035 -7.437 -17.572 1.00 0.00 H new ATOM 0 HA THR A 784 39.064 -4.613 -16.701 1.00 0.00 H new ATOM 0 HB THR A 784 41.486 -5.416 -16.551 1.00 0.00 H new ATOM 0 HG1 THR A 784 42.276 -3.752 -17.974 1.00 0.00 H new ATOM 0 HG21 THR A 784 42.615 -6.041 -18.663 1.00 0.00 H new ATOM 0 HG22 THR A 784 41.308 -7.184 -18.272 1.00 0.00 H new ATOM 0 HG23 THR A 784 41.061 -5.944 -19.524 1.00 0.00 H new ATOM 888 N CYS A 785 39.006 -4.070 -19.366 1.00 0.00 N ATOM 889 CA CYS A 785 38.366 -3.849 -20.694 1.00 0.00 C ATOM 890 C CYS A 785 38.915 -4.846 -21.718 1.00 0.00 C ATOM 891 O CYS A 785 40.040 -4.737 -22.165 1.00 0.00 O ATOM 892 CB CYS A 785 38.735 -2.420 -21.079 1.00 0.00 C ATOM 893 SG CYS A 785 37.317 -1.339 -20.776 1.00 0.00 S ATOM 0 H CYS A 785 39.579 -3.298 -19.026 1.00 0.00 H new ATOM 0 HA CYS A 785 37.286 -3.993 -20.662 1.00 0.00 H new ATOM 0 HB2 CYS A 785 39.594 -2.084 -20.498 1.00 0.00 H new ATOM 0 HB3 CYS A 785 39.023 -2.376 -22.129 1.00 0.00 H new ATOM 898 N GLY A 786 38.128 -5.817 -22.093 1.00 0.00 N ATOM 899 CA GLY A 786 38.599 -6.822 -23.087 1.00 0.00 C ATOM 900 C GLY A 786 38.296 -8.227 -22.564 1.00 0.00 C ATOM 901 O GLY A 786 38.042 -9.141 -23.322 1.00 0.00 O ATOM 0 H GLY A 786 37.177 -5.958 -21.753 1.00 0.00 H new ATOM 0 HA2 GLY A 786 38.104 -6.663 -24.045 1.00 0.00 H new ATOM 0 HA3 GLY A 786 39.669 -6.708 -23.258 1.00 0.00 H new ATOM 905 N THR A 787 38.322 -8.405 -21.271 1.00 0.00 N ATOM 906 CA THR A 787 38.037 -9.751 -20.695 1.00 0.00 C ATOM 907 C THR A 787 37.277 -9.607 -19.370 1.00 0.00 C ATOM 908 O THR A 787 37.526 -10.323 -18.420 1.00 0.00 O ATOM 909 CB THR A 787 39.411 -10.383 -20.460 1.00 0.00 C ATOM 910 OG1 THR A 787 40.235 -9.472 -19.744 1.00 0.00 O ATOM 911 CG2 THR A 787 40.060 -10.711 -21.804 1.00 0.00 C ATOM 0 H THR A 787 38.528 -7.676 -20.588 1.00 0.00 H new ATOM 0 HA THR A 787 37.418 -10.360 -21.354 1.00 0.00 H new ATOM 0 HB THR A 787 39.295 -11.300 -19.882 1.00 0.00 H new ATOM 0 HG1 THR A 787 41.114 -9.877 -19.592 1.00 0.00 H new ATOM 0 HG21 THR A 787 41.038 -11.161 -21.635 1.00 0.00 H new ATOM 0 HG22 THR A 787 39.429 -11.410 -22.352 1.00 0.00 H new ATOM 0 HG23 THR A 787 40.177 -9.796 -22.385 1.00 0.00 H new ATOM 919 N PHE A 788 36.352 -8.683 -19.302 1.00 0.00 N ATOM 920 CA PHE A 788 35.573 -8.492 -18.038 1.00 0.00 C ATOM 921 C PHE A 788 35.002 -9.833 -17.559 1.00 0.00 C ATOM 922 O PHE A 788 35.068 -10.829 -18.251 1.00 0.00 O ATOM 923 CB PHE A 788 34.445 -7.527 -18.410 1.00 0.00 C ATOM 924 CG PHE A 788 34.806 -6.126 -17.964 1.00 0.00 C ATOM 925 CD1 PHE A 788 35.012 -5.120 -18.918 1.00 0.00 C ATOM 926 CD2 PHE A 788 34.931 -5.834 -16.601 1.00 0.00 C ATOM 927 CE1 PHE A 788 35.342 -3.821 -18.506 1.00 0.00 C ATOM 928 CE2 PHE A 788 35.262 -4.536 -16.189 1.00 0.00 C ATOM 929 CZ PHE A 788 35.467 -3.529 -17.142 1.00 0.00 C ATOM 0 H PHE A 788 36.102 -8.053 -20.065 1.00 0.00 H new ATOM 0 HA PHE A 788 36.189 -8.104 -17.227 1.00 0.00 H new ATOM 0 HB2 PHE A 788 34.278 -7.545 -19.487 1.00 0.00 H new ATOM 0 HB3 PHE A 788 33.514 -7.841 -17.938 1.00 0.00 H new ATOM 0 HD1 PHE A 788 34.917 -5.345 -19.970 1.00 0.00 H new ATOM 0 HD2 PHE A 788 34.772 -6.609 -15.866 1.00 0.00 H new ATOM 0 HE1 PHE A 788 35.500 -3.045 -19.241 1.00 0.00 H new ATOM 0 HE2 PHE A 788 35.359 -4.312 -15.137 1.00 0.00 H new ATOM 0 HZ PHE A 788 35.721 -2.528 -16.825 1.00 0.00 H new ATOM 939 N GLN A 789 34.439 -9.866 -16.379 1.00 0.00 N ATOM 940 CA GLN A 789 33.865 -11.145 -15.859 1.00 0.00 C ATOM 941 C GLN A 789 32.874 -10.864 -14.723 1.00 0.00 C ATOM 942 O GLN A 789 32.778 -9.759 -14.229 1.00 0.00 O ATOM 943 CB GLN A 789 35.066 -11.929 -15.333 1.00 0.00 C ATOM 944 CG GLN A 789 34.728 -13.421 -15.285 1.00 0.00 C ATOM 945 CD GLN A 789 35.935 -14.200 -14.764 1.00 0.00 C ATOM 946 OE1 GLN A 789 37.008 -14.131 -15.330 1.00 0.00 O ATOM 947 NE2 GLN A 789 35.805 -14.946 -13.701 1.00 0.00 N ATOM 0 H GLN A 789 34.351 -9.065 -15.753 1.00 0.00 H new ATOM 0 HA GLN A 789 33.319 -11.693 -16.627 1.00 0.00 H new ATOM 0 HB2 GLN A 789 35.931 -11.763 -15.976 1.00 0.00 H new ATOM 0 HB3 GLN A 789 35.336 -11.575 -14.338 1.00 0.00 H new ATOM 0 HG2 GLN A 789 33.867 -13.589 -14.639 1.00 0.00 H new ATOM 0 HG3 GLN A 789 34.455 -13.775 -16.279 1.00 0.00 H new ATOM 0 HE21 GLN A 789 34.904 -15.004 -13.226 1.00 0.00 H new ATOM 0 HE22 GLN A 789 36.604 -15.471 -13.346 1.00 0.00 H new ATOM 956 N GLN A 790 32.135 -11.859 -14.307 1.00 0.00 N ATOM 957 CA GLN A 790 31.151 -11.649 -13.204 1.00 0.00 C ATOM 958 C GLN A 790 31.778 -12.038 -11.859 1.00 0.00 C ATOM 959 O GLN A 790 32.602 -12.927 -11.782 1.00 0.00 O ATOM 960 CB GLN A 790 29.972 -12.570 -13.542 1.00 0.00 C ATOM 961 CG GLN A 790 30.337 -14.020 -13.209 1.00 0.00 C ATOM 962 CD GLN A 790 29.604 -14.451 -11.939 1.00 0.00 C ATOM 963 OE1 GLN A 790 30.178 -15.086 -11.077 1.00 0.00 O ATOM 964 NE2 GLN A 790 28.348 -14.128 -11.784 1.00 0.00 N ATOM 0 H GLN A 790 32.170 -12.807 -14.683 1.00 0.00 H new ATOM 0 HA GLN A 790 30.838 -10.608 -13.118 1.00 0.00 H new ATOM 0 HB2 GLN A 790 29.089 -12.268 -12.978 1.00 0.00 H new ATOM 0 HB3 GLN A 790 29.721 -12.482 -14.599 1.00 0.00 H new ATOM 0 HG2 GLN A 790 30.066 -14.674 -14.038 1.00 0.00 H new ATOM 0 HG3 GLN A 790 31.414 -14.112 -13.069 1.00 0.00 H new ATOM 0 HE21 GLN A 790 27.866 -13.595 -12.507 1.00 0.00 H new ATOM 0 HE22 GLN A 790 27.850 -14.409 -10.940 1.00 0.00 H new ATOM 973 N GLY A 791 31.394 -11.379 -10.799 1.00 0.00 N ATOM 974 CA GLY A 791 31.969 -11.715 -9.464 1.00 0.00 C ATOM 975 C GLY A 791 31.015 -12.648 -8.717 1.00 0.00 C ATOM 976 O GLY A 791 30.288 -13.417 -9.313 1.00 0.00 O ATOM 0 H GLY A 791 30.708 -10.624 -10.799 1.00 0.00 H new ATOM 0 HA2 GLY A 791 32.941 -12.193 -9.585 1.00 0.00 H new ATOM 0 HA3 GLY A 791 32.131 -10.805 -8.887 1.00 0.00 H new ATOM 980 N GLU A 792 31.014 -12.588 -7.413 1.00 0.00 N ATOM 981 CA GLU A 792 30.105 -13.474 -6.628 1.00 0.00 C ATOM 982 C GLU A 792 28.652 -13.029 -6.814 1.00 0.00 C ATOM 983 O GLU A 792 27.726 -13.778 -6.578 1.00 0.00 O ATOM 984 CB GLU A 792 30.535 -13.296 -5.170 1.00 0.00 C ATOM 985 CG GLU A 792 32.052 -13.478 -5.054 1.00 0.00 C ATOM 986 CD GLU A 792 32.636 -12.359 -4.186 1.00 0.00 C ATOM 987 OE1 GLU A 792 32.849 -12.600 -3.009 1.00 0.00 O ATOM 988 OE2 GLU A 792 32.859 -11.282 -4.714 1.00 0.00 O ATOM 0 H GLU A 792 31.601 -11.966 -6.858 1.00 0.00 H new ATOM 0 HA GLU A 792 30.166 -14.515 -6.945 1.00 0.00 H new ATOM 0 HB2 GLU A 792 30.249 -12.306 -4.815 1.00 0.00 H new ATOM 0 HB3 GLU A 792 30.022 -14.021 -4.538 1.00 0.00 H new ATOM 0 HG2 GLU A 792 32.280 -14.449 -4.615 1.00 0.00 H new ATOM 0 HG3 GLU A 792 32.508 -13.460 -6.044 1.00 0.00 H new ATOM 995 N CYS A 793 28.449 -11.811 -7.239 1.00 0.00 N ATOM 996 CA CYS A 793 27.061 -11.310 -7.442 1.00 0.00 C ATOM 997 C CYS A 793 26.971 -10.527 -8.762 1.00 0.00 C ATOM 998 O CYS A 793 27.972 -10.151 -9.342 1.00 0.00 O ATOM 999 CB CYS A 793 26.803 -10.400 -6.233 1.00 0.00 C ATOM 1000 SG CYS A 793 25.429 -9.277 -6.574 1.00 0.00 S ATOM 0 H CYS A 793 29.187 -11.141 -7.455 1.00 0.00 H new ATOM 0 HA CYS A 793 26.324 -12.110 -7.510 1.00 0.00 H new ATOM 0 HB2 CYS A 793 26.577 -11.006 -5.355 1.00 0.00 H new ATOM 0 HB3 CYS A 793 27.701 -9.827 -6.002 1.00 0.00 H new ATOM 1005 N HIS A 794 25.781 -10.283 -9.237 1.00 0.00 N ATOM 1006 CA HIS A 794 25.623 -9.526 -10.516 1.00 0.00 C ATOM 1007 C HIS A 794 24.126 -9.385 -10.860 1.00 0.00 C ATOM 1008 O HIS A 794 23.307 -10.184 -10.452 1.00 0.00 O ATOM 1009 CB HIS A 794 26.367 -10.379 -11.571 1.00 0.00 C ATOM 1010 CG HIS A 794 25.693 -10.257 -12.920 1.00 0.00 C ATOM 1011 ND1 HIS A 794 25.478 -9.031 -13.528 1.00 0.00 N ATOM 1012 CD2 HIS A 794 25.165 -11.195 -13.770 1.00 0.00 C ATOM 1013 CE1 HIS A 794 24.840 -9.262 -14.691 1.00 0.00 C ATOM 1014 NE2 HIS A 794 24.626 -10.567 -14.888 1.00 0.00 N ATOM 0 H HIS A 794 24.909 -10.574 -8.796 1.00 0.00 H new ATOM 0 HA HIS A 794 26.025 -8.514 -10.465 1.00 0.00 H new ATOM 0 HB2 HIS A 794 27.405 -10.053 -11.645 1.00 0.00 H new ATOM 0 HB3 HIS A 794 26.382 -11.423 -11.258 1.00 0.00 H new ATOM 0 HD2 HIS A 794 25.167 -12.261 -13.597 1.00 0.00 H new ATOM 0 HE1 HIS A 794 24.538 -8.488 -15.381 1.00 0.00 H new ATOM 0 HE2 HIS A 794 24.167 -11.007 -15.686 1.00 0.00 H new ATOM 1022 N SER A 795 23.774 -8.374 -11.609 1.00 0.00 N ATOM 1023 CA SER A 795 22.346 -8.180 -11.978 1.00 0.00 C ATOM 1024 C SER A 795 22.046 -8.876 -13.304 1.00 0.00 C ATOM 1025 O SER A 795 22.451 -8.431 -14.355 1.00 0.00 O ATOM 1026 CB SER A 795 22.172 -6.672 -12.120 1.00 0.00 C ATOM 1027 OG SER A 795 21.110 -6.405 -13.029 1.00 0.00 O ATOM 0 H SER A 795 24.417 -7.674 -11.981 1.00 0.00 H new ATOM 0 HA SER A 795 21.669 -8.600 -11.234 1.00 0.00 H new ATOM 0 HB2 SER A 795 21.956 -6.226 -11.149 1.00 0.00 H new ATOM 0 HB3 SER A 795 23.096 -6.220 -12.480 1.00 0.00 H new ATOM 0 HG SER A 795 21.052 -5.440 -13.190 1.00 0.00 H new ATOM 1033 N ILE A 796 21.332 -9.960 -13.259 1.00 0.00 N ATOM 1034 CA ILE A 796 20.994 -10.701 -14.516 1.00 0.00 C ATOM 1035 C ILE A 796 20.687 -9.726 -15.675 1.00 0.00 C ATOM 1036 O ILE A 796 20.832 -10.066 -16.831 1.00 0.00 O ATOM 1037 CB ILE A 796 19.746 -11.514 -14.161 1.00 0.00 C ATOM 1038 CG1 ILE A 796 18.785 -10.640 -13.345 1.00 0.00 C ATOM 1039 CG2 ILE A 796 20.150 -12.738 -13.334 1.00 0.00 C ATOM 1040 CD1 ILE A 796 17.403 -11.294 -13.306 1.00 0.00 C ATOM 0 H ILE A 796 20.962 -10.373 -12.403 1.00 0.00 H new ATOM 0 HA ILE A 796 21.821 -11.325 -14.853 1.00 0.00 H new ATOM 0 HB ILE A 796 19.253 -11.842 -15.076 1.00 0.00 H new ATOM 0 HG12 ILE A 796 19.166 -10.511 -12.332 1.00 0.00 H new ATOM 0 HG13 ILE A 796 18.716 -9.647 -13.788 1.00 0.00 H new ATOM 0 HG21 ILE A 796 19.261 -13.316 -13.082 1.00 0.00 H new ATOM 0 HG22 ILE A 796 20.834 -13.358 -13.913 1.00 0.00 H new ATOM 0 HG23 ILE A 796 20.643 -12.412 -12.418 1.00 0.00 H new ATOM 0 HD11 ILE A 796 16.722 -10.671 -12.726 1.00 0.00 H new ATOM 0 HD12 ILE A 796 17.022 -11.400 -14.322 1.00 0.00 H new ATOM 0 HD13 ILE A 796 17.479 -12.278 -12.843 1.00 0.00 H new ATOM 1052 N ASN A 797 20.264 -8.522 -15.373 1.00 0.00 N ATOM 1053 CA ASN A 797 19.952 -7.545 -16.462 1.00 0.00 C ATOM 1054 C ASN A 797 21.016 -6.432 -16.538 1.00 0.00 C ATOM 1055 O ASN A 797 20.693 -5.263 -16.534 1.00 0.00 O ATOM 1056 CB ASN A 797 18.603 -6.953 -16.068 1.00 0.00 C ATOM 1057 CG ASN A 797 18.739 -6.255 -14.715 1.00 0.00 C ATOM 1058 OD1 ASN A 797 19.386 -5.234 -14.608 1.00 0.00 O ATOM 1059 ND2 ASN A 797 18.153 -6.767 -13.666 1.00 0.00 N ATOM 0 H ASN A 797 20.122 -8.175 -14.424 1.00 0.00 H new ATOM 0 HA ASN A 797 19.937 -8.023 -17.442 1.00 0.00 H new ATOM 0 HB2 ASN A 797 18.268 -6.244 -16.825 1.00 0.00 H new ATOM 0 HB3 ASN A 797 17.850 -7.739 -16.012 1.00 0.00 H new ATOM 0 HD21 ASN A 797 18.240 -6.309 -12.759 1.00 0.00 H new ATOM 0 HD22 ASN A 797 17.609 -7.625 -13.754 1.00 0.00 H new ATOM 1066 N SER A 798 22.278 -6.777 -16.609 1.00 0.00 N ATOM 1067 CA SER A 798 23.328 -5.712 -16.685 1.00 0.00 C ATOM 1068 C SER A 798 23.846 -5.573 -18.123 1.00 0.00 C ATOM 1069 O SER A 798 24.963 -5.156 -18.350 1.00 0.00 O ATOM 1070 CB SER A 798 24.452 -6.169 -15.764 1.00 0.00 C ATOM 1071 OG SER A 798 23.902 -6.654 -14.547 1.00 0.00 O ATOM 0 H SER A 798 22.624 -7.736 -16.618 1.00 0.00 H new ATOM 0 HA SER A 798 22.933 -4.740 -16.388 1.00 0.00 H new ATOM 0 HB2 SER A 798 25.037 -6.951 -16.248 1.00 0.00 H new ATOM 0 HB3 SER A 798 25.131 -5.341 -15.563 1.00 0.00 H new ATOM 0 HG SER A 798 23.134 -7.231 -14.742 1.00 0.00 H new ATOM 1077 N ASN A 799 23.045 -5.917 -19.097 1.00 0.00 N ATOM 1078 CA ASN A 799 23.509 -5.800 -20.514 1.00 0.00 C ATOM 1079 C ASN A 799 22.397 -5.232 -21.409 1.00 0.00 C ATOM 1080 O ASN A 799 22.623 -4.336 -22.200 1.00 0.00 O ATOM 1081 CB ASN A 799 23.855 -7.228 -20.935 1.00 0.00 C ATOM 1082 CG ASN A 799 24.880 -7.815 -19.964 1.00 0.00 C ATOM 1083 OD1 ASN A 799 26.067 -7.601 -20.115 1.00 0.00 O ATOM 1084 ND2 ASN A 799 24.471 -8.551 -18.969 1.00 0.00 N ATOM 0 H ASN A 799 22.096 -6.272 -18.976 1.00 0.00 H new ATOM 0 HA ASN A 799 24.359 -5.124 -20.608 1.00 0.00 H new ATOM 0 HB2 ASN A 799 22.955 -7.843 -20.945 1.00 0.00 H new ATOM 0 HB3 ASN A 799 24.256 -7.232 -21.949 1.00 0.00 H new ATOM 0 HD21 ASN A 799 25.147 -8.948 -18.316 1.00 0.00 H new ATOM 0 HD22 ASN A 799 23.475 -8.730 -18.843 1.00 0.00 H new ATOM 1091 N SER A 800 21.202 -5.745 -21.294 1.00 0.00 N ATOM 1092 CA SER A 800 20.082 -5.231 -22.142 1.00 0.00 C ATOM 1093 C SER A 800 19.809 -3.758 -21.829 1.00 0.00 C ATOM 1094 O SER A 800 19.433 -2.988 -22.692 1.00 0.00 O ATOM 1095 CB SER A 800 18.878 -6.090 -21.768 1.00 0.00 C ATOM 1096 OG SER A 800 17.846 -5.898 -22.730 1.00 0.00 O ATOM 0 H SER A 800 20.951 -6.496 -20.652 1.00 0.00 H new ATOM 0 HA SER A 800 20.311 -5.289 -23.206 1.00 0.00 H new ATOM 0 HB2 SER A 800 19.164 -7.141 -21.730 1.00 0.00 H new ATOM 0 HB3 SER A 800 18.519 -5.821 -20.774 1.00 0.00 H new ATOM 0 HG SER A 800 17.071 -6.450 -22.493 1.00 0.00 H new ATOM 1102 N VAL A 801 19.996 -3.361 -20.604 1.00 0.00 N ATOM 1103 CA VAL A 801 19.748 -1.938 -20.232 1.00 0.00 C ATOM 1104 C VAL A 801 20.501 -0.993 -21.180 1.00 0.00 C ATOM 1105 O VAL A 801 19.930 -0.085 -21.750 1.00 0.00 O ATOM 1106 CB VAL A 801 20.287 -1.810 -18.809 1.00 0.00 C ATOM 1107 CG1 VAL A 801 20.172 -0.358 -18.347 1.00 0.00 C ATOM 1108 CG2 VAL A 801 19.470 -2.708 -17.874 1.00 0.00 C ATOM 0 H VAL A 801 20.311 -3.960 -19.841 1.00 0.00 H new ATOM 0 HA VAL A 801 18.693 -1.672 -20.300 1.00 0.00 H new ATOM 0 HB VAL A 801 21.333 -2.115 -18.788 1.00 0.00 H new ATOM 0 HG11 VAL A 801 20.557 -0.268 -17.331 1.00 0.00 H new ATOM 0 HG12 VAL A 801 20.751 0.283 -19.013 1.00 0.00 H new ATOM 0 HG13 VAL A 801 19.126 -0.052 -18.367 1.00 0.00 H new ATOM 0 HG21 VAL A 801 19.853 -2.619 -16.857 1.00 0.00 H new ATOM 0 HG22 VAL A 801 18.424 -2.401 -17.896 1.00 0.00 H new ATOM 0 HG23 VAL A 801 19.551 -3.744 -18.202 1.00 0.00 H new ATOM 1118 N LEU A 802 21.779 -1.202 -21.351 1.00 0.00 N ATOM 1119 CA LEU A 802 22.571 -0.318 -22.261 1.00 0.00 C ATOM 1120 C LEU A 802 22.068 -0.431 -23.707 1.00 0.00 C ATOM 1121 O LEU A 802 21.926 0.555 -24.401 1.00 0.00 O ATOM 1122 CB LEU A 802 24.006 -0.834 -22.152 1.00 0.00 C ATOM 1123 CG LEU A 802 24.859 0.171 -21.375 1.00 0.00 C ATOM 1124 CD1 LEU A 802 24.999 1.453 -22.191 1.00 0.00 C ATOM 1125 CD2 LEU A 802 24.189 0.491 -20.035 1.00 0.00 C ATOM 0 H LEU A 802 22.311 -1.947 -20.900 1.00 0.00 H new ATOM 0 HA LEU A 802 22.486 0.733 -21.986 1.00 0.00 H new ATOM 0 HB2 LEU A 802 24.018 -1.801 -21.649 1.00 0.00 H new ATOM 0 HB3 LEU A 802 24.424 -0.987 -23.147 1.00 0.00 H new ATOM 0 HG LEU A 802 25.845 -0.257 -21.192 1.00 0.00 H new ATOM 0 HD11 LEU A 802 25.606 2.171 -21.640 1.00 0.00 H new ATOM 0 HD12 LEU A 802 25.479 1.228 -23.143 1.00 0.00 H new ATOM 0 HD13 LEU A 802 24.012 1.878 -22.374 1.00 0.00 H new ATOM 0 HD21 LEU A 802 24.800 1.207 -19.485 1.00 0.00 H new ATOM 0 HD22 LEU A 802 23.202 0.918 -20.214 1.00 0.00 H new ATOM 0 HD23 LEU A 802 24.088 -0.424 -19.451 1.00 0.00 H new ATOM 1137 N GLU A 803 21.802 -1.622 -24.163 1.00 0.00 N ATOM 1138 CA GLU A 803 21.310 -1.792 -25.564 1.00 0.00 C ATOM 1139 C GLU A 803 20.055 -0.941 -25.804 1.00 0.00 C ATOM 1140 O GLU A 803 19.715 -0.628 -26.929 1.00 0.00 O ATOM 1141 CB GLU A 803 20.974 -3.278 -25.686 1.00 0.00 C ATOM 1142 CG GLU A 803 20.677 -3.615 -27.148 1.00 0.00 C ATOM 1143 CD GLU A 803 19.783 -4.854 -27.216 1.00 0.00 C ATOM 1144 OE1 GLU A 803 19.452 -5.261 -28.317 1.00 0.00 O ATOM 1145 OE2 GLU A 803 19.446 -5.375 -26.166 1.00 0.00 O ATOM 0 H GLU A 803 21.903 -2.486 -23.630 1.00 0.00 H new ATOM 0 HA GLU A 803 22.051 -1.474 -26.298 1.00 0.00 H new ATOM 0 HB2 GLU A 803 21.807 -3.881 -25.325 1.00 0.00 H new ATOM 0 HB3 GLU A 803 20.112 -3.519 -25.064 1.00 0.00 H new ATOM 0 HG2 GLU A 803 20.185 -2.772 -27.634 1.00 0.00 H new ATOM 0 HG3 GLU A 803 21.607 -3.795 -27.687 1.00 0.00 H new ATOM 1152 N ARG A 804 19.367 -0.566 -24.760 1.00 0.00 N ATOM 1153 CA ARG A 804 18.135 0.264 -24.937 1.00 0.00 C ATOM 1154 C ARG A 804 18.464 1.758 -24.857 1.00 0.00 C ATOM 1155 O ARG A 804 17.739 2.588 -25.367 1.00 0.00 O ATOM 1156 CB ARG A 804 17.217 -0.140 -23.787 1.00 0.00 C ATOM 1157 CG ARG A 804 16.727 -1.570 -24.005 1.00 0.00 C ATOM 1158 CD ARG A 804 15.213 -1.627 -23.795 1.00 0.00 C ATOM 1159 NE ARG A 804 15.029 -2.447 -22.567 1.00 0.00 N ATOM 1160 CZ ARG A 804 14.229 -2.035 -21.622 1.00 0.00 C ATOM 1161 NH1 ARG A 804 14.631 -2.037 -20.381 1.00 0.00 N ATOM 1162 NH2 ARG A 804 13.027 -1.623 -21.919 1.00 0.00 N ATOM 0 H ARG A 804 19.601 -0.796 -23.794 1.00 0.00 H new ATOM 0 HA ARG A 804 17.675 0.100 -25.911 1.00 0.00 H new ATOM 0 HB2 ARG A 804 17.750 -0.067 -22.839 1.00 0.00 H new ATOM 0 HB3 ARG A 804 16.368 0.542 -23.728 1.00 0.00 H new ATOM 0 HG2 ARG A 804 16.978 -1.902 -25.012 1.00 0.00 H new ATOM 0 HG3 ARG A 804 17.227 -2.247 -23.312 1.00 0.00 H new ATOM 0 HD2 ARG A 804 14.793 -0.629 -23.670 1.00 0.00 H new ATOM 0 HD3 ARG A 804 14.712 -2.079 -24.651 1.00 0.00 H new ATOM 0 HE ARG A 804 15.528 -3.331 -22.464 1.00 0.00 H new ATOM 0 HH11 ARG A 804 15.570 -2.360 -20.150 1.00 0.00 H new ATOM 0 HH12 ARG A 804 14.006 -1.715 -19.642 1.00 0.00 H new ATOM 0 HH21 ARG A 804 12.713 -1.623 -22.890 1.00 0.00 H new ATOM 0 HH22 ARG A 804 12.401 -1.301 -21.181 1.00 0.00 H new ATOM 1176 N LYS A 805 19.546 2.111 -24.221 1.00 0.00 N ATOM 1177 CA LYS A 805 19.905 3.556 -24.116 1.00 0.00 C ATOM 1178 C LYS A 805 21.368 3.786 -24.512 1.00 0.00 C ATOM 1179 O LYS A 805 22.128 4.385 -23.779 1.00 0.00 O ATOM 1180 CB LYS A 805 19.691 3.905 -22.642 1.00 0.00 C ATOM 1181 CG LYS A 805 18.217 4.233 -22.401 1.00 0.00 C ATOM 1182 CD LYS A 805 18.077 5.706 -22.011 1.00 0.00 C ATOM 1183 CE LYS A 805 18.845 5.969 -20.712 1.00 0.00 C ATOM 1184 NZ LYS A 805 18.673 7.425 -20.450 1.00 0.00 N ATOM 0 H LYS A 805 20.196 1.466 -23.771 1.00 0.00 H new ATOM 0 HA LYS A 805 19.303 4.175 -24.782 1.00 0.00 H new ATOM 0 HB2 LYS A 805 19.996 3.069 -22.012 1.00 0.00 H new ATOM 0 HB3 LYS A 805 20.313 4.756 -22.365 1.00 0.00 H new ATOM 0 HG2 LYS A 805 17.636 4.028 -23.300 1.00 0.00 H new ATOM 0 HG3 LYS A 805 17.817 3.597 -21.611 1.00 0.00 H new ATOM 0 HD2 LYS A 805 18.462 6.342 -22.808 1.00 0.00 H new ATOM 0 HD3 LYS A 805 17.025 5.960 -21.881 1.00 0.00 H new ATOM 0 HE2 LYS A 805 18.449 5.371 -19.891 1.00 0.00 H new ATOM 0 HE3 LYS A 805 19.898 5.709 -20.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 805 19.172 7.682 -19.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 805 19.065 7.969 -21.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 805 17.661 7.642 -20.348 1.00 0.00 H new ATOM 1198 N CYS A 806 21.772 3.317 -25.665 1.00 0.00 N ATOM 1199 CA CYS A 806 23.189 3.520 -26.088 1.00 0.00 C ATOM 1200 C CYS A 806 23.340 3.334 -27.605 1.00 0.00 C ATOM 1201 O CYS A 806 23.538 4.281 -28.339 1.00 0.00 O ATOM 1202 CB CYS A 806 23.982 2.454 -25.336 1.00 0.00 C ATOM 1203 SG CYS A 806 25.510 3.182 -24.706 1.00 0.00 S ATOM 0 H CYS A 806 21.187 2.806 -26.326 1.00 0.00 H new ATOM 0 HA CYS A 806 23.539 4.528 -25.865 1.00 0.00 H new ATOM 0 HB2 CYS A 806 23.389 2.056 -24.513 1.00 0.00 H new ATOM 0 HB3 CYS A 806 24.209 1.619 -25.998 1.00 0.00 H new ATOM 1208 N ILE A 807 23.252 2.122 -28.075 1.00 0.00 N ATOM 1209 CA ILE A 807 23.392 1.875 -29.542 1.00 0.00 C ATOM 1210 C ILE A 807 22.386 2.723 -30.336 1.00 0.00 C ATOM 1211 O ILE A 807 21.203 2.726 -30.056 1.00 0.00 O ATOM 1212 CB ILE A 807 23.095 0.385 -29.713 1.00 0.00 C ATOM 1213 CG1 ILE A 807 24.143 -0.430 -28.946 1.00 0.00 C ATOM 1214 CG2 ILE A 807 23.147 0.015 -31.196 1.00 0.00 C ATOM 1215 CD1 ILE A 807 23.695 -1.891 -28.856 1.00 0.00 C ATOM 0 H ILE A 807 23.089 1.289 -27.509 1.00 0.00 H new ATOM 0 HA ILE A 807 24.381 2.145 -29.913 1.00 0.00 H new ATOM 0 HB ILE A 807 22.101 0.166 -29.323 1.00 0.00 H new ATOM 0 HG12 ILE A 807 25.108 -0.366 -29.449 1.00 0.00 H new ATOM 0 HG13 ILE A 807 24.277 -0.018 -27.946 1.00 0.00 H new ATOM 0 HG21 ILE A 807 22.935 -1.048 -31.314 1.00 0.00 H new ATOM 0 HG22 ILE A 807 22.404 0.596 -31.742 1.00 0.00 H new ATOM 0 HG23 ILE A 807 24.139 0.233 -31.591 1.00 0.00 H new ATOM 0 HD11 ILE A 807 24.442 -2.468 -28.310 1.00 0.00 H new ATOM 0 HD12 ILE A 807 22.740 -1.947 -28.333 1.00 0.00 H new ATOM 0 HD13 ILE A 807 23.583 -2.300 -29.860 1.00 0.00 H new ATOM 1227 N GLY A 808 22.854 3.446 -31.325 1.00 0.00 N ATOM 1228 CA GLY A 808 21.929 4.292 -32.139 1.00 0.00 C ATOM 1229 C GLY A 808 22.121 5.775 -31.797 1.00 0.00 C ATOM 1230 O GLY A 808 21.448 6.634 -32.336 1.00 0.00 O ATOM 0 H GLY A 808 23.835 3.486 -31.602 1.00 0.00 H new ATOM 0 HA2 GLY A 808 22.117 4.130 -33.200 1.00 0.00 H new ATOM 0 HA3 GLY A 808 20.896 3.999 -31.949 1.00 0.00 H new ATOM 1234 N LEU A 809 23.030 6.093 -30.910 1.00 0.00 N ATOM 1235 CA LEU A 809 23.246 7.532 -30.549 1.00 0.00 C ATOM 1236 C LEU A 809 24.738 7.876 -30.582 1.00 0.00 C ATOM 1237 O LEU A 809 25.586 7.008 -30.519 1.00 0.00 O ATOM 1238 CB LEU A 809 22.710 7.686 -29.121 1.00 0.00 C ATOM 1239 CG LEU A 809 21.288 7.134 -29.027 1.00 0.00 C ATOM 1240 CD1 LEU A 809 21.190 6.197 -27.825 1.00 0.00 C ATOM 1241 CD2 LEU A 809 20.305 8.292 -28.850 1.00 0.00 C ATOM 0 H LEU A 809 23.629 5.426 -30.422 1.00 0.00 H new ATOM 0 HA LEU A 809 22.742 8.197 -31.250 1.00 0.00 H new ATOM 0 HB2 LEU A 809 23.359 7.158 -28.422 1.00 0.00 H new ATOM 0 HB3 LEU A 809 22.719 8.737 -28.833 1.00 0.00 H new ATOM 0 HG LEU A 809 21.046 6.587 -29.938 1.00 0.00 H new ATOM 0 HD11 LEU A 809 20.177 5.801 -27.754 1.00 0.00 H new ATOM 0 HD12 LEU A 809 21.894 5.374 -27.947 1.00 0.00 H new ATOM 0 HD13 LEU A 809 21.429 6.747 -26.915 1.00 0.00 H new ATOM 0 HD21 LEU A 809 19.290 7.901 -28.783 1.00 0.00 H new ATOM 0 HD22 LEU A 809 20.545 8.837 -27.937 1.00 0.00 H new ATOM 0 HD23 LEU A 809 20.378 8.965 -29.704 1.00 0.00 H new ATOM 1253 N GLU A 810 25.063 9.137 -30.676 1.00 0.00 N ATOM 1254 CA GLU A 810 26.499 9.540 -30.711 1.00 0.00 C ATOM 1255 C GLU A 810 27.041 9.634 -29.281 1.00 0.00 C ATOM 1256 O GLU A 810 28.226 9.784 -29.058 1.00 0.00 O ATOM 1257 CB GLU A 810 26.509 10.909 -31.382 1.00 0.00 C ATOM 1258 CG GLU A 810 27.951 11.397 -31.525 1.00 0.00 C ATOM 1259 CD GLU A 810 27.951 12.833 -32.053 1.00 0.00 C ATOM 1260 OE1 GLU A 810 28.588 13.670 -31.434 1.00 0.00 O ATOM 1261 OE2 GLU A 810 27.314 13.071 -33.065 1.00 0.00 O ATOM 0 H GLU A 810 24.396 9.907 -30.730 1.00 0.00 H new ATOM 0 HA GLU A 810 27.124 8.825 -31.247 1.00 0.00 H new ATOM 0 HB2 GLU A 810 26.035 10.849 -32.362 1.00 0.00 H new ATOM 0 HB3 GLU A 810 25.930 11.619 -30.791 1.00 0.00 H new ATOM 0 HG2 GLU A 810 28.459 11.352 -30.562 1.00 0.00 H new ATOM 0 HG3 GLU A 810 28.501 10.747 -32.206 1.00 0.00 H new ATOM 1268 N ARG A 811 26.172 9.551 -28.311 1.00 0.00 N ATOM 1269 CA ARG A 811 26.612 9.633 -26.890 1.00 0.00 C ATOM 1270 C ARG A 811 25.758 8.685 -26.043 1.00 0.00 C ATOM 1271 O ARG A 811 24.717 8.228 -26.475 1.00 0.00 O ATOM 1272 CB ARG A 811 26.385 11.088 -26.480 1.00 0.00 C ATOM 1273 CG ARG A 811 24.947 11.494 -26.797 1.00 0.00 C ATOM 1274 CD ARG A 811 24.115 11.472 -25.513 1.00 0.00 C ATOM 1275 NE ARG A 811 22.741 11.857 -25.939 1.00 0.00 N ATOM 1276 CZ ARG A 811 21.756 11.010 -25.807 1.00 0.00 C ATOM 1277 NH1 ARG A 811 21.765 9.892 -26.479 1.00 0.00 N ATOM 1278 NH2 ARG A 811 20.765 11.281 -25.005 1.00 0.00 N ATOM 0 H ARG A 811 25.168 9.429 -28.444 1.00 0.00 H new ATOM 0 HA ARG A 811 27.654 9.344 -26.752 1.00 0.00 H new ATOM 0 HB2 ARG A 811 26.581 11.211 -25.415 1.00 0.00 H new ATOM 0 HB3 ARG A 811 27.082 11.738 -27.009 1.00 0.00 H new ATOM 0 HG2 ARG A 811 24.928 12.491 -27.238 1.00 0.00 H new ATOM 0 HG3 ARG A 811 24.519 10.812 -27.532 1.00 0.00 H new ATOM 0 HD2 ARG A 811 24.124 10.484 -25.054 1.00 0.00 H new ATOM 0 HD3 ARG A 811 24.510 12.170 -24.775 1.00 0.00 H new ATOM 0 HE ARG A 811 22.569 12.782 -26.334 1.00 0.00 H new ATOM 0 HH11 ARG A 811 22.541 9.680 -27.107 1.00 0.00 H new ATOM 0 HH12 ARG A 811 20.996 9.229 -26.377 1.00 0.00 H new ATOM 0 HH21 ARG A 811 20.758 12.155 -24.480 1.00 0.00 H new ATOM 0 HH22 ARG A 811 19.996 10.619 -24.903 1.00 0.00 H new ATOM 1292 N CYS A 812 26.173 8.388 -24.845 1.00 0.00 N ATOM 1293 CA CYS A 812 25.363 7.464 -23.998 1.00 0.00 C ATOM 1294 C CYS A 812 25.408 7.878 -22.525 1.00 0.00 C ATOM 1295 O CYS A 812 26.458 8.045 -21.952 1.00 0.00 O ATOM 1296 CB CYS A 812 26.028 6.104 -24.182 1.00 0.00 C ATOM 1297 SG CYS A 812 24.888 4.799 -23.672 1.00 0.00 S ATOM 0 H CYS A 812 27.029 8.740 -24.416 1.00 0.00 H new ATOM 0 HA CYS A 812 24.311 7.466 -24.284 1.00 0.00 H new ATOM 0 HB2 CYS A 812 26.313 5.965 -25.225 1.00 0.00 H new ATOM 0 HB3 CYS A 812 26.943 6.052 -23.592 1.00 0.00 H new ATOM 1302 N VAL A 813 24.269 8.039 -21.912 1.00 0.00 N ATOM 1303 CA VAL A 813 24.242 8.438 -20.474 1.00 0.00 C ATOM 1304 C VAL A 813 23.345 7.473 -19.701 1.00 0.00 C ATOM 1305 O VAL A 813 22.153 7.407 -19.924 1.00 0.00 O ATOM 1306 CB VAL A 813 23.661 9.850 -20.453 1.00 0.00 C ATOM 1307 CG1 VAL A 813 23.507 10.316 -19.003 1.00 0.00 C ATOM 1308 CG2 VAL A 813 24.604 10.800 -21.193 1.00 0.00 C ATOM 0 H VAL A 813 23.354 7.912 -22.344 1.00 0.00 H new ATOM 0 HA VAL A 813 25.229 8.411 -20.013 1.00 0.00 H new ATOM 0 HB VAL A 813 22.687 9.849 -20.942 1.00 0.00 H new ATOM 0 HG11 VAL A 813 23.092 11.324 -18.987 1.00 0.00 H new ATOM 0 HG12 VAL A 813 22.837 9.639 -18.473 1.00 0.00 H new ATOM 0 HG13 VAL A 813 24.482 10.317 -18.516 1.00 0.00 H new ATOM 0 HG21 VAL A 813 24.190 11.808 -21.178 1.00 0.00 H new ATOM 0 HG22 VAL A 813 25.578 10.801 -20.703 1.00 0.00 H new ATOM 0 HG23 VAL A 813 24.717 10.469 -22.225 1.00 0.00 H new ATOM 1318 N VAL A 814 23.903 6.722 -18.796 1.00 0.00 N ATOM 1319 CA VAL A 814 23.069 5.763 -18.018 1.00 0.00 C ATOM 1320 C VAL A 814 23.201 6.023 -16.518 1.00 0.00 C ATOM 1321 O VAL A 814 24.288 6.113 -15.985 1.00 0.00 O ATOM 1322 CB VAL A 814 23.629 4.387 -18.372 1.00 0.00 C ATOM 1323 CG1 VAL A 814 22.906 3.316 -17.555 1.00 0.00 C ATOM 1324 CG2 VAL A 814 23.416 4.121 -19.865 1.00 0.00 C ATOM 0 H VAL A 814 24.895 6.729 -18.561 1.00 0.00 H new ATOM 0 HA VAL A 814 22.009 5.854 -18.256 1.00 0.00 H new ATOM 0 HB VAL A 814 24.695 4.358 -18.145 1.00 0.00 H new ATOM 0 HG11 VAL A 814 23.306 2.334 -17.808 1.00 0.00 H new ATOM 0 HG12 VAL A 814 23.056 3.506 -16.492 1.00 0.00 H new ATOM 0 HG13 VAL A 814 21.840 3.343 -17.782 1.00 0.00 H new ATOM 0 HG21 VAL A 814 23.815 3.139 -20.120 1.00 0.00 H new ATOM 0 HG22 VAL A 814 22.350 4.150 -20.091 1.00 0.00 H new ATOM 0 HG23 VAL A 814 23.931 4.885 -20.448 1.00 0.00 H new ATOM 1334 N ALA A 815 22.098 6.144 -15.833 1.00 0.00 N ATOM 1335 CA ALA A 815 22.156 6.396 -14.368 1.00 0.00 C ATOM 1336 C ALA A 815 22.255 5.066 -13.622 1.00 0.00 C ATOM 1337 O ALA A 815 21.902 4.026 -14.140 1.00 0.00 O ATOM 1338 CB ALA A 815 20.847 7.109 -14.032 1.00 0.00 C ATOM 0 H ALA A 815 21.159 6.079 -16.226 1.00 0.00 H new ATOM 0 HA ALA A 815 23.021 6.993 -14.080 1.00 0.00 H new ATOM 0 HB1 ALA A 815 20.816 7.329 -12.965 1.00 0.00 H new ATOM 0 HB2 ALA A 815 20.784 8.040 -14.596 1.00 0.00 H new ATOM 0 HB3 ALA A 815 20.006 6.468 -14.295 1.00 0.00 H new ATOM 1344 N ILE A 816 22.729 5.089 -12.412 1.00 0.00 N ATOM 1345 CA ILE A 816 22.847 3.821 -11.641 1.00 0.00 C ATOM 1346 C ILE A 816 21.825 3.786 -10.505 1.00 0.00 C ATOM 1347 O ILE A 816 21.665 4.737 -9.767 1.00 0.00 O ATOM 1348 CB ILE A 816 24.263 3.836 -11.083 1.00 0.00 C ATOM 1349 CG1 ILE A 816 25.265 3.872 -12.241 1.00 0.00 C ATOM 1350 CG2 ILE A 816 24.496 2.579 -10.246 1.00 0.00 C ATOM 1351 CD1 ILE A 816 26.685 3.962 -11.684 1.00 0.00 C ATOM 0 H ILE A 816 23.040 5.928 -11.922 1.00 0.00 H new ATOM 0 HA ILE A 816 22.656 2.944 -12.260 1.00 0.00 H new ATOM 0 HB ILE A 816 24.398 4.718 -10.456 1.00 0.00 H new ATOM 0 HG12 ILE A 816 25.160 2.977 -12.855 1.00 0.00 H new ATOM 0 HG13 ILE A 816 25.061 4.727 -12.886 1.00 0.00 H new ATOM 0 HG21 ILE A 816 25.510 2.591 -9.847 1.00 0.00 H new ATOM 0 HG22 ILE A 816 23.782 2.553 -9.423 1.00 0.00 H new ATOM 0 HG23 ILE A 816 24.362 1.696 -10.871 1.00 0.00 H new ATOM 0 HD11 ILE A 816 27.398 3.988 -12.508 1.00 0.00 H new ATOM 0 HD12 ILE A 816 26.786 4.870 -11.089 1.00 0.00 H new ATOM 0 HD13 ILE A 816 26.886 3.093 -11.057 1.00 0.00 H new ATOM 1363 N SER A 817 21.128 2.692 -10.361 1.00 0.00 N ATOM 1364 CA SER A 817 20.116 2.590 -9.275 1.00 0.00 C ATOM 1365 C SER A 817 19.693 1.128 -9.092 1.00 0.00 C ATOM 1366 O SER A 817 20.036 0.278 -9.890 1.00 0.00 O ATOM 1367 CB SER A 817 18.946 3.447 -9.739 1.00 0.00 C ATOM 1368 OG SER A 817 19.028 3.637 -11.145 1.00 0.00 O ATOM 0 H SER A 817 21.217 1.864 -10.950 1.00 0.00 H new ATOM 0 HA SER A 817 20.499 2.929 -8.312 1.00 0.00 H new ATOM 0 HB2 SER A 817 18.003 2.965 -9.481 1.00 0.00 H new ATOM 0 HB3 SER A 817 18.962 4.410 -9.229 1.00 0.00 H new ATOM 0 HG SER A 817 18.494 4.417 -11.401 1.00 0.00 H new ATOM 1374 N PRO A 818 18.958 0.888 -8.043 1.00 0.00 N ATOM 1375 CA PRO A 818 18.482 -0.479 -7.744 1.00 0.00 C ATOM 1376 C PRO A 818 17.282 -0.863 -8.625 1.00 0.00 C ATOM 1377 O PRO A 818 17.354 -1.780 -9.421 1.00 0.00 O ATOM 1378 CB PRO A 818 18.075 -0.406 -6.280 1.00 0.00 C ATOM 1379 CG PRO A 818 17.752 1.040 -6.027 1.00 0.00 C ATOM 1380 CD PRO A 818 18.515 1.863 -7.045 1.00 0.00 C ATOM 0 HA PRO A 818 19.242 -1.236 -7.940 1.00 0.00 H new ATOM 0 HB2 PRO A 818 17.213 -1.042 -6.080 1.00 0.00 H new ATOM 0 HB3 PRO A 818 18.881 -0.748 -5.631 1.00 0.00 H new ATOM 0 HG2 PRO A 818 16.680 1.215 -6.119 1.00 0.00 H new ATOM 0 HG3 PRO A 818 18.036 1.325 -5.014 1.00 0.00 H new ATOM 0 HD2 PRO A 818 17.881 2.629 -7.492 1.00 0.00 H new ATOM 0 HD3 PRO A 818 19.361 2.376 -6.588 1.00 0.00 H new ATOM 1388 N SER A 819 16.179 -0.175 -8.489 1.00 0.00 N ATOM 1389 CA SER A 819 14.980 -0.512 -9.322 1.00 0.00 C ATOM 1390 C SER A 819 15.202 -0.135 -10.793 1.00 0.00 C ATOM 1391 O SER A 819 14.348 -0.352 -11.629 1.00 0.00 O ATOM 1392 CB SER A 819 13.841 0.313 -8.726 1.00 0.00 C ATOM 1393 OG SER A 819 12.613 -0.385 -8.907 1.00 0.00 O ATOM 0 H SER A 819 16.054 0.603 -7.841 1.00 0.00 H new ATOM 0 HA SER A 819 14.769 -1.581 -9.309 1.00 0.00 H new ATOM 0 HB2 SER A 819 14.020 0.489 -7.665 1.00 0.00 H new ATOM 0 HB3 SER A 819 13.793 1.290 -9.208 1.00 0.00 H new ATOM 0 HG SER A 819 11.879 0.140 -8.525 1.00 0.00 H new ATOM 1399 N ASN A 820 16.334 0.423 -11.120 1.00 0.00 N ATOM 1400 CA ASN A 820 16.585 0.803 -12.543 1.00 0.00 C ATOM 1401 C ASN A 820 17.114 -0.403 -13.321 1.00 0.00 C ATOM 1402 O ASN A 820 17.039 -0.455 -14.534 1.00 0.00 O ATOM 1403 CB ASN A 820 17.640 1.904 -12.488 1.00 0.00 C ATOM 1404 CG ASN A 820 17.898 2.429 -13.905 1.00 0.00 C ATOM 1405 OD1 ASN A 820 18.269 1.678 -14.785 1.00 0.00 O ATOM 1406 ND2 ASN A 820 17.716 3.696 -14.163 1.00 0.00 N ATOM 0 H ASN A 820 17.093 0.632 -10.471 1.00 0.00 H new ATOM 0 HA ASN A 820 15.677 1.139 -13.044 1.00 0.00 H new ATOM 0 HB2 ASN A 820 17.302 2.715 -11.843 1.00 0.00 H new ATOM 0 HB3 ASN A 820 18.564 1.517 -12.057 1.00 0.00 H new ATOM 0 HD21 ASN A 820 17.885 4.055 -15.103 1.00 0.00 H new ATOM 0 HD22 ASN A 820 17.405 4.327 -13.425 1.00 0.00 H new ATOM 1413 N PHE A 821 17.649 -1.373 -12.635 1.00 0.00 N ATOM 1414 CA PHE A 821 18.184 -2.573 -13.335 1.00 0.00 C ATOM 1415 C PHE A 821 17.281 -3.787 -13.089 1.00 0.00 C ATOM 1416 O PHE A 821 16.752 -4.377 -14.011 1.00 0.00 O ATOM 1417 CB PHE A 821 19.564 -2.798 -12.723 1.00 0.00 C ATOM 1418 CG PHE A 821 20.609 -2.146 -13.595 1.00 0.00 C ATOM 1419 CD1 PHE A 821 21.313 -2.909 -14.533 1.00 0.00 C ATOM 1420 CD2 PHE A 821 20.873 -0.777 -13.466 1.00 0.00 C ATOM 1421 CE1 PHE A 821 22.282 -2.305 -15.342 1.00 0.00 C ATOM 1422 CE2 PHE A 821 21.842 -0.172 -14.276 1.00 0.00 C ATOM 1423 CZ PHE A 821 22.546 -0.935 -15.214 1.00 0.00 C ATOM 0 H PHE A 821 17.739 -1.387 -11.619 1.00 0.00 H new ATOM 0 HA PHE A 821 18.230 -2.433 -14.415 1.00 0.00 H new ATOM 0 HB2 PHE A 821 19.601 -2.380 -11.717 1.00 0.00 H new ATOM 0 HB3 PHE A 821 19.764 -3.866 -12.632 1.00 0.00 H new ATOM 0 HD1 PHE A 821 21.108 -3.965 -14.633 1.00 0.00 H new ATOM 0 HD2 PHE A 821 20.330 -0.188 -12.742 1.00 0.00 H new ATOM 0 HE1 PHE A 821 22.826 -2.895 -16.065 1.00 0.00 H new ATOM 0 HE2 PHE A 821 22.046 0.884 -14.177 1.00 0.00 H new ATOM 0 HZ PHE A 821 23.293 -0.468 -15.839 1.00 0.00 H new ATOM 1433 N GLY A 822 17.099 -4.168 -11.853 1.00 0.00 N ATOM 1434 CA GLY A 822 16.229 -5.343 -11.558 1.00 0.00 C ATOM 1435 C GLY A 822 15.462 -5.105 -10.257 1.00 0.00 C ATOM 1436 O GLY A 822 14.248 -5.166 -10.223 1.00 0.00 O ATOM 0 H GLY A 822 17.514 -3.718 -11.037 1.00 0.00 H new ATOM 0 HA2 GLY A 822 15.530 -5.505 -12.379 1.00 0.00 H new ATOM 0 HA3 GLY A 822 16.836 -6.245 -11.474 1.00 0.00 H new ATOM 1440 N GLY A 823 16.155 -4.831 -9.186 1.00 0.00 N ATOM 1441 CA GLY A 823 15.457 -4.591 -7.890 1.00 0.00 C ATOM 1442 C GLY A 823 16.214 -5.294 -6.759 1.00 0.00 C ATOM 1443 O GLY A 823 16.204 -6.504 -6.649 1.00 0.00 O ATOM 0 H GLY A 823 17.172 -4.763 -9.151 1.00 0.00 H new ATOM 0 HA2 GLY A 823 15.397 -3.521 -7.691 1.00 0.00 H new ATOM 0 HA3 GLY A 823 14.434 -4.963 -7.942 1.00 0.00 H new ATOM 1447 N ASP A 824 16.869 -4.542 -5.919 1.00 0.00 N ATOM 1448 CA ASP A 824 17.630 -5.160 -4.792 1.00 0.00 C ATOM 1449 C ASP A 824 18.403 -6.391 -5.271 1.00 0.00 C ATOM 1450 O ASP A 824 18.188 -7.485 -4.791 1.00 0.00 O ATOM 1451 CB ASP A 824 16.568 -5.565 -3.773 1.00 0.00 C ATOM 1452 CG ASP A 824 16.205 -4.362 -2.903 1.00 0.00 C ATOM 1453 OD1 ASP A 824 15.881 -4.571 -1.745 1.00 0.00 O ATOM 1454 OD2 ASP A 824 16.259 -3.252 -3.407 1.00 0.00 O ATOM 0 H ASP A 824 16.912 -3.524 -5.963 1.00 0.00 H new ATOM 0 HA ASP A 824 18.364 -4.472 -4.373 1.00 0.00 H new ATOM 0 HB2 ASP A 824 15.681 -5.936 -4.286 1.00 0.00 H new ATOM 0 HB3 ASP A 824 16.940 -6.378 -3.150 1.00 0.00 H new ATOM 1459 N PRO A 825 19.279 -6.168 -6.211 1.00 0.00 N ATOM 1460 CA PRO A 825 20.090 -7.266 -6.761 1.00 0.00 C ATOM 1461 C PRO A 825 21.322 -7.511 -5.878 1.00 0.00 C ATOM 1462 O PRO A 825 21.560 -8.610 -5.417 1.00 0.00 O ATOM 1463 CB PRO A 825 20.504 -6.753 -8.129 1.00 0.00 C ATOM 1464 CG PRO A 825 20.455 -5.250 -8.031 1.00 0.00 C ATOM 1465 CD PRO A 825 19.573 -4.889 -6.849 1.00 0.00 C ATOM 0 HA PRO A 825 19.553 -8.213 -6.810 1.00 0.00 H new ATOM 0 HB2 PRO A 825 21.505 -7.096 -8.390 1.00 0.00 H new ATOM 0 HB3 PRO A 825 19.830 -7.117 -8.904 1.00 0.00 H new ATOM 0 HG2 PRO A 825 21.457 -4.843 -7.898 1.00 0.00 H new ATOM 0 HG3 PRO A 825 20.056 -4.820 -8.950 1.00 0.00 H new ATOM 0 HD2 PRO A 825 20.084 -4.212 -6.164 1.00 0.00 H new ATOM 0 HD3 PRO A 825 18.661 -4.387 -7.172 1.00 0.00 H new ATOM 1473 N CYS A 826 22.106 -6.491 -5.641 1.00 0.00 N ATOM 1474 CA CYS A 826 23.324 -6.658 -4.789 1.00 0.00 C ATOM 1475 C CYS A 826 23.389 -5.551 -3.726 1.00 0.00 C ATOM 1476 O CYS A 826 24.030 -4.538 -3.923 1.00 0.00 O ATOM 1477 CB CYS A 826 24.494 -6.529 -5.758 1.00 0.00 C ATOM 1478 SG CYS A 826 25.765 -7.729 -5.325 1.00 0.00 S ATOM 0 H CYS A 826 21.956 -5.548 -6.001 1.00 0.00 H new ATOM 0 HA CYS A 826 23.329 -7.609 -4.257 1.00 0.00 H new ATOM 0 HB2 CYS A 826 24.154 -6.696 -6.780 1.00 0.00 H new ATOM 0 HB3 CYS A 826 24.903 -5.519 -5.719 1.00 0.00 H new ATOM 1483 N PRO A 827 22.717 -5.787 -2.631 1.00 0.00 N ATOM 1484 CA PRO A 827 22.694 -4.808 -1.531 1.00 0.00 C ATOM 1485 C PRO A 827 23.891 -5.005 -0.582 1.00 0.00 C ATOM 1486 O PRO A 827 24.404 -6.095 -0.426 1.00 0.00 O ATOM 1487 CB PRO A 827 21.390 -5.118 -0.813 1.00 0.00 C ATOM 1488 CG PRO A 827 21.089 -6.565 -1.121 1.00 0.00 C ATOM 1489 CD PRO A 827 21.910 -6.966 -2.336 1.00 0.00 C ATOM 0 HA PRO A 827 22.761 -3.779 -1.884 1.00 0.00 H new ATOM 0 HB2 PRO A 827 21.487 -4.958 0.261 1.00 0.00 H new ATOM 0 HB3 PRO A 827 20.587 -4.468 -1.161 1.00 0.00 H new ATOM 0 HG2 PRO A 827 21.337 -7.196 -0.268 1.00 0.00 H new ATOM 0 HG3 PRO A 827 20.025 -6.700 -1.318 1.00 0.00 H new ATOM 0 HD2 PRO A 827 22.535 -7.833 -2.125 1.00 0.00 H new ATOM 0 HD3 PRO A 827 21.271 -7.231 -3.178 1.00 0.00 H new ATOM 1497 N GLU A 828 24.334 -3.945 0.048 1.00 0.00 N ATOM 1498 CA GLU A 828 25.494 -4.045 0.991 1.00 0.00 C ATOM 1499 C GLU A 828 26.624 -4.877 0.387 1.00 0.00 C ATOM 1500 O GLU A 828 27.152 -5.772 1.017 1.00 0.00 O ATOM 1501 CB GLU A 828 24.932 -4.732 2.233 1.00 0.00 C ATOM 1502 CG GLU A 828 24.345 -3.679 3.174 1.00 0.00 C ATOM 1503 CD GLU A 828 25.478 -2.978 3.927 1.00 0.00 C ATOM 1504 OE1 GLU A 828 25.320 -2.747 5.114 1.00 0.00 O ATOM 1505 OE2 GLU A 828 26.484 -2.684 3.303 1.00 0.00 O ATOM 0 H GLU A 828 23.941 -3.009 -0.050 1.00 0.00 H new ATOM 0 HA GLU A 828 25.919 -3.066 1.214 1.00 0.00 H new ATOM 0 HB2 GLU A 828 24.163 -5.450 1.948 1.00 0.00 H new ATOM 0 HB3 GLU A 828 25.718 -5.291 2.740 1.00 0.00 H new ATOM 0 HG2 GLU A 828 23.766 -2.951 2.606 1.00 0.00 H new ATOM 0 HG3 GLU A 828 23.661 -4.149 3.881 1.00 0.00 H new ATOM 1512 N VAL A 829 27.003 -4.592 -0.823 1.00 0.00 N ATOM 1513 CA VAL A 829 28.101 -5.370 -1.458 1.00 0.00 C ATOM 1514 C VAL A 829 28.902 -4.475 -2.406 1.00 0.00 C ATOM 1515 O VAL A 829 28.346 -3.681 -3.138 1.00 0.00 O ATOM 1516 CB VAL A 829 27.390 -6.475 -2.231 1.00 0.00 C ATOM 1517 CG1 VAL A 829 28.346 -7.083 -3.263 1.00 0.00 C ATOM 1518 CG2 VAL A 829 26.934 -7.564 -1.257 1.00 0.00 C ATOM 0 H VAL A 829 26.601 -3.854 -1.402 1.00 0.00 H new ATOM 0 HA VAL A 829 28.809 -5.768 -0.731 1.00 0.00 H new ATOM 0 HB VAL A 829 26.525 -6.056 -2.744 1.00 0.00 H new ATOM 0 HG11 VAL A 829 27.834 -7.872 -3.813 1.00 0.00 H new ATOM 0 HG12 VAL A 829 28.671 -6.309 -3.958 1.00 0.00 H new ATOM 0 HG13 VAL A 829 29.214 -7.501 -2.753 1.00 0.00 H new ATOM 0 HG21 VAL A 829 26.425 -8.355 -1.808 1.00 0.00 H new ATOM 0 HG22 VAL A 829 27.801 -7.979 -0.744 1.00 0.00 H new ATOM 0 HG23 VAL A 829 26.250 -7.134 -0.525 1.00 0.00 H new ATOM 1528 N MET A 830 30.204 -4.593 -2.392 1.00 0.00 N ATOM 1529 CA MET A 830 31.039 -3.746 -3.296 1.00 0.00 C ATOM 1530 C MET A 830 30.389 -3.677 -4.682 1.00 0.00 C ATOM 1531 O MET A 830 30.585 -4.540 -5.515 1.00 0.00 O ATOM 1532 CB MET A 830 32.390 -4.460 -3.368 1.00 0.00 C ATOM 1533 CG MET A 830 33.501 -3.434 -3.593 1.00 0.00 C ATOM 1534 SD MET A 830 34.775 -3.635 -2.322 1.00 0.00 S ATOM 1535 CE MET A 830 35.959 -2.442 -2.993 1.00 0.00 C ATOM 0 H MET A 830 30.724 -5.237 -1.796 1.00 0.00 H new ATOM 0 HA MET A 830 31.143 -2.722 -2.937 1.00 0.00 H new ATOM 0 HB2 MET A 830 32.571 -5.011 -2.445 1.00 0.00 H new ATOM 0 HB3 MET A 830 32.385 -5.189 -4.178 1.00 0.00 H new ATOM 0 HG2 MET A 830 33.937 -3.565 -4.584 1.00 0.00 H new ATOM 0 HG3 MET A 830 33.091 -2.425 -3.556 1.00 0.00 H new ATOM 0 HE1 MET A 830 36.840 -2.404 -2.352 1.00 0.00 H new ATOM 0 HE2 MET A 830 36.254 -2.747 -3.997 1.00 0.00 H new ATOM 0 HE3 MET A 830 35.497 -1.455 -3.035 1.00 0.00 H new ATOM 1545 N LYS A 831 29.616 -2.657 -4.935 1.00 0.00 N ATOM 1546 CA LYS A 831 28.956 -2.537 -6.264 1.00 0.00 C ATOM 1547 C LYS A 831 29.791 -1.667 -7.201 1.00 0.00 C ATOM 1548 O LYS A 831 30.495 -0.772 -6.777 1.00 0.00 O ATOM 1549 CB LYS A 831 27.607 -1.876 -5.974 1.00 0.00 C ATOM 1550 CG LYS A 831 27.836 -0.504 -5.337 1.00 0.00 C ATOM 1551 CD LYS A 831 27.561 -0.582 -3.833 1.00 0.00 C ATOM 1552 CE LYS A 831 28.372 0.495 -3.109 1.00 0.00 C ATOM 1553 NZ LYS A 831 29.711 -0.117 -2.882 1.00 0.00 N ATOM 0 H LYS A 831 29.413 -1.903 -4.279 1.00 0.00 H new ATOM 0 HA LYS A 831 28.842 -3.503 -6.756 1.00 0.00 H new ATOM 0 HB2 LYS A 831 27.037 -1.769 -6.897 1.00 0.00 H new ATOM 0 HB3 LYS A 831 27.018 -2.505 -5.306 1.00 0.00 H new ATOM 0 HG2 LYS A 831 28.861 -0.177 -5.513 1.00 0.00 H new ATOM 0 HG3 LYS A 831 27.182 0.236 -5.798 1.00 0.00 H new ATOM 0 HD2 LYS A 831 26.497 -0.443 -3.639 1.00 0.00 H new ATOM 0 HD3 LYS A 831 27.828 -1.569 -3.455 1.00 0.00 H new ATOM 0 HE2 LYS A 831 28.449 1.401 -3.710 1.00 0.00 H new ATOM 0 HE3 LYS A 831 27.902 0.776 -2.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 831 30.285 0.514 -2.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 831 29.597 -1.034 -2.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 831 30.187 -0.259 -3.796 1.00 0.00 H new ATOM 1567 N ARG A 832 29.715 -1.925 -8.476 1.00 0.00 N ATOM 1568 CA ARG A 832 30.499 -1.120 -9.454 1.00 0.00 C ATOM 1569 C ARG A 832 29.842 -1.203 -10.833 1.00 0.00 C ATOM 1570 O ARG A 832 29.193 -2.177 -11.161 1.00 0.00 O ATOM 1571 CB ARG A 832 31.886 -1.763 -9.474 1.00 0.00 C ATOM 1572 CG ARG A 832 32.949 -0.695 -9.202 1.00 0.00 C ATOM 1573 CD ARG A 832 34.047 -0.788 -10.264 1.00 0.00 C ATOM 1574 NE ARG A 832 35.301 -1.030 -9.500 1.00 0.00 N ATOM 1575 CZ ARG A 832 36.384 -1.404 -10.126 1.00 0.00 C ATOM 1576 NH1 ARG A 832 36.303 -2.235 -11.128 1.00 0.00 N ATOM 1577 NH2 ARG A 832 37.547 -0.946 -9.748 1.00 0.00 N ATOM 0 H ARG A 832 29.141 -2.662 -8.885 1.00 0.00 H new ATOM 0 HA ARG A 832 30.550 -0.065 -9.186 1.00 0.00 H new ATOM 0 HB2 ARG A 832 31.945 -2.549 -8.721 1.00 0.00 H new ATOM 0 HB3 ARG A 832 32.067 -2.233 -10.441 1.00 0.00 H new ATOM 0 HG2 ARG A 832 32.496 0.296 -9.217 1.00 0.00 H new ATOM 0 HG3 ARG A 832 33.376 -0.836 -8.209 1.00 0.00 H new ATOM 0 HD2 ARG A 832 33.850 -1.598 -10.966 1.00 0.00 H new ATOM 0 HD3 ARG A 832 34.111 0.131 -10.847 1.00 0.00 H new ATOM 0 HE ARG A 832 35.314 -0.904 -8.488 1.00 0.00 H new ATOM 0 HH11 ARG A 832 35.394 -2.592 -11.422 1.00 0.00 H new ATOM 0 HH12 ARG A 832 37.149 -2.528 -11.618 1.00 0.00 H new ATOM 0 HH21 ARG A 832 37.609 -0.296 -8.964 1.00 0.00 H new ATOM 0 HH22 ARG A 832 38.393 -1.238 -10.237 1.00 0.00 H new ATOM 1591 N VAL A 833 30.000 -0.195 -11.648 1.00 0.00 N ATOM 1592 CA VAL A 833 29.376 -0.236 -13.003 1.00 0.00 C ATOM 1593 C VAL A 833 30.445 -0.238 -14.098 1.00 0.00 C ATOM 1594 O VAL A 833 31.071 0.765 -14.370 1.00 0.00 O ATOM 1595 CB VAL A 833 28.530 1.031 -13.092 1.00 0.00 C ATOM 1596 CG1 VAL A 833 27.848 1.091 -14.459 1.00 0.00 C ATOM 1597 CG2 VAL A 833 27.466 1.016 -11.993 1.00 0.00 C ATOM 0 H VAL A 833 30.530 0.650 -11.437 1.00 0.00 H new ATOM 0 HA VAL A 833 28.783 -1.139 -13.144 1.00 0.00 H new ATOM 0 HB VAL A 833 29.170 1.904 -12.964 1.00 0.00 H new ATOM 0 HG11 VAL A 833 27.243 1.995 -14.524 1.00 0.00 H new ATOM 0 HG12 VAL A 833 28.605 1.103 -15.243 1.00 0.00 H new ATOM 0 HG13 VAL A 833 27.209 0.217 -14.585 1.00 0.00 H new ATOM 0 HG21 VAL A 833 26.863 1.922 -12.058 1.00 0.00 H new ATOM 0 HG22 VAL A 833 26.825 0.143 -12.119 1.00 0.00 H new ATOM 0 HG23 VAL A 833 27.951 0.972 -11.018 1.00 0.00 H new ATOM 1607 N ALA A 834 30.656 -1.359 -14.727 1.00 0.00 N ATOM 1608 CA ALA A 834 31.682 -1.430 -15.806 1.00 0.00 C ATOM 1609 C ALA A 834 30.978 -1.566 -17.158 1.00 0.00 C ATOM 1610 O ALA A 834 30.079 -2.368 -17.315 1.00 0.00 O ATOM 1611 CB ALA A 834 32.505 -2.679 -15.497 1.00 0.00 C ATOM 0 H ALA A 834 30.162 -2.232 -14.541 1.00 0.00 H new ATOM 0 HA ALA A 834 32.312 -0.542 -15.850 1.00 0.00 H new ATOM 0 HB1 ALA A 834 33.283 -2.798 -16.251 1.00 0.00 H new ATOM 0 HB2 ALA A 834 32.965 -2.578 -14.514 1.00 0.00 H new ATOM 0 HB3 ALA A 834 31.855 -3.554 -15.505 1.00 0.00 H new ATOM 1617 N VAL A 835 31.371 -0.798 -18.135 1.00 0.00 N ATOM 1618 CA VAL A 835 30.702 -0.908 -19.463 1.00 0.00 C ATOM 1619 C VAL A 835 31.711 -0.773 -20.608 1.00 0.00 C ATOM 1620 O VAL A 835 32.541 0.115 -20.622 1.00 0.00 O ATOM 1621 CB VAL A 835 29.708 0.249 -19.494 1.00 0.00 C ATOM 1622 CG1 VAL A 835 29.098 0.362 -20.891 1.00 0.00 C ATOM 1623 CG2 VAL A 835 28.599 -0.007 -18.473 1.00 0.00 C ATOM 0 H VAL A 835 32.118 -0.106 -18.075 1.00 0.00 H new ATOM 0 HA VAL A 835 30.222 -1.878 -19.593 1.00 0.00 H new ATOM 0 HB VAL A 835 30.223 1.177 -19.248 1.00 0.00 H new ATOM 0 HG11 VAL A 835 28.388 1.189 -20.912 1.00 0.00 H new ATOM 0 HG12 VAL A 835 29.888 0.544 -21.619 1.00 0.00 H new ATOM 0 HG13 VAL A 835 28.582 -0.566 -21.139 1.00 0.00 H new ATOM 0 HG21 VAL A 835 27.888 0.819 -18.494 1.00 0.00 H new ATOM 0 HG22 VAL A 835 28.084 -0.936 -18.720 1.00 0.00 H new ATOM 0 HG23 VAL A 835 29.033 -0.087 -17.476 1.00 0.00 H new ATOM 1633 N GLU A 836 31.635 -1.652 -21.567 1.00 0.00 N ATOM 1634 CA GLU A 836 32.574 -1.596 -22.721 1.00 0.00 C ATOM 1635 C GLU A 836 31.765 -1.558 -24.024 1.00 0.00 C ATOM 1636 O GLU A 836 31.106 -2.514 -24.380 1.00 0.00 O ATOM 1637 CB GLU A 836 33.393 -2.884 -22.631 1.00 0.00 C ATOM 1638 CG GLU A 836 34.866 -2.578 -22.918 1.00 0.00 C ATOM 1639 CD GLU A 836 35.061 -2.365 -24.420 1.00 0.00 C ATOM 1640 OE1 GLU A 836 35.189 -1.220 -24.824 1.00 0.00 O ATOM 1641 OE2 GLU A 836 35.079 -3.348 -25.142 1.00 0.00 O ATOM 0 H GLU A 836 30.957 -2.413 -21.601 1.00 0.00 H new ATOM 0 HA GLU A 836 33.215 -0.715 -22.705 1.00 0.00 H new ATOM 0 HB2 GLU A 836 33.289 -3.324 -21.639 1.00 0.00 H new ATOM 0 HB3 GLU A 836 33.017 -3.616 -23.346 1.00 0.00 H new ATOM 0 HG2 GLU A 836 35.177 -1.688 -22.371 1.00 0.00 H new ATOM 0 HG3 GLU A 836 35.493 -3.400 -22.572 1.00 0.00 H new ATOM 1648 N ALA A 837 31.807 -0.465 -24.735 1.00 0.00 N ATOM 1649 CA ALA A 837 31.033 -0.384 -26.010 1.00 0.00 C ATOM 1650 C ALA A 837 31.967 -0.404 -27.224 1.00 0.00 C ATOM 1651 O ALA A 837 33.155 -0.167 -27.117 1.00 0.00 O ATOM 1652 CB ALA A 837 30.287 0.950 -25.932 1.00 0.00 C ATOM 0 H ALA A 837 32.339 0.371 -24.492 1.00 0.00 H new ATOM 0 HA ALA A 837 30.358 -1.232 -26.128 1.00 0.00 H new ATOM 0 HB1 ALA A 837 29.692 1.087 -26.835 1.00 0.00 H new ATOM 0 HB2 ALA A 837 29.631 0.950 -25.061 1.00 0.00 H new ATOM 0 HB3 ALA A 837 31.006 1.764 -25.844 1.00 0.00 H new ATOM 1658 N VAL A 838 31.428 -0.688 -28.381 1.00 0.00 N ATOM 1659 CA VAL A 838 32.259 -0.732 -29.618 1.00 0.00 C ATOM 1660 C VAL A 838 31.872 0.428 -30.543 1.00 0.00 C ATOM 1661 O VAL A 838 30.748 0.526 -30.984 1.00 0.00 O ATOM 1662 CB VAL A 838 31.920 -2.071 -30.268 1.00 0.00 C ATOM 1663 CG1 VAL A 838 32.818 -2.289 -31.487 1.00 0.00 C ATOM 1664 CG2 VAL A 838 32.147 -3.199 -29.259 1.00 0.00 C ATOM 0 H VAL A 838 30.439 -0.893 -28.522 1.00 0.00 H new ATOM 0 HA VAL A 838 33.325 -0.638 -29.412 1.00 0.00 H new ATOM 0 HB VAL A 838 30.876 -2.068 -30.582 1.00 0.00 H new ATOM 0 HG11 VAL A 838 32.576 -3.245 -31.951 1.00 0.00 H new ATOM 0 HG12 VAL A 838 32.657 -1.486 -32.206 1.00 0.00 H new ATOM 0 HG13 VAL A 838 33.862 -2.292 -31.174 1.00 0.00 H new ATOM 0 HG21 VAL A 838 31.905 -4.156 -29.722 1.00 0.00 H new ATOM 0 HG22 VAL A 838 33.191 -3.202 -28.945 1.00 0.00 H new ATOM 0 HG23 VAL A 838 31.507 -3.044 -28.390 1.00 0.00 H new ATOM 1674 N CYS A 839 32.791 1.308 -30.845 1.00 0.00 N ATOM 1675 CA CYS A 839 32.454 2.449 -31.742 1.00 0.00 C ATOM 1676 C CYS A 839 33.054 2.246 -33.133 1.00 0.00 C ATOM 1677 O CYS A 839 34.119 1.684 -33.290 1.00 0.00 O ATOM 1678 CB CYS A 839 33.081 3.664 -31.072 1.00 0.00 C ATOM 1679 SG CYS A 839 31.800 4.605 -30.221 1.00 0.00 S ATOM 0 H CYS A 839 33.754 1.285 -30.511 1.00 0.00 H new ATOM 0 HA CYS A 839 31.378 2.554 -31.880 1.00 0.00 H new ATOM 0 HB2 CYS A 839 33.847 3.348 -30.364 1.00 0.00 H new ATOM 0 HB3 CYS A 839 33.574 4.290 -31.816 1.00 0.00 H new ATOM 1684 N SER A 840 32.369 2.702 -34.144 1.00 0.00 N ATOM 1685 CA SER A 840 32.885 2.544 -35.535 1.00 0.00 C ATOM 1686 C SER A 840 32.631 3.828 -36.331 1.00 0.00 C ATOM 1687 O SER A 840 32.564 4.908 -35.781 1.00 0.00 O ATOM 1688 CB SER A 840 32.089 1.384 -36.124 1.00 0.00 C ATOM 1689 OG SER A 840 30.741 1.794 -36.327 1.00 0.00 O ATOM 0 H SER A 840 31.471 3.179 -34.068 1.00 0.00 H new ATOM 0 HA SER A 840 33.958 2.354 -35.563 1.00 0.00 H new ATOM 0 HB2 SER A 840 32.531 1.067 -37.069 1.00 0.00 H new ATOM 0 HB3 SER A 840 32.123 0.526 -35.452 1.00 0.00 H new ATOM 0 HG SER A 840 30.227 1.051 -36.707 1.00 0.00 H new ATOM 1695 N THR A 841 32.489 3.718 -37.623 1.00 0.00 N ATOM 1696 CA THR A 841 32.239 4.933 -38.452 1.00 0.00 C ATOM 1697 C THR A 841 30.923 4.782 -39.218 1.00 0.00 C ATOM 1698 O THR A 841 30.205 3.816 -39.051 1.00 0.00 O ATOM 1699 CB THR A 841 33.421 5.006 -39.416 1.00 0.00 C ATOM 1700 OG1 THR A 841 33.431 3.849 -40.242 1.00 0.00 O ATOM 1701 CG2 THR A 841 34.723 5.077 -38.617 1.00 0.00 C ATOM 0 H THR A 841 32.535 2.841 -38.141 1.00 0.00 H new ATOM 0 HA THR A 841 32.154 5.837 -37.850 1.00 0.00 H new ATOM 0 HB THR A 841 33.329 5.895 -40.040 1.00 0.00 H new ATOM 0 HG1 THR A 841 34.188 3.896 -40.862 1.00 0.00 H new ATOM 0 HG21 THR A 841 35.568 5.129 -39.303 1.00 0.00 H new ATOM 0 HG22 THR A 841 34.714 5.965 -37.984 1.00 0.00 H new ATOM 0 HG23 THR A 841 34.816 4.188 -37.993 1.00 0.00 H new