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 794 HIS : no HD1:sc= -4.59! K(o=-8.1!,f=-1.9) USER MOD Set 1.2: A 798 SER OG : rot -115:sc= -3.07! USER MOD Set 1.3: A 799 ASN : amide:sc= -0.442 K(o=-8.1,f=-3.9!) USER MOD Single : A 729 SER OG : rot 180:sc= 0.00687 USER MOD Single : A 736 SER OG : rot 180:sc= 0 USER MOD Single : A 757 THR OG1 : rot -35:sc= 0.902 USER MOD Single : A 759 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 761 HIS : no HD1:sc= -1.33! C(o=-1.3!,f=-3.8!) USER MOD Single : A 763 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 768 GLN : amide:sc= -0.787 X(o=-0.79,f=-0.82) USER MOD Single : A 769 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 SER OG : rot 180:sc= 0 USER MOD Single : A 774 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.0166) USER MOD Single : A 777 SER OG : rot 180:sc= 0 USER MOD Single : A 780 THR OG1 : rot 48:sc= 0.213 USER MOD Single : A 784 THR OG1 : rot 180:sc= 0.0105 USER MOD Single : A 787 THR OG1 : rot 180:sc= 0 USER MOD Single : A 789 GLN : amide:sc= -3.79! C(o=-3.8!,f=-2.7!) USER MOD Single : A 790 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 795 SER OG : rot -9:sc= -1.14! USER MOD Single : A 797 ASN : amide:sc= -1.85! C(o=-1.9!,f=-5.4!) 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 180:sc= 0.24 USER MOD Single : A 819 SER OG : rot 180:sc= 0 USER MOD Single : A 820 ASN : amide:sc= -0.298 K(o=-0.3,f=-3.4!) USER MOD Single : A 830 MET CE :methyl 156:sc= -1.99! (180deg=-3.57!) USER MOD Single : A 831 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 840 SER OG : rot 66:sc= 1.23 USER MOD Single : A 841 THR OG1 : rot 21:sc= -0.43 USER MOD ----------------------------------------------------------------- ATOM 39 N VAL A 728 37.862 2.427 -35.630 1.00 0.00 N ATOM 40 CA VAL A 728 37.155 1.722 -34.521 1.00 0.00 C ATOM 41 C VAL A 728 37.723 2.166 -33.171 1.00 0.00 C ATOM 42 O VAL A 728 38.730 1.663 -32.713 1.00 0.00 O ATOM 43 CB VAL A 728 37.428 0.238 -34.757 1.00 0.00 C ATOM 44 CG1 VAL A 728 36.944 -0.569 -33.552 1.00 0.00 C ATOM 45 CG2 VAL A 728 36.683 -0.223 -36.012 1.00 0.00 C ATOM 0 HA VAL A 728 36.087 1.940 -34.505 1.00 0.00 H new ATOM 0 HB VAL A 728 38.499 0.082 -34.891 1.00 0.00 H new ATOM 0 HG11 VAL A 728 37.139 -1.628 -33.721 1.00 0.00 H new ATOM 0 HG12 VAL A 728 37.474 -0.241 -32.658 1.00 0.00 H new ATOM 0 HG13 VAL A 728 35.874 -0.414 -33.417 1.00 0.00 H new ATOM 0 HG21 VAL A 728 36.877 -1.282 -36.182 1.00 0.00 H new ATOM 0 HG22 VAL A 728 35.613 -0.067 -35.878 1.00 0.00 H new ATOM 0 HG23 VAL A 728 37.028 0.351 -36.872 1.00 0.00 H new ATOM 55 N SER A 729 37.084 3.106 -32.529 1.00 0.00 N ATOM 56 CA SER A 729 37.589 3.583 -31.208 1.00 0.00 C ATOM 57 C SER A 729 37.079 2.678 -30.080 1.00 0.00 C ATOM 58 O SER A 729 36.862 1.497 -30.265 1.00 0.00 O ATOM 59 CB SER A 729 37.022 4.992 -31.057 1.00 0.00 C ATOM 60 OG SER A 729 37.898 5.766 -30.244 1.00 0.00 O ATOM 0 H SER A 729 36.235 3.564 -32.861 1.00 0.00 H new ATOM 0 HA SER A 729 38.678 3.569 -31.155 1.00 0.00 H new ATOM 0 HB2 SER A 729 36.909 5.458 -32.036 1.00 0.00 H new ATOM 0 HB3 SER A 729 36.030 4.951 -30.607 1.00 0.00 H new ATOM 0 HG SER A 729 37.538 6.672 -30.146 1.00 0.00 H new ATOM 66 N GLY A 730 36.887 3.230 -28.913 1.00 0.00 N ATOM 67 CA GLY A 730 36.394 2.415 -27.769 1.00 0.00 C ATOM 68 C GLY A 730 36.483 3.242 -26.487 1.00 0.00 C ATOM 69 O GLY A 730 37.496 3.850 -26.200 1.00 0.00 O ATOM 0 H GLY A 730 37.051 4.215 -28.703 1.00 0.00 H new ATOM 0 HA2 GLY A 730 35.364 2.105 -27.945 1.00 0.00 H new ATOM 0 HA3 GLY A 730 36.988 1.506 -27.672 1.00 0.00 H new ATOM 73 N VAL A 731 35.436 3.274 -25.714 1.00 0.00 N ATOM 74 CA VAL A 731 35.470 4.066 -24.451 1.00 0.00 C ATOM 75 C VAL A 731 35.226 3.156 -23.243 1.00 0.00 C ATOM 76 O VAL A 731 34.420 2.248 -23.290 1.00 0.00 O ATOM 77 CB VAL A 731 34.340 5.084 -24.594 1.00 0.00 C ATOM 78 CG1 VAL A 731 34.486 6.163 -23.518 1.00 0.00 C ATOM 79 CG2 VAL A 731 34.412 5.733 -25.979 1.00 0.00 C ATOM 0 H VAL A 731 34.559 2.788 -25.900 1.00 0.00 H new ATOM 0 HA VAL A 731 36.435 4.546 -24.292 1.00 0.00 H new ATOM 0 HB VAL A 731 33.380 4.581 -24.476 1.00 0.00 H new ATOM 0 HG11 VAL A 731 33.680 6.890 -23.620 1.00 0.00 H new ATOM 0 HG12 VAL A 731 34.437 5.702 -22.531 1.00 0.00 H new ATOM 0 HG13 VAL A 731 35.445 6.667 -23.636 1.00 0.00 H new ATOM 0 HG21 VAL A 731 33.606 6.460 -26.083 1.00 0.00 H new ATOM 0 HG22 VAL A 731 35.372 6.236 -26.096 1.00 0.00 H new ATOM 0 HG23 VAL A 731 34.309 4.966 -26.746 1.00 0.00 H new ATOM 89 N CYS A 732 35.919 3.393 -22.164 1.00 0.00 N ATOM 90 CA CYS A 732 35.730 2.544 -20.953 1.00 0.00 C ATOM 91 C CYS A 732 35.027 3.350 -19.857 1.00 0.00 C ATOM 92 O CYS A 732 34.966 4.562 -19.912 1.00 0.00 O ATOM 93 CB CYS A 732 37.142 2.160 -20.512 1.00 0.00 C ATOM 94 SG CYS A 732 37.348 0.366 -20.637 1.00 0.00 S ATOM 0 H CYS A 732 36.609 4.138 -22.068 1.00 0.00 H new ATOM 0 HA CYS A 732 35.115 1.666 -21.153 1.00 0.00 H new ATOM 0 HB2 CYS A 732 37.879 2.666 -21.136 1.00 0.00 H new ATOM 0 HB3 CYS A 732 37.315 2.486 -19.486 1.00 0.00 H new ATOM 99 N ALA A 733 34.498 2.693 -18.864 1.00 0.00 N ATOM 100 CA ALA A 733 33.803 3.435 -17.775 1.00 0.00 C ATOM 101 C ALA A 733 33.803 2.618 -16.479 1.00 0.00 C ATOM 102 O ALA A 733 33.066 1.664 -16.332 1.00 0.00 O ATOM 103 CB ALA A 733 32.375 3.632 -18.279 1.00 0.00 C ATOM 0 H ALA A 733 34.516 1.679 -18.759 1.00 0.00 H new ATOM 0 HA ALA A 733 34.294 4.381 -17.549 1.00 0.00 H new ATOM 0 HB1 ALA A 733 31.796 4.173 -17.530 1.00 0.00 H new ATOM 0 HB2 ALA A 733 32.392 4.203 -19.207 1.00 0.00 H new ATOM 0 HB3 ALA A 733 31.916 2.660 -18.460 1.00 0.00 H new ATOM 109 N ASP A 734 34.631 2.986 -15.543 1.00 0.00 N ATOM 110 CA ASP A 734 34.685 2.241 -14.255 1.00 0.00 C ATOM 111 C ASP A 734 34.290 3.175 -13.109 1.00 0.00 C ATOM 112 O ASP A 734 35.061 4.011 -12.681 1.00 0.00 O ATOM 113 CB ASP A 734 36.141 1.797 -14.117 1.00 0.00 C ATOM 114 CG ASP A 734 36.241 0.675 -13.081 1.00 0.00 C ATOM 115 OD1 ASP A 734 35.218 0.324 -12.519 1.00 0.00 O ATOM 116 OD2 ASP A 734 37.339 0.186 -12.870 1.00 0.00 O ATOM 0 H ASP A 734 35.275 3.774 -15.615 1.00 0.00 H new ATOM 0 HA ASP A 734 34.003 1.391 -14.228 1.00 0.00 H new ATOM 0 HB2 ASP A 734 36.519 1.452 -15.079 1.00 0.00 H new ATOM 0 HB3 ASP A 734 36.762 2.641 -13.815 1.00 0.00 H new ATOM 121 N VAL A 735 33.093 3.039 -12.607 1.00 0.00 N ATOM 122 CA VAL A 735 32.648 3.921 -11.490 1.00 0.00 C ATOM 123 C VAL A 735 32.061 3.085 -10.348 1.00 0.00 C ATOM 124 O VAL A 735 31.572 1.992 -10.554 1.00 0.00 O ATOM 125 CB VAL A 735 31.576 4.813 -12.112 1.00 0.00 C ATOM 126 CG1 VAL A 735 30.885 5.630 -11.022 1.00 0.00 C ATOM 127 CG2 VAL A 735 32.229 5.762 -13.123 1.00 0.00 C ATOM 0 H VAL A 735 32.404 2.356 -12.922 1.00 0.00 H new ATOM 0 HA VAL A 735 33.468 4.497 -11.062 1.00 0.00 H new ATOM 0 HB VAL A 735 30.837 4.190 -12.616 1.00 0.00 H new ATOM 0 HG11 VAL A 735 30.121 6.264 -11.472 1.00 0.00 H new ATOM 0 HG12 VAL A 735 30.420 4.956 -10.302 1.00 0.00 H new ATOM 0 HG13 VAL A 735 31.620 6.253 -10.513 1.00 0.00 H new ATOM 0 HG21 VAL A 735 31.466 6.400 -13.569 1.00 0.00 H new ATOM 0 HG22 VAL A 735 32.969 6.381 -12.616 1.00 0.00 H new ATOM 0 HG23 VAL A 735 32.718 5.181 -13.905 1.00 0.00 H new ATOM 137 N SER A 736 32.108 3.592 -9.145 1.00 0.00 N ATOM 138 CA SER A 736 31.554 2.827 -7.990 1.00 0.00 C ATOM 139 C SER A 736 30.034 2.683 -8.122 1.00 0.00 C ATOM 140 O SER A 736 29.448 3.050 -9.122 1.00 0.00 O ATOM 141 CB SER A 736 31.907 3.658 -6.759 1.00 0.00 C ATOM 142 OG SER A 736 33.315 3.626 -6.558 1.00 0.00 O ATOM 0 H SER A 736 32.506 4.502 -8.912 1.00 0.00 H new ATOM 0 HA SER A 736 31.962 1.818 -7.934 1.00 0.00 H new ATOM 0 HB2 SER A 736 31.570 4.686 -6.891 1.00 0.00 H new ATOM 0 HB3 SER A 736 31.394 3.265 -5.881 1.00 0.00 H new ATOM 0 HG SER A 736 33.545 4.160 -5.769 1.00 0.00 H new ATOM 148 N GLU A 737 29.395 2.153 -7.117 1.00 0.00 N ATOM 149 CA GLU A 737 27.913 1.980 -7.172 1.00 0.00 C ATOM 150 C GLU A 737 27.226 3.016 -6.275 1.00 0.00 C ATOM 151 O GLU A 737 27.861 3.668 -5.469 1.00 0.00 O ATOM 152 CB GLU A 737 27.677 0.558 -6.645 1.00 0.00 C ATOM 153 CG GLU A 737 26.189 0.343 -6.360 1.00 0.00 C ATOM 154 CD GLU A 737 25.406 0.390 -7.668 1.00 0.00 C ATOM 155 OE1 GLU A 737 26.026 0.592 -8.701 1.00 0.00 O ATOM 156 OE2 GLU A 737 24.199 0.222 -7.615 1.00 0.00 O ATOM 0 H GLU A 737 29.835 1.830 -6.255 1.00 0.00 H new ATOM 0 HA GLU A 737 27.508 2.120 -8.174 1.00 0.00 H new ATOM 0 HB2 GLU A 737 28.024 -0.172 -7.377 1.00 0.00 H new ATOM 0 HB3 GLU A 737 28.256 0.398 -5.736 1.00 0.00 H new ATOM 0 HG2 GLU A 737 26.038 -0.618 -5.868 1.00 0.00 H new ATOM 0 HG3 GLU A 737 25.824 1.111 -5.678 1.00 0.00 H new ATOM 479 N THR A 757 22.007 8.690 -6.482 1.00 0.00 N ATOM 480 CA THR A 757 22.666 7.465 -7.043 1.00 0.00 C ATOM 481 C THR A 757 23.917 7.828 -7.853 1.00 0.00 C ATOM 482 O THR A 757 24.313 8.974 -7.929 1.00 0.00 O ATOM 483 CB THR A 757 21.612 6.821 -7.949 1.00 0.00 C ATOM 484 OG1 THR A 757 20.584 7.762 -8.231 1.00 0.00 O ATOM 485 CG2 THR A 757 21.012 5.606 -7.246 1.00 0.00 C ATOM 0 HA THR A 757 22.997 6.793 -6.251 1.00 0.00 H new ATOM 0 HB THR A 757 22.080 6.508 -8.882 1.00 0.00 H new ATOM 0 HG1 THR A 757 20.436 8.330 -7.446 1.00 0.00 H new ATOM 0 HG21 THR A 757 20.262 5.147 -7.890 1.00 0.00 H new ATOM 0 HG22 THR A 757 21.799 4.883 -7.034 1.00 0.00 H new ATOM 0 HG23 THR A 757 20.546 5.920 -6.312 1.00 0.00 H new ATOM 493 N ALA A 758 24.544 6.846 -8.456 1.00 0.00 N ATOM 494 CA ALA A 758 25.772 7.115 -9.265 1.00 0.00 C ATOM 495 C ALA A 758 25.400 7.373 -10.726 1.00 0.00 C ATOM 496 O ALA A 758 24.256 7.256 -11.116 1.00 0.00 O ATOM 497 CB ALA A 758 26.609 5.844 -9.146 1.00 0.00 C ATOM 0 H ALA A 758 24.256 5.868 -8.422 1.00 0.00 H new ATOM 0 HA ALA A 758 26.311 7.995 -8.914 1.00 0.00 H new ATOM 0 HB1 ALA A 758 27.531 5.961 -9.715 1.00 0.00 H new ATOM 0 HB2 ALA A 758 26.849 5.663 -8.098 1.00 0.00 H new ATOM 0 HB3 ALA A 758 26.045 4.999 -9.540 1.00 0.00 H new ATOM 503 N LYS A 759 26.358 7.722 -11.537 1.00 0.00 N ATOM 504 CA LYS A 759 26.055 7.987 -12.972 1.00 0.00 C ATOM 505 C LYS A 759 27.248 7.599 -13.854 1.00 0.00 C ATOM 506 O LYS A 759 28.392 7.731 -13.467 1.00 0.00 O ATOM 507 CB LYS A 759 25.796 9.490 -13.050 1.00 0.00 C ATOM 508 CG LYS A 759 24.287 9.744 -13.091 1.00 0.00 C ATOM 509 CD LYS A 759 24.019 11.180 -13.546 1.00 0.00 C ATOM 510 CE LYS A 759 22.890 11.778 -12.703 1.00 0.00 C ATOM 511 NZ LYS A 759 23.059 13.251 -12.828 1.00 0.00 N ATOM 0 H LYS A 759 27.336 7.835 -11.270 1.00 0.00 H new ATOM 0 HA LYS A 759 25.203 7.406 -13.325 1.00 0.00 H new ATOM 0 HB2 LYS A 759 26.237 9.991 -12.189 1.00 0.00 H new ATOM 0 HB3 LYS A 759 26.270 9.906 -13.939 1.00 0.00 H new ATOM 0 HG2 LYS A 759 23.808 9.041 -13.773 1.00 0.00 H new ATOM 0 HG3 LYS A 759 23.853 9.578 -12.105 1.00 0.00 H new ATOM 0 HD2 LYS A 759 24.923 11.781 -13.442 1.00 0.00 H new ATOM 0 HD3 LYS A 759 23.746 11.194 -14.601 1.00 0.00 H new ATOM 0 HE2 LYS A 759 21.913 11.460 -13.068 1.00 0.00 H new ATOM 0 HE3 LYS A 759 22.961 11.459 -11.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 759 22.321 13.733 -12.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 759 23.995 13.525 -12.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 759 22.979 13.526 -13.828 1.00 0.00 H new ATOM 525 N VAL A 760 26.980 7.117 -15.038 1.00 0.00 N ATOM 526 CA VAL A 760 28.085 6.716 -15.960 1.00 0.00 C ATOM 527 C VAL A 760 27.771 7.204 -17.376 1.00 0.00 C ATOM 528 O VAL A 760 26.687 6.998 -17.880 1.00 0.00 O ATOM 529 CB VAL A 760 28.103 5.189 -15.916 1.00 0.00 C ATOM 530 CG1 VAL A 760 29.185 4.663 -16.861 1.00 0.00 C ATOM 531 CG2 VAL A 760 28.400 4.722 -14.488 1.00 0.00 C ATOM 0 H VAL A 760 26.039 6.983 -15.409 1.00 0.00 H new ATOM 0 HA VAL A 760 29.047 7.141 -15.672 1.00 0.00 H new ATOM 0 HB VAL A 760 27.132 4.806 -16.228 1.00 0.00 H new ATOM 0 HG11 VAL A 760 29.198 3.574 -16.829 1.00 0.00 H new ATOM 0 HG12 VAL A 760 28.973 4.994 -17.878 1.00 0.00 H new ATOM 0 HG13 VAL A 760 30.157 5.046 -16.550 1.00 0.00 H new ATOM 0 HG21 VAL A 760 28.413 3.633 -14.457 1.00 0.00 H new ATOM 0 HG22 VAL A 760 29.371 5.105 -14.174 1.00 0.00 H new ATOM 0 HG23 VAL A 760 27.628 5.095 -13.815 1.00 0.00 H new ATOM 541 N HIS A 761 28.701 7.844 -18.026 1.00 0.00 N ATOM 542 CA HIS A 761 28.426 8.334 -19.410 1.00 0.00 C ATOM 543 C HIS A 761 29.666 8.195 -20.298 1.00 0.00 C ATOM 544 O HIS A 761 30.767 8.523 -19.904 1.00 0.00 O ATOM 545 CB HIS A 761 28.062 9.807 -19.238 1.00 0.00 C ATOM 546 CG HIS A 761 29.178 10.517 -18.523 1.00 0.00 C ATOM 547 ND1 HIS A 761 29.526 10.216 -17.215 1.00 0.00 N ATOM 548 CD2 HIS A 761 30.034 11.513 -18.920 1.00 0.00 C ATOM 549 CE1 HIS A 761 30.553 11.018 -16.874 1.00 0.00 C ATOM 550 NE2 HIS A 761 30.902 11.829 -17.878 1.00 0.00 N ATOM 0 H HIS A 761 29.633 8.049 -17.665 1.00 0.00 H new ATOM 0 HA HIS A 761 27.634 7.761 -19.892 1.00 0.00 H new ATOM 0 HB2 HIS A 761 27.889 10.266 -20.211 1.00 0.00 H new ATOM 0 HB3 HIS A 761 27.135 9.900 -18.672 1.00 0.00 H new ATOM 0 HD2 HIS A 761 30.035 11.981 -19.893 1.00 0.00 H new ATOM 0 HE1 HIS A 761 31.035 11.007 -15.908 1.00 0.00 H new ATOM 0 HE2 HIS A 761 31.644 12.529 -17.880 1.00 0.00 H new ATOM 558 N LEU A 762 29.489 7.708 -21.495 1.00 0.00 N ATOM 559 CA LEU A 762 30.648 7.544 -22.417 1.00 0.00 C ATOM 560 C LEU A 762 30.474 8.469 -23.627 1.00 0.00 C ATOM 561 O LEU A 762 29.371 8.742 -24.055 1.00 0.00 O ATOM 562 CB LEU A 762 30.609 6.076 -22.847 1.00 0.00 C ATOM 563 CG LEU A 762 30.630 5.179 -21.606 1.00 0.00 C ATOM 564 CD1 LEU A 762 29.212 4.687 -21.302 1.00 0.00 C ATOM 565 CD2 LEU A 762 31.540 3.976 -21.864 1.00 0.00 C ATOM 0 H LEU A 762 28.589 7.416 -21.875 1.00 0.00 H new ATOM 0 HA LEU A 762 31.599 7.799 -21.949 1.00 0.00 H new ATOM 0 HB2 LEU A 762 29.711 5.882 -23.434 1.00 0.00 H new ATOM 0 HB3 LEU A 762 31.463 5.851 -23.486 1.00 0.00 H new ATOM 0 HG LEU A 762 31.006 5.748 -20.755 1.00 0.00 H new ATOM 0 HD11 LEU A 762 29.230 4.049 -20.418 1.00 0.00 H new ATOM 0 HD12 LEU A 762 28.562 5.542 -21.119 1.00 0.00 H new ATOM 0 HD13 LEU A 762 28.834 4.119 -22.152 1.00 0.00 H new ATOM 0 HD21 LEU A 762 31.556 3.336 -20.982 1.00 0.00 H new ATOM 0 HD22 LEU A 762 31.162 3.410 -22.716 1.00 0.00 H new ATOM 0 HD23 LEU A 762 32.551 4.324 -22.079 1.00 0.00 H new ATOM 577 N LYS A 763 31.550 8.956 -24.181 1.00 0.00 N ATOM 578 CA LYS A 763 31.430 9.863 -25.360 1.00 0.00 C ATOM 579 C LYS A 763 32.415 9.453 -26.458 1.00 0.00 C ATOM 580 O LYS A 763 33.602 9.689 -26.362 1.00 0.00 O ATOM 581 CB LYS A 763 31.778 11.250 -24.824 1.00 0.00 C ATOM 582 CG LYS A 763 33.188 11.228 -24.229 1.00 0.00 C ATOM 583 CD LYS A 763 33.151 11.798 -22.810 1.00 0.00 C ATOM 584 CE LYS A 763 34.010 13.063 -22.746 1.00 0.00 C ATOM 585 NZ LYS A 763 35.405 12.571 -22.566 1.00 0.00 N ATOM 0 H LYS A 763 32.503 8.767 -23.871 1.00 0.00 H new ATOM 0 HA LYS A 763 30.435 9.829 -25.803 1.00 0.00 H new ATOM 0 HB2 LYS A 763 31.722 11.986 -25.626 1.00 0.00 H new ATOM 0 HB3 LYS A 763 31.056 11.550 -24.065 1.00 0.00 H new ATOM 0 HG2 LYS A 763 33.572 10.208 -24.213 1.00 0.00 H new ATOM 0 HG3 LYS A 763 33.866 11.814 -24.850 1.00 0.00 H new ATOM 0 HD2 LYS A 763 32.124 12.028 -22.526 1.00 0.00 H new ATOM 0 HD3 LYS A 763 33.520 11.058 -22.100 1.00 0.00 H new ATOM 0 HE2 LYS A 763 33.914 13.652 -23.658 1.00 0.00 H new ATOM 0 HE3 LYS A 763 33.707 13.704 -21.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 763 36.055 13.381 -22.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 763 35.468 12.019 -21.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 763 35.667 11.969 -23.372 1.00 0.00 H new ATOM 599 N CYS A 764 31.931 8.842 -27.502 1.00 0.00 N ATOM 600 CA CYS A 764 32.840 8.417 -28.609 1.00 0.00 C ATOM 601 C CYS A 764 33.077 9.585 -29.570 1.00 0.00 C ATOM 602 O CYS A 764 32.512 10.650 -29.419 1.00 0.00 O ATOM 603 CB CYS A 764 32.101 7.282 -29.316 1.00 0.00 C ATOM 604 SG CYS A 764 33.256 5.929 -29.653 1.00 0.00 S ATOM 0 H CYS A 764 30.946 8.617 -27.639 1.00 0.00 H new ATOM 0 HA CYS A 764 33.817 8.100 -28.245 1.00 0.00 H new ATOM 0 HB2 CYS A 764 31.279 6.927 -28.695 1.00 0.00 H new ATOM 0 HB3 CYS A 764 31.664 7.642 -30.247 1.00 0.00 H new ATOM 609 N ALA A 765 33.906 9.394 -30.556 1.00 0.00 N ATOM 610 CA ALA A 765 34.176 10.497 -31.523 1.00 0.00 C ATOM 611 C ALA A 765 32.935 10.753 -32.385 1.00 0.00 C ATOM 612 O ALA A 765 32.068 9.908 -32.488 1.00 0.00 O ATOM 613 CB ALA A 765 35.335 9.996 -32.384 1.00 0.00 C ATOM 0 H ALA A 765 34.408 8.525 -30.736 1.00 0.00 H new ATOM 0 HA ALA A 765 34.418 11.436 -31.025 1.00 0.00 H new ATOM 0 HB1 ALA A 765 35.594 10.754 -33.123 1.00 0.00 H new ATOM 0 HB2 ALA A 765 36.199 9.797 -31.750 1.00 0.00 H new ATOM 0 HB3 ALA A 765 35.040 9.079 -32.894 1.00 0.00 H new ATOM 619 N PRO A 766 32.896 11.914 -32.975 1.00 0.00 N ATOM 620 CA PRO A 766 31.753 12.292 -33.837 1.00 0.00 C ATOM 621 C PRO A 766 31.781 11.496 -35.146 1.00 0.00 C ATOM 622 O PRO A 766 32.800 11.393 -35.800 1.00 0.00 O ATOM 623 CB PRO A 766 31.974 13.776 -34.101 1.00 0.00 C ATOM 624 CG PRO A 766 33.447 13.983 -33.923 1.00 0.00 C ATOM 625 CD PRO A 766 33.907 12.973 -32.898 1.00 0.00 C ATOM 0 HA PRO A 766 30.787 12.086 -33.377 1.00 0.00 H new ATOM 0 HB2 PRO A 766 31.655 14.050 -35.107 1.00 0.00 H new ATOM 0 HB3 PRO A 766 31.402 14.391 -33.406 1.00 0.00 H new ATOM 0 HG2 PRO A 766 33.974 13.844 -34.867 1.00 0.00 H new ATOM 0 HG3 PRO A 766 33.657 14.998 -33.587 1.00 0.00 H new ATOM 0 HD2 PRO A 766 34.903 12.594 -33.129 1.00 0.00 H new ATOM 0 HD3 PRO A 766 33.955 13.409 -31.900 1.00 0.00 H new ATOM 633 N GLY A 767 30.671 10.930 -35.530 1.00 0.00 N ATOM 634 CA GLY A 767 30.634 10.143 -36.795 1.00 0.00 C ATOM 635 C GLY A 767 30.513 8.658 -36.469 1.00 0.00 C ATOM 636 O GLY A 767 29.734 7.942 -37.066 1.00 0.00 O ATOM 0 H GLY A 767 29.787 10.978 -35.023 1.00 0.00 H new ATOM 0 HA2 GLY A 767 29.791 10.461 -37.409 1.00 0.00 H new ATOM 0 HA3 GLY A 767 31.538 10.326 -37.376 1.00 0.00 H new ATOM 640 N GLN A 768 31.277 8.185 -35.527 1.00 0.00 N ATOM 641 CA GLN A 768 31.201 6.741 -35.167 1.00 0.00 C ATOM 642 C GLN A 768 30.085 6.513 -34.148 1.00 0.00 C ATOM 643 O GLN A 768 30.105 7.053 -33.060 1.00 0.00 O ATOM 644 CB GLN A 768 32.561 6.414 -34.559 1.00 0.00 C ATOM 645 CG GLN A 768 33.564 6.126 -35.678 1.00 0.00 C ATOM 646 CD GLN A 768 34.016 7.444 -36.310 1.00 0.00 C ATOM 647 OE1 GLN A 768 33.607 7.778 -37.404 1.00 0.00 O ATOM 648 NE2 GLN A 768 34.849 8.210 -35.664 1.00 0.00 N ATOM 0 H GLN A 768 31.950 8.733 -34.991 1.00 0.00 H new ATOM 0 HA GLN A 768 30.979 6.109 -36.027 1.00 0.00 H new ATOM 0 HB2 GLN A 768 32.909 7.248 -33.950 1.00 0.00 H new ATOM 0 HB3 GLN A 768 32.478 5.550 -33.899 1.00 0.00 H new ATOM 0 HG2 GLN A 768 34.424 5.587 -35.280 1.00 0.00 H new ATOM 0 HG3 GLN A 768 33.108 5.486 -36.433 1.00 0.00 H new ATOM 0 HE21 GLN A 768 35.192 7.929 -34.745 1.00 0.00 H new ATOM 0 HE22 GLN A 768 35.158 9.090 -36.077 1.00 0.00 H new ATOM 657 N THR A 769 29.112 5.717 -34.490 1.00 0.00 N ATOM 658 CA THR A 769 27.994 5.457 -33.538 1.00 0.00 C ATOM 659 C THR A 769 28.162 4.088 -32.877 1.00 0.00 C ATOM 660 O THR A 769 28.661 3.154 -33.473 1.00 0.00 O ATOM 661 CB THR A 769 26.729 5.480 -34.395 1.00 0.00 C ATOM 662 OG1 THR A 769 26.769 4.406 -35.324 1.00 0.00 O ATOM 663 CG2 THR A 769 26.646 6.805 -35.147 1.00 0.00 C ATOM 0 H THR A 769 29.041 5.235 -35.386 1.00 0.00 H new ATOM 0 HA THR A 769 27.961 6.195 -32.736 1.00 0.00 H new ATOM 0 HB THR A 769 25.853 5.374 -33.755 1.00 0.00 H new ATOM 0 HG1 THR A 769 25.958 4.418 -35.873 1.00 0.00 H new ATOM 0 HG21 THR A 769 25.744 6.821 -35.758 1.00 0.00 H new ATOM 0 HG22 THR A 769 26.615 7.628 -34.432 1.00 0.00 H new ATOM 0 HG23 THR A 769 27.520 6.915 -35.788 1.00 0.00 H new ATOM 671 N ILE A 770 27.748 3.964 -31.647 1.00 0.00 N ATOM 672 CA ILE A 770 27.883 2.656 -30.944 1.00 0.00 C ATOM 673 C ILE A 770 26.909 1.642 -31.548 1.00 0.00 C ATOM 674 O ILE A 770 25.717 1.869 -31.600 1.00 0.00 O ATOM 675 CB ILE A 770 27.522 2.950 -29.488 1.00 0.00 C ATOM 676 CG1 ILE A 770 28.474 4.012 -28.931 1.00 0.00 C ATOM 677 CG2 ILE A 770 27.647 1.669 -28.660 1.00 0.00 C ATOM 678 CD1 ILE A 770 27.839 4.676 -27.706 1.00 0.00 C ATOM 0 H ILE A 770 27.322 4.711 -31.098 1.00 0.00 H new ATOM 0 HA ILE A 770 28.884 2.233 -31.034 1.00 0.00 H new ATOM 0 HB ILE A 770 26.497 3.316 -29.436 1.00 0.00 H new ATOM 0 HG12 ILE A 770 29.425 3.555 -28.658 1.00 0.00 H new ATOM 0 HG13 ILE A 770 28.687 4.761 -29.694 1.00 0.00 H new ATOM 0 HG21 ILE A 770 27.389 1.880 -27.622 1.00 0.00 H new ATOM 0 HG22 ILE A 770 26.969 0.913 -29.056 1.00 0.00 H new ATOM 0 HG23 ILE A 770 28.672 1.301 -28.712 1.00 0.00 H new ATOM 0 HD11 ILE A 770 28.517 5.432 -27.310 1.00 0.00 H new ATOM 0 HD12 ILE A 770 26.899 5.147 -27.994 1.00 0.00 H new ATOM 0 HD13 ILE A 770 27.649 3.923 -26.942 1.00 0.00 H new ATOM 690 N SER A 771 27.403 0.526 -32.004 1.00 0.00 N ATOM 691 CA SER A 771 26.496 -0.496 -32.603 1.00 0.00 C ATOM 692 C SER A 771 26.573 -1.810 -31.824 1.00 0.00 C ATOM 693 O SER A 771 25.752 -2.690 -31.996 1.00 0.00 O ATOM 694 CB SER A 771 27.015 -0.690 -34.023 1.00 0.00 C ATOM 695 OG SER A 771 26.509 -1.913 -34.546 1.00 0.00 O ATOM 0 H SER A 771 28.392 0.276 -31.989 1.00 0.00 H new ATOM 0 HA SER A 771 25.453 -0.181 -32.581 1.00 0.00 H new ATOM 0 HB2 SER A 771 26.705 0.144 -34.653 1.00 0.00 H new ATOM 0 HB3 SER A 771 28.105 -0.703 -34.025 1.00 0.00 H new ATOM 0 HG SER A 771 26.840 -2.040 -35.460 1.00 0.00 H new ATOM 701 N ALA A 772 27.546 -1.956 -30.966 1.00 0.00 N ATOM 702 CA ALA A 772 27.657 -3.223 -30.186 1.00 0.00 C ATOM 703 C ALA A 772 28.269 -2.959 -28.807 1.00 0.00 C ATOM 704 O ALA A 772 29.292 -2.312 -28.683 1.00 0.00 O ATOM 705 CB ALA A 772 28.583 -4.111 -31.017 1.00 0.00 C ATOM 0 H ALA A 772 28.264 -1.259 -30.772 1.00 0.00 H new ATOM 0 HA ALA A 772 26.684 -3.683 -30.012 1.00 0.00 H new ATOM 0 HB1 ALA A 772 28.719 -5.068 -30.513 1.00 0.00 H new ATOM 0 HB2 ALA A 772 28.142 -4.278 -31.999 1.00 0.00 H new ATOM 0 HB3 ALA A 772 29.550 -3.621 -31.132 1.00 0.00 H new ATOM 711 N ILE A 773 27.648 -3.452 -27.767 1.00 0.00 N ATOM 712 CA ILE A 773 28.195 -3.230 -26.398 1.00 0.00 C ATOM 713 C ILE A 773 29.262 -4.284 -26.091 1.00 0.00 C ATOM 714 O ILE A 773 29.047 -5.467 -26.267 1.00 0.00 O ATOM 715 CB ILE A 773 27.003 -3.389 -25.455 1.00 0.00 C ATOM 716 CG1 ILE A 773 25.915 -2.377 -25.826 1.00 0.00 C ATOM 717 CG2 ILE A 773 27.456 -3.142 -24.016 1.00 0.00 C ATOM 718 CD1 ILE A 773 26.446 -0.956 -25.624 1.00 0.00 C ATOM 0 H ILE A 773 26.787 -3.998 -27.808 1.00 0.00 H new ATOM 0 HA ILE A 773 28.663 -2.251 -26.293 1.00 0.00 H new ATOM 0 HB ILE A 773 26.604 -4.399 -25.544 1.00 0.00 H new ATOM 0 HG12 ILE A 773 25.611 -2.518 -26.863 1.00 0.00 H new ATOM 0 HG13 ILE A 773 25.030 -2.537 -25.210 1.00 0.00 H new ATOM 0 HG21 ILE A 773 26.606 -3.255 -23.343 1.00 0.00 H new ATOM 0 HG22 ILE A 773 28.229 -3.863 -23.749 1.00 0.00 H new ATOM 0 HG23 ILE A 773 27.856 -2.132 -23.929 1.00 0.00 H new ATOM 0 HD11 ILE A 773 25.671 -0.237 -25.888 1.00 0.00 H new ATOM 0 HD12 ILE A 773 26.728 -0.818 -24.580 1.00 0.00 H new ATOM 0 HD13 ILE A 773 27.318 -0.800 -26.259 1.00 0.00 H new ATOM 730 N LYS A 774 30.409 -3.869 -25.637 1.00 0.00 N ATOM 731 CA LYS A 774 31.485 -4.854 -25.323 1.00 0.00 C ATOM 732 C LYS A 774 31.235 -5.500 -23.951 1.00 0.00 C ATOM 733 O LYS A 774 31.472 -6.676 -23.760 1.00 0.00 O ATOM 734 CB LYS A 774 32.777 -4.036 -25.316 1.00 0.00 C ATOM 735 CG LYS A 774 33.929 -4.889 -24.775 1.00 0.00 C ATOM 736 CD LYS A 774 34.484 -5.770 -25.899 1.00 0.00 C ATOM 737 CE LYS A 774 35.648 -5.049 -26.587 1.00 0.00 C ATOM 738 NZ LYS A 774 36.837 -5.341 -25.737 1.00 0.00 N ATOM 0 H LYS A 774 30.651 -2.892 -25.469 1.00 0.00 H new ATOM 0 HA LYS A 774 31.526 -5.669 -26.046 1.00 0.00 H new ATOM 0 HB2 LYS A 774 33.008 -3.695 -26.325 1.00 0.00 H new ATOM 0 HB3 LYS A 774 32.651 -3.146 -24.700 1.00 0.00 H new ATOM 0 HG2 LYS A 774 34.716 -4.247 -24.379 1.00 0.00 H new ATOM 0 HG3 LYS A 774 33.580 -5.510 -23.950 1.00 0.00 H new ATOM 0 HD2 LYS A 774 34.822 -6.724 -25.494 1.00 0.00 H new ATOM 0 HD3 LYS A 774 33.700 -5.990 -26.623 1.00 0.00 H new ATOM 0 HE2 LYS A 774 35.791 -5.412 -27.605 1.00 0.00 H new ATOM 0 HE3 LYS A 774 35.464 -3.977 -26.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 37.573 -4.628 -25.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 36.562 -5.315 -24.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 37.207 -6.285 -25.970 1.00 0.00 H new ATOM 752 N PHE A 775 30.754 -4.745 -22.997 1.00 0.00 N ATOM 753 CA PHE A 775 30.495 -5.333 -21.644 1.00 0.00 C ATOM 754 C PHE A 775 29.502 -4.468 -20.857 1.00 0.00 C ATOM 755 O PHE A 775 29.149 -3.379 -21.263 1.00 0.00 O ATOM 756 CB PHE A 775 31.852 -5.351 -20.939 1.00 0.00 C ATOM 757 CG PHE A 775 31.686 -5.976 -19.571 1.00 0.00 C ATOM 758 CD1 PHE A 775 31.588 -7.369 -19.446 1.00 0.00 C ATOM 759 CD2 PHE A 775 31.620 -5.165 -18.433 1.00 0.00 C ATOM 760 CE1 PHE A 775 31.423 -7.948 -18.182 1.00 0.00 C ATOM 761 CE2 PHE A 775 31.457 -5.746 -17.168 1.00 0.00 C ATOM 762 CZ PHE A 775 31.357 -7.138 -17.043 1.00 0.00 C ATOM 0 H PHE A 775 30.530 -3.754 -23.093 1.00 0.00 H new ATOM 0 HA PHE A 775 30.059 -6.329 -21.719 1.00 0.00 H new ATOM 0 HB2 PHE A 775 32.575 -5.917 -21.527 1.00 0.00 H new ATOM 0 HB3 PHE A 775 32.242 -4.337 -20.845 1.00 0.00 H new ATOM 0 HD1 PHE A 775 31.640 -7.995 -20.324 1.00 0.00 H new ATOM 0 HD2 PHE A 775 31.695 -4.092 -18.529 1.00 0.00 H new ATOM 0 HE1 PHE A 775 31.347 -9.021 -18.086 1.00 0.00 H new ATOM 0 HE2 PHE A 775 31.408 -5.120 -16.289 1.00 0.00 H new ATOM 0 HZ PHE A 775 31.229 -7.585 -16.068 1.00 0.00 H new ATOM 772 N ALA A 776 29.049 -4.956 -19.729 1.00 0.00 N ATOM 773 CA ALA A 776 28.076 -4.179 -18.897 1.00 0.00 C ATOM 774 C ALA A 776 27.467 -5.089 -17.825 1.00 0.00 C ATOM 775 O ALA A 776 26.459 -5.733 -18.041 1.00 0.00 O ATOM 776 CB ALA A 776 26.998 -3.699 -19.870 1.00 0.00 C ATOM 0 H ALA A 776 29.312 -5.864 -19.346 1.00 0.00 H new ATOM 0 HA ALA A 776 28.549 -3.343 -18.382 1.00 0.00 H new ATOM 0 HB1 ALA A 776 26.250 -3.121 -19.328 1.00 0.00 H new ATOM 0 HB2 ALA A 776 27.453 -3.073 -20.638 1.00 0.00 H new ATOM 0 HB3 ALA A 776 26.522 -4.560 -20.339 1.00 0.00 H new ATOM 782 N SER A 777 28.072 -5.145 -16.673 1.00 0.00 N ATOM 783 CA SER A 777 27.532 -6.014 -15.584 1.00 0.00 C ATOM 784 C SER A 777 27.383 -5.215 -14.288 1.00 0.00 C ATOM 785 O SER A 777 28.282 -4.508 -13.875 1.00 0.00 O ATOM 786 CB SER A 777 28.573 -7.115 -15.412 1.00 0.00 C ATOM 787 OG SER A 777 28.321 -7.812 -14.197 1.00 0.00 O ATOM 0 H SER A 777 28.918 -4.627 -16.435 1.00 0.00 H new ATOM 0 HA SER A 777 26.546 -6.412 -15.825 1.00 0.00 H new ATOM 0 HB2 SER A 777 28.533 -7.804 -16.255 1.00 0.00 H new ATOM 0 HB3 SER A 777 29.575 -6.686 -15.398 1.00 0.00 H new ATOM 0 HG SER A 777 28.987 -8.522 -14.083 1.00 0.00 H new ATOM 793 N PHE A 778 26.255 -5.320 -13.643 1.00 0.00 N ATOM 794 CA PHE A 778 26.051 -4.565 -12.371 1.00 0.00 C ATOM 795 C PHE A 778 26.261 -5.486 -11.164 1.00 0.00 C ATOM 796 O PHE A 778 25.319 -6.011 -10.601 1.00 0.00 O ATOM 797 CB PHE A 778 24.601 -4.086 -12.432 1.00 0.00 C ATOM 798 CG PHE A 778 24.228 -3.425 -11.128 1.00 0.00 C ATOM 799 CD1 PHE A 778 23.605 -4.165 -10.116 1.00 0.00 C ATOM 800 CD2 PHE A 778 24.498 -2.069 -10.936 1.00 0.00 C ATOM 801 CE1 PHE A 778 23.253 -3.547 -8.911 1.00 0.00 C ATOM 802 CE2 PHE A 778 24.149 -1.450 -9.734 1.00 0.00 C ATOM 803 CZ PHE A 778 23.525 -2.190 -8.719 1.00 0.00 C ATOM 0 H PHE A 778 25.466 -5.894 -13.939 1.00 0.00 H new ATOM 0 HA PHE A 778 26.754 -3.739 -12.262 1.00 0.00 H new ATOM 0 HB2 PHE A 778 24.474 -3.384 -13.256 1.00 0.00 H new ATOM 0 HB3 PHE A 778 23.937 -4.929 -12.626 1.00 0.00 H new ATOM 0 HD1 PHE A 778 23.396 -5.214 -10.266 1.00 0.00 H new ATOM 0 HD2 PHE A 778 24.977 -1.498 -11.718 1.00 0.00 H new ATOM 0 HE1 PHE A 778 22.772 -4.118 -8.131 1.00 0.00 H new ATOM 0 HE2 PHE A 778 24.360 -0.401 -9.586 1.00 0.00 H new ATOM 0 HZ PHE A 778 23.255 -1.711 -7.789 1.00 0.00 H new ATOM 813 N GLY A 779 27.488 -5.689 -10.759 1.00 0.00 N ATOM 814 CA GLY A 779 27.742 -6.578 -9.589 1.00 0.00 C ATOM 815 C GLY A 779 29.247 -6.772 -9.395 1.00 0.00 C ATOM 816 O GLY A 779 29.952 -5.871 -8.987 1.00 0.00 O ATOM 0 H GLY A 779 28.319 -5.280 -11.185 1.00 0.00 H new ATOM 0 HA2 GLY A 779 27.304 -6.144 -8.690 1.00 0.00 H new ATOM 0 HA3 GLY A 779 27.260 -7.543 -9.744 1.00 0.00 H new ATOM 820 N THR A 780 29.745 -7.946 -9.682 1.00 0.00 N ATOM 821 CA THR A 780 31.207 -8.202 -9.514 1.00 0.00 C ATOM 822 C THR A 780 31.870 -8.433 -10.877 1.00 0.00 C ATOM 823 O THR A 780 31.800 -9.513 -11.426 1.00 0.00 O ATOM 824 CB THR A 780 31.282 -9.470 -8.661 1.00 0.00 C ATOM 825 OG1 THR A 780 30.461 -10.475 -9.242 1.00 0.00 O ATOM 826 CG2 THR A 780 30.793 -9.165 -7.244 1.00 0.00 C ATOM 0 H THR A 780 29.203 -8.739 -10.025 1.00 0.00 H new ATOM 0 HA THR A 780 31.724 -7.361 -9.052 1.00 0.00 H new ATOM 0 HB THR A 780 32.313 -9.820 -8.618 1.00 0.00 H new ATOM 0 HG1 THR A 780 30.644 -10.532 -10.203 1.00 0.00 H new ATOM 0 HG21 THR A 780 30.847 -10.069 -6.638 1.00 0.00 H new ATOM 0 HG22 THR A 780 31.422 -8.393 -6.801 1.00 0.00 H new ATOM 0 HG23 THR A 780 29.761 -8.815 -7.283 1.00 0.00 H new ATOM 834 N PRO A 781 32.493 -7.401 -11.377 1.00 0.00 N ATOM 835 CA PRO A 781 33.173 -7.488 -12.682 1.00 0.00 C ATOM 836 C PRO A 781 34.542 -8.167 -12.529 1.00 0.00 C ATOM 837 O PRO A 781 35.366 -7.750 -11.739 1.00 0.00 O ATOM 838 CB PRO A 781 33.340 -6.037 -13.101 1.00 0.00 C ATOM 839 CG PRO A 781 33.340 -5.249 -11.820 1.00 0.00 C ATOM 840 CD PRO A 781 32.605 -6.070 -10.779 1.00 0.00 C ATOM 0 HA PRO A 781 32.617 -8.077 -13.412 1.00 0.00 H new ATOM 0 HB2 PRO A 781 34.269 -5.892 -13.652 1.00 0.00 H new ATOM 0 HB3 PRO A 781 32.528 -5.721 -13.756 1.00 0.00 H new ATOM 0 HG2 PRO A 781 34.360 -5.044 -11.496 1.00 0.00 H new ATOM 0 HG3 PRO A 781 32.851 -4.285 -11.963 1.00 0.00 H new ATOM 0 HD2 PRO A 781 33.154 -6.102 -9.838 1.00 0.00 H new ATOM 0 HD3 PRO A 781 31.624 -5.649 -10.561 1.00 0.00 H new ATOM 848 N LEU A 782 34.787 -9.209 -13.278 1.00 0.00 N ATOM 849 CA LEU A 782 36.101 -9.912 -13.175 1.00 0.00 C ATOM 850 C LEU A 782 37.001 -9.507 -14.347 1.00 0.00 C ATOM 851 O LEU A 782 36.679 -9.734 -15.495 1.00 0.00 O ATOM 852 CB LEU A 782 35.765 -11.399 -13.245 1.00 0.00 C ATOM 853 CG LEU A 782 34.792 -11.759 -12.124 1.00 0.00 C ATOM 854 CD1 LEU A 782 34.283 -13.185 -12.326 1.00 0.00 C ATOM 855 CD2 LEU A 782 35.509 -11.662 -10.776 1.00 0.00 C ATOM 0 H LEU A 782 34.136 -9.604 -13.956 1.00 0.00 H new ATOM 0 HA LEU A 782 36.635 -9.662 -12.258 1.00 0.00 H new ATOM 0 HB2 LEU A 782 35.324 -11.637 -14.213 1.00 0.00 H new ATOM 0 HB3 LEU A 782 36.675 -11.992 -13.155 1.00 0.00 H new ATOM 0 HG LEU A 782 33.950 -11.067 -12.140 1.00 0.00 H new ATOM 0 HD11 LEU A 782 33.589 -13.440 -11.525 1.00 0.00 H new ATOM 0 HD12 LEU A 782 33.772 -13.256 -13.286 1.00 0.00 H new ATOM 0 HD13 LEU A 782 35.125 -13.877 -12.311 1.00 0.00 H new ATOM 0 HD21 LEU A 782 34.815 -11.919 -9.976 1.00 0.00 H new ATOM 0 HD22 LEU A 782 36.352 -12.353 -10.762 1.00 0.00 H new ATOM 0 HD23 LEU A 782 35.872 -10.645 -10.629 1.00 0.00 H new ATOM 867 N GLY A 783 38.127 -8.910 -14.066 1.00 0.00 N ATOM 868 CA GLY A 783 39.043 -8.493 -15.165 1.00 0.00 C ATOM 869 C GLY A 783 39.129 -6.967 -15.200 1.00 0.00 C ATOM 870 O GLY A 783 38.513 -6.284 -14.406 1.00 0.00 O ATOM 0 H GLY A 783 38.452 -8.693 -13.124 1.00 0.00 H new ATOM 0 HA2 GLY A 783 40.033 -8.921 -15.010 1.00 0.00 H new ATOM 0 HA3 GLY A 783 38.678 -8.870 -16.120 1.00 0.00 H new ATOM 874 N THR A 784 39.885 -6.424 -16.114 1.00 0.00 N ATOM 875 CA THR A 784 40.006 -4.939 -16.195 1.00 0.00 C ATOM 876 C THR A 784 39.361 -4.421 -17.485 1.00 0.00 C ATOM 877 O THR A 784 38.579 -5.104 -18.116 1.00 0.00 O ATOM 878 CB THR A 784 41.510 -4.665 -16.199 1.00 0.00 C ATOM 879 OG1 THR A 784 42.124 -5.413 -17.240 1.00 0.00 O ATOM 880 CG2 THR A 784 42.108 -5.074 -14.854 1.00 0.00 C ATOM 0 H THR A 784 40.424 -6.942 -16.808 1.00 0.00 H new ATOM 0 HA THR A 784 39.502 -4.439 -15.368 1.00 0.00 H new ATOM 0 HB THR A 784 41.685 -3.602 -16.364 1.00 0.00 H new ATOM 0 HG1 THR A 784 43.088 -5.237 -17.245 1.00 0.00 H new ATOM 0 HG21 THR A 784 43.180 -4.878 -14.858 1.00 0.00 H new ATOM 0 HG22 THR A 784 41.637 -4.499 -14.057 1.00 0.00 H new ATOM 0 HG23 THR A 784 41.934 -6.137 -14.687 1.00 0.00 H new ATOM 888 N CYS A 785 39.681 -3.218 -17.879 1.00 0.00 N ATOM 889 CA CYS A 785 39.086 -2.658 -19.127 1.00 0.00 C ATOM 890 C CYS A 785 39.683 -3.350 -20.356 1.00 0.00 C ATOM 891 O CYS A 785 40.862 -3.247 -20.627 1.00 0.00 O ATOM 892 CB CYS A 785 39.457 -1.175 -19.114 1.00 0.00 C ATOM 893 SG CYS A 785 37.974 -0.187 -18.799 1.00 0.00 S ATOM 0 H CYS A 785 40.328 -2.599 -17.391 1.00 0.00 H new ATOM 0 HA CYS A 785 38.007 -2.807 -19.172 1.00 0.00 H new ATOM 0 HB2 CYS A 785 40.205 -0.983 -18.345 1.00 0.00 H new ATOM 0 HB3 CYS A 785 39.900 -0.891 -20.069 1.00 0.00 H new ATOM 898 N GLY A 786 38.876 -4.056 -21.101 1.00 0.00 N ATOM 899 CA GLY A 786 39.397 -4.754 -22.311 1.00 0.00 C ATOM 900 C GLY A 786 39.069 -6.245 -22.221 1.00 0.00 C ATOM 901 O GLY A 786 38.880 -6.908 -23.222 1.00 0.00 O ATOM 0 H GLY A 786 37.879 -4.179 -20.924 1.00 0.00 H new ATOM 0 HA2 GLY A 786 38.953 -4.327 -23.210 1.00 0.00 H new ATOM 0 HA3 GLY A 786 40.475 -4.612 -22.390 1.00 0.00 H new ATOM 905 N THR A 787 39.001 -6.777 -21.032 1.00 0.00 N ATOM 906 CA THR A 787 38.684 -8.227 -20.882 1.00 0.00 C ATOM 907 C THR A 787 37.588 -8.420 -19.829 1.00 0.00 C ATOM 908 O THR A 787 37.502 -9.447 -19.189 1.00 0.00 O ATOM 909 CB THR A 787 39.992 -8.875 -20.426 1.00 0.00 C ATOM 910 OG1 THR A 787 40.694 -7.977 -19.578 1.00 0.00 O ATOM 911 CG2 THR A 787 40.852 -9.206 -21.647 1.00 0.00 C ATOM 0 H THR A 787 39.151 -6.272 -20.158 1.00 0.00 H new ATOM 0 HA THR A 787 38.315 -8.669 -21.808 1.00 0.00 H new ATOM 0 HB THR A 787 39.772 -9.792 -19.880 1.00 0.00 H new ATOM 0 HG1 THR A 787 41.532 -8.392 -19.284 1.00 0.00 H new ATOM 0 HG21 THR A 787 41.784 -9.668 -21.321 1.00 0.00 H new ATOM 0 HG22 THR A 787 40.313 -9.896 -22.296 1.00 0.00 H new ATOM 0 HG23 THR A 787 41.073 -8.290 -22.195 1.00 0.00 H new ATOM 919 N PHE A 788 36.751 -7.435 -19.649 1.00 0.00 N ATOM 920 CA PHE A 788 35.657 -7.555 -18.637 1.00 0.00 C ATOM 921 C PHE A 788 34.881 -8.860 -18.856 1.00 0.00 C ATOM 922 O PHE A 788 34.986 -9.487 -19.892 1.00 0.00 O ATOM 923 CB PHE A 788 34.755 -6.343 -18.884 1.00 0.00 C ATOM 924 CG PHE A 788 35.250 -5.163 -18.071 1.00 0.00 C ATOM 925 CD1 PHE A 788 35.365 -3.901 -18.668 1.00 0.00 C ATOM 926 CD2 PHE A 788 35.591 -5.333 -16.725 1.00 0.00 C ATOM 927 CE1 PHE A 788 35.821 -2.809 -17.920 1.00 0.00 C ATOM 928 CE2 PHE A 788 36.048 -4.240 -15.975 1.00 0.00 C ATOM 929 CZ PHE A 788 36.162 -2.977 -16.574 1.00 0.00 C ATOM 0 H PHE A 788 36.775 -6.551 -20.158 1.00 0.00 H new ATOM 0 HA PHE A 788 36.036 -7.577 -17.615 1.00 0.00 H new ATOM 0 HB2 PHE A 788 34.751 -6.090 -19.944 1.00 0.00 H new ATOM 0 HB3 PHE A 788 33.727 -6.581 -18.609 1.00 0.00 H new ATOM 0 HD1 PHE A 788 35.101 -3.770 -19.707 1.00 0.00 H new ATOM 0 HD2 PHE A 788 35.502 -6.306 -16.264 1.00 0.00 H new ATOM 0 HE1 PHE A 788 35.909 -1.837 -18.382 1.00 0.00 H new ATOM 0 HE2 PHE A 788 36.312 -4.371 -14.936 1.00 0.00 H new ATOM 0 HZ PHE A 788 36.513 -2.135 -15.996 1.00 0.00 H new ATOM 939 N GLN A 789 34.106 -9.276 -17.891 1.00 0.00 N ATOM 940 CA GLN A 789 33.327 -10.541 -18.052 1.00 0.00 C ATOM 941 C GLN A 789 32.412 -10.760 -16.844 1.00 0.00 C ATOM 942 O GLN A 789 32.845 -10.725 -15.710 1.00 0.00 O ATOM 943 CB GLN A 789 34.381 -11.647 -18.133 1.00 0.00 C ATOM 944 CG GLN A 789 35.292 -11.580 -16.906 1.00 0.00 C ATOM 945 CD GLN A 789 35.221 -12.903 -16.141 1.00 0.00 C ATOM 946 OE1 GLN A 789 36.237 -13.497 -15.833 1.00 0.00 O ATOM 947 NE2 GLN A 789 34.055 -13.396 -15.819 1.00 0.00 N ATOM 0 H GLN A 789 33.978 -8.797 -17.000 1.00 0.00 H new ATOM 0 HA GLN A 789 32.687 -10.521 -18.934 1.00 0.00 H new ATOM 0 HB2 GLN A 789 33.896 -12.622 -18.185 1.00 0.00 H new ATOM 0 HB3 GLN A 789 34.971 -11.535 -19.043 1.00 0.00 H new ATOM 0 HG2 GLN A 789 36.319 -11.381 -17.213 1.00 0.00 H new ATOM 0 HG3 GLN A 789 34.987 -10.757 -16.259 1.00 0.00 H new ATOM 0 HE21 GLN A 789 33.202 -12.899 -16.077 1.00 0.00 H new ATOM 0 HE22 GLN A 789 33.997 -14.278 -15.310 1.00 0.00 H new ATOM 956 N GLN A 790 31.147 -10.986 -17.080 1.00 0.00 N ATOM 957 CA GLN A 790 30.205 -11.207 -15.944 1.00 0.00 C ATOM 958 C GLN A 790 30.598 -12.468 -15.169 1.00 0.00 C ATOM 959 O GLN A 790 30.890 -13.497 -15.746 1.00 0.00 O ATOM 960 CB GLN A 790 28.832 -11.385 -16.595 1.00 0.00 C ATOM 961 CG GLN A 790 28.934 -12.397 -17.738 1.00 0.00 C ATOM 962 CD GLN A 790 27.671 -13.260 -17.768 1.00 0.00 C ATOM 963 OE1 GLN A 790 27.502 -14.140 -16.948 1.00 0.00 O ATOM 964 NE2 GLN A 790 26.771 -13.043 -18.687 1.00 0.00 N ATOM 0 H GLN A 790 30.726 -11.027 -18.008 1.00 0.00 H new ATOM 0 HA GLN A 790 30.215 -10.381 -15.233 1.00 0.00 H new ATOM 0 HB2 GLN A 790 28.109 -11.728 -15.855 1.00 0.00 H new ATOM 0 HB3 GLN A 790 28.471 -10.429 -16.973 1.00 0.00 H new ATOM 0 HG2 GLN A 790 29.055 -11.877 -18.688 1.00 0.00 H new ATOM 0 HG3 GLN A 790 29.814 -13.026 -17.604 1.00 0.00 H new ATOM 0 HE21 GLN A 790 26.913 -12.304 -19.376 1.00 0.00 H new ATOM 0 HE22 GLN A 790 25.925 -13.612 -18.717 1.00 0.00 H new ATOM 973 N GLY A 791 30.610 -12.394 -13.866 1.00 0.00 N ATOM 974 CA GLY A 791 30.983 -13.588 -13.056 1.00 0.00 C ATOM 975 C GLY A 791 29.715 -14.326 -12.636 1.00 0.00 C ATOM 976 O GLY A 791 29.080 -14.990 -13.432 1.00 0.00 O ATOM 0 H GLY A 791 30.378 -11.559 -13.328 1.00 0.00 H new ATOM 0 HA2 GLY A 791 31.627 -14.249 -13.636 1.00 0.00 H new ATOM 0 HA3 GLY A 791 31.549 -13.283 -12.176 1.00 0.00 H new ATOM 980 N GLU A 792 29.340 -14.220 -11.393 1.00 0.00 N ATOM 981 CA GLU A 792 28.107 -14.921 -10.927 1.00 0.00 C ATOM 982 C GLU A 792 27.093 -13.897 -10.414 1.00 0.00 C ATOM 983 O GLU A 792 25.901 -14.136 -10.407 1.00 0.00 O ATOM 984 CB GLU A 792 28.566 -15.836 -9.792 1.00 0.00 C ATOM 985 CG GLU A 792 27.457 -16.838 -9.466 1.00 0.00 C ATOM 986 CD GLU A 792 27.967 -17.849 -8.439 1.00 0.00 C ATOM 987 OE1 GLU A 792 27.494 -17.813 -7.316 1.00 0.00 O ATOM 988 OE2 GLU A 792 28.821 -18.645 -8.794 1.00 0.00 O ATOM 0 H GLU A 792 29.830 -13.681 -10.680 1.00 0.00 H new ATOM 0 HA GLU A 792 27.624 -15.484 -11.725 1.00 0.00 H new ATOM 0 HB2 GLU A 792 29.475 -16.364 -10.081 1.00 0.00 H new ATOM 0 HB3 GLU A 792 28.808 -15.245 -8.909 1.00 0.00 H new ATOM 0 HG2 GLU A 792 26.584 -16.315 -9.075 1.00 0.00 H new ATOM 0 HG3 GLU A 792 27.140 -17.353 -10.373 1.00 0.00 H new ATOM 995 N CYS A 793 27.560 -12.757 -9.986 1.00 0.00 N ATOM 996 CA CYS A 793 26.632 -11.714 -9.473 1.00 0.00 C ATOM 997 C CYS A 793 26.076 -10.884 -10.635 1.00 0.00 C ATOM 998 O CYS A 793 26.690 -9.936 -11.082 1.00 0.00 O ATOM 999 CB CYS A 793 27.487 -10.846 -8.558 1.00 0.00 C ATOM 1000 SG CYS A 793 26.412 -9.880 -7.478 1.00 0.00 S ATOM 0 H CYS A 793 28.548 -12.503 -9.970 1.00 0.00 H new ATOM 0 HA CYS A 793 25.776 -12.141 -8.950 1.00 0.00 H new ATOM 0 HB2 CYS A 793 28.153 -11.471 -7.963 1.00 0.00 H new ATOM 0 HB3 CYS A 793 28.117 -10.183 -9.151 1.00 0.00 H new ATOM 1005 N HIS A 794 24.920 -11.232 -11.126 1.00 0.00 N ATOM 1006 CA HIS A 794 24.328 -10.462 -12.258 1.00 0.00 C ATOM 1007 C HIS A 794 22.967 -9.885 -11.851 1.00 0.00 C ATOM 1008 O HIS A 794 22.188 -10.525 -11.174 1.00 0.00 O ATOM 1009 CB HIS A 794 24.167 -11.483 -13.382 1.00 0.00 C ATOM 1010 CG HIS A 794 23.845 -10.772 -14.667 1.00 0.00 C ATOM 1011 ND1 HIS A 794 24.472 -9.592 -15.038 1.00 0.00 N ATOM 1012 CD2 HIS A 794 22.965 -11.062 -15.678 1.00 0.00 C ATOM 1013 CE1 HIS A 794 23.960 -9.219 -16.227 1.00 0.00 C ATOM 1014 NE2 HIS A 794 23.038 -10.083 -16.661 1.00 0.00 N ATOM 0 H HIS A 794 24.359 -12.016 -10.793 1.00 0.00 H new ATOM 0 HA HIS A 794 24.950 -9.619 -12.559 1.00 0.00 H new ATOM 0 HB2 HIS A 794 25.083 -12.062 -13.495 1.00 0.00 H new ATOM 0 HB3 HIS A 794 23.373 -12.188 -13.136 1.00 0.00 H new ATOM 0 HD2 HIS A 794 22.313 -11.922 -15.706 1.00 0.00 H new ATOM 0 HE1 HIS A 794 24.258 -8.330 -16.764 1.00 0.00 H new ATOM 0 HE2 HIS A 794 22.503 -10.034 -17.528 1.00 0.00 H new ATOM 1022 N SER A 795 22.676 -8.678 -12.258 1.00 0.00 N ATOM 1023 CA SER A 795 21.365 -8.064 -11.892 1.00 0.00 C ATOM 1024 C SER A 795 20.262 -8.565 -12.829 1.00 0.00 C ATOM 1025 O SER A 795 19.157 -8.065 -12.820 1.00 0.00 O ATOM 1026 CB SER A 795 21.569 -6.563 -12.059 1.00 0.00 C ATOM 1027 OG SER A 795 20.318 -5.900 -11.922 1.00 0.00 O ATOM 0 H SER A 795 23.287 -8.092 -12.826 1.00 0.00 H new ATOM 0 HA SER A 795 21.059 -8.323 -10.878 1.00 0.00 H new ATOM 0 HB2 SER A 795 22.272 -6.195 -11.312 1.00 0.00 H new ATOM 0 HB3 SER A 795 22.001 -6.350 -13.037 1.00 0.00 H new ATOM 0 HG SER A 795 19.598 -6.564 -11.892 1.00 0.00 H new ATOM 1033 N ILE A 796 20.562 -9.543 -13.639 1.00 0.00 N ATOM 1034 CA ILE A 796 19.535 -10.081 -14.580 1.00 0.00 C ATOM 1035 C ILE A 796 19.154 -9.027 -15.627 1.00 0.00 C ATOM 1036 O ILE A 796 18.242 -9.220 -16.406 1.00 0.00 O ATOM 1037 CB ILE A 796 18.330 -10.429 -13.701 1.00 0.00 C ATOM 1038 CG1 ILE A 796 18.808 -11.151 -12.436 1.00 0.00 C ATOM 1039 CG2 ILE A 796 17.376 -11.340 -14.475 1.00 0.00 C ATOM 1040 CD1 ILE A 796 18.423 -10.332 -11.204 1.00 0.00 C ATOM 0 H ILE A 796 21.475 -9.994 -13.691 1.00 0.00 H new ATOM 0 HA ILE A 796 19.902 -10.947 -15.131 1.00 0.00 H new ATOM 0 HB ILE A 796 17.811 -9.512 -13.423 1.00 0.00 H new ATOM 0 HG12 ILE A 796 18.361 -12.143 -12.380 1.00 0.00 H new ATOM 0 HG13 ILE A 796 19.889 -11.290 -12.470 1.00 0.00 H new ATOM 0 HG21 ILE A 796 16.519 -11.587 -13.848 1.00 0.00 H new ATOM 0 HG22 ILE A 796 17.032 -10.828 -15.374 1.00 0.00 H new ATOM 0 HG23 ILE A 796 17.895 -12.256 -14.756 1.00 0.00 H new ATOM 0 HD11 ILE A 796 18.763 -10.846 -10.305 1.00 0.00 H new ATOM 0 HD12 ILE A 796 18.891 -9.349 -11.260 1.00 0.00 H new ATOM 0 HD13 ILE A 796 17.340 -10.216 -11.168 1.00 0.00 H new ATOM 1052 N ASN A 797 19.841 -7.913 -15.654 1.00 0.00 N ATOM 1053 CA ASN A 797 19.501 -6.859 -16.660 1.00 0.00 C ATOM 1054 C ASN A 797 20.671 -5.881 -16.842 1.00 0.00 C ATOM 1055 O ASN A 797 20.475 -4.689 -16.983 1.00 0.00 O ATOM 1056 CB ASN A 797 18.283 -6.140 -16.080 1.00 0.00 C ATOM 1057 CG ASN A 797 17.594 -5.330 -17.180 1.00 0.00 C ATOM 1058 OD1 ASN A 797 18.111 -5.205 -18.274 1.00 0.00 O ATOM 1059 ND2 ASN A 797 16.439 -4.771 -16.937 1.00 0.00 N ATOM 0 H ASN A 797 20.616 -7.688 -15.030 1.00 0.00 H new ATOM 0 HA ASN A 797 19.298 -7.283 -17.643 1.00 0.00 H new ATOM 0 HB2 ASN A 797 17.587 -6.865 -15.658 1.00 0.00 H new ATOM 0 HB3 ASN A 797 18.590 -5.482 -15.267 1.00 0.00 H new ATOM 0 HD21 ASN A 797 15.971 -4.230 -17.664 1.00 0.00 H new ATOM 0 HD22 ASN A 797 16.005 -4.875 -16.020 1.00 0.00 H new ATOM 1066 N SER A 798 21.883 -6.372 -16.844 1.00 0.00 N ATOM 1067 CA SER A 798 23.059 -5.463 -17.017 1.00 0.00 C ATOM 1068 C SER A 798 23.514 -5.451 -18.482 1.00 0.00 C ATOM 1069 O SER A 798 24.475 -4.805 -18.832 1.00 0.00 O ATOM 1070 CB SER A 798 24.147 -6.047 -16.127 1.00 0.00 C ATOM 1071 OG SER A 798 23.554 -6.916 -15.170 1.00 0.00 O ATOM 0 H SER A 798 22.111 -7.360 -16.734 1.00 0.00 H new ATOM 0 HA SER A 798 22.823 -4.433 -16.750 1.00 0.00 H new ATOM 0 HB2 SER A 798 24.873 -6.592 -16.730 1.00 0.00 H new ATOM 0 HB3 SER A 798 24.689 -5.247 -15.623 1.00 0.00 H new ATOM 0 HG SER A 798 23.684 -6.549 -14.270 1.00 0.00 H new ATOM 1077 N ASN A 799 22.825 -6.155 -19.341 1.00 0.00 N ATOM 1078 CA ASN A 799 23.229 -6.177 -20.783 1.00 0.00 C ATOM 1079 C ASN A 799 22.124 -5.577 -21.666 1.00 0.00 C ATOM 1080 O ASN A 799 22.375 -5.122 -22.764 1.00 0.00 O ATOM 1081 CB ASN A 799 23.428 -7.657 -21.118 1.00 0.00 C ATOM 1082 CG ASN A 799 24.575 -8.228 -20.281 1.00 0.00 C ATOM 1083 OD1 ASN A 799 24.486 -8.295 -19.072 1.00 0.00 O ATOM 1084 ND2 ASN A 799 25.658 -8.647 -20.881 1.00 0.00 N ATOM 0 H ASN A 799 22.004 -6.714 -19.111 1.00 0.00 H new ATOM 0 HA ASN A 799 24.129 -5.588 -20.960 1.00 0.00 H new ATOM 0 HB2 ASN A 799 22.510 -8.211 -20.920 1.00 0.00 H new ATOM 0 HB3 ASN A 799 23.647 -7.773 -22.179 1.00 0.00 H new ATOM 0 HD21 ASN A 799 26.429 -9.030 -20.334 1.00 0.00 H new ATOM 0 HD22 ASN A 799 25.733 -8.591 -21.897 1.00 0.00 H new ATOM 1091 N SER A 800 20.906 -5.571 -21.195 1.00 0.00 N ATOM 1092 CA SER A 800 19.792 -5.000 -22.014 1.00 0.00 C ATOM 1093 C SER A 800 19.626 -3.504 -21.727 1.00 0.00 C ATOM 1094 O SER A 800 19.243 -2.736 -22.588 1.00 0.00 O ATOM 1095 CB SER A 800 18.548 -5.766 -21.571 1.00 0.00 C ATOM 1096 OG SER A 800 18.059 -6.540 -22.661 1.00 0.00 O ATOM 0 H SER A 800 20.632 -5.935 -20.282 1.00 0.00 H new ATOM 0 HA SER A 800 19.978 -5.097 -23.084 1.00 0.00 H new ATOM 0 HB2 SER A 800 18.787 -6.414 -20.728 1.00 0.00 H new ATOM 0 HB3 SER A 800 17.781 -5.071 -21.231 1.00 0.00 H new ATOM 0 HG SER A 800 17.261 -7.034 -22.379 1.00 0.00 H new ATOM 1102 N VAL A 801 19.915 -3.084 -20.528 1.00 0.00 N ATOM 1103 CA VAL A 801 19.774 -1.637 -20.188 1.00 0.00 C ATOM 1104 C VAL A 801 20.708 -0.782 -21.053 1.00 0.00 C ATOM 1105 O VAL A 801 20.435 0.370 -21.322 1.00 0.00 O ATOM 1106 CB VAL A 801 20.174 -1.536 -18.719 1.00 0.00 C ATOM 1107 CG1 VAL A 801 20.104 -0.075 -18.274 1.00 0.00 C ATOM 1108 CG2 VAL A 801 19.217 -2.373 -17.868 1.00 0.00 C ATOM 0 H VAL A 801 20.243 -3.678 -19.767 1.00 0.00 H new ATOM 0 HA VAL A 801 18.762 -1.275 -20.367 1.00 0.00 H new ATOM 0 HB VAL A 801 21.191 -1.909 -18.593 1.00 0.00 H new ATOM 0 HG11 VAL A 801 20.389 -0.000 -17.225 1.00 0.00 H new ATOM 0 HG12 VAL A 801 20.786 0.523 -18.879 1.00 0.00 H new ATOM 0 HG13 VAL A 801 19.087 0.296 -18.401 1.00 0.00 H new ATOM 0 HG21 VAL A 801 19.504 -2.300 -16.819 1.00 0.00 H new ATOM 0 HG22 VAL A 801 18.200 -2.002 -17.993 1.00 0.00 H new ATOM 0 HG23 VAL A 801 19.264 -3.415 -18.185 1.00 0.00 H new ATOM 1118 N LEU A 802 21.806 -1.335 -21.489 1.00 0.00 N ATOM 1119 CA LEU A 802 22.753 -0.546 -22.335 1.00 0.00 C ATOM 1120 C LEU A 802 22.268 -0.496 -23.788 1.00 0.00 C ATOM 1121 O LEU A 802 22.087 0.563 -24.355 1.00 0.00 O ATOM 1122 CB LEU A 802 24.082 -1.292 -22.241 1.00 0.00 C ATOM 1123 CG LEU A 802 24.854 -0.806 -21.015 1.00 0.00 C ATOM 1124 CD1 LEU A 802 25.241 0.660 -21.204 1.00 0.00 C ATOM 1125 CD2 LEU A 802 23.971 -0.943 -19.771 1.00 0.00 C ATOM 0 H LEU A 802 22.090 -2.296 -21.298 1.00 0.00 H new ATOM 0 HA LEU A 802 22.837 0.487 -21.998 1.00 0.00 H new ATOM 0 HB2 LEU A 802 23.905 -2.365 -22.170 1.00 0.00 H new ATOM 0 HB3 LEU A 802 24.670 -1.125 -23.144 1.00 0.00 H new ATOM 0 HG LEU A 802 25.755 -1.406 -20.891 1.00 0.00 H new ATOM 0 HD11 LEU A 802 25.792 1.007 -20.329 1.00 0.00 H new ATOM 0 HD12 LEU A 802 25.868 0.760 -22.090 1.00 0.00 H new ATOM 0 HD13 LEU A 802 24.340 1.261 -21.327 1.00 0.00 H new ATOM 0 HD21 LEU A 802 24.520 -0.597 -18.895 1.00 0.00 H new ATOM 0 HD22 LEU A 802 23.071 -0.342 -19.896 1.00 0.00 H new ATOM 0 HD23 LEU A 802 23.693 -1.988 -19.635 1.00 0.00 H new ATOM 1137 N GLU A 803 22.067 -1.630 -24.395 1.00 0.00 N ATOM 1138 CA GLU A 803 21.595 -1.646 -25.812 1.00 0.00 C ATOM 1139 C GLU A 803 20.296 -0.841 -25.969 1.00 0.00 C ATOM 1140 O GLU A 803 19.959 -0.400 -27.050 1.00 0.00 O ATOM 1141 CB GLU A 803 21.343 -3.122 -26.124 1.00 0.00 C ATOM 1142 CG GLU A 803 22.673 -3.874 -26.151 1.00 0.00 C ATOM 1143 CD GLU A 803 23.077 -4.146 -27.600 1.00 0.00 C ATOM 1144 OE1 GLU A 803 24.199 -3.821 -27.952 1.00 0.00 O ATOM 1145 OE2 GLU A 803 22.258 -4.674 -28.335 1.00 0.00 O ATOM 0 H GLU A 803 22.208 -2.548 -23.974 1.00 0.00 H new ATOM 0 HA GLU A 803 22.323 -1.195 -26.486 1.00 0.00 H new ATOM 0 HB2 GLU A 803 20.684 -3.556 -25.372 1.00 0.00 H new ATOM 0 HB3 GLU A 803 20.839 -3.220 -27.085 1.00 0.00 H new ATOM 0 HG2 GLU A 803 23.444 -3.288 -25.651 1.00 0.00 H new ATOM 0 HG3 GLU A 803 22.583 -4.813 -25.605 1.00 0.00 H new ATOM 1152 N ARG A 804 19.566 -0.645 -24.906 1.00 0.00 N ATOM 1153 CA ARG A 804 18.291 0.130 -25.013 1.00 0.00 C ATOM 1154 C ARG A 804 18.506 1.625 -24.714 1.00 0.00 C ATOM 1155 O ARG A 804 17.693 2.453 -25.074 1.00 0.00 O ATOM 1156 CB ARG A 804 17.366 -0.491 -23.966 1.00 0.00 C ATOM 1157 CG ARG A 804 16.489 -1.558 -24.627 1.00 0.00 C ATOM 1158 CD ARG A 804 15.571 -0.899 -25.659 1.00 0.00 C ATOM 1159 NE ARG A 804 15.502 -1.868 -26.788 1.00 0.00 N ATOM 1160 CZ ARG A 804 14.382 -2.036 -27.439 1.00 0.00 C ATOM 1161 NH1 ARG A 804 13.739 -1.003 -27.910 1.00 0.00 N ATOM 1162 NH2 ARG A 804 13.906 -3.239 -27.617 1.00 0.00 N ATOM 0 H ARG A 804 19.793 -0.985 -23.971 1.00 0.00 H new ATOM 0 HA ARG A 804 17.880 0.080 -26.022 1.00 0.00 H new ATOM 0 HB2 ARG A 804 17.955 -0.935 -23.163 1.00 0.00 H new ATOM 0 HB3 ARG A 804 16.741 0.280 -23.514 1.00 0.00 H new ATOM 0 HG2 ARG A 804 17.114 -2.310 -25.109 1.00 0.00 H new ATOM 0 HG3 ARG A 804 15.894 -2.073 -23.873 1.00 0.00 H new ATOM 0 HD2 ARG A 804 14.582 -0.707 -25.242 1.00 0.00 H new ATOM 0 HD3 ARG A 804 15.970 0.061 -25.987 1.00 0.00 H new ATOM 0 HE ARG A 804 16.330 -2.401 -27.053 1.00 0.00 H new ATOM 0 HH11 ARG A 804 14.111 -0.064 -27.770 1.00 0.00 H new ATOM 0 HH12 ARG A 804 12.865 -1.135 -28.418 1.00 0.00 H new ATOM 0 HH21 ARG A 804 14.409 -4.046 -27.248 1.00 0.00 H new ATOM 0 HH22 ARG A 804 13.032 -3.371 -28.125 1.00 0.00 H new ATOM 1176 N LYS A 805 19.582 1.986 -24.064 1.00 0.00 N ATOM 1177 CA LYS A 805 19.803 3.439 -23.765 1.00 0.00 C ATOM 1178 C LYS A 805 21.199 3.910 -24.208 1.00 0.00 C ATOM 1179 O LYS A 805 21.714 4.886 -23.700 1.00 0.00 O ATOM 1180 CB LYS A 805 19.662 3.548 -22.248 1.00 0.00 C ATOM 1181 CG LYS A 805 18.633 4.627 -21.908 1.00 0.00 C ATOM 1182 CD LYS A 805 19.296 5.726 -21.077 1.00 0.00 C ATOM 1183 CE LYS A 805 18.394 6.085 -19.892 1.00 0.00 C ATOM 1184 NZ LYS A 805 18.115 7.538 -20.049 1.00 0.00 N ATOM 0 H LYS A 805 20.308 1.352 -23.731 1.00 0.00 H new ATOM 0 HA LYS A 805 19.093 4.068 -24.303 1.00 0.00 H new ATOM 0 HB2 LYS A 805 19.351 2.590 -21.831 1.00 0.00 H new ATOM 0 HB3 LYS A 805 20.624 3.794 -21.799 1.00 0.00 H new ATOM 0 HG2 LYS A 805 18.219 5.050 -22.823 1.00 0.00 H new ATOM 0 HG3 LYS A 805 17.802 4.190 -21.354 1.00 0.00 H new ATOM 0 HD2 LYS A 805 20.269 5.389 -20.718 1.00 0.00 H new ATOM 0 HD3 LYS A 805 19.472 6.607 -21.694 1.00 0.00 H new ATOM 0 HE2 LYS A 805 17.473 5.502 -19.906 1.00 0.00 H new ATOM 0 HE3 LYS A 805 18.888 5.878 -18.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 805 17.502 7.860 -19.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 805 19.010 8.068 -20.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 805 17.639 7.704 -20.958 1.00 0.00 H new ATOM 1198 N CYS A 806 21.816 3.240 -25.142 1.00 0.00 N ATOM 1199 CA CYS A 806 23.176 3.684 -25.589 1.00 0.00 C ATOM 1200 C CYS A 806 23.517 3.094 -26.963 1.00 0.00 C ATOM 1201 O CYS A 806 24.662 2.818 -27.261 1.00 0.00 O ATOM 1202 CB CYS A 806 24.141 3.160 -24.524 1.00 0.00 C ATOM 1203 SG CYS A 806 24.378 4.422 -23.248 1.00 0.00 S ATOM 0 H CYS A 806 21.447 2.414 -25.613 1.00 0.00 H new ATOM 0 HA CYS A 806 23.233 4.767 -25.693 1.00 0.00 H new ATOM 0 HB2 CYS A 806 23.746 2.247 -24.078 1.00 0.00 H new ATOM 0 HB3 CYS A 806 25.098 2.904 -24.979 1.00 0.00 H new ATOM 1208 N ILE A 807 22.537 2.899 -27.800 1.00 0.00 N ATOM 1209 CA ILE A 807 22.816 2.328 -29.150 1.00 0.00 C ATOM 1210 C ILE A 807 22.264 3.251 -30.241 1.00 0.00 C ATOM 1211 O ILE A 807 21.068 3.352 -30.435 1.00 0.00 O ATOM 1212 CB ILE A 807 22.098 0.984 -29.169 1.00 0.00 C ATOM 1213 CG1 ILE A 807 22.892 -0.026 -28.341 1.00 0.00 C ATOM 1214 CG2 ILE A 807 21.981 0.483 -30.610 1.00 0.00 C ATOM 1215 CD1 ILE A 807 24.276 -0.220 -28.960 1.00 0.00 C ATOM 0 H ILE A 807 21.557 3.109 -27.610 1.00 0.00 H new ATOM 0 HA ILE A 807 23.884 2.220 -29.339 1.00 0.00 H new ATOM 0 HB ILE A 807 21.100 1.100 -28.746 1.00 0.00 H new ATOM 0 HG12 ILE A 807 22.988 0.326 -27.314 1.00 0.00 H new ATOM 0 HG13 ILE A 807 22.362 -0.978 -28.304 1.00 0.00 H new ATOM 0 HG21 ILE A 807 21.467 -0.478 -30.620 1.00 0.00 H new ATOM 0 HG22 ILE A 807 21.415 1.203 -31.201 1.00 0.00 H new ATOM 0 HG23 ILE A 807 22.977 0.367 -31.037 1.00 0.00 H new ATOM 0 HD11 ILE A 807 24.841 -0.940 -28.369 1.00 0.00 H new ATOM 0 HD12 ILE A 807 24.170 -0.591 -29.979 1.00 0.00 H new ATOM 0 HD13 ILE A 807 24.805 0.733 -28.974 1.00 0.00 H new ATOM 1227 N GLY A 808 23.124 3.927 -30.954 1.00 0.00 N ATOM 1228 CA GLY A 808 22.646 4.841 -32.030 1.00 0.00 C ATOM 1229 C GLY A 808 22.990 6.285 -31.664 1.00 0.00 C ATOM 1230 O GLY A 808 22.549 7.218 -32.306 1.00 0.00 O ATOM 0 H GLY A 808 24.137 3.886 -30.838 1.00 0.00 H new ATOM 0 HA2 GLY A 808 23.110 4.575 -32.980 1.00 0.00 H new ATOM 0 HA3 GLY A 808 21.569 4.735 -32.160 1.00 0.00 H new ATOM 1234 N LEU A 809 23.774 6.477 -30.642 1.00 0.00 N ATOM 1235 CA LEU A 809 24.145 7.863 -30.239 1.00 0.00 C ATOM 1236 C LEU A 809 25.657 7.964 -30.031 1.00 0.00 C ATOM 1237 O LEU A 809 26.264 7.119 -29.405 1.00 0.00 O ATOM 1238 CB LEU A 809 23.408 8.105 -28.919 1.00 0.00 C ATOM 1239 CG LEU A 809 21.903 7.964 -29.139 1.00 0.00 C ATOM 1240 CD1 LEU A 809 21.259 7.357 -27.892 1.00 0.00 C ATOM 1241 CD2 LEU A 809 21.298 9.344 -29.398 1.00 0.00 C ATOM 0 H LEU A 809 24.175 5.735 -30.068 1.00 0.00 H new ATOM 0 HA LEU A 809 23.876 8.598 -30.997 1.00 0.00 H new ATOM 0 HB2 LEU A 809 23.744 7.391 -28.167 1.00 0.00 H new ATOM 0 HB3 LEU A 809 23.639 9.100 -28.539 1.00 0.00 H new ATOM 0 HG LEU A 809 21.720 7.316 -29.996 1.00 0.00 H new ATOM 0 HD11 LEU A 809 20.185 7.257 -28.049 1.00 0.00 H new ATOM 0 HD12 LEU A 809 21.691 6.375 -27.701 1.00 0.00 H new ATOM 0 HD13 LEU A 809 21.441 8.006 -27.036 1.00 0.00 H new ATOM 0 HD21 LEU A 809 20.224 9.247 -29.555 1.00 0.00 H new ATOM 0 HD22 LEU A 809 21.482 9.989 -28.539 1.00 0.00 H new ATOM 0 HD23 LEU A 809 21.756 9.782 -30.285 1.00 0.00 H new ATOM 1253 N GLU A 810 26.271 8.991 -30.549 1.00 0.00 N ATOM 1254 CA GLU A 810 27.743 9.138 -30.376 1.00 0.00 C ATOM 1255 C GLU A 810 28.058 9.353 -28.898 1.00 0.00 C ATOM 1256 O GLU A 810 29.194 9.291 -28.475 1.00 0.00 O ATOM 1257 CB GLU A 810 28.122 10.371 -31.195 1.00 0.00 C ATOM 1258 CG GLU A 810 27.621 11.631 -30.488 1.00 0.00 C ATOM 1259 CD GLU A 810 28.016 12.865 -31.301 1.00 0.00 C ATOM 1260 OE1 GLU A 810 27.138 13.458 -31.904 1.00 0.00 O ATOM 1261 OE2 GLU A 810 29.191 13.196 -31.307 1.00 0.00 O ATOM 0 H GLU A 810 25.819 9.733 -31.083 1.00 0.00 H new ATOM 0 HA GLU A 810 28.296 8.258 -30.704 1.00 0.00 H new ATOM 0 HB2 GLU A 810 29.204 10.418 -31.320 1.00 0.00 H new ATOM 0 HB3 GLU A 810 27.688 10.305 -32.193 1.00 0.00 H new ATOM 0 HG2 GLU A 810 26.538 11.590 -30.373 1.00 0.00 H new ATOM 0 HG3 GLU A 810 28.046 11.692 -29.486 1.00 0.00 H new ATOM 1268 N ARG A 811 27.051 9.608 -28.111 1.00 0.00 N ATOM 1269 CA ARG A 811 27.271 9.829 -26.655 1.00 0.00 C ATOM 1270 C ARG A 811 25.972 9.571 -25.894 1.00 0.00 C ATOM 1271 O ARG A 811 24.927 10.088 -26.233 1.00 0.00 O ATOM 1272 CB ARG A 811 27.684 11.290 -26.531 1.00 0.00 C ATOM 1273 CG ARG A 811 27.548 11.744 -25.075 1.00 0.00 C ATOM 1274 CD ARG A 811 28.399 12.997 -24.850 1.00 0.00 C ATOM 1275 NE ARG A 811 27.472 13.987 -24.236 1.00 0.00 N ATOM 1276 CZ ARG A 811 27.914 15.162 -23.874 1.00 0.00 C ATOM 1277 NH1 ARG A 811 29.150 15.505 -24.126 1.00 0.00 N ATOM 1278 NH2 ARG A 811 27.119 15.996 -23.259 1.00 0.00 N ATOM 0 H ARG A 811 26.080 9.673 -28.415 1.00 0.00 H new ATOM 0 HA ARG A 811 28.027 9.162 -26.241 1.00 0.00 H new ATOM 0 HB2 ARG A 811 28.713 11.417 -26.867 1.00 0.00 H new ATOM 0 HB3 ARG A 811 27.060 11.910 -27.175 1.00 0.00 H new ATOM 0 HG2 ARG A 811 26.504 11.954 -24.844 1.00 0.00 H new ATOM 0 HG3 ARG A 811 27.869 10.948 -24.403 1.00 0.00 H new ATOM 0 HD2 ARG A 811 29.244 12.788 -24.194 1.00 0.00 H new ATOM 0 HD3 ARG A 811 28.809 13.370 -25.789 1.00 0.00 H new ATOM 0 HE ARG A 811 26.490 13.748 -24.098 1.00 0.00 H new ATOM 0 HH11 ARG A 811 29.772 14.855 -24.606 1.00 0.00 H new ATOM 0 HH12 ARG A 811 29.492 16.423 -23.842 1.00 0.00 H new ATOM 0 HH21 ARG A 811 26.154 15.730 -23.062 1.00 0.00 H new ATOM 0 HH22 ARG A 811 27.463 16.914 -22.976 1.00 0.00 H new ATOM 1292 N CYS A 812 26.033 8.779 -24.872 1.00 0.00 N ATOM 1293 CA CYS A 812 24.798 8.483 -24.083 1.00 0.00 C ATOM 1294 C CYS A 812 25.126 8.402 -22.592 1.00 0.00 C ATOM 1295 O CYS A 812 26.232 8.075 -22.207 1.00 0.00 O ATOM 1296 CB CYS A 812 24.308 7.128 -24.599 1.00 0.00 C ATOM 1297 SG CYS A 812 25.498 5.842 -24.150 1.00 0.00 S ATOM 0 H CYS A 812 26.881 8.319 -24.541 1.00 0.00 H new ATOM 0 HA CYS A 812 24.042 9.260 -24.199 1.00 0.00 H new ATOM 0 HB2 CYS A 812 23.331 6.898 -24.175 1.00 0.00 H new ATOM 0 HB3 CYS A 812 24.185 7.162 -25.682 1.00 0.00 H new ATOM 1302 N VAL A 813 24.175 8.696 -21.750 1.00 0.00 N ATOM 1303 CA VAL A 813 24.433 8.635 -20.284 1.00 0.00 C ATOM 1304 C VAL A 813 23.437 7.686 -19.611 1.00 0.00 C ATOM 1305 O VAL A 813 22.365 7.432 -20.123 1.00 0.00 O ATOM 1306 CB VAL A 813 24.236 10.063 -19.785 1.00 0.00 C ATOM 1307 CG1 VAL A 813 24.447 10.106 -18.271 1.00 0.00 C ATOM 1308 CG2 VAL A 813 25.250 10.983 -20.467 1.00 0.00 C ATOM 0 H VAL A 813 23.230 8.976 -22.013 1.00 0.00 H new ATOM 0 HA VAL A 813 25.431 8.261 -20.056 1.00 0.00 H new ATOM 0 HB VAL A 813 23.225 10.396 -20.021 1.00 0.00 H new ATOM 0 HG11 VAL A 813 24.307 11.126 -17.913 1.00 0.00 H new ATOM 0 HG12 VAL A 813 23.727 9.448 -17.784 1.00 0.00 H new ATOM 0 HG13 VAL A 813 25.458 9.775 -18.035 1.00 0.00 H new ATOM 0 HG21 VAL A 813 25.111 12.004 -20.112 1.00 0.00 H new ATOM 0 HG22 VAL A 813 26.260 10.650 -20.229 1.00 0.00 H new ATOM 0 HG23 VAL A 813 25.102 10.951 -21.546 1.00 0.00 H new ATOM 1318 N VAL A 814 23.781 7.164 -18.467 1.00 0.00 N ATOM 1319 CA VAL A 814 22.855 6.234 -17.764 1.00 0.00 C ATOM 1320 C VAL A 814 22.957 6.429 -16.250 1.00 0.00 C ATOM 1321 O VAL A 814 24.023 6.652 -15.715 1.00 0.00 O ATOM 1322 CB VAL A 814 23.332 4.838 -18.155 1.00 0.00 C ATOM 1323 CG1 VAL A 814 22.355 3.794 -17.610 1.00 0.00 C ATOM 1324 CG2 VAL A 814 23.395 4.730 -19.680 1.00 0.00 C ATOM 0 H VAL A 814 24.664 7.341 -17.988 1.00 0.00 H new ATOM 0 HA VAL A 814 21.813 6.403 -18.036 1.00 0.00 H new ATOM 0 HB VAL A 814 24.323 4.662 -17.736 1.00 0.00 H new ATOM 0 HG11 VAL A 814 22.695 2.797 -17.889 1.00 0.00 H new ATOM 0 HG12 VAL A 814 22.309 3.871 -16.524 1.00 0.00 H new ATOM 0 HG13 VAL A 814 21.364 3.970 -18.029 1.00 0.00 H new ATOM 0 HG21 VAL A 814 23.736 3.733 -19.960 1.00 0.00 H new ATOM 0 HG22 VAL A 814 22.404 4.906 -20.098 1.00 0.00 H new ATOM 0 HG23 VAL A 814 24.090 5.474 -20.069 1.00 0.00 H new ATOM 1334 N ALA A 815 21.856 6.348 -15.558 1.00 0.00 N ATOM 1335 CA ALA A 815 21.892 6.528 -14.079 1.00 0.00 C ATOM 1336 C ALA A 815 21.806 5.167 -13.385 1.00 0.00 C ATOM 1337 O ALA A 815 20.932 4.370 -13.666 1.00 0.00 O ATOM 1338 CB ALA A 815 20.665 7.375 -13.751 1.00 0.00 C ATOM 0 H ALA A 815 20.933 6.165 -15.951 1.00 0.00 H new ATOM 0 HA ALA A 815 22.813 7.003 -13.741 1.00 0.00 H new ATOM 0 HB1 ALA A 815 20.621 7.551 -12.676 1.00 0.00 H new ATOM 0 HB2 ALA A 815 20.732 8.330 -14.273 1.00 0.00 H new ATOM 0 HB3 ALA A 815 19.765 6.850 -14.069 1.00 0.00 H new ATOM 1344 N ILE A 816 22.704 4.892 -12.482 1.00 0.00 N ATOM 1345 CA ILE A 816 22.668 3.581 -11.775 1.00 0.00 C ATOM 1346 C ILE A 816 21.683 3.637 -10.605 1.00 0.00 C ATOM 1347 O ILE A 816 21.686 4.566 -9.820 1.00 0.00 O ATOM 1348 CB ILE A 816 24.090 3.364 -11.268 1.00 0.00 C ATOM 1349 CG1 ILE A 816 25.049 3.278 -12.458 1.00 0.00 C ATOM 1350 CG2 ILE A 816 24.153 2.059 -10.472 1.00 0.00 C ATOM 1351 CD1 ILE A 816 26.480 3.524 -11.978 1.00 0.00 C ATOM 0 H ILE A 816 23.460 5.517 -12.203 1.00 0.00 H new ATOM 0 HA ILE A 816 22.341 2.771 -12.426 1.00 0.00 H new ATOM 0 HB ILE A 816 24.378 4.198 -10.627 1.00 0.00 H new ATOM 0 HG12 ILE A 816 24.975 2.297 -12.928 1.00 0.00 H new ATOM 0 HG13 ILE A 816 24.776 4.015 -13.213 1.00 0.00 H new ATOM 0 HG21 ILE A 816 25.169 1.903 -10.109 1.00 0.00 H new ATOM 0 HG22 ILE A 816 23.470 2.116 -9.625 1.00 0.00 H new ATOM 0 HG23 ILE A 816 23.865 1.227 -11.114 1.00 0.00 H new ATOM 0 HD11 ILE A 816 27.163 3.463 -12.825 1.00 0.00 H new ATOM 0 HD12 ILE A 816 26.548 4.514 -11.528 1.00 0.00 H new ATOM 0 HD13 ILE A 816 26.750 2.770 -11.239 1.00 0.00 H new ATOM 1363 N SER A 817 20.839 2.651 -10.483 1.00 0.00 N ATOM 1364 CA SER A 817 19.853 2.644 -9.363 1.00 0.00 C ATOM 1365 C SER A 817 19.276 1.237 -9.180 1.00 0.00 C ATOM 1366 O SER A 817 19.412 0.392 -10.042 1.00 0.00 O ATOM 1367 CB SER A 817 18.762 3.621 -9.791 1.00 0.00 C ATOM 1368 OG SER A 817 17.879 2.972 -10.698 1.00 0.00 O ATOM 0 H SER A 817 20.788 1.848 -11.110 1.00 0.00 H new ATOM 0 HA SER A 817 20.303 2.929 -8.412 1.00 0.00 H new ATOM 0 HB2 SER A 817 18.211 3.974 -8.919 1.00 0.00 H new ATOM 0 HB3 SER A 817 19.207 4.497 -10.263 1.00 0.00 H new ATOM 0 HG SER A 817 17.176 3.597 -10.974 1.00 0.00 H new ATOM 1374 N PRO A 818 18.645 1.036 -8.053 1.00 0.00 N ATOM 1375 CA PRO A 818 18.038 -0.276 -7.744 1.00 0.00 C ATOM 1376 C PRO A 818 16.671 -0.431 -8.434 1.00 0.00 C ATOM 1377 O PRO A 818 15.870 -1.265 -8.058 1.00 0.00 O ATOM 1378 CB PRO A 818 17.876 -0.251 -6.233 1.00 0.00 C ATOM 1379 CG PRO A 818 17.797 1.206 -5.861 1.00 0.00 C ATOM 1380 CD PRO A 818 18.461 2.001 -6.969 1.00 0.00 C ATOM 0 HA PRO A 818 18.645 -1.111 -8.094 1.00 0.00 H new ATOM 0 HB2 PRO A 818 16.976 -0.784 -5.926 1.00 0.00 H new ATOM 0 HB3 PRO A 818 18.718 -0.737 -5.740 1.00 0.00 H new ATOM 0 HG2 PRO A 818 16.759 1.514 -5.739 1.00 0.00 H new ATOM 0 HG3 PRO A 818 18.297 1.385 -4.909 1.00 0.00 H new ATOM 0 HD2 PRO A 818 17.839 2.838 -7.284 1.00 0.00 H new ATOM 0 HD3 PRO A 818 19.414 2.417 -6.642 1.00 0.00 H new ATOM 1388 N SER A 819 16.394 0.364 -9.436 1.00 0.00 N ATOM 1389 CA SER A 819 15.079 0.250 -10.136 1.00 0.00 C ATOM 1390 C SER A 819 15.293 0.097 -11.646 1.00 0.00 C ATOM 1391 O SER A 819 14.516 -0.536 -12.331 1.00 0.00 O ATOM 1392 CB SER A 819 14.352 1.556 -9.829 1.00 0.00 C ATOM 1393 OG SER A 819 13.451 1.351 -8.746 1.00 0.00 O ATOM 0 H SER A 819 17.019 1.084 -9.798 1.00 0.00 H new ATOM 0 HA SER A 819 14.511 -0.620 -9.806 1.00 0.00 H new ATOM 0 HB2 SER A 819 15.071 2.335 -9.576 1.00 0.00 H new ATOM 0 HB3 SER A 819 13.808 1.898 -10.709 1.00 0.00 H new ATOM 0 HG SER A 819 12.984 2.189 -8.546 1.00 0.00 H new ATOM 1399 N ASN A 820 16.342 0.673 -12.167 1.00 0.00 N ATOM 1400 CA ASN A 820 16.605 0.561 -13.633 1.00 0.00 C ATOM 1401 C ASN A 820 16.857 -0.901 -14.020 1.00 0.00 C ATOM 1402 O ASN A 820 16.353 -1.383 -15.016 1.00 0.00 O ATOM 1403 CB ASN A 820 17.858 1.403 -13.876 1.00 0.00 C ATOM 1404 CG ASN A 820 17.511 2.586 -14.782 1.00 0.00 C ATOM 1405 OD1 ASN A 820 16.360 2.794 -15.113 1.00 0.00 O ATOM 1406 ND2 ASN A 820 18.463 3.376 -15.198 1.00 0.00 N ATOM 0 H ASN A 820 17.028 1.216 -11.643 1.00 0.00 H new ATOM 0 HA ASN A 820 15.760 0.904 -14.230 1.00 0.00 H new ATOM 0 HB2 ASN A 820 18.257 1.763 -12.927 1.00 0.00 H new ATOM 0 HB3 ASN A 820 18.635 0.793 -14.338 1.00 0.00 H new ATOM 0 HD21 ASN A 820 18.241 4.168 -15.801 1.00 0.00 H new ATOM 0 HD22 ASN A 820 19.429 3.201 -14.920 1.00 0.00 H new ATOM 1413 N PHE A 821 17.632 -1.608 -13.244 1.00 0.00 N ATOM 1414 CA PHE A 821 17.912 -3.039 -13.572 1.00 0.00 C ATOM 1415 C PHE A 821 16.853 -3.947 -12.937 1.00 0.00 C ATOM 1416 O PHE A 821 15.938 -4.402 -13.594 1.00 0.00 O ATOM 1417 CB PHE A 821 19.287 -3.323 -12.971 1.00 0.00 C ATOM 1418 CG PHE A 821 20.325 -2.464 -13.650 1.00 0.00 C ATOM 1419 CD1 PHE A 821 20.544 -1.153 -13.212 1.00 0.00 C ATOM 1420 CD2 PHE A 821 21.068 -2.978 -14.717 1.00 0.00 C ATOM 1421 CE1 PHE A 821 21.507 -0.356 -13.843 1.00 0.00 C ATOM 1422 CE2 PHE A 821 22.032 -2.183 -15.348 1.00 0.00 C ATOM 1423 CZ PHE A 821 22.251 -0.872 -14.912 1.00 0.00 C ATOM 0 H PHE A 821 18.084 -1.260 -12.398 1.00 0.00 H new ATOM 0 HA PHE A 821 17.889 -3.226 -14.646 1.00 0.00 H new ATOM 0 HB2 PHE A 821 19.276 -3.119 -11.900 1.00 0.00 H new ATOM 0 HB3 PHE A 821 19.537 -4.377 -13.092 1.00 0.00 H new ATOM 0 HD1 PHE A 821 19.970 -0.756 -12.387 1.00 0.00 H new ATOM 0 HD2 PHE A 821 20.898 -3.990 -15.055 1.00 0.00 H new ATOM 0 HE1 PHE A 821 21.676 0.656 -13.506 1.00 0.00 H new ATOM 0 HE2 PHE A 821 22.606 -2.582 -16.171 1.00 0.00 H new ATOM 0 HZ PHE A 821 22.994 -0.258 -15.399 1.00 0.00 H new ATOM 1433 N GLY A 822 16.971 -4.215 -11.662 1.00 0.00 N ATOM 1434 CA GLY A 822 15.970 -5.095 -10.992 1.00 0.00 C ATOM 1435 C GLY A 822 16.372 -5.321 -9.532 1.00 0.00 C ATOM 1436 O GLY A 822 16.215 -6.400 -8.995 1.00 0.00 O ATOM 0 H GLY A 822 17.715 -3.864 -11.059 1.00 0.00 H new ATOM 0 HA2 GLY A 822 14.981 -4.639 -11.040 1.00 0.00 H new ATOM 0 HA3 GLY A 822 15.906 -6.050 -11.513 1.00 0.00 H new ATOM 1440 N GLY A 823 16.891 -4.314 -8.883 1.00 0.00 N ATOM 1441 CA GLY A 823 17.302 -4.477 -7.458 1.00 0.00 C ATOM 1442 C GLY A 823 18.761 -4.934 -7.386 1.00 0.00 C ATOM 1443 O GLY A 823 19.517 -4.785 -8.327 1.00 0.00 O ATOM 0 H GLY A 823 17.048 -3.386 -9.277 1.00 0.00 H new ATOM 0 HA2 GLY A 823 17.180 -3.534 -6.925 1.00 0.00 H new ATOM 0 HA3 GLY A 823 16.659 -5.206 -6.966 1.00 0.00 H new ATOM 1447 N ASP A 824 19.162 -5.492 -6.275 1.00 0.00 N ATOM 1448 CA ASP A 824 20.577 -5.961 -6.138 1.00 0.00 C ATOM 1449 C ASP A 824 20.634 -7.491 -6.144 1.00 0.00 C ATOM 1450 O ASP A 824 19.800 -8.148 -5.553 1.00 0.00 O ATOM 1451 CB ASP A 824 21.055 -5.414 -4.791 1.00 0.00 C ATOM 1452 CG ASP A 824 19.984 -5.657 -3.727 1.00 0.00 C ATOM 1453 OD1 ASP A 824 19.271 -6.641 -3.846 1.00 0.00 O ATOM 1454 OD2 ASP A 824 19.893 -4.855 -2.812 1.00 0.00 O ATOM 0 H ASP A 824 18.574 -5.644 -5.456 1.00 0.00 H new ATOM 0 HA ASP A 824 21.202 -5.616 -6.962 1.00 0.00 H new ATOM 0 HB2 ASP A 824 21.987 -5.899 -4.500 1.00 0.00 H new ATOM 0 HB3 ASP A 824 21.264 -4.347 -4.874 1.00 0.00 H new ATOM 1459 N PRO A 825 21.624 -8.006 -6.823 1.00 0.00 N ATOM 1460 CA PRO A 825 21.802 -9.466 -6.914 1.00 0.00 C ATOM 1461 C PRO A 825 22.510 -10.011 -5.661 1.00 0.00 C ATOM 1462 O PRO A 825 22.017 -10.905 -5.001 1.00 0.00 O ATOM 1463 CB PRO A 825 22.675 -9.644 -8.147 1.00 0.00 C ATOM 1464 CG PRO A 825 23.426 -8.348 -8.298 1.00 0.00 C ATOM 1465 CD PRO A 825 22.644 -7.273 -7.569 1.00 0.00 C ATOM 0 HA PRO A 825 20.856 -10.004 -6.982 1.00 0.00 H new ATOM 0 HB2 PRO A 825 23.360 -10.483 -8.025 1.00 0.00 H new ATOM 0 HB3 PRO A 825 22.070 -9.852 -9.030 1.00 0.00 H new ATOM 0 HG2 PRO A 825 24.430 -8.438 -7.884 1.00 0.00 H new ATOM 0 HG3 PRO A 825 23.538 -8.091 -9.351 1.00 0.00 H new ATOM 0 HD2 PRO A 825 23.287 -6.698 -6.903 1.00 0.00 H new ATOM 0 HD3 PRO A 825 22.195 -6.567 -8.267 1.00 0.00 H new ATOM 1473 N CYS A 826 23.659 -9.479 -5.329 1.00 0.00 N ATOM 1474 CA CYS A 826 24.391 -9.977 -4.114 1.00 0.00 C ATOM 1475 C CYS A 826 24.665 -8.819 -3.146 1.00 0.00 C ATOM 1476 O CYS A 826 25.466 -7.952 -3.430 1.00 0.00 O ATOM 1477 CB CYS A 826 25.729 -10.560 -4.619 1.00 0.00 C ATOM 1478 SG CYS A 826 25.544 -11.257 -6.286 1.00 0.00 S ATOM 0 H CYS A 826 24.123 -8.727 -5.839 1.00 0.00 H new ATOM 0 HA CYS A 826 23.802 -10.725 -3.582 1.00 0.00 H new ATOM 0 HB2 CYS A 826 26.490 -9.779 -4.629 1.00 0.00 H new ATOM 0 HB3 CYS A 826 26.075 -11.333 -3.933 1.00 0.00 H new ATOM 1483 N PRO A 827 23.987 -8.849 -2.032 1.00 0.00 N ATOM 1484 CA PRO A 827 24.156 -7.799 -1.017 1.00 0.00 C ATOM 1485 C PRO A 827 25.319 -8.145 -0.075 1.00 0.00 C ATOM 1486 O PRO A 827 25.765 -9.273 -0.011 1.00 0.00 O ATOM 1487 CB PRO A 827 22.834 -7.819 -0.265 1.00 0.00 C ATOM 1488 CG PRO A 827 22.281 -9.210 -0.453 1.00 0.00 C ATOM 1489 CD PRO A 827 22.999 -9.845 -1.633 1.00 0.00 C ATOM 0 HA PRO A 827 24.388 -6.824 -1.444 1.00 0.00 H new ATOM 0 HB2 PRO A 827 22.981 -7.595 0.792 1.00 0.00 H new ATOM 0 HB3 PRO A 827 22.148 -7.068 -0.658 1.00 0.00 H new ATOM 0 HG2 PRO A 827 22.430 -9.804 0.448 1.00 0.00 H new ATOM 0 HG3 PRO A 827 21.207 -9.172 -0.636 1.00 0.00 H new ATOM 0 HD2 PRO A 827 23.473 -10.785 -1.351 1.00 0.00 H new ATOM 0 HD3 PRO A 827 22.308 -10.068 -2.446 1.00 0.00 H new ATOM 1497 N GLU A 828 25.813 -7.179 0.653 1.00 0.00 N ATOM 1498 CA GLU A 828 26.945 -7.450 1.590 1.00 0.00 C ATOM 1499 C GLU A 828 28.214 -7.831 0.815 1.00 0.00 C ATOM 1500 O GLU A 828 29.202 -8.240 1.392 1.00 0.00 O ATOM 1501 CB GLU A 828 26.470 -8.623 2.447 1.00 0.00 C ATOM 1502 CG GLU A 828 27.285 -8.675 3.741 1.00 0.00 C ATOM 1503 CD GLU A 828 26.340 -8.832 4.934 1.00 0.00 C ATOM 1504 OE1 GLU A 828 26.130 -9.958 5.354 1.00 0.00 O ATOM 1505 OE2 GLU A 828 25.843 -7.824 5.407 1.00 0.00 O ATOM 0 H GLU A 828 25.483 -6.214 0.640 1.00 0.00 H new ATOM 0 HA GLU A 828 27.198 -6.575 2.189 1.00 0.00 H new ATOM 0 HB2 GLU A 828 25.410 -8.513 2.677 1.00 0.00 H new ATOM 0 HB3 GLU A 828 26.582 -9.557 1.897 1.00 0.00 H new ATOM 0 HG2 GLU A 828 27.987 -9.508 3.708 1.00 0.00 H new ATOM 0 HG3 GLU A 828 27.875 -7.765 3.848 1.00 0.00 H new ATOM 1512 N VAL A 829 28.198 -7.700 -0.482 1.00 0.00 N ATOM 1513 CA VAL A 829 29.410 -8.057 -1.280 1.00 0.00 C ATOM 1514 C VAL A 829 29.891 -6.849 -2.090 1.00 0.00 C ATOM 1515 O VAL A 829 29.112 -6.166 -2.725 1.00 0.00 O ATOM 1516 CB VAL A 829 28.956 -9.178 -2.212 1.00 0.00 C ATOM 1517 CG1 VAL A 829 30.123 -9.601 -3.105 1.00 0.00 C ATOM 1518 CG2 VAL A 829 28.491 -10.375 -1.379 1.00 0.00 C ATOM 0 H VAL A 829 27.403 -7.363 -1.025 1.00 0.00 H new ATOM 0 HA VAL A 829 30.242 -8.364 -0.646 1.00 0.00 H new ATOM 0 HB VAL A 829 28.133 -8.825 -2.833 1.00 0.00 H new ATOM 0 HG11 VAL A 829 29.800 -10.401 -3.771 1.00 0.00 H new ATOM 0 HG12 VAL A 829 30.456 -8.748 -3.697 1.00 0.00 H new ATOM 0 HG13 VAL A 829 30.946 -9.955 -2.484 1.00 0.00 H new ATOM 0 HG21 VAL A 829 28.166 -11.176 -2.043 1.00 0.00 H new ATOM 0 HG22 VAL A 829 29.315 -10.729 -0.759 1.00 0.00 H new ATOM 0 HG23 VAL A 829 27.660 -10.074 -0.741 1.00 0.00 H new ATOM 1528 N MET A 830 31.169 -6.578 -2.071 1.00 0.00 N ATOM 1529 CA MET A 830 31.694 -5.414 -2.841 1.00 0.00 C ATOM 1530 C MET A 830 31.135 -5.432 -4.266 1.00 0.00 C ATOM 1531 O MET A 830 31.175 -6.440 -4.944 1.00 0.00 O ATOM 1532 CB MET A 830 33.210 -5.601 -2.860 1.00 0.00 C ATOM 1533 CG MET A 830 33.815 -4.998 -1.592 1.00 0.00 C ATOM 1534 SD MET A 830 34.388 -3.317 -1.938 1.00 0.00 S ATOM 1535 CE MET A 830 32.766 -2.515 -1.913 1.00 0.00 C ATOM 0 H MET A 830 31.870 -7.111 -1.557 1.00 0.00 H new ATOM 0 HA MET A 830 31.407 -4.461 -2.396 1.00 0.00 H new ATOM 0 HB2 MET A 830 33.455 -6.661 -2.924 1.00 0.00 H new ATOM 0 HB3 MET A 830 33.635 -5.122 -3.742 1.00 0.00 H new ATOM 0 HG2 MET A 830 33.073 -4.984 -0.793 1.00 0.00 H new ATOM 0 HG3 MET A 830 34.646 -5.613 -1.245 1.00 0.00 H new ATOM 0 HE1 MET A 830 32.887 -1.457 -1.681 1.00 0.00 H new ATOM 0 HE2 MET A 830 32.293 -2.620 -2.889 1.00 0.00 H new ATOM 0 HE3 MET A 830 32.140 -2.984 -1.154 1.00 0.00 H new ATOM 1545 N LYS A 831 30.613 -4.329 -4.725 1.00 0.00 N ATOM 1546 CA LYS A 831 30.052 -4.292 -6.108 1.00 0.00 C ATOM 1547 C LYS A 831 30.561 -3.054 -6.854 1.00 0.00 C ATOM 1548 O LYS A 831 31.194 -2.188 -6.284 1.00 0.00 O ATOM 1549 CB LYS A 831 28.536 -4.221 -5.920 1.00 0.00 C ATOM 1550 CG LYS A 831 28.165 -2.898 -5.249 1.00 0.00 C ATOM 1551 CD LYS A 831 26.783 -3.022 -4.603 1.00 0.00 C ATOM 1552 CE LYS A 831 25.734 -3.296 -5.683 1.00 0.00 C ATOM 1553 NZ LYS A 831 24.650 -4.041 -4.985 1.00 0.00 N ATOM 0 H LYS A 831 30.550 -3.453 -4.206 1.00 0.00 H new ATOM 0 HA LYS A 831 30.349 -5.160 -6.697 1.00 0.00 H new ATOM 0 HB2 LYS A 831 28.035 -4.304 -6.885 1.00 0.00 H new ATOM 0 HB3 LYS A 831 28.195 -5.058 -5.311 1.00 0.00 H new ATOM 0 HG2 LYS A 831 28.909 -2.640 -4.495 1.00 0.00 H new ATOM 0 HG3 LYS A 831 28.163 -2.093 -5.984 1.00 0.00 H new ATOM 0 HD2 LYS A 831 26.784 -3.829 -3.870 1.00 0.00 H new ATOM 0 HD3 LYS A 831 26.537 -2.105 -4.067 1.00 0.00 H new ATOM 0 HE2 LYS A 831 25.360 -2.368 -6.115 1.00 0.00 H new ATOM 0 HE3 LYS A 831 26.153 -3.882 -6.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 831 23.892 -4.265 -5.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 831 25.034 -4.923 -4.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 831 24.266 -3.455 -4.216 1.00 0.00 H new ATOM 1567 N ARG A 832 30.288 -2.970 -8.127 1.00 0.00 N ATOM 1568 CA ARG A 832 30.752 -1.793 -8.917 1.00 0.00 C ATOM 1569 C ARG A 832 30.070 -1.782 -10.289 1.00 0.00 C ATOM 1570 O ARG A 832 29.490 -2.762 -10.710 1.00 0.00 O ATOM 1571 CB ARG A 832 32.259 -1.985 -9.069 1.00 0.00 C ATOM 1572 CG ARG A 832 32.961 -0.630 -8.953 1.00 0.00 C ATOM 1573 CD ARG A 832 33.429 -0.420 -7.510 1.00 0.00 C ATOM 1574 NE ARG A 832 34.915 -0.457 -7.580 1.00 0.00 N ATOM 1575 CZ ARG A 832 35.616 0.509 -7.051 1.00 0.00 C ATOM 1576 NH1 ARG A 832 36.510 1.133 -7.767 1.00 0.00 N ATOM 1577 NH2 ARG A 832 35.420 0.850 -5.807 1.00 0.00 N ATOM 0 H ARG A 832 29.763 -3.666 -8.656 1.00 0.00 H new ATOM 0 HA ARG A 832 30.511 -0.847 -8.432 1.00 0.00 H new ATOM 0 HB2 ARG A 832 32.629 -2.665 -8.302 1.00 0.00 H new ATOM 0 HB3 ARG A 832 32.483 -2.441 -10.033 1.00 0.00 H new ATOM 0 HG2 ARG A 832 33.812 -0.590 -9.632 1.00 0.00 H new ATOM 0 HG3 ARG A 832 32.281 0.170 -9.246 1.00 0.00 H new ATOM 0 HD2 ARG A 832 33.076 0.532 -7.115 1.00 0.00 H new ATOM 0 HD3 ARG A 832 33.045 -1.200 -6.853 1.00 0.00 H new ATOM 0 HE ARG A 832 35.385 -1.236 -8.041 1.00 0.00 H new ATOM 0 HH11 ARG A 832 36.661 0.866 -8.740 1.00 0.00 H new ATOM 0 HH12 ARG A 832 37.058 1.888 -7.354 1.00 0.00 H new ATOM 0 HH21 ARG A 832 34.720 0.362 -5.249 1.00 0.00 H new ATOM 0 HH22 ARG A 832 35.967 1.605 -5.393 1.00 0.00 H new ATOM 1591 N VAL A 833 30.136 -0.684 -10.988 1.00 0.00 N ATOM 1592 CA VAL A 833 29.488 -0.618 -12.330 1.00 0.00 C ATOM 1593 C VAL A 833 30.547 -0.568 -13.434 1.00 0.00 C ATOM 1594 O VAL A 833 31.201 0.436 -13.636 1.00 0.00 O ATOM 1595 CB VAL A 833 28.674 0.674 -12.312 1.00 0.00 C ATOM 1596 CG1 VAL A 833 28.056 0.912 -13.691 1.00 0.00 C ATOM 1597 CG2 VAL A 833 27.561 0.554 -11.269 1.00 0.00 C ATOM 0 H VAL A 833 30.609 0.169 -10.690 1.00 0.00 H new ATOM 0 HA VAL A 833 28.867 -1.491 -12.529 1.00 0.00 H new ATOM 0 HB VAL A 833 29.325 1.511 -12.060 1.00 0.00 H new ATOM 0 HG11 VAL A 833 27.476 1.835 -13.675 1.00 0.00 H new ATOM 0 HG12 VAL A 833 28.848 0.994 -14.435 1.00 0.00 H new ATOM 0 HG13 VAL A 833 27.403 0.077 -13.946 1.00 0.00 H new ATOM 0 HG21 VAL A 833 26.977 1.474 -11.252 1.00 0.00 H new ATOM 0 HG22 VAL A 833 26.912 -0.283 -11.525 1.00 0.00 H new ATOM 0 HG23 VAL A 833 28.000 0.385 -10.286 1.00 0.00 H new ATOM 1607 N ALA A 834 30.720 -1.644 -14.147 1.00 0.00 N ATOM 1608 CA ALA A 834 31.737 -1.662 -15.242 1.00 0.00 C ATOM 1609 C ALA A 834 31.032 -1.692 -16.601 1.00 0.00 C ATOM 1610 O ALA A 834 30.166 -2.508 -16.840 1.00 0.00 O ATOM 1611 CB ALA A 834 32.535 -2.946 -15.022 1.00 0.00 C ATOM 0 H ALA A 834 30.203 -2.514 -14.022 1.00 0.00 H new ATOM 0 HA ALA A 834 32.379 -0.781 -15.231 1.00 0.00 H new ATOM 0 HB1 ALA A 834 33.305 -3.032 -15.789 1.00 0.00 H new ATOM 0 HB2 ALA A 834 33.004 -2.919 -14.039 1.00 0.00 H new ATOM 0 HB3 ALA A 834 31.866 -3.805 -15.081 1.00 0.00 H new ATOM 1617 N VAL A 835 31.395 -0.810 -17.495 1.00 0.00 N ATOM 1618 CA VAL A 835 30.733 -0.801 -18.835 1.00 0.00 C ATOM 1619 C VAL A 835 31.746 -0.479 -19.940 1.00 0.00 C ATOM 1620 O VAL A 835 32.737 0.185 -19.716 1.00 0.00 O ATOM 1621 CB VAL A 835 29.675 0.304 -18.749 1.00 0.00 C ATOM 1622 CG1 VAL A 835 29.192 0.665 -20.156 1.00 0.00 C ATOM 1623 CG2 VAL A 835 28.489 -0.189 -17.921 1.00 0.00 C ATOM 0 H VAL A 835 32.115 -0.101 -17.358 1.00 0.00 H new ATOM 0 HA VAL A 835 30.300 -1.771 -19.078 1.00 0.00 H new ATOM 0 HB VAL A 835 30.112 1.184 -18.277 1.00 0.00 H new ATOM 0 HG11 VAL A 835 28.440 1.451 -20.092 1.00 0.00 H new ATOM 0 HG12 VAL A 835 30.035 1.017 -20.751 1.00 0.00 H new ATOM 0 HG13 VAL A 835 28.757 -0.216 -20.629 1.00 0.00 H new ATOM 0 HG21 VAL A 835 27.736 0.597 -17.860 1.00 0.00 H new ATOM 0 HG22 VAL A 835 28.056 -1.070 -18.394 1.00 0.00 H new ATOM 0 HG23 VAL A 835 28.828 -0.446 -16.917 1.00 0.00 H new ATOM 1633 N GLU A 836 31.493 -0.946 -21.130 1.00 0.00 N ATOM 1634 CA GLU A 836 32.426 -0.677 -22.264 1.00 0.00 C ATOM 1635 C GLU A 836 31.625 -0.618 -23.572 1.00 0.00 C ATOM 1636 O GLU A 836 30.705 -1.384 -23.779 1.00 0.00 O ATOM 1637 CB GLU A 836 33.405 -1.852 -22.269 1.00 0.00 C ATOM 1638 CG GLU A 836 34.818 -1.338 -22.555 1.00 0.00 C ATOM 1639 CD GLU A 836 35.650 -2.455 -23.184 1.00 0.00 C ATOM 1640 OE1 GLU A 836 36.151 -2.249 -24.277 1.00 0.00 O ATOM 1641 OE2 GLU A 836 35.771 -3.499 -22.563 1.00 0.00 O ATOM 0 H GLU A 836 30.675 -1.506 -21.369 1.00 0.00 H new ATOM 0 HA GLU A 836 32.954 0.271 -22.164 1.00 0.00 H new ATOM 0 HB2 GLU A 836 33.380 -2.364 -21.307 1.00 0.00 H new ATOM 0 HB3 GLU A 836 33.112 -2.580 -23.025 1.00 0.00 H new ATOM 0 HG2 GLU A 836 34.775 -0.480 -23.226 1.00 0.00 H new ATOM 0 HG3 GLU A 836 35.286 -0.997 -21.632 1.00 0.00 H new ATOM 1648 N ALA A 837 31.964 0.281 -24.455 1.00 0.00 N ATOM 1649 CA ALA A 837 31.207 0.376 -25.742 1.00 0.00 C ATOM 1650 C ALA A 837 32.122 0.137 -26.947 1.00 0.00 C ATOM 1651 O ALA A 837 33.332 0.147 -26.837 1.00 0.00 O ATOM 1652 CB ALA A 837 30.663 1.801 -25.767 1.00 0.00 C ATOM 0 H ALA A 837 32.726 0.950 -24.346 1.00 0.00 H new ATOM 0 HA ALA A 837 30.421 -0.376 -25.802 1.00 0.00 H new ATOM 0 HB1 ALA A 837 30.092 1.956 -26.682 1.00 0.00 H new ATOM 0 HB2 ALA A 837 30.016 1.959 -24.904 1.00 0.00 H new ATOM 0 HB3 ALA A 837 31.492 2.508 -25.732 1.00 0.00 H new ATOM 1658 N VAL A 838 31.539 -0.078 -28.098 1.00 0.00 N ATOM 1659 CA VAL A 838 32.353 -0.319 -29.324 1.00 0.00 C ATOM 1660 C VAL A 838 31.909 0.637 -30.438 1.00 0.00 C ATOM 1661 O VAL A 838 30.751 0.682 -30.802 1.00 0.00 O ATOM 1662 CB VAL A 838 32.064 -1.766 -29.714 1.00 0.00 C ATOM 1663 CG1 VAL A 838 32.876 -2.135 -30.957 1.00 0.00 C ATOM 1664 CG2 VAL A 838 32.454 -2.691 -28.557 1.00 0.00 C ATOM 0 H VAL A 838 30.529 -0.097 -28.241 1.00 0.00 H new ATOM 0 HA VAL A 838 33.417 -0.150 -29.158 1.00 0.00 H new ATOM 0 HB VAL A 838 31.002 -1.878 -29.930 1.00 0.00 H new ATOM 0 HG11 VAL A 838 32.668 -3.169 -31.234 1.00 0.00 H new ATOM 0 HG12 VAL A 838 32.600 -1.476 -31.781 1.00 0.00 H new ATOM 0 HG13 VAL A 838 33.939 -2.023 -30.744 1.00 0.00 H new ATOM 0 HG21 VAL A 838 32.249 -3.725 -28.833 1.00 0.00 H new ATOM 0 HG22 VAL A 838 33.517 -2.577 -28.342 1.00 0.00 H new ATOM 0 HG23 VAL A 838 31.875 -2.430 -27.671 1.00 0.00 H new ATOM 1674 N CYS A 839 32.815 1.400 -30.980 1.00 0.00 N ATOM 1675 CA CYS A 839 32.430 2.349 -32.068 1.00 0.00 C ATOM 1676 C CYS A 839 32.990 1.879 -33.413 1.00 0.00 C ATOM 1677 O CYS A 839 34.152 1.546 -33.534 1.00 0.00 O ATOM 1678 CB CYS A 839 33.055 3.684 -31.668 1.00 0.00 C ATOM 1679 SG CYS A 839 32.085 4.433 -30.337 1.00 0.00 S ATOM 0 H CYS A 839 33.801 1.410 -30.721 1.00 0.00 H new ATOM 0 HA CYS A 839 31.349 2.420 -32.185 1.00 0.00 H new ATOM 0 HB2 CYS A 839 34.084 3.532 -31.341 1.00 0.00 H new ATOM 0 HB3 CYS A 839 33.089 4.353 -32.528 1.00 0.00 H new ATOM 1684 N SER A 840 32.167 1.849 -34.424 1.00 0.00 N ATOM 1685 CA SER A 840 32.644 1.401 -35.766 1.00 0.00 C ATOM 1686 C SER A 840 31.720 1.946 -36.859 1.00 0.00 C ATOM 1687 O SER A 840 30.914 1.229 -37.417 1.00 0.00 O ATOM 1688 CB SER A 840 32.580 -0.122 -35.719 1.00 0.00 C ATOM 1689 OG SER A 840 31.220 -0.536 -35.740 1.00 0.00 O ATOM 0 H SER A 840 31.183 2.115 -34.381 1.00 0.00 H new ATOM 0 HA SER A 840 33.649 1.758 -35.991 1.00 0.00 H new ATOM 0 HB2 SER A 840 33.114 -0.546 -36.569 1.00 0.00 H new ATOM 0 HB3 SER A 840 33.070 -0.490 -34.818 1.00 0.00 H new ATOM 0 HG SER A 840 30.820 -0.300 -36.603 1.00 0.00 H new ATOM 1695 N THR A 841 31.831 3.210 -37.168 1.00 0.00 N ATOM 1696 CA THR A 841 30.959 3.802 -38.225 1.00 0.00 C ATOM 1697 C THR A 841 29.521 3.289 -38.073 1.00 0.00 C ATOM 1698 O THR A 841 29.131 2.810 -37.026 1.00 0.00 O ATOM 1699 CB THR A 841 31.563 3.330 -39.550 1.00 0.00 C ATOM 1700 OG1 THR A 841 31.519 1.910 -39.611 1.00 0.00 O ATOM 1701 CG2 THR A 841 33.013 3.805 -39.647 1.00 0.00 C ATOM 0 H THR A 841 32.488 3.859 -36.734 1.00 0.00 H new ATOM 0 HA THR A 841 30.916 4.889 -38.164 1.00 0.00 H new ATOM 0 HB THR A 841 30.991 3.745 -40.380 1.00 0.00 H new ATOM 0 HG1 THR A 841 30.837 1.577 -38.991 1.00 0.00 H new ATOM 0 HG21 THR A 841 33.444 3.469 -40.590 1.00 0.00 H new ATOM 0 HG22 THR A 841 33.043 4.894 -39.602 1.00 0.00 H new ATOM 0 HG23 THR A 841 33.588 3.391 -38.818 1.00 0.00 H new