USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=17 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 100:sc= 0.421 USER MOD Set 1.2: A 790 GLN : amide:sc= -2.95! C(o=-13!,f=-18!) USER MOD Set 1.3: A 794 HIS : no HD1:sc= -7.11! C(o=-13!,f=-17!) USER MOD Set 1.4: A 798 SER OG : rot 138:sc= -3.04! USER MOD Single : A 729 SER OG : rot 61:sc= 0.102 USER MOD Single : A 736 SER OG : rot 180:sc= 0.0257 USER MOD Single : A 757 THR OG1 : rot 28:sc= 0.607 USER MOD Single : A 759 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 761 HIS : no HD1:sc= -0.0143 X(o=-0.014,f=-0.0064) USER MOD Single : A 763 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 768 GLN : amide:sc= -3.28! C(o=-3.3!,f=-4.7!) USER MOD Single : A 769 THR OG1 : rot 180:sc= 0.0918 USER MOD Single : A 771 SER OG : rot 180:sc= 0 USER MOD Single : A 774 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.281) USER MOD Single : A 780 THR OG1 : rot 64:sc= 1.15 USER MOD Single : A 784 THR OG1 : rot 180:sc= 0.0138 USER MOD Single : A 787 THR OG1 : rot -43:sc= 0.744 USER MOD Single : A 789 GLN : amide:sc= -0.536 X(o=-0.54,f=-0.15) USER MOD Single : A 795 SER OG : rot 180:sc= -0.233 USER MOD Single : A 797 ASN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 799 ASN : amide:sc= -1.2 K(o=-1.2,f=-7.4!) 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= -0.654 USER MOD Single : A 819 SER OG : rot 180:sc= 0 USER MOD Single : A 820 ASN : amide:sc= -3.24! C(o=-3.2!,f=-1.6!) USER MOD Single : A 830 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 831 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 840 SER OG : rot 180:sc= -0.0221 USER MOD Single : A 841 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 39 N VAL A 728 37.845 1.811 -34.859 1.00 0.00 N ATOM 40 CA VAL A 728 36.842 1.628 -33.767 1.00 0.00 C ATOM 41 C VAL A 728 37.494 1.875 -32.401 1.00 0.00 C ATOM 42 O VAL A 728 38.490 1.269 -32.061 1.00 0.00 O ATOM 43 CB VAL A 728 36.388 0.173 -33.890 1.00 0.00 C ATOM 44 CG1 VAL A 728 35.515 -0.194 -32.691 1.00 0.00 C ATOM 45 CG2 VAL A 728 35.582 -0.001 -35.180 1.00 0.00 C ATOM 0 HA VAL A 728 36.008 2.325 -33.850 1.00 0.00 H new ATOM 0 HB VAL A 728 37.261 -0.479 -33.915 1.00 0.00 H new ATOM 0 HG11 VAL A 728 35.192 -1.231 -32.780 1.00 0.00 H new ATOM 0 HG12 VAL A 728 36.088 -0.070 -31.772 1.00 0.00 H new ATOM 0 HG13 VAL A 728 34.641 0.457 -32.664 1.00 0.00 H new ATOM 0 HG21 VAL A 728 35.258 -1.038 -35.269 1.00 0.00 H new ATOM 0 HG22 VAL A 728 34.709 0.651 -35.154 1.00 0.00 H new ATOM 0 HG23 VAL A 728 36.205 0.259 -36.036 1.00 0.00 H new ATOM 55 N SER A 729 36.939 2.763 -31.617 1.00 0.00 N ATOM 56 CA SER A 729 37.531 3.047 -30.274 1.00 0.00 C ATOM 57 C SER A 729 36.425 3.224 -29.227 1.00 0.00 C ATOM 58 O SER A 729 36.179 4.314 -28.749 1.00 0.00 O ATOM 59 CB SER A 729 38.303 4.349 -30.454 1.00 0.00 C ATOM 60 OG SER A 729 37.470 5.302 -31.105 1.00 0.00 O ATOM 0 H SER A 729 36.104 3.302 -31.847 1.00 0.00 H new ATOM 0 HA SER A 729 38.168 2.234 -29.926 1.00 0.00 H new ATOM 0 HB2 SER A 729 38.625 4.731 -29.485 1.00 0.00 H new ATOM 0 HB3 SER A 729 39.203 4.173 -31.043 1.00 0.00 H new ATOM 0 HG SER A 729 36.680 5.478 -30.552 1.00 0.00 H new ATOM 66 N GLY A 730 35.760 2.161 -28.865 1.00 0.00 N ATOM 67 CA GLY A 730 34.674 2.272 -27.850 1.00 0.00 C ATOM 68 C GLY A 730 35.208 2.991 -26.609 1.00 0.00 C ATOM 69 O GLY A 730 36.336 3.440 -26.577 1.00 0.00 O ATOM 0 H GLY A 730 35.921 1.221 -29.228 1.00 0.00 H new ATOM 0 HA2 GLY A 730 33.828 2.820 -28.265 1.00 0.00 H new ATOM 0 HA3 GLY A 730 34.310 1.280 -27.581 1.00 0.00 H new ATOM 73 N VAL A 731 34.407 3.098 -25.585 1.00 0.00 N ATOM 74 CA VAL A 731 34.872 3.789 -24.346 1.00 0.00 C ATOM 75 C VAL A 731 34.540 2.941 -23.117 1.00 0.00 C ATOM 76 O VAL A 731 33.459 2.401 -22.996 1.00 0.00 O ATOM 77 CB VAL A 731 34.102 5.109 -24.304 1.00 0.00 C ATOM 78 CG1 VAL A 731 34.782 6.065 -23.324 1.00 0.00 C ATOM 79 CG2 VAL A 731 34.082 5.740 -25.700 1.00 0.00 C ATOM 0 H VAL A 731 33.453 2.739 -25.551 1.00 0.00 H new ATOM 0 HA VAL A 731 35.950 3.950 -24.347 1.00 0.00 H new ATOM 0 HB VAL A 731 33.079 4.919 -23.979 1.00 0.00 H new ATOM 0 HG11 VAL A 731 34.233 7.006 -23.294 1.00 0.00 H new ATOM 0 HG12 VAL A 731 34.793 5.619 -22.329 1.00 0.00 H new ATOM 0 HG13 VAL A 731 35.805 6.252 -23.649 1.00 0.00 H new ATOM 0 HG21 VAL A 731 33.532 6.681 -25.666 1.00 0.00 H new ATOM 0 HG22 VAL A 731 35.104 5.929 -26.029 1.00 0.00 H new ATOM 0 HG23 VAL A 731 33.595 5.060 -26.400 1.00 0.00 H new ATOM 89 N CYS A 732 35.462 2.817 -22.207 1.00 0.00 N ATOM 90 CA CYS A 732 35.200 2.005 -20.985 1.00 0.00 C ATOM 91 C CYS A 732 35.101 2.917 -19.759 1.00 0.00 C ATOM 92 O CYS A 732 35.981 3.713 -19.496 1.00 0.00 O ATOM 93 CB CYS A 732 36.404 1.075 -20.869 1.00 0.00 C ATOM 94 SG CYS A 732 35.840 -0.605 -20.515 1.00 0.00 S ATOM 0 H CYS A 732 36.388 3.243 -22.255 1.00 0.00 H new ATOM 0 HA CYS A 732 34.262 1.452 -21.044 1.00 0.00 H new ATOM 0 HB2 CYS A 732 36.978 1.089 -21.796 1.00 0.00 H new ATOM 0 HB3 CYS A 732 37.069 1.421 -20.077 1.00 0.00 H new ATOM 99 N ALA A 733 34.038 2.810 -19.007 1.00 0.00 N ATOM 100 CA ALA A 733 33.893 3.678 -17.802 1.00 0.00 C ATOM 101 C ALA A 733 33.322 2.879 -16.623 1.00 0.00 C ATOM 102 O ALA A 733 32.259 2.298 -16.710 1.00 0.00 O ATOM 103 CB ALA A 733 32.918 4.777 -18.220 1.00 0.00 C ATOM 0 H ALA A 733 33.268 2.163 -19.174 1.00 0.00 H new ATOM 0 HA ALA A 733 34.852 4.080 -17.474 1.00 0.00 H new ATOM 0 HB1 ALA A 733 32.759 5.459 -17.385 1.00 0.00 H new ATOM 0 HB2 ALA A 733 33.331 5.328 -19.065 1.00 0.00 H new ATOM 0 HB3 ALA A 733 31.967 4.329 -18.509 1.00 0.00 H new ATOM 109 N ASP A 734 34.024 2.850 -15.525 1.00 0.00 N ATOM 110 CA ASP A 734 33.527 2.092 -14.340 1.00 0.00 C ATOM 111 C ASP A 734 33.185 3.067 -13.210 1.00 0.00 C ATOM 112 O ASP A 734 34.056 3.653 -12.600 1.00 0.00 O ATOM 113 CB ASP A 734 34.686 1.185 -13.935 1.00 0.00 C ATOM 114 CG ASP A 734 35.973 2.007 -13.864 1.00 0.00 C ATOM 115 OD1 ASP A 734 36.272 2.512 -12.795 1.00 0.00 O ATOM 116 OD2 ASP A 734 36.638 2.117 -14.880 1.00 0.00 O ATOM 0 H ASP A 734 34.921 3.318 -15.396 1.00 0.00 H new ATOM 0 HA ASP A 734 32.625 1.520 -14.557 1.00 0.00 H new ATOM 0 HB2 ASP A 734 34.482 0.725 -12.968 1.00 0.00 H new ATOM 0 HB3 ASP A 734 34.798 0.375 -14.656 1.00 0.00 H new ATOM 121 N VAL A 735 31.925 3.245 -12.927 1.00 0.00 N ATOM 122 CA VAL A 735 31.535 4.184 -11.837 1.00 0.00 C ATOM 123 C VAL A 735 30.955 3.411 -10.653 1.00 0.00 C ATOM 124 O VAL A 735 30.594 2.257 -10.766 1.00 0.00 O ATOM 125 CB VAL A 735 30.473 5.089 -12.457 1.00 0.00 C ATOM 126 CG1 VAL A 735 30.062 6.157 -11.445 1.00 0.00 C ATOM 127 CG2 VAL A 735 31.043 5.765 -13.708 1.00 0.00 C ATOM 0 H VAL A 735 31.150 2.783 -13.402 1.00 0.00 H new ATOM 0 HA VAL A 735 32.385 4.751 -11.458 1.00 0.00 H new ATOM 0 HB VAL A 735 29.603 4.492 -12.731 1.00 0.00 H new ATOM 0 HG11 VAL A 735 29.304 6.804 -11.886 1.00 0.00 H new ATOM 0 HG12 VAL A 735 29.656 5.677 -10.554 1.00 0.00 H new ATOM 0 HG13 VAL A 735 30.933 6.753 -11.171 1.00 0.00 H new ATOM 0 HG21 VAL A 735 30.284 6.411 -14.150 1.00 0.00 H new ATOM 0 HG22 VAL A 735 31.913 6.362 -13.435 1.00 0.00 H new ATOM 0 HG23 VAL A 735 31.338 5.004 -14.431 1.00 0.00 H new ATOM 137 N SER A 736 30.863 4.039 -9.513 1.00 0.00 N ATOM 138 CA SER A 736 30.307 3.340 -8.321 1.00 0.00 C ATOM 139 C SER A 736 28.854 3.767 -8.085 1.00 0.00 C ATOM 140 O SER A 736 28.297 4.547 -8.833 1.00 0.00 O ATOM 141 CB SER A 736 31.192 3.777 -7.158 1.00 0.00 C ATOM 142 OG SER A 736 31.232 5.198 -7.105 1.00 0.00 O ATOM 0 H SER A 736 31.149 5.005 -9.356 1.00 0.00 H new ATOM 0 HA SER A 736 30.301 2.257 -8.443 1.00 0.00 H new ATOM 0 HB2 SER A 736 30.804 3.378 -6.221 1.00 0.00 H new ATOM 0 HB3 SER A 736 32.199 3.378 -7.282 1.00 0.00 H new ATOM 0 HG SER A 736 31.799 5.482 -6.357 1.00 0.00 H new ATOM 148 N GLU A 737 28.239 3.260 -7.054 1.00 0.00 N ATOM 149 CA GLU A 737 26.822 3.637 -6.769 1.00 0.00 C ATOM 150 C GLU A 737 26.682 4.130 -5.326 1.00 0.00 C ATOM 151 O GLU A 737 26.719 3.356 -4.390 1.00 0.00 O ATOM 152 CB GLU A 737 26.027 2.348 -6.979 1.00 0.00 C ATOM 153 CG GLU A 737 24.648 2.480 -6.331 1.00 0.00 C ATOM 154 CD GLU A 737 23.808 1.244 -6.664 1.00 0.00 C ATOM 155 OE1 GLU A 737 22.797 1.402 -7.328 1.00 0.00 O ATOM 156 OE2 GLU A 737 24.191 0.163 -6.248 1.00 0.00 O ATOM 0 H GLU A 737 28.654 2.601 -6.395 1.00 0.00 H new ATOM 0 HA GLU A 737 26.470 4.445 -7.410 1.00 0.00 H new ATOM 0 HB2 GLU A 737 25.921 2.145 -8.045 1.00 0.00 H new ATOM 0 HB3 GLU A 737 26.564 1.504 -6.546 1.00 0.00 H new ATOM 0 HG2 GLU A 737 24.750 2.583 -5.251 1.00 0.00 H new ATOM 0 HG3 GLU A 737 24.149 3.380 -6.691 1.00 0.00 H new ATOM 479 N THR A 757 22.603 8.857 -6.437 1.00 0.00 N ATOM 480 CA THR A 757 23.138 7.765 -7.309 1.00 0.00 C ATOM 481 C THR A 757 24.097 8.334 -8.353 1.00 0.00 C ATOM 482 O THR A 757 23.759 9.232 -9.098 1.00 0.00 O ATOM 483 CB THR A 757 21.909 7.162 -7.994 1.00 0.00 C ATOM 484 OG1 THR A 757 21.224 8.180 -8.715 1.00 0.00 O ATOM 485 CG2 THR A 757 20.976 6.563 -6.943 1.00 0.00 C ATOM 0 HA THR A 757 23.695 7.024 -6.736 1.00 0.00 H new ATOM 0 HB THR A 757 22.225 6.378 -8.682 1.00 0.00 H new ATOM 0 HG1 THR A 757 21.861 8.874 -8.986 1.00 0.00 H new ATOM 0 HG21 THR A 757 20.102 6.135 -7.434 1.00 0.00 H new ATOM 0 HG22 THR A 757 21.502 5.783 -6.392 1.00 0.00 H new ATOM 0 HG23 THR A 757 20.658 7.343 -6.252 1.00 0.00 H new ATOM 493 N ALA A 758 25.294 7.818 -8.414 1.00 0.00 N ATOM 494 CA ALA A 758 26.270 8.332 -9.412 1.00 0.00 C ATOM 495 C ALA A 758 25.713 8.133 -10.820 1.00 0.00 C ATOM 496 O ALA A 758 24.716 7.466 -11.013 1.00 0.00 O ATOM 497 CB ALA A 758 27.530 7.491 -9.210 1.00 0.00 C ATOM 0 H ALA A 758 25.636 7.065 -7.817 1.00 0.00 H new ATOM 0 HA ALA A 758 26.474 9.396 -9.289 1.00 0.00 H new ATOM 0 HB1 ALA A 758 28.298 7.812 -9.913 1.00 0.00 H new ATOM 0 HB2 ALA A 758 27.894 7.620 -8.191 1.00 0.00 H new ATOM 0 HB3 ALA A 758 27.297 6.440 -9.382 1.00 0.00 H new ATOM 503 N LYS A 759 26.341 8.701 -11.805 1.00 0.00 N ATOM 504 CA LYS A 759 25.837 8.536 -13.195 1.00 0.00 C ATOM 505 C LYS A 759 26.968 8.085 -14.122 1.00 0.00 C ATOM 506 O LYS A 759 28.134 8.215 -13.806 1.00 0.00 O ATOM 507 CB LYS A 759 25.340 9.925 -13.603 1.00 0.00 C ATOM 508 CG LYS A 759 23.811 9.937 -13.645 1.00 0.00 C ATOM 509 CD LYS A 759 23.335 11.176 -14.407 1.00 0.00 C ATOM 510 CE LYS A 759 21.852 11.025 -14.759 1.00 0.00 C ATOM 511 NZ LYS A 759 21.479 12.311 -15.413 1.00 0.00 N ATOM 0 H LYS A 759 27.181 9.272 -11.710 1.00 0.00 H new ATOM 0 HA LYS A 759 25.052 7.782 -13.260 1.00 0.00 H new ATOM 0 HB2 LYS A 759 25.699 10.672 -12.895 1.00 0.00 H new ATOM 0 HB3 LYS A 759 25.742 10.192 -14.580 1.00 0.00 H new ATOM 0 HG2 LYS A 759 23.442 9.034 -14.131 1.00 0.00 H new ATOM 0 HG3 LYS A 759 23.408 9.942 -12.632 1.00 0.00 H new ATOM 0 HD2 LYS A 759 23.486 12.069 -13.800 1.00 0.00 H new ATOM 0 HD3 LYS A 759 23.923 11.305 -15.315 1.00 0.00 H new ATOM 0 HE2 LYS A 759 21.689 10.180 -15.428 1.00 0.00 H new ATOM 0 HE3 LYS A 759 21.251 10.846 -13.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 759 20.475 12.284 -15.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 759 21.638 13.097 -14.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 759 22.063 12.451 -16.262 1.00 0.00 H new ATOM 525 N VAL A 760 26.630 7.555 -15.264 1.00 0.00 N ATOM 526 CA VAL A 760 27.680 7.095 -16.215 1.00 0.00 C ATOM 527 C VAL A 760 27.740 8.068 -17.388 1.00 0.00 C ATOM 528 O VAL A 760 26.729 8.420 -17.962 1.00 0.00 O ATOM 529 CB VAL A 760 27.229 5.711 -16.677 1.00 0.00 C ATOM 530 CG1 VAL A 760 28.016 5.305 -17.926 1.00 0.00 C ATOM 531 CG2 VAL A 760 27.488 4.696 -15.560 1.00 0.00 C ATOM 0 H VAL A 760 25.670 7.420 -15.581 1.00 0.00 H new ATOM 0 HA VAL A 760 28.673 7.053 -15.767 1.00 0.00 H new ATOM 0 HB VAL A 760 26.165 5.735 -16.912 1.00 0.00 H new ATOM 0 HG11 VAL A 760 27.693 4.317 -18.254 1.00 0.00 H new ATOM 0 HG12 VAL A 760 27.836 6.029 -18.721 1.00 0.00 H new ATOM 0 HG13 VAL A 760 29.081 5.280 -17.693 1.00 0.00 H new ATOM 0 HG21 VAL A 760 27.167 3.707 -15.886 1.00 0.00 H new ATOM 0 HG22 VAL A 760 28.553 4.674 -15.328 1.00 0.00 H new ATOM 0 HG23 VAL A 760 26.928 4.984 -14.670 1.00 0.00 H new ATOM 541 N HIS A 761 28.908 8.509 -17.755 1.00 0.00 N ATOM 542 CA HIS A 761 29.002 9.461 -18.893 1.00 0.00 C ATOM 543 C HIS A 761 29.693 8.826 -20.101 1.00 0.00 C ATOM 544 O HIS A 761 30.896 8.661 -20.130 1.00 0.00 O ATOM 545 CB HIS A 761 29.833 10.627 -18.360 1.00 0.00 C ATOM 546 CG HIS A 761 29.010 11.429 -17.390 1.00 0.00 C ATOM 547 ND1 HIS A 761 29.491 11.801 -16.144 1.00 0.00 N ATOM 548 CD2 HIS A 761 27.738 11.939 -17.468 1.00 0.00 C ATOM 549 CE1 HIS A 761 28.522 12.504 -15.529 1.00 0.00 C ATOM 550 NE2 HIS A 761 27.431 12.617 -16.293 1.00 0.00 N ATOM 0 H HIS A 761 29.795 8.254 -17.321 1.00 0.00 H new ATOM 0 HA HIS A 761 28.015 9.770 -19.237 1.00 0.00 H new ATOM 0 HB2 HIS A 761 30.731 10.252 -17.868 1.00 0.00 H new ATOM 0 HB3 HIS A 761 30.161 11.260 -19.184 1.00 0.00 H new ATOM 0 HD2 HIS A 761 27.076 11.830 -18.314 1.00 0.00 H new ATOM 0 HE1 HIS A 761 28.615 12.925 -14.539 1.00 0.00 H new ATOM 0 HE2 HIS A 761 26.561 13.097 -16.064 1.00 0.00 H new ATOM 558 N LEU A 762 28.934 8.469 -21.097 1.00 0.00 N ATOM 559 CA LEU A 762 29.530 7.847 -22.310 1.00 0.00 C ATOM 560 C LEU A 762 29.416 8.842 -23.466 1.00 0.00 C ATOM 561 O LEU A 762 28.335 9.160 -23.910 1.00 0.00 O ATOM 562 CB LEU A 762 28.686 6.599 -22.588 1.00 0.00 C ATOM 563 CG LEU A 762 28.959 5.538 -21.517 1.00 0.00 C ATOM 564 CD1 LEU A 762 27.754 4.602 -21.410 1.00 0.00 C ATOM 565 CD2 LEU A 762 30.198 4.728 -21.906 1.00 0.00 C ATOM 0 H LEU A 762 27.921 8.582 -21.123 1.00 0.00 H new ATOM 0 HA LEU A 762 30.581 7.587 -22.185 1.00 0.00 H new ATOM 0 HB2 LEU A 762 27.627 6.859 -22.594 1.00 0.00 H new ATOM 0 HB3 LEU A 762 28.922 6.202 -23.575 1.00 0.00 H new ATOM 0 HG LEU A 762 29.129 6.026 -20.557 1.00 0.00 H new ATOM 0 HD11 LEU A 762 27.947 3.846 -20.648 1.00 0.00 H new ATOM 0 HD12 LEU A 762 26.870 5.177 -21.135 1.00 0.00 H new ATOM 0 HD13 LEU A 762 27.586 4.114 -22.370 1.00 0.00 H new ATOM 0 HD21 LEU A 762 30.393 3.973 -21.144 1.00 0.00 H new ATOM 0 HD22 LEU A 762 30.027 4.240 -22.866 1.00 0.00 H new ATOM 0 HD23 LEU A 762 31.058 5.393 -21.985 1.00 0.00 H new ATOM 577 N LYS A 763 30.509 9.347 -23.955 1.00 0.00 N ATOM 578 CA LYS A 763 30.417 10.321 -25.080 1.00 0.00 C ATOM 579 C LYS A 763 31.518 10.085 -26.110 1.00 0.00 C ATOM 580 O LYS A 763 32.693 10.210 -25.824 1.00 0.00 O ATOM 581 CB LYS A 763 30.581 11.695 -24.428 1.00 0.00 C ATOM 582 CG LYS A 763 31.759 11.666 -23.449 1.00 0.00 C ATOM 583 CD LYS A 763 31.731 12.926 -22.583 1.00 0.00 C ATOM 584 CE LYS A 763 30.689 12.761 -21.474 1.00 0.00 C ATOM 585 NZ LYS A 763 29.757 13.910 -21.648 1.00 0.00 N ATOM 0 H LYS A 763 31.453 9.133 -23.632 1.00 0.00 H new ATOM 0 HA LYS A 763 29.473 10.225 -25.616 1.00 0.00 H new ATOM 0 HB2 LYS A 763 30.750 12.453 -25.193 1.00 0.00 H new ATOM 0 HB3 LYS A 763 29.666 11.970 -23.903 1.00 0.00 H new ATOM 0 HG2 LYS A 763 31.701 10.778 -22.820 1.00 0.00 H new ATOM 0 HG3 LYS A 763 32.700 11.609 -23.996 1.00 0.00 H new ATOM 0 HD2 LYS A 763 32.715 13.103 -22.149 1.00 0.00 H new ATOM 0 HD3 LYS A 763 31.491 13.795 -23.195 1.00 0.00 H new ATOM 0 HE2 LYS A 763 30.164 11.810 -21.564 1.00 0.00 H new ATOM 0 HE3 LYS A 763 31.155 12.776 -20.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 763 29.013 13.866 -20.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 763 30.283 14.802 -21.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 763 29.323 13.865 -22.592 1.00 0.00 H new ATOM 599 N CYS A 764 31.142 9.744 -27.309 1.00 0.00 N ATOM 600 CA CYS A 764 32.154 9.498 -28.368 1.00 0.00 C ATOM 601 C CYS A 764 32.329 10.773 -29.198 1.00 0.00 C ATOM 602 O CYS A 764 31.392 11.520 -29.399 1.00 0.00 O ATOM 603 CB CYS A 764 31.574 8.371 -29.222 1.00 0.00 C ATOM 604 SG CYS A 764 32.165 6.773 -28.606 1.00 0.00 S ATOM 0 H CYS A 764 30.172 9.625 -27.601 1.00 0.00 H new ATOM 0 HA CYS A 764 33.131 9.229 -27.968 1.00 0.00 H new ATOM 0 HB2 CYS A 764 30.485 8.403 -29.193 1.00 0.00 H new ATOM 0 HB3 CYS A 764 31.869 8.502 -30.263 1.00 0.00 H new ATOM 609 N ALA A 765 33.517 11.035 -29.672 1.00 0.00 N ATOM 610 CA ALA A 765 33.743 12.269 -30.490 1.00 0.00 C ATOM 611 C ALA A 765 32.555 12.513 -31.430 1.00 0.00 C ATOM 612 O ALA A 765 31.784 11.613 -31.701 1.00 0.00 O ATOM 613 CB ALA A 765 35.009 11.984 -31.292 1.00 0.00 C ATOM 0 H ALA A 765 34.341 10.451 -29.530 1.00 0.00 H new ATOM 0 HA ALA A 765 33.843 13.160 -29.870 1.00 0.00 H new ATOM 0 HB1 ALA A 765 35.243 12.844 -31.920 1.00 0.00 H new ATOM 0 HB2 ALA A 765 35.838 11.797 -30.609 1.00 0.00 H new ATOM 0 HB3 ALA A 765 34.852 11.108 -31.921 1.00 0.00 H new ATOM 619 N PRO A 766 32.448 13.728 -31.893 1.00 0.00 N ATOM 620 CA PRO A 766 31.346 14.096 -32.810 1.00 0.00 C ATOM 621 C PRO A 766 31.549 13.432 -34.174 1.00 0.00 C ATOM 622 O PRO A 766 32.346 13.871 -34.980 1.00 0.00 O ATOM 623 CB PRO A 766 31.448 15.613 -32.910 1.00 0.00 C ATOM 624 CG PRO A 766 32.875 15.927 -32.579 1.00 0.00 C ATOM 625 CD PRO A 766 33.344 14.856 -31.621 1.00 0.00 C ATOM 0 HA PRO A 766 30.366 13.771 -32.460 1.00 0.00 H new ATOM 0 HB2 PRO A 766 31.189 15.961 -33.910 1.00 0.00 H new ATOM 0 HB3 PRO A 766 30.765 16.101 -32.215 1.00 0.00 H new ATOM 0 HG2 PRO A 766 33.488 15.936 -33.480 1.00 0.00 H new ATOM 0 HG3 PRO A 766 32.959 16.915 -32.126 1.00 0.00 H new ATOM 0 HD2 PRO A 766 34.386 14.590 -31.797 1.00 0.00 H new ATOM 0 HD3 PRO A 766 33.269 15.185 -30.585 1.00 0.00 H new ATOM 633 N GLY A 767 30.831 12.375 -34.435 1.00 0.00 N ATOM 634 CA GLY A 767 30.973 11.673 -35.741 1.00 0.00 C ATOM 635 C GLY A 767 31.109 10.172 -35.486 1.00 0.00 C ATOM 636 O GLY A 767 30.918 9.358 -36.369 1.00 0.00 O ATOM 0 H GLY A 767 30.149 11.966 -33.797 1.00 0.00 H new ATOM 0 HA2 GLY A 767 30.106 11.871 -36.371 1.00 0.00 H new ATOM 0 HA3 GLY A 767 31.847 12.045 -36.275 1.00 0.00 H new ATOM 640 N GLN A 768 31.440 9.801 -34.277 1.00 0.00 N ATOM 641 CA GLN A 768 31.590 8.354 -33.949 1.00 0.00 C ATOM 642 C GLN A 768 30.355 7.865 -33.185 1.00 0.00 C ATOM 643 O GLN A 768 30.091 8.292 -32.078 1.00 0.00 O ATOM 644 CB GLN A 768 32.838 8.274 -33.066 1.00 0.00 C ATOM 645 CG GLN A 768 34.092 8.301 -33.944 1.00 0.00 C ATOM 646 CD GLN A 768 35.250 8.939 -33.170 1.00 0.00 C ATOM 647 OE1 GLN A 768 35.590 10.083 -33.397 1.00 0.00 O ATOM 648 NE2 GLN A 768 35.874 8.242 -32.259 1.00 0.00 N ATOM 0 H GLN A 768 31.613 10.440 -33.501 1.00 0.00 H new ATOM 0 HA GLN A 768 31.685 7.731 -34.839 1.00 0.00 H new ATOM 0 HB2 GLN A 768 32.854 9.109 -32.366 1.00 0.00 H new ATOM 0 HB3 GLN A 768 32.817 7.360 -32.472 1.00 0.00 H new ATOM 0 HG2 GLN A 768 34.358 7.288 -34.246 1.00 0.00 H new ATOM 0 HG3 GLN A 768 33.897 8.865 -34.856 1.00 0.00 H new ATOM 0 HE21 GLN A 768 35.589 7.281 -32.068 1.00 0.00 H new ATOM 0 HE22 GLN A 768 36.646 8.658 -31.739 1.00 0.00 H new ATOM 657 N THR A 769 29.598 6.975 -33.764 1.00 0.00 N ATOM 658 CA THR A 769 28.380 6.464 -33.064 1.00 0.00 C ATOM 659 C THR A 769 28.603 5.033 -32.570 1.00 0.00 C ATOM 660 O THR A 769 29.331 4.265 -33.167 1.00 0.00 O ATOM 661 CB THR A 769 27.277 6.489 -34.121 1.00 0.00 C ATOM 662 OG1 THR A 769 27.857 6.373 -35.412 1.00 0.00 O ATOM 663 CG2 THR A 769 26.501 7.801 -34.024 1.00 0.00 C ATOM 0 H THR A 769 29.767 6.579 -34.689 1.00 0.00 H new ATOM 0 HA THR A 769 28.131 7.066 -32.190 1.00 0.00 H new ATOM 0 HB THR A 769 26.595 5.655 -33.952 1.00 0.00 H new ATOM 0 HG1 THR A 769 27.150 6.387 -36.091 1.00 0.00 H new ATOM 0 HG21 THR A 769 25.715 7.816 -34.779 1.00 0.00 H new ATOM 0 HG22 THR A 769 26.054 7.887 -33.034 1.00 0.00 H new ATOM 0 HG23 THR A 769 27.179 8.638 -34.190 1.00 0.00 H new ATOM 671 N ILE A 770 27.973 4.667 -31.485 1.00 0.00 N ATOM 672 CA ILE A 770 28.147 3.284 -30.950 1.00 0.00 C ATOM 673 C ILE A 770 27.408 2.293 -31.846 1.00 0.00 C ATOM 674 O ILE A 770 26.410 2.624 -32.457 1.00 0.00 O ATOM 675 CB ILE A 770 27.521 3.307 -29.555 1.00 0.00 C ATOM 676 CG1 ILE A 770 28.456 4.033 -28.583 1.00 0.00 C ATOM 677 CG2 ILE A 770 27.301 1.869 -29.072 1.00 0.00 C ATOM 678 CD1 ILE A 770 27.727 4.278 -27.260 1.00 0.00 C ATOM 0 H ILE A 770 27.346 5.265 -30.946 1.00 0.00 H new ATOM 0 HA ILE A 770 29.194 2.981 -30.916 1.00 0.00 H new ATOM 0 HB ILE A 770 26.565 3.830 -29.596 1.00 0.00 H new ATOM 0 HG12 ILE A 770 29.353 3.438 -28.411 1.00 0.00 H new ATOM 0 HG13 ILE A 770 28.780 4.981 -29.013 1.00 0.00 H new ATOM 0 HG21 ILE A 770 26.855 1.883 -28.078 1.00 0.00 H new ATOM 0 HG22 ILE A 770 26.634 1.352 -29.762 1.00 0.00 H new ATOM 0 HG23 ILE A 770 28.258 1.348 -29.033 1.00 0.00 H new ATOM 0 HD11 ILE A 770 28.392 4.795 -26.568 1.00 0.00 H new ATOM 0 HD12 ILE A 770 26.843 4.891 -27.439 1.00 0.00 H new ATOM 0 HD13 ILE A 770 27.425 3.324 -26.829 1.00 0.00 H new ATOM 690 N SER A 771 27.877 1.082 -31.934 1.00 0.00 N ATOM 691 CA SER A 771 27.182 0.088 -32.798 1.00 0.00 C ATOM 692 C SER A 771 27.164 -1.293 -32.140 1.00 0.00 C ATOM 693 O SER A 771 26.696 -2.253 -32.718 1.00 0.00 O ATOM 694 CB SER A 771 27.996 0.052 -34.089 1.00 0.00 C ATOM 695 OG SER A 771 28.922 -1.028 -34.029 1.00 0.00 O ATOM 0 H SER A 771 28.706 0.738 -31.449 1.00 0.00 H new ATOM 0 HA SER A 771 26.141 0.361 -32.971 1.00 0.00 H new ATOM 0 HB2 SER A 771 27.334 -0.068 -34.947 1.00 0.00 H new ATOM 0 HB3 SER A 771 28.527 0.994 -34.225 1.00 0.00 H new ATOM 0 HG SER A 771 29.446 -1.056 -34.857 1.00 0.00 H new ATOM 701 N ALA A 772 27.663 -1.411 -30.937 1.00 0.00 N ATOM 702 CA ALA A 772 27.655 -2.753 -30.279 1.00 0.00 C ATOM 703 C ALA A 772 28.132 -2.670 -28.826 1.00 0.00 C ATOM 704 O ALA A 772 28.986 -1.876 -28.482 1.00 0.00 O ATOM 705 CB ALA A 772 28.625 -3.597 -31.104 1.00 0.00 C ATOM 0 H ALA A 772 28.069 -0.652 -30.389 1.00 0.00 H new ATOM 0 HA ALA A 772 26.650 -3.175 -30.246 1.00 0.00 H new ATOM 0 HB1 ALA A 772 28.678 -4.602 -30.686 1.00 0.00 H new ATOM 0 HB2 ALA A 772 28.275 -3.650 -32.135 1.00 0.00 H new ATOM 0 HB3 ALA A 772 29.615 -3.141 -31.080 1.00 0.00 H new ATOM 711 N ILE A 773 27.577 -3.492 -27.973 1.00 0.00 N ATOM 712 CA ILE A 773 27.982 -3.482 -26.538 1.00 0.00 C ATOM 713 C ILE A 773 28.821 -4.732 -26.248 1.00 0.00 C ATOM 714 O ILE A 773 28.616 -5.774 -26.837 1.00 0.00 O ATOM 715 CB ILE A 773 26.671 -3.520 -25.751 1.00 0.00 C ATOM 716 CG1 ILE A 773 25.768 -2.370 -26.207 1.00 0.00 C ATOM 717 CG2 ILE A 773 26.966 -3.371 -24.258 1.00 0.00 C ATOM 718 CD1 ILE A 773 26.429 -1.035 -25.862 1.00 0.00 C ATOM 0 H ILE A 773 26.856 -4.173 -28.212 1.00 0.00 H new ATOM 0 HA ILE A 773 28.580 -2.611 -26.272 1.00 0.00 H new ATOM 0 HB ILE A 773 26.169 -4.471 -25.930 1.00 0.00 H new ATOM 0 HG12 ILE A 773 25.593 -2.435 -27.281 1.00 0.00 H new ATOM 0 HG13 ILE A 773 24.795 -2.443 -25.721 1.00 0.00 H new ATOM 0 HG21 ILE A 773 26.031 -3.398 -23.698 1.00 0.00 H new ATOM 0 HG22 ILE A 773 27.609 -4.188 -23.931 1.00 0.00 H new ATOM 0 HG23 ILE A 773 27.468 -2.420 -24.079 1.00 0.00 H new ATOM 0 HD11 ILE A 773 25.787 -0.216 -26.186 1.00 0.00 H new ATOM 0 HD12 ILE A 773 26.581 -0.972 -24.784 1.00 0.00 H new ATOM 0 HD13 ILE A 773 27.391 -0.964 -26.369 1.00 0.00 H new ATOM 730 N LYS A 774 29.758 -4.643 -25.351 1.00 0.00 N ATOM 731 CA LYS A 774 30.597 -5.838 -25.042 1.00 0.00 C ATOM 732 C LYS A 774 30.338 -6.330 -23.617 1.00 0.00 C ATOM 733 O LYS A 774 30.540 -7.488 -23.308 1.00 0.00 O ATOM 734 CB LYS A 774 32.039 -5.360 -25.185 1.00 0.00 C ATOM 735 CG LYS A 774 32.908 -6.515 -25.683 1.00 0.00 C ATOM 736 CD LYS A 774 32.418 -6.966 -27.061 1.00 0.00 C ATOM 737 CE LYS A 774 33.590 -7.546 -27.854 1.00 0.00 C ATOM 738 NZ LYS A 774 33.985 -8.775 -27.113 1.00 0.00 N ATOM 0 H LYS A 774 29.982 -3.802 -24.819 1.00 0.00 H new ATOM 0 HA LYS A 774 30.372 -6.672 -25.706 1.00 0.00 H new ATOM 0 HB2 LYS A 774 32.090 -4.525 -25.883 1.00 0.00 H new ATOM 0 HB3 LYS A 774 32.411 -4.997 -24.227 1.00 0.00 H new ATOM 0 HG2 LYS A 774 33.950 -6.201 -25.741 1.00 0.00 H new ATOM 0 HG3 LYS A 774 32.864 -7.347 -24.980 1.00 0.00 H new ATOM 0 HD2 LYS A 774 31.633 -7.714 -26.953 1.00 0.00 H new ATOM 0 HD3 LYS A 774 31.983 -6.123 -27.598 1.00 0.00 H new ATOM 0 HE2 LYS A 774 33.297 -7.779 -28.878 1.00 0.00 H new ATOM 0 HE3 LYS A 774 34.416 -6.838 -27.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 34.514 -9.408 -27.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 34.585 -8.515 -26.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 33.133 -9.262 -26.770 1.00 0.00 H new ATOM 752 N PHE A 775 29.894 -5.470 -22.746 1.00 0.00 N ATOM 753 CA PHE A 775 29.631 -5.916 -21.349 1.00 0.00 C ATOM 754 C PHE A 775 28.899 -4.826 -20.560 1.00 0.00 C ATOM 755 O PHE A 775 28.855 -3.678 -20.956 1.00 0.00 O ATOM 756 CB PHE A 775 31.013 -6.175 -20.749 1.00 0.00 C ATOM 757 CG PHE A 775 30.862 -6.805 -19.386 1.00 0.00 C ATOM 758 CD1 PHE A 775 30.558 -8.168 -19.271 1.00 0.00 C ATOM 759 CD2 PHE A 775 31.027 -6.026 -18.234 1.00 0.00 C ATOM 760 CE1 PHE A 775 30.419 -8.749 -18.005 1.00 0.00 C ATOM 761 CE2 PHE A 775 30.888 -6.609 -16.969 1.00 0.00 C ATOM 762 CZ PHE A 775 30.585 -7.969 -16.854 1.00 0.00 C ATOM 0 H PHE A 775 29.703 -4.486 -22.937 1.00 0.00 H new ATOM 0 HA PHE A 775 28.997 -6.802 -21.317 1.00 0.00 H new ATOM 0 HB2 PHE A 775 31.587 -6.831 -21.403 1.00 0.00 H new ATOM 0 HB3 PHE A 775 31.567 -5.240 -20.669 1.00 0.00 H new ATOM 0 HD1 PHE A 775 30.431 -8.770 -20.159 1.00 0.00 H new ATOM 0 HD2 PHE A 775 31.261 -4.975 -18.322 1.00 0.00 H new ATOM 0 HE1 PHE A 775 30.184 -9.799 -17.916 1.00 0.00 H new ATOM 0 HE2 PHE A 775 31.015 -6.008 -16.081 1.00 0.00 H new ATOM 0 HZ PHE A 775 30.479 -8.418 -15.877 1.00 0.00 H new ATOM 772 N ALA A 776 28.328 -5.188 -19.448 1.00 0.00 N ATOM 773 CA ALA A 776 27.592 -4.195 -18.615 1.00 0.00 C ATOM 774 C ALA A 776 26.923 -4.913 -17.440 1.00 0.00 C ATOM 775 O ALA A 776 25.719 -5.077 -17.403 1.00 0.00 O ATOM 776 CB ALA A 776 26.545 -3.590 -19.548 1.00 0.00 C ATOM 0 H ALA A 776 28.339 -6.138 -19.076 1.00 0.00 H new ATOM 0 HA ALA A 776 28.244 -3.428 -18.198 1.00 0.00 H new ATOM 0 HB1 ALA A 776 25.960 -2.847 -19.006 1.00 0.00 H new ATOM 0 HB2 ALA A 776 27.042 -3.114 -20.393 1.00 0.00 H new ATOM 0 HB3 ALA A 776 25.884 -4.377 -19.912 1.00 0.00 H new ATOM 782 N SER A 777 27.697 -5.344 -16.480 1.00 0.00 N ATOM 783 CA SER A 777 27.112 -6.056 -15.303 1.00 0.00 C ATOM 784 C SER A 777 26.810 -5.080 -14.169 1.00 0.00 C ATOM 785 O SER A 777 27.420 -4.036 -14.052 1.00 0.00 O ATOM 786 CB SER A 777 28.184 -7.050 -14.874 1.00 0.00 C ATOM 787 OG SER A 777 28.066 -7.293 -13.476 1.00 0.00 O ATOM 0 H SER A 777 28.711 -5.234 -16.459 1.00 0.00 H new ATOM 0 HA SER A 777 26.169 -6.543 -15.552 1.00 0.00 H new ATOM 0 HB2 SER A 777 28.074 -7.983 -15.428 1.00 0.00 H new ATOM 0 HB3 SER A 777 29.174 -6.657 -15.104 1.00 0.00 H new ATOM 0 HG SER A 777 27.585 -8.134 -13.330 1.00 0.00 H new ATOM 793 N PHE A 778 25.870 -5.417 -13.330 1.00 0.00 N ATOM 794 CA PHE A 778 25.519 -4.518 -12.198 1.00 0.00 C ATOM 795 C PHE A 778 25.621 -5.283 -10.873 1.00 0.00 C ATOM 796 O PHE A 778 24.698 -5.957 -10.460 1.00 0.00 O ATOM 797 CB PHE A 778 24.074 -4.092 -12.463 1.00 0.00 C ATOM 798 CG PHE A 778 23.492 -3.483 -11.209 1.00 0.00 C ATOM 799 CD1 PHE A 778 23.683 -2.124 -10.939 1.00 0.00 C ATOM 800 CD2 PHE A 778 22.763 -4.279 -10.318 1.00 0.00 C ATOM 801 CE1 PHE A 778 23.146 -1.559 -9.776 1.00 0.00 C ATOM 802 CE2 PHE A 778 22.225 -3.714 -9.156 1.00 0.00 C ATOM 803 CZ PHE A 778 22.417 -2.354 -8.885 1.00 0.00 C ATOM 0 H PHE A 778 25.329 -6.280 -13.381 1.00 0.00 H new ATOM 0 HA PHE A 778 26.187 -3.660 -12.125 1.00 0.00 H new ATOM 0 HB2 PHE A 778 24.040 -3.371 -13.280 1.00 0.00 H new ATOM 0 HB3 PHE A 778 23.480 -4.952 -12.772 1.00 0.00 H new ATOM 0 HD1 PHE A 778 24.245 -1.510 -11.628 1.00 0.00 H new ATOM 0 HD2 PHE A 778 22.616 -5.328 -10.527 1.00 0.00 H new ATOM 0 HE1 PHE A 778 23.294 -0.510 -9.567 1.00 0.00 H new ATOM 0 HE2 PHE A 778 21.662 -4.327 -8.468 1.00 0.00 H new ATOM 0 HZ PHE A 778 22.002 -1.918 -7.988 1.00 0.00 H new ATOM 813 N GLY A 779 26.738 -5.189 -10.209 1.00 0.00 N ATOM 814 CA GLY A 779 26.898 -5.910 -8.913 1.00 0.00 C ATOM 815 C GLY A 779 28.386 -6.077 -8.602 1.00 0.00 C ATOM 816 O GLY A 779 29.024 -5.184 -8.082 1.00 0.00 O ATOM 0 H GLY A 779 27.548 -4.645 -10.506 1.00 0.00 H new ATOM 0 HA2 GLY A 779 26.409 -5.355 -8.113 1.00 0.00 H new ATOM 0 HA3 GLY A 779 26.415 -6.886 -8.965 1.00 0.00 H new ATOM 820 N THR A 780 28.944 -7.214 -8.916 1.00 0.00 N ATOM 821 CA THR A 780 30.394 -7.433 -8.634 1.00 0.00 C ATOM 822 C THR A 780 31.091 -8.028 -9.864 1.00 0.00 C ATOM 823 O THR A 780 31.119 -9.229 -10.042 1.00 0.00 O ATOM 824 CB THR A 780 30.424 -8.422 -7.470 1.00 0.00 C ATOM 825 OG1 THR A 780 29.894 -9.670 -7.896 1.00 0.00 O ATOM 826 CG2 THR A 780 29.586 -7.877 -6.313 1.00 0.00 C ATOM 0 H THR A 780 28.462 -7.999 -9.354 1.00 0.00 H new ATOM 0 HA THR A 780 30.913 -6.505 -8.395 1.00 0.00 H new ATOM 0 HB THR A 780 31.453 -8.559 -7.137 1.00 0.00 H new ATOM 0 HG1 THR A 780 30.471 -10.050 -8.591 1.00 0.00 H new ATOM 0 HG21 THR A 780 29.608 -8.584 -5.483 1.00 0.00 H new ATOM 0 HG22 THR A 780 29.995 -6.921 -5.986 1.00 0.00 H new ATOM 0 HG23 THR A 780 28.557 -7.738 -6.643 1.00 0.00 H new ATOM 834 N PRO A 781 31.629 -7.156 -10.672 1.00 0.00 N ATOM 835 CA PRO A 781 32.336 -7.590 -11.898 1.00 0.00 C ATOM 836 C PRO A 781 33.713 -8.171 -11.548 1.00 0.00 C ATOM 837 O PRO A 781 34.149 -8.123 -10.415 1.00 0.00 O ATOM 838 CB PRO A 781 32.484 -6.307 -12.703 1.00 0.00 C ATOM 839 CG PRO A 781 32.441 -5.202 -11.689 1.00 0.00 C ATOM 840 CD PRO A 781 31.619 -5.699 -10.521 1.00 0.00 C ATOM 0 HA PRO A 781 31.804 -8.371 -12.441 1.00 0.00 H new ATOM 0 HB2 PRO A 781 33.422 -6.296 -13.258 1.00 0.00 H new ATOM 0 HB3 PRO A 781 31.680 -6.204 -13.432 1.00 0.00 H new ATOM 0 HG2 PRO A 781 33.448 -4.937 -11.366 1.00 0.00 H new ATOM 0 HG3 PRO A 781 31.997 -4.304 -12.118 1.00 0.00 H new ATOM 0 HD2 PRO A 781 32.054 -5.394 -9.569 1.00 0.00 H new ATOM 0 HD3 PRO A 781 30.604 -5.302 -10.550 1.00 0.00 H new ATOM 848 N LEU A 782 34.397 -8.721 -12.516 1.00 0.00 N ATOM 849 CA LEU A 782 35.747 -9.305 -12.243 1.00 0.00 C ATOM 850 C LEU A 782 36.721 -8.932 -13.366 1.00 0.00 C ATOM 851 O LEU A 782 36.528 -9.288 -14.511 1.00 0.00 O ATOM 852 CB LEU A 782 35.525 -10.818 -12.207 1.00 0.00 C ATOM 853 CG LEU A 782 36.523 -11.459 -11.241 1.00 0.00 C ATOM 854 CD1 LEU A 782 36.099 -12.899 -10.949 1.00 0.00 C ATOM 855 CD2 LEU A 782 37.917 -11.459 -11.873 1.00 0.00 C ATOM 0 H LEU A 782 34.082 -8.792 -13.483 1.00 0.00 H new ATOM 0 HA LEU A 782 36.177 -8.934 -11.313 1.00 0.00 H new ATOM 0 HB2 LEU A 782 34.505 -11.039 -11.892 1.00 0.00 H new ATOM 0 HB3 LEU A 782 35.648 -11.238 -13.205 1.00 0.00 H new ATOM 0 HG LEU A 782 36.544 -10.890 -10.312 1.00 0.00 H new ATOM 0 HD11 LEU A 782 36.810 -13.355 -10.261 1.00 0.00 H new ATOM 0 HD12 LEU A 782 35.106 -12.902 -10.499 1.00 0.00 H new ATOM 0 HD13 LEU A 782 36.078 -13.468 -11.879 1.00 0.00 H new ATOM 0 HD21 LEU A 782 38.628 -11.916 -11.185 1.00 0.00 H new ATOM 0 HD22 LEU A 782 37.895 -12.028 -12.803 1.00 0.00 H new ATOM 0 HD23 LEU A 782 38.222 -10.434 -12.082 1.00 0.00 H new ATOM 867 N GLY A 783 37.765 -8.220 -13.047 1.00 0.00 N ATOM 868 CA GLY A 783 38.748 -7.827 -14.097 1.00 0.00 C ATOM 869 C GLY A 783 38.409 -6.427 -14.609 1.00 0.00 C ATOM 870 O GLY A 783 37.497 -5.784 -14.127 1.00 0.00 O ATOM 0 H GLY A 783 37.981 -7.893 -12.105 1.00 0.00 H new ATOM 0 HA2 GLY A 783 39.759 -7.843 -13.689 1.00 0.00 H new ATOM 0 HA3 GLY A 783 38.725 -8.543 -14.919 1.00 0.00 H new ATOM 874 N THR A 784 39.133 -5.948 -15.581 1.00 0.00 N ATOM 875 CA THR A 784 38.846 -4.586 -16.119 1.00 0.00 C ATOM 876 C THR A 784 38.447 -4.674 -17.594 1.00 0.00 C ATOM 877 O THR A 784 38.060 -5.719 -18.079 1.00 0.00 O ATOM 878 CB THR A 784 40.154 -3.813 -15.961 1.00 0.00 C ATOM 879 OG1 THR A 784 41.232 -4.731 -15.822 1.00 0.00 O ATOM 880 CG2 THR A 784 40.074 -2.925 -14.720 1.00 0.00 C ATOM 0 H THR A 784 39.909 -6.438 -16.026 1.00 0.00 H new ATOM 0 HA THR A 784 38.022 -4.101 -15.596 1.00 0.00 H new ATOM 0 HB THR A 784 40.319 -3.191 -16.841 1.00 0.00 H new ATOM 0 HG1 THR A 784 42.072 -4.236 -15.722 1.00 0.00 H new ATOM 0 HG21 THR A 784 41.007 -2.373 -14.607 1.00 0.00 H new ATOM 0 HG22 THR A 784 39.248 -2.222 -14.828 1.00 0.00 H new ATOM 0 HG23 THR A 784 39.910 -3.545 -13.839 1.00 0.00 H new ATOM 888 N CYS A 785 38.535 -3.588 -18.308 1.00 0.00 N ATOM 889 CA CYS A 785 38.158 -3.615 -19.750 1.00 0.00 C ATOM 890 C CYS A 785 39.044 -4.605 -20.511 1.00 0.00 C ATOM 891 O CYS A 785 40.250 -4.462 -20.561 1.00 0.00 O ATOM 892 CB CYS A 785 38.398 -2.193 -20.248 1.00 0.00 C ATOM 893 SG CYS A 785 37.154 -1.778 -21.497 1.00 0.00 S ATOM 0 H CYS A 785 38.851 -2.684 -17.958 1.00 0.00 H new ATOM 0 HA CYS A 785 37.126 -3.932 -19.900 1.00 0.00 H new ATOM 0 HB2 CYS A 785 38.344 -1.490 -19.417 1.00 0.00 H new ATOM 0 HB3 CYS A 785 39.398 -2.108 -20.672 1.00 0.00 H new ATOM 898 N GLY A 786 38.457 -5.609 -21.101 1.00 0.00 N ATOM 899 CA GLY A 786 39.267 -6.606 -21.857 1.00 0.00 C ATOM 900 C GLY A 786 39.173 -7.967 -21.170 1.00 0.00 C ATOM 901 O GLY A 786 39.278 -9.000 -21.801 1.00 0.00 O ATOM 0 H GLY A 786 37.452 -5.783 -21.093 1.00 0.00 H new ATOM 0 HA2 GLY A 786 38.907 -6.679 -22.883 1.00 0.00 H new ATOM 0 HA3 GLY A 786 40.307 -6.283 -21.906 1.00 0.00 H new ATOM 905 N THR A 787 38.977 -7.979 -19.881 1.00 0.00 N ATOM 906 CA THR A 787 38.876 -9.279 -19.156 1.00 0.00 C ATOM 907 C THR A 787 37.695 -9.253 -18.179 1.00 0.00 C ATOM 908 O THR A 787 37.745 -9.836 -17.115 1.00 0.00 O ATOM 909 CB THR A 787 40.198 -9.413 -18.399 1.00 0.00 C ATOM 910 OG1 THR A 787 40.232 -10.666 -17.729 1.00 0.00 O ATOM 911 CG2 THR A 787 40.320 -8.282 -17.378 1.00 0.00 C ATOM 0 H THR A 787 38.882 -7.147 -19.298 1.00 0.00 H new ATOM 0 HA THR A 787 38.707 -10.117 -19.832 1.00 0.00 H new ATOM 0 HB THR A 787 41.029 -9.354 -19.102 1.00 0.00 H new ATOM 0 HG1 THR A 787 39.365 -10.833 -17.303 1.00 0.00 H new ATOM 0 HG21 THR A 787 41.263 -8.378 -16.839 1.00 0.00 H new ATOM 0 HG22 THR A 787 40.293 -7.322 -17.894 1.00 0.00 H new ATOM 0 HG23 THR A 787 39.491 -8.338 -16.672 1.00 0.00 H new ATOM 919 N PHE A 788 36.634 -8.580 -18.534 1.00 0.00 N ATOM 920 CA PHE A 788 35.453 -8.519 -17.624 1.00 0.00 C ATOM 921 C PHE A 788 34.830 -9.912 -17.482 1.00 0.00 C ATOM 922 O PHE A 788 34.601 -10.601 -18.456 1.00 0.00 O ATOM 923 CB PHE A 788 34.477 -7.557 -18.302 1.00 0.00 C ATOM 924 CG PHE A 788 34.617 -6.183 -17.689 1.00 0.00 C ATOM 925 CD1 PHE A 788 34.637 -6.038 -16.297 1.00 0.00 C ATOM 926 CD2 PHE A 788 34.727 -5.056 -18.512 1.00 0.00 C ATOM 927 CE1 PHE A 788 34.768 -4.765 -15.728 1.00 0.00 C ATOM 928 CE2 PHE A 788 34.858 -3.782 -17.943 1.00 0.00 C ATOM 929 CZ PHE A 788 34.878 -3.637 -16.551 1.00 0.00 C ATOM 0 H PHE A 788 36.533 -8.071 -19.412 1.00 0.00 H new ATOM 0 HA PHE A 788 35.718 -8.184 -16.621 1.00 0.00 H new ATOM 0 HB2 PHE A 788 34.679 -7.512 -19.372 1.00 0.00 H new ATOM 0 HB3 PHE A 788 33.455 -7.917 -18.185 1.00 0.00 H new ATOM 0 HD1 PHE A 788 34.551 -6.907 -15.662 1.00 0.00 H new ATOM 0 HD2 PHE A 788 34.711 -5.168 -19.586 1.00 0.00 H new ATOM 0 HE1 PHE A 788 34.784 -4.653 -14.654 1.00 0.00 H new ATOM 0 HE2 PHE A 788 34.943 -2.913 -18.578 1.00 0.00 H new ATOM 0 HZ PHE A 788 34.978 -2.656 -16.112 1.00 0.00 H new ATOM 939 N GLN A 789 34.555 -10.331 -16.277 1.00 0.00 N ATOM 940 CA GLN A 789 33.946 -11.678 -16.077 1.00 0.00 C ATOM 941 C GLN A 789 32.876 -11.621 -14.983 1.00 0.00 C ATOM 942 O GLN A 789 32.916 -10.783 -14.105 1.00 0.00 O ATOM 943 CB GLN A 789 35.108 -12.575 -15.646 1.00 0.00 C ATOM 944 CG GLN A 789 35.760 -13.194 -16.883 1.00 0.00 C ATOM 945 CD GLN A 789 35.603 -14.716 -16.837 1.00 0.00 C ATOM 946 OE1 GLN A 789 35.309 -15.337 -17.839 1.00 0.00 O ATOM 947 NE2 GLN A 789 35.789 -15.345 -15.710 1.00 0.00 N ATOM 0 H GLN A 789 34.725 -9.800 -15.423 1.00 0.00 H new ATOM 0 HA GLN A 789 33.456 -12.048 -16.978 1.00 0.00 H new ATOM 0 HB2 GLN A 789 35.842 -11.994 -15.087 1.00 0.00 H new ATOM 0 HB3 GLN A 789 34.748 -13.360 -14.980 1.00 0.00 H new ATOM 0 HG2 GLN A 789 35.298 -12.798 -17.787 1.00 0.00 H new ATOM 0 HG3 GLN A 789 36.816 -12.928 -16.922 1.00 0.00 H new ATOM 0 HE21 GLN A 789 36.036 -14.823 -14.869 1.00 0.00 H new ATOM 0 HE22 GLN A 789 35.688 -16.359 -15.669 1.00 0.00 H new ATOM 956 N GLN A 790 31.921 -12.509 -15.031 1.00 0.00 N ATOM 957 CA GLN A 790 30.845 -12.510 -13.995 1.00 0.00 C ATOM 958 C GLN A 790 31.425 -12.857 -12.620 1.00 0.00 C ATOM 959 O GLN A 790 31.925 -13.943 -12.403 1.00 0.00 O ATOM 960 CB GLN A 790 29.867 -13.592 -14.449 1.00 0.00 C ATOM 961 CG GLN A 790 28.514 -12.960 -14.771 1.00 0.00 C ATOM 962 CD GLN A 790 28.709 -11.812 -15.762 1.00 0.00 C ATOM 963 OE1 GLN A 790 28.814 -10.666 -15.369 1.00 0.00 O ATOM 964 NE2 GLN A 790 28.763 -12.070 -17.041 1.00 0.00 N ATOM 0 H GLN A 790 31.838 -13.235 -15.743 1.00 0.00 H new ATOM 0 HA GLN A 790 30.367 -11.535 -13.898 1.00 0.00 H new ATOM 0 HB2 GLN A 790 30.258 -14.104 -15.328 1.00 0.00 H new ATOM 0 HB3 GLN A 790 29.752 -14.343 -13.667 1.00 0.00 H new ATOM 0 HG2 GLN A 790 27.843 -13.708 -15.193 1.00 0.00 H new ATOM 0 HG3 GLN A 790 28.047 -12.591 -13.858 1.00 0.00 H new ATOM 0 HE21 GLN A 790 28.675 -13.031 -17.372 1.00 0.00 H new ATOM 0 HE22 GLN A 790 28.893 -11.311 -17.709 1.00 0.00 H new ATOM 973 N GLY A 791 31.361 -11.945 -11.688 1.00 0.00 N ATOM 974 CA GLY A 791 31.910 -12.226 -10.332 1.00 0.00 C ATOM 975 C GLY A 791 31.105 -13.352 -9.674 1.00 0.00 C ATOM 976 O GLY A 791 31.234 -14.508 -10.028 1.00 0.00 O ATOM 0 H GLY A 791 30.952 -11.018 -11.808 1.00 0.00 H new ATOM 0 HA2 GLY A 791 32.960 -12.511 -10.406 1.00 0.00 H new ATOM 0 HA3 GLY A 791 31.866 -11.327 -9.717 1.00 0.00 H new ATOM 980 N GLU A 792 30.276 -13.023 -8.720 1.00 0.00 N ATOM 981 CA GLU A 792 29.463 -14.074 -8.038 1.00 0.00 C ATOM 982 C GLU A 792 27.974 -13.702 -8.062 1.00 0.00 C ATOM 983 O GLU A 792 27.111 -14.556 -8.007 1.00 0.00 O ATOM 984 CB GLU A 792 29.978 -14.102 -6.602 1.00 0.00 C ATOM 985 CG GLU A 792 30.722 -15.415 -6.350 1.00 0.00 C ATOM 986 CD GLU A 792 29.721 -16.572 -6.322 1.00 0.00 C ATOM 987 OE1 GLU A 792 29.510 -17.172 -7.364 1.00 0.00 O ATOM 988 OE2 GLU A 792 29.182 -16.838 -5.260 1.00 0.00 O ATOM 0 H GLU A 792 30.126 -12.072 -8.383 1.00 0.00 H new ATOM 0 HA GLU A 792 29.555 -15.043 -8.528 1.00 0.00 H new ATOM 0 HB2 GLU A 792 30.643 -13.256 -6.427 1.00 0.00 H new ATOM 0 HB3 GLU A 792 29.146 -14.004 -5.904 1.00 0.00 H new ATOM 0 HG2 GLU A 792 31.464 -15.581 -7.131 1.00 0.00 H new ATOM 0 HG3 GLU A 792 31.261 -15.364 -5.404 1.00 0.00 H new ATOM 995 N CYS A 793 27.668 -12.435 -8.141 1.00 0.00 N ATOM 996 CA CYS A 793 26.237 -12.013 -8.168 1.00 0.00 C ATOM 997 C CYS A 793 25.811 -11.710 -9.605 1.00 0.00 C ATOM 998 O CYS A 793 25.249 -12.543 -10.286 1.00 0.00 O ATOM 999 CB CYS A 793 26.183 -10.743 -7.318 1.00 0.00 C ATOM 1000 SG CYS A 793 26.516 -11.155 -5.588 1.00 0.00 S ATOM 0 H CYS A 793 28.346 -11.674 -8.188 1.00 0.00 H new ATOM 0 HA CYS A 793 25.568 -12.786 -7.789 1.00 0.00 H new ATOM 0 HB2 CYS A 793 26.916 -10.021 -7.678 1.00 0.00 H new ATOM 0 HB3 CYS A 793 25.203 -10.274 -7.408 1.00 0.00 H new ATOM 1005 N HIS A 794 26.080 -10.521 -10.067 1.00 0.00 N ATOM 1006 CA HIS A 794 25.697 -10.149 -11.459 1.00 0.00 C ATOM 1007 C HIS A 794 24.188 -10.296 -11.663 1.00 0.00 C ATOM 1008 O HIS A 794 23.649 -11.383 -11.619 1.00 0.00 O ATOM 1009 CB HIS A 794 26.453 -11.128 -12.363 1.00 0.00 C ATOM 1010 CG HIS A 794 26.107 -10.843 -13.799 1.00 0.00 C ATOM 1011 ND1 HIS A 794 26.640 -9.759 -14.480 1.00 0.00 N ATOM 1012 CD2 HIS A 794 25.278 -11.474 -14.692 1.00 0.00 C ATOM 1013 CE1 HIS A 794 26.128 -9.769 -15.722 1.00 0.00 C ATOM 1014 NE2 HIS A 794 25.294 -10.797 -15.905 1.00 0.00 N ATOM 0 H HIS A 794 26.551 -9.787 -9.538 1.00 0.00 H new ATOM 0 HA HIS A 794 25.946 -9.111 -11.681 1.00 0.00 H new ATOM 0 HB2 HIS A 794 27.527 -11.029 -12.209 1.00 0.00 H new ATOM 0 HB3 HIS A 794 26.188 -12.154 -12.109 1.00 0.00 H new ATOM 0 HD2 HIS A 794 24.700 -12.362 -14.483 1.00 0.00 H new ATOM 0 HE1 HIS A 794 26.362 -9.036 -16.480 1.00 0.00 H new ATOM 0 HE2 HIS A 794 24.780 -11.034 -16.753 1.00 0.00 H new ATOM 1022 N SER A 795 23.501 -9.206 -11.879 1.00 0.00 N ATOM 1023 CA SER A 795 22.027 -9.286 -12.088 1.00 0.00 C ATOM 1024 C SER A 795 21.735 -10.152 -13.328 1.00 0.00 C ATOM 1025 O SER A 795 22.194 -11.270 -13.428 1.00 0.00 O ATOM 1026 CB SER A 795 21.582 -7.840 -12.311 1.00 0.00 C ATOM 1027 OG SER A 795 22.168 -7.346 -13.511 1.00 0.00 O ATOM 0 H SER A 795 23.896 -8.266 -11.920 1.00 0.00 H new ATOM 0 HA SER A 795 21.500 -9.739 -11.248 1.00 0.00 H new ATOM 0 HB2 SER A 795 20.495 -7.788 -12.375 1.00 0.00 H new ATOM 0 HB3 SER A 795 21.881 -7.221 -11.465 1.00 0.00 H new ATOM 0 HG SER A 795 21.883 -6.420 -13.657 1.00 0.00 H new ATOM 1033 N ILE A 796 20.976 -9.650 -14.274 1.00 0.00 N ATOM 1034 CA ILE A 796 20.679 -10.471 -15.493 1.00 0.00 C ATOM 1035 C ILE A 796 20.514 -9.566 -16.733 1.00 0.00 C ATOM 1036 O ILE A 796 20.822 -9.963 -17.840 1.00 0.00 O ATOM 1037 CB ILE A 796 19.370 -11.234 -15.198 1.00 0.00 C ATOM 1038 CG1 ILE A 796 19.229 -11.494 -13.690 1.00 0.00 C ATOM 1039 CG2 ILE A 796 19.404 -12.576 -15.930 1.00 0.00 C ATOM 1040 CD1 ILE A 796 18.065 -12.459 -13.445 1.00 0.00 C ATOM 0 H ILE A 796 20.555 -8.721 -14.257 1.00 0.00 H new ATOM 0 HA ILE A 796 21.495 -11.160 -15.710 1.00 0.00 H new ATOM 0 HB ILE A 796 18.525 -10.634 -15.536 1.00 0.00 H new ATOM 0 HG12 ILE A 796 20.154 -11.915 -13.295 1.00 0.00 H new ATOM 0 HG13 ILE A 796 19.055 -10.556 -13.163 1.00 0.00 H new ATOM 0 HG21 ILE A 796 18.483 -13.124 -15.728 1.00 0.00 H new ATOM 0 HG22 ILE A 796 19.496 -12.403 -17.002 1.00 0.00 H new ATOM 0 HG23 ILE A 796 20.257 -13.159 -15.582 1.00 0.00 H new ATOM 0 HD11 ILE A 796 17.965 -12.644 -12.375 1.00 0.00 H new ATOM 0 HD12 ILE A 796 17.143 -12.021 -13.826 1.00 0.00 H new ATOM 0 HD13 ILE A 796 18.258 -13.400 -13.959 1.00 0.00 H new ATOM 1052 N ASN A 797 20.033 -8.357 -16.560 1.00 0.00 N ATOM 1053 CA ASN A 797 19.859 -7.446 -17.738 1.00 0.00 C ATOM 1054 C ASN A 797 21.166 -6.690 -18.016 1.00 0.00 C ATOM 1055 O ASN A 797 21.188 -5.694 -18.714 1.00 0.00 O ATOM 1056 CB ASN A 797 18.750 -6.479 -17.331 1.00 0.00 C ATOM 1057 CG ASN A 797 17.392 -7.157 -17.530 1.00 0.00 C ATOM 1058 OD1 ASN A 797 17.133 -8.202 -16.963 1.00 0.00 O ATOM 1059 ND2 ASN A 797 16.509 -6.606 -18.316 1.00 0.00 N ATOM 0 H ASN A 797 19.755 -7.963 -15.661 1.00 0.00 H new ATOM 0 HA ASN A 797 19.607 -7.988 -18.649 1.00 0.00 H new ATOM 0 HB2 ASN A 797 18.873 -6.184 -16.289 1.00 0.00 H new ATOM 0 HB3 ASN A 797 18.807 -5.569 -17.929 1.00 0.00 H new ATOM 0 HD21 ASN A 797 15.602 -7.051 -18.455 1.00 0.00 H new ATOM 0 HD22 ASN A 797 16.726 -5.730 -18.792 1.00 0.00 H new ATOM 1066 N SER A 798 22.246 -7.163 -17.461 1.00 0.00 N ATOM 1067 CA SER A 798 23.581 -6.504 -17.664 1.00 0.00 C ATOM 1068 C SER A 798 23.705 -5.881 -19.072 1.00 0.00 C ATOM 1069 O SER A 798 23.706 -4.675 -19.226 1.00 0.00 O ATOM 1070 CB SER A 798 24.590 -7.631 -17.500 1.00 0.00 C ATOM 1071 OG SER A 798 24.093 -8.566 -16.554 1.00 0.00 O ATOM 0 H SER A 798 22.268 -7.991 -16.865 1.00 0.00 H new ATOM 0 HA SER A 798 23.734 -5.686 -16.959 1.00 0.00 H new ATOM 0 HB2 SER A 798 24.765 -8.122 -18.458 1.00 0.00 H new ATOM 0 HB3 SER A 798 25.548 -7.232 -17.167 1.00 0.00 H new ATOM 0 HG SER A 798 24.264 -9.477 -16.873 1.00 0.00 H new ATOM 1077 N ASN A 799 23.808 -6.696 -20.095 1.00 0.00 N ATOM 1078 CA ASN A 799 23.934 -6.147 -21.486 1.00 0.00 C ATOM 1079 C ASN A 799 22.557 -5.841 -22.085 1.00 0.00 C ATOM 1080 O ASN A 799 22.409 -4.952 -22.896 1.00 0.00 O ATOM 1081 CB ASN A 799 24.626 -7.256 -22.283 1.00 0.00 C ATOM 1082 CG ASN A 799 26.130 -6.979 -22.347 1.00 0.00 C ATOM 1083 OD1 ASN A 799 26.806 -7.002 -21.338 1.00 0.00 O ATOM 1084 ND2 ASN A 799 26.687 -6.719 -23.500 1.00 0.00 N ATOM 0 H ASN A 799 23.810 -7.714 -20.029 1.00 0.00 H new ATOM 0 HA ASN A 799 24.492 -5.211 -21.502 1.00 0.00 H new ATOM 0 HB2 ASN A 799 24.444 -8.223 -21.814 1.00 0.00 H new ATOM 0 HB3 ASN A 799 24.212 -7.307 -23.290 1.00 0.00 H new ATOM 0 HD21 ASN A 799 27.689 -6.535 -23.553 1.00 0.00 H new ATOM 0 HD22 ASN A 799 26.120 -6.700 -24.348 1.00 0.00 H new ATOM 1091 N SER A 800 21.553 -6.567 -21.696 1.00 0.00 N ATOM 1092 CA SER A 800 20.189 -6.313 -22.248 1.00 0.00 C ATOM 1093 C SER A 800 19.786 -4.842 -22.049 1.00 0.00 C ATOM 1094 O SER A 800 18.870 -4.351 -22.680 1.00 0.00 O ATOM 1095 CB SER A 800 19.269 -7.233 -21.451 1.00 0.00 C ATOM 1096 OG SER A 800 17.939 -7.105 -21.936 1.00 0.00 O ATOM 0 H SER A 800 21.613 -7.328 -21.019 1.00 0.00 H new ATOM 0 HA SER A 800 20.138 -6.505 -23.320 1.00 0.00 H new ATOM 0 HB2 SER A 800 19.603 -8.267 -21.541 1.00 0.00 H new ATOM 0 HB3 SER A 800 19.308 -6.977 -20.392 1.00 0.00 H new ATOM 0 HG SER A 800 17.347 -7.696 -21.426 1.00 0.00 H new ATOM 1102 N VAL A 801 20.461 -4.136 -21.181 1.00 0.00 N ATOM 1103 CA VAL A 801 20.107 -2.700 -20.947 1.00 0.00 C ATOM 1104 C VAL A 801 20.905 -1.761 -21.873 1.00 0.00 C ATOM 1105 O VAL A 801 20.351 -0.885 -22.508 1.00 0.00 O ATOM 1106 CB VAL A 801 20.480 -2.444 -19.491 1.00 0.00 C ATOM 1107 CG1 VAL A 801 20.221 -0.976 -19.148 1.00 0.00 C ATOM 1108 CG2 VAL A 801 19.631 -3.337 -18.584 1.00 0.00 C ATOM 0 H VAL A 801 21.240 -4.488 -20.624 1.00 0.00 H new ATOM 0 HA VAL A 801 19.054 -2.508 -21.156 1.00 0.00 H new ATOM 0 HB VAL A 801 21.536 -2.671 -19.341 1.00 0.00 H new ATOM 0 HG11 VAL A 801 20.488 -0.793 -18.107 1.00 0.00 H new ATOM 0 HG12 VAL A 801 20.825 -0.339 -19.795 1.00 0.00 H new ATOM 0 HG13 VAL A 801 19.166 -0.748 -19.298 1.00 0.00 H new ATOM 0 HG21 VAL A 801 19.897 -3.155 -17.543 1.00 0.00 H new ATOM 0 HG22 VAL A 801 18.576 -3.110 -18.734 1.00 0.00 H new ATOM 0 HG23 VAL A 801 19.815 -4.383 -18.828 1.00 0.00 H new ATOM 1118 N LEU A 802 22.195 -1.936 -21.950 1.00 0.00 N ATOM 1119 CA LEU A 802 23.024 -1.050 -22.831 1.00 0.00 C ATOM 1120 C LEU A 802 22.851 -1.410 -24.316 1.00 0.00 C ATOM 1121 O LEU A 802 23.201 -0.645 -25.189 1.00 0.00 O ATOM 1122 CB LEU A 802 24.462 -1.295 -22.386 1.00 0.00 C ATOM 1123 CG LEU A 802 24.782 -0.393 -21.194 1.00 0.00 C ATOM 1124 CD1 LEU A 802 24.662 1.073 -21.616 1.00 0.00 C ATOM 1125 CD2 LEU A 802 23.794 -0.678 -20.061 1.00 0.00 C ATOM 0 H LEU A 802 22.715 -2.652 -21.443 1.00 0.00 H new ATOM 0 HA LEU A 802 22.730 -0.005 -22.739 1.00 0.00 H new ATOM 0 HB2 LEU A 802 24.597 -2.341 -22.112 1.00 0.00 H new ATOM 0 HB3 LEU A 802 25.149 -1.090 -23.207 1.00 0.00 H new ATOM 0 HG LEU A 802 25.798 -0.591 -20.851 1.00 0.00 H new ATOM 0 HD11 LEU A 802 24.890 1.716 -20.766 1.00 0.00 H new ATOM 0 HD12 LEU A 802 25.364 1.278 -22.425 1.00 0.00 H new ATOM 0 HD13 LEU A 802 23.646 1.271 -21.958 1.00 0.00 H new ATOM 0 HD21 LEU A 802 24.021 -0.036 -19.210 1.00 0.00 H new ATOM 0 HD22 LEU A 802 22.779 -0.480 -20.405 1.00 0.00 H new ATOM 0 HD23 LEU A 802 23.877 -1.722 -19.760 1.00 0.00 H new ATOM 1137 N GLU A 803 22.327 -2.557 -24.612 1.00 0.00 N ATOM 1138 CA GLU A 803 22.147 -2.936 -26.044 1.00 0.00 C ATOM 1139 C GLU A 803 20.869 -2.310 -26.616 1.00 0.00 C ATOM 1140 O GLU A 803 20.768 -2.059 -27.800 1.00 0.00 O ATOM 1141 CB GLU A 803 22.034 -4.461 -26.039 1.00 0.00 C ATOM 1142 CG GLU A 803 23.377 -5.076 -26.435 1.00 0.00 C ATOM 1143 CD GLU A 803 23.178 -6.004 -27.636 1.00 0.00 C ATOM 1144 OE1 GLU A 803 22.927 -7.178 -27.417 1.00 0.00 O ATOM 1145 OE2 GLU A 803 23.282 -5.525 -28.753 1.00 0.00 O ATOM 0 H GLU A 803 22.014 -3.251 -23.933 1.00 0.00 H new ATOM 0 HA GLU A 803 22.972 -2.584 -26.663 1.00 0.00 H new ATOM 0 HB2 GLU A 803 21.740 -4.811 -25.049 1.00 0.00 H new ATOM 0 HB3 GLU A 803 21.257 -4.781 -26.734 1.00 0.00 H new ATOM 0 HG2 GLU A 803 24.090 -4.290 -26.683 1.00 0.00 H new ATOM 0 HG3 GLU A 803 23.796 -5.633 -25.597 1.00 0.00 H new ATOM 1152 N ARG A 804 19.893 -2.056 -25.787 1.00 0.00 N ATOM 1153 CA ARG A 804 18.625 -1.448 -26.292 1.00 0.00 C ATOM 1154 C ARG A 804 18.610 0.087 -26.137 1.00 0.00 C ATOM 1155 O ARG A 804 17.831 0.763 -26.778 1.00 0.00 O ATOM 1156 CB ARG A 804 17.526 -2.076 -25.434 1.00 0.00 C ATOM 1157 CG ARG A 804 16.331 -2.442 -26.319 1.00 0.00 C ATOM 1158 CD ARG A 804 16.416 -3.919 -26.710 1.00 0.00 C ATOM 1159 NE ARG A 804 15.711 -4.014 -28.018 1.00 0.00 N ATOM 1160 CZ ARG A 804 16.278 -3.557 -29.101 1.00 0.00 C ATOM 1161 NH1 ARG A 804 15.554 -2.988 -30.024 1.00 0.00 N ATOM 1162 NH2 ARG A 804 17.569 -3.669 -29.260 1.00 0.00 N ATOM 0 H ARG A 804 19.917 -2.242 -24.784 1.00 0.00 H new ATOM 0 HA ARG A 804 18.497 -1.637 -27.358 1.00 0.00 H new ATOM 0 HB2 ARG A 804 17.906 -2.966 -24.932 1.00 0.00 H new ATOM 0 HB3 ARG A 804 17.215 -1.379 -24.656 1.00 0.00 H new ATOM 0 HG2 ARG A 804 15.399 -2.249 -25.787 1.00 0.00 H new ATOM 0 HG3 ARG A 804 16.323 -1.818 -27.213 1.00 0.00 H new ATOM 0 HD2 ARG A 804 17.452 -4.245 -26.796 1.00 0.00 H new ATOM 0 HD3 ARG A 804 15.943 -4.553 -25.960 1.00 0.00 H new ATOM 0 HE ARG A 804 14.784 -4.437 -28.068 1.00 0.00 H new ATOM 0 HH11 ARG A 804 14.545 -2.900 -29.899 1.00 0.00 H new ATOM 0 HH12 ARG A 804 15.996 -2.630 -30.871 1.00 0.00 H new ATOM 0 HH21 ARG A 804 18.135 -4.114 -28.538 1.00 0.00 H new ATOM 0 HH22 ARG A 804 18.011 -3.312 -30.107 1.00 0.00 H new ATOM 1176 N LYS A 805 19.450 0.652 -25.302 1.00 0.00 N ATOM 1177 CA LYS A 805 19.429 2.145 -25.153 1.00 0.00 C ATOM 1178 C LYS A 805 20.789 2.786 -25.469 1.00 0.00 C ATOM 1179 O LYS A 805 21.057 3.900 -25.064 1.00 0.00 O ATOM 1180 CB LYS A 805 19.066 2.383 -23.694 1.00 0.00 C ATOM 1181 CG LYS A 805 18.363 3.731 -23.561 1.00 0.00 C ATOM 1182 CD LYS A 805 17.472 3.719 -22.322 1.00 0.00 C ATOM 1183 CE LYS A 805 17.925 4.816 -21.359 1.00 0.00 C ATOM 1184 NZ LYS A 805 16.737 5.086 -20.506 1.00 0.00 N ATOM 0 H LYS A 805 20.135 0.159 -24.729 1.00 0.00 H new ATOM 0 HA LYS A 805 18.723 2.595 -25.851 1.00 0.00 H new ATOM 0 HB2 LYS A 805 18.417 1.585 -23.334 1.00 0.00 H new ATOM 0 HB3 LYS A 805 19.964 2.366 -23.077 1.00 0.00 H new ATOM 0 HG2 LYS A 805 19.099 4.531 -23.485 1.00 0.00 H new ATOM 0 HG3 LYS A 805 17.765 3.931 -24.450 1.00 0.00 H new ATOM 0 HD2 LYS A 805 16.432 3.877 -22.607 1.00 0.00 H new ATOM 0 HD3 LYS A 805 17.524 2.746 -21.833 1.00 0.00 H new ATOM 0 HE2 LYS A 805 18.776 4.491 -20.761 1.00 0.00 H new ATOM 0 HE3 LYS A 805 18.237 5.711 -21.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 805 16.967 5.830 -19.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 805 15.945 5.400 -21.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 805 16.467 4.217 -20.002 1.00 0.00 H new ATOM 1198 N CYS A 806 21.645 2.116 -26.182 1.00 0.00 N ATOM 1199 CA CYS A 806 22.971 2.732 -26.497 1.00 0.00 C ATOM 1200 C CYS A 806 23.522 2.170 -27.808 1.00 0.00 C ATOM 1201 O CYS A 806 24.650 1.724 -27.882 1.00 0.00 O ATOM 1202 CB CYS A 806 23.883 2.371 -25.322 1.00 0.00 C ATOM 1203 SG CYS A 806 23.489 3.420 -23.894 1.00 0.00 S ATOM 0 H CYS A 806 21.493 1.180 -26.559 1.00 0.00 H new ATOM 0 HA CYS A 806 22.897 3.812 -26.626 1.00 0.00 H new ATOM 0 HB2 CYS A 806 23.755 1.321 -25.060 1.00 0.00 H new ATOM 0 HB3 CYS A 806 24.927 2.504 -25.606 1.00 0.00 H new ATOM 1208 N ILE A 807 22.730 2.193 -28.841 1.00 0.00 N ATOM 1209 CA ILE A 807 23.191 1.666 -30.153 1.00 0.00 C ATOM 1210 C ILE A 807 22.677 2.576 -31.274 1.00 0.00 C ATOM 1211 O ILE A 807 21.566 2.433 -31.746 1.00 0.00 O ATOM 1212 CB ILE A 807 22.587 0.261 -30.250 1.00 0.00 C ATOM 1213 CG1 ILE A 807 23.500 -0.725 -29.516 1.00 0.00 C ATOM 1214 CG2 ILE A 807 22.466 -0.158 -31.720 1.00 0.00 C ATOM 1215 CD1 ILE A 807 22.863 -2.112 -29.517 1.00 0.00 C ATOM 0 H ILE A 807 21.777 2.557 -28.833 1.00 0.00 H new ATOM 0 HA ILE A 807 24.277 1.633 -30.244 1.00 0.00 H new ATOM 0 HB ILE A 807 21.595 0.261 -29.797 1.00 0.00 H new ATOM 0 HG12 ILE A 807 24.476 -0.762 -30.000 1.00 0.00 H new ATOM 0 HG13 ILE A 807 23.665 -0.390 -28.492 1.00 0.00 H new ATOM 0 HG21 ILE A 807 22.036 -1.158 -31.779 1.00 0.00 H new ATOM 0 HG22 ILE A 807 21.822 0.546 -32.247 1.00 0.00 H new ATOM 0 HG23 ILE A 807 23.454 -0.160 -32.180 1.00 0.00 H new ATOM 0 HD11 ILE A 807 23.515 -2.812 -28.994 1.00 0.00 H new ATOM 0 HD12 ILE A 807 21.897 -2.069 -29.013 1.00 0.00 H new ATOM 0 HD13 ILE A 807 22.721 -2.447 -30.545 1.00 0.00 H new ATOM 1227 N GLY A 808 23.481 3.510 -31.699 1.00 0.00 N ATOM 1228 CA GLY A 808 23.050 4.433 -32.785 1.00 0.00 C ATOM 1229 C GLY A 808 23.052 5.870 -32.257 1.00 0.00 C ATOM 1230 O GLY A 808 22.567 6.780 -32.900 1.00 0.00 O ATOM 0 H GLY A 808 24.421 3.674 -31.340 1.00 0.00 H new ATOM 0 HA2 GLY A 808 23.721 4.346 -33.640 1.00 0.00 H new ATOM 0 HA3 GLY A 808 22.053 4.163 -33.134 1.00 0.00 H new ATOM 1234 N LEU A 809 23.597 6.081 -31.087 1.00 0.00 N ATOM 1235 CA LEU A 809 23.634 7.459 -30.512 1.00 0.00 C ATOM 1236 C LEU A 809 25.085 7.917 -30.329 1.00 0.00 C ATOM 1237 O LEU A 809 25.991 7.114 -30.230 1.00 0.00 O ATOM 1238 CB LEU A 809 22.941 7.339 -29.153 1.00 0.00 C ATOM 1239 CG LEU A 809 21.465 6.997 -29.357 1.00 0.00 C ATOM 1240 CD1 LEU A 809 20.969 6.161 -28.176 1.00 0.00 C ATOM 1241 CD2 LEU A 809 20.649 8.291 -29.443 1.00 0.00 C ATOM 0 H LEU A 809 24.019 5.358 -30.504 1.00 0.00 H new ATOM 0 HA LEU A 809 23.147 8.189 -31.159 1.00 0.00 H new ATOM 0 HB2 LEU A 809 23.424 6.567 -28.554 1.00 0.00 H new ATOM 0 HB3 LEU A 809 23.035 8.275 -28.602 1.00 0.00 H new ATOM 0 HG LEU A 809 21.347 6.430 -30.280 1.00 0.00 H new ATOM 0 HD11 LEU A 809 19.917 5.916 -28.320 1.00 0.00 H new ATOM 0 HD12 LEU A 809 21.550 5.241 -28.112 1.00 0.00 H new ATOM 0 HD13 LEU A 809 21.086 6.729 -27.253 1.00 0.00 H new ATOM 0 HD21 LEU A 809 19.596 8.048 -29.588 1.00 0.00 H new ATOM 0 HD22 LEU A 809 20.767 8.857 -28.519 1.00 0.00 H new ATOM 0 HD23 LEU A 809 21.003 8.889 -30.283 1.00 0.00 H new ATOM 1253 N GLU A 810 25.312 9.202 -30.283 1.00 0.00 N ATOM 1254 CA GLU A 810 26.706 9.705 -30.106 1.00 0.00 C ATOM 1255 C GLU A 810 27.055 9.774 -28.617 1.00 0.00 C ATOM 1256 O GLU A 810 28.208 9.827 -28.241 1.00 0.00 O ATOM 1257 CB GLU A 810 26.705 11.104 -30.720 1.00 0.00 C ATOM 1258 CG GLU A 810 28.126 11.668 -30.703 1.00 0.00 C ATOM 1259 CD GLU A 810 28.229 12.763 -29.641 1.00 0.00 C ATOM 1260 OE1 GLU A 810 28.316 12.421 -28.473 1.00 0.00 O ATOM 1261 OE2 GLU A 810 28.219 13.926 -30.013 1.00 0.00 O ATOM 0 H GLU A 810 24.595 9.924 -30.360 1.00 0.00 H new ATOM 0 HA GLU A 810 27.443 9.055 -30.577 1.00 0.00 H new ATOM 0 HB2 GLU A 810 26.330 11.064 -31.743 1.00 0.00 H new ATOM 0 HB3 GLU A 810 26.036 11.758 -30.161 1.00 0.00 H new ATOM 0 HG2 GLU A 810 28.841 10.873 -30.491 1.00 0.00 H new ATOM 0 HG3 GLU A 810 28.380 12.072 -31.683 1.00 0.00 H new ATOM 1268 N ARG A 811 26.064 9.772 -27.768 1.00 0.00 N ATOM 1269 CA ARG A 811 26.335 9.836 -26.305 1.00 0.00 C ATOM 1270 C ARG A 811 25.236 9.104 -25.535 1.00 0.00 C ATOM 1271 O ARG A 811 24.063 9.245 -25.818 1.00 0.00 O ATOM 1272 CB ARG A 811 26.325 11.323 -25.963 1.00 0.00 C ATOM 1273 CG ARG A 811 26.734 11.518 -24.500 1.00 0.00 C ATOM 1274 CD ARG A 811 26.084 12.793 -23.952 1.00 0.00 C ATOM 1275 NE ARG A 811 24.621 12.589 -24.145 1.00 0.00 N ATOM 1276 CZ ARG A 811 23.861 13.595 -24.484 1.00 0.00 C ATOM 1277 NH1 ARG A 811 22.672 13.720 -23.959 1.00 0.00 N ATOM 1278 NH2 ARG A 811 24.287 14.474 -25.348 1.00 0.00 N ATOM 0 H ARG A 811 25.078 9.729 -28.025 1.00 0.00 H new ATOM 0 HA ARG A 811 27.281 9.364 -26.040 1.00 0.00 H new ATOM 0 HB2 ARG A 811 27.011 11.861 -26.617 1.00 0.00 H new ATOM 0 HB3 ARG A 811 25.331 11.738 -26.132 1.00 0.00 H new ATOM 0 HG2 ARG A 811 26.426 10.657 -23.907 1.00 0.00 H new ATOM 0 HG3 ARG A 811 27.819 11.588 -24.421 1.00 0.00 H new ATOM 0 HD2 ARG A 811 26.327 12.940 -22.900 1.00 0.00 H new ATOM 0 HD3 ARG A 811 26.434 13.676 -24.486 1.00 0.00 H new ATOM 0 HE ARG A 811 24.213 11.664 -24.012 1.00 0.00 H new ATOM 0 HH11 ARG A 811 22.337 13.032 -23.284 1.00 0.00 H new ATOM 0 HH12 ARG A 811 22.078 14.506 -24.223 1.00 0.00 H new ATOM 0 HH21 ARG A 811 25.215 14.376 -25.760 1.00 0.00 H new ATOM 0 HH22 ARG A 811 23.692 15.259 -25.612 1.00 0.00 H new ATOM 1292 N CYS A 812 25.607 8.323 -24.567 1.00 0.00 N ATOM 1293 CA CYS A 812 24.590 7.578 -23.777 1.00 0.00 C ATOM 1294 C CYS A 812 24.737 7.898 -22.289 1.00 0.00 C ATOM 1295 O CYS A 812 25.826 8.081 -21.786 1.00 0.00 O ATOM 1296 CB CYS A 812 24.885 6.103 -24.037 1.00 0.00 C ATOM 1297 SG CYS A 812 23.389 5.292 -24.650 1.00 0.00 S ATOM 0 H CYS A 812 26.575 8.166 -24.285 1.00 0.00 H new ATOM 0 HA CYS A 812 23.572 7.846 -24.061 1.00 0.00 H new ATOM 0 HB2 CYS A 812 25.690 6.004 -24.765 1.00 0.00 H new ATOM 0 HB3 CYS A 812 25.224 5.621 -23.120 1.00 0.00 H new ATOM 1302 N VAL A 813 23.646 7.966 -21.583 1.00 0.00 N ATOM 1303 CA VAL A 813 23.716 8.271 -20.128 1.00 0.00 C ATOM 1304 C VAL A 813 22.744 7.371 -19.368 1.00 0.00 C ATOM 1305 O VAL A 813 21.559 7.353 -19.640 1.00 0.00 O ATOM 1306 CB VAL A 813 23.305 9.740 -20.007 1.00 0.00 C ATOM 1307 CG1 VAL A 813 21.793 9.870 -20.211 1.00 0.00 C ATOM 1308 CG2 VAL A 813 23.679 10.260 -18.618 1.00 0.00 C ATOM 0 H VAL A 813 22.706 7.823 -21.951 1.00 0.00 H new ATOM 0 HA VAL A 813 24.708 8.098 -19.710 1.00 0.00 H new ATOM 0 HB VAL A 813 23.823 10.325 -20.767 1.00 0.00 H new ATOM 0 HG11 VAL A 813 21.503 10.917 -20.124 1.00 0.00 H new ATOM 0 HG12 VAL A 813 21.526 9.500 -21.201 1.00 0.00 H new ATOM 0 HG13 VAL A 813 21.272 9.285 -19.453 1.00 0.00 H new ATOM 0 HG21 VAL A 813 23.387 11.306 -18.530 1.00 0.00 H new ATOM 0 HG22 VAL A 813 23.161 9.674 -17.859 1.00 0.00 H new ATOM 0 HG23 VAL A 813 24.756 10.171 -18.474 1.00 0.00 H new ATOM 1318 N VAL A 814 23.228 6.623 -18.420 1.00 0.00 N ATOM 1319 CA VAL A 814 22.318 5.726 -17.650 1.00 0.00 C ATOM 1320 C VAL A 814 22.553 5.891 -16.147 1.00 0.00 C ATOM 1321 O VAL A 814 23.675 5.947 -15.687 1.00 0.00 O ATOM 1322 CB VAL A 814 22.684 4.309 -18.097 1.00 0.00 C ATOM 1323 CG1 VAL A 814 22.080 3.296 -17.125 1.00 0.00 C ATOM 1324 CG2 VAL A 814 22.132 4.053 -19.505 1.00 0.00 C ATOM 0 H VAL A 814 24.209 6.591 -18.143 1.00 0.00 H new ATOM 0 HA VAL A 814 21.268 5.953 -17.832 1.00 0.00 H new ATOM 0 HB VAL A 814 23.769 4.204 -18.108 1.00 0.00 H new ATOM 0 HG11 VAL A 814 22.340 2.287 -17.443 1.00 0.00 H new ATOM 0 HG12 VAL A 814 22.473 3.474 -16.124 1.00 0.00 H new ATOM 0 HG13 VAL A 814 20.995 3.404 -17.114 1.00 0.00 H new ATOM 0 HG21 VAL A 814 22.394 3.043 -19.821 1.00 0.00 H new ATOM 0 HG22 VAL A 814 21.047 4.160 -19.496 1.00 0.00 H new ATOM 0 HG23 VAL A 814 22.562 4.774 -20.201 1.00 0.00 H new ATOM 1334 N ALA A 815 21.501 5.974 -15.381 1.00 0.00 N ATOM 1335 CA ALA A 815 21.663 6.135 -13.908 1.00 0.00 C ATOM 1336 C ALA A 815 21.900 4.772 -13.255 1.00 0.00 C ATOM 1337 O ALA A 815 21.379 3.765 -13.691 1.00 0.00 O ATOM 1338 CB ALA A 815 20.345 6.739 -13.429 1.00 0.00 C ATOM 0 H ALA A 815 20.536 5.937 -15.711 1.00 0.00 H new ATOM 0 HA ALA A 815 22.515 6.764 -13.650 1.00 0.00 H new ATOM 0 HB1 ALA A 815 20.384 6.889 -12.350 1.00 0.00 H new ATOM 0 HB2 ALA A 815 20.183 7.697 -13.923 1.00 0.00 H new ATOM 0 HB3 ALA A 815 19.525 6.063 -13.672 1.00 0.00 H new ATOM 1344 N ILE A 816 22.682 4.731 -12.214 1.00 0.00 N ATOM 1345 CA ILE A 816 22.951 3.432 -11.535 1.00 0.00 C ATOM 1346 C ILE A 816 22.002 3.250 -10.347 1.00 0.00 C ATOM 1347 O ILE A 816 22.089 3.952 -9.360 1.00 0.00 O ATOM 1348 CB ILE A 816 24.395 3.528 -11.051 1.00 0.00 C ATOM 1349 CG1 ILE A 816 25.338 3.564 -12.257 1.00 0.00 C ATOM 1350 CG2 ILE A 816 24.723 2.312 -10.184 1.00 0.00 C ATOM 1351 CD1 ILE A 816 26.576 4.393 -11.911 1.00 0.00 C ATOM 0 H ILE A 816 23.147 5.540 -11.803 1.00 0.00 H new ATOM 0 HA ILE A 816 22.799 2.581 -12.199 1.00 0.00 H new ATOM 0 HB ILE A 816 24.521 4.438 -10.465 1.00 0.00 H new ATOM 0 HG12 ILE A 816 25.631 2.551 -12.534 1.00 0.00 H new ATOM 0 HG13 ILE A 816 24.828 3.995 -13.119 1.00 0.00 H new ATOM 0 HG21 ILE A 816 25.754 2.380 -9.838 1.00 0.00 H new ATOM 0 HG22 ILE A 816 24.053 2.286 -9.325 1.00 0.00 H new ATOM 0 HG23 ILE A 816 24.596 1.402 -10.771 1.00 0.00 H new ATOM 0 HD11 ILE A 816 27.248 4.419 -12.769 1.00 0.00 H new ATOM 0 HD12 ILE A 816 26.274 5.409 -11.656 1.00 0.00 H new ATOM 0 HD13 ILE A 816 27.090 3.943 -11.062 1.00 0.00 H new ATOM 1363 N SER A 817 21.097 2.315 -10.434 1.00 0.00 N ATOM 1364 CA SER A 817 20.148 2.094 -9.305 1.00 0.00 C ATOM 1365 C SER A 817 19.504 0.708 -9.418 1.00 0.00 C ATOM 1366 O SER A 817 19.844 -0.065 -10.291 1.00 0.00 O ATOM 1367 CB SER A 817 19.098 3.193 -9.448 1.00 0.00 C ATOM 1368 OG SER A 817 17.934 2.654 -10.064 1.00 0.00 O ATOM 0 H SER A 817 20.973 1.696 -11.235 1.00 0.00 H new ATOM 0 HA SER A 817 20.643 2.132 -8.335 1.00 0.00 H new ATOM 0 HB2 SER A 817 18.849 3.603 -8.469 1.00 0.00 H new ATOM 0 HB3 SER A 817 19.493 4.014 -10.046 1.00 0.00 H new ATOM 0 HG SER A 817 17.257 3.357 -10.156 1.00 0.00 H new ATOM 1374 N PRO A 818 18.590 0.444 -8.524 1.00 0.00 N ATOM 1375 CA PRO A 818 17.891 -0.858 -8.516 1.00 0.00 C ATOM 1376 C PRO A 818 16.803 -0.901 -9.595 1.00 0.00 C ATOM 1377 O PRO A 818 16.580 -1.915 -10.223 1.00 0.00 O ATOM 1378 CB PRO A 818 17.270 -0.925 -7.130 1.00 0.00 C ATOM 1379 CG PRO A 818 17.109 0.505 -6.697 1.00 0.00 C ATOM 1380 CD PRO A 818 18.135 1.328 -7.450 1.00 0.00 C ATOM 0 HA PRO A 818 18.558 -1.694 -8.725 1.00 0.00 H new ATOM 0 HB2 PRO A 818 16.309 -1.439 -7.154 1.00 0.00 H new ATOM 0 HB3 PRO A 818 17.909 -1.475 -6.439 1.00 0.00 H new ATOM 0 HG2 PRO A 818 16.101 0.859 -6.912 1.00 0.00 H new ATOM 0 HG3 PRO A 818 17.257 0.599 -5.621 1.00 0.00 H new ATOM 0 HD2 PRO A 818 17.697 2.244 -7.847 1.00 0.00 H new ATOM 0 HD3 PRO A 818 18.960 1.624 -6.802 1.00 0.00 H new ATOM 1388 N SER A 819 16.128 0.193 -9.819 1.00 0.00 N ATOM 1389 CA SER A 819 15.054 0.208 -10.861 1.00 0.00 C ATOM 1390 C SER A 819 15.650 0.447 -12.256 1.00 0.00 C ATOM 1391 O SER A 819 14.972 0.896 -13.158 1.00 0.00 O ATOM 1392 CB SER A 819 14.141 1.366 -10.466 1.00 0.00 C ATOM 1393 OG SER A 819 12.791 1.017 -10.747 1.00 0.00 O ATOM 0 H SER A 819 16.271 1.076 -9.329 1.00 0.00 H new ATOM 0 HA SER A 819 14.521 -0.741 -10.910 1.00 0.00 H new ATOM 0 HB2 SER A 819 14.257 1.591 -9.406 1.00 0.00 H new ATOM 0 HB3 SER A 819 14.418 2.266 -11.015 1.00 0.00 H new ATOM 0 HG SER A 819 12.202 1.758 -10.493 1.00 0.00 H new ATOM 1399 N ASN A 820 16.907 0.150 -12.441 1.00 0.00 N ATOM 1400 CA ASN A 820 17.532 0.362 -13.776 1.00 0.00 C ATOM 1401 C ASN A 820 17.990 -0.976 -14.363 1.00 0.00 C ATOM 1402 O ASN A 820 18.278 -1.085 -15.538 1.00 0.00 O ATOM 1403 CB ASN A 820 18.731 1.272 -13.510 1.00 0.00 C ATOM 1404 CG ASN A 820 18.342 2.725 -13.794 1.00 0.00 C ATOM 1405 OD1 ASN A 820 19.142 3.495 -14.287 1.00 0.00 O ATOM 1406 ND2 ASN A 820 17.138 3.134 -13.504 1.00 0.00 N ATOM 0 H ASN A 820 17.527 -0.230 -11.726 1.00 0.00 H new ATOM 0 HA ASN A 820 16.839 0.801 -14.493 1.00 0.00 H new ATOM 0 HB2 ASN A 820 19.058 1.167 -12.475 1.00 0.00 H new ATOM 0 HB3 ASN A 820 19.570 0.979 -14.141 1.00 0.00 H new ATOM 0 HD21 ASN A 820 16.869 4.100 -13.691 1.00 0.00 H new ATOM 0 HD22 ASN A 820 16.466 2.488 -13.090 1.00 0.00 H new ATOM 1413 N PHE A 821 18.061 -1.998 -13.552 1.00 0.00 N ATOM 1414 CA PHE A 821 18.501 -3.328 -14.068 1.00 0.00 C ATOM 1415 C PHE A 821 17.492 -4.417 -13.684 1.00 0.00 C ATOM 1416 O PHE A 821 16.739 -4.894 -14.511 1.00 0.00 O ATOM 1417 CB PHE A 821 19.850 -3.582 -13.400 1.00 0.00 C ATOM 1418 CG PHE A 821 20.915 -2.814 -14.136 1.00 0.00 C ATOM 1419 CD1 PHE A 821 21.425 -1.629 -13.593 1.00 0.00 C ATOM 1420 CD2 PHE A 821 21.388 -3.279 -15.368 1.00 0.00 C ATOM 1421 CE1 PHE A 821 22.408 -0.911 -14.281 1.00 0.00 C ATOM 1422 CE2 PHE A 821 22.372 -2.561 -16.057 1.00 0.00 C ATOM 1423 CZ PHE A 821 22.881 -1.377 -15.513 1.00 0.00 C ATOM 0 H PHE A 821 17.834 -1.970 -12.558 1.00 0.00 H new ATOM 0 HA PHE A 821 18.574 -3.343 -15.155 1.00 0.00 H new ATOM 0 HB2 PHE A 821 19.817 -3.272 -12.355 1.00 0.00 H new ATOM 0 HB3 PHE A 821 20.080 -4.647 -13.410 1.00 0.00 H new ATOM 0 HD1 PHE A 821 21.059 -1.269 -12.643 1.00 0.00 H new ATOM 0 HD2 PHE A 821 20.993 -4.193 -15.788 1.00 0.00 H new ATOM 0 HE1 PHE A 821 22.802 0.003 -13.862 1.00 0.00 H new ATOM 0 HE2 PHE A 821 22.738 -2.921 -17.007 1.00 0.00 H new ATOM 0 HZ PHE A 821 23.640 -0.822 -16.044 1.00 0.00 H new ATOM 1433 N GLY A 822 17.470 -4.817 -12.441 1.00 0.00 N ATOM 1434 CA GLY A 822 16.505 -5.875 -12.018 1.00 0.00 C ATOM 1435 C GLY A 822 16.372 -5.875 -10.493 1.00 0.00 C ATOM 1436 O GLY A 822 16.490 -6.900 -9.853 1.00 0.00 O ATOM 0 H GLY A 822 18.075 -4.459 -11.702 1.00 0.00 H new ATOM 0 HA2 GLY A 822 15.532 -5.698 -12.477 1.00 0.00 H new ATOM 0 HA3 GLY A 822 16.847 -6.851 -12.362 1.00 0.00 H new ATOM 1440 N GLY A 823 16.126 -4.737 -9.908 1.00 0.00 N ATOM 1441 CA GLY A 823 15.985 -4.677 -8.424 1.00 0.00 C ATOM 1442 C GLY A 823 17.358 -4.846 -7.769 1.00 0.00 C ATOM 1443 O GLY A 823 18.299 -4.143 -8.084 1.00 0.00 O ATOM 0 H GLY A 823 16.016 -3.845 -10.391 1.00 0.00 H new ATOM 0 HA2 GLY A 823 15.545 -3.724 -8.129 1.00 0.00 H new ATOM 0 HA3 GLY A 823 15.309 -5.460 -8.081 1.00 0.00 H new ATOM 1447 N ASP A 824 17.481 -5.775 -6.858 1.00 0.00 N ATOM 1448 CA ASP A 824 18.795 -5.991 -6.181 1.00 0.00 C ATOM 1449 C ASP A 824 19.208 -7.464 -6.278 1.00 0.00 C ATOM 1450 O ASP A 824 18.404 -8.351 -6.059 1.00 0.00 O ATOM 1451 CB ASP A 824 18.557 -5.600 -4.726 1.00 0.00 C ATOM 1452 CG ASP A 824 17.298 -6.298 -4.210 1.00 0.00 C ATOM 1453 OD1 ASP A 824 16.339 -5.605 -3.917 1.00 0.00 O ATOM 1454 OD2 ASP A 824 17.315 -7.515 -4.119 1.00 0.00 O ATOM 0 H ASP A 824 16.729 -6.394 -6.553 1.00 0.00 H new ATOM 0 HA ASP A 824 19.594 -5.407 -6.637 1.00 0.00 H new ATOM 0 HB2 ASP A 824 19.417 -5.881 -4.118 1.00 0.00 H new ATOM 0 HB3 ASP A 824 18.447 -4.519 -4.642 1.00 0.00 H new ATOM 1459 N PRO A 825 20.455 -7.672 -6.609 1.00 0.00 N ATOM 1460 CA PRO A 825 20.989 -9.042 -6.738 1.00 0.00 C ATOM 1461 C PRO A 825 21.302 -9.633 -5.355 1.00 0.00 C ATOM 1462 O PRO A 825 20.460 -10.241 -4.724 1.00 0.00 O ATOM 1463 CB PRO A 825 22.266 -8.857 -7.544 1.00 0.00 C ATOM 1464 CG PRO A 825 22.695 -7.441 -7.286 1.00 0.00 C ATOM 1465 CD PRO A 825 21.459 -6.652 -6.906 1.00 0.00 C ATOM 0 HA PRO A 825 20.286 -9.728 -7.210 1.00 0.00 H new ATOM 0 HB2 PRO A 825 23.034 -9.564 -7.231 1.00 0.00 H new ATOM 0 HB3 PRO A 825 22.089 -9.027 -8.606 1.00 0.00 H new ATOM 0 HG2 PRO A 825 23.434 -7.404 -6.486 1.00 0.00 H new ATOM 0 HG3 PRO A 825 23.164 -7.015 -8.173 1.00 0.00 H new ATOM 0 HD2 PRO A 825 21.645 -6.014 -6.042 1.00 0.00 H new ATOM 0 HD3 PRO A 825 21.137 -6.002 -7.719 1.00 0.00 H new ATOM 1473 N CYS A 826 22.507 -9.453 -4.879 1.00 0.00 N ATOM 1474 CA CYS A 826 22.870 -10.008 -3.538 1.00 0.00 C ATOM 1475 C CYS A 826 23.185 -8.884 -2.543 1.00 0.00 C ATOM 1476 O CYS A 826 23.842 -7.917 -2.880 1.00 0.00 O ATOM 1477 CB CYS A 826 24.114 -10.855 -3.782 1.00 0.00 C ATOM 1478 SG CYS A 826 25.399 -9.836 -4.544 1.00 0.00 S ATOM 0 H CYS A 826 23.253 -8.948 -5.357 1.00 0.00 H new ATOM 0 HA CYS A 826 22.051 -10.585 -3.109 1.00 0.00 H new ATOM 0 HB2 CYS A 826 24.475 -11.270 -2.841 1.00 0.00 H new ATOM 0 HB3 CYS A 826 23.872 -11.698 -4.430 1.00 0.00 H new ATOM 1483 N PRO A 827 22.700 -9.058 -1.343 1.00 0.00 N ATOM 1484 CA PRO A 827 22.921 -8.066 -0.281 1.00 0.00 C ATOM 1485 C PRO A 827 24.263 -8.324 0.407 1.00 0.00 C ATOM 1486 O PRO A 827 24.992 -9.228 0.049 1.00 0.00 O ATOM 1487 CB PRO A 827 21.776 -8.320 0.688 1.00 0.00 C ATOM 1488 CG PRO A 827 21.387 -9.760 0.481 1.00 0.00 C ATOM 1489 CD PRO A 827 21.894 -10.185 -0.884 1.00 0.00 C ATOM 0 HA PRO A 827 22.947 -7.041 -0.650 1.00 0.00 H new ATOM 0 HB2 PRO A 827 22.086 -8.141 1.718 1.00 0.00 H new ATOM 0 HB3 PRO A 827 20.937 -7.654 0.487 1.00 0.00 H new ATOM 0 HG2 PRO A 827 21.817 -10.388 1.261 1.00 0.00 H new ATOM 0 HG3 PRO A 827 20.305 -9.876 0.540 1.00 0.00 H new ATOM 0 HD2 PRO A 827 22.487 -11.097 -0.820 1.00 0.00 H new ATOM 0 HD3 PRO A 827 21.070 -10.388 -1.568 1.00 0.00 H new ATOM 1497 N GLU A 828 24.588 -7.536 1.387 1.00 0.00 N ATOM 1498 CA GLU A 828 25.884 -7.722 2.114 1.00 0.00 C ATOM 1499 C GLU A 828 27.075 -7.634 1.149 1.00 0.00 C ATOM 1500 O GLU A 828 28.169 -8.062 1.462 1.00 0.00 O ATOM 1501 CB GLU A 828 25.793 -9.119 2.732 1.00 0.00 C ATOM 1502 CG GLU A 828 24.756 -9.111 3.854 1.00 0.00 C ATOM 1503 CD GLU A 828 24.378 -10.548 4.207 1.00 0.00 C ATOM 1504 OE1 GLU A 828 23.231 -10.768 4.560 1.00 0.00 O ATOM 1505 OE2 GLU A 828 25.241 -11.405 4.120 1.00 0.00 O ATOM 0 H GLU A 828 24.013 -6.764 1.723 1.00 0.00 H new ATOM 0 HA GLU A 828 26.042 -6.948 2.865 1.00 0.00 H new ATOM 0 HB2 GLU A 828 25.516 -9.848 1.971 1.00 0.00 H new ATOM 0 HB3 GLU A 828 26.765 -9.420 3.122 1.00 0.00 H new ATOM 0 HG2 GLU A 828 25.157 -8.603 4.731 1.00 0.00 H new ATOM 0 HG3 GLU A 828 23.871 -8.557 3.542 1.00 0.00 H new ATOM 1512 N VAL A 829 26.874 -7.088 -0.020 1.00 0.00 N ATOM 1513 CA VAL A 829 28.002 -6.975 -0.995 1.00 0.00 C ATOM 1514 C VAL A 829 28.086 -5.541 -1.538 1.00 0.00 C ATOM 1515 O VAL A 829 27.081 -4.903 -1.786 1.00 0.00 O ATOM 1516 CB VAL A 829 27.660 -7.955 -2.114 1.00 0.00 C ATOM 1517 CG1 VAL A 829 28.651 -7.773 -3.265 1.00 0.00 C ATOM 1518 CG2 VAL A 829 27.755 -9.390 -1.585 1.00 0.00 C ATOM 0 H VAL A 829 25.981 -6.716 -0.343 1.00 0.00 H new ATOM 0 HA VAL A 829 28.967 -7.201 -0.541 1.00 0.00 H new ATOM 0 HB VAL A 829 26.647 -7.765 -2.468 1.00 0.00 H new ATOM 0 HG11 VAL A 829 28.410 -8.471 -4.066 1.00 0.00 H new ATOM 0 HG12 VAL A 829 28.587 -6.752 -3.642 1.00 0.00 H new ATOM 0 HG13 VAL A 829 29.663 -7.966 -2.908 1.00 0.00 H new ATOM 0 HG21 VAL A 829 27.511 -10.089 -2.384 1.00 0.00 H new ATOM 0 HG22 VAL A 829 28.768 -9.581 -1.233 1.00 0.00 H new ATOM 0 HG23 VAL A 829 27.053 -9.521 -0.761 1.00 0.00 H new ATOM 1528 N MET A 830 29.274 -5.032 -1.726 1.00 0.00 N ATOM 1529 CA MET A 830 29.414 -3.638 -2.253 1.00 0.00 C ATOM 1530 C MET A 830 28.569 -3.466 -3.522 1.00 0.00 C ATOM 1531 O MET A 830 27.848 -4.358 -3.924 1.00 0.00 O ATOM 1532 CB MET A 830 30.902 -3.478 -2.566 1.00 0.00 C ATOM 1533 CG MET A 830 31.614 -2.870 -1.355 1.00 0.00 C ATOM 1534 SD MET A 830 32.211 -4.199 -0.278 1.00 0.00 S ATOM 1535 CE MET A 830 33.750 -3.403 0.241 1.00 0.00 C ATOM 0 H MET A 830 30.152 -5.517 -1.539 1.00 0.00 H new ATOM 0 HA MET A 830 29.069 -2.889 -1.540 1.00 0.00 H new ATOM 0 HB2 MET A 830 31.339 -4.446 -2.811 1.00 0.00 H new ATOM 0 HB3 MET A 830 31.035 -2.838 -3.439 1.00 0.00 H new ATOM 0 HG2 MET A 830 32.449 -2.250 -1.683 1.00 0.00 H new ATOM 0 HG3 MET A 830 30.932 -2.221 -0.806 1.00 0.00 H new ATOM 0 HE1 MET A 830 34.288 -4.061 0.923 1.00 0.00 H new ATOM 0 HE2 MET A 830 34.369 -3.203 -0.634 1.00 0.00 H new ATOM 0 HE3 MET A 830 33.522 -2.465 0.747 1.00 0.00 H new ATOM 1545 N LYS A 831 28.648 -2.325 -4.157 1.00 0.00 N ATOM 1546 CA LYS A 831 27.845 -2.110 -5.397 1.00 0.00 C ATOM 1547 C LYS A 831 28.638 -1.301 -6.428 1.00 0.00 C ATOM 1548 O LYS A 831 28.854 -0.116 -6.270 1.00 0.00 O ATOM 1549 CB LYS A 831 26.618 -1.327 -4.939 1.00 0.00 C ATOM 1550 CG LYS A 831 25.664 -2.262 -4.195 1.00 0.00 C ATOM 1551 CD LYS A 831 24.425 -1.482 -3.752 1.00 0.00 C ATOM 1552 CE LYS A 831 23.958 -1.997 -2.388 1.00 0.00 C ATOM 1553 NZ LYS A 831 24.179 -0.861 -1.453 1.00 0.00 N ATOM 0 H LYS A 831 29.230 -1.537 -3.872 1.00 0.00 H new ATOM 0 HA LYS A 831 27.581 -3.052 -5.878 1.00 0.00 H new ATOM 0 HB2 LYS A 831 26.920 -0.506 -4.289 1.00 0.00 H new ATOM 0 HB3 LYS A 831 26.114 -0.885 -5.798 1.00 0.00 H new ATOM 0 HG2 LYS A 831 25.373 -3.091 -4.841 1.00 0.00 H new ATOM 0 HG3 LYS A 831 26.164 -2.694 -3.328 1.00 0.00 H new ATOM 0 HD2 LYS A 831 24.654 -0.418 -3.692 1.00 0.00 H new ATOM 0 HD3 LYS A 831 23.629 -1.595 -4.488 1.00 0.00 H new ATOM 0 HE2 LYS A 831 22.908 -2.288 -2.414 1.00 0.00 H new ATOM 0 HE3 LYS A 831 24.525 -2.876 -2.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 831 23.882 -1.137 -0.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 831 25.188 -0.610 -1.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 831 23.621 -0.041 -1.765 1.00 0.00 H new ATOM 1567 N ARG A 832 29.069 -1.936 -7.481 1.00 0.00 N ATOM 1568 CA ARG A 832 29.847 -1.211 -8.526 1.00 0.00 C ATOM 1569 C ARG A 832 29.245 -1.503 -9.907 1.00 0.00 C ATOM 1570 O ARG A 832 28.732 -2.577 -10.153 1.00 0.00 O ATOM 1571 CB ARG A 832 31.268 -1.763 -8.421 1.00 0.00 C ATOM 1572 CG ARG A 832 31.878 -1.351 -7.079 1.00 0.00 C ATOM 1573 CD ARG A 832 33.185 -2.116 -6.850 1.00 0.00 C ATOM 1574 NE ARG A 832 34.256 -1.089 -6.968 1.00 0.00 N ATOM 1575 CZ ARG A 832 35.399 -1.267 -6.363 1.00 0.00 C ATOM 1576 NH1 ARG A 832 35.439 -1.377 -5.064 1.00 0.00 N ATOM 1577 NH2 ARG A 832 36.501 -1.332 -7.057 1.00 0.00 N ATOM 0 H ARG A 832 28.916 -2.928 -7.665 1.00 0.00 H new ATOM 0 HA ARG A 832 29.831 -0.130 -8.390 1.00 0.00 H new ATOM 0 HB2 ARG A 832 31.255 -2.849 -8.508 1.00 0.00 H new ATOM 0 HB3 ARG A 832 31.878 -1.385 -9.241 1.00 0.00 H new ATOM 0 HG2 ARG A 832 32.067 -0.278 -7.069 1.00 0.00 H new ATOM 0 HG3 ARG A 832 31.177 -1.559 -6.271 1.00 0.00 H new ATOM 0 HD2 ARG A 832 33.199 -2.590 -5.868 1.00 0.00 H new ATOM 0 HD3 ARG A 832 33.314 -2.908 -7.588 1.00 0.00 H new ATOM 0 HE ARG A 832 34.097 -0.247 -7.521 1.00 0.00 H new ATOM 0 HH11 ARG A 832 34.577 -1.324 -4.521 1.00 0.00 H new ATOM 0 HH12 ARG A 832 36.332 -1.516 -4.591 1.00 0.00 H new ATOM 0 HH21 ARG A 832 36.470 -1.244 -8.073 1.00 0.00 H new ATOM 0 HH22 ARG A 832 37.394 -1.471 -6.584 1.00 0.00 H new ATOM 1591 N VAL A 833 29.302 -0.562 -10.810 1.00 0.00 N ATOM 1592 CA VAL A 833 28.728 -0.802 -12.166 1.00 0.00 C ATOM 1593 C VAL A 833 29.808 -0.662 -13.245 1.00 0.00 C ATOM 1594 O VAL A 833 30.388 0.388 -13.428 1.00 0.00 O ATOM 1595 CB VAL A 833 27.659 0.278 -12.330 1.00 0.00 C ATOM 1596 CG1 VAL A 833 27.024 0.167 -13.715 1.00 0.00 C ATOM 1597 CG2 VAL A 833 26.581 0.089 -11.259 1.00 0.00 C ATOM 0 H VAL A 833 29.719 0.358 -10.669 1.00 0.00 H new ATOM 0 HA VAL A 833 28.319 -1.807 -12.269 1.00 0.00 H new ATOM 0 HB VAL A 833 28.117 1.261 -12.221 1.00 0.00 H new ATOM 0 HG11 VAL A 833 26.262 0.938 -13.829 1.00 0.00 H new ATOM 0 HG12 VAL A 833 27.791 0.299 -14.478 1.00 0.00 H new ATOM 0 HG13 VAL A 833 26.565 -0.815 -13.827 1.00 0.00 H new ATOM 0 HG21 VAL A 833 25.817 0.858 -11.373 1.00 0.00 H new ATOM 0 HG22 VAL A 833 26.126 -0.895 -11.371 1.00 0.00 H new ATOM 0 HG23 VAL A 833 27.032 0.170 -10.270 1.00 0.00 H new ATOM 1607 N ALA A 834 30.081 -1.721 -13.959 1.00 0.00 N ATOM 1608 CA ALA A 834 31.121 -1.656 -15.029 1.00 0.00 C ATOM 1609 C ALA A 834 30.464 -1.821 -16.404 1.00 0.00 C ATOM 1610 O ALA A 834 29.723 -2.754 -16.637 1.00 0.00 O ATOM 1611 CB ALA A 834 32.058 -2.829 -14.742 1.00 0.00 C ATOM 0 H ALA A 834 29.629 -2.629 -13.848 1.00 0.00 H new ATOM 0 HA ALA A 834 31.652 -0.704 -15.036 1.00 0.00 H new ATOM 0 HB1 ALA A 834 32.853 -2.851 -15.488 1.00 0.00 H new ATOM 0 HB2 ALA A 834 32.494 -2.712 -13.750 1.00 0.00 H new ATOM 0 HB3 ALA A 834 31.496 -3.762 -14.784 1.00 0.00 H new ATOM 1617 N VAL A 835 30.726 -0.923 -17.316 1.00 0.00 N ATOM 1618 CA VAL A 835 30.108 -1.039 -18.672 1.00 0.00 C ATOM 1619 C VAL A 835 31.187 -1.002 -19.761 1.00 0.00 C ATOM 1620 O VAL A 835 32.321 -0.639 -19.520 1.00 0.00 O ATOM 1621 CB VAL A 835 29.181 0.175 -18.788 1.00 0.00 C ATOM 1622 CG1 VAL A 835 28.844 0.430 -20.262 1.00 0.00 C ATOM 1623 CG2 VAL A 835 27.891 -0.098 -18.014 1.00 0.00 C ATOM 0 H VAL A 835 31.338 -0.118 -17.183 1.00 0.00 H new ATOM 0 HA VAL A 835 29.570 -1.978 -18.799 1.00 0.00 H new ATOM 0 HB VAL A 835 29.680 1.051 -18.375 1.00 0.00 H new ATOM 0 HG11 VAL A 835 28.184 1.294 -20.340 1.00 0.00 H new ATOM 0 HG12 VAL A 835 29.762 0.623 -20.817 1.00 0.00 H new ATOM 0 HG13 VAL A 835 28.346 -0.446 -20.678 1.00 0.00 H new ATOM 0 HG21 VAL A 835 27.229 0.764 -18.095 1.00 0.00 H new ATOM 0 HG22 VAL A 835 27.396 -0.976 -18.430 1.00 0.00 H new ATOM 0 HG23 VAL A 835 28.127 -0.277 -16.965 1.00 0.00 H new ATOM 1633 N GLU A 836 30.834 -1.377 -20.960 1.00 0.00 N ATOM 1634 CA GLU A 836 31.826 -1.371 -22.075 1.00 0.00 C ATOM 1635 C GLU A 836 31.099 -1.180 -23.411 1.00 0.00 C ATOM 1636 O GLU A 836 30.402 -2.056 -23.875 1.00 0.00 O ATOM 1637 CB GLU A 836 32.494 -2.746 -22.016 1.00 0.00 C ATOM 1638 CG GLU A 836 34.013 -2.582 -22.084 1.00 0.00 C ATOM 1639 CD GLU A 836 34.593 -3.601 -23.067 1.00 0.00 C ATOM 1640 OE1 GLU A 836 34.430 -4.786 -22.825 1.00 0.00 O ATOM 1641 OE2 GLU A 836 35.190 -3.180 -24.043 1.00 0.00 O ATOM 0 H GLU A 836 29.898 -1.689 -21.217 1.00 0.00 H new ATOM 0 HA GLU A 836 32.554 -0.564 -21.986 1.00 0.00 H new ATOM 0 HB2 GLU A 836 32.214 -3.258 -21.095 1.00 0.00 H new ATOM 0 HB3 GLU A 836 32.148 -3.366 -22.843 1.00 0.00 H new ATOM 0 HG2 GLU A 836 34.266 -1.570 -22.401 1.00 0.00 H new ATOM 0 HG3 GLU A 836 34.449 -2.725 -21.096 1.00 0.00 H new ATOM 1648 N ALA A 837 31.255 -0.042 -24.030 1.00 0.00 N ATOM 1649 CA ALA A 837 30.567 0.193 -25.335 1.00 0.00 C ATOM 1650 C ALA A 837 31.587 0.254 -26.477 1.00 0.00 C ATOM 1651 O ALA A 837 32.767 0.445 -26.262 1.00 0.00 O ATOM 1652 CB ALA A 837 29.864 1.541 -25.176 1.00 0.00 C ATOM 0 H ALA A 837 31.826 0.733 -23.692 1.00 0.00 H new ATOM 0 HA ALA A 837 29.869 -0.608 -25.578 1.00 0.00 H new ATOM 0 HB1 ALA A 837 29.334 1.786 -26.096 1.00 0.00 H new ATOM 0 HB2 ALA A 837 29.153 1.486 -24.351 1.00 0.00 H new ATOM 0 HB3 ALA A 837 30.603 2.314 -24.967 1.00 0.00 H new ATOM 1658 N VAL A 838 31.136 0.093 -27.691 1.00 0.00 N ATOM 1659 CA VAL A 838 32.075 0.140 -28.848 1.00 0.00 C ATOM 1660 C VAL A 838 31.677 1.269 -29.802 1.00 0.00 C ATOM 1661 O VAL A 838 30.524 1.420 -30.155 1.00 0.00 O ATOM 1662 CB VAL A 838 31.926 -1.212 -29.536 1.00 0.00 C ATOM 1663 CG1 VAL A 838 32.947 -1.319 -30.669 1.00 0.00 C ATOM 1664 CG2 VAL A 838 32.174 -2.333 -28.521 1.00 0.00 C ATOM 0 H VAL A 838 30.158 -0.069 -27.932 1.00 0.00 H new ATOM 0 HA VAL A 838 33.103 0.328 -28.537 1.00 0.00 H new ATOM 0 HB VAL A 838 30.918 -1.305 -29.941 1.00 0.00 H new ATOM 0 HG11 VAL A 838 32.843 -2.285 -31.163 1.00 0.00 H new ATOM 0 HG12 VAL A 838 32.774 -0.522 -31.392 1.00 0.00 H new ATOM 0 HG13 VAL A 838 33.954 -1.227 -30.261 1.00 0.00 H new ATOM 0 HG21 VAL A 838 32.067 -3.300 -29.013 1.00 0.00 H new ATOM 0 HG22 VAL A 838 33.182 -2.241 -28.116 1.00 0.00 H new ATOM 0 HG23 VAL A 838 31.449 -2.257 -27.710 1.00 0.00 H new ATOM 1674 N CYS A 839 32.621 2.063 -30.221 1.00 0.00 N ATOM 1675 CA CYS A 839 32.295 3.181 -31.151 1.00 0.00 C ATOM 1676 C CYS A 839 33.038 2.996 -32.481 1.00 0.00 C ATOM 1677 O CYS A 839 34.204 2.654 -32.509 1.00 0.00 O ATOM 1678 CB CYS A 839 32.783 4.445 -30.440 1.00 0.00 C ATOM 1679 SG CYS A 839 31.363 5.418 -29.875 1.00 0.00 S ATOM 0 H CYS A 839 33.604 1.987 -29.960 1.00 0.00 H new ATOM 0 HA CYS A 839 31.231 3.228 -31.382 1.00 0.00 H new ATOM 0 HB2 CYS A 839 33.412 4.176 -29.591 1.00 0.00 H new ATOM 0 HB3 CYS A 839 33.397 5.040 -31.116 1.00 0.00 H new ATOM 1684 N SER A 840 32.374 3.221 -33.581 1.00 0.00 N ATOM 1685 CA SER A 840 33.044 3.058 -34.904 1.00 0.00 C ATOM 1686 C SER A 840 33.330 4.431 -35.520 1.00 0.00 C ATOM 1687 O SER A 840 33.633 5.381 -34.826 1.00 0.00 O ATOM 1688 CB SER A 840 32.050 2.278 -35.763 1.00 0.00 C ATOM 1689 OG SER A 840 30.907 3.089 -36.012 1.00 0.00 O ATOM 0 H SER A 840 31.397 3.511 -33.622 1.00 0.00 H new ATOM 0 HA SER A 840 34.000 2.540 -34.823 1.00 0.00 H new ATOM 0 HB2 SER A 840 32.516 1.986 -36.704 1.00 0.00 H new ATOM 0 HB3 SER A 840 31.755 1.360 -35.255 1.00 0.00 H new ATOM 0 HG SER A 840 30.268 2.592 -36.564 1.00 0.00 H new ATOM 1695 N THR A 841 33.240 4.546 -36.817 1.00 0.00 N ATOM 1696 CA THR A 841 33.509 5.863 -37.468 1.00 0.00 C ATOM 1697 C THR A 841 32.608 6.044 -38.693 1.00 0.00 C ATOM 1698 O THR A 841 32.197 5.088 -39.321 1.00 0.00 O ATOM 1699 CB THR A 841 34.979 5.807 -37.883 1.00 0.00 C ATOM 1700 OG1 THR A 841 35.368 4.452 -38.056 1.00 0.00 O ATOM 1701 CG2 THR A 841 35.842 6.455 -36.799 1.00 0.00 C ATOM 0 H THR A 841 32.993 3.788 -37.454 1.00 0.00 H new ATOM 0 HA THR A 841 33.306 6.702 -36.802 1.00 0.00 H new ATOM 0 HB THR A 841 35.114 6.346 -38.821 1.00 0.00 H new ATOM 0 HG1 THR A 841 36.310 4.414 -38.324 1.00 0.00 H new ATOM 0 HG21 THR A 841 36.890 6.415 -37.096 1.00 0.00 H new ATOM 0 HG22 THR A 841 35.542 7.495 -36.668 1.00 0.00 H new ATOM 0 HG23 THR A 841 35.710 5.918 -35.860 1.00 0.00 H new