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 817 SER OG : rot -170:sc= -2.64! USER MOD Set 1.2: A 820 ASN : amide:sc= -0.243 K(o=-2.9,f=-7.4!) USER MOD Set 2.1: A 790 GLN : amide:sc= -0.785 K(o=-8.2,f=-7!) USER MOD Set 2.2: A 794 HIS : no HD1:sc= -7.46! C(o=-8.2!,f=-4.5!) USER MOD Set 2.3: A 795 SER OG : rot 34:sc= 0.554 USER MOD Set 2.4: A 798 SER OG : rot -48:sc= -0.504 USER MOD Single : A 729 SER OG : rot 180:sc= -0.681 USER MOD Single : A 736 SER OG : rot 180:sc= 0 USER MOD Single : A 757 THR OG1 : rot -3:sc= 0.781 USER MOD Single : A 759 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 761 HIS : no HD1:sc= -0.401 X(o=-0.4,f=-0.19) USER MOD Single : A 763 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 768 GLN : amide:sc= -0.254 X(o=-0.25,f=-0.024) USER MOD Single : A 769 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 SER OG : rot -26:sc= 0.357! USER MOD Single : A 774 LYS NZ :NH3+ -134:sc= -0.46 (180deg=-1.16) USER MOD Single : A 777 SER OG : rot 180:sc= 0 USER MOD Single : A 780 THR OG1 : rot 30:sc= 1.11 USER MOD Single : A 784 THR OG1 : rot 180:sc= 0 USER MOD Single : A 787 THR OG1 : rot 180:sc= -0.274 USER MOD Single : A 789 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 797 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 799 ASN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 800 SER OG : rot 180:sc= 0 USER MOD Single : A 805 LYS NZ :NH3+ -120:sc= 0 (180deg=-0.812) USER MOD Single : A 819 SER OG : rot 180:sc= 0 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 113:sc= 0.169 USER MOD Single : A 841 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 39 N VAL A 728 36.444 0.756 -35.529 1.00 0.00 N ATOM 40 CA VAL A 728 37.171 2.047 -35.358 1.00 0.00 C ATOM 41 C VAL A 728 37.800 2.120 -33.962 1.00 0.00 C ATOM 42 O VAL A 728 39.006 2.097 -33.813 1.00 0.00 O ATOM 43 CB VAL A 728 36.104 3.126 -35.524 1.00 0.00 C ATOM 44 CG1 VAL A 728 36.702 4.494 -35.194 1.00 0.00 C ATOM 45 CG2 VAL A 728 35.601 3.125 -36.971 1.00 0.00 C ATOM 0 HA VAL A 728 37.982 2.163 -36.077 1.00 0.00 H new ATOM 0 HB VAL A 728 35.274 2.922 -34.848 1.00 0.00 H new ATOM 0 HG11 VAL A 728 35.939 5.263 -35.313 1.00 0.00 H new ATOM 0 HG12 VAL A 728 37.061 4.495 -34.165 1.00 0.00 H new ATOM 0 HG13 VAL A 728 37.533 4.700 -35.869 1.00 0.00 H new ATOM 0 HG21 VAL A 728 34.839 3.895 -37.092 1.00 0.00 H new ATOM 0 HG22 VAL A 728 36.433 3.329 -37.645 1.00 0.00 H new ATOM 0 HG23 VAL A 728 35.173 2.151 -37.207 1.00 0.00 H new ATOM 55 N SER A 729 36.994 2.208 -32.938 1.00 0.00 N ATOM 56 CA SER A 729 37.552 2.282 -31.556 1.00 0.00 C ATOM 57 C SER A 729 36.447 2.062 -30.519 1.00 0.00 C ATOM 58 O SER A 729 35.273 2.089 -30.832 1.00 0.00 O ATOM 59 CB SER A 729 38.121 3.692 -31.435 1.00 0.00 C ATOM 60 OG SER A 729 37.148 4.631 -31.876 1.00 0.00 O ATOM 0 H SER A 729 35.976 2.232 -32.998 1.00 0.00 H new ATOM 0 HA SER A 729 38.308 1.517 -31.379 1.00 0.00 H new ATOM 0 HB2 SER A 729 38.399 3.897 -30.401 1.00 0.00 H new ATOM 0 HB3 SER A 729 39.028 3.783 -32.033 1.00 0.00 H new ATOM 0 HG SER A 729 37.510 5.538 -31.798 1.00 0.00 H new ATOM 66 N GLY A 730 36.816 1.842 -29.287 1.00 0.00 N ATOM 67 CA GLY A 730 35.792 1.620 -28.229 1.00 0.00 C ATOM 68 C GLY A 730 36.086 2.532 -27.038 1.00 0.00 C ATOM 69 O GLY A 730 37.067 3.248 -27.021 1.00 0.00 O ATOM 0 H GLY A 730 37.784 1.806 -28.968 1.00 0.00 H new ATOM 0 HA2 GLY A 730 34.796 1.826 -28.622 1.00 0.00 H new ATOM 0 HA3 GLY A 730 35.800 0.577 -27.913 1.00 0.00 H new ATOM 73 N VAL A 731 35.244 2.513 -26.042 1.00 0.00 N ATOM 74 CA VAL A 731 35.480 3.383 -24.851 1.00 0.00 C ATOM 75 C VAL A 731 35.331 2.574 -23.559 1.00 0.00 C ATOM 76 O VAL A 731 34.434 1.767 -23.419 1.00 0.00 O ATOM 77 CB VAL A 731 34.405 4.472 -24.922 1.00 0.00 C ATOM 78 CG1 VAL A 731 34.822 5.539 -25.936 1.00 0.00 C ATOM 79 CG2 VAL A 731 33.070 3.852 -25.352 1.00 0.00 C ATOM 0 H VAL A 731 34.405 1.935 -25.999 1.00 0.00 H new ATOM 0 HA VAL A 731 36.486 3.803 -24.851 1.00 0.00 H new ATOM 0 HB VAL A 731 34.291 4.930 -23.939 1.00 0.00 H new ATOM 0 HG11 VAL A 731 34.056 6.313 -25.985 1.00 0.00 H new ATOM 0 HG12 VAL A 731 35.768 5.984 -25.628 1.00 0.00 H new ATOM 0 HG13 VAL A 731 34.939 5.081 -26.918 1.00 0.00 H new ATOM 0 HG21 VAL A 731 32.307 4.629 -25.402 1.00 0.00 H new ATOM 0 HG22 VAL A 731 33.182 3.391 -26.333 1.00 0.00 H new ATOM 0 HG23 VAL A 731 32.770 3.095 -24.627 1.00 0.00 H new ATOM 89 N CYS A 732 36.205 2.787 -22.617 1.00 0.00 N ATOM 90 CA CYS A 732 36.121 2.036 -21.333 1.00 0.00 C ATOM 91 C CYS A 732 35.696 2.983 -20.210 1.00 0.00 C ATOM 92 O CYS A 732 35.917 4.175 -20.284 1.00 0.00 O ATOM 93 CB CYS A 732 37.536 1.518 -21.082 1.00 0.00 C ATOM 94 SG CYS A 732 37.860 0.095 -22.152 1.00 0.00 S ATOM 0 H CYS A 732 36.977 3.451 -22.680 1.00 0.00 H new ATOM 0 HA CYS A 732 35.393 1.226 -21.371 1.00 0.00 H new ATOM 0 HB2 CYS A 732 38.263 2.306 -21.278 1.00 0.00 H new ATOM 0 HB3 CYS A 732 37.650 1.233 -20.036 1.00 0.00 H new ATOM 99 N ALA A 733 35.093 2.472 -19.171 1.00 0.00 N ATOM 100 CA ALA A 733 34.666 3.370 -18.058 1.00 0.00 C ATOM 101 C ALA A 733 34.265 2.559 -16.821 1.00 0.00 C ATOM 102 O ALA A 733 33.294 1.829 -16.830 1.00 0.00 O ATOM 103 CB ALA A 733 33.463 4.129 -18.610 1.00 0.00 C ATOM 0 H ALA A 733 34.879 1.483 -19.044 1.00 0.00 H new ATOM 0 HA ALA A 733 35.469 4.036 -17.742 1.00 0.00 H new ATOM 0 HB1 ALA A 733 33.086 4.815 -17.851 1.00 0.00 H new ATOM 0 HB2 ALA A 733 33.763 4.694 -19.493 1.00 0.00 H new ATOM 0 HB3 ALA A 733 32.680 3.421 -18.881 1.00 0.00 H new ATOM 109 N ASP A 734 35.007 2.688 -15.758 1.00 0.00 N ATOM 110 CA ASP A 734 34.678 1.932 -14.514 1.00 0.00 C ATOM 111 C ASP A 734 34.205 2.908 -13.435 1.00 0.00 C ATOM 112 O ASP A 734 34.923 3.807 -13.044 1.00 0.00 O ATOM 113 CB ASP A 734 35.987 1.265 -14.096 1.00 0.00 C ATOM 114 CG ASP A 734 35.973 -0.201 -14.532 1.00 0.00 C ATOM 115 OD1 ASP A 734 37.028 -0.702 -14.886 1.00 0.00 O ATOM 116 OD2 ASP A 734 34.910 -0.796 -14.503 1.00 0.00 O ATOM 0 H ASP A 734 35.831 3.286 -15.695 1.00 0.00 H new ATOM 0 HA ASP A 734 33.884 1.200 -14.664 1.00 0.00 H new ATOM 0 HB2 ASP A 734 36.832 1.782 -14.549 1.00 0.00 H new ATOM 0 HB3 ASP A 734 36.114 1.333 -13.016 1.00 0.00 H new ATOM 121 N VAL A 735 33.008 2.741 -12.948 1.00 0.00 N ATOM 122 CA VAL A 735 32.504 3.668 -11.897 1.00 0.00 C ATOM 123 C VAL A 735 31.946 2.881 -10.707 1.00 0.00 C ATOM 124 O VAL A 735 31.361 1.829 -10.865 1.00 0.00 O ATOM 125 CB VAL A 735 31.392 4.459 -12.577 1.00 0.00 C ATOM 126 CG1 VAL A 735 30.672 5.318 -11.539 1.00 0.00 C ATOM 127 CG2 VAL A 735 31.994 5.361 -13.657 1.00 0.00 C ATOM 0 H VAL A 735 32.359 2.006 -13.230 1.00 0.00 H new ATOM 0 HA VAL A 735 33.292 4.312 -11.506 1.00 0.00 H new ATOM 0 HB VAL A 735 30.682 3.770 -13.034 1.00 0.00 H new ATOM 0 HG11 VAL A 735 29.877 5.884 -12.024 1.00 0.00 H new ATOM 0 HG12 VAL A 735 30.243 4.676 -10.770 1.00 0.00 H new ATOM 0 HG13 VAL A 735 31.382 6.008 -11.082 1.00 0.00 H new ATOM 0 HG21 VAL A 735 31.199 5.927 -14.143 1.00 0.00 H new ATOM 0 HG22 VAL A 735 32.704 6.051 -13.201 1.00 0.00 H new ATOM 0 HG23 VAL A 735 32.509 4.748 -14.397 1.00 0.00 H new ATOM 137 N SER A 736 32.121 3.389 -9.519 1.00 0.00 N ATOM 138 CA SER A 736 31.601 2.675 -8.318 1.00 0.00 C ATOM 139 C SER A 736 30.172 3.133 -8.018 1.00 0.00 C ATOM 140 O SER A 736 29.558 3.831 -8.802 1.00 0.00 O ATOM 141 CB SER A 736 32.542 3.070 -7.183 1.00 0.00 C ATOM 142 OG SER A 736 33.634 2.159 -7.140 1.00 0.00 O ATOM 0 H SER A 736 32.602 4.268 -9.327 1.00 0.00 H new ATOM 0 HA SER A 736 31.568 1.594 -8.458 1.00 0.00 H new ATOM 0 HB2 SER A 736 32.907 4.086 -7.334 1.00 0.00 H new ATOM 0 HB3 SER A 736 32.008 3.061 -6.233 1.00 0.00 H new ATOM 0 HG SER A 736 34.241 2.411 -6.413 1.00 0.00 H new ATOM 148 N GLU A 737 29.637 2.750 -6.892 1.00 0.00 N ATOM 149 CA GLU A 737 28.245 3.168 -6.547 1.00 0.00 C ATOM 150 C GLU A 737 28.261 4.213 -5.427 1.00 0.00 C ATOM 151 O GLU A 737 29.208 4.320 -4.675 1.00 0.00 O ATOM 152 CB GLU A 737 27.551 1.890 -6.075 1.00 0.00 C ATOM 153 CG GLU A 737 26.107 1.877 -6.582 1.00 0.00 C ATOM 154 CD GLU A 737 25.175 2.399 -5.487 1.00 0.00 C ATOM 155 OE1 GLU A 737 25.383 2.044 -4.339 1.00 0.00 O ATOM 156 OE2 GLU A 737 24.268 3.147 -5.816 1.00 0.00 O ATOM 0 H GLU A 737 30.101 2.167 -6.196 1.00 0.00 H new ATOM 0 HA GLU A 737 27.733 3.623 -7.395 1.00 0.00 H new ATOM 0 HB2 GLU A 737 28.086 1.015 -6.445 1.00 0.00 H new ATOM 0 HB3 GLU A 737 27.566 1.836 -4.986 1.00 0.00 H new ATOM 0 HG2 GLU A 737 26.019 2.496 -7.475 1.00 0.00 H new ATOM 0 HG3 GLU A 737 25.820 0.865 -6.866 1.00 0.00 H new ATOM 479 N THR A 757 23.543 10.021 -7.605 1.00 0.00 N ATOM 480 CA THR A 757 23.519 8.673 -8.245 1.00 0.00 C ATOM 481 C THR A 757 24.708 8.514 -9.194 1.00 0.00 C ATOM 482 O THR A 757 24.831 9.226 -10.169 1.00 0.00 O ATOM 483 CB THR A 757 22.200 8.625 -9.024 1.00 0.00 C ATOM 484 OG1 THR A 757 21.547 9.890 -8.943 1.00 0.00 O ATOM 485 CG2 THR A 757 21.298 7.547 -8.430 1.00 0.00 C ATOM 0 HA THR A 757 23.589 7.869 -7.512 1.00 0.00 H new ATOM 0 HB THR A 757 22.406 8.393 -10.069 1.00 0.00 H new ATOM 0 HG1 THR A 757 22.067 10.490 -8.369 1.00 0.00 H new ATOM 0 HG21 THR A 757 20.360 7.512 -8.983 1.00 0.00 H new ATOM 0 HG22 THR A 757 21.795 6.579 -8.497 1.00 0.00 H new ATOM 0 HG23 THR A 757 21.094 7.779 -7.385 1.00 0.00 H new ATOM 493 N ALA A 758 25.586 7.585 -8.916 1.00 0.00 N ATOM 494 CA ALA A 758 26.766 7.386 -9.808 1.00 0.00 C ATOM 495 C ALA A 758 26.326 7.458 -11.272 1.00 0.00 C ATOM 496 O ALA A 758 25.177 7.225 -11.593 1.00 0.00 O ATOM 497 CB ALA A 758 27.288 5.989 -9.470 1.00 0.00 C ATOM 0 H ALA A 758 25.537 6.958 -8.113 1.00 0.00 H new ATOM 0 HA ALA A 758 27.532 8.148 -9.665 1.00 0.00 H new ATOM 0 HB1 ALA A 758 28.159 5.767 -10.087 1.00 0.00 H new ATOM 0 HB2 ALA A 758 27.569 5.950 -8.418 1.00 0.00 H new ATOM 0 HB3 ALA A 758 26.509 5.252 -9.665 1.00 0.00 H new ATOM 503 N LYS A 759 27.223 7.776 -12.163 1.00 0.00 N ATOM 504 CA LYS A 759 26.836 7.860 -13.602 1.00 0.00 C ATOM 505 C LYS A 759 27.979 7.382 -14.502 1.00 0.00 C ATOM 506 O LYS A 759 29.132 7.383 -14.118 1.00 0.00 O ATOM 507 CB LYS A 759 26.560 9.344 -13.847 1.00 0.00 C ATOM 508 CG LYS A 759 25.121 9.673 -13.444 1.00 0.00 C ATOM 509 CD LYS A 759 25.087 11.015 -12.708 1.00 0.00 C ATOM 510 CE LYS A 759 25.870 12.062 -13.509 1.00 0.00 C ATOM 511 NZ LYS A 759 25.974 13.241 -12.603 1.00 0.00 N ATOM 0 H LYS A 759 28.202 7.980 -11.961 1.00 0.00 H new ATOM 0 HA LYS A 759 25.975 7.232 -13.828 1.00 0.00 H new ATOM 0 HB2 LYS A 759 27.257 9.953 -13.272 1.00 0.00 H new ATOM 0 HB3 LYS A 759 26.718 9.585 -14.898 1.00 0.00 H new ATOM 0 HG2 LYS A 759 24.486 9.716 -14.329 1.00 0.00 H new ATOM 0 HG3 LYS A 759 24.723 8.886 -12.804 1.00 0.00 H new ATOM 0 HD2 LYS A 759 24.056 11.342 -12.574 1.00 0.00 H new ATOM 0 HD3 LYS A 759 25.519 10.906 -11.713 1.00 0.00 H new ATOM 0 HE2 LYS A 759 26.856 11.690 -13.787 1.00 0.00 H new ATOM 0 HE3 LYS A 759 25.353 12.319 -14.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 759 26.498 14.001 -13.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 759 25.020 13.578 -12.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 759 26.476 12.968 -11.734 1.00 0.00 H new ATOM 525 N VAL A 760 27.662 6.974 -15.700 1.00 0.00 N ATOM 526 CA VAL A 760 28.718 6.495 -16.635 1.00 0.00 C ATOM 527 C VAL A 760 28.922 7.542 -17.731 1.00 0.00 C ATOM 528 O VAL A 760 27.973 8.033 -18.311 1.00 0.00 O ATOM 529 CB VAL A 760 28.173 5.190 -17.220 1.00 0.00 C ATOM 530 CG1 VAL A 760 29.121 4.680 -18.306 1.00 0.00 C ATOM 531 CG2 VAL A 760 28.064 4.141 -16.111 1.00 0.00 C ATOM 0 H VAL A 760 26.713 6.952 -16.073 1.00 0.00 H new ATOM 0 HA VAL A 760 29.680 6.336 -16.148 1.00 0.00 H new ATOM 0 HB VAL A 760 27.189 5.371 -17.652 1.00 0.00 H new ATOM 0 HG11 VAL A 760 28.732 3.751 -18.722 1.00 0.00 H new ATOM 0 HG12 VAL A 760 29.203 5.425 -19.097 1.00 0.00 H new ATOM 0 HG13 VAL A 760 30.106 4.500 -17.874 1.00 0.00 H new ATOM 0 HG21 VAL A 760 27.676 3.211 -16.527 1.00 0.00 H new ATOM 0 HG22 VAL A 760 29.049 3.963 -15.681 1.00 0.00 H new ATOM 0 HG23 VAL A 760 27.389 4.501 -15.335 1.00 0.00 H new ATOM 541 N HIS A 761 30.142 7.888 -18.026 1.00 0.00 N ATOM 542 CA HIS A 761 30.378 8.910 -19.085 1.00 0.00 C ATOM 543 C HIS A 761 30.973 8.278 -20.346 1.00 0.00 C ATOM 544 O HIS A 761 32.137 7.935 -20.394 1.00 0.00 O ATOM 545 CB HIS A 761 31.367 9.898 -18.469 1.00 0.00 C ATOM 546 CG HIS A 761 30.672 11.206 -18.208 1.00 0.00 C ATOM 547 ND1 HIS A 761 31.064 12.061 -17.189 1.00 0.00 N ATOM 548 CD2 HIS A 761 29.610 11.820 -18.825 1.00 0.00 C ATOM 549 CE1 HIS A 761 30.248 13.134 -17.224 1.00 0.00 C ATOM 550 NE2 HIS A 761 29.344 13.036 -18.203 1.00 0.00 N ATOM 0 H HIS A 761 30.981 7.512 -17.585 1.00 0.00 H new ATOM 0 HA HIS A 761 29.448 9.389 -19.392 1.00 0.00 H new ATOM 0 HB2 HIS A 761 31.768 9.495 -17.539 1.00 0.00 H new ATOM 0 HB3 HIS A 761 32.212 10.050 -19.141 1.00 0.00 H new ATOM 0 HD2 HIS A 761 29.064 11.420 -19.666 1.00 0.00 H new ATOM 0 HE1 HIS A 761 30.317 13.970 -16.544 1.00 0.00 H new ATOM 0 HE2 HIS A 761 28.615 13.708 -18.443 1.00 0.00 H new ATOM 558 N LEU A 762 30.176 8.125 -21.362 1.00 0.00 N ATOM 559 CA LEU A 762 30.675 7.524 -22.626 1.00 0.00 C ATOM 560 C LEU A 762 30.620 8.580 -23.730 1.00 0.00 C ATOM 561 O LEU A 762 29.661 9.316 -23.840 1.00 0.00 O ATOM 562 CB LEU A 762 29.722 6.370 -22.927 1.00 0.00 C ATOM 563 CG LEU A 762 29.948 5.247 -21.916 1.00 0.00 C ATOM 564 CD1 LEU A 762 28.700 4.367 -21.843 1.00 0.00 C ATOM 565 CD2 LEU A 762 31.144 4.399 -22.358 1.00 0.00 C ATOM 0 H LEU A 762 29.192 8.393 -21.371 1.00 0.00 H new ATOM 0 HA LEU A 762 31.705 7.173 -22.555 1.00 0.00 H new ATOM 0 HB2 LEU A 762 28.689 6.715 -22.879 1.00 0.00 H new ATOM 0 HB3 LEU A 762 29.888 6.002 -23.939 1.00 0.00 H new ATOM 0 HG LEU A 762 30.147 5.676 -20.934 1.00 0.00 H new ATOM 0 HD11 LEU A 762 28.861 3.566 -21.122 1.00 0.00 H new ATOM 0 HD12 LEU A 762 27.847 4.970 -21.531 1.00 0.00 H new ATOM 0 HD13 LEU A 762 28.500 3.937 -22.824 1.00 0.00 H new ATOM 0 HD21 LEU A 762 31.307 3.597 -21.638 1.00 0.00 H new ATOM 0 HD22 LEU A 762 30.943 3.970 -23.340 1.00 0.00 H new ATOM 0 HD23 LEU A 762 32.034 5.026 -22.411 1.00 0.00 H new ATOM 577 N LYS A 763 31.629 8.669 -24.548 1.00 0.00 N ATOM 578 CA LYS A 763 31.600 9.693 -25.632 1.00 0.00 C ATOM 579 C LYS A 763 32.022 9.096 -26.976 1.00 0.00 C ATOM 580 O LYS A 763 32.848 8.208 -27.048 1.00 0.00 O ATOM 581 CB LYS A 763 32.602 10.754 -25.185 1.00 0.00 C ATOM 582 CG LYS A 763 32.400 12.026 -26.006 1.00 0.00 C ATOM 583 CD LYS A 763 33.110 13.193 -25.319 1.00 0.00 C ATOM 584 CE LYS A 763 34.612 12.903 -25.239 1.00 0.00 C ATOM 585 NZ LYS A 763 35.173 13.431 -26.513 1.00 0.00 N ATOM 0 H LYS A 763 32.465 8.085 -24.516 1.00 0.00 H new ATOM 0 HA LYS A 763 30.598 10.095 -25.781 1.00 0.00 H new ATOM 0 HB2 LYS A 763 32.471 10.969 -24.124 1.00 0.00 H new ATOM 0 HB3 LYS A 763 33.620 10.385 -25.312 1.00 0.00 H new ATOM 0 HG2 LYS A 763 32.794 11.888 -27.013 1.00 0.00 H new ATOM 0 HG3 LYS A 763 31.336 12.242 -26.107 1.00 0.00 H new ATOM 0 HD2 LYS A 763 32.936 14.115 -25.873 1.00 0.00 H new ATOM 0 HD3 LYS A 763 32.704 13.341 -24.318 1.00 0.00 H new ATOM 0 HE2 LYS A 763 35.063 13.392 -24.376 1.00 0.00 H new ATOM 0 HE3 LYS A 763 34.803 11.835 -25.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 763 36.200 13.269 -26.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 763 34.730 12.942 -27.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 763 34.982 14.451 -26.580 1.00 0.00 H new ATOM 599 N CYS A 764 31.450 9.586 -28.042 1.00 0.00 N ATOM 600 CA CYS A 764 31.800 9.069 -29.396 1.00 0.00 C ATOM 601 C CYS A 764 31.838 10.234 -30.393 1.00 0.00 C ATOM 602 O CYS A 764 31.205 11.251 -30.193 1.00 0.00 O ATOM 603 CB CYS A 764 30.683 8.090 -29.752 1.00 0.00 C ATOM 604 SG CYS A 764 30.991 6.503 -28.939 1.00 0.00 S ATOM 0 H CYS A 764 30.750 10.328 -28.033 1.00 0.00 H new ATOM 0 HA CYS A 764 32.777 8.586 -29.422 1.00 0.00 H new ATOM 0 HB2 CYS A 764 29.719 8.491 -29.438 1.00 0.00 H new ATOM 0 HB3 CYS A 764 30.634 7.954 -30.832 1.00 0.00 H new ATOM 609 N ALA A 765 32.574 10.099 -31.460 1.00 0.00 N ATOM 610 CA ALA A 765 32.643 11.208 -32.458 1.00 0.00 C ATOM 611 C ALA A 765 31.448 11.139 -33.415 1.00 0.00 C ATOM 612 O ALA A 765 30.624 10.252 -33.317 1.00 0.00 O ATOM 613 CB ALA A 765 33.951 10.979 -33.211 1.00 0.00 C ATOM 0 H ALA A 765 33.129 9.274 -31.686 1.00 0.00 H new ATOM 0 HA ALA A 765 32.611 12.190 -31.987 1.00 0.00 H new ATOM 0 HB1 ALA A 765 34.077 11.755 -33.966 1.00 0.00 H new ATOM 0 HB2 ALA A 765 34.785 11.015 -32.510 1.00 0.00 H new ATOM 0 HB3 ALA A 765 33.926 10.003 -33.695 1.00 0.00 H new ATOM 619 N PRO A 766 31.397 12.087 -34.313 1.00 0.00 N ATOM 620 CA PRO A 766 30.296 12.140 -35.301 1.00 0.00 C ATOM 621 C PRO A 766 30.434 10.997 -36.306 1.00 0.00 C ATOM 622 O PRO A 766 31.522 10.529 -36.583 1.00 0.00 O ATOM 623 CB PRO A 766 30.478 13.493 -35.976 1.00 0.00 C ATOM 624 CG PRO A 766 31.927 13.819 -35.793 1.00 0.00 C ATOM 625 CD PRO A 766 32.357 13.177 -34.495 1.00 0.00 C ATOM 0 HA PRO A 766 29.309 12.032 -34.852 1.00 0.00 H new ATOM 0 HB2 PRO A 766 30.213 13.447 -37.032 1.00 0.00 H new ATOM 0 HB3 PRO A 766 29.841 14.251 -35.520 1.00 0.00 H new ATOM 0 HG2 PRO A 766 32.517 13.439 -36.627 1.00 0.00 H new ATOM 0 HG3 PRO A 766 32.080 14.898 -35.760 1.00 0.00 H new ATOM 0 HD2 PRO A 766 33.380 12.805 -34.552 1.00 0.00 H new ATOM 0 HD3 PRO A 766 32.321 13.885 -33.667 1.00 0.00 H new ATOM 633 N GLY A 767 29.343 10.539 -36.854 1.00 0.00 N ATOM 634 CA GLY A 767 29.419 9.424 -37.840 1.00 0.00 C ATOM 635 C GLY A 767 29.787 8.129 -37.107 1.00 0.00 C ATOM 636 O GLY A 767 29.971 7.093 -37.713 1.00 0.00 O ATOM 0 H GLY A 767 28.404 10.887 -36.663 1.00 0.00 H new ATOM 0 HA2 GLY A 767 28.463 9.308 -38.351 1.00 0.00 H new ATOM 0 HA3 GLY A 767 30.163 9.648 -38.604 1.00 0.00 H new ATOM 640 N GLN A 768 29.891 8.183 -35.802 1.00 0.00 N ATOM 641 CA GLN A 768 30.246 6.966 -35.020 1.00 0.00 C ATOM 642 C GLN A 768 29.168 6.692 -33.967 1.00 0.00 C ATOM 643 O GLN A 768 28.941 7.489 -33.078 1.00 0.00 O ATOM 644 CB GLN A 768 31.575 7.307 -34.344 1.00 0.00 C ATOM 645 CG GLN A 768 32.739 6.863 -35.233 1.00 0.00 C ATOM 646 CD GLN A 768 34.058 7.334 -34.616 1.00 0.00 C ATOM 647 OE1 GLN A 768 34.417 6.921 -33.532 1.00 0.00 O ATOM 648 NE2 GLN A 768 34.800 8.187 -35.267 1.00 0.00 N ATOM 0 H GLN A 768 29.744 9.025 -35.245 1.00 0.00 H new ATOM 0 HA GLN A 768 30.322 6.076 -35.645 1.00 0.00 H new ATOM 0 HB2 GLN A 768 31.635 8.380 -34.160 1.00 0.00 H new ATOM 0 HB3 GLN A 768 31.637 6.813 -33.374 1.00 0.00 H new ATOM 0 HG2 GLN A 768 32.740 5.778 -35.335 1.00 0.00 H new ATOM 0 HG3 GLN A 768 32.625 7.277 -36.235 1.00 0.00 H new ATOM 0 HE21 GLN A 768 34.499 8.534 -36.178 1.00 0.00 H new ATOM 0 HE22 GLN A 768 35.681 8.507 -34.865 1.00 0.00 H new ATOM 657 N THR A 769 28.501 5.576 -34.056 1.00 0.00 N ATOM 658 CA THR A 769 27.441 5.263 -33.053 1.00 0.00 C ATOM 659 C THR A 769 27.683 3.882 -32.438 1.00 0.00 C ATOM 660 O THR A 769 28.201 2.989 -33.079 1.00 0.00 O ATOM 661 CB THR A 769 26.132 5.273 -33.844 1.00 0.00 C ATOM 662 OG1 THR A 769 26.168 4.248 -34.829 1.00 0.00 O ATOM 663 CG2 THR A 769 25.954 6.632 -34.525 1.00 0.00 C ATOM 0 H THR A 769 28.642 4.868 -34.777 1.00 0.00 H new ATOM 0 HA THR A 769 27.428 5.979 -32.231 1.00 0.00 H new ATOM 0 HB THR A 769 25.297 5.098 -33.166 1.00 0.00 H new ATOM 0 HG1 THR A 769 25.329 4.252 -35.336 1.00 0.00 H new ATOM 0 HG21 THR A 769 25.021 6.637 -35.088 1.00 0.00 H new ATOM 0 HG22 THR A 769 25.926 7.417 -33.769 1.00 0.00 H new ATOM 0 HG23 THR A 769 26.788 6.811 -35.203 1.00 0.00 H new ATOM 671 N ILE A 770 27.313 3.700 -31.199 1.00 0.00 N ATOM 672 CA ILE A 770 27.524 2.375 -30.546 1.00 0.00 C ATOM 673 C ILE A 770 26.751 1.294 -31.306 1.00 0.00 C ATOM 674 O ILE A 770 25.539 1.325 -31.385 1.00 0.00 O ATOM 675 CB ILE A 770 26.974 2.538 -29.132 1.00 0.00 C ATOM 676 CG1 ILE A 770 27.748 3.644 -28.409 1.00 0.00 C ATOM 677 CG2 ILE A 770 27.133 1.222 -28.369 1.00 0.00 C ATOM 678 CD1 ILE A 770 27.044 3.984 -27.093 1.00 0.00 C ATOM 0 H ILE A 770 26.875 4.409 -30.612 1.00 0.00 H new ATOM 0 HA ILE A 770 28.572 2.075 -30.538 1.00 0.00 H new ATOM 0 HB ILE A 770 25.918 2.805 -29.180 1.00 0.00 H new ATOM 0 HG12 ILE A 770 28.770 3.319 -28.214 1.00 0.00 H new ATOM 0 HG13 ILE A 770 27.811 4.531 -29.040 1.00 0.00 H new ATOM 0 HG21 ILE A 770 26.740 1.337 -27.359 1.00 0.00 H new ATOM 0 HG22 ILE A 770 26.583 0.434 -28.884 1.00 0.00 H new ATOM 0 HG23 ILE A 770 28.189 0.955 -28.320 1.00 0.00 H new ATOM 0 HD11 ILE A 770 27.595 4.771 -26.578 1.00 0.00 H new ATOM 0 HD12 ILE A 770 26.030 4.327 -27.301 1.00 0.00 H new ATOM 0 HD13 ILE A 770 27.005 3.096 -26.462 1.00 0.00 H new ATOM 690 N SER A 771 27.439 0.338 -31.864 1.00 0.00 N ATOM 691 CA SER A 771 26.737 -0.740 -32.618 1.00 0.00 C ATOM 692 C SER A 771 26.757 -2.056 -31.834 1.00 0.00 C ATOM 693 O SER A 771 26.187 -3.044 -32.256 1.00 0.00 O ATOM 694 CB SER A 771 27.523 -0.885 -33.918 1.00 0.00 C ATOM 695 OG SER A 771 27.117 -2.076 -34.583 1.00 0.00 O ATOM 0 H SER A 771 28.455 0.255 -31.831 1.00 0.00 H new ATOM 0 HA SER A 771 25.689 -0.497 -32.792 1.00 0.00 H new ATOM 0 HB2 SER A 771 27.351 -0.020 -34.559 1.00 0.00 H new ATOM 0 HB3 SER A 771 28.592 -0.918 -33.708 1.00 0.00 H new ATOM 0 HG SER A 771 26.777 -2.718 -33.925 1.00 0.00 H new ATOM 701 N ALA A 772 27.400 -2.089 -30.698 1.00 0.00 N ATOM 702 CA ALA A 772 27.433 -3.362 -29.918 1.00 0.00 C ATOM 703 C ALA A 772 28.032 -3.146 -28.525 1.00 0.00 C ATOM 704 O ALA A 772 29.039 -2.486 -28.364 1.00 0.00 O ATOM 705 CB ALA A 772 28.327 -4.290 -30.737 1.00 0.00 C ATOM 0 H ALA A 772 27.897 -1.303 -30.280 1.00 0.00 H new ATOM 0 HA ALA A 772 26.433 -3.766 -29.762 1.00 0.00 H new ATOM 0 HB1 ALA A 772 28.408 -5.254 -30.235 1.00 0.00 H new ATOM 0 HB2 ALA A 772 27.894 -4.432 -31.727 1.00 0.00 H new ATOM 0 HB3 ALA A 772 29.318 -3.848 -30.834 1.00 0.00 H new ATOM 711 N ILE A 773 27.410 -3.702 -27.514 1.00 0.00 N ATOM 712 CA ILE A 773 27.938 -3.538 -26.128 1.00 0.00 C ATOM 713 C ILE A 773 29.002 -4.611 -25.871 1.00 0.00 C ATOM 714 O ILE A 773 28.770 -5.785 -26.078 1.00 0.00 O ATOM 715 CB ILE A 773 26.726 -3.736 -25.209 1.00 0.00 C ATOM 716 CG1 ILE A 773 25.551 -2.900 -25.724 1.00 0.00 C ATOM 717 CG2 ILE A 773 27.080 -3.293 -23.790 1.00 0.00 C ATOM 718 CD1 ILE A 773 25.869 -1.414 -25.555 1.00 0.00 C ATOM 0 H ILE A 773 26.561 -4.261 -27.591 1.00 0.00 H new ATOM 0 HA ILE A 773 28.403 -2.567 -25.960 1.00 0.00 H new ATOM 0 HB ILE A 773 26.448 -4.790 -25.201 1.00 0.00 H new ATOM 0 HG12 ILE A 773 25.363 -3.125 -26.774 1.00 0.00 H new ATOM 0 HG13 ILE A 773 24.643 -3.153 -25.176 1.00 0.00 H new ATOM 0 HG21 ILE A 773 26.217 -3.435 -23.139 1.00 0.00 H new ATOM 0 HG22 ILE A 773 27.915 -3.888 -23.421 1.00 0.00 H new ATOM 0 HG23 ILE A 773 27.360 -2.240 -23.797 1.00 0.00 H new ATOM 0 HD11 ILE A 773 25.033 -0.819 -25.922 1.00 0.00 H new ATOM 0 HD12 ILE A 773 26.035 -1.195 -24.500 1.00 0.00 H new ATOM 0 HD13 ILE A 773 26.766 -1.167 -26.123 1.00 0.00 H new ATOM 730 N LYS A 774 30.162 -4.223 -25.421 1.00 0.00 N ATOM 731 CA LYS A 774 31.230 -5.234 -25.160 1.00 0.00 C ATOM 732 C LYS A 774 30.994 -5.946 -23.823 1.00 0.00 C ATOM 733 O LYS A 774 31.235 -7.130 -23.694 1.00 0.00 O ATOM 734 CB LYS A 774 32.532 -4.437 -25.120 1.00 0.00 C ATOM 735 CG LYS A 774 33.707 -5.392 -24.889 1.00 0.00 C ATOM 736 CD LYS A 774 35.011 -4.710 -25.310 1.00 0.00 C ATOM 737 CE LYS A 774 35.454 -5.250 -26.674 1.00 0.00 C ATOM 738 NZ LYS A 774 35.197 -4.137 -27.630 1.00 0.00 N ATOM 0 H LYS A 774 30.418 -3.256 -25.223 1.00 0.00 H new ATOM 0 HA LYS A 774 31.247 -6.010 -25.925 1.00 0.00 H new ATOM 0 HB2 LYS A 774 32.668 -3.895 -26.056 1.00 0.00 H new ATOM 0 HB3 LYS A 774 32.492 -3.693 -24.324 1.00 0.00 H new ATOM 0 HG2 LYS A 774 33.756 -5.677 -23.838 1.00 0.00 H new ATOM 0 HG3 LYS A 774 33.562 -6.308 -25.461 1.00 0.00 H new ATOM 0 HD2 LYS A 774 34.868 -3.631 -25.363 1.00 0.00 H new ATOM 0 HD3 LYS A 774 35.786 -4.893 -24.566 1.00 0.00 H new ATOM 0 HE2 LYS A 774 36.508 -5.528 -26.665 1.00 0.00 H new ATOM 0 HE3 LYS A 774 34.891 -6.143 -26.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 34.722 -4.509 -28.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 34.590 -3.424 -27.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 36.100 -3.699 -27.904 1.00 0.00 H new ATOM 752 N PHE A 775 30.525 -5.244 -22.830 1.00 0.00 N ATOM 753 CA PHE A 775 30.284 -5.906 -21.513 1.00 0.00 C ATOM 754 C PHE A 775 29.502 -4.980 -20.577 1.00 0.00 C ATOM 755 O PHE A 775 29.601 -3.772 -20.652 1.00 0.00 O ATOM 756 CB PHE A 775 31.678 -6.186 -20.952 1.00 0.00 C ATOM 757 CG PHE A 775 31.555 -6.835 -19.593 1.00 0.00 C ATOM 758 CD1 PHE A 775 31.286 -8.206 -19.493 1.00 0.00 C ATOM 759 CD2 PHE A 775 31.708 -6.065 -18.435 1.00 0.00 C ATOM 760 CE1 PHE A 775 31.170 -8.805 -18.233 1.00 0.00 C ATOM 761 CE2 PHE A 775 31.593 -6.664 -17.176 1.00 0.00 C ATOM 762 CZ PHE A 775 31.324 -8.035 -17.074 1.00 0.00 C ATOM 0 H PHE A 775 30.299 -4.250 -22.869 1.00 0.00 H new ATOM 0 HA PHE A 775 29.692 -6.816 -21.614 1.00 0.00 H new ATOM 0 HB2 PHE A 775 32.230 -6.838 -21.629 1.00 0.00 H new ATOM 0 HB3 PHE A 775 32.243 -5.257 -20.873 1.00 0.00 H new ATOM 0 HD1 PHE A 775 31.168 -8.800 -20.387 1.00 0.00 H new ATOM 0 HD2 PHE A 775 31.915 -5.008 -18.513 1.00 0.00 H new ATOM 0 HE1 PHE A 775 30.962 -9.862 -18.155 1.00 0.00 H new ATOM 0 HE2 PHE A 775 31.712 -6.069 -16.282 1.00 0.00 H new ATOM 0 HZ PHE A 775 31.235 -8.498 -16.102 1.00 0.00 H new ATOM 772 N ALA A 776 28.728 -5.545 -19.696 1.00 0.00 N ATOM 773 CA ALA A 776 27.934 -4.716 -18.747 1.00 0.00 C ATOM 774 C ALA A 776 27.443 -5.591 -17.593 1.00 0.00 C ATOM 775 O ALA A 776 26.825 -6.614 -17.803 1.00 0.00 O ATOM 776 CB ALA A 776 26.755 -4.192 -19.564 1.00 0.00 C ATOM 0 H ALA A 776 28.610 -6.553 -19.591 1.00 0.00 H new ATOM 0 HA ALA A 776 28.515 -3.901 -18.314 1.00 0.00 H new ATOM 0 HB1 ALA A 776 26.122 -3.570 -18.931 1.00 0.00 H new ATOM 0 HB2 ALA A 776 27.126 -3.599 -20.400 1.00 0.00 H new ATOM 0 HB3 ALA A 776 26.174 -5.032 -19.945 1.00 0.00 H new ATOM 782 N SER A 777 27.713 -5.203 -16.379 1.00 0.00 N ATOM 783 CA SER A 777 27.253 -6.028 -15.225 1.00 0.00 C ATOM 784 C SER A 777 27.078 -5.161 -13.977 1.00 0.00 C ATOM 785 O SER A 777 27.992 -4.490 -13.537 1.00 0.00 O ATOM 786 CB SER A 777 28.359 -7.057 -15.013 1.00 0.00 C ATOM 787 OG SER A 777 28.247 -7.610 -13.708 1.00 0.00 O ATOM 0 H SER A 777 28.228 -4.357 -16.135 1.00 0.00 H new ATOM 0 HA SER A 777 26.287 -6.496 -15.415 1.00 0.00 H new ATOM 0 HB2 SER A 777 28.285 -7.846 -15.762 1.00 0.00 H new ATOM 0 HB3 SER A 777 29.335 -6.589 -15.139 1.00 0.00 H new ATOM 0 HG SER A 777 28.956 -8.272 -13.571 1.00 0.00 H new ATOM 793 N PHE A 778 25.906 -5.170 -13.406 1.00 0.00 N ATOM 794 CA PHE A 778 25.659 -4.352 -12.188 1.00 0.00 C ATOM 795 C PHE A 778 25.812 -5.225 -10.940 1.00 0.00 C ATOM 796 O PHE A 778 24.846 -5.722 -10.398 1.00 0.00 O ATOM 797 CB PHE A 778 24.217 -3.867 -12.329 1.00 0.00 C ATOM 798 CG PHE A 778 23.890 -2.916 -11.203 1.00 0.00 C ATOM 799 CD1 PHE A 778 24.634 -1.743 -11.040 1.00 0.00 C ATOM 800 CD2 PHE A 778 22.841 -3.209 -10.323 1.00 0.00 C ATOM 801 CE1 PHE A 778 24.330 -0.860 -9.997 1.00 0.00 C ATOM 802 CE2 PHE A 778 22.536 -2.326 -9.280 1.00 0.00 C ATOM 803 CZ PHE A 778 23.281 -1.152 -9.116 1.00 0.00 C ATOM 0 H PHE A 778 25.106 -5.711 -13.733 1.00 0.00 H new ATOM 0 HA PHE A 778 26.359 -3.523 -12.089 1.00 0.00 H new ATOM 0 HB2 PHE A 778 24.082 -3.369 -13.289 1.00 0.00 H new ATOM 0 HB3 PHE A 778 23.534 -4.716 -12.311 1.00 0.00 H new ATOM 0 HD1 PHE A 778 25.443 -1.518 -11.719 1.00 0.00 H new ATOM 0 HD2 PHE A 778 22.268 -4.115 -10.449 1.00 0.00 H new ATOM 0 HE1 PHE A 778 24.904 0.046 -9.872 1.00 0.00 H new ATOM 0 HE2 PHE A 778 21.726 -2.551 -8.602 1.00 0.00 H new ATOM 0 HZ PHE A 778 23.047 -0.472 -8.310 1.00 0.00 H new ATOM 813 N GLY A 779 27.019 -5.419 -10.483 1.00 0.00 N ATOM 814 CA GLY A 779 27.228 -6.262 -9.270 1.00 0.00 C ATOM 815 C GLY A 779 28.722 -6.353 -8.956 1.00 0.00 C ATOM 816 O GLY A 779 29.383 -5.356 -8.741 1.00 0.00 O ATOM 0 H GLY A 779 27.868 -5.032 -10.895 1.00 0.00 H new ATOM 0 HA2 GLY A 779 26.694 -5.834 -8.422 1.00 0.00 H new ATOM 0 HA3 GLY A 779 26.820 -7.259 -9.434 1.00 0.00 H new ATOM 820 N THR A 780 29.261 -7.543 -8.926 1.00 0.00 N ATOM 821 CA THR A 780 30.715 -7.698 -8.624 1.00 0.00 C ATOM 822 C THR A 780 31.458 -8.255 -9.844 1.00 0.00 C ATOM 823 O THR A 780 31.472 -9.448 -10.073 1.00 0.00 O ATOM 824 CB THR A 780 30.773 -8.691 -7.463 1.00 0.00 C ATOM 825 OG1 THR A 780 30.324 -9.964 -7.910 1.00 0.00 O ATOM 826 CG2 THR A 780 29.879 -8.203 -6.322 1.00 0.00 C ATOM 0 H THR A 780 28.758 -8.414 -9.097 1.00 0.00 H new ATOM 0 HA THR A 780 31.187 -6.748 -8.375 1.00 0.00 H new ATOM 0 HB THR A 780 31.799 -8.771 -7.105 1.00 0.00 H new ATOM 0 HG1 THR A 780 30.529 -10.067 -8.863 1.00 0.00 H new ATOM 0 HG21 THR A 780 29.923 -8.913 -5.496 1.00 0.00 H new ATOM 0 HG22 THR A 780 30.225 -7.227 -5.980 1.00 0.00 H new ATOM 0 HG23 THR A 780 28.851 -8.120 -6.675 1.00 0.00 H new ATOM 834 N PRO A 781 32.049 -7.363 -10.589 1.00 0.00 N ATOM 835 CA PRO A 781 32.802 -7.758 -11.797 1.00 0.00 C ATOM 836 C PRO A 781 34.190 -8.287 -11.416 1.00 0.00 C ATOM 837 O PRO A 781 34.575 -8.275 -10.263 1.00 0.00 O ATOM 838 CB PRO A 781 32.921 -6.463 -12.587 1.00 0.00 C ATOM 839 CG PRO A 781 32.813 -5.363 -11.568 1.00 0.00 C ATOM 840 CD PRO A 781 32.056 -5.915 -10.377 1.00 0.00 C ATOM 0 HA PRO A 781 32.315 -8.554 -12.360 1.00 0.00 H new ATOM 0 HB2 PRO A 781 33.871 -6.413 -13.120 1.00 0.00 H new ATOM 0 HB3 PRO A 781 32.132 -6.385 -13.335 1.00 0.00 H new ATOM 0 HG2 PRO A 781 33.803 -5.021 -11.267 1.00 0.00 H new ATOM 0 HG3 PRO A 781 32.292 -4.502 -11.987 1.00 0.00 H new ATOM 0 HD2 PRO A 781 32.546 -5.653 -9.439 1.00 0.00 H new ATOM 0 HD3 PRO A 781 31.043 -5.515 -10.330 1.00 0.00 H new ATOM 848 N LEU A 782 34.941 -8.751 -12.378 1.00 0.00 N ATOM 849 CA LEU A 782 36.305 -9.282 -12.073 1.00 0.00 C ATOM 850 C LEU A 782 37.300 -8.832 -13.150 1.00 0.00 C ATOM 851 O LEU A 782 37.305 -9.338 -14.254 1.00 0.00 O ATOM 852 CB LEU A 782 36.153 -10.804 -12.086 1.00 0.00 C ATOM 853 CG LEU A 782 36.004 -11.313 -10.653 1.00 0.00 C ATOM 854 CD1 LEU A 782 35.750 -12.822 -10.669 1.00 0.00 C ATOM 855 CD2 LEU A 782 37.290 -11.023 -9.876 1.00 0.00 C ATOM 0 H LEU A 782 34.671 -8.786 -13.361 1.00 0.00 H new ATOM 0 HA LEU A 782 36.684 -8.920 -11.117 1.00 0.00 H new ATOM 0 HB2 LEU A 782 35.282 -11.088 -12.677 1.00 0.00 H new ATOM 0 HB3 LEU A 782 37.022 -11.263 -12.558 1.00 0.00 H new ATOM 0 HG LEU A 782 35.165 -10.809 -10.174 1.00 0.00 H new ATOM 0 HD11 LEU A 782 35.644 -13.184 -9.646 1.00 0.00 H new ATOM 0 HD12 LEU A 782 34.836 -13.031 -11.225 1.00 0.00 H new ATOM 0 HD13 LEU A 782 36.589 -13.327 -11.147 1.00 0.00 H new ATOM 0 HD21 LEU A 782 37.187 -11.385 -8.853 1.00 0.00 H new ATOM 0 HD22 LEU A 782 38.127 -11.528 -10.357 1.00 0.00 H new ATOM 0 HD23 LEU A 782 37.473 -9.949 -9.864 1.00 0.00 H new ATOM 867 N GLY A 783 38.142 -7.885 -12.834 1.00 0.00 N ATOM 868 CA GLY A 783 39.134 -7.407 -13.840 1.00 0.00 C ATOM 869 C GLY A 783 38.668 -6.075 -14.428 1.00 0.00 C ATOM 870 O GLY A 783 37.659 -5.527 -14.029 1.00 0.00 O ATOM 0 H GLY A 783 38.186 -7.423 -11.926 1.00 0.00 H new ATOM 0 HA2 GLY A 783 40.112 -7.288 -13.373 1.00 0.00 H new ATOM 0 HA3 GLY A 783 39.248 -8.146 -14.633 1.00 0.00 H new ATOM 874 N THR A 784 39.394 -5.548 -15.376 1.00 0.00 N ATOM 875 CA THR A 784 38.991 -4.250 -15.992 1.00 0.00 C ATOM 876 C THR A 784 38.997 -4.369 -17.518 1.00 0.00 C ATOM 877 O THR A 784 38.994 -5.454 -18.064 1.00 0.00 O ATOM 878 CB THR A 784 40.049 -3.249 -15.527 1.00 0.00 C ATOM 879 OG1 THR A 784 41.266 -3.937 -15.267 1.00 0.00 O ATOM 880 CG2 THR A 784 39.571 -2.551 -14.251 1.00 0.00 C ATOM 0 H THR A 784 40.249 -5.959 -15.751 1.00 0.00 H new ATOM 0 HA THR A 784 37.986 -3.945 -15.701 1.00 0.00 H new ATOM 0 HB THR A 784 40.211 -2.503 -16.305 1.00 0.00 H new ATOM 0 HG1 THR A 784 41.947 -3.297 -14.970 1.00 0.00 H new ATOM 0 HG21 THR A 784 40.327 -1.838 -13.921 1.00 0.00 H new ATOM 0 HG22 THR A 784 38.638 -2.024 -14.452 1.00 0.00 H new ATOM 0 HG23 THR A 784 39.407 -3.293 -13.470 1.00 0.00 H new ATOM 888 N CYS A 785 39.002 -3.265 -18.214 1.00 0.00 N ATOM 889 CA CYS A 785 39.007 -3.329 -19.703 1.00 0.00 C ATOM 890 C CYS A 785 40.251 -4.076 -20.188 1.00 0.00 C ATOM 891 O CYS A 785 41.369 -3.647 -19.982 1.00 0.00 O ATOM 892 CB CYS A 785 39.024 -1.878 -20.173 1.00 0.00 C ATOM 893 SG CYS A 785 37.452 -1.498 -20.985 1.00 0.00 S ATOM 0 H CYS A 785 39.003 -2.325 -17.818 1.00 0.00 H new ATOM 0 HA CYS A 785 38.142 -3.862 -20.097 1.00 0.00 H new ATOM 0 HB2 CYS A 785 39.180 -1.210 -19.326 1.00 0.00 H new ATOM 0 HB3 CYS A 785 39.852 -1.716 -20.863 1.00 0.00 H new ATOM 898 N GLY A 786 40.060 -5.191 -20.833 1.00 0.00 N ATOM 899 CA GLY A 786 41.218 -5.980 -21.337 1.00 0.00 C ATOM 900 C GLY A 786 40.962 -7.458 -21.049 1.00 0.00 C ATOM 901 O GLY A 786 41.186 -8.315 -21.880 1.00 0.00 O ATOM 0 H GLY A 786 39.145 -5.593 -21.035 1.00 0.00 H new ATOM 0 HA2 GLY A 786 41.348 -5.820 -22.407 1.00 0.00 H new ATOM 0 HA3 GLY A 786 42.138 -5.654 -20.852 1.00 0.00 H new ATOM 905 N THR A 787 40.493 -7.757 -19.870 1.00 0.00 N ATOM 906 CA THR A 787 40.211 -9.166 -19.502 1.00 0.00 C ATOM 907 C THR A 787 39.030 -9.209 -18.524 1.00 0.00 C ATOM 908 O THR A 787 39.006 -9.989 -17.593 1.00 0.00 O ATOM 909 CB THR A 787 41.488 -9.660 -18.829 1.00 0.00 C ATOM 910 OG1 THR A 787 42.603 -9.378 -19.665 1.00 0.00 O ATOM 911 CG2 THR A 787 41.387 -11.162 -18.599 1.00 0.00 C ATOM 0 H THR A 787 40.292 -7.074 -19.139 1.00 0.00 H new ATOM 0 HA THR A 787 39.945 -9.784 -20.360 1.00 0.00 H new ATOM 0 HB THR A 787 41.618 -9.154 -17.872 1.00 0.00 H new ATOM 0 HG1 THR A 787 43.424 -9.694 -19.233 1.00 0.00 H new ATOM 0 HG21 THR A 787 42.298 -11.519 -18.118 1.00 0.00 H new ATOM 0 HG22 THR A 787 40.531 -11.375 -17.958 1.00 0.00 H new ATOM 0 HG23 THR A 787 41.259 -11.669 -19.556 1.00 0.00 H new ATOM 919 N PHE A 788 38.050 -8.370 -18.737 1.00 0.00 N ATOM 920 CA PHE A 788 36.860 -8.343 -17.832 1.00 0.00 C ATOM 921 C PHE A 788 36.285 -9.750 -17.636 1.00 0.00 C ATOM 922 O PHE A 788 36.736 -10.712 -18.225 1.00 0.00 O ATOM 923 CB PHE A 788 35.845 -7.456 -18.548 1.00 0.00 C ATOM 924 CG PHE A 788 35.751 -6.122 -17.849 1.00 0.00 C ATOM 925 CD1 PHE A 788 35.678 -4.943 -18.600 1.00 0.00 C ATOM 926 CD2 PHE A 788 35.740 -6.064 -16.451 1.00 0.00 C ATOM 927 CE1 PHE A 788 35.592 -3.705 -17.953 1.00 0.00 C ATOM 928 CE2 PHE A 788 35.652 -4.825 -15.803 1.00 0.00 C ATOM 929 CZ PHE A 788 35.578 -3.646 -16.555 1.00 0.00 C ATOM 0 H PHE A 788 38.022 -7.698 -19.504 1.00 0.00 H new ATOM 0 HA PHE A 788 37.116 -7.971 -16.840 1.00 0.00 H new ATOM 0 HB2 PHE A 788 36.142 -7.313 -19.587 1.00 0.00 H new ATOM 0 HB3 PHE A 788 34.869 -7.941 -18.560 1.00 0.00 H new ATOM 0 HD1 PHE A 788 35.688 -4.989 -19.679 1.00 0.00 H new ATOM 0 HD2 PHE A 788 35.799 -6.974 -15.872 1.00 0.00 H new ATOM 0 HE1 PHE A 788 35.536 -2.795 -18.533 1.00 0.00 H new ATOM 0 HE2 PHE A 788 35.641 -4.779 -14.724 1.00 0.00 H new ATOM 0 HZ PHE A 788 35.510 -2.691 -16.056 1.00 0.00 H new ATOM 939 N GLN A 789 35.285 -9.865 -16.804 1.00 0.00 N ATOM 940 CA GLN A 789 34.656 -11.195 -16.547 1.00 0.00 C ATOM 941 C GLN A 789 33.272 -10.994 -15.919 1.00 0.00 C ATOM 942 O GLN A 789 32.905 -9.898 -15.547 1.00 0.00 O ATOM 943 CB GLN A 789 35.600 -11.899 -15.569 1.00 0.00 C ATOM 944 CG GLN A 789 36.355 -13.014 -16.299 1.00 0.00 C ATOM 945 CD GLN A 789 37.424 -13.600 -15.374 1.00 0.00 C ATOM 946 OE1 GLN A 789 37.233 -14.651 -14.795 1.00 0.00 O ATOM 947 NE2 GLN A 789 38.550 -12.960 -15.208 1.00 0.00 N ATOM 0 H GLN A 789 34.873 -9.089 -16.287 1.00 0.00 H new ATOM 0 HA GLN A 789 34.516 -11.778 -17.457 1.00 0.00 H new ATOM 0 HB2 GLN A 789 36.306 -11.182 -15.149 1.00 0.00 H new ATOM 0 HB3 GLN A 789 35.033 -12.314 -14.736 1.00 0.00 H new ATOM 0 HG2 GLN A 789 35.660 -13.795 -16.609 1.00 0.00 H new ATOM 0 HG3 GLN A 789 36.818 -12.621 -17.204 1.00 0.00 H new ATOM 0 HE21 GLN A 789 38.711 -12.078 -15.694 1.00 0.00 H new ATOM 0 HE22 GLN A 789 39.268 -13.342 -14.593 1.00 0.00 H new ATOM 956 N GLN A 790 32.499 -12.038 -15.798 1.00 0.00 N ATOM 957 CA GLN A 790 31.143 -11.886 -15.193 1.00 0.00 C ATOM 958 C GLN A 790 31.217 -12.060 -13.676 1.00 0.00 C ATOM 959 O GLN A 790 30.233 -12.346 -13.023 1.00 0.00 O ATOM 960 CB GLN A 790 30.295 -12.990 -15.819 1.00 0.00 C ATOM 961 CG GLN A 790 28.822 -12.584 -15.778 1.00 0.00 C ATOM 962 CD GLN A 790 28.327 -12.305 -17.197 1.00 0.00 C ATOM 963 OE1 GLN A 790 29.112 -12.212 -18.120 1.00 0.00 O ATOM 964 NE2 GLN A 790 27.048 -12.165 -17.411 1.00 0.00 N ATOM 0 H GLN A 790 32.744 -12.984 -16.089 1.00 0.00 H new ATOM 0 HA GLN A 790 30.721 -10.898 -15.379 1.00 0.00 H new ATOM 0 HB2 GLN A 790 30.607 -13.164 -16.849 1.00 0.00 H new ATOM 0 HB3 GLN A 790 30.441 -13.926 -15.280 1.00 0.00 H new ATOM 0 HG2 GLN A 790 28.228 -13.378 -15.324 1.00 0.00 H new ATOM 0 HG3 GLN A 790 28.696 -11.697 -15.157 1.00 0.00 H new ATOM 0 HE21 GLN A 790 26.390 -12.243 -16.636 1.00 0.00 H new ATOM 0 HE22 GLN A 790 26.706 -11.977 -18.354 1.00 0.00 H new ATOM 973 N GLY A 791 32.377 -11.882 -13.114 1.00 0.00 N ATOM 974 CA GLY A 791 32.529 -12.035 -11.640 1.00 0.00 C ATOM 975 C GLY A 791 31.750 -13.259 -11.165 1.00 0.00 C ATOM 976 O GLY A 791 31.949 -14.358 -11.642 1.00 0.00 O ATOM 0 H GLY A 791 33.232 -11.636 -13.613 1.00 0.00 H new ATOM 0 HA2 GLY A 791 33.583 -12.141 -11.383 1.00 0.00 H new ATOM 0 HA3 GLY A 791 32.165 -11.141 -11.133 1.00 0.00 H new ATOM 980 N GLU A 792 30.862 -13.077 -10.229 1.00 0.00 N ATOM 981 CA GLU A 792 30.067 -14.232 -9.719 1.00 0.00 C ATOM 982 C GLU A 792 28.577 -13.866 -9.647 1.00 0.00 C ATOM 983 O GLU A 792 27.714 -14.706 -9.806 1.00 0.00 O ATOM 984 CB GLU A 792 30.622 -14.502 -8.320 1.00 0.00 C ATOM 985 CG GLU A 792 29.858 -15.663 -7.682 1.00 0.00 C ATOM 986 CD GLU A 792 30.560 -16.981 -8.015 1.00 0.00 C ATOM 987 OE1 GLU A 792 30.516 -17.378 -9.167 1.00 0.00 O ATOM 988 OE2 GLU A 792 31.131 -17.570 -7.111 1.00 0.00 O ATOM 0 H GLU A 792 30.651 -12.179 -9.794 1.00 0.00 H new ATOM 0 HA GLU A 792 30.145 -15.105 -10.367 1.00 0.00 H new ATOM 0 HB2 GLU A 792 31.684 -14.740 -8.379 1.00 0.00 H new ATOM 0 HB3 GLU A 792 30.529 -13.609 -7.702 1.00 0.00 H new ATOM 0 HG2 GLU A 792 29.807 -15.529 -6.601 1.00 0.00 H new ATOM 0 HG3 GLU A 792 28.832 -15.682 -8.049 1.00 0.00 H new ATOM 995 N CYS A 793 28.271 -12.618 -9.410 1.00 0.00 N ATOM 996 CA CYS A 793 26.839 -12.204 -9.327 1.00 0.00 C ATOM 997 C CYS A 793 26.479 -11.300 -10.511 1.00 0.00 C ATOM 998 O CYS A 793 27.245 -10.445 -10.909 1.00 0.00 O ATOM 999 CB CYS A 793 26.726 -11.432 -8.015 1.00 0.00 C ATOM 1000 SG CYS A 793 25.004 -11.433 -7.461 1.00 0.00 S ATOM 0 H CYS A 793 28.949 -11.869 -9.271 1.00 0.00 H new ATOM 0 HA CYS A 793 26.161 -13.057 -9.360 1.00 0.00 H new ATOM 0 HB2 CYS A 793 27.363 -11.887 -7.257 1.00 0.00 H new ATOM 0 HB3 CYS A 793 27.075 -10.408 -8.152 1.00 0.00 H new ATOM 1005 N HIS A 794 25.317 -11.483 -11.073 1.00 0.00 N ATOM 1006 CA HIS A 794 24.901 -10.636 -12.229 1.00 0.00 C ATOM 1007 C HIS A 794 23.381 -10.454 -12.223 1.00 0.00 C ATOM 1008 O HIS A 794 22.639 -11.363 -11.910 1.00 0.00 O ATOM 1009 CB HIS A 794 25.347 -11.415 -13.467 1.00 0.00 C ATOM 1010 CG HIS A 794 24.830 -10.735 -14.706 1.00 0.00 C ATOM 1011 ND1 HIS A 794 24.908 -9.362 -14.889 1.00 0.00 N ATOM 1012 CD2 HIS A 794 24.224 -11.228 -15.834 1.00 0.00 C ATOM 1013 CE1 HIS A 794 24.359 -9.083 -16.087 1.00 0.00 C ATOM 1014 NE2 HIS A 794 23.927 -10.186 -16.702 1.00 0.00 N ATOM 0 H HIS A 794 24.635 -12.184 -10.782 1.00 0.00 H new ATOM 0 HA HIS A 794 25.341 -9.639 -12.197 1.00 0.00 H new ATOM 0 HB2 HIS A 794 26.435 -11.474 -13.499 1.00 0.00 H new ATOM 0 HB3 HIS A 794 24.974 -12.438 -13.419 1.00 0.00 H new ATOM 0 HD2 HIS A 794 24.010 -12.270 -16.019 1.00 0.00 H new ATOM 0 HE1 HIS A 794 24.278 -8.088 -16.500 1.00 0.00 H new ATOM 0 HE2 HIS A 794 23.475 -10.250 -17.614 1.00 0.00 H new ATOM 1022 N SER A 795 22.914 -9.285 -12.563 1.00 0.00 N ATOM 1023 CA SER A 795 21.442 -9.045 -12.576 1.00 0.00 C ATOM 1024 C SER A 795 20.827 -9.566 -13.882 1.00 0.00 C ATOM 1025 O SER A 795 19.677 -9.308 -14.183 1.00 0.00 O ATOM 1026 CB SER A 795 21.290 -7.530 -12.473 1.00 0.00 C ATOM 1027 OG SER A 795 22.269 -6.903 -13.294 1.00 0.00 O ATOM 0 H SER A 795 23.487 -8.485 -12.832 1.00 0.00 H new ATOM 0 HA SER A 795 20.931 -9.562 -11.763 1.00 0.00 H new ATOM 0 HB2 SER A 795 20.290 -7.231 -12.787 1.00 0.00 H new ATOM 0 HB3 SER A 795 21.408 -7.211 -11.438 1.00 0.00 H new ATOM 0 HG SER A 795 22.425 -7.450 -14.092 1.00 0.00 H new ATOM 1033 N ILE A 796 21.584 -10.293 -14.661 1.00 0.00 N ATOM 1034 CA ILE A 796 21.040 -10.827 -15.947 1.00 0.00 C ATOM 1035 C ILE A 796 20.285 -9.730 -16.704 1.00 0.00 C ATOM 1036 O ILE A 796 19.435 -10.002 -17.526 1.00 0.00 O ATOM 1037 CB ILE A 796 20.088 -11.946 -15.541 1.00 0.00 C ATOM 1038 CG1 ILE A 796 20.866 -13.034 -14.795 1.00 0.00 C ATOM 1039 CG2 ILE A 796 19.443 -12.546 -16.793 1.00 0.00 C ATOM 1040 CD1 ILE A 796 19.927 -14.192 -14.454 1.00 0.00 C ATOM 0 H ILE A 796 22.554 -10.540 -14.464 1.00 0.00 H new ATOM 0 HA ILE A 796 21.829 -11.182 -16.609 1.00 0.00 H new ATOM 0 HB ILE A 796 19.312 -11.544 -14.889 1.00 0.00 H new ATOM 0 HG12 ILE A 796 21.692 -13.391 -15.410 1.00 0.00 H new ATOM 0 HG13 ILE A 796 21.301 -12.624 -13.883 1.00 0.00 H new ATOM 0 HG21 ILE A 796 18.762 -13.346 -16.504 1.00 0.00 H new ATOM 0 HG22 ILE A 796 18.888 -11.772 -17.323 1.00 0.00 H new ATOM 0 HG23 ILE A 796 20.219 -12.948 -17.445 1.00 0.00 H new ATOM 0 HD11 ILE A 796 20.481 -14.966 -13.923 1.00 0.00 H new ATOM 0 HD12 ILE A 796 19.116 -13.829 -13.823 1.00 0.00 H new ATOM 0 HD13 ILE A 796 19.513 -14.608 -15.373 1.00 0.00 H new ATOM 1052 N ASN A 797 20.594 -8.493 -16.432 1.00 0.00 N ATOM 1053 CA ASN A 797 19.898 -7.376 -17.131 1.00 0.00 C ATOM 1054 C ASN A 797 20.832 -6.171 -17.240 1.00 0.00 C ATOM 1055 O ASN A 797 20.408 -5.061 -17.484 1.00 0.00 O ATOM 1056 CB ASN A 797 18.696 -7.045 -16.246 1.00 0.00 C ATOM 1057 CG ASN A 797 17.555 -6.507 -17.113 1.00 0.00 C ATOM 1058 OD1 ASN A 797 16.758 -7.265 -17.627 1.00 0.00 O ATOM 1059 ND2 ASN A 797 17.444 -5.219 -17.296 1.00 0.00 N ATOM 0 H ASN A 797 21.300 -8.206 -15.754 1.00 0.00 H new ATOM 0 HA ASN A 797 19.595 -7.641 -18.144 1.00 0.00 H new ATOM 0 HB2 ASN A 797 18.370 -7.936 -15.709 1.00 0.00 H new ATOM 0 HB3 ASN A 797 18.976 -6.306 -15.496 1.00 0.00 H new ATOM 0 HD21 ASN A 797 16.687 -4.849 -17.871 1.00 0.00 H new ATOM 0 HD22 ASN A 797 18.114 -4.583 -16.864 1.00 0.00 H new ATOM 1066 N SER A 798 22.106 -6.389 -17.058 1.00 0.00 N ATOM 1067 CA SER A 798 23.078 -5.264 -17.147 1.00 0.00 C ATOM 1068 C SER A 798 23.421 -4.973 -18.608 1.00 0.00 C ATOM 1069 O SER A 798 23.724 -3.854 -18.973 1.00 0.00 O ATOM 1070 CB SER A 798 24.312 -5.757 -16.403 1.00 0.00 C ATOM 1071 OG SER A 798 23.906 -6.467 -15.241 1.00 0.00 O ATOM 0 H SER A 798 22.516 -7.300 -16.851 1.00 0.00 H new ATOM 0 HA SER A 798 22.681 -4.341 -16.724 1.00 0.00 H new ATOM 0 HB2 SER A 798 24.907 -6.403 -17.049 1.00 0.00 H new ATOM 0 HB3 SER A 798 24.945 -4.914 -16.126 1.00 0.00 H new ATOM 0 HG SER A 798 23.233 -5.945 -14.757 1.00 0.00 H new ATOM 1077 N ASN A 799 23.375 -5.969 -19.447 1.00 0.00 N ATOM 1078 CA ASN A 799 23.699 -5.746 -20.885 1.00 0.00 C ATOM 1079 C ASN A 799 22.451 -5.300 -21.654 1.00 0.00 C ATOM 1080 O ASN A 799 22.532 -4.868 -22.786 1.00 0.00 O ATOM 1081 CB ASN A 799 24.186 -7.101 -21.393 1.00 0.00 C ATOM 1082 CG ASN A 799 25.166 -6.890 -22.547 1.00 0.00 C ATOM 1083 OD1 ASN A 799 26.164 -6.212 -22.396 1.00 0.00 O ATOM 1084 ND2 ASN A 799 24.923 -7.442 -23.703 1.00 0.00 N ATOM 0 H ASN A 799 23.127 -6.927 -19.201 1.00 0.00 H new ATOM 0 HA ASN A 799 24.446 -4.964 -21.021 1.00 0.00 H new ATOM 0 HB2 ASN A 799 24.670 -7.651 -20.586 1.00 0.00 H new ATOM 0 HB3 ASN A 799 23.340 -7.702 -21.726 1.00 0.00 H new ATOM 0 HD21 ASN A 799 25.570 -7.305 -24.480 1.00 0.00 H new ATOM 0 HD22 ASN A 799 24.086 -8.011 -23.831 1.00 0.00 H new ATOM 1091 N SER A 800 21.298 -5.399 -21.049 1.00 0.00 N ATOM 1092 CA SER A 800 20.052 -4.977 -21.754 1.00 0.00 C ATOM 1093 C SER A 800 19.802 -3.482 -21.535 1.00 0.00 C ATOM 1094 O SER A 800 19.093 -2.845 -22.288 1.00 0.00 O ATOM 1095 CB SER A 800 18.938 -5.805 -21.121 1.00 0.00 C ATOM 1096 OG SER A 800 19.257 -7.185 -21.234 1.00 0.00 O ATOM 0 H SER A 800 21.164 -5.752 -20.101 1.00 0.00 H new ATOM 0 HA SER A 800 20.113 -5.134 -22.831 1.00 0.00 H new ATOM 0 HB2 SER A 800 18.817 -5.532 -20.073 1.00 0.00 H new ATOM 0 HB3 SER A 800 17.989 -5.598 -21.615 1.00 0.00 H new ATOM 0 HG SER A 800 18.544 -7.720 -20.827 1.00 0.00 H new ATOM 1102 N VAL A 801 20.379 -2.918 -20.510 1.00 0.00 N ATOM 1103 CA VAL A 801 20.173 -1.466 -20.244 1.00 0.00 C ATOM 1104 C VAL A 801 20.960 -0.626 -21.256 1.00 0.00 C ATOM 1105 O VAL A 801 20.476 0.366 -21.764 1.00 0.00 O ATOM 1106 CB VAL A 801 20.706 -1.244 -18.829 1.00 0.00 C ATOM 1107 CG1 VAL A 801 20.445 0.202 -18.405 1.00 0.00 C ATOM 1108 CG2 VAL A 801 19.990 -2.194 -17.864 1.00 0.00 C ATOM 0 H VAL A 801 20.984 -3.400 -19.845 1.00 0.00 H new ATOM 0 HA VAL A 801 19.127 -1.172 -20.335 1.00 0.00 H new ATOM 0 HB VAL A 801 21.778 -1.440 -18.809 1.00 0.00 H new ATOM 0 HG11 VAL A 801 20.825 0.360 -17.396 1.00 0.00 H new ATOM 0 HG12 VAL A 801 20.950 0.880 -19.093 1.00 0.00 H new ATOM 0 HG13 VAL A 801 19.373 0.399 -18.424 1.00 0.00 H new ATOM 0 HG21 VAL A 801 20.368 -2.039 -16.853 1.00 0.00 H new ATOM 0 HG22 VAL A 801 18.919 -1.995 -17.886 1.00 0.00 H new ATOM 0 HG23 VAL A 801 20.174 -3.225 -18.165 1.00 0.00 H new ATOM 1118 N LEU A 802 22.168 -1.018 -21.555 1.00 0.00 N ATOM 1119 CA LEU A 802 22.983 -0.242 -22.535 1.00 0.00 C ATOM 1120 C LEU A 802 22.493 -0.513 -23.963 1.00 0.00 C ATOM 1121 O LEU A 802 22.405 0.380 -24.781 1.00 0.00 O ATOM 1122 CB LEU A 802 24.411 -0.752 -22.352 1.00 0.00 C ATOM 1123 CG LEU A 802 25.031 -0.109 -21.110 1.00 0.00 C ATOM 1124 CD1 LEU A 802 24.945 1.414 -21.225 1.00 0.00 C ATOM 1125 CD2 LEU A 802 24.267 -0.568 -19.865 1.00 0.00 C ATOM 0 H LEU A 802 22.626 -1.841 -21.164 1.00 0.00 H new ATOM 0 HA LEU A 802 22.911 0.834 -22.374 1.00 0.00 H new ATOM 0 HB2 LEU A 802 24.410 -1.837 -22.250 1.00 0.00 H new ATOM 0 HB3 LEU A 802 25.008 -0.515 -23.233 1.00 0.00 H new ATOM 0 HG LEU A 802 26.076 -0.409 -21.030 1.00 0.00 H new ATOM 0 HD11 LEU A 802 25.387 1.871 -20.340 1.00 0.00 H new ATOM 0 HD12 LEU A 802 25.486 1.743 -22.112 1.00 0.00 H new ATOM 0 HD13 LEU A 802 23.900 1.714 -21.305 1.00 0.00 H new ATOM 0 HD21 LEU A 802 24.707 -0.111 -18.979 1.00 0.00 H new ATOM 0 HD22 LEU A 802 23.223 -0.267 -19.948 1.00 0.00 H new ATOM 0 HD23 LEU A 802 24.326 -1.653 -19.781 1.00 0.00 H new ATOM 1137 N GLU A 803 22.176 -1.741 -24.268 1.00 0.00 N ATOM 1138 CA GLU A 803 21.692 -2.069 -25.639 1.00 0.00 C ATOM 1139 C GLU A 803 20.255 -1.564 -25.842 1.00 0.00 C ATOM 1140 O GLU A 803 19.787 -1.432 -26.955 1.00 0.00 O ATOM 1141 CB GLU A 803 21.739 -3.595 -25.718 1.00 0.00 C ATOM 1142 CG GLU A 803 21.332 -4.046 -27.121 1.00 0.00 C ATOM 1143 CD GLU A 803 22.096 -5.318 -27.491 1.00 0.00 C ATOM 1144 OE1 GLU A 803 21.466 -6.359 -27.576 1.00 0.00 O ATOM 1145 OE2 GLU A 803 23.298 -5.230 -27.682 1.00 0.00 O ATOM 0 H GLU A 803 22.231 -2.532 -23.627 1.00 0.00 H new ATOM 0 HA GLU A 803 22.300 -1.598 -26.411 1.00 0.00 H new ATOM 0 HB2 GLU A 803 22.743 -3.951 -25.487 1.00 0.00 H new ATOM 0 HB3 GLU A 803 21.069 -4.029 -24.976 1.00 0.00 H new ATOM 0 HG2 GLU A 803 20.258 -4.231 -27.158 1.00 0.00 H new ATOM 0 HG3 GLU A 803 21.545 -3.258 -27.844 1.00 0.00 H new ATOM 1152 N ARG A 804 19.553 -1.282 -24.776 1.00 0.00 N ATOM 1153 CA ARG A 804 18.148 -0.787 -24.917 1.00 0.00 C ATOM 1154 C ARG A 804 18.114 0.746 -25.030 1.00 0.00 C ATOM 1155 O ARG A 804 17.232 1.310 -25.647 1.00 0.00 O ATOM 1156 CB ARG A 804 17.437 -1.245 -23.642 1.00 0.00 C ATOM 1157 CG ARG A 804 16.117 -0.481 -23.488 1.00 0.00 C ATOM 1158 CD ARG A 804 15.010 -1.449 -23.065 1.00 0.00 C ATOM 1159 NE ARG A 804 14.089 -0.636 -22.223 1.00 0.00 N ATOM 1160 CZ ARG A 804 12.939 -0.240 -22.703 1.00 0.00 C ATOM 1161 NH1 ARG A 804 12.889 0.767 -23.534 1.00 0.00 N ATOM 1162 NH2 ARG A 804 11.839 -0.849 -22.351 1.00 0.00 N ATOM 0 H ARG A 804 19.888 -1.372 -23.817 1.00 0.00 H new ATOM 0 HA ARG A 804 17.671 -1.174 -25.818 1.00 0.00 H new ATOM 0 HB2 ARG A 804 17.246 -2.317 -23.685 1.00 0.00 H new ATOM 0 HB3 ARG A 804 18.074 -1.070 -22.775 1.00 0.00 H new ATOM 0 HG2 ARG A 804 16.227 0.309 -22.745 1.00 0.00 H new ATOM 0 HG3 ARG A 804 15.852 0.001 -24.429 1.00 0.00 H new ATOM 0 HD2 ARG A 804 14.493 -1.860 -23.932 1.00 0.00 H new ATOM 0 HD3 ARG A 804 15.415 -2.292 -22.506 1.00 0.00 H new ATOM 0 HE ARG A 804 14.356 -0.388 -21.270 1.00 0.00 H new ATOM 0 HH11 ARG A 804 13.747 1.245 -23.809 1.00 0.00 H new ATOM 0 HH12 ARG A 804 11.992 1.075 -23.908 1.00 0.00 H new ATOM 0 HH21 ARG A 804 11.876 -1.634 -21.701 1.00 0.00 H new ATOM 0 HH22 ARG A 804 10.942 -0.539 -22.726 1.00 0.00 H new ATOM 1176 N LYS A 805 19.062 1.424 -24.442 1.00 0.00 N ATOM 1177 CA LYS A 805 19.066 2.918 -24.526 1.00 0.00 C ATOM 1178 C LYS A 805 20.373 3.429 -25.149 1.00 0.00 C ATOM 1179 O LYS A 805 20.370 4.334 -25.960 1.00 0.00 O ATOM 1180 CB LYS A 805 18.944 3.392 -23.077 1.00 0.00 C ATOM 1181 CG LYS A 805 18.721 4.906 -23.051 1.00 0.00 C ATOM 1182 CD LYS A 805 19.559 5.527 -21.930 1.00 0.00 C ATOM 1183 CE LYS A 805 18.803 5.413 -20.604 1.00 0.00 C ATOM 1184 NZ LYS A 805 19.812 5.739 -19.558 1.00 0.00 N ATOM 0 H LYS A 805 19.830 1.014 -23.910 1.00 0.00 H new ATOM 0 HA LYS A 805 18.258 3.292 -25.154 1.00 0.00 H new ATOM 0 HB2 LYS A 805 18.115 2.883 -22.586 1.00 0.00 H new ATOM 0 HB3 LYS A 805 19.847 3.137 -22.523 1.00 0.00 H new ATOM 0 HG2 LYS A 805 18.999 5.342 -24.011 1.00 0.00 H new ATOM 0 HG3 LYS A 805 17.665 5.126 -22.895 1.00 0.00 H new ATOM 0 HD2 LYS A 805 20.521 5.020 -21.857 1.00 0.00 H new ATOM 0 HD3 LYS A 805 19.767 6.573 -22.154 1.00 0.00 H new ATOM 0 HE2 LYS A 805 17.960 6.104 -20.569 1.00 0.00 H new ATOM 0 HE3 LYS A 805 18.399 4.410 -20.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 805 19.921 4.928 -18.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 805 20.725 5.948 -20.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 805 19.496 6.569 -19.017 1.00 0.00 H new ATOM 1198 N CYS A 806 21.483 2.858 -24.779 1.00 0.00 N ATOM 1199 CA CYS A 806 22.786 3.315 -25.353 1.00 0.00 C ATOM 1200 C CYS A 806 23.077 2.598 -26.674 1.00 0.00 C ATOM 1201 O CYS A 806 23.970 1.780 -26.762 1.00 0.00 O ATOM 1202 CB CYS A 806 23.825 2.941 -24.301 1.00 0.00 C ATOM 1203 SG CYS A 806 24.283 4.415 -23.359 1.00 0.00 S ATOM 0 H CYS A 806 21.549 2.095 -24.105 1.00 0.00 H new ATOM 0 HA CYS A 806 22.786 4.382 -25.574 1.00 0.00 H new ATOM 0 HB2 CYS A 806 23.424 2.179 -23.633 1.00 0.00 H new ATOM 0 HB3 CYS A 806 24.706 2.514 -24.780 1.00 0.00 H new ATOM 1208 N ILE A 807 22.334 2.904 -27.703 1.00 0.00 N ATOM 1209 CA ILE A 807 22.571 2.241 -29.013 1.00 0.00 C ATOM 1210 C ILE A 807 22.194 3.180 -30.167 1.00 0.00 C ATOM 1211 O ILE A 807 21.071 3.632 -30.272 1.00 0.00 O ATOM 1212 CB ILE A 807 21.657 1.028 -28.991 1.00 0.00 C ATOM 1213 CG1 ILE A 807 22.252 -0.038 -28.072 1.00 0.00 C ATOM 1214 CG2 ILE A 807 21.519 0.465 -30.407 1.00 0.00 C ATOM 1215 CD1 ILE A 807 23.587 -0.518 -28.644 1.00 0.00 C ATOM 0 H ILE A 807 21.574 3.584 -27.691 1.00 0.00 H new ATOM 0 HA ILE A 807 23.617 1.972 -29.162 1.00 0.00 H new ATOM 0 HB ILE A 807 20.674 1.319 -28.622 1.00 0.00 H new ATOM 0 HG12 ILE A 807 22.398 0.370 -27.072 1.00 0.00 H new ATOM 0 HG13 ILE A 807 21.563 -0.877 -27.977 1.00 0.00 H new ATOM 0 HG21 ILE A 807 20.863 -0.405 -30.390 1.00 0.00 H new ATOM 0 HG22 ILE A 807 21.095 1.226 -31.062 1.00 0.00 H new ATOM 0 HG23 ILE A 807 22.501 0.172 -30.779 1.00 0.00 H new ATOM 0 HD11 ILE A 807 24.011 -1.278 -27.988 1.00 0.00 H new ATOM 0 HD12 ILE A 807 23.427 -0.942 -29.635 1.00 0.00 H new ATOM 0 HD13 ILE A 807 24.276 0.324 -28.716 1.00 0.00 H new ATOM 1227 N GLY A 808 23.124 3.475 -31.033 1.00 0.00 N ATOM 1228 CA GLY A 808 22.820 4.381 -32.177 1.00 0.00 C ATOM 1229 C GLY A 808 22.966 5.839 -31.739 1.00 0.00 C ATOM 1230 O GLY A 808 22.388 6.732 -32.327 1.00 0.00 O ATOM 0 H GLY A 808 24.082 3.128 -30.998 1.00 0.00 H new ATOM 0 HA2 GLY A 808 23.495 4.172 -33.007 1.00 0.00 H new ATOM 0 HA3 GLY A 808 21.807 4.200 -32.537 1.00 0.00 H new ATOM 1234 N LEU A 809 23.735 6.093 -30.715 1.00 0.00 N ATOM 1235 CA LEU A 809 23.909 7.501 -30.249 1.00 0.00 C ATOM 1236 C LEU A 809 25.396 7.891 -30.250 1.00 0.00 C ATOM 1237 O LEU A 809 26.264 7.071 -30.029 1.00 0.00 O ATOM 1238 CB LEU A 809 23.351 7.512 -28.828 1.00 0.00 C ATOM 1239 CG LEU A 809 21.828 7.417 -28.880 1.00 0.00 C ATOM 1240 CD1 LEU A 809 21.285 7.127 -27.478 1.00 0.00 C ATOM 1241 CD2 LEU A 809 21.252 8.743 -29.386 1.00 0.00 C ATOM 0 H LEU A 809 24.249 5.391 -30.182 1.00 0.00 H new ATOM 0 HA LEU A 809 23.401 8.215 -30.896 1.00 0.00 H new ATOM 0 HB2 LEU A 809 23.759 6.677 -28.259 1.00 0.00 H new ATOM 0 HB3 LEU A 809 23.652 8.425 -28.314 1.00 0.00 H new ATOM 0 HG LEU A 809 21.537 6.612 -29.555 1.00 0.00 H new ATOM 0 HD11 LEU A 809 20.198 7.059 -27.516 1.00 0.00 H new ATOM 0 HD12 LEU A 809 21.695 6.184 -27.117 1.00 0.00 H new ATOM 0 HD13 LEU A 809 21.575 7.931 -26.802 1.00 0.00 H new ATOM 0 HD21 LEU A 809 20.165 8.677 -29.424 1.00 0.00 H new ATOM 0 HD22 LEU A 809 21.543 9.548 -28.711 1.00 0.00 H new ATOM 0 HD23 LEU A 809 21.638 8.950 -30.384 1.00 0.00 H new ATOM 1253 N GLU A 810 25.691 9.143 -30.498 1.00 0.00 N ATOM 1254 CA GLU A 810 27.116 9.590 -30.515 1.00 0.00 C ATOM 1255 C GLU A 810 27.590 9.889 -29.087 1.00 0.00 C ATOM 1256 O GLU A 810 28.714 10.293 -28.862 1.00 0.00 O ATOM 1257 CB GLU A 810 27.119 10.863 -31.361 1.00 0.00 C ATOM 1258 CG GLU A 810 26.633 10.536 -32.775 1.00 0.00 C ATOM 1259 CD GLU A 810 25.309 11.254 -33.040 1.00 0.00 C ATOM 1260 OE1 GLU A 810 24.407 10.617 -33.558 1.00 0.00 O ATOM 1261 OE2 GLU A 810 25.219 12.427 -32.719 1.00 0.00 O ATOM 0 H GLU A 810 25.006 9.874 -30.689 1.00 0.00 H new ATOM 0 HA GLU A 810 27.786 8.831 -30.920 1.00 0.00 H new ATOM 0 HB2 GLU A 810 26.473 11.615 -30.908 1.00 0.00 H new ATOM 0 HB3 GLU A 810 28.123 11.285 -31.398 1.00 0.00 H new ATOM 0 HG2 GLU A 810 27.379 10.845 -33.507 1.00 0.00 H new ATOM 0 HG3 GLU A 810 26.503 9.459 -32.886 1.00 0.00 H new ATOM 1268 N ARG A 811 26.732 9.693 -28.125 1.00 0.00 N ATOM 1269 CA ARG A 811 27.110 9.959 -26.707 1.00 0.00 C ATOM 1270 C ARG A 811 26.255 9.085 -25.788 1.00 0.00 C ATOM 1271 O ARG A 811 25.210 8.604 -26.179 1.00 0.00 O ATOM 1272 CB ARG A 811 26.804 11.440 -26.487 1.00 0.00 C ATOM 1273 CG ARG A 811 27.692 11.988 -25.373 1.00 0.00 C ATOM 1274 CD ARG A 811 27.603 13.516 -25.355 1.00 0.00 C ATOM 1275 NE ARG A 811 28.472 13.937 -24.224 1.00 0.00 N ATOM 1276 CZ ARG A 811 28.551 15.197 -23.900 1.00 0.00 C ATOM 1277 NH1 ARG A 811 28.711 16.101 -24.828 1.00 0.00 N ATOM 1278 NH2 ARG A 811 28.469 15.553 -22.649 1.00 0.00 N ATOM 0 H ARG A 811 25.778 9.358 -28.260 1.00 0.00 H new ATOM 0 HA ARG A 811 28.155 9.733 -26.494 1.00 0.00 H new ATOM 0 HB2 ARG A 811 26.974 11.997 -27.408 1.00 0.00 H new ATOM 0 HB3 ARG A 811 25.754 11.569 -26.225 1.00 0.00 H new ATOM 0 HG2 ARG A 811 27.378 11.583 -24.411 1.00 0.00 H new ATOM 0 HG3 ARG A 811 28.724 11.675 -25.529 1.00 0.00 H new ATOM 0 HD2 ARG A 811 27.947 13.943 -26.297 1.00 0.00 H new ATOM 0 HD3 ARG A 811 26.576 13.850 -25.210 1.00 0.00 H new ATOM 0 HE ARG A 811 29.005 13.241 -23.703 1.00 0.00 H new ATOM 0 HH11 ARG A 811 28.774 15.821 -25.807 1.00 0.00 H new ATOM 0 HH12 ARG A 811 28.773 17.087 -24.574 1.00 0.00 H new ATOM 0 HH21 ARG A 811 28.343 14.846 -21.925 1.00 0.00 H new ATOM 0 HH22 ARG A 811 28.531 16.539 -22.394 1.00 0.00 H new ATOM 1292 N CYS A 812 26.675 8.871 -24.571 1.00 0.00 N ATOM 1293 CA CYS A 812 25.853 8.020 -23.661 1.00 0.00 C ATOM 1294 C CYS A 812 26.121 8.342 -22.187 1.00 0.00 C ATOM 1295 O CYS A 812 27.228 8.641 -21.792 1.00 0.00 O ATOM 1296 CB CYS A 812 26.279 6.590 -23.978 1.00 0.00 C ATOM 1297 SG CYS A 812 24.907 5.718 -24.765 1.00 0.00 S ATOM 0 H CYS A 812 27.537 9.241 -24.171 1.00 0.00 H new ATOM 0 HA CYS A 812 24.787 8.187 -23.814 1.00 0.00 H new ATOM 0 HB2 CYS A 812 27.147 6.595 -24.637 1.00 0.00 H new ATOM 0 HB3 CYS A 812 26.575 6.076 -23.064 1.00 0.00 H new ATOM 1302 N VAL A 813 25.099 8.278 -21.378 1.00 0.00 N ATOM 1303 CA VAL A 813 25.256 8.572 -19.924 1.00 0.00 C ATOM 1304 C VAL A 813 24.144 7.863 -19.145 1.00 0.00 C ATOM 1305 O VAL A 813 22.988 8.224 -19.231 1.00 0.00 O ATOM 1306 CB VAL A 813 25.116 10.090 -19.798 1.00 0.00 C ATOM 1307 CG1 VAL A 813 25.412 10.508 -18.357 1.00 0.00 C ATOM 1308 CG2 VAL A 813 26.109 10.777 -20.740 1.00 0.00 C ATOM 0 H VAL A 813 24.152 8.032 -21.665 1.00 0.00 H new ATOM 0 HA VAL A 813 26.211 8.228 -19.527 1.00 0.00 H new ATOM 0 HB VAL A 813 24.101 10.384 -20.064 1.00 0.00 H new ATOM 0 HG11 VAL A 813 25.313 11.590 -18.264 1.00 0.00 H new ATOM 0 HG12 VAL A 813 24.707 10.020 -17.684 1.00 0.00 H new ATOM 0 HG13 VAL A 813 26.428 10.213 -18.094 1.00 0.00 H new ATOM 0 HG21 VAL A 813 26.008 11.859 -20.649 1.00 0.00 H new ATOM 0 HG22 VAL A 813 27.125 10.484 -20.475 1.00 0.00 H new ATOM 0 HG23 VAL A 813 25.902 10.478 -21.768 1.00 0.00 H new ATOM 1318 N VAL A 814 24.483 6.858 -18.387 1.00 0.00 N ATOM 1319 CA VAL A 814 23.435 6.132 -17.608 1.00 0.00 C ATOM 1320 C VAL A 814 23.558 6.442 -16.113 1.00 0.00 C ATOM 1321 O VAL A 814 24.573 6.190 -15.495 1.00 0.00 O ATOM 1322 CB VAL A 814 23.707 4.652 -17.874 1.00 0.00 C ATOM 1323 CG1 VAL A 814 22.803 3.795 -16.984 1.00 0.00 C ATOM 1324 CG2 VAL A 814 23.416 4.337 -19.344 1.00 0.00 C ATOM 0 H VAL A 814 25.434 6.508 -18.272 1.00 0.00 H new ATOM 0 HA VAL A 814 22.428 6.426 -17.902 1.00 0.00 H new ATOM 0 HB VAL A 814 24.751 4.431 -17.651 1.00 0.00 H new ATOM 0 HG11 VAL A 814 22.999 2.740 -17.175 1.00 0.00 H new ATOM 0 HG12 VAL A 814 23.007 4.018 -15.937 1.00 0.00 H new ATOM 0 HG13 VAL A 814 21.759 4.016 -17.205 1.00 0.00 H new ATOM 0 HG21 VAL A 814 23.610 3.282 -19.535 1.00 0.00 H new ATOM 0 HG22 VAL A 814 22.372 4.560 -19.564 1.00 0.00 H new ATOM 0 HG23 VAL A 814 24.059 4.945 -19.981 1.00 0.00 H new ATOM 1334 N ALA A 815 22.526 6.991 -15.532 1.00 0.00 N ATOM 1335 CA ALA A 815 22.571 7.322 -14.079 1.00 0.00 C ATOM 1336 C ALA A 815 22.359 6.056 -13.244 1.00 0.00 C ATOM 1337 O ALA A 815 21.258 5.757 -12.828 1.00 0.00 O ATOM 1338 CB ALA A 815 21.419 8.303 -13.865 1.00 0.00 C ATOM 0 H ALA A 815 21.652 7.225 -16.002 1.00 0.00 H new ATOM 0 HA ALA A 815 23.530 7.745 -13.778 1.00 0.00 H new ATOM 0 HB1 ALA A 815 21.382 8.598 -12.816 1.00 0.00 H new ATOM 0 HB2 ALA A 815 21.573 9.186 -14.485 1.00 0.00 H new ATOM 0 HB3 ALA A 815 20.479 7.826 -14.141 1.00 0.00 H new ATOM 1344 N ILE A 816 23.407 5.313 -12.998 1.00 0.00 N ATOM 1345 CA ILE A 816 23.271 4.063 -12.188 1.00 0.00 C ATOM 1346 C ILE A 816 22.295 4.276 -11.029 1.00 0.00 C ATOM 1347 O ILE A 816 22.243 5.334 -10.433 1.00 0.00 O ATOM 1348 CB ILE A 816 24.669 3.786 -11.650 1.00 0.00 C ATOM 1349 CG1 ILE A 816 25.604 3.424 -12.804 1.00 0.00 C ATOM 1350 CG2 ILE A 816 24.610 2.620 -10.662 1.00 0.00 C ATOM 1351 CD1 ILE A 816 27.028 3.862 -12.459 1.00 0.00 C ATOM 0 H ILE A 816 24.352 5.517 -13.323 1.00 0.00 H new ATOM 0 HA ILE A 816 22.884 3.235 -12.782 1.00 0.00 H new ATOM 0 HB ILE A 816 25.045 4.677 -11.146 1.00 0.00 H new ATOM 0 HG12 ILE A 816 25.576 2.350 -12.986 1.00 0.00 H new ATOM 0 HG13 ILE A 816 25.274 3.912 -13.721 1.00 0.00 H new ATOM 0 HG21 ILE A 816 25.609 2.420 -10.275 1.00 0.00 H new ATOM 0 HG22 ILE A 816 23.946 2.876 -9.836 1.00 0.00 H new ATOM 0 HG23 ILE A 816 24.232 1.732 -11.169 1.00 0.00 H new ATOM 0 HD11 ILE A 816 27.697 3.605 -13.280 1.00 0.00 H new ATOM 0 HD12 ILE A 816 27.048 4.940 -12.298 1.00 0.00 H new ATOM 0 HD13 ILE A 816 27.355 3.354 -11.552 1.00 0.00 H new ATOM 1363 N SER A 817 21.520 3.280 -10.709 1.00 0.00 N ATOM 1364 CA SER A 817 20.549 3.422 -9.590 1.00 0.00 C ATOM 1365 C SER A 817 20.167 2.039 -9.050 1.00 0.00 C ATOM 1366 O SER A 817 20.575 1.028 -9.589 1.00 0.00 O ATOM 1367 CB SER A 817 19.340 4.129 -10.203 1.00 0.00 C ATOM 1368 OG SER A 817 18.174 3.332 -10.017 1.00 0.00 O ATOM 0 H SER A 817 21.517 2.372 -11.174 1.00 0.00 H new ATOM 0 HA SER A 817 20.956 3.984 -8.749 1.00 0.00 H new ATOM 0 HB2 SER A 817 19.203 5.105 -9.738 1.00 0.00 H new ATOM 0 HB3 SER A 817 19.508 4.303 -11.266 1.00 0.00 H new ATOM 0 HG SER A 817 17.434 3.708 -10.538 1.00 0.00 H new ATOM 1374 N PRO A 818 19.395 2.043 -8.001 1.00 0.00 N ATOM 1375 CA PRO A 818 18.951 0.776 -7.376 1.00 0.00 C ATOM 1376 C PRO A 818 17.917 0.045 -8.252 1.00 0.00 C ATOM 1377 O PRO A 818 18.206 -0.977 -8.840 1.00 0.00 O ATOM 1378 CB PRO A 818 18.337 1.221 -6.054 1.00 0.00 C ATOM 1379 CG PRO A 818 17.928 2.648 -6.273 1.00 0.00 C ATOM 1380 CD PRO A 818 18.872 3.221 -7.303 1.00 0.00 C ATOM 0 HA PRO A 818 19.768 0.066 -7.246 1.00 0.00 H new ATOM 0 HB2 PRO A 818 17.480 0.602 -5.789 1.00 0.00 H new ATOM 0 HB3 PRO A 818 19.055 1.138 -5.238 1.00 0.00 H new ATOM 0 HG2 PRO A 818 16.896 2.705 -6.620 1.00 0.00 H new ATOM 0 HG3 PRO A 818 17.983 3.213 -5.342 1.00 0.00 H new ATOM 0 HD2 PRO A 818 18.355 3.893 -7.988 1.00 0.00 H new ATOM 0 HD3 PRO A 818 19.672 3.795 -6.835 1.00 0.00 H new ATOM 1388 N SER A 819 16.720 0.556 -8.342 1.00 0.00 N ATOM 1389 CA SER A 819 15.683 -0.122 -9.180 1.00 0.00 C ATOM 1390 C SER A 819 15.771 0.344 -10.637 1.00 0.00 C ATOM 1391 O SER A 819 14.769 0.534 -11.298 1.00 0.00 O ATOM 1392 CB SER A 819 14.349 0.285 -8.565 1.00 0.00 C ATOM 1393 OG SER A 819 13.760 -0.846 -7.931 1.00 0.00 O ATOM 0 H SER A 819 16.413 1.409 -7.875 1.00 0.00 H new ATOM 0 HA SER A 819 15.814 -1.204 -9.194 1.00 0.00 H new ATOM 0 HB2 SER A 819 14.498 1.086 -7.841 1.00 0.00 H new ATOM 0 HB3 SER A 819 13.683 0.672 -9.336 1.00 0.00 H new ATOM 0 HG SER A 819 12.903 -0.588 -7.533 1.00 0.00 H new ATOM 1399 N ASN A 820 16.958 0.528 -11.144 1.00 0.00 N ATOM 1400 CA ASN A 820 17.100 0.981 -12.558 1.00 0.00 C ATOM 1401 C ASN A 820 17.409 -0.218 -13.461 1.00 0.00 C ATOM 1402 O ASN A 820 16.989 -0.275 -14.600 1.00 0.00 O ATOM 1403 CB ASN A 820 18.270 1.965 -12.548 1.00 0.00 C ATOM 1404 CG ASN A 820 17.764 3.364 -12.913 1.00 0.00 C ATOM 1405 OD1 ASN A 820 17.008 3.962 -12.173 1.00 0.00 O ATOM 1406 ND2 ASN A 820 18.151 3.914 -14.032 1.00 0.00 N ATOM 0 H ASN A 820 17.835 0.385 -10.643 1.00 0.00 H new ATOM 0 HA ASN A 820 16.190 1.443 -12.940 1.00 0.00 H new ATOM 0 HB2 ASN A 820 18.737 1.981 -11.563 1.00 0.00 H new ATOM 0 HB3 ASN A 820 19.033 1.646 -13.258 1.00 0.00 H new ATOM 0 HD21 ASN A 820 17.819 4.845 -14.284 1.00 0.00 H new ATOM 0 HD22 ASN A 820 18.786 3.413 -14.654 1.00 0.00 H new ATOM 1413 N PHE A 821 18.138 -1.176 -12.959 1.00 0.00 N ATOM 1414 CA PHE A 821 18.475 -2.371 -13.785 1.00 0.00 C ATOM 1415 C PHE A 821 17.546 -3.535 -13.428 1.00 0.00 C ATOM 1416 O PHE A 821 17.037 -4.225 -14.290 1.00 0.00 O ATOM 1417 CB PHE A 821 19.919 -2.709 -13.421 1.00 0.00 C ATOM 1418 CG PHE A 821 20.862 -1.868 -14.249 1.00 0.00 C ATOM 1419 CD1 PHE A 821 22.038 -2.431 -14.754 1.00 0.00 C ATOM 1420 CD2 PHE A 821 20.559 -0.525 -14.510 1.00 0.00 C ATOM 1421 CE1 PHE A 821 22.914 -1.654 -15.521 1.00 0.00 C ATOM 1422 CE2 PHE A 821 21.435 0.252 -15.277 1.00 0.00 C ATOM 1423 CZ PHE A 821 22.613 -0.312 -15.782 1.00 0.00 C ATOM 0 H PHE A 821 18.516 -1.184 -12.012 1.00 0.00 H new ATOM 0 HA PHE A 821 18.357 -2.184 -14.852 1.00 0.00 H new ATOM 0 HB2 PHE A 821 20.089 -2.526 -12.360 1.00 0.00 H new ATOM 0 HB3 PHE A 821 20.110 -3.768 -13.597 1.00 0.00 H new ATOM 0 HD1 PHE A 821 22.271 -3.466 -14.552 1.00 0.00 H new ATOM 0 HD2 PHE A 821 19.651 -0.090 -14.120 1.00 0.00 H new ATOM 0 HE1 PHE A 821 23.822 -2.090 -15.911 1.00 0.00 H new ATOM 0 HE2 PHE A 821 21.202 1.287 -15.479 1.00 0.00 H new ATOM 0 HZ PHE A 821 23.289 0.288 -16.373 1.00 0.00 H new ATOM 1433 N GLY A 822 17.322 -3.759 -12.161 1.00 0.00 N ATOM 1434 CA GLY A 822 16.426 -4.878 -11.748 1.00 0.00 C ATOM 1435 C GLY A 822 16.033 -4.704 -10.280 1.00 0.00 C ATOM 1436 O GLY A 822 14.922 -4.999 -9.887 1.00 0.00 O ATOM 0 H GLY A 822 17.720 -3.216 -11.395 1.00 0.00 H new ATOM 0 HA2 GLY A 822 15.534 -4.894 -12.375 1.00 0.00 H new ATOM 0 HA3 GLY A 822 16.931 -5.833 -11.889 1.00 0.00 H new ATOM 1440 N GLY A 823 16.935 -4.228 -9.465 1.00 0.00 N ATOM 1441 CA GLY A 823 16.608 -4.038 -8.024 1.00 0.00 C ATOM 1442 C GLY A 823 17.749 -4.578 -7.161 1.00 0.00 C ATOM 1443 O GLY A 823 18.733 -3.906 -6.925 1.00 0.00 O ATOM 0 H GLY A 823 17.882 -3.963 -9.735 1.00 0.00 H new ATOM 0 HA2 GLY A 823 16.449 -2.980 -7.814 1.00 0.00 H new ATOM 0 HA3 GLY A 823 15.679 -4.554 -7.781 1.00 0.00 H new ATOM 1447 N ASP A 824 17.626 -5.789 -6.690 1.00 0.00 N ATOM 1448 CA ASP A 824 18.706 -6.373 -5.842 1.00 0.00 C ATOM 1449 C ASP A 824 18.772 -7.892 -6.034 1.00 0.00 C ATOM 1450 O ASP A 824 18.161 -8.637 -5.295 1.00 0.00 O ATOM 1451 CB ASP A 824 18.305 -6.034 -4.407 1.00 0.00 C ATOM 1452 CG ASP A 824 19.419 -6.461 -3.450 1.00 0.00 C ATOM 1453 OD1 ASP A 824 20.569 -6.422 -3.854 1.00 0.00 O ATOM 1454 OD2 ASP A 824 19.102 -6.820 -2.328 1.00 0.00 O ATOM 0 H ASP A 824 16.826 -6.399 -6.855 1.00 0.00 H new ATOM 0 HA ASP A 824 19.689 -5.979 -6.098 1.00 0.00 H new ATOM 0 HB2 ASP A 824 18.121 -4.964 -4.313 1.00 0.00 H new ATOM 0 HB3 ASP A 824 17.375 -6.541 -4.149 1.00 0.00 H new ATOM 1459 N PRO A 825 19.519 -8.299 -7.025 1.00 0.00 N ATOM 1460 CA PRO A 825 19.667 -9.742 -7.318 1.00 0.00 C ATOM 1461 C PRO A 825 20.530 -10.414 -6.248 1.00 0.00 C ATOM 1462 O PRO A 825 20.171 -11.436 -5.698 1.00 0.00 O ATOM 1463 CB PRO A 825 20.360 -9.768 -8.674 1.00 0.00 C ATOM 1464 CG PRO A 825 21.080 -8.457 -8.766 1.00 0.00 C ATOM 1465 CD PRO A 825 20.289 -7.463 -7.947 1.00 0.00 C ATOM 0 HA PRO A 825 18.718 -10.278 -7.325 1.00 0.00 H new ATOM 0 HB2 PRO A 825 21.054 -10.605 -8.747 1.00 0.00 H new ATOM 0 HB3 PRO A 825 19.639 -9.880 -9.484 1.00 0.00 H new ATOM 0 HG2 PRO A 825 22.097 -8.548 -8.386 1.00 0.00 H new ATOM 0 HG3 PRO A 825 21.155 -8.130 -9.803 1.00 0.00 H new ATOM 0 HD2 PRO A 825 20.944 -6.776 -7.411 1.00 0.00 H new ATOM 0 HD3 PRO A 825 19.637 -6.857 -8.576 1.00 0.00 H new ATOM 1473 N CYS A 826 21.667 -9.849 -5.950 1.00 0.00 N ATOM 1474 CA CYS A 826 22.548 -10.456 -4.915 1.00 0.00 C ATOM 1475 C CYS A 826 22.018 -10.117 -3.517 1.00 0.00 C ATOM 1476 O CYS A 826 21.496 -9.042 -3.295 1.00 0.00 O ATOM 1477 CB CYS A 826 23.915 -9.830 -5.144 1.00 0.00 C ATOM 1478 SG CYS A 826 25.128 -11.132 -5.470 1.00 0.00 S ATOM 0 H CYS A 826 22.023 -8.994 -6.378 1.00 0.00 H new ATOM 0 HA CYS A 826 22.588 -11.543 -4.984 1.00 0.00 H new ATOM 0 HB2 CYS A 826 23.874 -9.138 -5.985 1.00 0.00 H new ATOM 0 HB3 CYS A 826 24.213 -9.251 -4.270 1.00 0.00 H new ATOM 1483 N PRO A 827 22.173 -11.050 -2.622 1.00 0.00 N ATOM 1484 CA PRO A 827 21.705 -10.855 -1.230 1.00 0.00 C ATOM 1485 C PRO A 827 22.629 -9.911 -0.439 1.00 0.00 C ATOM 1486 O PRO A 827 23.783 -10.205 -0.199 1.00 0.00 O ATOM 1487 CB PRO A 827 21.737 -12.256 -0.640 1.00 0.00 C ATOM 1488 CG PRO A 827 22.751 -13.005 -1.455 1.00 0.00 C ATOM 1489 CD PRO A 827 22.786 -12.364 -2.825 1.00 0.00 C ATOM 0 HA PRO A 827 20.719 -10.392 -1.190 1.00 0.00 H new ATOM 0 HB2 PRO A 827 22.018 -12.233 0.413 1.00 0.00 H new ATOM 0 HB3 PRO A 827 20.757 -12.730 -0.699 1.00 0.00 H new ATOM 0 HG2 PRO A 827 23.733 -12.959 -0.984 1.00 0.00 H new ATOM 0 HG3 PRO A 827 22.482 -14.059 -1.530 1.00 0.00 H new ATOM 0 HD2 PRO A 827 23.807 -12.274 -3.197 1.00 0.00 H new ATOM 0 HD3 PRO A 827 22.232 -12.954 -3.555 1.00 0.00 H new ATOM 1497 N GLU A 828 22.109 -8.779 -0.037 1.00 0.00 N ATOM 1498 CA GLU A 828 22.917 -7.787 0.743 1.00 0.00 C ATOM 1499 C GLU A 828 24.377 -7.754 0.277 1.00 0.00 C ATOM 1500 O GLU A 828 25.284 -7.599 1.072 1.00 0.00 O ATOM 1501 CB GLU A 828 22.828 -8.266 2.190 1.00 0.00 C ATOM 1502 CG GLU A 828 21.362 -8.516 2.554 1.00 0.00 C ATOM 1503 CD GLU A 828 20.561 -7.229 2.357 1.00 0.00 C ATOM 1504 OE1 GLU A 828 20.684 -6.345 3.189 1.00 0.00 O ATOM 1505 OE2 GLU A 828 19.842 -7.146 1.375 1.00 0.00 O ATOM 0 H GLU A 828 21.146 -8.495 -0.218 1.00 0.00 H new ATOM 0 HA GLU A 828 22.540 -6.773 0.612 1.00 0.00 H new ATOM 0 HB2 GLU A 828 23.407 -9.181 2.318 1.00 0.00 H new ATOM 0 HB3 GLU A 828 23.258 -7.520 2.859 1.00 0.00 H new ATOM 0 HG2 GLU A 828 20.952 -9.311 1.931 1.00 0.00 H new ATOM 0 HG3 GLU A 828 21.285 -8.850 3.589 1.00 0.00 H new ATOM 1512 N VAL A 829 24.614 -7.896 -0.993 1.00 0.00 N ATOM 1513 CA VAL A 829 26.026 -7.866 -1.485 1.00 0.00 C ATOM 1514 C VAL A 829 26.413 -6.431 -1.857 1.00 0.00 C ATOM 1515 O VAL A 829 25.570 -5.567 -1.994 1.00 0.00 O ATOM 1516 CB VAL A 829 26.043 -8.757 -2.720 1.00 0.00 C ATOM 1517 CG1 VAL A 829 27.489 -8.990 -3.166 1.00 0.00 C ATOM 1518 CG2 VAL A 829 25.393 -10.101 -2.389 1.00 0.00 C ATOM 0 H VAL A 829 23.902 -8.031 -1.711 1.00 0.00 H new ATOM 0 HA VAL A 829 26.734 -8.211 -0.731 1.00 0.00 H new ATOM 0 HB VAL A 829 25.489 -8.271 -3.523 1.00 0.00 H new ATOM 0 HG11 VAL A 829 27.499 -9.628 -4.050 1.00 0.00 H new ATOM 0 HG12 VAL A 829 27.955 -8.034 -3.403 1.00 0.00 H new ATOM 0 HG13 VAL A 829 28.044 -9.475 -2.363 1.00 0.00 H new ATOM 0 HG21 VAL A 829 25.405 -10.739 -3.273 1.00 0.00 H new ATOM 0 HG22 VAL A 829 25.947 -10.585 -1.585 1.00 0.00 H new ATOM 0 HG23 VAL A 829 24.363 -9.939 -2.073 1.00 0.00 H new ATOM 1528 N MET A 830 27.680 -6.169 -2.023 1.00 0.00 N ATOM 1529 CA MET A 830 28.110 -4.787 -2.386 1.00 0.00 C ATOM 1530 C MET A 830 27.550 -4.407 -3.759 1.00 0.00 C ATOM 1531 O MET A 830 26.706 -5.091 -4.307 1.00 0.00 O ATOM 1532 CB MET A 830 29.636 -4.839 -2.426 1.00 0.00 C ATOM 1533 CG MET A 830 30.205 -3.732 -1.537 1.00 0.00 C ATOM 1534 SD MET A 830 31.987 -3.589 -1.819 1.00 0.00 S ATOM 1535 CE MET A 830 32.159 -1.862 -1.311 1.00 0.00 C ATOM 0 H MET A 830 28.434 -6.848 -1.924 1.00 0.00 H new ATOM 0 HA MET A 830 27.749 -4.043 -1.676 1.00 0.00 H new ATOM 0 HB2 MET A 830 29.987 -5.812 -2.083 1.00 0.00 H new ATOM 0 HB3 MET A 830 29.988 -4.716 -3.450 1.00 0.00 H new ATOM 0 HG2 MET A 830 29.714 -2.784 -1.758 1.00 0.00 H new ATOM 0 HG3 MET A 830 30.009 -3.956 -0.488 1.00 0.00 H new ATOM 0 HE1 MET A 830 33.201 -1.557 -1.407 1.00 0.00 H new ATOM 0 HE2 MET A 830 31.536 -1.232 -1.946 1.00 0.00 H new ATOM 0 HE3 MET A 830 31.843 -1.755 -0.273 1.00 0.00 H new ATOM 1545 N LYS A 831 28.012 -3.322 -4.321 1.00 0.00 N ATOM 1546 CA LYS A 831 27.503 -2.903 -5.659 1.00 0.00 C ATOM 1547 C LYS A 831 28.634 -2.290 -6.498 1.00 0.00 C ATOM 1548 O LYS A 831 29.634 -1.836 -5.977 1.00 0.00 O ATOM 1549 CB LYS A 831 26.428 -1.856 -5.363 1.00 0.00 C ATOM 1550 CG LYS A 831 25.085 -2.323 -5.932 1.00 0.00 C ATOM 1551 CD LYS A 831 24.227 -2.908 -4.805 1.00 0.00 C ATOM 1552 CE LYS A 831 23.767 -1.782 -3.872 1.00 0.00 C ATOM 1553 NZ LYS A 831 22.963 -2.458 -2.809 1.00 0.00 N ATOM 0 H LYS A 831 28.718 -2.709 -3.913 1.00 0.00 H new ATOM 0 HA LYS A 831 27.110 -3.745 -6.230 1.00 0.00 H new ATOM 0 HB2 LYS A 831 26.344 -1.700 -4.287 1.00 0.00 H new ATOM 0 HB3 LYS A 831 26.708 -0.899 -5.803 1.00 0.00 H new ATOM 0 HG2 LYS A 831 24.567 -1.487 -6.401 1.00 0.00 H new ATOM 0 HG3 LYS A 831 25.247 -3.073 -6.706 1.00 0.00 H new ATOM 0 HD2 LYS A 831 23.362 -3.424 -5.223 1.00 0.00 H new ATOM 0 HD3 LYS A 831 24.799 -3.647 -4.245 1.00 0.00 H new ATOM 0 HE2 LYS A 831 24.618 -1.252 -3.445 1.00 0.00 H new ATOM 0 HE3 LYS A 831 23.170 -1.045 -4.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 831 22.615 -1.748 -2.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 831 22.155 -2.948 -3.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 831 23.559 -3.149 -2.309 1.00 0.00 H new ATOM 1567 N ARG A 832 28.477 -2.277 -7.793 1.00 0.00 N ATOM 1568 CA ARG A 832 29.534 -1.698 -8.680 1.00 0.00 C ATOM 1569 C ARG A 832 28.989 -1.567 -10.109 1.00 0.00 C ATOM 1570 O ARG A 832 28.013 -2.198 -10.464 1.00 0.00 O ATOM 1571 CB ARG A 832 30.689 -2.703 -8.630 1.00 0.00 C ATOM 1572 CG ARG A 832 32.027 -1.954 -8.644 1.00 0.00 C ATOM 1573 CD ARG A 832 32.741 -2.151 -7.302 1.00 0.00 C ATOM 1574 NE ARG A 832 33.175 -3.576 -7.301 1.00 0.00 N ATOM 1575 CZ ARG A 832 34.172 -3.957 -6.546 1.00 0.00 C ATOM 1576 NH1 ARG A 832 35.376 -4.041 -7.046 1.00 0.00 N ATOM 1577 NH2 ARG A 832 33.967 -4.255 -5.292 1.00 0.00 N ATOM 0 H ARG A 832 27.659 -2.643 -8.280 1.00 0.00 H new ATOM 0 HA ARG A 832 29.853 -0.705 -8.363 1.00 0.00 H new ATOM 0 HB2 ARG A 832 30.613 -3.315 -7.731 1.00 0.00 H new ATOM 0 HB3 ARG A 832 30.632 -3.380 -9.482 1.00 0.00 H new ATOM 0 HG2 ARG A 832 32.652 -2.322 -9.458 1.00 0.00 H new ATOM 0 HG3 ARG A 832 31.859 -0.892 -8.826 1.00 0.00 H new ATOM 0 HD2 ARG A 832 33.594 -1.479 -7.206 1.00 0.00 H new ATOM 0 HD3 ARG A 832 32.074 -1.941 -6.466 1.00 0.00 H new ATOM 0 HE ARG A 832 32.694 -4.255 -7.890 1.00 0.00 H new ATOM 0 HH11 ARG A 832 35.539 -3.809 -8.026 1.00 0.00 H new ATOM 0 HH12 ARG A 832 36.153 -4.338 -6.456 1.00 0.00 H new ATOM 0 HH21 ARG A 832 33.028 -4.191 -4.900 1.00 0.00 H new ATOM 0 HH22 ARG A 832 34.746 -4.552 -4.704 1.00 0.00 H new ATOM 1591 N VAL A 833 29.603 -0.758 -10.934 1.00 0.00 N ATOM 1592 CA VAL A 833 29.094 -0.610 -12.332 1.00 0.00 C ATOM 1593 C VAL A 833 30.243 -0.647 -13.349 1.00 0.00 C ATOM 1594 O VAL A 833 31.007 0.289 -13.474 1.00 0.00 O ATOM 1595 CB VAL A 833 28.405 0.752 -12.364 1.00 0.00 C ATOM 1596 CG1 VAL A 833 27.884 1.026 -13.778 1.00 0.00 C ATOM 1597 CG2 VAL A 833 27.232 0.753 -11.381 1.00 0.00 C ATOM 0 H VAL A 833 30.425 -0.199 -10.705 1.00 0.00 H new ATOM 0 HA VAL A 833 28.419 -1.424 -12.598 1.00 0.00 H new ATOM 0 HB VAL A 833 29.118 1.527 -12.081 1.00 0.00 H new ATOM 0 HG11 VAL A 833 27.392 1.998 -13.802 1.00 0.00 H new ATOM 0 HG12 VAL A 833 28.718 1.024 -14.480 1.00 0.00 H new ATOM 0 HG13 VAL A 833 27.171 0.251 -14.060 1.00 0.00 H new ATOM 0 HG21 VAL A 833 26.740 1.725 -11.403 1.00 0.00 H new ATOM 0 HG22 VAL A 833 26.519 -0.021 -11.664 1.00 0.00 H new ATOM 0 HG23 VAL A 833 27.601 0.556 -10.374 1.00 0.00 H new ATOM 1607 N ALA A 834 30.362 -1.723 -14.074 1.00 0.00 N ATOM 1608 CA ALA A 834 31.455 -1.834 -15.087 1.00 0.00 C ATOM 1609 C ALA A 834 30.831 -1.927 -16.481 1.00 0.00 C ATOM 1610 O ALA A 834 30.155 -2.884 -16.801 1.00 0.00 O ATOM 1611 CB ALA A 834 32.195 -3.126 -14.741 1.00 0.00 C ATOM 0 H ALA A 834 29.748 -2.535 -14.011 1.00 0.00 H new ATOM 0 HA ALA A 834 32.129 -0.978 -15.080 1.00 0.00 H new ATOM 0 HB1 ALA A 834 33.014 -3.276 -15.444 1.00 0.00 H new ATOM 0 HB2 ALA A 834 32.594 -3.057 -13.729 1.00 0.00 H new ATOM 0 HB3 ALA A 834 31.506 -3.968 -14.803 1.00 0.00 H new ATOM 1617 N VAL A 835 31.047 -0.947 -17.316 1.00 0.00 N ATOM 1618 CA VAL A 835 30.450 -1.006 -18.681 1.00 0.00 C ATOM 1619 C VAL A 835 31.519 -0.849 -19.771 1.00 0.00 C ATOM 1620 O VAL A 835 32.599 -0.340 -19.545 1.00 0.00 O ATOM 1621 CB VAL A 835 29.463 0.166 -18.724 1.00 0.00 C ATOM 1622 CG1 VAL A 835 29.118 0.504 -20.180 1.00 0.00 C ATOM 1623 CG2 VAL A 835 28.183 -0.219 -17.980 1.00 0.00 C ATOM 0 H VAL A 835 31.605 -0.117 -17.116 1.00 0.00 H new ATOM 0 HA VAL A 835 29.970 -1.966 -18.869 1.00 0.00 H new ATOM 0 HB VAL A 835 29.919 1.035 -18.249 1.00 0.00 H new ATOM 0 HG11 VAL A 835 28.416 1.338 -20.204 1.00 0.00 H new ATOM 0 HG12 VAL A 835 30.027 0.780 -20.715 1.00 0.00 H new ATOM 0 HG13 VAL A 835 28.665 -0.365 -20.658 1.00 0.00 H new ATOM 0 HG21 VAL A 835 27.480 0.614 -18.010 1.00 0.00 H new ATOM 0 HG22 VAL A 835 27.733 -1.090 -18.456 1.00 0.00 H new ATOM 0 HG23 VAL A 835 28.422 -0.455 -16.943 1.00 0.00 H new ATOM 1633 N GLU A 836 31.202 -1.297 -20.952 1.00 0.00 N ATOM 1634 CA GLU A 836 32.149 -1.202 -22.097 1.00 0.00 C ATOM 1635 C GLU A 836 31.331 -1.018 -23.374 1.00 0.00 C ATOM 1636 O GLU A 836 30.265 -1.585 -23.514 1.00 0.00 O ATOM 1637 CB GLU A 836 32.900 -2.534 -22.112 1.00 0.00 C ATOM 1638 CG GLU A 836 34.150 -2.406 -22.985 1.00 0.00 C ATOM 1639 CD GLU A 836 35.113 -3.553 -22.669 1.00 0.00 C ATOM 1640 OE1 GLU A 836 34.642 -4.593 -22.241 1.00 0.00 O ATOM 1641 OE2 GLU A 836 36.304 -3.369 -22.860 1.00 0.00 O ATOM 0 H GLU A 836 30.308 -1.734 -21.177 1.00 0.00 H new ATOM 0 HA GLU A 836 32.846 -0.368 -22.018 1.00 0.00 H new ATOM 0 HB2 GLU A 836 33.180 -2.817 -21.097 1.00 0.00 H new ATOM 0 HB3 GLU A 836 32.254 -3.323 -22.497 1.00 0.00 H new ATOM 0 HG2 GLU A 836 33.874 -2.429 -24.039 1.00 0.00 H new ATOM 0 HG3 GLU A 836 34.637 -1.448 -22.803 1.00 0.00 H new ATOM 1648 N ALA A 837 31.794 -0.240 -24.311 1.00 0.00 N ATOM 1649 CA ALA A 837 30.989 -0.061 -25.557 1.00 0.00 C ATOM 1650 C ALA A 837 31.867 -0.020 -26.809 1.00 0.00 C ATOM 1651 O ALA A 837 33.033 0.316 -26.763 1.00 0.00 O ATOM 1652 CB ALA A 837 30.279 1.276 -25.366 1.00 0.00 C ATOM 0 H ALA A 837 32.676 0.271 -24.274 1.00 0.00 H new ATOM 0 HA ALA A 837 30.301 -0.893 -25.706 1.00 0.00 H new ATOM 0 HB1 ALA A 837 29.662 1.488 -26.239 1.00 0.00 H new ATOM 0 HB2 ALA A 837 29.648 1.229 -24.478 1.00 0.00 H new ATOM 0 HB3 ALA A 837 31.019 2.067 -25.244 1.00 0.00 H new ATOM 1658 N VAL A 838 31.296 -0.365 -27.935 1.00 0.00 N ATOM 1659 CA VAL A 838 32.059 -0.357 -29.213 1.00 0.00 C ATOM 1660 C VAL A 838 31.490 0.732 -30.129 1.00 0.00 C ATOM 1661 O VAL A 838 30.377 0.629 -30.606 1.00 0.00 O ATOM 1662 CB VAL A 838 31.832 -1.741 -29.818 1.00 0.00 C ATOM 1663 CG1 VAL A 838 32.495 -1.816 -31.194 1.00 0.00 C ATOM 1664 CG2 VAL A 838 32.444 -2.803 -28.901 1.00 0.00 C ATOM 0 H VAL A 838 30.322 -0.655 -28.021 1.00 0.00 H new ATOM 0 HA VAL A 838 33.120 -0.151 -29.074 1.00 0.00 H new ATOM 0 HB VAL A 838 30.762 -1.919 -29.922 1.00 0.00 H new ATOM 0 HG11 VAL A 838 32.331 -2.804 -31.623 1.00 0.00 H new ATOM 0 HG12 VAL A 838 32.061 -1.060 -31.849 1.00 0.00 H new ATOM 0 HG13 VAL A 838 33.565 -1.637 -31.092 1.00 0.00 H new ATOM 0 HG21 VAL A 838 32.283 -3.792 -29.331 1.00 0.00 H new ATOM 0 HG22 VAL A 838 33.514 -2.622 -28.798 1.00 0.00 H new ATOM 0 HG23 VAL A 838 31.971 -2.753 -27.920 1.00 0.00 H new ATOM 1674 N CYS A 839 32.237 1.772 -30.381 1.00 0.00 N ATOM 1675 CA CYS A 839 31.718 2.855 -31.265 1.00 0.00 C ATOM 1676 C CYS A 839 32.416 2.830 -32.627 1.00 0.00 C ATOM 1677 O CYS A 839 33.623 2.952 -32.723 1.00 0.00 O ATOM 1678 CB CYS A 839 32.035 4.153 -30.525 1.00 0.00 C ATOM 1679 SG CYS A 839 30.523 5.129 -30.343 1.00 0.00 S ATOM 0 H CYS A 839 33.178 1.919 -30.016 1.00 0.00 H new ATOM 0 HA CYS A 839 30.652 2.742 -31.463 1.00 0.00 H new ATOM 0 HB2 CYS A 839 32.458 3.931 -29.545 1.00 0.00 H new ATOM 0 HB3 CYS A 839 32.785 4.723 -31.074 1.00 0.00 H new ATOM 1684 N SER A 840 31.661 2.676 -33.678 1.00 0.00 N ATOM 1685 CA SER A 840 32.265 2.642 -35.040 1.00 0.00 C ATOM 1686 C SER A 840 31.365 3.396 -36.025 1.00 0.00 C ATOM 1687 O SER A 840 31.732 4.429 -36.546 1.00 0.00 O ATOM 1688 CB SER A 840 32.337 1.161 -35.404 1.00 0.00 C ATOM 1689 OG SER A 840 31.132 0.518 -35.008 1.00 0.00 O ATOM 0 H SER A 840 30.647 2.572 -33.653 1.00 0.00 H new ATOM 0 HA SER A 840 33.247 3.115 -35.074 1.00 0.00 H new ATOM 0 HB2 SER A 840 32.488 1.046 -36.477 1.00 0.00 H new ATOM 0 HB3 SER A 840 33.190 0.695 -34.911 1.00 0.00 H new ATOM 0 HG SER A 840 30.639 0.228 -35.804 1.00 0.00 H new ATOM 1695 N THR A 841 30.189 2.884 -36.278 1.00 0.00 N ATOM 1696 CA THR A 841 29.250 3.564 -37.230 1.00 0.00 C ATOM 1697 C THR A 841 28.122 2.605 -37.625 1.00 0.00 C ATOM 1698 O THR A 841 28.214 1.411 -37.427 1.00 0.00 O ATOM 1699 CB THR A 841 30.093 3.930 -38.461 1.00 0.00 C ATOM 1700 OG1 THR A 841 29.236 4.113 -39.580 1.00 0.00 O ATOM 1701 CG2 THR A 841 31.091 2.810 -38.761 1.00 0.00 C ATOM 0 H THR A 841 29.834 2.021 -35.866 1.00 0.00 H new ATOM 0 HA THR A 841 28.790 4.446 -36.785 1.00 0.00 H new ATOM 0 HB THR A 841 30.640 4.852 -38.262 1.00 0.00 H new ATOM 0 HG1 THR A 841 29.771 4.348 -40.367 1.00 0.00 H new ATOM 0 HG21 THR A 841 31.685 3.077 -39.635 1.00 0.00 H new ATOM 0 HG22 THR A 841 31.749 2.670 -37.904 1.00 0.00 H new ATOM 0 HG23 THR A 841 30.550 1.884 -38.958 1.00 0.00 H new