USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=16 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 -72:sc= -0.543! USER MOD Set 1.2: A 820 ASN : amide:sc= -1.21! C(o=-1.8!,f=-3.5!) USER MOD Set 2.1: A 777 SER OG : rot 20:sc= 0.952 USER MOD Set 2.2: A 794 HIS : no HD1:sc= -2.4! C(o=-1.8!,f=-4.3!) USER MOD Set 2.3: A 798 SER OG : rot 79:sc= -0.388 USER MOD Single : A 729 SER OG : rot 180:sc= -0.186 USER MOD Single : A 736 SER OG : rot 180:sc= 0 USER MOD Single : A 757 THR OG1 : rot -25:sc= 0.411 USER MOD Single : A 759 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 761 HIS : no HD1:sc= -7.66! C(o=-7.7!,f=-6.6!) USER MOD Single : A 763 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 768 GLN : amide:sc= -0.435 X(o=-0.44,f=0) USER MOD Single : A 769 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 SER OG : rot 180:sc= 0 USER MOD Single : A 774 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 780 THR OG1 : rot 57:sc= 0.129 USER MOD Single : A 784 THR OG1 : rot 180:sc= 0 USER MOD Single : A 787 THR OG1 : rot 180:sc= 0 USER MOD Single : A 789 GLN : amide:sc= -1.4 X(o=-1.4,f=-1.2) USER MOD Single : A 790 GLN : amide:sc= -0.965 K(o=-0.97,f=-2.3!) USER MOD Single : A 795 SER OG : rot 180:sc= 0 USER MOD Single : A 797 ASN : amide:sc= -0.0334 X(o=-0.033,f=0) USER MOD Single : A 799 ASN : amide:sc= -2.12! C(o=-2.1!,f=-3.8!) 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 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 180:sc= 0.0112 USER MOD Single : A 841 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 39 N VAL A 728 37.276 2.773 -36.309 1.00 0.00 N ATOM 40 CA VAL A 728 36.715 2.006 -35.163 1.00 0.00 C ATOM 41 C VAL A 728 37.315 2.510 -33.850 1.00 0.00 C ATOM 42 O VAL A 728 38.227 3.313 -33.842 1.00 0.00 O ATOM 43 CB VAL A 728 37.129 0.563 -35.417 1.00 0.00 C ATOM 44 CG1 VAL A 728 36.352 0.007 -36.609 1.00 0.00 C ATOM 45 CG2 VAL A 728 38.629 0.511 -35.716 1.00 0.00 C ATOM 0 HA VAL A 728 35.633 2.113 -35.082 1.00 0.00 H new ATOM 0 HB VAL A 728 36.911 -0.037 -34.534 1.00 0.00 H new ATOM 0 HG11 VAL A 728 36.651 -1.026 -36.788 1.00 0.00 H new ATOM 0 HG12 VAL A 728 35.284 0.044 -36.396 1.00 0.00 H new ATOM 0 HG13 VAL A 728 36.567 0.605 -37.494 1.00 0.00 H new ATOM 0 HG21 VAL A 728 38.928 -0.521 -35.898 1.00 0.00 H new ATOM 0 HG22 VAL A 728 38.845 1.113 -36.599 1.00 0.00 H new ATOM 0 HG23 VAL A 728 39.184 0.904 -34.864 1.00 0.00 H new ATOM 55 N SER A 729 36.811 2.047 -32.741 1.00 0.00 N ATOM 56 CA SER A 729 37.357 2.502 -31.430 1.00 0.00 C ATOM 57 C SER A 729 36.715 1.713 -30.285 1.00 0.00 C ATOM 58 O SER A 729 35.742 1.009 -30.471 1.00 0.00 O ATOM 59 CB SER A 729 36.986 3.979 -31.336 1.00 0.00 C ATOM 60 OG SER A 729 36.858 4.346 -29.966 1.00 0.00 O ATOM 0 H SER A 729 36.046 1.375 -32.684 1.00 0.00 H new ATOM 0 HA SER A 729 38.433 2.347 -31.357 1.00 0.00 H new ATOM 0 HB2 SER A 729 37.750 4.589 -31.818 1.00 0.00 H new ATOM 0 HB3 SER A 729 36.050 4.165 -31.863 1.00 0.00 H new ATOM 0 HG SER A 729 36.621 5.295 -29.902 1.00 0.00 H new ATOM 66 N GLY A 730 37.255 1.825 -29.104 1.00 0.00 N ATOM 67 CA GLY A 730 36.680 1.086 -27.945 1.00 0.00 C ATOM 68 C GLY A 730 36.664 1.997 -26.720 1.00 0.00 C ATOM 69 O GLY A 730 37.656 2.613 -26.381 1.00 0.00 O ATOM 0 H GLY A 730 38.072 2.398 -28.890 1.00 0.00 H new ATOM 0 HA2 GLY A 730 35.668 0.753 -28.178 1.00 0.00 H new ATOM 0 HA3 GLY A 730 37.270 0.193 -27.740 1.00 0.00 H new ATOM 73 N VAL A 731 35.549 2.092 -26.053 1.00 0.00 N ATOM 74 CA VAL A 731 35.479 2.969 -24.849 1.00 0.00 C ATOM 75 C VAL A 731 35.339 2.122 -23.581 1.00 0.00 C ATOM 76 O VAL A 731 34.444 1.309 -23.459 1.00 0.00 O ATOM 77 CB VAL A 731 34.238 3.832 -25.060 1.00 0.00 C ATOM 78 CG1 VAL A 731 34.506 4.843 -26.175 1.00 0.00 C ATOM 79 CG2 VAL A 731 33.058 2.940 -25.455 1.00 0.00 C ATOM 0 H VAL A 731 34.685 1.603 -26.287 1.00 0.00 H new ATOM 0 HA VAL A 731 36.378 3.573 -24.726 1.00 0.00 H new ATOM 0 HB VAL A 731 34.001 4.361 -24.137 1.00 0.00 H new ATOM 0 HG11 VAL A 731 33.621 5.460 -26.327 1.00 0.00 H new ATOM 0 HG12 VAL A 731 35.347 5.478 -25.896 1.00 0.00 H new ATOM 0 HG13 VAL A 731 34.742 4.313 -27.098 1.00 0.00 H new ATOM 0 HG21 VAL A 731 32.171 3.555 -25.606 1.00 0.00 H new ATOM 0 HG22 VAL A 731 33.294 2.412 -26.379 1.00 0.00 H new ATOM 0 HG23 VAL A 731 32.867 2.217 -24.662 1.00 0.00 H new ATOM 89 N CYS A 732 36.219 2.308 -22.638 1.00 0.00 N ATOM 90 CA CYS A 732 36.143 1.518 -21.376 1.00 0.00 C ATOM 91 C CYS A 732 35.713 2.431 -20.224 1.00 0.00 C ATOM 92 O CYS A 732 36.440 3.317 -19.820 1.00 0.00 O ATOM 93 CB CYS A 732 37.566 0.993 -21.155 1.00 0.00 C ATOM 94 SG CYS A 732 37.747 0.402 -19.451 1.00 0.00 S ATOM 0 H CYS A 732 36.990 2.974 -22.686 1.00 0.00 H new ATOM 0 HA CYS A 732 35.418 0.705 -21.428 1.00 0.00 H new ATOM 0 HB2 CYS A 732 37.777 0.184 -21.854 1.00 0.00 H new ATOM 0 HB3 CYS A 732 38.290 1.783 -21.354 1.00 0.00 H new ATOM 99 N ALA A 733 34.539 2.224 -19.693 1.00 0.00 N ATOM 100 CA ALA A 733 34.072 3.087 -18.569 1.00 0.00 C ATOM 101 C ALA A 733 33.931 2.276 -17.277 1.00 0.00 C ATOM 102 O ALA A 733 33.512 1.136 -17.285 1.00 0.00 O ATOM 103 CB ALA A 733 32.711 3.613 -19.019 1.00 0.00 C ATOM 0 H ALA A 733 33.885 1.498 -19.987 1.00 0.00 H new ATOM 0 HA ALA A 733 34.777 3.890 -18.354 1.00 0.00 H new ATOM 0 HB1 ALA A 733 32.297 4.259 -18.245 1.00 0.00 H new ATOM 0 HB2 ALA A 733 32.827 4.181 -19.942 1.00 0.00 H new ATOM 0 HB3 ALA A 733 32.036 2.775 -19.191 1.00 0.00 H new ATOM 109 N ASP A 734 34.281 2.865 -16.167 1.00 0.00 N ATOM 110 CA ASP A 734 34.176 2.147 -14.863 1.00 0.00 C ATOM 111 C ASP A 734 34.046 3.167 -13.727 1.00 0.00 C ATOM 112 O ASP A 734 34.925 3.975 -13.507 1.00 0.00 O ATOM 113 CB ASP A 734 35.478 1.360 -14.733 1.00 0.00 C ATOM 114 CG ASP A 734 36.665 2.313 -14.880 1.00 0.00 C ATOM 115 OD1 ASP A 734 37.238 2.674 -13.865 1.00 0.00 O ATOM 116 OD2 ASP A 734 36.983 2.664 -16.004 1.00 0.00 O ATOM 0 H ASP A 734 34.638 3.819 -16.106 1.00 0.00 H new ATOM 0 HA ASP A 734 33.306 1.492 -14.814 1.00 0.00 H new ATOM 0 HB2 ASP A 734 35.518 0.859 -13.766 1.00 0.00 H new ATOM 0 HB3 ASP A 734 35.524 0.584 -15.497 1.00 0.00 H new ATOM 121 N VAL A 735 32.961 3.137 -13.003 1.00 0.00 N ATOM 122 CA VAL A 735 32.790 4.111 -11.888 1.00 0.00 C ATOM 123 C VAL A 735 32.422 3.391 -10.590 1.00 0.00 C ATOM 124 O VAL A 735 31.803 2.346 -10.599 1.00 0.00 O ATOM 125 CB VAL A 735 31.645 5.018 -12.332 1.00 0.00 C ATOM 126 CG1 VAL A 735 31.373 6.065 -11.251 1.00 0.00 C ATOM 127 CG2 VAL A 735 32.029 5.721 -13.636 1.00 0.00 C ATOM 0 H VAL A 735 32.189 2.484 -13.134 1.00 0.00 H new ATOM 0 HA VAL A 735 33.707 4.666 -11.689 1.00 0.00 H new ATOM 0 HB VAL A 735 30.748 4.419 -12.491 1.00 0.00 H new ATOM 0 HG11 VAL A 735 30.555 6.712 -11.569 1.00 0.00 H new ATOM 0 HG12 VAL A 735 31.100 5.566 -10.321 1.00 0.00 H new ATOM 0 HG13 VAL A 735 32.269 6.665 -11.091 1.00 0.00 H new ATOM 0 HG21 VAL A 735 31.212 6.369 -13.954 1.00 0.00 H new ATOM 0 HG22 VAL A 735 32.926 6.319 -13.476 1.00 0.00 H new ATOM 0 HG23 VAL A 735 32.223 4.976 -14.408 1.00 0.00 H new ATOM 137 N SER A 736 32.803 3.945 -9.470 1.00 0.00 N ATOM 138 CA SER A 736 32.480 3.300 -8.167 1.00 0.00 C ATOM 139 C SER A 736 31.262 3.987 -7.541 1.00 0.00 C ATOM 140 O SER A 736 31.125 5.192 -7.594 1.00 0.00 O ATOM 141 CB SER A 736 33.720 3.512 -7.304 1.00 0.00 C ATOM 142 OG SER A 736 34.451 2.294 -7.225 1.00 0.00 O ATOM 0 H SER A 736 33.325 4.819 -9.403 1.00 0.00 H new ATOM 0 HA SER A 736 32.237 2.242 -8.270 1.00 0.00 H new ATOM 0 HB2 SER A 736 34.344 4.297 -7.730 1.00 0.00 H new ATOM 0 HB3 SER A 736 33.431 3.841 -6.306 1.00 0.00 H new ATOM 0 HG SER A 736 35.249 2.427 -6.673 1.00 0.00 H new ATOM 148 N GLU A 737 30.375 3.234 -6.953 1.00 0.00 N ATOM 149 CA GLU A 737 29.169 3.858 -6.327 1.00 0.00 C ATOM 150 C GLU A 737 29.574 4.765 -5.157 1.00 0.00 C ATOM 151 O GLU A 737 30.454 4.441 -4.384 1.00 0.00 O ATOM 152 CB GLU A 737 28.331 2.682 -5.826 1.00 0.00 C ATOM 153 CG GLU A 737 26.879 3.132 -5.650 1.00 0.00 C ATOM 154 CD GLU A 737 25.948 2.137 -6.345 1.00 0.00 C ATOM 155 OE1 GLU A 737 24.764 2.421 -6.420 1.00 0.00 O ATOM 156 OE2 GLU A 737 26.433 1.111 -6.788 1.00 0.00 O ATOM 0 H GLU A 737 30.429 2.218 -6.877 1.00 0.00 H new ATOM 0 HA GLU A 737 28.621 4.483 -7.032 1.00 0.00 H new ATOM 0 HB2 GLU A 737 28.384 1.855 -6.535 1.00 0.00 H new ATOM 0 HB3 GLU A 737 28.727 2.316 -4.879 1.00 0.00 H new ATOM 0 HG2 GLU A 737 26.633 3.197 -4.590 1.00 0.00 H new ATOM 0 HG3 GLU A 737 26.743 4.128 -6.070 1.00 0.00 H new ATOM 479 N THR A 757 23.404 8.888 -6.124 1.00 0.00 N ATOM 480 CA THR A 757 24.061 7.747 -6.828 1.00 0.00 C ATOM 481 C THR A 757 25.102 8.266 -7.828 1.00 0.00 C ATOM 482 O THR A 757 25.242 9.455 -8.034 1.00 0.00 O ATOM 483 CB THR A 757 22.928 7.027 -7.559 1.00 0.00 C ATOM 484 OG1 THR A 757 22.172 7.972 -8.306 1.00 0.00 O ATOM 485 CG2 THR A 757 22.020 6.335 -6.542 1.00 0.00 C ATOM 0 HA THR A 757 24.587 7.086 -6.139 1.00 0.00 H new ATOM 0 HB THR A 757 23.348 6.281 -8.234 1.00 0.00 H new ATOM 0 HG1 THR A 757 22.267 8.860 -7.902 1.00 0.00 H new ATOM 0 HG21 THR A 757 21.213 5.822 -7.065 1.00 0.00 H new ATOM 0 HG22 THR A 757 22.600 5.611 -5.970 1.00 0.00 H new ATOM 0 HG23 THR A 757 21.599 7.078 -5.865 1.00 0.00 H new ATOM 493 N ALA A 758 25.832 7.379 -8.450 1.00 0.00 N ATOM 494 CA ALA A 758 26.864 7.818 -9.437 1.00 0.00 C ATOM 495 C ALA A 758 26.319 7.698 -10.860 1.00 0.00 C ATOM 496 O ALA A 758 25.215 7.241 -11.077 1.00 0.00 O ATOM 497 CB ALA A 758 28.038 6.863 -9.232 1.00 0.00 C ATOM 0 H ALA A 758 25.759 6.370 -8.318 1.00 0.00 H new ATOM 0 HA ALA A 758 27.155 8.859 -9.295 1.00 0.00 H new ATOM 0 HB1 ALA A 758 28.841 7.120 -9.923 1.00 0.00 H new ATOM 0 HB2 ALA A 758 28.400 6.946 -8.207 1.00 0.00 H new ATOM 0 HB3 ALA A 758 27.712 5.840 -9.419 1.00 0.00 H new ATOM 503 N LYS A 759 27.085 8.106 -11.832 1.00 0.00 N ATOM 504 CA LYS A 759 26.608 8.016 -13.244 1.00 0.00 C ATOM 505 C LYS A 759 27.754 7.600 -14.170 1.00 0.00 C ATOM 506 O LYS A 759 28.891 7.979 -13.977 1.00 0.00 O ATOM 507 CB LYS A 759 26.132 9.427 -13.595 1.00 0.00 C ATOM 508 CG LYS A 759 24.711 9.636 -13.072 1.00 0.00 C ATOM 509 CD LYS A 759 24.082 10.842 -13.774 1.00 0.00 C ATOM 510 CE LYS A 759 24.197 12.076 -12.873 1.00 0.00 C ATOM 511 NZ LYS A 759 22.996 12.021 -11.993 1.00 0.00 N ATOM 0 H LYS A 759 28.019 8.498 -11.713 1.00 0.00 H new ATOM 0 HA LYS A 759 25.818 7.274 -13.360 1.00 0.00 H new ATOM 0 HB2 LYS A 759 26.803 10.167 -13.158 1.00 0.00 H new ATOM 0 HB3 LYS A 759 26.157 9.572 -14.675 1.00 0.00 H new ATOM 0 HG2 LYS A 759 24.111 8.744 -13.251 1.00 0.00 H new ATOM 0 HG3 LYS A 759 24.729 9.797 -11.994 1.00 0.00 H new ATOM 0 HD2 LYS A 759 24.583 11.025 -14.725 1.00 0.00 H new ATOM 0 HD3 LYS A 759 23.035 10.640 -13.999 1.00 0.00 H new ATOM 0 HE2 LYS A 759 25.117 12.054 -12.288 1.00 0.00 H new ATOM 0 HE3 LYS A 759 24.215 12.994 -13.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 759 23.003 12.835 -11.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 759 22.136 12.050 -12.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 759 23.010 11.140 -11.441 1.00 0.00 H new ATOM 525 N VAL A 760 27.459 6.827 -15.177 1.00 0.00 N ATOM 526 CA VAL A 760 28.528 6.387 -16.119 1.00 0.00 C ATOM 527 C VAL A 760 28.373 7.153 -17.430 1.00 0.00 C ATOM 528 O VAL A 760 27.285 7.278 -17.956 1.00 0.00 O ATOM 529 CB VAL A 760 28.291 4.894 -16.331 1.00 0.00 C ATOM 530 CG1 VAL A 760 29.103 4.415 -17.537 1.00 0.00 C ATOM 531 CG2 VAL A 760 28.735 4.126 -15.083 1.00 0.00 C ATOM 0 H VAL A 760 26.524 6.480 -15.390 1.00 0.00 H new ATOM 0 HA VAL A 760 29.533 6.574 -15.741 1.00 0.00 H new ATOM 0 HB VAL A 760 27.231 4.716 -16.511 1.00 0.00 H new ATOM 0 HG11 VAL A 760 28.934 3.349 -17.689 1.00 0.00 H new ATOM 0 HG12 VAL A 760 28.791 4.962 -18.426 1.00 0.00 H new ATOM 0 HG13 VAL A 760 30.163 4.592 -17.355 1.00 0.00 H new ATOM 0 HG21 VAL A 760 28.566 3.060 -15.233 1.00 0.00 H new ATOM 0 HG22 VAL A 760 29.795 4.304 -14.904 1.00 0.00 H new ATOM 0 HG23 VAL A 760 28.160 4.467 -14.222 1.00 0.00 H new ATOM 541 N HIS A 761 29.440 7.670 -17.969 1.00 0.00 N ATOM 542 CA HIS A 761 29.317 8.424 -19.245 1.00 0.00 C ATOM 543 C HIS A 761 30.162 7.803 -20.358 1.00 0.00 C ATOM 544 O HIS A 761 31.360 7.642 -20.233 1.00 0.00 O ATOM 545 CB HIS A 761 29.823 9.826 -18.917 1.00 0.00 C ATOM 546 CG HIS A 761 28.901 10.840 -19.527 1.00 0.00 C ATOM 547 ND1 HIS A 761 28.107 10.546 -20.623 1.00 0.00 N ATOM 548 CD2 HIS A 761 28.631 12.147 -19.207 1.00 0.00 C ATOM 549 CE1 HIS A 761 27.403 11.656 -20.921 1.00 0.00 C ATOM 550 NE2 HIS A 761 27.688 12.661 -20.088 1.00 0.00 N ATOM 0 H HIS A 761 30.383 7.604 -17.586 1.00 0.00 H new ATOM 0 HA HIS A 761 28.290 8.418 -19.611 1.00 0.00 H new ATOM 0 HB2 HIS A 761 29.871 9.964 -17.837 1.00 0.00 H new ATOM 0 HB3 HIS A 761 30.834 9.959 -19.301 1.00 0.00 H new ATOM 0 HD2 HIS A 761 29.084 12.694 -18.393 1.00 0.00 H new ATOM 0 HE1 HIS A 761 26.695 11.725 -21.734 1.00 0.00 H new ATOM 0 HE2 HIS A 761 27.297 13.603 -20.097 1.00 0.00 H new ATOM 558 N LEU A 762 29.536 7.454 -21.447 1.00 0.00 N ATOM 559 CA LEU A 762 30.278 6.846 -22.586 1.00 0.00 C ATOM 560 C LEU A 762 30.086 7.740 -23.811 1.00 0.00 C ATOM 561 O LEU A 762 29.087 7.660 -24.493 1.00 0.00 O ATOM 562 CB LEU A 762 29.624 5.478 -22.813 1.00 0.00 C ATOM 563 CG LEU A 762 30.158 4.476 -21.789 1.00 0.00 C ATOM 564 CD1 LEU A 762 29.126 3.368 -21.573 1.00 0.00 C ATOM 565 CD2 LEU A 762 31.459 3.863 -22.309 1.00 0.00 C ATOM 0 H LEU A 762 28.533 7.565 -21.598 1.00 0.00 H new ATOM 0 HA LEU A 762 31.347 6.743 -22.398 1.00 0.00 H new ATOM 0 HB2 LEU A 762 28.541 5.562 -22.723 1.00 0.00 H new ATOM 0 HB3 LEU A 762 29.834 5.127 -23.823 1.00 0.00 H new ATOM 0 HG LEU A 762 30.346 4.987 -20.845 1.00 0.00 H new ATOM 0 HD11 LEU A 762 29.507 2.654 -20.843 1.00 0.00 H new ATOM 0 HD12 LEU A 762 28.197 3.803 -21.205 1.00 0.00 H new ATOM 0 HD13 LEU A 762 28.938 2.857 -22.517 1.00 0.00 H new ATOM 0 HD21 LEU A 762 31.841 3.148 -21.580 1.00 0.00 H new ATOM 0 HD22 LEU A 762 31.269 3.352 -23.253 1.00 0.00 H new ATOM 0 HD23 LEU A 762 32.196 4.651 -22.465 1.00 0.00 H new ATOM 577 N LYS A 763 31.034 8.583 -24.106 1.00 0.00 N ATOM 578 CA LYS A 763 30.881 9.475 -25.291 1.00 0.00 C ATOM 579 C LYS A 763 31.912 9.155 -26.369 1.00 0.00 C ATOM 580 O LYS A 763 33.072 8.925 -26.093 1.00 0.00 O ATOM 581 CB LYS A 763 31.099 10.887 -24.749 1.00 0.00 C ATOM 582 CG LYS A 763 32.409 10.935 -23.961 1.00 0.00 C ATOM 583 CD LYS A 763 33.089 12.288 -24.178 1.00 0.00 C ATOM 584 CE LYS A 763 34.563 12.187 -23.780 1.00 0.00 C ATOM 585 NZ LYS A 763 35.311 12.773 -24.925 1.00 0.00 N ATOM 0 H LYS A 763 31.903 8.694 -23.583 1.00 0.00 H new ATOM 0 HA LYS A 763 29.905 9.352 -25.760 1.00 0.00 H new ATOM 0 HB2 LYS A 763 31.130 11.602 -25.571 1.00 0.00 H new ATOM 0 HB3 LYS A 763 30.266 11.174 -24.108 1.00 0.00 H new ATOM 0 HG2 LYS A 763 32.213 10.781 -22.900 1.00 0.00 H new ATOM 0 HG3 LYS A 763 33.069 10.129 -24.283 1.00 0.00 H new ATOM 0 HD2 LYS A 763 33.003 12.587 -25.223 1.00 0.00 H new ATOM 0 HD3 LYS A 763 32.593 13.056 -23.585 1.00 0.00 H new ATOM 0 HE2 LYS A 763 34.761 12.733 -22.858 1.00 0.00 H new ATOM 0 HE3 LYS A 763 34.855 11.151 -23.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 763 36.331 12.740 -24.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 763 35.108 12.228 -25.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 763 35.017 13.761 -25.062 1.00 0.00 H new ATOM 599 N CYS A 764 31.486 9.140 -27.599 1.00 0.00 N ATOM 600 CA CYS A 764 32.424 8.839 -28.718 1.00 0.00 C ATOM 601 C CYS A 764 32.503 10.047 -29.661 1.00 0.00 C ATOM 602 O CYS A 764 31.648 10.910 -29.649 1.00 0.00 O ATOM 603 CB CYS A 764 31.816 7.636 -29.436 1.00 0.00 C ATOM 604 SG CYS A 764 32.863 6.184 -29.175 1.00 0.00 S ATOM 0 H CYS A 764 30.523 9.324 -27.881 1.00 0.00 H new ATOM 0 HA CYS A 764 33.436 8.630 -28.371 1.00 0.00 H new ATOM 0 HB2 CYS A 764 30.811 7.445 -29.060 1.00 0.00 H new ATOM 0 HB3 CYS A 764 31.724 7.844 -30.502 1.00 0.00 H new ATOM 609 N ALA A 765 33.518 10.118 -30.479 1.00 0.00 N ATOM 610 CA ALA A 765 33.637 11.277 -31.415 1.00 0.00 C ATOM 611 C ALA A 765 32.323 11.474 -32.181 1.00 0.00 C ATOM 612 O ALA A 765 31.458 10.621 -32.156 1.00 0.00 O ATOM 613 CB ALA A 765 34.765 10.898 -32.374 1.00 0.00 C ATOM 0 H ALA A 765 34.267 9.429 -30.541 1.00 0.00 H new ATOM 0 HA ALA A 765 33.844 12.211 -30.893 1.00 0.00 H new ATOM 0 HB1 ALA A 765 34.915 11.701 -33.095 1.00 0.00 H new ATOM 0 HB2 ALA A 765 35.685 10.741 -31.810 1.00 0.00 H new ATOM 0 HB3 ALA A 765 34.502 9.981 -32.901 1.00 0.00 H new ATOM 619 N PRO A 766 32.221 12.597 -32.838 1.00 0.00 N ATOM 620 CA PRO A 766 31.003 12.909 -33.618 1.00 0.00 C ATOM 621 C PRO A 766 30.947 12.041 -34.879 1.00 0.00 C ATOM 622 O PRO A 766 31.861 12.031 -35.680 1.00 0.00 O ATOM 623 CB PRO A 766 31.170 14.380 -33.976 1.00 0.00 C ATOM 624 CG PRO A 766 32.647 14.623 -33.936 1.00 0.00 C ATOM 625 CD PRO A 766 33.222 13.663 -32.919 1.00 0.00 C ATOM 0 HA PRO A 766 30.080 12.715 -33.071 1.00 0.00 H new ATOM 0 HB2 PRO A 766 30.761 14.595 -34.963 1.00 0.00 H new ATOM 0 HB3 PRO A 766 30.645 15.021 -33.267 1.00 0.00 H new ATOM 0 HG2 PRO A 766 33.092 14.459 -34.917 1.00 0.00 H new ATOM 0 HG3 PRO A 766 32.861 15.655 -33.658 1.00 0.00 H new ATOM 0 HD2 PRO A 766 34.191 13.278 -33.236 1.00 0.00 H new ATOM 0 HD3 PRO A 766 33.371 14.146 -31.953 1.00 0.00 H new ATOM 633 N GLY A 767 29.881 11.312 -35.062 1.00 0.00 N ATOM 634 CA GLY A 767 29.769 10.447 -36.270 1.00 0.00 C ATOM 635 C GLY A 767 29.877 8.981 -35.851 1.00 0.00 C ATOM 636 O GLY A 767 29.227 8.116 -36.402 1.00 0.00 O ATOM 0 H GLY A 767 29.083 11.278 -34.428 1.00 0.00 H new ATOM 0 HA2 GLY A 767 28.818 10.625 -36.772 1.00 0.00 H new ATOM 0 HA3 GLY A 767 30.557 10.693 -36.982 1.00 0.00 H new ATOM 640 N GLN A 768 30.699 8.695 -34.878 1.00 0.00 N ATOM 641 CA GLN A 768 30.853 7.284 -34.421 1.00 0.00 C ATOM 642 C GLN A 768 29.810 6.968 -33.344 1.00 0.00 C ATOM 643 O GLN A 768 29.823 7.531 -32.267 1.00 0.00 O ATOM 644 CB GLN A 768 32.266 7.206 -33.843 1.00 0.00 C ATOM 645 CG GLN A 768 33.286 7.223 -34.985 1.00 0.00 C ATOM 646 CD GLN A 768 34.693 7.397 -34.412 1.00 0.00 C ATOM 647 OE1 GLN A 768 35.530 8.042 -35.010 1.00 0.00 O ATOM 648 NE2 GLN A 768 34.991 6.842 -33.270 1.00 0.00 N ATOM 0 H GLN A 768 31.271 9.377 -34.380 1.00 0.00 H new ATOM 0 HA GLN A 768 30.707 6.566 -35.228 1.00 0.00 H new ATOM 0 HB2 GLN A 768 32.442 8.046 -33.171 1.00 0.00 H new ATOM 0 HB3 GLN A 768 32.380 6.296 -33.253 1.00 0.00 H new ATOM 0 HG2 GLN A 768 33.226 6.295 -35.554 1.00 0.00 H new ATOM 0 HG3 GLN A 768 33.060 8.035 -35.676 1.00 0.00 H new ATOM 0 HE21 GLN A 768 34.288 6.300 -32.767 1.00 0.00 H new ATOM 0 HE22 GLN A 768 35.927 6.950 -32.879 1.00 0.00 H new ATOM 657 N THR A 769 28.906 6.070 -33.627 1.00 0.00 N ATOM 658 CA THR A 769 27.860 5.717 -32.620 1.00 0.00 C ATOM 659 C THR A 769 28.108 4.308 -32.067 1.00 0.00 C ATOM 660 O THR A 769 28.900 3.554 -32.596 1.00 0.00 O ATOM 661 CB THR A 769 26.540 5.762 -33.394 1.00 0.00 C ATOM 662 OG1 THR A 769 26.486 4.664 -34.296 1.00 0.00 O ATOM 663 CG2 THR A 769 26.443 7.073 -34.178 1.00 0.00 C ATOM 0 H THR A 769 28.845 5.565 -34.511 1.00 0.00 H new ATOM 0 HA THR A 769 27.861 6.397 -31.768 1.00 0.00 H new ATOM 0 HB THR A 769 25.708 5.702 -32.693 1.00 0.00 H new ATOM 0 HG1 THR A 769 25.641 4.689 -34.792 1.00 0.00 H new ATOM 0 HG21 THR A 769 25.502 7.100 -34.727 1.00 0.00 H new ATOM 0 HG22 THR A 769 26.484 7.914 -33.486 1.00 0.00 H new ATOM 0 HG23 THR A 769 27.274 7.140 -34.880 1.00 0.00 H new ATOM 671 N ILE A 770 27.434 3.948 -31.006 1.00 0.00 N ATOM 672 CA ILE A 770 27.630 2.588 -30.420 1.00 0.00 C ATOM 673 C ILE A 770 26.725 1.580 -31.134 1.00 0.00 C ATOM 674 O ILE A 770 25.542 1.496 -30.868 1.00 0.00 O ATOM 675 CB ILE A 770 27.227 2.724 -28.953 1.00 0.00 C ATOM 676 CG1 ILE A 770 28.233 3.621 -28.227 1.00 0.00 C ATOM 677 CG2 ILE A 770 27.214 1.343 -28.297 1.00 0.00 C ATOM 678 CD1 ILE A 770 27.493 4.521 -27.238 1.00 0.00 C ATOM 0 H ILE A 770 26.757 4.536 -30.520 1.00 0.00 H new ATOM 0 HA ILE A 770 28.655 2.233 -30.526 1.00 0.00 H new ATOM 0 HB ILE A 770 26.233 3.167 -28.891 1.00 0.00 H new ATOM 0 HG12 ILE A 770 28.967 3.011 -27.701 1.00 0.00 H new ATOM 0 HG13 ILE A 770 28.781 4.228 -28.948 1.00 0.00 H new ATOM 0 HG21 ILE A 770 26.926 1.440 -27.250 1.00 0.00 H new ATOM 0 HG22 ILE A 770 26.498 0.702 -28.812 1.00 0.00 H new ATOM 0 HG23 ILE A 770 28.208 0.901 -28.361 1.00 0.00 H new ATOM 0 HD11 ILE A 770 28.209 5.160 -26.721 1.00 0.00 H new ATOM 0 HD12 ILE A 770 26.776 5.141 -27.776 1.00 0.00 H new ATOM 0 HD13 ILE A 770 26.965 3.905 -26.510 1.00 0.00 H new ATOM 690 N SER A 771 27.270 0.812 -32.036 1.00 0.00 N ATOM 691 CA SER A 771 26.435 -0.189 -32.766 1.00 0.00 C ATOM 692 C SER A 771 26.412 -1.528 -32.019 1.00 0.00 C ATOM 693 O SER A 771 25.687 -2.431 -32.383 1.00 0.00 O ATOM 694 CB SER A 771 27.112 -0.350 -34.124 1.00 0.00 C ATOM 695 OG SER A 771 26.117 -0.526 -35.125 1.00 0.00 O ATOM 0 H SER A 771 28.255 0.832 -32.300 1.00 0.00 H new ATOM 0 HA SER A 771 25.398 0.135 -32.856 1.00 0.00 H new ATOM 0 HB2 SER A 771 27.719 0.528 -34.348 1.00 0.00 H new ATOM 0 HB3 SER A 771 27.785 -1.207 -34.109 1.00 0.00 H new ATOM 0 HG SER A 771 26.547 -0.628 -36.000 1.00 0.00 H new ATOM 701 N ALA A 772 27.192 -1.668 -30.979 1.00 0.00 N ATOM 702 CA ALA A 772 27.191 -2.962 -30.232 1.00 0.00 C ATOM 703 C ALA A 772 27.884 -2.820 -28.873 1.00 0.00 C ATOM 704 O ALA A 772 28.868 -2.121 -28.735 1.00 0.00 O ATOM 705 CB ALA A 772 27.974 -3.926 -31.122 1.00 0.00 C ATOM 0 H ALA A 772 27.823 -0.952 -30.617 1.00 0.00 H new ATOM 0 HA ALA A 772 26.177 -3.306 -30.027 1.00 0.00 H new ATOM 0 HB1 ALA A 772 28.021 -4.905 -30.645 1.00 0.00 H new ATOM 0 HB2 ALA A 772 27.476 -4.016 -32.087 1.00 0.00 H new ATOM 0 HB3 ALA A 772 28.985 -3.545 -31.270 1.00 0.00 H new ATOM 711 N ILE A 773 27.372 -3.483 -27.867 1.00 0.00 N ATOM 712 CA ILE A 773 27.994 -3.395 -26.511 1.00 0.00 C ATOM 713 C ILE A 773 28.967 -4.567 -26.327 1.00 0.00 C ATOM 714 O ILE A 773 28.607 -5.714 -26.493 1.00 0.00 O ATOM 715 CB ILE A 773 26.823 -3.496 -25.529 1.00 0.00 C ATOM 716 CG1 ILE A 773 25.803 -2.399 -25.843 1.00 0.00 C ATOM 717 CG2 ILE A 773 27.336 -3.318 -24.100 1.00 0.00 C ATOM 718 CD1 ILE A 773 26.450 -1.027 -25.647 1.00 0.00 C ATOM 0 H ILE A 773 26.549 -4.082 -27.926 1.00 0.00 H new ATOM 0 HA ILE A 773 28.560 -2.476 -26.360 1.00 0.00 H new ATOM 0 HB ILE A 773 26.351 -4.474 -25.625 1.00 0.00 H new ATOM 0 HG12 ILE A 773 25.447 -2.502 -26.868 1.00 0.00 H new ATOM 0 HG13 ILE A 773 24.934 -2.499 -25.193 1.00 0.00 H new ATOM 0 HG21 ILE A 773 26.502 -3.390 -23.402 1.00 0.00 H new ATOM 0 HG22 ILE A 773 28.065 -4.097 -23.876 1.00 0.00 H new ATOM 0 HG23 ILE A 773 27.808 -2.340 -24.002 1.00 0.00 H new ATOM 0 HD11 ILE A 773 25.723 -0.246 -25.871 1.00 0.00 H new ATOM 0 HD12 ILE A 773 26.784 -0.926 -24.614 1.00 0.00 H new ATOM 0 HD13 ILE A 773 27.305 -0.929 -26.316 1.00 0.00 H new ATOM 730 N LYS A 774 30.196 -4.289 -25.984 1.00 0.00 N ATOM 731 CA LYS A 774 31.182 -5.397 -25.795 1.00 0.00 C ATOM 732 C LYS A 774 31.017 -6.058 -24.426 1.00 0.00 C ATOM 733 O LYS A 774 31.146 -7.258 -24.291 1.00 0.00 O ATOM 734 CB LYS A 774 32.554 -4.734 -25.900 1.00 0.00 C ATOM 735 CG LYS A 774 33.644 -5.807 -25.822 1.00 0.00 C ATOM 736 CD LYS A 774 33.973 -6.306 -27.230 1.00 0.00 C ATOM 737 CE LYS A 774 35.439 -6.001 -27.551 1.00 0.00 C ATOM 738 NZ LYS A 774 36.158 -7.286 -27.328 1.00 0.00 N ATOM 0 H LYS A 774 30.560 -3.349 -25.827 1.00 0.00 H new ATOM 0 HA LYS A 774 31.043 -6.184 -26.537 1.00 0.00 H new ATOM 0 HB2 LYS A 774 32.634 -4.186 -26.839 1.00 0.00 H new ATOM 0 HB3 LYS A 774 32.683 -4.010 -25.096 1.00 0.00 H new ATOM 0 HG2 LYS A 774 34.538 -5.398 -25.352 1.00 0.00 H new ATOM 0 HG3 LYS A 774 33.308 -6.637 -25.200 1.00 0.00 H new ATOM 0 HD2 LYS A 774 33.790 -7.378 -27.299 1.00 0.00 H new ATOM 0 HD3 LYS A 774 33.322 -5.824 -27.959 1.00 0.00 H new ATOM 0 HE2 LYS A 774 35.555 -5.657 -28.579 1.00 0.00 H new ATOM 0 HE3 LYS A 774 35.829 -5.214 -26.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 37.170 -7.157 -27.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 36.036 -7.585 -26.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 35.770 -8.015 -27.961 1.00 0.00 H new ATOM 752 N PHE A 775 30.733 -5.298 -23.406 1.00 0.00 N ATOM 753 CA PHE A 775 30.567 -5.917 -22.059 1.00 0.00 C ATOM 754 C PHE A 775 29.595 -5.108 -21.196 1.00 0.00 C ATOM 755 O PHE A 775 29.196 -4.015 -21.542 1.00 0.00 O ATOM 756 CB PHE A 775 31.969 -5.900 -21.446 1.00 0.00 C ATOM 757 CG PHE A 775 31.951 -6.633 -20.126 1.00 0.00 C ATOM 758 CD1 PHE A 775 32.123 -8.023 -20.094 1.00 0.00 C ATOM 759 CD2 PHE A 775 31.759 -5.924 -18.936 1.00 0.00 C ATOM 760 CE1 PHE A 775 32.104 -8.702 -18.869 1.00 0.00 C ATOM 761 CE2 PHE A 775 31.739 -6.602 -17.711 1.00 0.00 C ATOM 762 CZ PHE A 775 31.911 -7.991 -17.678 1.00 0.00 C ATOM 0 H PHE A 775 30.609 -4.286 -23.443 1.00 0.00 H new ATOM 0 HA PHE A 775 30.153 -6.923 -22.124 1.00 0.00 H new ATOM 0 HB2 PHE A 775 32.680 -6.370 -22.125 1.00 0.00 H new ATOM 0 HB3 PHE A 775 32.301 -4.872 -21.299 1.00 0.00 H new ATOM 0 HD1 PHE A 775 32.270 -8.571 -21.013 1.00 0.00 H new ATOM 0 HD2 PHE A 775 31.626 -4.853 -18.962 1.00 0.00 H new ATOM 0 HE1 PHE A 775 32.238 -9.773 -18.843 1.00 0.00 H new ATOM 0 HE2 PHE A 775 31.591 -6.054 -16.792 1.00 0.00 H new ATOM 0 HZ PHE A 775 31.895 -8.515 -16.734 1.00 0.00 H new ATOM 772 N ALA A 776 29.216 -5.652 -20.073 1.00 0.00 N ATOM 773 CA ALA A 776 28.271 -4.944 -19.162 1.00 0.00 C ATOM 774 C ALA A 776 27.828 -5.898 -18.050 1.00 0.00 C ATOM 775 O ALA A 776 27.195 -6.905 -18.303 1.00 0.00 O ATOM 776 CB ALA A 776 27.080 -4.553 -20.040 1.00 0.00 C ATOM 0 H ALA A 776 29.524 -6.567 -19.743 1.00 0.00 H new ATOM 0 HA ALA A 776 28.720 -4.072 -18.688 1.00 0.00 H new ATOM 0 HB1 ALA A 776 26.341 -4.026 -19.437 1.00 0.00 H new ATOM 0 HB2 ALA A 776 27.420 -3.903 -20.846 1.00 0.00 H new ATOM 0 HB3 ALA A 776 26.630 -5.451 -20.463 1.00 0.00 H new ATOM 782 N SER A 777 28.154 -5.597 -16.823 1.00 0.00 N ATOM 783 CA SER A 777 27.743 -6.500 -15.709 1.00 0.00 C ATOM 784 C SER A 777 27.574 -5.712 -14.407 1.00 0.00 C ATOM 785 O SER A 777 28.422 -4.929 -14.024 1.00 0.00 O ATOM 786 CB SER A 777 28.880 -7.510 -15.581 1.00 0.00 C ATOM 787 OG SER A 777 28.481 -8.557 -14.706 1.00 0.00 O ATOM 0 H SER A 777 28.683 -4.771 -16.544 1.00 0.00 H new ATOM 0 HA SER A 777 26.785 -6.982 -15.906 1.00 0.00 H new ATOM 0 HB2 SER A 777 29.134 -7.916 -16.560 1.00 0.00 H new ATOM 0 HB3 SER A 777 29.775 -7.021 -15.197 1.00 0.00 H new ATOM 0 HG SER A 777 27.504 -8.570 -14.636 1.00 0.00 H new ATOM 793 N PHE A 778 26.479 -5.919 -13.728 1.00 0.00 N ATOM 794 CA PHE A 778 26.237 -5.190 -12.446 1.00 0.00 C ATOM 795 C PHE A 778 26.592 -6.096 -11.259 1.00 0.00 C ATOM 796 O PHE A 778 26.089 -7.195 -11.137 1.00 0.00 O ATOM 797 CB PHE A 778 24.739 -4.883 -12.464 1.00 0.00 C ATOM 798 CG PHE A 778 24.398 -3.882 -11.385 1.00 0.00 C ATOM 799 CD1 PHE A 778 24.632 -4.189 -10.040 1.00 0.00 C ATOM 800 CD2 PHE A 778 23.835 -2.648 -11.732 1.00 0.00 C ATOM 801 CE1 PHE A 778 24.302 -3.264 -9.042 1.00 0.00 C ATOM 802 CE2 PHE A 778 23.507 -1.722 -10.735 1.00 0.00 C ATOM 803 CZ PHE A 778 23.739 -2.030 -9.391 1.00 0.00 C ATOM 0 H PHE A 778 25.738 -6.563 -14.005 1.00 0.00 H new ATOM 0 HA PHE A 778 26.840 -4.288 -12.347 1.00 0.00 H new ATOM 0 HB2 PHE A 778 24.453 -4.489 -13.439 1.00 0.00 H new ATOM 0 HB3 PHE A 778 24.171 -5.800 -12.312 1.00 0.00 H new ATOM 0 HD1 PHE A 778 25.067 -5.140 -9.771 1.00 0.00 H new ATOM 0 HD2 PHE A 778 23.654 -2.410 -12.770 1.00 0.00 H new ATOM 0 HE1 PHE A 778 24.481 -3.502 -8.004 1.00 0.00 H new ATOM 0 HE2 PHE A 778 23.075 -0.770 -11.004 1.00 0.00 H new ATOM 0 HZ PHE A 778 23.484 -1.316 -8.622 1.00 0.00 H new ATOM 813 N GLY A 779 27.454 -5.647 -10.383 1.00 0.00 N ATOM 814 CA GLY A 779 27.831 -6.492 -9.211 1.00 0.00 C ATOM 815 C GLY A 779 29.357 -6.556 -9.085 1.00 0.00 C ATOM 816 O GLY A 779 30.002 -5.583 -8.750 1.00 0.00 O ATOM 0 H GLY A 779 27.911 -4.736 -10.428 1.00 0.00 H new ATOM 0 HA2 GLY A 779 27.399 -6.079 -8.300 1.00 0.00 H new ATOM 0 HA3 GLY A 779 27.425 -7.496 -9.330 1.00 0.00 H new ATOM 820 N THR A 780 29.941 -7.699 -9.347 1.00 0.00 N ATOM 821 CA THR A 780 31.428 -7.821 -9.240 1.00 0.00 C ATOM 822 C THR A 780 31.997 -8.578 -10.448 1.00 0.00 C ATOM 823 O THR A 780 32.223 -9.769 -10.382 1.00 0.00 O ATOM 824 CB THR A 780 31.670 -8.616 -7.955 1.00 0.00 C ATOM 825 OG1 THR A 780 30.776 -9.721 -7.911 1.00 0.00 O ATOM 826 CG2 THR A 780 31.437 -7.719 -6.739 1.00 0.00 C ATOM 0 H THR A 780 29.455 -8.550 -9.629 1.00 0.00 H new ATOM 0 HA THR A 780 31.915 -6.846 -9.220 1.00 0.00 H new ATOM 0 HB THR A 780 32.699 -8.976 -7.940 1.00 0.00 H new ATOM 0 HG1 THR A 780 30.894 -10.269 -8.715 1.00 0.00 H new ATOM 0 HG21 THR A 780 31.611 -8.290 -5.827 1.00 0.00 H new ATOM 0 HG22 THR A 780 32.124 -6.873 -6.774 1.00 0.00 H new ATOM 0 HG23 THR A 780 30.410 -7.353 -6.748 1.00 0.00 H new ATOM 834 N PRO A 781 32.208 -7.855 -11.516 1.00 0.00 N ATOM 835 CA PRO A 781 32.755 -8.463 -12.749 1.00 0.00 C ATOM 836 C PRO A 781 34.265 -8.696 -12.597 1.00 0.00 C ATOM 837 O PRO A 781 34.917 -8.070 -11.786 1.00 0.00 O ATOM 838 CB PRO A 781 32.476 -7.420 -13.822 1.00 0.00 C ATOM 839 CG PRO A 781 32.386 -6.114 -13.086 1.00 0.00 C ATOM 840 CD PRO A 781 31.947 -6.424 -11.669 1.00 0.00 C ATOM 0 HA PRO A 781 32.313 -9.432 -12.982 1.00 0.00 H new ATOM 0 HB2 PRO A 781 33.272 -7.398 -14.567 1.00 0.00 H new ATOM 0 HB3 PRO A 781 31.549 -7.638 -14.352 1.00 0.00 H new ATOM 0 HG2 PRO A 781 33.350 -5.605 -13.087 1.00 0.00 H new ATOM 0 HG3 PRO A 781 31.673 -5.447 -13.572 1.00 0.00 H new ATOM 0 HD2 PRO A 781 32.508 -5.837 -10.941 1.00 0.00 H new ATOM 0 HD3 PRO A 781 30.892 -6.194 -11.520 1.00 0.00 H new ATOM 848 N LEU A 782 34.824 -9.589 -13.369 1.00 0.00 N ATOM 849 CA LEU A 782 36.292 -9.850 -13.258 1.00 0.00 C ATOM 850 C LEU A 782 37.055 -9.043 -14.313 1.00 0.00 C ATOM 851 O LEU A 782 36.795 -9.146 -15.495 1.00 0.00 O ATOM 852 CB LEU A 782 36.450 -11.349 -13.510 1.00 0.00 C ATOM 853 CG LEU A 782 37.208 -11.984 -12.341 1.00 0.00 C ATOM 854 CD1 LEU A 782 36.939 -13.489 -12.314 1.00 0.00 C ATOM 855 CD2 LEU A 782 38.709 -11.739 -12.513 1.00 0.00 C ATOM 0 H LEU A 782 34.333 -10.147 -14.068 1.00 0.00 H new ATOM 0 HA LEU A 782 36.690 -9.557 -12.286 1.00 0.00 H new ATOM 0 HB2 LEU A 782 35.471 -11.816 -13.619 1.00 0.00 H new ATOM 0 HB3 LEU A 782 36.989 -11.517 -14.442 1.00 0.00 H new ATOM 0 HG LEU A 782 36.870 -11.538 -11.406 1.00 0.00 H new ATOM 0 HD11 LEU A 782 37.479 -13.940 -11.482 1.00 0.00 H new ATOM 0 HD12 LEU A 782 35.870 -13.665 -12.192 1.00 0.00 H new ATOM 0 HD13 LEU A 782 37.276 -13.936 -13.250 1.00 0.00 H new ATOM 0 HD21 LEU A 782 39.249 -12.191 -11.681 1.00 0.00 H new ATOM 0 HD22 LEU A 782 39.046 -12.185 -13.449 1.00 0.00 H new ATOM 0 HD23 LEU A 782 38.903 -10.667 -12.532 1.00 0.00 H new ATOM 867 N GLY A 783 37.995 -8.240 -13.892 1.00 0.00 N ATOM 868 CA GLY A 783 38.774 -7.427 -14.871 1.00 0.00 C ATOM 869 C GLY A 783 38.974 -6.013 -14.323 1.00 0.00 C ATOM 870 O GLY A 783 38.705 -5.740 -13.170 1.00 0.00 O ATOM 0 H GLY A 783 38.257 -8.112 -12.915 1.00 0.00 H new ATOM 0 HA2 GLY A 783 39.740 -7.895 -15.059 1.00 0.00 H new ATOM 0 HA3 GLY A 783 38.248 -7.387 -15.825 1.00 0.00 H new ATOM 874 N THR A 784 39.448 -5.112 -15.140 1.00 0.00 N ATOM 875 CA THR A 784 39.667 -3.713 -14.667 1.00 0.00 C ATOM 876 C THR A 784 39.212 -2.720 -15.742 1.00 0.00 C ATOM 877 O THR A 784 38.439 -1.818 -15.482 1.00 0.00 O ATOM 878 CB THR A 784 41.176 -3.606 -14.439 1.00 0.00 C ATOM 879 OG1 THR A 784 41.517 -4.256 -13.222 1.00 0.00 O ATOM 880 CG2 THR A 784 41.583 -2.134 -14.364 1.00 0.00 C ATOM 0 H THR A 784 39.693 -5.283 -16.115 1.00 0.00 H new ATOM 0 HA THR A 784 39.102 -3.485 -13.763 1.00 0.00 H new ATOM 0 HB THR A 784 41.702 -4.082 -15.267 1.00 0.00 H new ATOM 0 HG1 THR A 784 42.484 -4.190 -13.075 1.00 0.00 H new ATOM 0 HG21 THR A 784 42.658 -2.062 -14.202 1.00 0.00 H new ATOM 0 HG22 THR A 784 41.323 -1.637 -15.298 1.00 0.00 H new ATOM 0 HG23 THR A 784 41.058 -1.653 -13.539 1.00 0.00 H new ATOM 888 N CYS A 785 39.685 -2.880 -16.946 1.00 0.00 N ATOM 889 CA CYS A 785 39.284 -1.951 -18.042 1.00 0.00 C ATOM 890 C CYS A 785 39.704 -2.532 -19.393 1.00 0.00 C ATOM 891 O CYS A 785 40.652 -2.087 -20.007 1.00 0.00 O ATOM 892 CB CYS A 785 40.033 -0.649 -17.757 1.00 0.00 C ATOM 893 SG CYS A 785 39.733 0.531 -19.098 1.00 0.00 S ATOM 0 H CYS A 785 40.335 -3.617 -17.220 1.00 0.00 H new ATOM 0 HA CYS A 785 38.206 -1.793 -18.081 1.00 0.00 H new ATOM 0 HB2 CYS A 785 39.702 -0.228 -16.808 1.00 0.00 H new ATOM 0 HB3 CYS A 785 41.101 -0.845 -17.664 1.00 0.00 H new ATOM 898 N GLY A 786 39.001 -3.526 -19.855 1.00 0.00 N ATOM 899 CA GLY A 786 39.350 -4.145 -21.163 1.00 0.00 C ATOM 900 C GLY A 786 39.413 -5.661 -20.993 1.00 0.00 C ATOM 901 O GLY A 786 39.392 -6.407 -21.951 1.00 0.00 O ATOM 0 H GLY A 786 38.197 -3.938 -19.382 1.00 0.00 H new ATOM 0 HA2 GLY A 786 38.607 -3.881 -21.915 1.00 0.00 H new ATOM 0 HA3 GLY A 786 40.309 -3.765 -21.516 1.00 0.00 H new ATOM 905 N THR A 787 39.489 -6.120 -19.773 1.00 0.00 N ATOM 906 CA THR A 787 39.553 -7.589 -19.530 1.00 0.00 C ATOM 907 C THR A 787 38.387 -8.020 -18.639 1.00 0.00 C ATOM 908 O THR A 787 38.468 -8.994 -17.919 1.00 0.00 O ATOM 909 CB THR A 787 40.886 -7.813 -18.815 1.00 0.00 C ATOM 910 OG1 THR A 787 41.920 -7.147 -19.526 1.00 0.00 O ATOM 911 CG2 THR A 787 41.187 -9.309 -18.755 1.00 0.00 C ATOM 0 H THR A 787 39.510 -5.540 -18.934 1.00 0.00 H new ATOM 0 HA THR A 787 39.484 -8.168 -20.451 1.00 0.00 H new ATOM 0 HB THR A 787 40.828 -7.416 -17.802 1.00 0.00 H new ATOM 0 HG1 THR A 787 42.775 -7.288 -19.068 1.00 0.00 H new ATOM 0 HG21 THR A 787 42.137 -9.469 -18.245 1.00 0.00 H new ATOM 0 HG22 THR A 787 40.393 -9.818 -18.210 1.00 0.00 H new ATOM 0 HG23 THR A 787 41.246 -9.709 -19.767 1.00 0.00 H new ATOM 919 N PHE A 788 37.303 -7.300 -18.685 1.00 0.00 N ATOM 920 CA PHE A 788 36.129 -7.664 -17.843 1.00 0.00 C ATOM 921 C PHE A 788 35.711 -9.112 -18.110 1.00 0.00 C ATOM 922 O PHE A 788 36.218 -9.762 -19.004 1.00 0.00 O ATOM 923 CB PHE A 788 35.024 -6.698 -18.267 1.00 0.00 C ATOM 924 CG PHE A 788 35.430 -5.285 -17.920 1.00 0.00 C ATOM 925 CD1 PHE A 788 35.423 -4.292 -18.908 1.00 0.00 C ATOM 926 CD2 PHE A 788 35.813 -4.967 -16.611 1.00 0.00 C ATOM 927 CE1 PHE A 788 35.799 -2.981 -18.587 1.00 0.00 C ATOM 928 CE2 PHE A 788 36.189 -3.657 -16.291 1.00 0.00 C ATOM 929 CZ PHE A 788 36.182 -2.665 -17.278 1.00 0.00 C ATOM 0 H PHE A 788 37.178 -6.474 -19.270 1.00 0.00 H new ATOM 0 HA PHE A 788 36.347 -7.591 -16.778 1.00 0.00 H new ATOM 0 HB2 PHE A 788 34.843 -6.783 -19.339 1.00 0.00 H new ATOM 0 HB3 PHE A 788 34.091 -6.953 -17.765 1.00 0.00 H new ATOM 0 HD1 PHE A 788 35.128 -4.537 -19.918 1.00 0.00 H new ATOM 0 HD2 PHE A 788 35.818 -5.732 -15.849 1.00 0.00 H new ATOM 0 HE1 PHE A 788 35.793 -2.215 -19.348 1.00 0.00 H new ATOM 0 HE2 PHE A 788 36.485 -3.412 -15.282 1.00 0.00 H new ATOM 0 HZ PHE A 788 36.472 -1.655 -17.030 1.00 0.00 H new ATOM 939 N GLN A 789 34.790 -9.619 -17.342 1.00 0.00 N ATOM 940 CA GLN A 789 34.335 -11.025 -17.546 1.00 0.00 C ATOM 941 C GLN A 789 33.266 -11.384 -16.508 1.00 0.00 C ATOM 942 O GLN A 789 32.998 -10.629 -15.594 1.00 0.00 O ATOM 943 CB GLN A 789 35.589 -11.880 -17.349 1.00 0.00 C ATOM 944 CG GLN A 789 35.636 -12.975 -18.419 1.00 0.00 C ATOM 945 CD GLN A 789 36.350 -12.444 -19.665 1.00 0.00 C ATOM 946 OE1 GLN A 789 37.560 -12.499 -19.757 1.00 0.00 O ATOM 947 NE2 GLN A 789 35.645 -11.929 -20.635 1.00 0.00 N ATOM 0 H GLN A 789 34.330 -9.121 -16.580 1.00 0.00 H new ATOM 0 HA GLN A 789 33.890 -11.181 -18.529 1.00 0.00 H new ATOM 0 HB2 GLN A 789 36.481 -11.256 -17.413 1.00 0.00 H new ATOM 0 HB3 GLN A 789 35.584 -12.328 -16.355 1.00 0.00 H new ATOM 0 HG2 GLN A 789 36.157 -13.851 -18.034 1.00 0.00 H new ATOM 0 HG3 GLN A 789 34.625 -13.292 -18.674 1.00 0.00 H new ATOM 0 HE21 GLN A 789 34.629 -11.883 -20.558 1.00 0.00 H new ATOM 0 HE22 GLN A 789 36.110 -11.573 -21.470 1.00 0.00 H new ATOM 956 N GLN A 790 32.654 -12.527 -16.639 1.00 0.00 N ATOM 957 CA GLN A 790 31.604 -12.928 -15.656 1.00 0.00 C ATOM 958 C GLN A 790 32.179 -12.931 -14.235 1.00 0.00 C ATOM 959 O GLN A 790 33.378 -12.969 -14.041 1.00 0.00 O ATOM 960 CB GLN A 790 31.191 -14.338 -16.070 1.00 0.00 C ATOM 961 CG GLN A 790 29.857 -14.692 -15.411 1.00 0.00 C ATOM 962 CD GLN A 790 30.070 -15.820 -14.401 1.00 0.00 C ATOM 963 OE1 GLN A 790 30.996 -16.597 -14.527 1.00 0.00 O ATOM 964 NE2 GLN A 790 29.246 -15.944 -13.397 1.00 0.00 N ATOM 0 H GLN A 790 32.833 -13.202 -17.383 1.00 0.00 H new ATOM 0 HA GLN A 790 30.758 -12.240 -15.653 1.00 0.00 H new ATOM 0 HB2 GLN A 790 31.101 -14.398 -17.155 1.00 0.00 H new ATOM 0 HB3 GLN A 790 31.957 -15.055 -15.774 1.00 0.00 H new ATOM 0 HG2 GLN A 790 29.442 -13.816 -14.912 1.00 0.00 H new ATOM 0 HG3 GLN A 790 29.135 -14.999 -16.168 1.00 0.00 H new ATOM 0 HE21 GLN A 790 28.469 -15.292 -13.291 1.00 0.00 H new ATOM 0 HE22 GLN A 790 29.379 -16.693 -12.718 1.00 0.00 H new ATOM 973 N GLY A 791 31.333 -12.892 -13.240 1.00 0.00 N ATOM 974 CA GLY A 791 31.837 -12.891 -11.834 1.00 0.00 C ATOM 975 C GLY A 791 30.991 -13.838 -10.983 1.00 0.00 C ATOM 976 O GLY A 791 30.738 -14.968 -11.355 1.00 0.00 O ATOM 0 H GLY A 791 30.318 -12.861 -13.338 1.00 0.00 H new ATOM 0 HA2 GLY A 791 32.882 -13.202 -11.812 1.00 0.00 H new ATOM 0 HA3 GLY A 791 31.795 -11.882 -11.423 1.00 0.00 H new ATOM 980 N GLU A 792 30.554 -13.389 -9.838 1.00 0.00 N ATOM 981 CA GLU A 792 29.724 -14.264 -8.961 1.00 0.00 C ATOM 982 C GLU A 792 28.269 -13.786 -8.972 1.00 0.00 C ATOM 983 O GLU A 792 27.387 -14.468 -9.454 1.00 0.00 O ATOM 984 CB GLU A 792 30.331 -14.118 -7.566 1.00 0.00 C ATOM 985 CG GLU A 792 31.567 -15.013 -7.455 1.00 0.00 C ATOM 986 CD GLU A 792 31.259 -16.200 -6.540 1.00 0.00 C ATOM 987 OE1 GLU A 792 32.177 -16.947 -6.243 1.00 0.00 O ATOM 988 OE2 GLU A 792 30.112 -16.343 -6.152 1.00 0.00 O ATOM 0 H GLU A 792 30.736 -12.454 -9.472 1.00 0.00 H new ATOM 0 HA GLU A 792 29.720 -15.302 -9.292 1.00 0.00 H new ATOM 0 HB2 GLU A 792 30.603 -13.079 -7.382 1.00 0.00 H new ATOM 0 HB3 GLU A 792 29.599 -14.394 -6.808 1.00 0.00 H new ATOM 0 HG2 GLU A 792 31.861 -15.369 -8.443 1.00 0.00 H new ATOM 0 HG3 GLU A 792 32.407 -14.443 -7.058 1.00 0.00 H new ATOM 995 N CYS A 793 28.012 -12.620 -8.444 1.00 0.00 N ATOM 996 CA CYS A 793 26.611 -12.105 -8.428 1.00 0.00 C ATOM 997 C CYS A 793 26.357 -11.245 -9.672 1.00 0.00 C ATOM 998 O CYS A 793 26.547 -10.045 -9.659 1.00 0.00 O ATOM 999 CB CYS A 793 26.511 -11.258 -7.161 1.00 0.00 C ATOM 1000 SG CYS A 793 25.370 -12.045 -5.997 1.00 0.00 S ATOM 0 H CYS A 793 28.708 -12.003 -8.024 1.00 0.00 H new ATOM 0 HA CYS A 793 25.874 -12.908 -8.436 1.00 0.00 H new ATOM 0 HB2 CYS A 793 27.495 -11.149 -6.705 1.00 0.00 H new ATOM 0 HB3 CYS A 793 26.162 -10.255 -7.408 1.00 0.00 H new ATOM 1005 N HIS A 794 25.930 -11.851 -10.749 1.00 0.00 N ATOM 1006 CA HIS A 794 25.667 -11.068 -11.990 1.00 0.00 C ATOM 1007 C HIS A 794 24.161 -10.904 -12.217 1.00 0.00 C ATOM 1008 O HIS A 794 23.362 -11.694 -11.753 1.00 0.00 O ATOM 1009 CB HIS A 794 26.285 -11.891 -13.116 1.00 0.00 C ATOM 1010 CG HIS A 794 25.974 -11.243 -14.435 1.00 0.00 C ATOM 1011 ND1 HIS A 794 26.079 -9.873 -14.627 1.00 0.00 N ATOM 1012 CD2 HIS A 794 25.553 -11.758 -15.635 1.00 0.00 C ATOM 1013 CE1 HIS A 794 25.729 -9.615 -15.899 1.00 0.00 C ATOM 1014 NE2 HIS A 794 25.400 -10.730 -16.559 1.00 0.00 N ATOM 0 H HIS A 794 25.753 -12.853 -10.822 1.00 0.00 H new ATOM 0 HA HIS A 794 26.088 -10.064 -11.934 1.00 0.00 H new ATOM 0 HB2 HIS A 794 27.364 -11.963 -12.979 1.00 0.00 H new ATOM 0 HB3 HIS A 794 25.893 -12.908 -13.096 1.00 0.00 H new ATOM 0 HD2 HIS A 794 25.368 -12.804 -15.832 1.00 0.00 H new ATOM 0 HE1 HIS A 794 25.715 -8.627 -16.335 1.00 0.00 H new ATOM 0 HE2 HIS A 794 25.101 -10.810 -17.531 1.00 0.00 H new ATOM 1022 N SER A 795 23.773 -9.882 -12.930 1.00 0.00 N ATOM 1023 CA SER A 795 22.324 -9.658 -13.193 1.00 0.00 C ATOM 1024 C SER A 795 22.039 -9.789 -14.691 1.00 0.00 C ATOM 1025 O SER A 795 22.450 -8.966 -15.483 1.00 0.00 O ATOM 1026 CB SER A 795 22.050 -8.233 -12.726 1.00 0.00 C ATOM 1027 OG SER A 795 21.000 -7.676 -13.508 1.00 0.00 O ATOM 0 H SER A 795 24.399 -9.191 -13.343 1.00 0.00 H new ATOM 0 HA SER A 795 21.694 -10.383 -12.678 1.00 0.00 H new ATOM 0 HB2 SER A 795 21.774 -8.230 -11.671 1.00 0.00 H new ATOM 0 HB3 SER A 795 22.951 -7.627 -12.822 1.00 0.00 H new ATOM 0 HG SER A 795 20.820 -6.760 -13.209 1.00 0.00 H new ATOM 1033 N ILE A 796 21.338 -10.812 -15.082 1.00 0.00 N ATOM 1034 CA ILE A 796 21.024 -10.999 -16.533 1.00 0.00 C ATOM 1035 C ILE A 796 20.583 -9.672 -17.172 1.00 0.00 C ATOM 1036 O ILE A 796 20.682 -9.489 -18.368 1.00 0.00 O ATOM 1037 CB ILE A 796 19.877 -12.011 -16.562 1.00 0.00 C ATOM 1038 CG1 ILE A 796 18.877 -11.684 -15.445 1.00 0.00 C ATOM 1039 CG2 ILE A 796 20.435 -13.419 -16.348 1.00 0.00 C ATOM 1040 CD1 ILE A 796 17.507 -12.260 -15.799 1.00 0.00 C ATOM 0 H ILE A 796 20.965 -11.532 -14.462 1.00 0.00 H new ATOM 0 HA ILE A 796 21.893 -11.342 -17.095 1.00 0.00 H new ATOM 0 HB ILE A 796 19.373 -11.961 -17.527 1.00 0.00 H new ATOM 0 HG12 ILE A 796 19.224 -12.100 -14.499 1.00 0.00 H new ATOM 0 HG13 ILE A 796 18.805 -10.605 -15.312 1.00 0.00 H new ATOM 0 HG21 ILE A 796 19.619 -14.141 -16.368 1.00 0.00 H new ATOM 0 HG22 ILE A 796 21.146 -13.653 -17.140 1.00 0.00 H new ATOM 0 HG23 ILE A 796 20.939 -13.468 -15.383 1.00 0.00 H new ATOM 0 HD11 ILE A 796 16.798 -12.027 -15.005 1.00 0.00 H new ATOM 0 HD12 ILE A 796 17.160 -11.823 -16.735 1.00 0.00 H new ATOM 0 HD13 ILE A 796 17.585 -13.342 -15.910 1.00 0.00 H new ATOM 1052 N ASN A 797 20.100 -8.745 -16.387 1.00 0.00 N ATOM 1053 CA ASN A 797 19.656 -7.434 -16.962 1.00 0.00 C ATOM 1054 C ASN A 797 20.845 -6.470 -17.120 1.00 0.00 C ATOM 1055 O ASN A 797 20.682 -5.266 -17.096 1.00 0.00 O ATOM 1056 CB ASN A 797 18.655 -6.880 -15.949 1.00 0.00 C ATOM 1057 CG ASN A 797 17.419 -6.361 -16.684 1.00 0.00 C ATOM 1058 OD1 ASN A 797 16.662 -7.132 -17.241 1.00 0.00 O ATOM 1059 ND2 ASN A 797 17.181 -5.078 -16.710 1.00 0.00 N ATOM 0 H ASN A 797 19.993 -8.835 -15.377 1.00 0.00 H new ATOM 0 HA ASN A 797 19.221 -7.554 -17.954 1.00 0.00 H new ATOM 0 HB2 ASN A 797 18.370 -7.658 -15.241 1.00 0.00 H new ATOM 0 HB3 ASN A 797 19.112 -6.076 -15.372 1.00 0.00 H new ATOM 0 HD21 ASN A 797 16.359 -4.722 -17.198 1.00 0.00 H new ATOM 0 HD22 ASN A 797 17.817 -4.432 -16.242 1.00 0.00 H new ATOM 1066 N SER A 798 22.035 -6.985 -17.283 1.00 0.00 N ATOM 1067 CA SER A 798 23.220 -6.089 -17.442 1.00 0.00 C ATOM 1068 C SER A 798 23.351 -5.597 -18.891 1.00 0.00 C ATOM 1069 O SER A 798 23.819 -4.503 -19.142 1.00 0.00 O ATOM 1070 CB SER A 798 24.410 -6.946 -17.079 1.00 0.00 C ATOM 1071 OG SER A 798 24.505 -7.042 -15.660 1.00 0.00 O ATOM 0 H SER A 798 22.238 -7.984 -17.313 1.00 0.00 H new ATOM 0 HA SER A 798 23.136 -5.201 -16.816 1.00 0.00 H new ATOM 0 HB2 SER A 798 24.305 -7.939 -17.516 1.00 0.00 H new ATOM 0 HB3 SER A 798 25.323 -6.513 -17.488 1.00 0.00 H new ATOM 0 HG SER A 798 23.859 -7.702 -15.333 1.00 0.00 H new ATOM 1077 N ASN A 799 22.943 -6.392 -19.848 1.00 0.00 N ATOM 1078 CA ASN A 799 23.054 -5.954 -21.277 1.00 0.00 C ATOM 1079 C ASN A 799 21.679 -5.609 -21.862 1.00 0.00 C ATOM 1080 O ASN A 799 21.545 -5.375 -23.047 1.00 0.00 O ATOM 1081 CB ASN A 799 23.653 -7.156 -22.007 1.00 0.00 C ATOM 1082 CG ASN A 799 25.172 -7.152 -21.833 1.00 0.00 C ATOM 1083 OD1 ASN A 799 25.670 -7.287 -20.734 1.00 0.00 O ATOM 1084 ND2 ASN A 799 25.936 -7.004 -22.882 1.00 0.00 N ATOM 0 H ASN A 799 22.541 -7.318 -19.706 1.00 0.00 H new ATOM 0 HA ASN A 799 23.663 -5.056 -21.376 1.00 0.00 H new ATOM 0 HB2 ASN A 799 23.233 -8.081 -21.612 1.00 0.00 H new ATOM 0 HB3 ASN A 799 23.397 -7.117 -23.066 1.00 0.00 H new ATOM 0 HD21 ASN A 799 26.951 -7.002 -22.778 1.00 0.00 H new ATOM 0 HD22 ASN A 799 25.518 -6.891 -23.805 1.00 0.00 H new ATOM 1091 N SER A 800 20.659 -5.575 -21.053 1.00 0.00 N ATOM 1092 CA SER A 800 19.306 -5.242 -21.588 1.00 0.00 C ATOM 1093 C SER A 800 19.067 -3.732 -21.521 1.00 0.00 C ATOM 1094 O SER A 800 18.514 -3.142 -22.428 1.00 0.00 O ATOM 1095 CB SER A 800 18.325 -5.983 -20.686 1.00 0.00 C ATOM 1096 OG SER A 800 17.143 -5.204 -20.538 1.00 0.00 O ATOM 0 H SER A 800 20.700 -5.762 -20.051 1.00 0.00 H new ATOM 0 HA SER A 800 19.194 -5.534 -22.632 1.00 0.00 H new ATOM 0 HB2 SER A 800 18.082 -6.955 -21.114 1.00 0.00 H new ATOM 0 HB3 SER A 800 18.777 -6.168 -19.712 1.00 0.00 H new ATOM 0 HG SER A 800 16.509 -5.678 -19.960 1.00 0.00 H new ATOM 1102 N VAL A 801 19.477 -3.103 -20.456 1.00 0.00 N ATOM 1103 CA VAL A 801 19.270 -1.631 -20.338 1.00 0.00 C ATOM 1104 C VAL A 801 20.258 -0.886 -21.242 1.00 0.00 C ATOM 1105 O VAL A 801 19.941 0.137 -21.814 1.00 0.00 O ATOM 1106 CB VAL A 801 19.536 -1.306 -18.870 1.00 0.00 C ATOM 1107 CG1 VAL A 801 19.300 0.185 -18.630 1.00 0.00 C ATOM 1108 CG2 VAL A 801 18.586 -2.119 -17.987 1.00 0.00 C ATOM 0 H VAL A 801 19.945 -3.542 -19.663 1.00 0.00 H new ATOM 0 HA VAL A 801 18.268 -1.330 -20.644 1.00 0.00 H new ATOM 0 HB VAL A 801 20.567 -1.558 -18.623 1.00 0.00 H new ATOM 0 HG11 VAL A 801 19.489 0.419 -17.582 1.00 0.00 H new ATOM 0 HG12 VAL A 801 19.974 0.766 -19.259 1.00 0.00 H new ATOM 0 HG13 VAL A 801 18.268 0.434 -18.877 1.00 0.00 H new ATOM 0 HG21 VAL A 801 18.776 -1.887 -16.939 1.00 0.00 H new ATOM 0 HG22 VAL A 801 17.555 -1.867 -18.234 1.00 0.00 H new ATOM 0 HG23 VAL A 801 18.750 -3.183 -18.159 1.00 0.00 H new ATOM 1118 N LEU A 802 21.456 -1.395 -21.377 1.00 0.00 N ATOM 1119 CA LEU A 802 22.459 -0.714 -22.245 1.00 0.00 C ATOM 1120 C LEU A 802 22.048 -0.832 -23.713 1.00 0.00 C ATOM 1121 O LEU A 802 21.888 0.154 -24.403 1.00 0.00 O ATOM 1122 CB LEU A 802 23.773 -1.455 -21.993 1.00 0.00 C ATOM 1123 CG LEU A 802 24.519 -0.791 -20.837 1.00 0.00 C ATOM 1124 CD1 LEU A 802 24.764 0.683 -21.166 1.00 0.00 C ATOM 1125 CD2 LEU A 802 23.679 -0.894 -19.563 1.00 0.00 C ATOM 0 H LEU A 802 21.781 -2.250 -20.925 1.00 0.00 H new ATOM 0 HA LEU A 802 22.545 0.350 -22.022 1.00 0.00 H new ATOM 0 HB2 LEU A 802 23.574 -2.501 -21.758 1.00 0.00 H new ATOM 0 HB3 LEU A 802 24.389 -1.442 -22.892 1.00 0.00 H new ATOM 0 HG LEU A 802 25.474 -1.293 -20.686 1.00 0.00 H new ATOM 0 HD11 LEU A 802 25.296 1.156 -20.341 1.00 0.00 H new ATOM 0 HD12 LEU A 802 25.362 0.759 -22.074 1.00 0.00 H new ATOM 0 HD13 LEU A 802 23.809 1.186 -21.317 1.00 0.00 H new ATOM 0 HD21 LEU A 802 24.210 -0.421 -18.738 1.00 0.00 H new ATOM 0 HD22 LEU A 802 22.724 -0.392 -19.715 1.00 0.00 H new ATOM 0 HD23 LEU A 802 23.503 -1.944 -19.327 1.00 0.00 H new ATOM 1137 N GLU A 803 21.874 -2.031 -24.196 1.00 0.00 N ATOM 1138 CA GLU A 803 21.472 -2.205 -25.620 1.00 0.00 C ATOM 1139 C GLU A 803 20.095 -1.575 -25.857 1.00 0.00 C ATOM 1140 O GLU A 803 19.712 -1.299 -26.976 1.00 0.00 O ATOM 1141 CB GLU A 803 21.417 -3.718 -25.834 1.00 0.00 C ATOM 1142 CG GLU A 803 22.808 -4.235 -26.203 1.00 0.00 C ATOM 1143 CD GLU A 803 22.789 -4.775 -27.634 1.00 0.00 C ATOM 1144 OE1 GLU A 803 21.761 -5.294 -28.036 1.00 0.00 O ATOM 1145 OE2 GLU A 803 23.803 -4.662 -28.302 1.00 0.00 O ATOM 0 H GLU A 803 21.992 -2.896 -23.668 1.00 0.00 H new ATOM 0 HA GLU A 803 22.165 -1.723 -26.310 1.00 0.00 H new ATOM 0 HB2 GLU A 803 21.063 -4.211 -24.928 1.00 0.00 H new ATOM 0 HB3 GLU A 803 20.707 -3.958 -26.626 1.00 0.00 H new ATOM 0 HG2 GLU A 803 23.541 -3.433 -26.116 1.00 0.00 H new ATOM 0 HG3 GLU A 803 23.111 -5.020 -25.511 1.00 0.00 H new ATOM 1152 N ARG A 804 19.350 -1.342 -24.808 1.00 0.00 N ATOM 1153 CA ARG A 804 17.997 -0.730 -24.973 1.00 0.00 C ATOM 1154 C ARG A 804 18.075 0.803 -24.926 1.00 0.00 C ATOM 1155 O ARG A 804 17.188 1.489 -25.393 1.00 0.00 O ATOM 1156 CB ARG A 804 17.179 -1.260 -23.794 1.00 0.00 C ATOM 1157 CG ARG A 804 15.901 -0.429 -23.642 1.00 0.00 C ATOM 1158 CD ARG A 804 14.760 -1.328 -23.157 1.00 0.00 C ATOM 1159 NE ARG A 804 15.269 -1.957 -21.908 1.00 0.00 N ATOM 1160 CZ ARG A 804 14.493 -2.739 -21.209 1.00 0.00 C ATOM 1161 NH1 ARG A 804 14.290 -3.968 -21.595 1.00 0.00 N ATOM 1162 NH2 ARG A 804 13.919 -2.291 -20.126 1.00 0.00 N ATOM 0 H ARG A 804 19.619 -1.548 -23.846 1.00 0.00 H new ATOM 0 HA ARG A 804 17.552 -0.985 -25.935 1.00 0.00 H new ATOM 0 HB2 ARG A 804 16.927 -2.308 -23.955 1.00 0.00 H new ATOM 0 HB3 ARG A 804 17.768 -1.211 -22.878 1.00 0.00 H new ATOM 0 HG2 ARG A 804 16.065 0.383 -22.933 1.00 0.00 H new ATOM 0 HG3 ARG A 804 15.637 0.029 -24.595 1.00 0.00 H new ATOM 0 HD2 ARG A 804 13.856 -0.750 -22.967 1.00 0.00 H new ATOM 0 HD3 ARG A 804 14.507 -2.081 -23.903 1.00 0.00 H new ATOM 0 HE ARG A 804 16.224 -1.777 -21.599 1.00 0.00 H new ATOM 0 HH11 ARG A 804 14.738 -4.317 -22.442 1.00 0.00 H new ATOM 0 HH12 ARG A 804 13.684 -4.580 -21.049 1.00 0.00 H new ATOM 0 HH21 ARG A 804 14.077 -1.329 -19.826 1.00 0.00 H new ATOM 0 HH22 ARG A 804 13.312 -2.903 -19.580 1.00 0.00 H new ATOM 1176 N LYS A 805 19.123 1.350 -24.368 1.00 0.00 N ATOM 1177 CA LYS A 805 19.232 2.840 -24.304 1.00 0.00 C ATOM 1178 C LYS A 805 20.673 3.293 -24.556 1.00 0.00 C ATOM 1179 O LYS A 805 21.248 4.028 -23.778 1.00 0.00 O ATOM 1180 CB LYS A 805 18.798 3.207 -22.886 1.00 0.00 C ATOM 1181 CG LYS A 805 18.388 4.681 -22.842 1.00 0.00 C ATOM 1182 CD LYS A 805 17.796 5.005 -21.470 1.00 0.00 C ATOM 1183 CE LYS A 805 16.287 4.762 -21.497 1.00 0.00 C ATOM 1184 NZ LYS A 805 15.941 4.344 -20.109 1.00 0.00 N ATOM 0 H LYS A 805 19.902 0.836 -23.957 1.00 0.00 H new ATOM 0 HA LYS A 805 18.617 3.325 -25.063 1.00 0.00 H new ATOM 0 HB2 LYS A 805 17.964 2.577 -22.575 1.00 0.00 H new ATOM 0 HB3 LYS A 805 19.613 3.024 -22.186 1.00 0.00 H new ATOM 0 HG2 LYS A 805 19.253 5.316 -23.036 1.00 0.00 H new ATOM 0 HG3 LYS A 805 17.657 4.890 -23.624 1.00 0.00 H new ATOM 0 HD2 LYS A 805 18.262 4.384 -20.705 1.00 0.00 H new ATOM 0 HD3 LYS A 805 18.004 6.042 -21.208 1.00 0.00 H new ATOM 0 HE2 LYS A 805 15.747 5.664 -21.784 1.00 0.00 H new ATOM 0 HE3 LYS A 805 16.024 3.989 -22.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 805 14.920 4.159 -20.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 805 16.465 3.479 -19.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 805 16.196 5.102 -19.444 1.00 0.00 H new ATOM 1198 N CYS A 806 21.261 2.863 -25.636 1.00 0.00 N ATOM 1199 CA CYS A 806 22.665 3.273 -25.934 1.00 0.00 C ATOM 1200 C CYS A 806 22.962 3.107 -27.428 1.00 0.00 C ATOM 1201 O CYS A 806 23.678 3.891 -28.018 1.00 0.00 O ATOM 1202 CB CYS A 806 23.537 2.335 -25.101 1.00 0.00 C ATOM 1203 SG CYS A 806 25.038 3.207 -24.596 1.00 0.00 S ATOM 0 H CYS A 806 20.833 2.246 -26.326 1.00 0.00 H new ATOM 0 HA CYS A 806 22.850 4.320 -25.692 1.00 0.00 H new ATOM 0 HB2 CYS A 806 22.988 1.993 -24.223 1.00 0.00 H new ATOM 0 HB3 CYS A 806 23.795 1.449 -25.681 1.00 0.00 H new ATOM 1208 N ILE A 807 22.421 2.092 -28.042 1.00 0.00 N ATOM 1209 CA ILE A 807 22.676 1.880 -29.496 1.00 0.00 C ATOM 1210 C ILE A 807 21.945 2.951 -30.321 1.00 0.00 C ATOM 1211 O ILE A 807 20.772 3.203 -30.130 1.00 0.00 O ATOM 1212 CB ILE A 807 22.121 0.477 -29.788 1.00 0.00 C ATOM 1213 CG1 ILE A 807 23.195 -0.562 -29.464 1.00 0.00 C ATOM 1214 CG2 ILE A 807 21.730 0.356 -31.268 1.00 0.00 C ATOM 1215 CD1 ILE A 807 22.563 -1.953 -29.415 1.00 0.00 C ATOM 0 H ILE A 807 21.814 1.401 -27.602 1.00 0.00 H new ATOM 0 HA ILE A 807 23.732 1.957 -29.756 1.00 0.00 H new ATOM 0 HB ILE A 807 21.237 0.308 -29.174 1.00 0.00 H new ATOM 0 HG12 ILE A 807 23.981 -0.535 -30.219 1.00 0.00 H new ATOM 0 HG13 ILE A 807 23.663 -0.330 -28.507 1.00 0.00 H new ATOM 0 HG21 ILE A 807 21.339 -0.643 -31.460 1.00 0.00 H new ATOM 0 HG22 ILE A 807 20.966 1.097 -31.504 1.00 0.00 H new ATOM 0 HG23 ILE A 807 22.607 0.528 -31.891 1.00 0.00 H new ATOM 0 HD11 ILE A 807 23.329 -2.693 -29.184 1.00 0.00 H new ATOM 0 HD12 ILE A 807 21.793 -1.976 -28.644 1.00 0.00 H new ATOM 0 HD13 ILE A 807 22.116 -2.184 -30.382 1.00 0.00 H new ATOM 1227 N GLY A 808 22.636 3.582 -31.233 1.00 0.00 N ATOM 1228 CA GLY A 808 21.987 4.633 -32.070 1.00 0.00 C ATOM 1229 C GLY A 808 22.168 6.003 -31.413 1.00 0.00 C ATOM 1230 O GLY A 808 21.494 6.956 -31.750 1.00 0.00 O ATOM 0 H GLY A 808 23.622 3.415 -31.434 1.00 0.00 H new ATOM 0 HA2 GLY A 808 22.425 4.637 -33.068 1.00 0.00 H new ATOM 0 HA3 GLY A 808 20.926 4.413 -32.188 1.00 0.00 H new ATOM 1234 N LEU A 809 23.074 6.112 -30.479 1.00 0.00 N ATOM 1235 CA LEU A 809 23.292 7.426 -29.804 1.00 0.00 C ATOM 1236 C LEU A 809 24.779 7.793 -29.817 1.00 0.00 C ATOM 1237 O LEU A 809 25.637 6.959 -29.605 1.00 0.00 O ATOM 1238 CB LEU A 809 22.810 7.220 -28.370 1.00 0.00 C ATOM 1239 CG LEU A 809 21.290 7.083 -28.357 1.00 0.00 C ATOM 1240 CD1 LEU A 809 20.841 6.494 -27.018 1.00 0.00 C ATOM 1241 CD2 LEU A 809 20.652 8.462 -28.545 1.00 0.00 C ATOM 0 H LEU A 809 23.671 5.352 -30.154 1.00 0.00 H new ATOM 0 HA LEU A 809 22.760 8.236 -30.304 1.00 0.00 H new ATOM 0 HB2 LEU A 809 23.270 6.327 -27.946 1.00 0.00 H new ATOM 0 HB3 LEU A 809 23.115 8.062 -27.748 1.00 0.00 H new ATOM 0 HG LEU A 809 20.979 6.423 -29.167 1.00 0.00 H new ATOM 0 HD11 LEU A 809 19.755 6.396 -27.009 1.00 0.00 H new ATOM 0 HD12 LEU A 809 21.295 5.512 -26.882 1.00 0.00 H new ATOM 0 HD13 LEU A 809 21.153 7.153 -26.208 1.00 0.00 H new ATOM 0 HD21 LEU A 809 19.566 8.365 -28.536 1.00 0.00 H new ATOM 0 HD22 LEU A 809 20.964 9.121 -27.735 1.00 0.00 H new ATOM 0 HD23 LEU A 809 20.971 8.883 -29.498 1.00 0.00 H new ATOM 1253 N GLU A 810 25.088 9.038 -30.063 1.00 0.00 N ATOM 1254 CA GLU A 810 26.518 9.462 -30.087 1.00 0.00 C ATOM 1255 C GLU A 810 27.091 9.401 -28.672 1.00 0.00 C ATOM 1256 O GLU A 810 28.258 9.128 -28.469 1.00 0.00 O ATOM 1257 CB GLU A 810 26.497 10.903 -30.599 1.00 0.00 C ATOM 1258 CG GLU A 810 27.928 11.439 -30.678 1.00 0.00 C ATOM 1259 CD GLU A 810 27.904 12.905 -31.117 1.00 0.00 C ATOM 1260 OE1 GLU A 810 28.153 13.157 -32.285 1.00 0.00 O ATOM 1261 OE2 GLU A 810 27.638 13.750 -30.279 1.00 0.00 O ATOM 0 H GLU A 810 24.412 9.779 -30.248 1.00 0.00 H new ATOM 0 HA GLU A 810 27.137 8.822 -30.716 1.00 0.00 H new ATOM 0 HB2 GLU A 810 26.028 10.944 -31.582 1.00 0.00 H new ATOM 0 HB3 GLU A 810 25.900 11.527 -29.934 1.00 0.00 H new ATOM 0 HG2 GLU A 810 28.415 11.348 -29.707 1.00 0.00 H new ATOM 0 HG3 GLU A 810 28.510 10.847 -31.384 1.00 0.00 H new ATOM 1268 N ARG A 811 26.271 9.654 -27.691 1.00 0.00 N ATOM 1269 CA ARG A 811 26.751 9.615 -26.280 1.00 0.00 C ATOM 1270 C ARG A 811 25.783 8.785 -25.431 1.00 0.00 C ATOM 1271 O ARG A 811 24.628 8.629 -25.768 1.00 0.00 O ATOM 1272 CB ARG A 811 26.761 11.073 -25.820 1.00 0.00 C ATOM 1273 CG ARG A 811 28.164 11.656 -26.004 1.00 0.00 C ATOM 1274 CD ARG A 811 28.202 13.086 -25.462 1.00 0.00 C ATOM 1275 NE ARG A 811 28.543 13.934 -26.638 1.00 0.00 N ATOM 1276 CZ ARG A 811 29.781 14.022 -27.046 1.00 0.00 C ATOM 1277 NH1 ARG A 811 30.048 14.047 -28.321 1.00 0.00 N ATOM 1278 NH2 ARG A 811 30.752 14.084 -26.177 1.00 0.00 N ATOM 0 H ARG A 811 25.285 9.887 -27.805 1.00 0.00 H new ATOM 0 HA ARG A 811 27.737 9.159 -26.185 1.00 0.00 H new ATOM 0 HB2 ARG A 811 26.037 11.652 -26.394 1.00 0.00 H new ATOM 0 HB3 ARG A 811 26.463 11.137 -24.773 1.00 0.00 H new ATOM 0 HG2 ARG A 811 28.896 11.039 -25.482 1.00 0.00 H new ATOM 0 HG3 ARG A 811 28.436 11.649 -27.060 1.00 0.00 H new ATOM 0 HD2 ARG A 811 27.241 13.372 -25.034 1.00 0.00 H new ATOM 0 HD3 ARG A 811 28.946 13.189 -24.672 1.00 0.00 H new ATOM 0 HE ARG A 811 27.809 14.447 -27.126 1.00 0.00 H new ATOM 0 HH11 ARG A 811 29.290 13.998 -29.002 1.00 0.00 H new ATOM 0 HH12 ARG A 811 31.015 14.116 -28.638 1.00 0.00 H new ATOM 0 HH21 ARG A 811 30.545 14.064 -25.178 1.00 0.00 H new ATOM 0 HH22 ARG A 811 31.718 14.153 -26.496 1.00 0.00 H new ATOM 1292 N CYS A 812 26.243 8.250 -24.337 1.00 0.00 N ATOM 1293 CA CYS A 812 25.336 7.431 -23.476 1.00 0.00 C ATOM 1294 C CYS A 812 25.471 7.835 -22.003 1.00 0.00 C ATOM 1295 O CYS A 812 26.545 8.139 -21.525 1.00 0.00 O ATOM 1296 CB CYS A 812 25.797 5.987 -23.676 1.00 0.00 C ATOM 1297 SG CYS A 812 24.354 4.898 -23.728 1.00 0.00 S ATOM 0 H CYS A 812 27.201 8.341 -24.000 1.00 0.00 H new ATOM 0 HA CYS A 812 24.288 7.571 -23.743 1.00 0.00 H new ATOM 0 HB2 CYS A 812 26.366 5.900 -24.602 1.00 0.00 H new ATOM 0 HB3 CYS A 812 26.462 5.690 -22.865 1.00 0.00 H new ATOM 1302 N VAL A 813 24.382 7.841 -21.284 1.00 0.00 N ATOM 1303 CA VAL A 813 24.434 8.223 -19.842 1.00 0.00 C ATOM 1304 C VAL A 813 23.499 7.317 -19.029 1.00 0.00 C ATOM 1305 O VAL A 813 22.297 7.334 -19.207 1.00 0.00 O ATOM 1306 CB VAL A 813 23.951 9.671 -19.796 1.00 0.00 C ATOM 1307 CG1 VAL A 813 24.020 10.187 -18.357 1.00 0.00 C ATOM 1308 CG2 VAL A 813 24.842 10.536 -20.689 1.00 0.00 C ATOM 0 H VAL A 813 23.455 7.597 -21.633 1.00 0.00 H new ATOM 0 HA VAL A 813 25.433 8.117 -19.419 1.00 0.00 H new ATOM 0 HB VAL A 813 22.922 9.721 -20.152 1.00 0.00 H new ATOM 0 HG11 VAL A 813 23.675 11.221 -18.324 1.00 0.00 H new ATOM 0 HG12 VAL A 813 23.385 9.572 -17.719 1.00 0.00 H new ATOM 0 HG13 VAL A 813 25.049 10.136 -18.001 1.00 0.00 H new ATOM 0 HG21 VAL A 813 24.497 11.569 -20.656 1.00 0.00 H new ATOM 0 HG22 VAL A 813 25.871 10.486 -20.334 1.00 0.00 H new ATOM 0 HG23 VAL A 813 24.794 10.170 -21.715 1.00 0.00 H new ATOM 1318 N VAL A 814 24.041 6.528 -18.142 1.00 0.00 N ATOM 1319 CA VAL A 814 23.177 5.624 -17.323 1.00 0.00 C ATOM 1320 C VAL A 814 23.495 5.784 -15.834 1.00 0.00 C ATOM 1321 O VAL A 814 24.614 5.589 -15.405 1.00 0.00 O ATOM 1322 CB VAL A 814 23.525 4.213 -17.792 1.00 0.00 C ATOM 1323 CG1 VAL A 814 22.652 3.194 -17.054 1.00 0.00 C ATOM 1324 CG2 VAL A 814 23.273 4.102 -19.298 1.00 0.00 C ATOM 0 H VAL A 814 25.041 6.468 -17.948 1.00 0.00 H new ATOM 0 HA VAL A 814 22.117 5.848 -17.446 1.00 0.00 H new ATOM 0 HB VAL A 814 24.575 4.010 -17.580 1.00 0.00 H new ATOM 0 HG11 VAL A 814 22.903 2.188 -17.391 1.00 0.00 H new ATOM 0 HG12 VAL A 814 22.829 3.272 -15.981 1.00 0.00 H new ATOM 0 HG13 VAL A 814 21.601 3.395 -17.264 1.00 0.00 H new ATOM 0 HG21 VAL A 814 23.521 3.096 -19.635 1.00 0.00 H new ATOM 0 HG22 VAL A 814 22.223 4.307 -19.507 1.00 0.00 H new ATOM 0 HG23 VAL A 814 23.896 4.825 -19.825 1.00 0.00 H new ATOM 1334 N ALA A 815 22.520 6.140 -15.043 1.00 0.00 N ATOM 1335 CA ALA A 815 22.773 6.311 -13.582 1.00 0.00 C ATOM 1336 C ALA A 815 22.768 4.947 -12.889 1.00 0.00 C ATOM 1337 O ALA A 815 21.994 4.073 -13.227 1.00 0.00 O ATOM 1338 CB ALA A 815 21.619 7.174 -13.075 1.00 0.00 C ATOM 0 H ALA A 815 21.562 6.320 -15.343 1.00 0.00 H new ATOM 0 HA ALA A 815 23.740 6.771 -13.380 1.00 0.00 H new ATOM 0 HB1 ALA A 815 21.735 7.344 -12.005 1.00 0.00 H new ATOM 0 HB2 ALA A 815 21.623 8.131 -13.597 1.00 0.00 H new ATOM 0 HB3 ALA A 815 20.674 6.664 -13.261 1.00 0.00 H new ATOM 1344 N ILE A 816 23.623 4.756 -11.923 1.00 0.00 N ATOM 1345 CA ILE A 816 23.659 3.443 -11.216 1.00 0.00 C ATOM 1346 C ILE A 816 22.674 3.441 -10.046 1.00 0.00 C ATOM 1347 O ILE A 816 22.847 4.147 -9.074 1.00 0.00 O ATOM 1348 CB ILE A 816 25.091 3.302 -10.709 1.00 0.00 C ATOM 1349 CG1 ILE A 816 26.064 3.473 -11.878 1.00 0.00 C ATOM 1350 CG2 ILE A 816 25.275 1.916 -10.092 1.00 0.00 C ATOM 1351 CD1 ILE A 816 27.383 4.050 -11.364 1.00 0.00 C ATOM 0 H ILE A 816 24.296 5.448 -11.593 1.00 0.00 H new ATOM 0 HA ILE A 816 23.375 2.618 -11.870 1.00 0.00 H new ATOM 0 HB ILE A 816 25.289 4.066 -9.957 1.00 0.00 H new ATOM 0 HG12 ILE A 816 26.239 2.512 -12.362 1.00 0.00 H new ATOM 0 HG13 ILE A 816 25.634 4.135 -12.629 1.00 0.00 H new ATOM 0 HG21 ILE A 816 26.297 1.812 -9.729 1.00 0.00 H new ATOM 0 HG22 ILE A 816 24.580 1.793 -9.261 1.00 0.00 H new ATOM 0 HG23 ILE A 816 25.079 1.153 -10.846 1.00 0.00 H new ATOM 0 HD11 ILE A 816 28.076 4.172 -12.197 1.00 0.00 H new ATOM 0 HD12 ILE A 816 27.200 5.019 -10.900 1.00 0.00 H new ATOM 0 HD13 ILE A 816 27.815 3.371 -10.629 1.00 0.00 H new ATOM 1363 N SER A 817 21.642 2.653 -10.138 1.00 0.00 N ATOM 1364 CA SER A 817 20.642 2.601 -9.034 1.00 0.00 C ATOM 1365 C SER A 817 19.698 1.412 -9.238 1.00 0.00 C ATOM 1366 O SER A 817 19.622 0.858 -10.317 1.00 0.00 O ATOM 1367 CB SER A 817 19.876 3.916 -9.134 1.00 0.00 C ATOM 1368 OG SER A 817 19.264 4.006 -10.413 1.00 0.00 O ATOM 0 H SER A 817 21.446 2.041 -10.930 1.00 0.00 H new ATOM 0 HA SER A 817 21.108 2.475 -8.057 1.00 0.00 H new ATOM 0 HB2 SER A 817 19.119 3.970 -8.351 1.00 0.00 H new ATOM 0 HB3 SER A 817 20.553 4.757 -8.982 1.00 0.00 H new ATOM 0 HG SER A 817 19.950 4.173 -11.093 1.00 0.00 H new ATOM 1374 N PRO A 818 19.009 1.061 -8.187 1.00 0.00 N ATOM 1375 CA PRO A 818 18.060 -0.073 -8.248 1.00 0.00 C ATOM 1376 C PRO A 818 16.817 0.314 -9.059 1.00 0.00 C ATOM 1377 O PRO A 818 16.085 -0.533 -9.531 1.00 0.00 O ATOM 1378 CB PRO A 818 17.704 -0.324 -6.788 1.00 0.00 C ATOM 1379 CG PRO A 818 17.950 0.983 -6.099 1.00 0.00 C ATOM 1380 CD PRO A 818 19.052 1.682 -6.862 1.00 0.00 C ATOM 0 HA PRO A 818 18.476 -0.955 -8.734 1.00 0.00 H new ATOM 0 HB2 PRO A 818 16.665 -0.636 -6.683 1.00 0.00 H new ATOM 0 HB3 PRO A 818 18.319 -1.117 -6.362 1.00 0.00 H new ATOM 0 HG2 PRO A 818 17.044 1.589 -6.087 1.00 0.00 H new ATOM 0 HG3 PRO A 818 18.241 0.823 -5.061 1.00 0.00 H new ATOM 0 HD2 PRO A 818 18.880 2.757 -6.918 1.00 0.00 H new ATOM 0 HD3 PRO A 818 20.022 1.539 -6.385 1.00 0.00 H new ATOM 1388 N SER A 819 16.574 1.587 -9.225 1.00 0.00 N ATOM 1389 CA SER A 819 15.379 2.020 -10.006 1.00 0.00 C ATOM 1390 C SER A 819 15.772 2.284 -11.462 1.00 0.00 C ATOM 1391 O SER A 819 15.432 3.301 -12.033 1.00 0.00 O ATOM 1392 CB SER A 819 14.910 3.310 -9.337 1.00 0.00 C ATOM 1393 OG SER A 819 14.844 3.111 -7.929 1.00 0.00 O ATOM 0 H SER A 819 17.149 2.343 -8.855 1.00 0.00 H new ATOM 0 HA SER A 819 14.596 1.262 -10.017 1.00 0.00 H new ATOM 0 HB2 SER A 819 15.596 4.124 -9.569 1.00 0.00 H new ATOM 0 HB3 SER A 819 13.932 3.598 -9.722 1.00 0.00 H new ATOM 0 HG SER A 819 14.545 3.937 -7.495 1.00 0.00 H new ATOM 1399 N ASN A 820 16.487 1.375 -12.066 1.00 0.00 N ATOM 1400 CA ASN A 820 16.903 1.573 -13.484 1.00 0.00 C ATOM 1401 C ASN A 820 16.791 0.255 -14.257 1.00 0.00 C ATOM 1402 O ASN A 820 16.151 0.178 -15.286 1.00 0.00 O ATOM 1403 CB ASN A 820 18.361 2.026 -13.411 1.00 0.00 C ATOM 1404 CG ASN A 820 18.430 3.549 -13.526 1.00 0.00 C ATOM 1405 OD1 ASN A 820 19.064 4.202 -12.722 1.00 0.00 O ATOM 1406 ND2 ASN A 820 17.801 4.146 -14.499 1.00 0.00 N ATOM 0 H ASN A 820 16.801 0.504 -11.639 1.00 0.00 H new ATOM 0 HA ASN A 820 16.275 2.300 -14.000 1.00 0.00 H new ATOM 0 HB2 ASN A 820 18.807 1.701 -12.471 1.00 0.00 H new ATOM 0 HB3 ASN A 820 18.937 1.564 -14.213 1.00 0.00 H new ATOM 0 HD21 ASN A 820 17.841 5.162 -14.585 1.00 0.00 H new ATOM 0 HD22 ASN A 820 17.268 3.598 -15.174 1.00 0.00 H new ATOM 1413 N PHE A 821 17.408 -0.783 -13.762 1.00 0.00 N ATOM 1414 CA PHE A 821 17.341 -2.098 -14.465 1.00 0.00 C ATOM 1415 C PHE A 821 16.012 -2.795 -14.163 1.00 0.00 C ATOM 1416 O PHE A 821 15.470 -3.501 -14.990 1.00 0.00 O ATOM 1417 CB PHE A 821 18.510 -2.904 -13.900 1.00 0.00 C ATOM 1418 CG PHE A 821 19.809 -2.314 -14.392 1.00 0.00 C ATOM 1419 CD1 PHE A 821 20.438 -1.298 -13.662 1.00 0.00 C ATOM 1420 CD2 PHE A 821 20.384 -2.782 -15.578 1.00 0.00 C ATOM 1421 CE1 PHE A 821 21.642 -0.751 -14.119 1.00 0.00 C ATOM 1422 CE2 PHE A 821 21.589 -2.236 -16.035 1.00 0.00 C ATOM 1423 CZ PHE A 821 22.218 -1.219 -15.306 1.00 0.00 C ATOM 0 H PHE A 821 17.956 -0.778 -12.902 1.00 0.00 H new ATOM 0 HA PHE A 821 17.402 -1.992 -15.548 1.00 0.00 H new ATOM 0 HB2 PHE A 821 18.482 -2.892 -12.810 1.00 0.00 H new ATOM 0 HB3 PHE A 821 18.431 -3.946 -14.209 1.00 0.00 H new ATOM 0 HD1 PHE A 821 19.994 -0.937 -12.746 1.00 0.00 H new ATOM 0 HD2 PHE A 821 19.898 -3.565 -16.141 1.00 0.00 H new ATOM 0 HE1 PHE A 821 22.127 0.033 -13.556 1.00 0.00 H new ATOM 0 HE2 PHE A 821 22.034 -2.599 -16.950 1.00 0.00 H new ATOM 0 HZ PHE A 821 23.147 -0.796 -15.659 1.00 0.00 H new ATOM 1433 N GLY A 822 15.484 -2.604 -12.987 1.00 0.00 N ATOM 1434 CA GLY A 822 14.191 -3.257 -12.638 1.00 0.00 C ATOM 1435 C GLY A 822 14.335 -4.008 -11.314 1.00 0.00 C ATOM 1436 O GLY A 822 14.277 -5.222 -11.268 1.00 0.00 O ATOM 0 H GLY A 822 15.891 -2.025 -12.253 1.00 0.00 H new ATOM 0 HA2 GLY A 822 13.404 -2.507 -12.558 1.00 0.00 H new ATOM 0 HA3 GLY A 822 13.896 -3.947 -13.429 1.00 0.00 H new ATOM 1440 N GLY A 823 14.526 -3.298 -10.236 1.00 0.00 N ATOM 1441 CA GLY A 823 14.674 -3.974 -8.914 1.00 0.00 C ATOM 1442 C GLY A 823 16.158 -4.089 -8.556 1.00 0.00 C ATOM 1443 O GLY A 823 17.018 -3.594 -9.258 1.00 0.00 O ATOM 0 H GLY A 823 14.586 -2.280 -10.212 1.00 0.00 H new ATOM 0 HA2 GLY A 823 14.147 -3.409 -8.145 1.00 0.00 H new ATOM 0 HA3 GLY A 823 14.221 -4.965 -8.949 1.00 0.00 H new ATOM 1447 N ASP A 824 16.465 -4.739 -7.465 1.00 0.00 N ATOM 1448 CA ASP A 824 17.894 -4.889 -7.060 1.00 0.00 C ATOM 1449 C ASP A 824 18.396 -6.296 -7.408 1.00 0.00 C ATOM 1450 O ASP A 824 17.737 -7.276 -7.126 1.00 0.00 O ATOM 1451 CB ASP A 824 17.899 -4.675 -5.549 1.00 0.00 C ATOM 1452 CG ASP A 824 18.733 -3.439 -5.217 1.00 0.00 C ATOM 1453 OD1 ASP A 824 18.157 -2.466 -4.762 1.00 0.00 O ATOM 1454 OD2 ASP A 824 19.934 -3.487 -5.423 1.00 0.00 O ATOM 0 H ASP A 824 15.789 -5.173 -6.837 1.00 0.00 H new ATOM 0 HA ASP A 824 18.548 -4.183 -7.573 1.00 0.00 H new ATOM 0 HB2 ASP A 824 16.879 -4.549 -5.185 1.00 0.00 H new ATOM 0 HB3 ASP A 824 18.310 -5.551 -5.047 1.00 0.00 H new ATOM 1459 N PRO A 825 19.555 -6.344 -8.010 1.00 0.00 N ATOM 1460 CA PRO A 825 20.153 -7.638 -8.400 1.00 0.00 C ATOM 1461 C PRO A 825 20.714 -8.363 -7.169 1.00 0.00 C ATOM 1462 O PRO A 825 20.030 -9.133 -6.524 1.00 0.00 O ATOM 1463 CB PRO A 825 21.273 -7.244 -9.353 1.00 0.00 C ATOM 1464 CG PRO A 825 21.640 -5.841 -8.966 1.00 0.00 C ATOM 1465 CD PRO A 825 20.401 -5.205 -8.377 1.00 0.00 C ATOM 0 HA PRO A 825 19.435 -8.321 -8.854 1.00 0.00 H new ATOM 0 HB2 PRO A 825 22.126 -7.915 -9.257 1.00 0.00 H new ATOM 0 HB3 PRO A 825 20.943 -7.293 -10.391 1.00 0.00 H new ATOM 0 HG2 PRO A 825 22.454 -5.842 -8.242 1.00 0.00 H new ATOM 0 HG3 PRO A 825 21.986 -5.280 -9.834 1.00 0.00 H new ATOM 0 HD2 PRO A 825 20.642 -4.591 -7.509 1.00 0.00 H new ATOM 0 HD3 PRO A 825 19.905 -4.556 -9.098 1.00 0.00 H new ATOM 1473 N CYS A 826 21.954 -8.124 -6.840 1.00 0.00 N ATOM 1474 CA CYS A 826 22.555 -8.799 -5.653 1.00 0.00 C ATOM 1475 C CYS A 826 22.866 -7.770 -4.561 1.00 0.00 C ATOM 1476 O CYS A 826 23.833 -7.041 -4.649 1.00 0.00 O ATOM 1477 CB CYS A 826 23.843 -9.438 -6.170 1.00 0.00 C ATOM 1478 SG CYS A 826 23.577 -11.212 -6.416 1.00 0.00 S ATOM 0 H CYS A 826 22.577 -7.491 -7.341 1.00 0.00 H new ATOM 0 HA CYS A 826 21.883 -9.536 -5.213 1.00 0.00 H new ATOM 0 HB2 CYS A 826 24.143 -8.970 -7.108 1.00 0.00 H new ATOM 0 HB3 CYS A 826 24.653 -9.276 -5.459 1.00 0.00 H new ATOM 1483 N PRO A 827 22.024 -7.747 -3.566 1.00 0.00 N ATOM 1484 CA PRO A 827 22.203 -6.804 -2.441 1.00 0.00 C ATOM 1485 C PRO A 827 23.355 -7.256 -1.534 1.00 0.00 C ATOM 1486 O PRO A 827 23.819 -8.376 -1.612 1.00 0.00 O ATOM 1487 CB PRO A 827 20.874 -6.869 -1.700 1.00 0.00 C ATOM 1488 CG PRO A 827 20.301 -8.212 -2.043 1.00 0.00 C ATOM 1489 CD PRO A 827 20.836 -8.588 -3.406 1.00 0.00 C ATOM 0 HA PRO A 827 22.454 -5.795 -2.769 1.00 0.00 H new ATOM 0 HB2 PRO A 827 21.017 -6.764 -0.624 1.00 0.00 H new ATOM 0 HB3 PRO A 827 20.208 -6.065 -2.013 1.00 0.00 H new ATOM 0 HG2 PRO A 827 20.587 -8.955 -1.298 1.00 0.00 H new ATOM 0 HG3 PRO A 827 19.212 -8.175 -2.053 1.00 0.00 H new ATOM 0 HD2 PRO A 827 21.087 -9.647 -3.458 1.00 0.00 H new ATOM 0 HD3 PRO A 827 20.103 -8.396 -4.189 1.00 0.00 H new ATOM 1497 N GLU A 828 23.821 -6.386 -0.677 1.00 0.00 N ATOM 1498 CA GLU A 828 24.942 -6.757 0.239 1.00 0.00 C ATOM 1499 C GLU A 828 26.150 -7.254 -0.562 1.00 0.00 C ATOM 1500 O GLU A 828 26.760 -8.249 -0.225 1.00 0.00 O ATOM 1501 CB GLU A 828 24.388 -7.878 1.116 1.00 0.00 C ATOM 1502 CG GLU A 828 25.460 -8.319 2.116 1.00 0.00 C ATOM 1503 CD GLU A 828 25.576 -9.843 2.102 1.00 0.00 C ATOM 1504 OE1 GLU A 828 25.625 -10.424 3.174 1.00 0.00 O ATOM 1505 OE2 GLU A 828 25.615 -10.405 1.020 1.00 0.00 O ATOM 0 H GLU A 828 23.474 -5.433 -0.571 1.00 0.00 H new ATOM 0 HA GLU A 828 25.283 -5.906 0.829 1.00 0.00 H new ATOM 0 HB2 GLU A 828 23.500 -7.534 1.646 1.00 0.00 H new ATOM 0 HB3 GLU A 828 24.083 -8.722 0.497 1.00 0.00 H new ATOM 0 HG2 GLU A 828 26.419 -7.869 1.859 1.00 0.00 H new ATOM 0 HG3 GLU A 828 25.203 -7.973 3.117 1.00 0.00 H new ATOM 1512 N VAL A 829 26.498 -6.573 -1.619 1.00 0.00 N ATOM 1513 CA VAL A 829 27.667 -7.011 -2.434 1.00 0.00 C ATOM 1514 C VAL A 829 28.462 -5.792 -2.913 1.00 0.00 C ATOM 1515 O VAL A 829 27.921 -4.719 -3.092 1.00 0.00 O ATOM 1516 CB VAL A 829 27.062 -7.755 -3.620 1.00 0.00 C ATOM 1517 CG1 VAL A 829 28.117 -7.913 -4.715 1.00 0.00 C ATOM 1518 CG2 VAL A 829 26.588 -9.139 -3.167 1.00 0.00 C ATOM 0 H VAL A 829 26.025 -5.734 -1.953 1.00 0.00 H new ATOM 0 HA VAL A 829 28.356 -7.638 -1.868 1.00 0.00 H new ATOM 0 HB VAL A 829 26.215 -7.189 -4.009 1.00 0.00 H new ATOM 0 HG11 VAL A 829 27.685 -8.445 -5.563 1.00 0.00 H new ATOM 0 HG12 VAL A 829 28.456 -6.929 -5.039 1.00 0.00 H new ATOM 0 HG13 VAL A 829 28.964 -8.478 -4.326 1.00 0.00 H new ATOM 0 HG21 VAL A 829 26.156 -9.671 -4.014 1.00 0.00 H new ATOM 0 HG22 VAL A 829 27.435 -9.704 -2.778 1.00 0.00 H new ATOM 0 HG23 VAL A 829 25.836 -9.028 -2.386 1.00 0.00 H new ATOM 1528 N MET A 830 29.741 -5.950 -3.122 1.00 0.00 N ATOM 1529 CA MET A 830 30.567 -4.798 -3.589 1.00 0.00 C ATOM 1530 C MET A 830 29.820 -4.029 -4.683 1.00 0.00 C ATOM 1531 O MET A 830 29.470 -4.575 -5.710 1.00 0.00 O ATOM 1532 CB MET A 830 31.843 -5.427 -4.146 1.00 0.00 C ATOM 1533 CG MET A 830 32.841 -5.645 -3.007 1.00 0.00 C ATOM 1534 SD MET A 830 33.075 -7.421 -2.741 1.00 0.00 S ATOM 1535 CE MET A 830 34.857 -7.463 -3.046 1.00 0.00 C ATOM 0 H MET A 830 30.249 -6.824 -2.990 1.00 0.00 H new ATOM 0 HA MET A 830 30.782 -4.088 -2.791 1.00 0.00 H new ATOM 0 HB2 MET A 830 31.613 -6.377 -4.629 1.00 0.00 H new ATOM 0 HB3 MET A 830 32.279 -4.780 -4.907 1.00 0.00 H new ATOM 0 HG2 MET A 830 33.794 -5.174 -3.249 1.00 0.00 H new ATOM 0 HG3 MET A 830 32.476 -5.175 -2.094 1.00 0.00 H new ATOM 0 HE1 MET A 830 35.221 -8.484 -2.933 1.00 0.00 H new ATOM 0 HE2 MET A 830 35.061 -7.114 -4.058 1.00 0.00 H new ATOM 0 HE3 MET A 830 35.364 -6.816 -2.330 1.00 0.00 H new ATOM 1545 N LYS A 831 29.573 -2.766 -4.469 1.00 0.00 N ATOM 1546 CA LYS A 831 28.847 -1.963 -5.498 1.00 0.00 C ATOM 1547 C LYS A 831 29.821 -1.434 -6.554 1.00 0.00 C ATOM 1548 O LYS A 831 30.325 -0.333 -6.453 1.00 0.00 O ATOM 1549 CB LYS A 831 28.217 -0.807 -4.725 1.00 0.00 C ATOM 1550 CG LYS A 831 27.532 -1.347 -3.468 1.00 0.00 C ATOM 1551 CD LYS A 831 28.382 -1.015 -2.242 1.00 0.00 C ATOM 1552 CE LYS A 831 27.484 -0.453 -1.138 1.00 0.00 C ATOM 1553 NZ LYS A 831 27.952 0.947 -0.942 1.00 0.00 N ATOM 0 H LYS A 831 29.841 -2.254 -3.628 1.00 0.00 H new ATOM 0 HA LYS A 831 28.102 -2.556 -6.029 1.00 0.00 H new ATOM 0 HB2 LYS A 831 28.981 -0.079 -4.452 1.00 0.00 H new ATOM 0 HB3 LYS A 831 27.492 -0.288 -5.352 1.00 0.00 H new ATOM 0 HG2 LYS A 831 26.539 -0.909 -3.365 1.00 0.00 H new ATOM 0 HG3 LYS A 831 27.397 -2.426 -3.549 1.00 0.00 H new ATOM 0 HD2 LYS A 831 28.895 -1.909 -1.889 1.00 0.00 H new ATOM 0 HD3 LYS A 831 29.151 -0.289 -2.505 1.00 0.00 H new ATOM 0 HE2 LYS A 831 26.434 -0.482 -1.429 1.00 0.00 H new ATOM 0 HE3 LYS A 831 27.576 -1.033 -0.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 831 27.384 1.402 -0.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 831 28.953 0.942 -0.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 831 27.846 1.476 -1.831 1.00 0.00 H new ATOM 1567 N ARG A 832 30.088 -2.212 -7.562 1.00 0.00 N ATOM 1568 CA ARG A 832 31.027 -1.761 -8.628 1.00 0.00 C ATOM 1569 C ARG A 832 30.376 -1.966 -10.001 1.00 0.00 C ATOM 1570 O ARG A 832 29.937 -3.049 -10.333 1.00 0.00 O ATOM 1571 CB ARG A 832 32.261 -2.649 -8.474 1.00 0.00 C ATOM 1572 CG ARG A 832 33.394 -1.845 -7.833 1.00 0.00 C ATOM 1573 CD ARG A 832 33.116 -1.670 -6.338 1.00 0.00 C ATOM 1574 NE ARG A 832 34.444 -1.371 -5.734 1.00 0.00 N ATOM 1575 CZ ARG A 832 34.572 -1.307 -4.437 1.00 0.00 C ATOM 1576 NH1 ARG A 832 35.217 -0.311 -3.892 1.00 0.00 N ATOM 1577 NH2 ARG A 832 34.054 -2.238 -3.683 1.00 0.00 N ATOM 0 H ARG A 832 29.696 -3.144 -7.696 1.00 0.00 H new ATOM 0 HA ARG A 832 31.283 -0.705 -8.546 1.00 0.00 H new ATOM 0 HB2 ARG A 832 32.023 -3.516 -7.858 1.00 0.00 H new ATOM 0 HB3 ARG A 832 32.574 -3.026 -9.448 1.00 0.00 H new ATOM 0 HG2 ARG A 832 34.345 -2.357 -7.979 1.00 0.00 H new ATOM 0 HG3 ARG A 832 33.480 -0.871 -8.314 1.00 0.00 H new ATOM 0 HD2 ARG A 832 32.409 -0.859 -6.160 1.00 0.00 H new ATOM 0 HD3 ARG A 832 32.681 -2.572 -5.909 1.00 0.00 H new ATOM 0 HE ARG A 832 35.254 -1.216 -6.334 1.00 0.00 H new ATOM 0 HH11 ARG A 832 35.621 0.418 -4.480 1.00 0.00 H new ATOM 0 HH12 ARG A 832 35.317 -0.262 -2.878 1.00 0.00 H new ATOM 0 HH21 ARG A 832 33.549 -3.016 -4.108 1.00 0.00 H new ATOM 0 HH22 ARG A 832 34.154 -2.188 -2.669 1.00 0.00 H new ATOM 1591 N VAL A 833 30.308 -0.937 -10.801 1.00 0.00 N ATOM 1592 CA VAL A 833 29.682 -1.084 -12.146 1.00 0.00 C ATOM 1593 C VAL A 833 30.740 -0.998 -13.252 1.00 0.00 C ATOM 1594 O VAL A 833 31.662 -0.211 -13.187 1.00 0.00 O ATOM 1595 CB VAL A 833 28.702 0.084 -12.249 1.00 0.00 C ATOM 1596 CG1 VAL A 833 28.178 0.189 -13.682 1.00 0.00 C ATOM 1597 CG2 VAL A 833 27.528 -0.155 -11.295 1.00 0.00 C ATOM 0 H VAL A 833 30.657 -0.004 -10.583 1.00 0.00 H new ATOM 0 HA VAL A 833 29.190 -2.049 -12.265 1.00 0.00 H new ATOM 0 HB VAL A 833 29.211 1.010 -11.981 1.00 0.00 H new ATOM 0 HG11 VAL A 833 27.479 1.022 -13.754 1.00 0.00 H new ATOM 0 HG12 VAL A 833 29.012 0.355 -14.363 1.00 0.00 H new ATOM 0 HG13 VAL A 833 27.668 -0.736 -13.952 1.00 0.00 H new ATOM 0 HG21 VAL A 833 26.827 0.676 -11.366 1.00 0.00 H new ATOM 0 HG22 VAL A 833 27.021 -1.081 -11.566 1.00 0.00 H new ATOM 0 HG23 VAL A 833 27.899 -0.231 -10.273 1.00 0.00 H new ATOM 1607 N ALA A 834 30.608 -1.810 -14.268 1.00 0.00 N ATOM 1608 CA ALA A 834 31.600 -1.786 -15.387 1.00 0.00 C ATOM 1609 C ALA A 834 30.875 -1.980 -16.724 1.00 0.00 C ATOM 1610 O ALA A 834 29.984 -2.795 -16.839 1.00 0.00 O ATOM 1611 CB ALA A 834 32.536 -2.962 -15.111 1.00 0.00 C ATOM 0 H ALA A 834 29.855 -2.490 -14.373 1.00 0.00 H new ATOM 0 HA ALA A 834 32.142 -0.842 -15.446 1.00 0.00 H new ATOM 0 HB1 ALA A 834 33.296 -3.013 -15.891 1.00 0.00 H new ATOM 0 HB2 ALA A 834 33.018 -2.824 -14.143 1.00 0.00 H new ATOM 0 HB3 ALA A 834 31.963 -3.889 -15.102 1.00 0.00 H new ATOM 1617 N VAL A 835 31.248 -1.241 -17.737 1.00 0.00 N ATOM 1618 CA VAL A 835 30.562 -1.402 -19.056 1.00 0.00 C ATOM 1619 C VAL A 835 31.462 -0.940 -20.209 1.00 0.00 C ATOM 1620 O VAL A 835 31.985 0.157 -20.205 1.00 0.00 O ATOM 1621 CB VAL A 835 29.322 -0.513 -18.961 1.00 0.00 C ATOM 1622 CG1 VAL A 835 28.733 -0.303 -20.358 1.00 0.00 C ATOM 1623 CG2 VAL A 835 28.280 -1.186 -18.064 1.00 0.00 C ATOM 0 H VAL A 835 31.989 -0.541 -17.711 1.00 0.00 H new ATOM 0 HA VAL A 835 30.315 -2.444 -19.259 1.00 0.00 H new ATOM 0 HB VAL A 835 29.600 0.452 -18.537 1.00 0.00 H new ATOM 0 HG11 VAL A 835 27.849 0.331 -20.289 1.00 0.00 H new ATOM 0 HG12 VAL A 835 29.474 0.177 -20.997 1.00 0.00 H new ATOM 0 HG13 VAL A 835 28.456 -1.267 -20.785 1.00 0.00 H new ATOM 0 HG21 VAL A 835 27.395 -0.553 -17.996 1.00 0.00 H new ATOM 0 HG22 VAL A 835 28.003 -2.151 -18.488 1.00 0.00 H new ATOM 0 HG23 VAL A 835 28.698 -1.334 -17.068 1.00 0.00 H new ATOM 1633 N GLU A 836 31.637 -1.775 -21.199 1.00 0.00 N ATOM 1634 CA GLU A 836 32.496 -1.398 -22.358 1.00 0.00 C ATOM 1635 C GLU A 836 31.628 -1.290 -23.616 1.00 0.00 C ATOM 1636 O GLU A 836 30.880 -2.191 -23.941 1.00 0.00 O ATOM 1637 CB GLU A 836 33.505 -2.538 -22.496 1.00 0.00 C ATOM 1638 CG GLU A 836 34.844 -1.979 -22.983 1.00 0.00 C ATOM 1639 CD GLU A 836 35.990 -2.757 -22.335 1.00 0.00 C ATOM 1640 OE1 GLU A 836 36.132 -3.930 -22.642 1.00 0.00 O ATOM 1641 OE2 GLU A 836 36.709 -2.168 -21.543 1.00 0.00 O ATOM 0 H GLU A 836 31.220 -2.704 -21.254 1.00 0.00 H new ATOM 0 HA GLU A 836 32.995 -0.439 -22.219 1.00 0.00 H new ATOM 0 HB2 GLU A 836 33.636 -3.040 -21.537 1.00 0.00 H new ATOM 0 HB3 GLU A 836 33.133 -3.284 -23.199 1.00 0.00 H new ATOM 0 HG2 GLU A 836 34.908 -2.054 -24.069 1.00 0.00 H new ATOM 0 HG3 GLU A 836 34.921 -0.921 -22.732 1.00 0.00 H new ATOM 1648 N ALA A 837 31.719 -0.202 -24.327 1.00 0.00 N ATOM 1649 CA ALA A 837 30.887 -0.055 -25.560 1.00 0.00 C ATOM 1650 C ALA A 837 31.761 -0.093 -26.817 1.00 0.00 C ATOM 1651 O ALA A 837 32.948 0.168 -26.773 1.00 0.00 O ATOM 1652 CB ALA A 837 30.215 1.311 -25.420 1.00 0.00 C ATOM 0 H ALA A 837 32.328 0.588 -24.113 1.00 0.00 H new ATOM 0 HA ALA A 837 30.164 -0.865 -25.661 1.00 0.00 H new ATOM 0 HB1 ALA A 837 29.583 1.497 -26.289 1.00 0.00 H new ATOM 0 HB2 ALA A 837 29.604 1.325 -24.517 1.00 0.00 H new ATOM 0 HB3 ALA A 837 30.978 2.087 -25.354 1.00 0.00 H new ATOM 1658 N VAL A 838 31.175 -0.419 -27.939 1.00 0.00 N ATOM 1659 CA VAL A 838 31.959 -0.478 -29.207 1.00 0.00 C ATOM 1660 C VAL A 838 31.556 0.687 -30.117 1.00 0.00 C ATOM 1661 O VAL A 838 30.387 0.949 -30.323 1.00 0.00 O ATOM 1662 CB VAL A 838 31.580 -1.811 -29.845 1.00 0.00 C ATOM 1663 CG1 VAL A 838 32.305 -1.963 -31.183 1.00 0.00 C ATOM 1664 CG2 VAL A 838 31.987 -2.956 -28.913 1.00 0.00 C ATOM 0 H VAL A 838 30.185 -0.647 -28.032 1.00 0.00 H new ATOM 0 HA VAL A 838 33.033 -0.401 -29.039 1.00 0.00 H new ATOM 0 HB VAL A 838 30.503 -1.840 -30.011 1.00 0.00 H new ATOM 0 HG11 VAL A 838 32.033 -2.916 -31.638 1.00 0.00 H new ATOM 0 HG12 VAL A 838 32.017 -1.148 -31.848 1.00 0.00 H new ATOM 0 HG13 VAL A 838 33.382 -1.933 -31.019 1.00 0.00 H new ATOM 0 HG21 VAL A 838 31.717 -3.909 -29.368 1.00 0.00 H new ATOM 0 HG22 VAL A 838 33.064 -2.925 -28.748 1.00 0.00 H new ATOM 0 HG23 VAL A 838 31.470 -2.850 -27.959 1.00 0.00 H new ATOM 1674 N CYS A 839 32.510 1.390 -30.663 1.00 0.00 N ATOM 1675 CA CYS A 839 32.168 2.536 -31.556 1.00 0.00 C ATOM 1676 C CYS A 839 32.652 2.273 -32.984 1.00 0.00 C ATOM 1677 O CYS A 839 33.764 1.839 -33.207 1.00 0.00 O ATOM 1678 CB CYS A 839 32.894 3.738 -30.955 1.00 0.00 C ATOM 1679 SG CYS A 839 31.760 4.647 -29.878 1.00 0.00 S ATOM 0 H CYS A 839 33.507 1.223 -30.531 1.00 0.00 H new ATOM 0 HA CYS A 839 31.092 2.697 -31.618 1.00 0.00 H new ATOM 0 HB2 CYS A 839 33.764 3.406 -30.388 1.00 0.00 H new ATOM 0 HB3 CYS A 839 33.261 4.389 -31.748 1.00 0.00 H new ATOM 1684 N SER A 840 31.818 2.538 -33.952 1.00 0.00 N ATOM 1685 CA SER A 840 32.214 2.308 -35.371 1.00 0.00 C ATOM 1686 C SER A 840 31.692 3.456 -36.248 1.00 0.00 C ATOM 1687 O SER A 840 31.823 4.615 -35.908 1.00 0.00 O ATOM 1688 CB SER A 840 31.550 0.988 -35.755 1.00 0.00 C ATOM 1689 OG SER A 840 32.221 0.435 -36.882 1.00 0.00 O ATOM 0 H SER A 840 30.876 2.905 -33.821 1.00 0.00 H new ATOM 0 HA SER A 840 33.295 2.270 -35.505 1.00 0.00 H new ATOM 0 HB2 SER A 840 31.587 0.292 -34.917 1.00 0.00 H new ATOM 0 HB3 SER A 840 30.498 1.151 -35.988 1.00 0.00 H new ATOM 0 HG SER A 840 31.798 -0.414 -37.130 1.00 0.00 H new ATOM 1695 N THR A 841 31.099 3.149 -37.373 1.00 0.00 N ATOM 1696 CA THR A 841 30.577 4.231 -38.257 1.00 0.00 C ATOM 1697 C THR A 841 29.073 4.046 -38.489 1.00 0.00 C ATOM 1698 O THR A 841 28.513 3.007 -38.195 1.00 0.00 O ATOM 1699 CB THR A 841 31.342 4.078 -39.572 1.00 0.00 C ATOM 1700 OG1 THR A 841 31.256 2.730 -40.015 1.00 0.00 O ATOM 1701 CG2 THR A 841 32.808 4.456 -39.362 1.00 0.00 C ATOM 0 H THR A 841 30.955 2.199 -37.716 1.00 0.00 H new ATOM 0 HA THR A 841 30.714 5.220 -37.819 1.00 0.00 H new ATOM 0 HB THR A 841 30.906 4.736 -40.323 1.00 0.00 H new ATOM 0 HG1 THR A 841 31.745 2.631 -40.859 1.00 0.00 H new ATOM 0 HG21 THR A 841 33.350 4.346 -40.301 1.00 0.00 H new ATOM 0 HG22 THR A 841 32.872 5.491 -39.025 1.00 0.00 H new ATOM 0 HG23 THR A 841 33.248 3.801 -38.610 1.00 0.00 H new