USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 673 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 817 SER OG : rot 122:sc= 0.158 USER MOD Set 1.2: A 819 SER OG : rot 180:sc= 0.215 USER MOD Set 2.1: A 794 HIS : no HD1:sc= -5.1! C(o=-7.1!,f=-5.5!) USER MOD Set 2.2: A 795 SER OG : rot 170:sc= 0 USER MOD Set 2.3: A 798 SER OG : rot -80:sc= -2.01! USER MOD Set 3.1: A 797 ASN : amide:sc= -0.0118 X(o=-0.012,f=-0.38) USER MOD Set 3.2: A 800 SER OG : rot 160:sc= 0 USER MOD Single : A 729 SER OG : rot -57:sc= 1.17 USER MOD Single : A 736 SER OG : rot 180:sc= 0.066 USER MOD Single : A 757 THR OG1 : rot -43:sc= -0.091 USER MOD Single : A 759 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 761 HIS : no HD1:sc= -0.642 K(o=-0.64,f=-2.6) USER MOD Single : A 763 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 768 GLN : amide:sc= -3.93! C(o=-3.9!,f=-3.4!) USER MOD Single : A 769 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 SER OG : rot 180:sc= 0.0101 USER MOD Single : A 774 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 777 SER OG : rot -9:sc= 1.01 USER MOD Single : A 780 THR OG1 : rot 73:sc= 0.807 USER MOD Single : A 784 THR OG1 : rot 180:sc= 0 USER MOD Single : A 787 THR OG1 : rot -51:sc= 0.417 USER MOD Single : A 789 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 790 GLN : amide:sc= -0.544 K(o=-0.54,f=-1.9!) USER MOD Single : A 799 ASN : amide:sc= -1.84! C(o=-1.8!,f=-4!) USER MOD Single : A 805 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 820 ASN : amide:sc=-0.00921 K(o=-0.0092,f=-0.54) USER MOD Single : A 830 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 831 LYS NZ :NH3+ 158:sc= -0.0543 (180deg=-0.328) USER MOD Single : A 840 SER OG : rot 180:sc= 0 USER MOD Single : A 841 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 39 N VAL A 728 38.059 4.329 -34.768 1.00 0.00 N ATOM 40 CA VAL A 728 37.744 3.950 -33.359 1.00 0.00 C ATOM 41 C VAL A 728 36.814 2.732 -33.337 1.00 0.00 C ATOM 42 O VAL A 728 35.891 2.632 -34.122 1.00 0.00 O ATOM 43 CB VAL A 728 37.046 5.174 -32.769 1.00 0.00 C ATOM 44 CG1 VAL A 728 36.933 5.017 -31.251 1.00 0.00 C ATOM 45 CG2 VAL A 728 37.861 6.429 -33.090 1.00 0.00 C ATOM 0 HA VAL A 728 38.634 3.678 -32.792 1.00 0.00 H new ATOM 0 HB VAL A 728 36.049 5.265 -33.200 1.00 0.00 H new ATOM 0 HG11 VAL A 728 36.435 5.891 -30.831 1.00 0.00 H new ATOM 0 HG12 VAL A 728 36.354 4.123 -31.020 1.00 0.00 H new ATOM 0 HG13 VAL A 728 37.930 4.925 -30.820 1.00 0.00 H new ATOM 0 HG21 VAL A 728 37.364 7.303 -32.669 1.00 0.00 H new ATOM 0 HG22 VAL A 728 38.858 6.336 -32.659 1.00 0.00 H new ATOM 0 HG23 VAL A 728 37.943 6.543 -34.171 1.00 0.00 H new ATOM 55 N SER A 729 37.049 1.806 -32.446 1.00 0.00 N ATOM 56 CA SER A 729 36.174 0.598 -32.382 1.00 0.00 C ATOM 57 C SER A 729 36.296 -0.085 -31.016 1.00 0.00 C ATOM 58 O SER A 729 36.343 -1.296 -30.921 1.00 0.00 O ATOM 59 CB SER A 729 36.693 -0.320 -33.486 1.00 0.00 C ATOM 60 OG SER A 729 35.974 -1.548 -33.455 1.00 0.00 O ATOM 0 H SER A 729 37.805 1.833 -31.762 1.00 0.00 H new ATOM 0 HA SER A 729 35.121 0.847 -32.514 1.00 0.00 H new ATOM 0 HB2 SER A 729 36.575 0.159 -34.458 1.00 0.00 H new ATOM 0 HB3 SER A 729 37.758 -0.506 -33.349 1.00 0.00 H new ATOM 0 HG SER A 729 36.056 -1.953 -32.566 1.00 0.00 H new ATOM 66 N GLY A 730 36.346 0.675 -29.952 1.00 0.00 N ATOM 67 CA GLY A 730 36.464 0.048 -28.605 1.00 0.00 C ATOM 68 C GLY A 730 36.548 1.130 -27.525 1.00 0.00 C ATOM 69 O GLY A 730 37.545 1.813 -27.393 1.00 0.00 O ATOM 0 H GLY A 730 36.310 1.694 -29.959 1.00 0.00 H new ATOM 0 HA2 GLY A 730 35.605 -0.596 -28.419 1.00 0.00 H new ATOM 0 HA3 GLY A 730 37.351 -0.585 -28.566 1.00 0.00 H new ATOM 73 N VAL A 731 35.508 1.288 -26.750 1.00 0.00 N ATOM 74 CA VAL A 731 35.523 2.323 -25.673 1.00 0.00 C ATOM 75 C VAL A 731 35.520 1.635 -24.304 1.00 0.00 C ATOM 76 O VAL A 731 35.232 0.460 -24.196 1.00 0.00 O ATOM 77 CB VAL A 731 34.245 3.137 -25.876 1.00 0.00 C ATOM 78 CG1 VAL A 731 34.226 4.313 -24.899 1.00 0.00 C ATOM 79 CG2 VAL A 731 34.204 3.668 -27.311 1.00 0.00 C ATOM 0 H VAL A 731 34.647 0.745 -26.816 1.00 0.00 H new ATOM 0 HA VAL A 731 36.407 2.959 -25.714 1.00 0.00 H new ATOM 0 HB VAL A 731 33.378 2.502 -25.696 1.00 0.00 H new ATOM 0 HG11 VAL A 731 33.314 4.892 -25.045 1.00 0.00 H new ATOM 0 HG12 VAL A 731 34.257 3.937 -23.876 1.00 0.00 H new ATOM 0 HG13 VAL A 731 35.093 4.949 -25.078 1.00 0.00 H new ATOM 0 HG21 VAL A 731 33.293 4.249 -27.458 1.00 0.00 H new ATOM 0 HG22 VAL A 731 35.072 4.303 -27.489 1.00 0.00 H new ATOM 0 HG23 VAL A 731 34.217 2.831 -28.009 1.00 0.00 H new ATOM 89 N CYS A 732 35.836 2.348 -23.260 1.00 0.00 N ATOM 90 CA CYS A 732 35.847 1.712 -21.909 1.00 0.00 C ATOM 91 C CYS A 732 35.139 2.601 -20.881 1.00 0.00 C ATOM 92 O CYS A 732 34.995 3.794 -21.067 1.00 0.00 O ATOM 93 CB CYS A 732 37.326 1.568 -21.559 1.00 0.00 C ATOM 94 SG CYS A 732 37.632 -0.072 -20.862 1.00 0.00 S ATOM 0 H CYS A 732 36.086 3.337 -23.280 1.00 0.00 H new ATOM 0 HA CYS A 732 35.323 0.756 -21.904 1.00 0.00 H new ATOM 0 HB2 CYS A 732 37.936 1.714 -22.450 1.00 0.00 H new ATOM 0 HB3 CYS A 732 37.617 2.337 -20.844 1.00 0.00 H new ATOM 99 N ALA A 733 34.696 2.024 -19.795 1.00 0.00 N ATOM 100 CA ALA A 733 33.995 2.826 -18.747 1.00 0.00 C ATOM 101 C ALA A 733 33.984 2.057 -17.421 1.00 0.00 C ATOM 102 O ALA A 733 33.678 0.882 -17.379 1.00 0.00 O ATOM 103 CB ALA A 733 32.574 3.010 -19.270 1.00 0.00 C ATOM 0 H ALA A 733 34.789 1.030 -19.587 1.00 0.00 H new ATOM 0 HA ALA A 733 34.484 3.782 -18.560 1.00 0.00 H new ATOM 0 HB1 ALA A 733 31.995 3.592 -18.553 1.00 0.00 H new ATOM 0 HB2 ALA A 733 32.603 3.536 -20.224 1.00 0.00 H new ATOM 0 HB3 ALA A 733 32.108 2.034 -19.407 1.00 0.00 H new ATOM 109 N ASP A 734 34.315 2.708 -16.337 1.00 0.00 N ATOM 110 CA ASP A 734 34.318 2.006 -15.021 1.00 0.00 C ATOM 111 C ASP A 734 33.997 2.990 -13.887 1.00 0.00 C ATOM 112 O ASP A 734 34.778 3.865 -13.571 1.00 0.00 O ATOM 113 CB ASP A 734 35.739 1.458 -14.873 1.00 0.00 C ATOM 114 CG ASP A 734 36.059 0.538 -16.055 1.00 0.00 C ATOM 115 OD1 ASP A 734 36.837 0.945 -16.902 1.00 0.00 O ATOM 116 OD2 ASP A 734 35.521 -0.555 -16.091 1.00 0.00 O ATOM 0 H ASP A 734 34.582 3.692 -16.306 1.00 0.00 H new ATOM 0 HA ASP A 734 33.567 1.217 -14.972 1.00 0.00 H new ATOM 0 HB2 ASP A 734 36.454 2.279 -14.834 1.00 0.00 H new ATOM 0 HB3 ASP A 734 35.832 0.909 -13.936 1.00 0.00 H new ATOM 121 N VAL A 735 32.849 2.850 -13.276 1.00 0.00 N ATOM 122 CA VAL A 735 32.470 3.771 -12.163 1.00 0.00 C ATOM 123 C VAL A 735 31.774 2.981 -11.049 1.00 0.00 C ATOM 124 O VAL A 735 31.334 1.867 -11.250 1.00 0.00 O ATOM 125 CB VAL A 735 31.504 4.773 -12.793 1.00 0.00 C ATOM 126 CG1 VAL A 735 31.138 5.846 -11.769 1.00 0.00 C ATOM 127 CG2 VAL A 735 32.170 5.431 -14.004 1.00 0.00 C ATOM 0 H VAL A 735 32.156 2.136 -13.500 1.00 0.00 H new ATOM 0 HA VAL A 735 33.333 4.265 -11.716 1.00 0.00 H new ATOM 0 HB VAL A 735 30.600 4.253 -13.111 1.00 0.00 H new ATOM 0 HG11 VAL A 735 30.449 6.560 -12.220 1.00 0.00 H new ATOM 0 HG12 VAL A 735 30.663 5.379 -10.906 1.00 0.00 H new ATOM 0 HG13 VAL A 735 32.041 6.366 -11.449 1.00 0.00 H new ATOM 0 HG21 VAL A 735 31.481 6.146 -14.454 1.00 0.00 H new ATOM 0 HG22 VAL A 735 33.074 5.949 -13.685 1.00 0.00 H new ATOM 0 HG23 VAL A 735 32.429 4.667 -14.737 1.00 0.00 H new ATOM 137 N SER A 736 31.672 3.547 -9.875 1.00 0.00 N ATOM 138 CA SER A 736 31.003 2.820 -8.754 1.00 0.00 C ATOM 139 C SER A 736 29.484 2.843 -8.944 1.00 0.00 C ATOM 140 O SER A 736 28.982 3.319 -9.941 1.00 0.00 O ATOM 141 CB SER A 736 31.397 3.583 -7.493 1.00 0.00 C ATOM 142 OG SER A 736 32.661 4.205 -7.696 1.00 0.00 O ATOM 0 H SER A 736 32.021 4.477 -9.644 1.00 0.00 H new ATOM 0 HA SER A 736 31.302 1.773 -8.704 1.00 0.00 H new ATOM 0 HB2 SER A 736 30.643 4.334 -7.258 1.00 0.00 H new ATOM 0 HB3 SER A 736 31.446 2.903 -6.643 1.00 0.00 H new ATOM 0 HG SER A 736 32.917 4.698 -6.888 1.00 0.00 H new ATOM 148 N GLU A 737 28.749 2.333 -7.995 1.00 0.00 N ATOM 149 CA GLU A 737 27.265 2.331 -8.130 1.00 0.00 C ATOM 150 C GLU A 737 26.658 3.497 -7.346 1.00 0.00 C ATOM 151 O GLU A 737 27.325 4.459 -7.027 1.00 0.00 O ATOM 152 CB GLU A 737 26.812 0.996 -7.540 1.00 0.00 C ATOM 153 CG GLU A 737 27.248 0.906 -6.076 1.00 0.00 C ATOM 154 CD GLU A 737 26.013 0.755 -5.182 1.00 0.00 C ATOM 155 OE1 GLU A 737 26.140 0.154 -4.126 1.00 0.00 O ATOM 156 OE2 GLU A 737 24.962 1.242 -5.569 1.00 0.00 O ATOM 0 H GLU A 737 29.110 1.919 -7.135 1.00 0.00 H new ATOM 0 HA GLU A 737 26.948 2.447 -9.166 1.00 0.00 H new ATOM 0 HB2 GLU A 737 25.728 0.904 -7.613 1.00 0.00 H new ATOM 0 HB3 GLU A 737 27.241 0.171 -8.109 1.00 0.00 H new ATOM 0 HG2 GLU A 737 27.917 0.057 -5.936 1.00 0.00 H new ATOM 0 HG3 GLU A 737 27.805 1.800 -5.796 1.00 0.00 H new ATOM 479 N THR A 757 22.937 9.930 -8.657 1.00 0.00 N ATOM 480 CA THR A 757 23.586 8.595 -8.472 1.00 0.00 C ATOM 481 C THR A 757 24.802 8.466 -9.397 1.00 0.00 C ATOM 482 O THR A 757 24.916 9.164 -10.384 1.00 0.00 O ATOM 483 CB THR A 757 22.511 7.578 -8.869 1.00 0.00 C ATOM 484 OG1 THR A 757 22.084 7.838 -10.201 1.00 0.00 O ATOM 485 CG2 THR A 757 21.317 7.691 -7.921 1.00 0.00 C ATOM 0 HA THR A 757 23.940 8.445 -7.452 1.00 0.00 H new ATOM 0 HB THR A 757 22.926 6.572 -8.807 1.00 0.00 H new ATOM 0 HG1 THR A 757 21.962 8.803 -10.323 1.00 0.00 H new ATOM 0 HG21 THR A 757 20.555 6.966 -8.207 1.00 0.00 H new ATOM 0 HG22 THR A 757 21.643 7.491 -6.900 1.00 0.00 H new ATOM 0 HG23 THR A 757 20.901 8.697 -7.979 1.00 0.00 H new ATOM 493 N ALA A 758 25.710 7.580 -9.086 1.00 0.00 N ATOM 494 CA ALA A 758 26.913 7.412 -9.954 1.00 0.00 C ATOM 495 C ALA A 758 26.478 7.039 -11.372 1.00 0.00 C ATOM 496 O ALA A 758 25.814 6.046 -11.583 1.00 0.00 O ATOM 497 CB ALA A 758 27.707 6.271 -9.321 1.00 0.00 C ATOM 0 H ALA A 758 25.672 6.967 -8.272 1.00 0.00 H new ATOM 0 HA ALA A 758 27.505 8.324 -10.025 1.00 0.00 H new ATOM 0 HB1 ALA A 758 28.609 6.088 -9.905 1.00 0.00 H new ATOM 0 HB2 ALA A 758 27.983 6.541 -8.302 1.00 0.00 H new ATOM 0 HB3 ALA A 758 27.096 5.368 -9.304 1.00 0.00 H new ATOM 503 N LYS A 759 26.848 7.822 -12.346 1.00 0.00 N ATOM 504 CA LYS A 759 26.447 7.501 -13.746 1.00 0.00 C ATOM 505 C LYS A 759 27.654 7.039 -14.566 1.00 0.00 C ATOM 506 O LYS A 759 28.791 7.241 -14.190 1.00 0.00 O ATOM 507 CB LYS A 759 25.902 8.815 -14.309 1.00 0.00 C ATOM 508 CG LYS A 759 24.451 9.007 -13.865 1.00 0.00 C ATOM 509 CD LYS A 759 24.129 10.502 -13.809 1.00 0.00 C ATOM 510 CE LYS A 759 22.666 10.725 -14.200 1.00 0.00 C ATOM 511 NZ LYS A 759 22.652 12.037 -14.904 1.00 0.00 N ATOM 0 H LYS A 759 27.408 8.667 -12.235 1.00 0.00 H new ATOM 0 HA LYS A 759 25.715 6.694 -13.783 1.00 0.00 H new ATOM 0 HB2 LYS A 759 26.511 9.650 -13.963 1.00 0.00 H new ATOM 0 HB3 LYS A 759 25.961 8.807 -15.397 1.00 0.00 H new ATOM 0 HG2 LYS A 759 23.777 8.505 -14.559 1.00 0.00 H new ATOM 0 HG3 LYS A 759 24.296 8.554 -12.886 1.00 0.00 H new ATOM 0 HD2 LYS A 759 24.311 10.886 -12.805 1.00 0.00 H new ATOM 0 HD3 LYS A 759 24.785 11.051 -14.484 1.00 0.00 H new ATOM 0 HE2 LYS A 759 22.304 9.926 -14.847 1.00 0.00 H new ATOM 0 HE3 LYS A 759 22.021 10.741 -13.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 759 21.681 12.260 -15.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 759 22.995 12.779 -14.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 759 23.270 11.989 -15.739 1.00 0.00 H new ATOM 525 N VAL A 760 27.407 6.416 -15.686 1.00 0.00 N ATOM 526 CA VAL A 760 28.527 5.937 -16.542 1.00 0.00 C ATOM 527 C VAL A 760 28.619 6.846 -17.766 1.00 0.00 C ATOM 528 O VAL A 760 27.631 7.114 -18.420 1.00 0.00 O ATOM 529 CB VAL A 760 28.145 4.511 -16.941 1.00 0.00 C ATOM 530 CG1 VAL A 760 29.263 3.895 -17.785 1.00 0.00 C ATOM 531 CG2 VAL A 760 27.936 3.670 -15.676 1.00 0.00 C ATOM 0 H VAL A 760 26.473 6.218 -16.046 1.00 0.00 H new ATOM 0 HA VAL A 760 29.495 5.953 -16.041 1.00 0.00 H new ATOM 0 HB VAL A 760 27.224 4.531 -17.524 1.00 0.00 H new ATOM 0 HG11 VAL A 760 28.988 2.879 -18.068 1.00 0.00 H new ATOM 0 HG12 VAL A 760 29.413 4.494 -18.683 1.00 0.00 H new ATOM 0 HG13 VAL A 760 30.186 3.873 -17.206 1.00 0.00 H new ATOM 0 HG21 VAL A 760 27.663 2.653 -15.956 1.00 0.00 H new ATOM 0 HG22 VAL A 760 28.858 3.652 -15.095 1.00 0.00 H new ATOM 0 HG23 VAL A 760 27.138 4.107 -15.076 1.00 0.00 H new ATOM 541 N HIS A 761 29.786 7.326 -18.089 1.00 0.00 N ATOM 542 CA HIS A 761 29.901 8.219 -19.274 1.00 0.00 C ATOM 543 C HIS A 761 30.697 7.576 -20.413 1.00 0.00 C ATOM 544 O HIS A 761 31.893 7.382 -20.328 1.00 0.00 O ATOM 545 CB HIS A 761 30.622 9.460 -18.755 1.00 0.00 C ATOM 546 CG HIS A 761 29.649 10.320 -17.995 1.00 0.00 C ATOM 547 ND1 HIS A 761 28.876 9.818 -16.957 1.00 0.00 N ATOM 548 CD2 HIS A 761 29.308 11.644 -18.109 1.00 0.00 C ATOM 549 CE1 HIS A 761 28.116 10.829 -16.495 1.00 0.00 C ATOM 550 NE2 HIS A 761 28.340 11.964 -17.163 1.00 0.00 N ATOM 0 H HIS A 761 30.656 7.142 -17.590 1.00 0.00 H new ATOM 0 HA HIS A 761 28.920 8.441 -19.695 1.00 0.00 H new ATOM 0 HB2 HIS A 761 31.450 9.170 -18.108 1.00 0.00 H new ATOM 0 HB3 HIS A 761 31.048 10.021 -19.587 1.00 0.00 H new ATOM 0 HD2 HIS A 761 29.728 12.334 -18.826 1.00 0.00 H new ATOM 0 HE1 HIS A 761 27.411 10.734 -15.683 1.00 0.00 H new ATOM 0 HE2 HIS A 761 27.897 12.870 -17.012 1.00 0.00 H new ATOM 558 N LEU A 762 30.023 7.244 -21.477 1.00 0.00 N ATOM 559 CA LEU A 762 30.699 6.616 -22.646 1.00 0.00 C ATOM 560 C LEU A 762 30.445 7.507 -23.854 1.00 0.00 C ATOM 561 O LEU A 762 29.366 7.515 -24.406 1.00 0.00 O ATOM 562 CB LEU A 762 30.030 5.258 -22.831 1.00 0.00 C ATOM 563 CG LEU A 762 30.125 4.459 -21.537 1.00 0.00 C ATOM 564 CD1 LEU A 762 28.726 4.002 -21.123 1.00 0.00 C ATOM 565 CD2 LEU A 762 31.017 3.237 -21.764 1.00 0.00 C ATOM 0 H LEU A 762 29.019 7.383 -21.588 1.00 0.00 H new ATOM 0 HA LEU A 762 31.775 6.498 -22.514 1.00 0.00 H new ATOM 0 HB2 LEU A 762 28.985 5.392 -23.112 1.00 0.00 H new ATOM 0 HB3 LEU A 762 30.511 4.712 -23.643 1.00 0.00 H new ATOM 0 HG LEU A 762 30.552 5.080 -20.750 1.00 0.00 H new ATOM 0 HD11 LEU A 762 28.789 3.430 -20.197 1.00 0.00 H new ATOM 0 HD12 LEU A 762 28.090 4.873 -20.968 1.00 0.00 H new ATOM 0 HD13 LEU A 762 28.300 3.377 -21.908 1.00 0.00 H new ATOM 0 HD21 LEU A 762 31.088 2.662 -20.841 1.00 0.00 H new ATOM 0 HD22 LEU A 762 30.587 2.613 -22.548 1.00 0.00 H new ATOM 0 HD23 LEU A 762 32.012 3.564 -22.065 1.00 0.00 H new ATOM 577 N LYS A 763 31.418 8.249 -24.284 1.00 0.00 N ATOM 578 CA LYS A 763 31.188 9.135 -25.463 1.00 0.00 C ATOM 579 C LYS A 763 32.262 8.965 -26.527 1.00 0.00 C ATOM 580 O LYS A 763 33.397 8.634 -26.248 1.00 0.00 O ATOM 581 CB LYS A 763 31.220 10.563 -24.902 1.00 0.00 C ATOM 582 CG LYS A 763 32.539 10.805 -24.151 1.00 0.00 C ATOM 583 CD LYS A 763 33.508 11.577 -25.050 1.00 0.00 C ATOM 584 CE LYS A 763 34.207 12.667 -24.230 1.00 0.00 C ATOM 585 NZ LYS A 763 34.062 13.910 -25.038 1.00 0.00 N ATOM 0 H LYS A 763 32.354 8.285 -23.880 1.00 0.00 H new ATOM 0 HA LYS A 763 30.244 8.894 -25.952 1.00 0.00 H new ATOM 0 HB2 LYS A 763 31.117 11.283 -25.713 1.00 0.00 H new ATOM 0 HB3 LYS A 763 30.376 10.717 -24.230 1.00 0.00 H new ATOM 0 HG2 LYS A 763 32.350 11.366 -23.236 1.00 0.00 H new ATOM 0 HG3 LYS A 763 32.981 9.853 -23.856 1.00 0.00 H new ATOM 0 HD2 LYS A 763 34.246 10.897 -25.475 1.00 0.00 H new ATOM 0 HD3 LYS A 763 32.968 12.025 -25.885 1.00 0.00 H new ATOM 0 HE2 LYS A 763 33.747 12.779 -23.248 1.00 0.00 H new ATOM 0 HE3 LYS A 763 35.257 12.424 -24.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 763 34.517 14.702 -24.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 763 34.515 13.777 -25.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 763 33.053 14.120 -25.174 1.00 0.00 H new ATOM 599 N CYS A 764 31.894 9.195 -27.755 1.00 0.00 N ATOM 600 CA CYS A 764 32.863 9.062 -28.877 1.00 0.00 C ATOM 601 C CYS A 764 32.895 10.370 -29.672 1.00 0.00 C ATOM 602 O CYS A 764 32.019 11.202 -29.544 1.00 0.00 O ATOM 603 CB CYS A 764 32.323 7.922 -29.744 1.00 0.00 C ATOM 604 SG CYS A 764 31.885 6.516 -28.690 1.00 0.00 S ATOM 0 H CYS A 764 30.953 9.473 -28.032 1.00 0.00 H new ATOM 0 HA CYS A 764 33.877 8.857 -28.535 1.00 0.00 H new ATOM 0 HB2 CYS A 764 31.449 8.258 -30.302 1.00 0.00 H new ATOM 0 HB3 CYS A 764 33.072 7.622 -30.476 1.00 0.00 H new ATOM 609 N ALA A 765 33.892 10.566 -30.486 1.00 0.00 N ATOM 610 CA ALA A 765 33.960 11.827 -31.279 1.00 0.00 C ATOM 611 C ALA A 765 32.583 12.156 -31.861 1.00 0.00 C ATOM 612 O ALA A 765 31.768 11.278 -32.060 1.00 0.00 O ATOM 613 CB ALA A 765 34.960 11.542 -32.397 1.00 0.00 C ATOM 0 H ALA A 765 34.660 9.912 -30.638 1.00 0.00 H new ATOM 0 HA ALA A 765 34.263 12.681 -30.673 1.00 0.00 H new ATOM 0 HB1 ALA A 765 35.065 12.426 -33.026 1.00 0.00 H new ATOM 0 HB2 ALA A 765 35.928 11.288 -31.964 1.00 0.00 H new ATOM 0 HB3 ALA A 765 34.603 10.708 -33.001 1.00 0.00 H new ATOM 619 N PRO A 766 32.371 13.418 -32.112 1.00 0.00 N ATOM 620 CA PRO A 766 31.080 13.872 -32.676 1.00 0.00 C ATOM 621 C PRO A 766 30.943 13.397 -34.124 1.00 0.00 C ATOM 622 O PRO A 766 31.482 13.990 -35.038 1.00 0.00 O ATOM 623 CB PRO A 766 31.168 15.391 -32.604 1.00 0.00 C ATOM 624 CG PRO A 766 32.635 15.690 -32.596 1.00 0.00 C ATOM 625 CD PRO A 766 33.306 14.525 -31.908 1.00 0.00 C ATOM 0 HA PRO A 766 30.214 13.480 -32.142 1.00 0.00 H new ATOM 0 HB2 PRO A 766 30.674 15.857 -33.457 1.00 0.00 H new ATOM 0 HB3 PRO A 766 30.682 15.773 -31.707 1.00 0.00 H new ATOM 0 HG2 PRO A 766 33.012 15.810 -33.612 1.00 0.00 H new ATOM 0 HG3 PRO A 766 32.838 16.622 -32.068 1.00 0.00 H new ATOM 0 HD2 PRO A 766 34.282 14.311 -32.343 1.00 0.00 H new ATOM 0 HD3 PRO A 766 33.467 14.724 -30.848 1.00 0.00 H new ATOM 633 N GLY A 767 30.226 12.332 -34.335 1.00 0.00 N ATOM 634 CA GLY A 767 30.049 11.812 -35.718 1.00 0.00 C ATOM 635 C GLY A 767 30.000 10.287 -35.673 1.00 0.00 C ATOM 636 O GLY A 767 29.348 9.651 -36.477 1.00 0.00 O ATOM 0 H GLY A 767 29.753 11.797 -33.607 1.00 0.00 H new ATOM 0 HA2 GLY A 767 29.131 12.206 -36.153 1.00 0.00 H new ATOM 0 HA3 GLY A 767 30.870 12.144 -36.353 1.00 0.00 H new ATOM 640 N GLN A 768 30.686 9.695 -34.731 1.00 0.00 N ATOM 641 CA GLN A 768 30.683 8.208 -34.625 1.00 0.00 C ATOM 642 C GLN A 768 29.479 7.748 -33.803 1.00 0.00 C ATOM 643 O GLN A 768 28.941 8.490 -33.005 1.00 0.00 O ATOM 644 CB GLN A 768 31.984 7.859 -33.902 1.00 0.00 C ATOM 645 CG GLN A 768 33.157 7.947 -34.879 1.00 0.00 C ATOM 646 CD GLN A 768 34.312 8.702 -34.225 1.00 0.00 C ATOM 647 OE1 GLN A 768 34.703 8.399 -33.115 1.00 0.00 O ATOM 648 NE2 GLN A 768 34.881 9.681 -34.871 1.00 0.00 N ATOM 0 H GLN A 768 31.248 10.178 -34.030 1.00 0.00 H new ATOM 0 HA GLN A 768 30.615 7.723 -35.599 1.00 0.00 H new ATOM 0 HB2 GLN A 768 32.142 8.542 -33.067 1.00 0.00 H new ATOM 0 HB3 GLN A 768 31.921 6.854 -33.484 1.00 0.00 H new ATOM 0 HG2 GLN A 768 33.480 6.946 -35.167 1.00 0.00 H new ATOM 0 HG3 GLN A 768 32.846 8.456 -35.791 1.00 0.00 H new ATOM 0 HE21 GLN A 768 34.553 9.936 -35.803 1.00 0.00 H new ATOM 0 HE22 GLN A 768 35.654 10.192 -34.445 1.00 0.00 H new ATOM 657 N THR A 769 29.054 6.531 -33.985 1.00 0.00 N ATOM 658 CA THR A 769 27.884 6.033 -33.210 1.00 0.00 C ATOM 659 C THR A 769 28.134 4.604 -32.733 1.00 0.00 C ATOM 660 O THR A 769 28.772 3.818 -33.404 1.00 0.00 O ATOM 661 CB THR A 769 26.712 6.066 -34.190 1.00 0.00 C ATOM 662 OG1 THR A 769 27.091 5.429 -35.402 1.00 0.00 O ATOM 663 CG2 THR A 769 26.320 7.514 -34.475 1.00 0.00 C ATOM 0 H THR A 769 29.464 5.860 -34.635 1.00 0.00 H new ATOM 0 HA THR A 769 27.694 6.638 -32.324 1.00 0.00 H new ATOM 0 HB THR A 769 25.861 5.542 -33.754 1.00 0.00 H new ATOM 0 HG1 THR A 769 26.339 5.448 -36.031 1.00 0.00 H new ATOM 0 HG21 THR A 769 25.484 7.534 -35.174 1.00 0.00 H new ATOM 0 HG22 THR A 769 26.027 8.001 -33.545 1.00 0.00 H new ATOM 0 HG23 THR A 769 27.169 8.042 -34.909 1.00 0.00 H new ATOM 671 N ILE A 770 27.639 4.262 -31.578 1.00 0.00 N ATOM 672 CA ILE A 770 27.849 2.882 -31.060 1.00 0.00 C ATOM 673 C ILE A 770 27.064 1.896 -31.924 1.00 0.00 C ATOM 674 O ILE A 770 25.878 2.049 -32.133 1.00 0.00 O ATOM 675 CB ILE A 770 27.310 2.907 -29.634 1.00 0.00 C ATOM 676 CG1 ILE A 770 28.143 3.878 -28.795 1.00 0.00 C ATOM 677 CG2 ILE A 770 27.401 1.506 -29.030 1.00 0.00 C ATOM 678 CD1 ILE A 770 27.371 4.249 -27.530 1.00 0.00 C ATOM 0 H ILE A 770 27.098 4.877 -30.970 1.00 0.00 H new ATOM 0 HA ILE A 770 28.894 2.573 -31.083 1.00 0.00 H new ATOM 0 HB ILE A 770 26.269 3.231 -29.643 1.00 0.00 H new ATOM 0 HG12 ILE A 770 29.097 3.421 -28.531 1.00 0.00 H new ATOM 0 HG13 ILE A 770 28.368 4.774 -29.373 1.00 0.00 H new ATOM 0 HG21 ILE A 770 27.016 1.524 -28.011 1.00 0.00 H new ATOM 0 HG22 ILE A 770 26.811 0.812 -29.629 1.00 0.00 H new ATOM 0 HG23 ILE A 770 28.441 1.181 -29.019 1.00 0.00 H new ATOM 0 HD11 ILE A 770 27.964 4.941 -26.932 1.00 0.00 H new ATOM 0 HD12 ILE A 770 26.428 4.723 -27.805 1.00 0.00 H new ATOM 0 HD13 ILE A 770 27.169 3.349 -26.950 1.00 0.00 H new ATOM 690 N SER A 771 27.712 0.884 -32.424 1.00 0.00 N ATOM 691 CA SER A 771 26.992 -0.104 -33.275 1.00 0.00 C ATOM 692 C SER A 771 26.704 -1.398 -32.508 1.00 0.00 C ATOM 693 O SER A 771 25.987 -2.256 -32.985 1.00 0.00 O ATOM 694 CB SER A 771 27.939 -0.378 -34.438 1.00 0.00 C ATOM 695 OG SER A 771 29.256 -0.578 -33.935 1.00 0.00 O ATOM 0 H SER A 771 28.705 0.697 -32.282 1.00 0.00 H new ATOM 0 HA SER A 771 26.025 0.277 -33.602 1.00 0.00 H new ATOM 0 HB2 SER A 771 27.610 -1.259 -34.990 1.00 0.00 H new ATOM 0 HB3 SER A 771 27.927 0.459 -35.137 1.00 0.00 H new ATOM 0 HG SER A 771 29.867 -0.756 -34.680 1.00 0.00 H new ATOM 701 N ALA A 772 27.245 -1.559 -31.327 1.00 0.00 N ATOM 702 CA ALA A 772 26.969 -2.820 -30.573 1.00 0.00 C ATOM 703 C ALA A 772 27.637 -2.817 -29.197 1.00 0.00 C ATOM 704 O ALA A 772 28.664 -2.202 -28.991 1.00 0.00 O ATOM 705 CB ALA A 772 27.575 -3.922 -31.436 1.00 0.00 C ATOM 0 H ALA A 772 27.854 -0.887 -30.859 1.00 0.00 H new ATOM 0 HA ALA A 772 25.902 -2.949 -30.394 1.00 0.00 H new ATOM 0 HB1 ALA A 772 27.418 -4.888 -30.956 1.00 0.00 H new ATOM 0 HB2 ALA A 772 27.097 -3.922 -32.415 1.00 0.00 H new ATOM 0 HB3 ALA A 772 28.644 -3.745 -31.554 1.00 0.00 H new ATOM 711 N ILE A 773 27.053 -3.508 -28.253 1.00 0.00 N ATOM 712 CA ILE A 773 27.640 -3.562 -26.886 1.00 0.00 C ATOM 713 C ILE A 773 28.402 -4.882 -26.732 1.00 0.00 C ATOM 714 O ILE A 773 27.975 -5.910 -27.220 1.00 0.00 O ATOM 715 CB ILE A 773 26.445 -3.497 -25.931 1.00 0.00 C ATOM 716 CG1 ILE A 773 25.672 -2.196 -26.173 1.00 0.00 C ATOM 717 CG2 ILE A 773 26.943 -3.529 -24.486 1.00 0.00 C ATOM 718 CD1 ILE A 773 26.531 -1.002 -25.750 1.00 0.00 C ATOM 0 H ILE A 773 26.190 -4.039 -28.373 1.00 0.00 H new ATOM 0 HA ILE A 773 28.341 -2.752 -26.685 1.00 0.00 H new ATOM 0 HB ILE A 773 25.791 -4.351 -26.109 1.00 0.00 H new ATOM 0 HG12 ILE A 773 25.406 -2.110 -27.226 1.00 0.00 H new ATOM 0 HG13 ILE A 773 24.740 -2.205 -25.608 1.00 0.00 H new ATOM 0 HG21 ILE A 773 26.092 -3.483 -23.807 1.00 0.00 H new ATOM 0 HG22 ILE A 773 27.496 -4.452 -24.312 1.00 0.00 H new ATOM 0 HG23 ILE A 773 27.597 -2.675 -24.307 1.00 0.00 H new ATOM 0 HD11 ILE A 773 25.980 -0.078 -25.923 1.00 0.00 H new ATOM 0 HD12 ILE A 773 26.775 -1.086 -24.691 1.00 0.00 H new ATOM 0 HD13 ILE A 773 27.451 -0.990 -26.334 1.00 0.00 H new ATOM 730 N LYS A 774 29.521 -4.874 -26.066 1.00 0.00 N ATOM 731 CA LYS A 774 30.288 -6.144 -25.903 1.00 0.00 C ATOM 732 C LYS A 774 30.226 -6.664 -24.461 1.00 0.00 C ATOM 733 O LYS A 774 30.391 -7.843 -24.220 1.00 0.00 O ATOM 734 CB LYS A 774 31.724 -5.782 -26.278 1.00 0.00 C ATOM 735 CG LYS A 774 31.796 -5.464 -27.773 1.00 0.00 C ATOM 736 CD LYS A 774 31.740 -6.764 -28.580 1.00 0.00 C ATOM 737 CE LYS A 774 33.117 -7.049 -29.188 1.00 0.00 C ATOM 738 NZ LYS A 774 32.844 -7.405 -30.607 1.00 0.00 N ATOM 0 H LYS A 774 29.937 -4.051 -25.630 1.00 0.00 H new ATOM 0 HA LYS A 774 29.878 -6.940 -26.525 1.00 0.00 H new ATOM 0 HB2 LYS A 774 32.058 -4.923 -25.696 1.00 0.00 H new ATOM 0 HB3 LYS A 774 32.393 -6.608 -26.038 1.00 0.00 H new ATOM 0 HG2 LYS A 774 30.969 -4.813 -28.056 1.00 0.00 H new ATOM 0 HG3 LYS A 774 32.717 -4.925 -27.996 1.00 0.00 H new ATOM 0 HD2 LYS A 774 31.437 -7.590 -27.937 1.00 0.00 H new ATOM 0 HD3 LYS A 774 30.992 -6.683 -29.369 1.00 0.00 H new ATOM 0 HE2 LYS A 774 33.768 -6.177 -29.118 1.00 0.00 H new ATOM 0 HE3 LYS A 774 33.618 -7.864 -28.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 774 33.740 -7.614 -31.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 774 32.228 -8.242 -30.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 774 32.373 -6.608 -31.080 1.00 0.00 H new ATOM 752 N PHE A 775 29.990 -5.813 -23.499 1.00 0.00 N ATOM 753 CA PHE A 775 29.931 -6.310 -22.090 1.00 0.00 C ATOM 754 C PHE A 775 29.073 -5.396 -21.207 1.00 0.00 C ATOM 755 O PHE A 775 28.809 -4.256 -21.535 1.00 0.00 O ATOM 756 CB PHE A 775 31.382 -6.301 -21.613 1.00 0.00 C ATOM 757 CG PHE A 775 31.458 -6.876 -20.218 1.00 0.00 C ATOM 758 CD1 PHE A 775 31.428 -8.264 -20.031 1.00 0.00 C ATOM 759 CD2 PHE A 775 31.556 -6.023 -19.114 1.00 0.00 C ATOM 760 CE1 PHE A 775 31.496 -8.797 -18.739 1.00 0.00 C ATOM 761 CE2 PHE A 775 31.624 -6.556 -17.821 1.00 0.00 C ATOM 762 CZ PHE A 775 31.594 -7.942 -17.633 1.00 0.00 C ATOM 0 H PHE A 775 29.838 -4.812 -23.621 1.00 0.00 H new ATOM 0 HA PHE A 775 29.476 -7.299 -22.033 1.00 0.00 H new ATOM 0 HB2 PHE A 775 32.003 -6.885 -22.293 1.00 0.00 H new ATOM 0 HB3 PHE A 775 31.772 -5.283 -21.620 1.00 0.00 H new ATOM 0 HD1 PHE A 775 31.352 -8.922 -20.884 1.00 0.00 H new ATOM 0 HD2 PHE A 775 31.579 -4.953 -19.259 1.00 0.00 H new ATOM 0 HE1 PHE A 775 31.473 -9.867 -18.594 1.00 0.00 H new ATOM 0 HE2 PHE A 775 31.700 -5.897 -16.969 1.00 0.00 H new ATOM 0 HZ PHE A 775 31.646 -8.353 -16.636 1.00 0.00 H new ATOM 772 N ALA A 776 28.641 -5.903 -20.083 1.00 0.00 N ATOM 773 CA ALA A 776 27.800 -5.095 -19.154 1.00 0.00 C ATOM 774 C ALA A 776 27.412 -5.949 -17.942 1.00 0.00 C ATOM 775 O ALA A 776 26.652 -6.889 -18.055 1.00 0.00 O ATOM 776 CB ALA A 776 26.561 -4.712 -19.960 1.00 0.00 C ATOM 0 H ALA A 776 28.837 -6.852 -19.766 1.00 0.00 H new ATOM 0 HA ALA A 776 28.320 -4.213 -18.780 1.00 0.00 H new ATOM 0 HB1 ALA A 776 25.894 -4.114 -19.339 1.00 0.00 H new ATOM 0 HB2 ALA A 776 26.860 -4.133 -20.834 1.00 0.00 H new ATOM 0 HB3 ALA A 776 26.044 -5.615 -20.283 1.00 0.00 H new ATOM 782 N SER A 777 27.930 -5.637 -16.786 1.00 0.00 N ATOM 783 CA SER A 777 27.581 -6.441 -15.580 1.00 0.00 C ATOM 784 C SER A 777 27.504 -5.547 -14.337 1.00 0.00 C ATOM 785 O SER A 777 28.492 -4.998 -13.891 1.00 0.00 O ATOM 786 CB SER A 777 28.718 -7.450 -15.445 1.00 0.00 C ATOM 787 OG SER A 777 29.868 -6.795 -14.923 1.00 0.00 O ATOM 0 H SER A 777 28.576 -4.865 -16.624 1.00 0.00 H new ATOM 0 HA SER A 777 26.608 -6.924 -15.675 1.00 0.00 H new ATOM 0 HB2 SER A 777 28.420 -8.266 -14.786 1.00 0.00 H new ATOM 0 HB3 SER A 777 28.946 -7.891 -16.416 1.00 0.00 H new ATOM 0 HG SER A 777 29.712 -5.828 -14.900 1.00 0.00 H new ATOM 793 N PHE A 778 26.333 -5.399 -13.775 1.00 0.00 N ATOM 794 CA PHE A 778 26.189 -4.543 -12.561 1.00 0.00 C ATOM 795 C PHE A 778 26.364 -5.390 -11.298 1.00 0.00 C ATOM 796 O PHE A 778 25.404 -5.759 -10.649 1.00 0.00 O ATOM 797 CB PHE A 778 24.768 -3.985 -12.634 1.00 0.00 C ATOM 798 CG PHE A 778 24.402 -3.364 -11.306 1.00 0.00 C ATOM 799 CD1 PHE A 778 23.171 -3.663 -10.708 1.00 0.00 C ATOM 800 CD2 PHE A 778 25.293 -2.488 -10.674 1.00 0.00 C ATOM 801 CE1 PHE A 778 22.831 -3.084 -9.479 1.00 0.00 C ATOM 802 CE2 PHE A 778 24.954 -1.910 -9.445 1.00 0.00 C ATOM 803 CZ PHE A 778 23.723 -2.208 -8.848 1.00 0.00 C ATOM 0 H PHE A 778 25.471 -5.834 -14.104 1.00 0.00 H new ATOM 0 HA PHE A 778 26.937 -3.751 -12.523 1.00 0.00 H new ATOM 0 HB2 PHE A 778 24.698 -3.241 -13.427 1.00 0.00 H new ATOM 0 HB3 PHE A 778 24.066 -4.781 -12.881 1.00 0.00 H new ATOM 0 HD1 PHE A 778 22.484 -4.340 -11.195 1.00 0.00 H new ATOM 0 HD2 PHE A 778 26.242 -2.258 -11.135 1.00 0.00 H new ATOM 0 HE1 PHE A 778 21.881 -3.313 -9.018 1.00 0.00 H new ATOM 0 HE2 PHE A 778 25.642 -1.235 -8.958 1.00 0.00 H new ATOM 0 HZ PHE A 778 23.461 -1.762 -7.900 1.00 0.00 H new ATOM 813 N GLY A 779 27.581 -5.706 -10.942 1.00 0.00 N ATOM 814 CA GLY A 779 27.806 -6.530 -9.721 1.00 0.00 C ATOM 815 C GLY A 779 29.277 -6.456 -9.309 1.00 0.00 C ATOM 816 O GLY A 779 29.817 -5.390 -9.084 1.00 0.00 O ATOM 0 H GLY A 779 28.426 -5.430 -11.443 1.00 0.00 H new ATOM 0 HA2 GLY A 779 27.173 -6.173 -8.909 1.00 0.00 H new ATOM 0 HA3 GLY A 779 27.524 -7.565 -9.913 1.00 0.00 H new ATOM 820 N THR A 780 29.930 -7.582 -9.211 1.00 0.00 N ATOM 821 CA THR A 780 31.369 -7.584 -8.814 1.00 0.00 C ATOM 822 C THR A 780 32.225 -8.224 -9.912 1.00 0.00 C ATOM 823 O THR A 780 32.614 -9.370 -9.807 1.00 0.00 O ATOM 824 CB THR A 780 31.424 -8.425 -7.539 1.00 0.00 C ATOM 825 OG1 THR A 780 31.201 -9.790 -7.868 1.00 0.00 O ATOM 826 CG2 THR A 780 30.347 -7.953 -6.559 1.00 0.00 C ATOM 0 H THR A 780 29.529 -8.503 -9.389 1.00 0.00 H new ATOM 0 HA THR A 780 31.754 -6.576 -8.659 1.00 0.00 H new ATOM 0 HB THR A 780 32.404 -8.314 -7.074 1.00 0.00 H new ATOM 0 HG1 THR A 780 31.991 -10.150 -8.324 1.00 0.00 H new ATOM 0 HG21 THR A 780 30.391 -8.556 -5.652 1.00 0.00 H new ATOM 0 HG22 THR A 780 30.518 -6.906 -6.307 1.00 0.00 H new ATOM 0 HG23 THR A 780 29.365 -8.060 -7.019 1.00 0.00 H new ATOM 834 N PRO A 781 32.486 -7.457 -10.934 1.00 0.00 N ATOM 835 CA PRO A 781 33.300 -7.948 -12.064 1.00 0.00 C ATOM 836 C PRO A 781 34.793 -7.901 -11.713 1.00 0.00 C ATOM 837 O PRO A 781 35.182 -7.432 -10.662 1.00 0.00 O ATOM 838 CB PRO A 781 32.983 -6.972 -13.186 1.00 0.00 C ATOM 839 CG PRO A 781 32.551 -5.705 -12.502 1.00 0.00 C ATOM 840 CD PRO A 781 32.036 -6.080 -11.126 1.00 0.00 C ATOM 0 HA PRO A 781 33.080 -8.983 -12.328 1.00 0.00 H new ATOM 0 HB2 PRO A 781 33.856 -6.801 -13.816 1.00 0.00 H new ATOM 0 HB3 PRO A 781 32.195 -7.358 -13.832 1.00 0.00 H new ATOM 0 HG2 PRO A 781 33.386 -5.009 -12.422 1.00 0.00 H new ATOM 0 HG3 PRO A 781 31.773 -5.204 -13.079 1.00 0.00 H new ATOM 0 HD2 PRO A 781 32.438 -5.420 -10.358 1.00 0.00 H new ATOM 0 HD3 PRO A 781 30.950 -6.006 -11.074 1.00 0.00 H new ATOM 848 N LEU A 782 35.629 -8.387 -12.589 1.00 0.00 N ATOM 849 CA LEU A 782 37.096 -8.374 -12.316 1.00 0.00 C ATOM 850 C LEU A 782 37.869 -8.103 -13.612 1.00 0.00 C ATOM 851 O LEU A 782 37.583 -8.673 -14.646 1.00 0.00 O ATOM 852 CB LEU A 782 37.417 -9.771 -11.788 1.00 0.00 C ATOM 853 CG LEU A 782 37.612 -9.711 -10.273 1.00 0.00 C ATOM 854 CD1 LEU A 782 37.700 -11.131 -9.715 1.00 0.00 C ATOM 855 CD2 LEU A 782 38.907 -8.958 -9.955 1.00 0.00 C ATOM 0 H LEU A 782 35.360 -8.794 -13.485 1.00 0.00 H new ATOM 0 HA LEU A 782 37.376 -7.597 -11.605 1.00 0.00 H new ATOM 0 HB2 LEU A 782 36.608 -10.459 -12.034 1.00 0.00 H new ATOM 0 HB3 LEU A 782 38.318 -10.154 -12.267 1.00 0.00 H new ATOM 0 HG LEU A 782 36.768 -9.192 -9.818 1.00 0.00 H new ATOM 0 HD11 LEU A 782 37.839 -11.089 -8.635 1.00 0.00 H new ATOM 0 HD12 LEU A 782 36.779 -11.669 -9.942 1.00 0.00 H new ATOM 0 HD13 LEU A 782 38.544 -11.649 -10.170 1.00 0.00 H new ATOM 0 HD21 LEU A 782 39.047 -8.915 -8.875 1.00 0.00 H new ATOM 0 HD22 LEU A 782 39.751 -9.477 -10.410 1.00 0.00 H new ATOM 0 HD23 LEU A 782 38.846 -7.945 -10.354 1.00 0.00 H new ATOM 867 N GLY A 783 38.843 -7.238 -13.563 1.00 0.00 N ATOM 868 CA GLY A 783 39.630 -6.932 -14.792 1.00 0.00 C ATOM 869 C GLY A 783 40.011 -5.451 -14.801 1.00 0.00 C ATOM 870 O GLY A 783 39.765 -4.731 -13.854 1.00 0.00 O ATOM 0 H GLY A 783 39.129 -6.730 -12.726 1.00 0.00 H new ATOM 0 HA2 GLY A 783 40.528 -7.549 -14.824 1.00 0.00 H new ATOM 0 HA3 GLY A 783 39.045 -7.173 -15.680 1.00 0.00 H new ATOM 874 N THR A 784 40.611 -4.989 -15.864 1.00 0.00 N ATOM 875 CA THR A 784 41.007 -3.550 -15.930 1.00 0.00 C ATOM 876 C THR A 784 40.876 -3.028 -17.368 1.00 0.00 C ATOM 877 O THR A 784 41.853 -2.702 -18.010 1.00 0.00 O ATOM 878 CB THR A 784 42.472 -3.516 -15.477 1.00 0.00 C ATOM 879 OG1 THR A 784 42.946 -4.845 -15.291 1.00 0.00 O ATOM 880 CG2 THR A 784 42.584 -2.745 -14.162 1.00 0.00 C ATOM 0 H THR A 784 40.844 -5.543 -16.688 1.00 0.00 H new ATOM 0 HA THR A 784 40.374 -2.921 -15.305 1.00 0.00 H new ATOM 0 HB THR A 784 43.073 -3.021 -16.239 1.00 0.00 H new ATOM 0 HG1 THR A 784 43.883 -4.821 -15.003 1.00 0.00 H new ATOM 0 HG21 THR A 784 43.626 -2.722 -13.841 1.00 0.00 H new ATOM 0 HG22 THR A 784 42.226 -1.726 -14.306 1.00 0.00 H new ATOM 0 HG23 THR A 784 41.981 -3.237 -13.399 1.00 0.00 H new ATOM 888 N CYS A 785 39.675 -2.948 -17.873 1.00 0.00 N ATOM 889 CA CYS A 785 39.482 -2.448 -19.265 1.00 0.00 C ATOM 890 C CYS A 785 40.278 -3.305 -20.254 1.00 0.00 C ATOM 891 O CYS A 785 41.493 -3.331 -20.231 1.00 0.00 O ATOM 892 CB CYS A 785 40.013 -1.017 -19.250 1.00 0.00 C ATOM 893 SG CYS A 785 39.647 -0.223 -20.836 1.00 0.00 S ATOM 0 H CYS A 785 38.819 -3.207 -17.382 1.00 0.00 H new ATOM 0 HA CYS A 785 38.438 -2.493 -19.576 1.00 0.00 H new ATOM 0 HB2 CYS A 785 39.555 -0.456 -18.436 1.00 0.00 H new ATOM 0 HB3 CYS A 785 41.088 -1.018 -19.071 1.00 0.00 H new ATOM 898 N GLY A 786 39.600 -4.004 -21.122 1.00 0.00 N ATOM 899 CA GLY A 786 40.314 -4.859 -22.110 1.00 0.00 C ATOM 900 C GLY A 786 40.097 -6.330 -21.764 1.00 0.00 C ATOM 901 O GLY A 786 40.299 -7.206 -22.581 1.00 0.00 O ATOM 0 H GLY A 786 38.582 -4.020 -21.189 1.00 0.00 H new ATOM 0 HA2 GLY A 786 39.948 -4.654 -23.116 1.00 0.00 H new ATOM 0 HA3 GLY A 786 41.379 -4.627 -22.105 1.00 0.00 H new ATOM 905 N THR A 787 39.683 -6.613 -20.558 1.00 0.00 N ATOM 906 CA THR A 787 39.455 -8.033 -20.167 1.00 0.00 C ATOM 907 C THR A 787 38.505 -8.113 -18.966 1.00 0.00 C ATOM 908 O THR A 787 38.768 -8.803 -18.002 1.00 0.00 O ATOM 909 CB THR A 787 40.839 -8.571 -19.794 1.00 0.00 C ATOM 910 OG1 THR A 787 40.745 -9.962 -19.525 1.00 0.00 O ATOM 911 CG2 THR A 787 41.360 -7.842 -18.554 1.00 0.00 C ATOM 0 H THR A 787 39.494 -5.925 -19.829 1.00 0.00 H new ATOM 0 HA THR A 787 38.996 -8.610 -20.970 1.00 0.00 H new ATOM 0 HB THR A 787 41.528 -8.405 -20.622 1.00 0.00 H new ATOM 0 HG1 THR A 787 40.020 -10.123 -18.885 1.00 0.00 H new ATOM 0 HG21 THR A 787 42.345 -8.228 -18.292 1.00 0.00 H new ATOM 0 HG22 THR A 787 41.432 -6.775 -18.763 1.00 0.00 H new ATOM 0 HG23 THR A 787 40.674 -8.003 -17.722 1.00 0.00 H new ATOM 919 N PHE A 788 37.402 -7.416 -19.016 1.00 0.00 N ATOM 920 CA PHE A 788 36.443 -7.459 -17.872 1.00 0.00 C ATOM 921 C PHE A 788 35.988 -8.901 -17.624 1.00 0.00 C ATOM 922 O PHE A 788 35.917 -9.704 -18.533 1.00 0.00 O ATOM 923 CB PHE A 788 35.264 -6.591 -18.306 1.00 0.00 C ATOM 924 CG PHE A 788 35.658 -5.135 -18.223 1.00 0.00 C ATOM 925 CD1 PHE A 788 36.012 -4.577 -16.989 1.00 0.00 C ATOM 926 CD2 PHE A 788 35.673 -4.345 -19.379 1.00 0.00 C ATOM 927 CE1 PHE A 788 36.381 -3.228 -16.911 1.00 0.00 C ATOM 928 CE2 PHE A 788 36.041 -2.996 -19.301 1.00 0.00 C ATOM 929 CZ PHE A 788 36.394 -2.439 -18.066 1.00 0.00 C ATOM 0 H PHE A 788 37.123 -6.821 -19.796 1.00 0.00 H new ATOM 0 HA PHE A 788 36.889 -7.100 -16.944 1.00 0.00 H new ATOM 0 HB2 PHE A 788 34.969 -6.842 -19.325 1.00 0.00 H new ATOM 0 HB3 PHE A 788 34.402 -6.783 -17.667 1.00 0.00 H new ATOM 0 HD1 PHE A 788 36.001 -5.186 -16.097 1.00 0.00 H new ATOM 0 HD2 PHE A 788 35.401 -4.776 -20.331 1.00 0.00 H new ATOM 0 HE1 PHE A 788 36.655 -2.797 -15.959 1.00 0.00 H new ATOM 0 HE2 PHE A 788 36.052 -2.386 -20.192 1.00 0.00 H new ATOM 0 HZ PHE A 788 36.677 -1.398 -18.005 1.00 0.00 H new ATOM 939 N GLN A 789 35.679 -9.236 -16.402 1.00 0.00 N ATOM 940 CA GLN A 789 35.231 -10.627 -16.106 1.00 0.00 C ATOM 941 C GLN A 789 34.021 -10.610 -15.167 1.00 0.00 C ATOM 942 O GLN A 789 33.738 -9.624 -14.518 1.00 0.00 O ATOM 943 CB GLN A 789 36.430 -11.292 -15.428 1.00 0.00 C ATOM 944 CG GLN A 789 36.168 -12.790 -15.281 1.00 0.00 C ATOM 945 CD GLN A 789 37.412 -13.569 -15.705 1.00 0.00 C ATOM 946 OE1 GLN A 789 38.164 -14.037 -14.873 1.00 0.00 O ATOM 947 NE2 GLN A 789 37.666 -13.728 -16.975 1.00 0.00 N ATOM 0 H GLN A 789 35.717 -8.610 -15.598 1.00 0.00 H new ATOM 0 HA GLN A 789 34.922 -11.161 -17.005 1.00 0.00 H new ATOM 0 HB2 GLN A 789 37.332 -11.126 -16.017 1.00 0.00 H new ATOM 0 HB3 GLN A 789 36.602 -10.845 -14.449 1.00 0.00 H new ATOM 0 HG2 GLN A 789 35.913 -13.026 -14.248 1.00 0.00 H new ATOM 0 HG3 GLN A 789 35.316 -13.083 -15.894 1.00 0.00 H new ATOM 0 HE21 GLN A 789 37.035 -13.336 -17.674 1.00 0.00 H new ATOM 0 HE22 GLN A 789 38.495 -14.245 -17.269 1.00 0.00 H new ATOM 956 N GLN A 790 33.301 -11.694 -15.096 1.00 0.00 N ATOM 957 CA GLN A 790 32.112 -11.739 -14.201 1.00 0.00 C ATOM 958 C GLN A 790 32.497 -12.322 -12.840 1.00 0.00 C ATOM 959 O GLN A 790 33.324 -13.207 -12.745 1.00 0.00 O ATOM 960 CB GLN A 790 31.115 -12.652 -14.909 1.00 0.00 C ATOM 961 CG GLN A 790 29.890 -12.854 -14.016 1.00 0.00 C ATOM 962 CD GLN A 790 29.580 -14.347 -13.905 1.00 0.00 C ATOM 963 OE1 GLN A 790 29.941 -15.120 -14.769 1.00 0.00 O ATOM 964 NE2 GLN A 790 28.921 -14.788 -12.867 1.00 0.00 N ATOM 0 H GLN A 790 33.484 -12.550 -15.619 1.00 0.00 H new ATOM 0 HA GLN A 790 31.697 -10.748 -14.018 1.00 0.00 H new ATOM 0 HB2 GLN A 790 30.816 -12.214 -15.861 1.00 0.00 H new ATOM 0 HB3 GLN A 790 31.579 -13.613 -15.132 1.00 0.00 H new ATOM 0 HG2 GLN A 790 30.075 -12.436 -13.027 1.00 0.00 H new ATOM 0 HG3 GLN A 790 29.033 -12.324 -14.431 1.00 0.00 H new ATOM 0 HE21 GLN A 790 28.618 -14.138 -12.142 1.00 0.00 H new ATOM 0 HE22 GLN A 790 28.709 -15.782 -12.782 1.00 0.00 H new ATOM 973 N GLY A 791 31.902 -11.835 -11.788 1.00 0.00 N ATOM 974 CA GLY A 791 32.233 -12.359 -10.433 1.00 0.00 C ATOM 975 C GLY A 791 31.200 -13.409 -10.030 1.00 0.00 C ATOM 976 O GLY A 791 30.749 -14.194 -10.840 1.00 0.00 O ATOM 0 H GLY A 791 31.200 -11.096 -11.807 1.00 0.00 H new ATOM 0 HA2 GLY A 791 33.231 -12.796 -10.434 1.00 0.00 H new ATOM 0 HA3 GLY A 791 32.242 -11.545 -9.708 1.00 0.00 H new ATOM 980 N GLU A 792 30.823 -13.433 -8.783 1.00 0.00 N ATOM 981 CA GLU A 792 29.816 -14.434 -8.327 1.00 0.00 C ATOM 982 C GLU A 792 28.414 -13.821 -8.386 1.00 0.00 C ATOM 983 O GLU A 792 27.448 -14.483 -8.719 1.00 0.00 O ATOM 984 CB GLU A 792 30.204 -14.755 -6.882 1.00 0.00 C ATOM 985 CG GLU A 792 30.896 -16.120 -6.826 1.00 0.00 C ATOM 986 CD GLU A 792 32.351 -15.935 -6.390 1.00 0.00 C ATOM 987 OE1 GLU A 792 33.228 -16.358 -7.124 1.00 0.00 O ATOM 988 OE2 GLU A 792 32.564 -15.371 -5.328 1.00 0.00 O ATOM 0 H GLU A 792 31.168 -12.803 -8.059 1.00 0.00 H new ATOM 0 HA GLU A 792 29.802 -15.328 -8.950 1.00 0.00 H new ATOM 0 HB2 GLU A 792 30.868 -13.983 -6.493 1.00 0.00 H new ATOM 0 HB3 GLU A 792 29.317 -14.760 -6.249 1.00 0.00 H new ATOM 0 HG2 GLU A 792 30.376 -16.775 -6.127 1.00 0.00 H new ATOM 0 HG3 GLU A 792 30.856 -16.601 -7.804 1.00 0.00 H new ATOM 995 N CYS A 793 28.298 -12.559 -8.068 1.00 0.00 N ATOM 996 CA CYS A 793 26.959 -11.895 -8.104 1.00 0.00 C ATOM 997 C CYS A 793 26.809 -11.070 -9.390 1.00 0.00 C ATOM 998 O CYS A 793 27.779 -10.618 -9.966 1.00 0.00 O ATOM 999 CB CYS A 793 26.936 -10.979 -6.879 1.00 0.00 C ATOM 1000 SG CYS A 793 26.002 -11.772 -5.547 1.00 0.00 S ATOM 0 H CYS A 793 29.072 -11.958 -7.785 1.00 0.00 H new ATOM 0 HA CYS A 793 26.142 -12.617 -8.091 1.00 0.00 H new ATOM 0 HB2 CYS A 793 27.954 -10.770 -6.549 1.00 0.00 H new ATOM 0 HB3 CYS A 793 26.482 -10.022 -7.136 1.00 0.00 H new ATOM 1005 N HIS A 794 25.602 -10.870 -9.842 1.00 0.00 N ATOM 1006 CA HIS A 794 25.394 -10.075 -11.087 1.00 0.00 C ATOM 1007 C HIS A 794 23.898 -9.913 -11.369 1.00 0.00 C ATOM 1008 O HIS A 794 23.112 -10.811 -11.142 1.00 0.00 O ATOM 1009 CB HIS A 794 26.064 -10.894 -12.202 1.00 0.00 C ATOM 1010 CG HIS A 794 25.515 -10.467 -13.542 1.00 0.00 C ATOM 1011 ND1 HIS A 794 25.758 -9.208 -14.071 1.00 0.00 N ATOM 1012 CD2 HIS A 794 24.718 -11.112 -14.458 1.00 0.00 C ATOM 1013 CE1 HIS A 794 25.116 -9.136 -15.253 1.00 0.00 C ATOM 1014 NE2 HIS A 794 24.468 -10.271 -15.536 1.00 0.00 N ATOM 0 H HIS A 794 24.751 -11.222 -9.404 1.00 0.00 H new ATOM 0 HA HIS A 794 25.814 -9.072 -11.009 1.00 0.00 H new ATOM 0 HB2 HIS A 794 27.144 -10.747 -12.176 1.00 0.00 H new ATOM 0 HB3 HIS A 794 25.883 -11.957 -12.045 1.00 0.00 H new ATOM 0 HD2 HIS A 794 24.343 -12.120 -14.355 1.00 0.00 H new ATOM 0 HE1 HIS A 794 25.124 -8.267 -15.894 1.00 0.00 H new ATOM 0 HE2 HIS A 794 23.910 -10.476 -16.365 1.00 0.00 H new ATOM 1022 N SER A 795 23.501 -8.774 -11.867 1.00 0.00 N ATOM 1023 CA SER A 795 22.060 -8.559 -12.163 1.00 0.00 C ATOM 1024 C SER A 795 21.674 -9.354 -13.413 1.00 0.00 C ATOM 1025 O SER A 795 22.447 -9.480 -14.341 1.00 0.00 O ATOM 1026 CB SER A 795 21.926 -7.057 -12.412 1.00 0.00 C ATOM 1027 OG SER A 795 22.500 -6.735 -13.673 1.00 0.00 O ATOM 0 H SER A 795 24.112 -7.986 -12.081 1.00 0.00 H new ATOM 0 HA SER A 795 21.408 -8.889 -11.354 1.00 0.00 H new ATOM 0 HB2 SER A 795 20.876 -6.766 -12.393 1.00 0.00 H new ATOM 0 HB3 SER A 795 22.425 -6.500 -11.620 1.00 0.00 H new ATOM 0 HG SER A 795 22.275 -5.811 -13.908 1.00 0.00 H new ATOM 1033 N ILE A 796 20.490 -9.893 -13.444 1.00 0.00 N ATOM 1034 CA ILE A 796 20.064 -10.680 -14.638 1.00 0.00 C ATOM 1035 C ILE A 796 19.364 -9.759 -15.643 1.00 0.00 C ATOM 1036 O ILE A 796 18.356 -10.107 -16.228 1.00 0.00 O ATOM 1037 CB ILE A 796 19.095 -11.741 -14.099 1.00 0.00 C ATOM 1038 CG1 ILE A 796 19.632 -12.314 -12.779 1.00 0.00 C ATOM 1039 CG2 ILE A 796 18.965 -12.872 -15.116 1.00 0.00 C ATOM 1040 CD1 ILE A 796 18.598 -13.273 -12.182 1.00 0.00 C ATOM 0 H ILE A 796 19.798 -9.825 -12.698 1.00 0.00 H new ATOM 0 HA ILE A 796 20.906 -11.138 -15.158 1.00 0.00 H new ATOM 0 HB ILE A 796 18.121 -11.282 -13.927 1.00 0.00 H new ATOM 0 HG12 ILE A 796 20.572 -12.838 -12.953 1.00 0.00 H new ATOM 0 HG13 ILE A 796 19.842 -11.506 -12.078 1.00 0.00 H new ATOM 0 HG21 ILE A 796 18.277 -13.627 -14.735 1.00 0.00 H new ATOM 0 HG22 ILE A 796 18.583 -12.474 -16.056 1.00 0.00 H new ATOM 0 HG23 ILE A 796 19.942 -13.324 -15.284 1.00 0.00 H new ATOM 0 HD11 ILE A 796 18.978 -13.680 -11.245 1.00 0.00 H new ATOM 0 HD12 ILE A 796 17.669 -12.735 -11.993 1.00 0.00 H new ATOM 0 HD13 ILE A 796 18.410 -14.087 -12.882 1.00 0.00 H new ATOM 1052 N ASN A 797 19.899 -8.585 -15.844 1.00 0.00 N ATOM 1053 CA ASN A 797 19.280 -7.623 -16.808 1.00 0.00 C ATOM 1054 C ASN A 797 20.324 -6.582 -17.239 1.00 0.00 C ATOM 1055 O ASN A 797 19.993 -5.494 -17.669 1.00 0.00 O ATOM 1056 CB ASN A 797 18.154 -6.954 -16.019 1.00 0.00 C ATOM 1057 CG ASN A 797 17.000 -6.614 -16.962 1.00 0.00 C ATOM 1058 OD1 ASN A 797 16.545 -7.454 -17.711 1.00 0.00 O ATOM 1059 ND2 ASN A 797 16.505 -5.406 -16.955 1.00 0.00 N ATOM 0 H ASN A 797 20.743 -8.247 -15.381 1.00 0.00 H new ATOM 0 HA ASN A 797 18.913 -8.108 -17.712 1.00 0.00 H new ATOM 0 HB2 ASN A 797 17.807 -7.618 -15.227 1.00 0.00 H new ATOM 0 HB3 ASN A 797 18.522 -6.048 -15.537 1.00 0.00 H new ATOM 0 HD21 ASN A 797 15.735 -5.167 -17.579 1.00 0.00 H new ATOM 0 HD22 ASN A 797 16.888 -4.701 -16.325 1.00 0.00 H new ATOM 1066 N SER A 798 21.579 -6.919 -17.127 1.00 0.00 N ATOM 1067 CA SER A 798 22.661 -5.968 -17.520 1.00 0.00 C ATOM 1068 C SER A 798 22.526 -5.534 -18.990 1.00 0.00 C ATOM 1069 O SER A 798 22.171 -4.409 -19.284 1.00 0.00 O ATOM 1070 CB SER A 798 23.951 -6.755 -17.323 1.00 0.00 C ATOM 1071 OG SER A 798 24.652 -6.231 -16.202 1.00 0.00 O ATOM 0 H SER A 798 21.906 -7.820 -16.777 1.00 0.00 H new ATOM 0 HA SER A 798 22.625 -5.053 -16.929 1.00 0.00 H new ATOM 0 HB2 SER A 798 23.727 -7.810 -17.166 1.00 0.00 H new ATOM 0 HB3 SER A 798 24.571 -6.690 -18.217 1.00 0.00 H new ATOM 0 HG SER A 798 25.136 -5.422 -16.468 1.00 0.00 H new ATOM 1077 N ASN A 799 22.807 -6.417 -19.907 1.00 0.00 N ATOM 1078 CA ASN A 799 22.702 -6.063 -21.358 1.00 0.00 C ATOM 1079 C ASN A 799 21.266 -5.684 -21.752 1.00 0.00 C ATOM 1080 O ASN A 799 21.021 -5.241 -22.855 1.00 0.00 O ATOM 1081 CB ASN A 799 23.139 -7.323 -22.097 1.00 0.00 C ATOM 1082 CG ASN A 799 24.564 -7.134 -22.618 1.00 0.00 C ATOM 1083 OD1 ASN A 799 25.474 -6.887 -21.854 1.00 0.00 O ATOM 1084 ND2 ASN A 799 24.796 -7.238 -23.897 1.00 0.00 N ATOM 0 H ASN A 799 23.106 -7.373 -19.717 1.00 0.00 H new ATOM 0 HA ASN A 799 23.316 -5.196 -21.600 1.00 0.00 H new ATOM 0 HB2 ASN A 799 23.095 -8.184 -21.430 1.00 0.00 H new ATOM 0 HB3 ASN A 799 22.460 -7.526 -22.925 1.00 0.00 H new ATOM 0 HD21 ASN A 799 25.743 -7.112 -24.256 1.00 0.00 H new ATOM 0 HD22 ASN A 799 24.031 -7.446 -24.539 1.00 0.00 H new ATOM 1091 N SER A 800 20.320 -5.846 -20.875 1.00 0.00 N ATOM 1092 CA SER A 800 18.917 -5.485 -21.236 1.00 0.00 C ATOM 1093 C SER A 800 18.749 -3.962 -21.260 1.00 0.00 C ATOM 1094 O SER A 800 17.988 -3.425 -22.041 1.00 0.00 O ATOM 1095 CB SER A 800 18.051 -6.106 -20.144 1.00 0.00 C ATOM 1096 OG SER A 800 16.887 -5.309 -19.954 1.00 0.00 O ATOM 0 H SER A 800 20.451 -6.209 -19.931 1.00 0.00 H new ATOM 0 HA SER A 800 18.641 -5.848 -22.226 1.00 0.00 H new ATOM 0 HB2 SER A 800 17.769 -7.121 -20.422 1.00 0.00 H new ATOM 0 HB3 SER A 800 18.614 -6.175 -19.213 1.00 0.00 H new ATOM 0 HG SER A 800 16.194 -5.842 -19.512 1.00 0.00 H new ATOM 1102 N VAL A 801 19.448 -3.266 -20.413 1.00 0.00 N ATOM 1103 CA VAL A 801 19.325 -1.780 -20.390 1.00 0.00 C ATOM 1104 C VAL A 801 20.358 -1.146 -21.328 1.00 0.00 C ATOM 1105 O VAL A 801 20.235 -0.005 -21.722 1.00 0.00 O ATOM 1106 CB VAL A 801 19.603 -1.383 -18.944 1.00 0.00 C ATOM 1107 CG1 VAL A 801 19.481 0.135 -18.799 1.00 0.00 C ATOM 1108 CG2 VAL A 801 18.587 -2.064 -18.023 1.00 0.00 C ATOM 0 H VAL A 801 20.100 -3.659 -19.734 1.00 0.00 H new ATOM 0 HA VAL A 801 18.344 -1.443 -20.725 1.00 0.00 H new ATOM 0 HB VAL A 801 20.611 -1.696 -18.670 1.00 0.00 H new ATOM 0 HG11 VAL A 801 19.680 0.419 -17.766 1.00 0.00 H new ATOM 0 HG12 VAL A 801 20.203 0.622 -19.454 1.00 0.00 H new ATOM 0 HG13 VAL A 801 18.473 0.447 -19.074 1.00 0.00 H new ATOM 0 HG21 VAL A 801 18.786 -1.780 -16.989 1.00 0.00 H new ATOM 0 HG22 VAL A 801 17.580 -1.751 -18.298 1.00 0.00 H new ATOM 0 HG23 VAL A 801 18.671 -3.146 -18.125 1.00 0.00 H new ATOM 1118 N LEU A 802 21.376 -1.879 -21.685 1.00 0.00 N ATOM 1119 CA LEU A 802 22.420 -1.320 -22.594 1.00 0.00 C ATOM 1120 C LEU A 802 21.974 -1.392 -24.062 1.00 0.00 C ATOM 1121 O LEU A 802 22.110 -0.441 -24.806 1.00 0.00 O ATOM 1122 CB LEU A 802 23.645 -2.203 -22.371 1.00 0.00 C ATOM 1123 CG LEU A 802 24.559 -1.552 -21.335 1.00 0.00 C ATOM 1124 CD1 LEU A 802 24.982 -0.170 -21.829 1.00 0.00 C ATOM 1125 CD2 LEU A 802 23.807 -1.414 -20.010 1.00 0.00 C ATOM 0 H LEU A 802 21.532 -2.842 -21.387 1.00 0.00 H new ATOM 0 HA LEU A 802 22.617 -0.269 -22.383 1.00 0.00 H new ATOM 0 HB2 LEU A 802 23.337 -3.191 -22.030 1.00 0.00 H new ATOM 0 HB3 LEU A 802 24.182 -2.342 -23.309 1.00 0.00 H new ATOM 0 HG LEU A 802 25.444 -2.171 -21.187 1.00 0.00 H new ATOM 0 HD11 LEU A 802 25.634 0.296 -21.091 1.00 0.00 H new ATOM 0 HD12 LEU A 802 25.516 -0.269 -22.774 1.00 0.00 H new ATOM 0 HD13 LEU A 802 24.098 0.450 -21.975 1.00 0.00 H new ATOM 0 HD21 LEU A 802 24.458 -0.950 -19.269 1.00 0.00 H new ATOM 0 HD22 LEU A 802 22.923 -0.794 -20.156 1.00 0.00 H new ATOM 0 HD23 LEU A 802 23.504 -2.401 -19.659 1.00 0.00 H new ATOM 1137 N GLU A 803 21.448 -2.507 -24.486 1.00 0.00 N ATOM 1138 CA GLU A 803 20.999 -2.624 -25.908 1.00 0.00 C ATOM 1139 C GLU A 803 19.695 -1.852 -26.144 1.00 0.00 C ATOM 1140 O GLU A 803 19.372 -1.492 -27.259 1.00 0.00 O ATOM 1141 CB GLU A 803 20.771 -4.121 -26.121 1.00 0.00 C ATOM 1142 CG GLU A 803 20.219 -4.359 -27.528 1.00 0.00 C ATOM 1143 CD GLU A 803 18.695 -4.239 -27.507 1.00 0.00 C ATOM 1144 OE1 GLU A 803 18.175 -3.421 -28.248 1.00 0.00 O ATOM 1145 OE2 GLU A 803 18.074 -4.967 -26.750 1.00 0.00 O ATOM 0 H GLU A 803 21.309 -3.341 -23.915 1.00 0.00 H new ATOM 0 HA GLU A 803 21.733 -2.207 -26.598 1.00 0.00 H new ATOM 0 HB2 GLU A 803 21.707 -4.664 -25.989 1.00 0.00 H new ATOM 0 HB3 GLU A 803 20.073 -4.503 -25.376 1.00 0.00 H new ATOM 0 HG2 GLU A 803 20.642 -3.634 -28.223 1.00 0.00 H new ATOM 0 HG3 GLU A 803 20.511 -5.348 -27.882 1.00 0.00 H new ATOM 1152 N ARG A 804 18.945 -1.594 -25.111 1.00 0.00 N ATOM 1153 CA ARG A 804 17.663 -0.847 -25.292 1.00 0.00 C ATOM 1154 C ARG A 804 17.832 0.668 -25.061 1.00 0.00 C ATOM 1155 O ARG A 804 16.994 1.449 -25.463 1.00 0.00 O ATOM 1156 CB ARG A 804 16.716 -1.437 -24.249 1.00 0.00 C ATOM 1157 CG ARG A 804 15.410 -1.856 -24.929 1.00 0.00 C ATOM 1158 CD ARG A 804 15.459 -3.352 -25.254 1.00 0.00 C ATOM 1159 NE ARG A 804 14.111 -3.870 -24.888 1.00 0.00 N ATOM 1160 CZ ARG A 804 13.988 -5.067 -24.382 1.00 0.00 C ATOM 1161 NH1 ARG A 804 14.514 -6.091 -24.995 1.00 0.00 N ATOM 1162 NH2 ARG A 804 13.337 -5.240 -23.264 1.00 0.00 N ATOM 0 H ARG A 804 19.160 -1.865 -24.151 1.00 0.00 H new ATOM 0 HA ARG A 804 17.292 -0.950 -26.312 1.00 0.00 H new ATOM 0 HB2 ARG A 804 17.180 -2.297 -23.766 1.00 0.00 H new ATOM 0 HB3 ARG A 804 16.514 -0.703 -23.469 1.00 0.00 H new ATOM 0 HG2 ARG A 804 14.563 -1.643 -24.277 1.00 0.00 H new ATOM 0 HG3 ARG A 804 15.262 -1.279 -25.842 1.00 0.00 H new ATOM 0 HD2 ARG A 804 15.673 -3.520 -26.309 1.00 0.00 H new ATOM 0 HD3 ARG A 804 16.242 -3.854 -24.686 1.00 0.00 H new ATOM 0 HE ARG A 804 13.285 -3.290 -25.033 1.00 0.00 H new ATOM 0 HH11 ARG A 804 15.021 -5.956 -25.870 1.00 0.00 H new ATOM 0 HH12 ARG A 804 14.418 -7.026 -24.600 1.00 0.00 H new ATOM 0 HH21 ARG A 804 12.924 -4.440 -22.785 1.00 0.00 H new ATOM 0 HH22 ARG A 804 13.241 -6.176 -22.869 1.00 0.00 H new ATOM 1176 N LYS A 805 18.893 1.101 -24.424 1.00 0.00 N ATOM 1177 CA LYS A 805 19.048 2.579 -24.201 1.00 0.00 C ATOM 1178 C LYS A 805 20.490 3.063 -24.428 1.00 0.00 C ATOM 1179 O LYS A 805 21.019 3.827 -23.646 1.00 0.00 O ATOM 1180 CB LYS A 805 18.649 2.790 -22.743 1.00 0.00 C ATOM 1181 CG LYS A 805 18.572 4.287 -22.443 1.00 0.00 C ATOM 1182 CD LYS A 805 17.236 4.604 -21.770 1.00 0.00 C ATOM 1183 CE LYS A 805 17.259 6.037 -21.236 1.00 0.00 C ATOM 1184 NZ LYS A 805 15.841 6.488 -21.291 1.00 0.00 N ATOM 0 H LYS A 805 19.643 0.515 -24.056 1.00 0.00 H new ATOM 0 HA LYS A 805 18.437 3.145 -24.904 1.00 0.00 H new ATOM 0 HB2 LYS A 805 17.685 2.320 -22.548 1.00 0.00 H new ATOM 0 HB3 LYS A 805 19.375 2.314 -22.084 1.00 0.00 H new ATOM 0 HG2 LYS A 805 19.397 4.582 -21.794 1.00 0.00 H new ATOM 0 HG3 LYS A 805 18.672 4.859 -23.365 1.00 0.00 H new ATOM 0 HD2 LYS A 805 16.420 4.484 -22.483 1.00 0.00 H new ATOM 0 HD3 LYS A 805 17.053 3.904 -20.955 1.00 0.00 H new ATOM 0 HE2 LYS A 805 17.646 6.073 -20.218 1.00 0.00 H new ATOM 0 HE3 LYS A 805 17.901 6.675 -21.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 805 15.773 7.465 -20.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 805 15.502 6.449 -22.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 805 15.256 5.866 -20.698 1.00 0.00 H new ATOM 1198 N CYS A 806 21.131 2.639 -25.480 1.00 0.00 N ATOM 1199 CA CYS A 806 22.536 3.101 -25.719 1.00 0.00 C ATOM 1200 C CYS A 806 22.949 2.841 -27.168 1.00 0.00 C ATOM 1201 O CYS A 806 23.647 3.629 -27.776 1.00 0.00 O ATOM 1202 CB CYS A 806 23.399 2.284 -24.760 1.00 0.00 C ATOM 1203 SG CYS A 806 24.369 3.405 -23.716 1.00 0.00 S ATOM 0 H CYS A 806 20.753 2.000 -26.180 1.00 0.00 H new ATOM 0 HA CYS A 806 22.644 4.172 -25.550 1.00 0.00 H new ATOM 0 HB2 CYS A 806 22.769 1.646 -24.140 1.00 0.00 H new ATOM 0 HB3 CYS A 806 24.063 1.627 -25.321 1.00 0.00 H new ATOM 1208 N ILE A 807 22.525 1.747 -27.724 1.00 0.00 N ATOM 1209 CA ILE A 807 22.893 1.432 -29.132 1.00 0.00 C ATOM 1210 C ILE A 807 22.171 2.368 -30.112 1.00 0.00 C ATOM 1211 O ILE A 807 20.964 2.327 -30.246 1.00 0.00 O ATOM 1212 CB ILE A 807 22.430 -0.004 -29.336 1.00 0.00 C ATOM 1213 CG1 ILE A 807 23.242 -0.934 -28.431 1.00 0.00 C ATOM 1214 CG2 ILE A 807 22.633 -0.404 -30.797 1.00 0.00 C ATOM 1215 CD1 ILE A 807 22.947 -2.387 -28.801 1.00 0.00 C ATOM 0 H ILE A 807 21.937 1.052 -27.264 1.00 0.00 H new ATOM 0 HA ILE A 807 23.960 1.560 -29.313 1.00 0.00 H new ATOM 0 HB ILE A 807 21.373 -0.085 -29.084 1.00 0.00 H new ATOM 0 HG12 ILE A 807 24.307 -0.728 -28.541 1.00 0.00 H new ATOM 0 HG13 ILE A 807 22.989 -0.755 -27.386 1.00 0.00 H new ATOM 0 HG21 ILE A 807 22.301 -1.432 -30.942 1.00 0.00 H new ATOM 0 HG22 ILE A 807 22.053 0.259 -31.440 1.00 0.00 H new ATOM 0 HG23 ILE A 807 23.690 -0.324 -31.053 1.00 0.00 H new ATOM 0 HD11 ILE A 807 23.524 -3.051 -28.158 1.00 0.00 H new ATOM 0 HD12 ILE A 807 21.884 -2.588 -28.668 1.00 0.00 H new ATOM 0 HD13 ILE A 807 23.222 -2.561 -29.841 1.00 0.00 H new ATOM 1227 N GLY A 808 22.901 3.212 -30.797 1.00 0.00 N ATOM 1228 CA GLY A 808 22.249 4.143 -31.766 1.00 0.00 C ATOM 1229 C GLY A 808 22.510 5.598 -31.370 1.00 0.00 C ATOM 1230 O GLY A 808 21.811 6.496 -31.795 1.00 0.00 O ATOM 0 H GLY A 808 23.915 3.296 -30.727 1.00 0.00 H new ATOM 0 HA2 GLY A 808 22.632 3.959 -32.770 1.00 0.00 H new ATOM 0 HA3 GLY A 808 21.176 3.955 -31.794 1.00 0.00 H new ATOM 1234 N LEU A 809 23.504 5.848 -30.560 1.00 0.00 N ATOM 1235 CA LEU A 809 23.786 7.260 -30.153 1.00 0.00 C ATOM 1236 C LEU A 809 25.300 7.505 -30.062 1.00 0.00 C ATOM 1237 O LEU A 809 26.052 6.649 -29.641 1.00 0.00 O ATOM 1238 CB LEU A 809 23.139 7.412 -28.772 1.00 0.00 C ATOM 1239 CG LEU A 809 21.620 7.225 -28.884 1.00 0.00 C ATOM 1240 CD1 LEU A 809 21.032 6.957 -27.497 1.00 0.00 C ATOM 1241 CD2 LEU A 809 20.993 8.495 -29.469 1.00 0.00 C ATOM 0 H LEU A 809 24.129 5.145 -30.165 1.00 0.00 H new ATOM 0 HA LEU A 809 23.394 7.977 -30.874 1.00 0.00 H new ATOM 0 HB2 LEU A 809 23.555 6.677 -28.083 1.00 0.00 H new ATOM 0 HB3 LEU A 809 23.364 8.396 -28.362 1.00 0.00 H new ATOM 0 HG LEU A 809 21.406 6.379 -29.536 1.00 0.00 H new ATOM 0 HD11 LEU A 809 19.953 6.824 -27.579 1.00 0.00 H new ATOM 0 HD12 LEU A 809 21.478 6.054 -27.081 1.00 0.00 H new ATOM 0 HD13 LEU A 809 21.245 7.802 -26.842 1.00 0.00 H new ATOM 0 HD21 LEU A 809 19.914 8.364 -29.549 1.00 0.00 H new ATOM 0 HD22 LEU A 809 21.208 9.341 -28.816 1.00 0.00 H new ATOM 0 HD23 LEU A 809 21.410 8.684 -30.458 1.00 0.00 H new ATOM 1253 N GLU A 810 25.749 8.672 -30.454 1.00 0.00 N ATOM 1254 CA GLU A 810 27.210 8.968 -30.388 1.00 0.00 C ATOM 1255 C GLU A 810 27.647 9.020 -28.927 1.00 0.00 C ATOM 1256 O GLU A 810 28.785 8.753 -28.594 1.00 0.00 O ATOM 1257 CB GLU A 810 27.374 10.339 -31.047 1.00 0.00 C ATOM 1258 CG GLU A 810 26.695 10.336 -32.418 1.00 0.00 C ATOM 1259 CD GLU A 810 25.883 11.622 -32.590 1.00 0.00 C ATOM 1260 OE1 GLU A 810 24.894 11.772 -31.889 1.00 0.00 O ATOM 1261 OE2 GLU A 810 26.261 12.432 -33.418 1.00 0.00 O ATOM 0 H GLU A 810 25.168 9.429 -30.815 1.00 0.00 H new ATOM 0 HA GLU A 810 27.815 8.211 -30.887 1.00 0.00 H new ATOM 0 HB2 GLU A 810 26.936 11.112 -30.415 1.00 0.00 H new ATOM 0 HB3 GLU A 810 28.432 10.577 -31.155 1.00 0.00 H new ATOM 0 HG2 GLU A 810 27.444 10.258 -33.206 1.00 0.00 H new ATOM 0 HG3 GLU A 810 26.043 9.467 -32.511 1.00 0.00 H new ATOM 1268 N ARG A 811 26.745 9.363 -28.053 1.00 0.00 N ATOM 1269 CA ARG A 811 27.091 9.437 -26.607 1.00 0.00 C ATOM 1270 C ARG A 811 26.130 8.567 -25.796 1.00 0.00 C ATOM 1271 O ARG A 811 25.012 8.314 -26.202 1.00 0.00 O ATOM 1272 CB ARG A 811 26.935 10.911 -26.230 1.00 0.00 C ATOM 1273 CG ARG A 811 27.844 11.233 -25.039 1.00 0.00 C ATOM 1274 CD ARG A 811 27.745 12.723 -24.704 1.00 0.00 C ATOM 1275 NE ARG A 811 29.030 13.050 -24.024 1.00 0.00 N ATOM 1276 CZ ARG A 811 29.837 13.932 -24.545 1.00 0.00 C ATOM 1277 NH1 ARG A 811 30.260 14.936 -23.826 1.00 0.00 N ATOM 1278 NH2 ARG A 811 30.221 13.812 -25.786 1.00 0.00 N ATOM 0 H ARG A 811 25.778 9.597 -28.278 1.00 0.00 H new ATOM 0 HA ARG A 811 28.099 9.076 -26.403 1.00 0.00 H new ATOM 0 HB2 ARG A 811 27.193 11.544 -27.079 1.00 0.00 H new ATOM 0 HB3 ARG A 811 25.897 11.125 -25.977 1.00 0.00 H new ATOM 0 HG2 ARG A 811 27.553 10.636 -24.175 1.00 0.00 H new ATOM 0 HG3 ARG A 811 28.875 10.971 -25.275 1.00 0.00 H new ATOM 0 HD2 ARG A 811 27.611 13.322 -25.605 1.00 0.00 H new ATOM 0 HD3 ARG A 811 26.892 12.926 -24.056 1.00 0.00 H new ATOM 0 HE ARG A 811 29.278 12.584 -23.151 1.00 0.00 H new ATOM 0 HH11 ARG A 811 29.959 15.031 -22.856 1.00 0.00 H new ATOM 0 HH12 ARG A 811 30.891 15.625 -24.234 1.00 0.00 H new ATOM 0 HH21 ARG A 811 29.890 13.028 -26.349 1.00 0.00 H new ATOM 0 HH22 ARG A 811 30.852 14.502 -26.194 1.00 0.00 H new ATOM 1292 N CYS A 812 26.553 8.107 -24.655 1.00 0.00 N ATOM 1293 CA CYS A 812 25.660 7.250 -23.816 1.00 0.00 C ATOM 1294 C CYS A 812 25.758 7.654 -22.341 1.00 0.00 C ATOM 1295 O CYS A 812 26.826 7.675 -21.761 1.00 0.00 O ATOM 1296 CB CYS A 812 26.177 5.823 -24.013 1.00 0.00 C ATOM 1297 SG CYS A 812 24.973 4.868 -24.976 1.00 0.00 S ATOM 0 H CYS A 812 27.478 8.285 -24.263 1.00 0.00 H new ATOM 0 HA CYS A 812 24.613 7.350 -24.102 1.00 0.00 H new ATOM 0 HB2 CYS A 812 27.138 5.841 -24.528 1.00 0.00 H new ATOM 0 HB3 CYS A 812 26.343 5.349 -23.046 1.00 0.00 H new ATOM 1302 N VAL A 813 24.650 7.978 -21.731 1.00 0.00 N ATOM 1303 CA VAL A 813 24.679 8.379 -20.296 1.00 0.00 C ATOM 1304 C VAL A 813 23.614 7.607 -19.515 1.00 0.00 C ATOM 1305 O VAL A 813 22.438 7.907 -19.585 1.00 0.00 O ATOM 1306 CB VAL A 813 24.365 9.873 -20.294 1.00 0.00 C ATOM 1307 CG1 VAL A 813 24.168 10.349 -18.853 1.00 0.00 C ATOM 1308 CG2 VAL A 813 25.529 10.640 -20.927 1.00 0.00 C ATOM 0 H VAL A 813 23.727 7.982 -22.164 1.00 0.00 H new ATOM 0 HA VAL A 813 25.639 8.166 -19.826 1.00 0.00 H new ATOM 0 HB VAL A 813 23.455 10.054 -20.866 1.00 0.00 H new ATOM 0 HG11 VAL A 813 23.944 11.416 -18.850 1.00 0.00 H new ATOM 0 HG12 VAL A 813 23.341 9.803 -18.399 1.00 0.00 H new ATOM 0 HG13 VAL A 813 25.079 10.168 -18.282 1.00 0.00 H new ATOM 0 HG21 VAL A 813 25.305 11.707 -20.926 1.00 0.00 H new ATOM 0 HG22 VAL A 813 26.438 10.459 -20.354 1.00 0.00 H new ATOM 0 HG23 VAL A 813 25.673 10.301 -21.953 1.00 0.00 H new ATOM 1318 N VAL A 814 24.015 6.614 -18.769 1.00 0.00 N ATOM 1319 CA VAL A 814 23.023 5.824 -17.985 1.00 0.00 C ATOM 1320 C VAL A 814 23.410 5.812 -16.505 1.00 0.00 C ATOM 1321 O VAL A 814 24.481 5.372 -16.136 1.00 0.00 O ATOM 1322 CB VAL A 814 23.086 4.412 -18.561 1.00 0.00 C ATOM 1323 CG1 VAL A 814 22.139 3.501 -17.779 1.00 0.00 C ATOM 1324 CG2 VAL A 814 22.663 4.441 -20.032 1.00 0.00 C ATOM 0 H VAL A 814 24.985 6.316 -18.668 1.00 0.00 H new ATOM 0 HA VAL A 814 22.020 6.245 -18.052 1.00 0.00 H new ATOM 0 HB VAL A 814 24.105 4.033 -18.483 1.00 0.00 H new ATOM 0 HG11 VAL A 814 22.183 2.492 -18.189 1.00 0.00 H new ATOM 0 HG12 VAL A 814 22.437 3.480 -16.731 1.00 0.00 H new ATOM 0 HG13 VAL A 814 21.120 3.881 -17.858 1.00 0.00 H new ATOM 0 HG21 VAL A 814 22.708 3.433 -20.443 1.00 0.00 H new ATOM 0 HG22 VAL A 814 21.644 4.820 -20.110 1.00 0.00 H new ATOM 0 HG23 VAL A 814 23.336 5.091 -20.591 1.00 0.00 H new ATOM 1334 N ALA A 815 22.547 6.290 -15.656 1.00 0.00 N ATOM 1335 CA ALA A 815 22.863 6.305 -14.202 1.00 0.00 C ATOM 1336 C ALA A 815 22.809 4.886 -13.634 1.00 0.00 C ATOM 1337 O ALA A 815 22.223 3.994 -14.216 1.00 0.00 O ATOM 1338 CB ALA A 815 21.780 7.179 -13.574 1.00 0.00 C ATOM 0 H ALA A 815 21.635 6.672 -15.906 1.00 0.00 H new ATOM 0 HA ALA A 815 23.863 6.687 -13.999 1.00 0.00 H new ATOM 0 HB1 ALA A 815 21.942 7.242 -12.498 1.00 0.00 H new ATOM 0 HB2 ALA A 815 21.823 8.179 -14.006 1.00 0.00 H new ATOM 0 HB3 ALA A 815 20.801 6.742 -13.769 1.00 0.00 H new ATOM 1344 N ILE A 816 23.416 4.670 -12.503 1.00 0.00 N ATOM 1345 CA ILE A 816 23.402 3.310 -11.894 1.00 0.00 C ATOM 1346 C ILE A 816 22.593 3.335 -10.603 1.00 0.00 C ATOM 1347 O ILE A 816 23.134 3.424 -9.519 1.00 0.00 O ATOM 1348 CB ILE A 816 24.860 2.993 -11.602 1.00 0.00 C ATOM 1349 CG1 ILE A 816 25.676 3.137 -12.885 1.00 0.00 C ATOM 1350 CG2 ILE A 816 24.980 1.560 -11.082 1.00 0.00 C ATOM 1351 CD1 ILE A 816 27.054 3.691 -12.545 1.00 0.00 C ATOM 0 H ILE A 816 23.923 5.377 -11.971 1.00 0.00 H new ATOM 0 HA ILE A 816 22.949 2.564 -12.547 1.00 0.00 H new ATOM 0 HB ILE A 816 25.237 3.684 -10.848 1.00 0.00 H new ATOM 0 HG12 ILE A 816 25.772 2.170 -13.379 1.00 0.00 H new ATOM 0 HG13 ILE A 816 25.166 3.802 -13.582 1.00 0.00 H new ATOM 0 HG21 ILE A 816 26.026 1.335 -10.873 1.00 0.00 H new ATOM 0 HG22 ILE A 816 24.397 1.455 -10.167 1.00 0.00 H new ATOM 0 HG23 ILE A 816 24.603 0.867 -11.834 1.00 0.00 H new ATOM 0 HD11 ILE A 816 27.640 3.795 -13.458 1.00 0.00 H new ATOM 0 HD12 ILE A 816 26.947 4.666 -12.069 1.00 0.00 H new ATOM 0 HD13 ILE A 816 27.563 3.009 -11.864 1.00 0.00 H new ATOM 1363 N SER A 817 21.303 3.256 -10.708 1.00 0.00 N ATOM 1364 CA SER A 817 20.456 3.277 -9.483 1.00 0.00 C ATOM 1365 C SER A 817 19.819 1.904 -9.257 1.00 0.00 C ATOM 1366 O SER A 817 19.694 1.117 -10.173 1.00 0.00 O ATOM 1367 CB SER A 817 19.389 4.332 -9.758 1.00 0.00 C ATOM 1368 OG SER A 817 18.296 3.730 -10.442 1.00 0.00 O ATOM 0 H SER A 817 20.793 3.178 -11.588 1.00 0.00 H new ATOM 0 HA SER A 817 21.030 3.508 -8.586 1.00 0.00 H new ATOM 0 HB2 SER A 817 19.048 4.773 -8.821 1.00 0.00 H new ATOM 0 HB3 SER A 817 19.807 5.141 -10.358 1.00 0.00 H new ATOM 0 HG SER A 817 17.475 3.856 -9.922 1.00 0.00 H new ATOM 1374 N PRO A 818 19.435 1.668 -8.031 1.00 0.00 N ATOM 1375 CA PRO A 818 18.802 0.381 -7.668 1.00 0.00 C ATOM 1376 C PRO A 818 17.329 0.343 -8.116 1.00 0.00 C ATOM 1377 O PRO A 818 16.576 -0.521 -7.711 1.00 0.00 O ATOM 1378 CB PRO A 818 18.901 0.349 -6.148 1.00 0.00 C ATOM 1379 CG PRO A 818 18.983 1.789 -5.726 1.00 0.00 C ATOM 1380 CD PRO A 818 19.571 2.566 -6.883 1.00 0.00 C ATOM 0 HA PRO A 818 19.282 -0.473 -8.146 1.00 0.00 H new ATOM 0 HB2 PRO A 818 18.033 -0.141 -5.707 1.00 0.00 H new ATOM 0 HB3 PRO A 818 19.780 -0.207 -5.823 1.00 0.00 H new ATOM 0 HG2 PRO A 818 17.995 2.171 -5.470 1.00 0.00 H new ATOM 0 HG3 PRO A 818 19.605 1.894 -4.837 1.00 0.00 H new ATOM 0 HD2 PRO A 818 19.037 3.502 -7.045 1.00 0.00 H new ATOM 0 HD3 PRO A 818 20.615 2.822 -6.700 1.00 0.00 H new ATOM 1388 N SER A 819 16.914 1.268 -8.943 1.00 0.00 N ATOM 1389 CA SER A 819 15.495 1.270 -9.403 1.00 0.00 C ATOM 1390 C SER A 819 15.426 1.480 -10.922 1.00 0.00 C ATOM 1391 O SER A 819 14.390 1.811 -11.465 1.00 0.00 O ATOM 1392 CB SER A 819 14.847 2.440 -8.670 1.00 0.00 C ATOM 1393 OG SER A 819 15.695 3.580 -8.762 1.00 0.00 O ATOM 0 H SER A 819 17.494 2.018 -9.318 1.00 0.00 H new ATOM 0 HA SER A 819 14.992 0.326 -9.193 1.00 0.00 H new ATOM 0 HB2 SER A 819 13.872 2.661 -9.105 1.00 0.00 H new ATOM 0 HB3 SER A 819 14.679 2.181 -7.625 1.00 0.00 H new ATOM 0 HG SER A 819 15.281 4.334 -8.293 1.00 0.00 H new ATOM 1399 N ASN A 820 16.520 1.293 -11.611 1.00 0.00 N ATOM 1400 CA ASN A 820 16.509 1.484 -13.093 1.00 0.00 C ATOM 1401 C ASN A 820 16.849 0.166 -13.795 1.00 0.00 C ATOM 1402 O ASN A 820 16.612 0.000 -14.976 1.00 0.00 O ATOM 1403 CB ASN A 820 17.588 2.531 -13.373 1.00 0.00 C ATOM 1404 CG ASN A 820 17.483 2.994 -14.828 1.00 0.00 C ATOM 1405 OD1 ASN A 820 17.935 2.313 -15.728 1.00 0.00 O ATOM 1406 ND2 ASN A 820 16.900 4.129 -15.100 1.00 0.00 N ATOM 0 H ASN A 820 17.418 1.017 -11.215 1.00 0.00 H new ATOM 0 HA ASN A 820 15.533 1.801 -13.459 1.00 0.00 H new ATOM 0 HB2 ASN A 820 17.469 3.380 -12.700 1.00 0.00 H new ATOM 0 HB3 ASN A 820 18.576 2.111 -13.184 1.00 0.00 H new ATOM 0 HD21 ASN A 820 16.824 4.444 -16.067 1.00 0.00 H new ATOM 0 HD22 ASN A 820 16.520 4.701 -14.346 1.00 0.00 H new ATOM 1413 N PHE A 821 17.406 -0.769 -13.077 1.00 0.00 N ATOM 1414 CA PHE A 821 17.761 -2.079 -13.699 1.00 0.00 C ATOM 1415 C PHE A 821 16.663 -3.111 -13.425 1.00 0.00 C ATOM 1416 O PHE A 821 16.322 -3.908 -14.275 1.00 0.00 O ATOM 1417 CB PHE A 821 19.065 -2.494 -13.023 1.00 0.00 C ATOM 1418 CG PHE A 821 20.231 -1.936 -13.798 1.00 0.00 C ATOM 1419 CD1 PHE A 821 20.398 -0.552 -13.907 1.00 0.00 C ATOM 1420 CD2 PHE A 821 21.145 -2.803 -14.405 1.00 0.00 C ATOM 1421 CE1 PHE A 821 21.481 -0.033 -14.625 1.00 0.00 C ATOM 1422 CE2 PHE A 821 22.228 -2.285 -15.124 1.00 0.00 C ATOM 1423 CZ PHE A 821 22.396 -0.899 -15.233 1.00 0.00 C ATOM 0 H PHE A 821 17.632 -0.684 -12.086 1.00 0.00 H new ATOM 0 HA PHE A 821 17.866 -2.008 -14.782 1.00 0.00 H new ATOM 0 HB2 PHE A 821 19.088 -2.128 -11.997 1.00 0.00 H new ATOM 0 HB3 PHE A 821 19.133 -3.581 -12.975 1.00 0.00 H new ATOM 0 HD1 PHE A 821 19.691 0.116 -13.437 1.00 0.00 H new ATOM 0 HD2 PHE A 821 21.015 -3.872 -14.319 1.00 0.00 H new ATOM 0 HE1 PHE A 821 21.610 1.036 -14.710 1.00 0.00 H new ATOM 0 HE2 PHE A 821 22.934 -2.954 -15.594 1.00 0.00 H new ATOM 0 HZ PHE A 821 23.232 -0.499 -15.787 1.00 0.00 H new ATOM 1433 N GLY A 822 16.110 -3.101 -12.244 1.00 0.00 N ATOM 1434 CA GLY A 822 15.036 -4.081 -11.916 1.00 0.00 C ATOM 1435 C GLY A 822 14.649 -3.944 -10.442 1.00 0.00 C ATOM 1436 O GLY A 822 13.523 -4.201 -10.061 1.00 0.00 O ATOM 0 H GLY A 822 16.355 -2.457 -11.492 1.00 0.00 H new ATOM 0 HA2 GLY A 822 14.166 -3.907 -12.549 1.00 0.00 H new ATOM 0 HA3 GLY A 822 15.380 -5.095 -12.119 1.00 0.00 H new ATOM 1440 N GLY A 823 15.570 -3.541 -9.609 1.00 0.00 N ATOM 1441 CA GLY A 823 15.250 -3.389 -8.162 1.00 0.00 C ATOM 1442 C GLY A 823 16.494 -3.704 -7.327 1.00 0.00 C ATOM 1443 O GLY A 823 17.218 -2.817 -6.917 1.00 0.00 O ATOM 0 H GLY A 823 16.529 -3.311 -9.868 1.00 0.00 H new ATOM 0 HA2 GLY A 823 14.910 -2.373 -7.959 1.00 0.00 H new ATOM 0 HA3 GLY A 823 14.435 -4.059 -7.887 1.00 0.00 H new ATOM 1447 N ASP A 824 16.750 -4.960 -7.072 1.00 0.00 N ATOM 1448 CA ASP A 824 17.950 -5.326 -6.260 1.00 0.00 C ATOM 1449 C ASP A 824 18.509 -6.684 -6.713 1.00 0.00 C ATOM 1450 O ASP A 824 17.817 -7.682 -6.673 1.00 0.00 O ATOM 1451 CB ASP A 824 17.441 -5.409 -4.822 1.00 0.00 C ATOM 1452 CG ASP A 824 17.292 -3.998 -4.251 1.00 0.00 C ATOM 1453 OD1 ASP A 824 18.009 -3.680 -3.316 1.00 0.00 O ATOM 1454 OD2 ASP A 824 16.462 -3.260 -4.755 1.00 0.00 O ATOM 0 H ASP A 824 16.183 -5.746 -7.389 1.00 0.00 H new ATOM 0 HA ASP A 824 18.757 -4.602 -6.368 1.00 0.00 H new ATOM 0 HB2 ASP A 824 16.483 -5.927 -4.794 1.00 0.00 H new ATOM 0 HB3 ASP A 824 18.135 -5.988 -4.212 1.00 0.00 H new ATOM 1459 N PRO A 825 19.751 -6.672 -7.128 1.00 0.00 N ATOM 1460 CA PRO A 825 20.409 -7.914 -7.590 1.00 0.00 C ATOM 1461 C PRO A 825 20.782 -8.801 -6.394 1.00 0.00 C ATOM 1462 O PRO A 825 20.009 -9.635 -5.964 1.00 0.00 O ATOM 1463 CB PRO A 825 21.658 -7.417 -8.305 1.00 0.00 C ATOM 1464 CG PRO A 825 21.952 -6.078 -7.696 1.00 0.00 C ATOM 1465 CD PRO A 825 20.639 -5.509 -7.207 1.00 0.00 C ATOM 0 HA PRO A 825 19.770 -8.521 -8.232 1.00 0.00 H new ATOM 0 HB2 PRO A 825 22.492 -8.105 -8.165 1.00 0.00 H new ATOM 0 HB3 PRO A 825 21.490 -7.333 -9.379 1.00 0.00 H new ATOM 0 HG2 PRO A 825 22.659 -6.177 -6.872 1.00 0.00 H new ATOM 0 HG3 PRO A 825 22.409 -5.414 -8.430 1.00 0.00 H new ATOM 0 HD2 PRO A 825 20.751 -5.027 -6.236 1.00 0.00 H new ATOM 0 HD3 PRO A 825 20.250 -4.757 -7.894 1.00 0.00 H new ATOM 1473 N CYS A 826 21.960 -8.628 -5.855 1.00 0.00 N ATOM 1474 CA CYS A 826 22.376 -9.462 -4.690 1.00 0.00 C ATOM 1475 C CYS A 826 22.129 -8.697 -3.383 1.00 0.00 C ATOM 1476 O CYS A 826 22.512 -7.552 -3.251 1.00 0.00 O ATOM 1477 CB CYS A 826 23.870 -9.721 -4.896 1.00 0.00 C ATOM 1478 SG CYS A 826 24.088 -11.223 -5.886 1.00 0.00 S ATOM 0 H CYS A 826 22.651 -7.947 -6.170 1.00 0.00 H new ATOM 0 HA CYS A 826 21.814 -10.393 -4.623 1.00 0.00 H new ATOM 0 HB2 CYS A 826 24.332 -8.871 -5.398 1.00 0.00 H new ATOM 0 HB3 CYS A 826 24.368 -9.832 -3.933 1.00 0.00 H new ATOM 1483 N PRO A 827 21.488 -9.365 -2.459 1.00 0.00 N ATOM 1484 CA PRO A 827 21.182 -8.748 -1.148 1.00 0.00 C ATOM 1485 C PRO A 827 22.444 -8.635 -0.289 1.00 0.00 C ATOM 1486 O PRO A 827 23.171 -9.590 -0.107 1.00 0.00 O ATOM 1487 CB PRO A 827 20.187 -9.714 -0.519 1.00 0.00 C ATOM 1488 CG PRO A 827 20.459 -11.036 -1.173 1.00 0.00 C ATOM 1489 CD PRO A 827 20.999 -10.743 -2.553 1.00 0.00 C ATOM 0 HA PRO A 827 20.791 -7.735 -1.240 1.00 0.00 H new ATOM 0 HB2 PRO A 827 20.323 -9.773 0.561 1.00 0.00 H new ATOM 0 HB3 PRO A 827 19.160 -9.392 -0.693 1.00 0.00 H new ATOM 0 HG2 PRO A 827 21.178 -11.613 -0.592 1.00 0.00 H new ATOM 0 HG3 PRO A 827 19.548 -11.631 -1.234 1.00 0.00 H new ATOM 0 HD2 PRO A 827 21.799 -11.432 -2.823 1.00 0.00 H new ATOM 0 HD3 PRO A 827 20.224 -10.840 -3.313 1.00 0.00 H new ATOM 1497 N GLU A 828 22.705 -7.471 0.241 1.00 0.00 N ATOM 1498 CA GLU A 828 23.918 -7.290 1.091 1.00 0.00 C ATOM 1499 C GLU A 828 25.180 -7.669 0.312 1.00 0.00 C ATOM 1500 O GLU A 828 26.039 -8.372 0.806 1.00 0.00 O ATOM 1501 CB GLU A 828 23.713 -8.234 2.272 1.00 0.00 C ATOM 1502 CG GLU A 828 23.023 -7.480 3.406 1.00 0.00 C ATOM 1503 CD GLU A 828 22.505 -8.479 4.442 1.00 0.00 C ATOM 1504 OE1 GLU A 828 21.695 -9.314 4.076 1.00 0.00 O ATOM 1505 OE2 GLU A 828 22.930 -8.393 5.582 1.00 0.00 O ATOM 0 H GLU A 828 22.131 -6.636 0.122 1.00 0.00 H new ATOM 0 HA GLU A 828 24.047 -6.256 1.410 1.00 0.00 H new ATOM 0 HB2 GLU A 828 23.109 -9.089 1.968 1.00 0.00 H new ATOM 0 HB3 GLU A 828 24.672 -8.625 2.611 1.00 0.00 H new ATOM 0 HG2 GLU A 828 23.721 -6.785 3.873 1.00 0.00 H new ATOM 0 HG3 GLU A 828 22.198 -6.887 3.013 1.00 0.00 H new ATOM 1512 N VAL A 829 25.300 -7.208 -0.899 1.00 0.00 N ATOM 1513 CA VAL A 829 26.506 -7.540 -1.706 1.00 0.00 C ATOM 1514 C VAL A 829 27.048 -6.277 -2.383 1.00 0.00 C ATOM 1515 O VAL A 829 26.337 -5.586 -3.086 1.00 0.00 O ATOM 1516 CB VAL A 829 26.019 -8.543 -2.748 1.00 0.00 C ATOM 1517 CG1 VAL A 829 27.076 -8.697 -3.842 1.00 0.00 C ATOM 1518 CG2 VAL A 829 25.779 -9.899 -2.077 1.00 0.00 C ATOM 0 H VAL A 829 24.615 -6.615 -1.367 1.00 0.00 H new ATOM 0 HA VAL A 829 27.315 -7.947 -1.099 1.00 0.00 H new ATOM 0 HB VAL A 829 25.089 -8.185 -3.190 1.00 0.00 H new ATOM 0 HG11 VAL A 829 26.728 -9.413 -4.586 1.00 0.00 H new ATOM 0 HG12 VAL A 829 27.248 -7.733 -4.320 1.00 0.00 H new ATOM 0 HG13 VAL A 829 28.006 -9.055 -3.401 1.00 0.00 H new ATOM 0 HG21 VAL A 829 25.431 -10.616 -2.820 1.00 0.00 H new ATOM 0 HG22 VAL A 829 26.709 -10.256 -1.636 1.00 0.00 H new ATOM 0 HG23 VAL A 829 25.025 -9.791 -1.297 1.00 0.00 H new ATOM 1528 N MET A 830 28.303 -5.967 -2.169 1.00 0.00 N ATOM 1529 CA MET A 830 28.891 -4.747 -2.801 1.00 0.00 C ATOM 1530 C MET A 830 28.411 -4.624 -4.252 1.00 0.00 C ATOM 1531 O MET A 830 27.930 -5.576 -4.836 1.00 0.00 O ATOM 1532 CB MET A 830 30.403 -4.968 -2.751 1.00 0.00 C ATOM 1533 CG MET A 830 30.899 -4.805 -1.312 1.00 0.00 C ATOM 1534 SD MET A 830 31.126 -3.046 -0.947 1.00 0.00 S ATOM 1535 CE MET A 830 31.868 -3.244 0.692 1.00 0.00 C ATOM 0 H MET A 830 28.944 -6.505 -1.585 1.00 0.00 H new ATOM 0 HA MET A 830 28.597 -3.830 -2.290 1.00 0.00 H new ATOM 0 HB2 MET A 830 30.647 -5.964 -3.120 1.00 0.00 H new ATOM 0 HB3 MET A 830 30.907 -4.254 -3.403 1.00 0.00 H new ATOM 0 HG2 MET A 830 30.182 -5.242 -0.617 1.00 0.00 H new ATOM 0 HG3 MET A 830 31.839 -5.340 -1.177 1.00 0.00 H new ATOM 0 HE1 MET A 830 32.093 -2.263 1.111 1.00 0.00 H new ATOM 0 HE2 MET A 830 31.170 -3.767 1.346 1.00 0.00 H new ATOM 0 HE3 MET A 830 32.788 -3.822 0.607 1.00 0.00 H new ATOM 1545 N LYS A 831 28.538 -3.465 -4.842 1.00 0.00 N ATOM 1546 CA LYS A 831 28.080 -3.303 -6.254 1.00 0.00 C ATOM 1547 C LYS A 831 29.064 -2.442 -7.056 1.00 0.00 C ATOM 1548 O LYS A 831 29.623 -1.486 -6.557 1.00 0.00 O ATOM 1549 CB LYS A 831 26.727 -2.601 -6.150 1.00 0.00 C ATOM 1550 CG LYS A 831 25.618 -3.645 -6.035 1.00 0.00 C ATOM 1551 CD LYS A 831 24.479 -3.088 -5.181 1.00 0.00 C ATOM 1552 CE LYS A 831 23.962 -4.187 -4.244 1.00 0.00 C ATOM 1553 NZ LYS A 831 22.480 -3.993 -4.181 1.00 0.00 N ATOM 0 H LYS A 831 28.935 -2.630 -4.412 1.00 0.00 H new ATOM 0 HA LYS A 831 28.014 -4.261 -6.769 1.00 0.00 H new ATOM 0 HB2 LYS A 831 26.713 -1.943 -5.281 1.00 0.00 H new ATOM 0 HB3 LYS A 831 26.562 -1.975 -7.027 1.00 0.00 H new ATOM 0 HG2 LYS A 831 25.248 -3.909 -7.026 1.00 0.00 H new ATOM 0 HG3 LYS A 831 26.009 -4.559 -5.587 1.00 0.00 H new ATOM 0 HD2 LYS A 831 24.829 -2.234 -4.600 1.00 0.00 H new ATOM 0 HD3 LYS A 831 23.672 -2.730 -5.820 1.00 0.00 H new ATOM 0 HE2 LYS A 831 24.212 -5.177 -4.625 1.00 0.00 H new ATOM 0 HE3 LYS A 831 24.411 -4.103 -3.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 831 22.026 -4.881 -3.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 831 22.257 -3.246 -3.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 831 22.126 -3.716 -5.119 1.00 0.00 H new ATOM 1567 N ARG A 832 29.274 -2.784 -8.301 1.00 0.00 N ATOM 1568 CA ARG A 832 30.218 -1.998 -9.154 1.00 0.00 C ATOM 1569 C ARG A 832 29.692 -1.964 -10.595 1.00 0.00 C ATOM 1570 O ARG A 832 28.914 -2.806 -10.995 1.00 0.00 O ATOM 1571 CB ARG A 832 31.545 -2.748 -9.075 1.00 0.00 C ATOM 1572 CG ARG A 832 32.690 -1.801 -9.446 1.00 0.00 C ATOM 1573 CD ARG A 832 33.789 -1.884 -8.381 1.00 0.00 C ATOM 1574 NE ARG A 832 33.767 -0.561 -7.696 1.00 0.00 N ATOM 1575 CZ ARG A 832 34.833 -0.129 -7.079 1.00 0.00 C ATOM 1576 NH1 ARG A 832 35.199 -0.674 -5.949 1.00 0.00 N ATOM 1577 NH2 ARG A 832 35.535 0.844 -7.589 1.00 0.00 N ATOM 0 H ARG A 832 28.831 -3.576 -8.766 1.00 0.00 H new ATOM 0 HA ARG A 832 30.327 -0.965 -8.825 1.00 0.00 H new ATOM 0 HB2 ARG A 832 31.694 -3.139 -8.069 1.00 0.00 H new ATOM 0 HB3 ARG A 832 31.532 -3.603 -9.751 1.00 0.00 H new ATOM 0 HG2 ARG A 832 33.094 -2.068 -10.422 1.00 0.00 H new ATOM 0 HG3 ARG A 832 32.320 -0.779 -9.523 1.00 0.00 H new ATOM 0 HD2 ARG A 832 33.597 -2.695 -7.678 1.00 0.00 H new ATOM 0 HD3 ARG A 832 34.762 -2.078 -8.833 1.00 0.00 H new ATOM 0 HE ARG A 832 32.920 0.007 -7.709 1.00 0.00 H new ATOM 0 HH11 ARG A 832 34.652 -1.437 -5.550 1.00 0.00 H new ATOM 0 HH12 ARG A 832 36.032 -0.337 -5.466 1.00 0.00 H new ATOM 0 HH21 ARG A 832 35.252 1.269 -8.472 1.00 0.00 H new ATOM 0 HH22 ARG A 832 36.368 1.180 -7.105 1.00 0.00 H new ATOM 1591 N VAL A 833 30.105 -1.005 -11.382 1.00 0.00 N ATOM 1592 CA VAL A 833 29.605 -0.946 -12.787 1.00 0.00 C ATOM 1593 C VAL A 833 30.761 -0.969 -13.796 1.00 0.00 C ATOM 1594 O VAL A 833 31.591 -0.083 -13.835 1.00 0.00 O ATOM 1595 CB VAL A 833 28.840 0.371 -12.883 1.00 0.00 C ATOM 1596 CG1 VAL A 833 28.248 0.515 -14.287 1.00 0.00 C ATOM 1597 CG2 VAL A 833 27.708 0.378 -11.852 1.00 0.00 C ATOM 0 H VAL A 833 30.759 -0.268 -11.117 1.00 0.00 H new ATOM 0 HA VAL A 833 28.980 -1.807 -13.022 1.00 0.00 H new ATOM 0 HB VAL A 833 29.519 1.201 -12.686 1.00 0.00 H new ATOM 0 HG11 VAL A 833 27.701 1.455 -14.357 1.00 0.00 H new ATOM 0 HG12 VAL A 833 29.052 0.507 -15.023 1.00 0.00 H new ATOM 0 HG13 VAL A 833 27.569 -0.315 -14.482 1.00 0.00 H new ATOM 0 HG21 VAL A 833 27.160 1.318 -11.919 1.00 0.00 H new ATOM 0 HG22 VAL A 833 27.030 -0.452 -12.051 1.00 0.00 H new ATOM 0 HG23 VAL A 833 28.127 0.273 -10.851 1.00 0.00 H new ATOM 1607 N ALA A 834 30.809 -1.988 -14.611 1.00 0.00 N ATOM 1608 CA ALA A 834 31.891 -2.104 -15.634 1.00 0.00 C ATOM 1609 C ALA A 834 31.242 -2.291 -17.007 1.00 0.00 C ATOM 1610 O ALA A 834 30.553 -3.265 -17.243 1.00 0.00 O ATOM 1611 CB ALA A 834 32.688 -3.346 -15.236 1.00 0.00 C ATOM 0 H ALA A 834 30.137 -2.755 -14.612 1.00 0.00 H new ATOM 0 HA ALA A 834 32.534 -1.225 -15.683 1.00 0.00 H new ATOM 0 HB1 ALA A 834 33.503 -3.497 -15.943 1.00 0.00 H new ATOM 0 HB2 ALA A 834 33.097 -3.211 -14.235 1.00 0.00 H new ATOM 0 HB3 ALA A 834 32.033 -4.217 -15.246 1.00 0.00 H new ATOM 1617 N VAL A 835 31.447 -1.379 -17.917 1.00 0.00 N ATOM 1618 CA VAL A 835 30.819 -1.540 -19.262 1.00 0.00 C ATOM 1619 C VAL A 835 31.845 -1.411 -20.394 1.00 0.00 C ATOM 1620 O VAL A 835 32.954 -0.948 -20.207 1.00 0.00 O ATOM 1621 CB VAL A 835 29.800 -0.405 -19.346 1.00 0.00 C ATOM 1622 CG1 VAL A 835 29.302 -0.267 -20.786 1.00 0.00 C ATOM 1623 CG2 VAL A 835 28.616 -0.716 -18.425 1.00 0.00 C ATOM 0 H VAL A 835 32.014 -0.540 -17.792 1.00 0.00 H new ATOM 0 HA VAL A 835 30.372 -2.528 -19.376 1.00 0.00 H new ATOM 0 HB VAL A 835 30.270 0.528 -19.035 1.00 0.00 H new ATOM 0 HG11 VAL A 835 28.575 0.543 -20.844 1.00 0.00 H new ATOM 0 HG12 VAL A 835 30.144 -0.047 -21.443 1.00 0.00 H new ATOM 0 HG13 VAL A 835 28.832 -1.199 -21.099 1.00 0.00 H new ATOM 0 HG21 VAL A 835 27.887 0.093 -18.483 1.00 0.00 H new ATOM 0 HG22 VAL A 835 28.148 -1.649 -18.737 1.00 0.00 H new ATOM 0 HG23 VAL A 835 28.969 -0.813 -17.398 1.00 0.00 H new ATOM 1633 N GLU A 836 31.459 -1.827 -21.569 1.00 0.00 N ATOM 1634 CA GLU A 836 32.361 -1.756 -22.754 1.00 0.00 C ATOM 1635 C GLU A 836 31.494 -1.632 -24.011 1.00 0.00 C ATOM 1636 O GLU A 836 30.644 -2.462 -24.266 1.00 0.00 O ATOM 1637 CB GLU A 836 33.135 -3.077 -22.753 1.00 0.00 C ATOM 1638 CG GLU A 836 34.539 -2.850 -23.321 1.00 0.00 C ATOM 1639 CD GLU A 836 34.912 -4.013 -24.243 1.00 0.00 C ATOM 1640 OE1 GLU A 836 34.690 -5.148 -23.853 1.00 0.00 O ATOM 1641 OE2 GLU A 836 35.415 -3.751 -25.323 1.00 0.00 O ATOM 0 H GLU A 836 30.538 -2.221 -21.761 1.00 0.00 H new ATOM 0 HA GLU A 836 33.043 -0.906 -22.728 1.00 0.00 H new ATOM 0 HB2 GLU A 836 33.201 -3.471 -21.739 1.00 0.00 H new ATOM 0 HB3 GLU A 836 32.606 -3.820 -23.349 1.00 0.00 H new ATOM 0 HG2 GLU A 836 34.572 -1.910 -23.872 1.00 0.00 H new ATOM 0 HG3 GLU A 836 35.262 -2.769 -22.510 1.00 0.00 H new ATOM 1648 N ALA A 837 31.691 -0.611 -24.799 1.00 0.00 N ATOM 1649 CA ALA A 837 30.853 -0.464 -26.031 1.00 0.00 C ATOM 1650 C ALA A 837 31.710 -0.417 -27.300 1.00 0.00 C ATOM 1651 O ALA A 837 32.910 -0.248 -27.252 1.00 0.00 O ATOM 1652 CB ALA A 837 30.121 0.863 -25.841 1.00 0.00 C ATOM 0 H ALA A 837 32.385 0.121 -24.650 1.00 0.00 H new ATOM 0 HA ALA A 837 30.177 -1.310 -26.157 1.00 0.00 H new ATOM 0 HB1 ALA A 837 29.480 1.052 -26.702 1.00 0.00 H new ATOM 0 HB2 ALA A 837 29.511 0.816 -24.939 1.00 0.00 H new ATOM 0 HB3 ALA A 837 30.848 1.669 -25.746 1.00 0.00 H new ATOM 1658 N VAL A 838 31.083 -0.575 -28.439 1.00 0.00 N ATOM 1659 CA VAL A 838 31.832 -0.543 -29.727 1.00 0.00 C ATOM 1660 C VAL A 838 31.473 0.739 -30.490 1.00 0.00 C ATOM 1661 O VAL A 838 30.389 0.871 -31.021 1.00 0.00 O ATOM 1662 CB VAL A 838 31.360 -1.780 -30.492 1.00 0.00 C ATOM 1663 CG1 VAL A 838 31.704 -1.629 -31.975 1.00 0.00 C ATOM 1664 CG2 VAL A 838 32.059 -3.021 -29.932 1.00 0.00 C ATOM 0 H VAL A 838 30.078 -0.726 -28.530 1.00 0.00 H new ATOM 0 HA VAL A 838 32.913 -0.548 -29.589 1.00 0.00 H new ATOM 0 HB VAL A 838 30.281 -1.885 -30.380 1.00 0.00 H new ATOM 0 HG11 VAL A 838 31.367 -2.512 -32.518 1.00 0.00 H new ATOM 0 HG12 VAL A 838 31.208 -0.745 -32.375 1.00 0.00 H new ATOM 0 HG13 VAL A 838 32.783 -1.523 -32.089 1.00 0.00 H new ATOM 0 HG21 VAL A 838 31.724 -3.904 -30.476 1.00 0.00 H new ATOM 0 HG22 VAL A 838 33.138 -2.913 -30.045 1.00 0.00 H new ATOM 0 HG23 VAL A 838 31.814 -3.131 -28.876 1.00 0.00 H new ATOM 1674 N CYS A 839 32.372 1.682 -30.549 1.00 0.00 N ATOM 1675 CA CYS A 839 32.071 2.951 -31.278 1.00 0.00 C ATOM 1676 C CYS A 839 32.862 3.027 -32.589 1.00 0.00 C ATOM 1677 O CYS A 839 33.984 2.576 -32.675 1.00 0.00 O ATOM 1678 CB CYS A 839 32.516 4.060 -30.326 1.00 0.00 C ATOM 1679 SG CYS A 839 31.124 5.156 -29.973 1.00 0.00 S ATOM 0 H CYS A 839 33.299 1.632 -30.127 1.00 0.00 H new ATOM 0 HA CYS A 839 31.017 3.028 -31.545 1.00 0.00 H new ATOM 0 HB2 CYS A 839 32.894 3.627 -29.400 1.00 0.00 H new ATOM 0 HB3 CYS A 839 33.334 4.627 -30.770 1.00 0.00 H new ATOM 1684 N SER A 840 32.282 3.605 -33.606 1.00 0.00 N ATOM 1685 CA SER A 840 32.997 3.713 -34.913 1.00 0.00 C ATOM 1686 C SER A 840 32.302 4.744 -35.810 1.00 0.00 C ATOM 1687 O SER A 840 31.099 4.912 -35.760 1.00 0.00 O ATOM 1688 CB SER A 840 32.903 2.321 -35.529 1.00 0.00 C ATOM 1689 OG SER A 840 31.668 1.723 -35.151 1.00 0.00 O ATOM 0 H SER A 840 31.345 4.007 -33.590 1.00 0.00 H new ATOM 0 HA SER A 840 34.031 4.038 -34.794 1.00 0.00 H new ATOM 0 HB2 SER A 840 32.972 2.386 -36.615 1.00 0.00 H new ATOM 0 HB3 SER A 840 33.737 1.705 -35.193 1.00 0.00 H new ATOM 0 HG SER A 840 31.603 0.829 -35.546 1.00 0.00 H new ATOM 1695 N THR A 841 33.049 5.434 -36.630 1.00 0.00 N ATOM 1696 CA THR A 841 32.429 6.454 -37.528 1.00 0.00 C ATOM 1697 C THR A 841 31.752 5.770 -38.716 1.00 0.00 C ATOM 1698 O THR A 841 31.863 4.575 -38.901 1.00 0.00 O ATOM 1699 CB THR A 841 33.592 7.325 -38.004 1.00 0.00 C ATOM 1700 OG1 THR A 841 33.114 8.282 -38.941 1.00 0.00 O ATOM 1701 CG2 THR A 841 34.650 6.445 -38.667 1.00 0.00 C ATOM 0 H THR A 841 34.061 5.336 -36.718 1.00 0.00 H new ATOM 0 HA THR A 841 31.663 7.040 -37.019 1.00 0.00 H new ATOM 0 HB THR A 841 34.033 7.841 -37.151 1.00 0.00 H new ATOM 0 HG1 THR A 841 33.858 8.842 -39.245 1.00 0.00 H new ATOM 0 HG21 THR A 841 35.479 7.066 -39.006 1.00 0.00 H new ATOM 0 HG22 THR A 841 35.016 5.712 -37.948 1.00 0.00 H new ATOM 0 HG23 THR A 841 34.211 5.928 -39.520 1.00 0.00 H new