USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 946 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 833 THR OG1 : rot -165:sc= 0.419 USER MOD Set 1.2: A 867 THR OG1 : rot 68:sc= 0.0932! USER MOD Set 2.1: A 816 MET CE :methyl 172:sc= -1.69 (180deg=-1.88) USER MOD Set 2.2: A 822 MET CE :methyl 164:sc= -0.104 (180deg=-0.511) USER MOD Set 2.3: A 887 GLN : amide:sc= 0.596 K(o=-1.2,f=-3.7) USER MOD Single : A 786 THR OG1 : rot -24:sc= 0.192 USER MOD Single : A 788 HIS : no HD1:sc= -0.168 X(o=-0.17,f=0.023) USER MOD Single : A 790 THR OG1 : rot 180:sc= 0 USER MOD Single : A 798 TYR OH : rot 81:sc= -0.32 USER MOD Single : A 800 GLN : amide:sc= 0.472 K(o=0.47,f=-1.3) USER MOD Single : A 802 THR OG1 : rot 130:sc= -1.41 USER MOD Single : A 804 THR OG1 : rot 72:sc= 0.82 USER MOD Single : A 807 THR OG1 : rot 68:sc= 1.22 USER MOD Single : A 809 THR OG1 : rot 69:sc= 1.28 USER MOD Single : A 811 ASN : amide:sc= -0.0638 K(o=-0.064,f=-1.5!) USER MOD Single : A 814 SER OG : rot 180:sc= 0 USER MOD Single : A 815 SER OG : rot 82:sc= 1.29 USER MOD Single : A 825 GLN : amide:sc= -1.53 X(o=-1.5,f=-2!) USER MOD Single : A 831 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 834 SER OG : rot 54:sc= 1.26 USER MOD Single : A 838 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 841 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 848 SER OG : rot -35:sc= 0.0411 USER MOD Single : A 852 ASN : amide:sc= -3.61! C(o=-3.6!,f=-4.2!) USER MOD Single : A 853 SER OG : rot -85:sc=-0.00713 USER MOD Single : A 855 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 858 SER OG : rot -88:sc= 1.09 USER MOD Single : A 861 LYS NZ :NH3+ -167:sc= -0.0599 (180deg=-0.344) USER MOD Single : A 869 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 870 MET CE :methyl 170:sc= -0.0344 (180deg=-0.238) USER MOD Single : A 875 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 880 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 883 SER OG : rot 180:sc= 0 USER MOD Single : A 886 GLN : amide:sc= -1.26 X(o=-1.3,f=-1.3) USER MOD Single : A 888 GLN : amide:sc= -0.343 K(o=-0.34,f=-1.5) USER MOD Single : A 899 MET CE :methyl -163:sc= -0.103 (180deg=-0.456) USER MOD Single : A 901 THR OG1 : rot 76:sc= 1.02 USER MOD Single : A 902 ASN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 906 GLN : amide:sc= -0.384 X(o=-0.38,f=-0.77) USER MOD Single : A 907 ASN : amide:sc= -0.0383 K(o=-0.038,f=-1.3!) USER MOD Single : A 910 LYS NZ :NH3+ -158:sc= -2.21! (180deg=-3.81!) USER MOD Single : A 911 LYS NZ :NH3+ 158:sc= 1.28 (180deg=0.477) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 781 1.222 -32.389 -19.785 1.00 0.00 N ATOM 2 CA GLY A 781 1.806 -32.151 -18.447 1.00 0.00 C ATOM 3 C GLY A 781 2.094 -30.685 -18.209 1.00 0.00 C ATOM 4 O GLY A 781 1.427 -29.814 -18.774 1.00 0.00 O ATOM 0 HA2 GLY A 781 1.120 -32.515 -17.682 1.00 0.00 H new ATOM 0 HA3 GLY A 781 2.728 -32.723 -18.347 1.00 0.00 H new ATOM 10 N ILE A 782 3.089 -30.404 -17.383 1.00 0.00 N ATOM 11 CA ILE A 782 3.436 -29.033 -17.047 1.00 0.00 C ATOM 12 C ILE A 782 4.631 -28.557 -17.868 1.00 0.00 C ATOM 13 O ILE A 782 5.726 -29.110 -17.767 1.00 0.00 O ATOM 14 CB ILE A 782 3.753 -28.891 -15.542 1.00 0.00 C ATOM 15 CG1 ILE A 782 2.526 -29.278 -14.709 1.00 0.00 C ATOM 16 CG2 ILE A 782 4.197 -27.470 -15.216 1.00 0.00 C ATOM 17 CD1 ILE A 782 2.760 -29.232 -13.215 1.00 0.00 C ATOM 0 H ILE A 782 3.672 -31.109 -16.932 1.00 0.00 H new ATOM 0 HA ILE A 782 2.572 -28.412 -17.283 1.00 0.00 H new ATOM 0 HB ILE A 782 4.572 -29.565 -15.293 1.00 0.00 H new ATOM 0 HG12 ILE A 782 1.703 -28.608 -14.959 1.00 0.00 H new ATOM 0 HG13 ILE A 782 2.213 -30.284 -14.987 1.00 0.00 H new ATOM 0 HG21 ILE A 782 4.415 -27.392 -14.151 1.00 0.00 H new ATOM 0 HG22 ILE A 782 5.093 -27.228 -15.788 1.00 0.00 H new ATOM 0 HG23 ILE A 782 3.401 -26.772 -15.475 1.00 0.00 H new ATOM 0 HD11 ILE A 782 1.846 -29.519 -12.695 1.00 0.00 H new ATOM 0 HD12 ILE A 782 3.560 -29.923 -12.951 1.00 0.00 H new ATOM 0 HD13 ILE A 782 3.043 -28.221 -12.922 1.00 0.00 H new ATOM 29 N ASP A 783 4.405 -27.544 -18.695 1.00 0.00 N ATOM 30 CA ASP A 783 5.473 -26.952 -19.492 1.00 0.00 C ATOM 31 C ASP A 783 6.314 -26.018 -18.629 1.00 0.00 C ATOM 32 O ASP A 783 5.796 -25.058 -18.060 1.00 0.00 O ATOM 33 CB ASP A 783 4.884 -26.192 -20.685 1.00 0.00 C ATOM 34 CG ASP A 783 5.939 -25.461 -21.491 1.00 0.00 C ATOM 35 OD1 ASP A 783 6.752 -26.131 -22.155 1.00 0.00 O ATOM 36 OD2 ASP A 783 5.960 -24.211 -21.464 1.00 0.00 O ATOM 0 H ASP A 783 3.490 -27.114 -18.832 1.00 0.00 H new ATOM 0 HA ASP A 783 6.114 -27.748 -19.871 1.00 0.00 H new ATOM 0 HB2 ASP A 783 4.358 -26.893 -21.333 1.00 0.00 H new ATOM 0 HB3 ASP A 783 4.146 -25.475 -20.325 1.00 0.00 H new ATOM 41 N PRO A 784 7.617 -26.303 -18.501 1.00 0.00 N ATOM 42 CA PRO A 784 8.526 -25.538 -17.641 1.00 0.00 C ATOM 43 C PRO A 784 8.886 -24.168 -18.218 1.00 0.00 C ATOM 44 O PRO A 784 8.497 -23.831 -19.342 1.00 0.00 O ATOM 45 CB PRO A 784 9.783 -26.421 -17.556 1.00 0.00 C ATOM 46 CG PRO A 784 9.424 -27.715 -18.216 1.00 0.00 C ATOM 47 CD PRO A 784 8.315 -27.402 -19.175 1.00 0.00 C ATOM 0 HA PRO A 784 8.066 -25.326 -16.676 1.00 0.00 H new ATOM 0 HB2 PRO A 784 10.627 -25.948 -18.058 1.00 0.00 H new ATOM 0 HB3 PRO A 784 10.078 -26.581 -16.519 1.00 0.00 H new ATOM 0 HG2 PRO A 784 10.283 -28.137 -18.738 1.00 0.00 H new ATOM 0 HG3 PRO A 784 9.105 -28.452 -17.479 1.00 0.00 H new ATOM 0 HD2 PRO A 784 8.695 -27.103 -20.152 1.00 0.00 H new ATOM 0 HD3 PRO A 784 7.662 -28.260 -19.335 1.00 0.00 H new ATOM 55 N PHE A 785 9.619 -23.382 -17.421 1.00 0.00 N ATOM 56 CA PHE A 785 10.144 -22.069 -17.824 1.00 0.00 C ATOM 57 C PHE A 785 9.068 -20.976 -17.821 1.00 0.00 C ATOM 58 O PHE A 785 9.356 -19.823 -17.501 1.00 0.00 O ATOM 59 CB PHE A 785 10.831 -22.140 -19.196 1.00 0.00 C ATOM 60 CG PHE A 785 11.411 -20.830 -19.650 1.00 0.00 C ATOM 61 CD1 PHE A 785 12.535 -20.306 -19.034 1.00 0.00 C ATOM 62 CD2 PHE A 785 10.829 -20.122 -20.689 1.00 0.00 C ATOM 63 CE1 PHE A 785 13.069 -19.100 -19.445 1.00 0.00 C ATOM 64 CE2 PHE A 785 11.358 -18.916 -21.106 1.00 0.00 C ATOM 65 CZ PHE A 785 12.479 -18.404 -20.482 1.00 0.00 C ATOM 0 H PHE A 785 9.868 -23.641 -16.467 1.00 0.00 H new ATOM 0 HA PHE A 785 10.886 -21.794 -17.075 1.00 0.00 H new ATOM 0 HB2 PHE A 785 11.626 -22.885 -19.156 1.00 0.00 H new ATOM 0 HB3 PHE A 785 10.109 -22.484 -19.937 1.00 0.00 H new ATOM 0 HD1 PHE A 785 13.000 -20.847 -18.223 1.00 0.00 H new ATOM 0 HD2 PHE A 785 9.951 -20.518 -21.179 1.00 0.00 H new ATOM 0 HE1 PHE A 785 13.946 -18.702 -18.956 1.00 0.00 H new ATOM 0 HE2 PHE A 785 10.896 -18.374 -21.918 1.00 0.00 H new ATOM 0 HZ PHE A 785 12.894 -17.460 -20.805 1.00 0.00 H new ATOM 75 N THR A 786 7.834 -21.331 -18.158 1.00 0.00 N ATOM 76 CA THR A 786 6.756 -20.349 -18.236 1.00 0.00 C ATOM 77 C THR A 786 6.317 -19.900 -16.837 1.00 0.00 C ATOM 78 O THR A 786 5.574 -18.931 -16.685 1.00 0.00 O ATOM 79 CB THR A 786 5.545 -20.903 -19.026 1.00 0.00 C ATOM 80 OG1 THR A 786 4.598 -19.859 -19.302 1.00 0.00 O ATOM 81 CG2 THR A 786 4.857 -22.021 -18.260 1.00 0.00 C ATOM 0 H THR A 786 7.554 -22.286 -18.381 1.00 0.00 H new ATOM 0 HA THR A 786 7.144 -19.482 -18.771 1.00 0.00 H new ATOM 0 HB THR A 786 5.923 -21.303 -19.967 1.00 0.00 H new ATOM 0 HG1 THR A 786 4.704 -19.139 -18.646 1.00 0.00 H new ATOM 0 HG21 THR A 786 4.010 -22.391 -18.838 1.00 0.00 H new ATOM 0 HG22 THR A 786 5.563 -22.834 -18.090 1.00 0.00 H new ATOM 0 HG23 THR A 786 4.503 -21.641 -17.301 1.00 0.00 H new ATOM 89 N ALA A 787 6.791 -20.606 -15.821 1.00 0.00 N ATOM 90 CA ALA A 787 6.511 -20.246 -14.440 1.00 0.00 C ATOM 91 C ALA A 787 7.382 -19.070 -14.013 1.00 0.00 C ATOM 92 O ALA A 787 8.610 -19.168 -14.006 1.00 0.00 O ATOM 93 CB ALA A 787 6.747 -21.439 -13.527 1.00 0.00 C ATOM 0 H ALA A 787 7.374 -21.436 -15.929 1.00 0.00 H new ATOM 0 HA ALA A 787 5.465 -19.949 -14.361 1.00 0.00 H new ATOM 0 HB1 ALA A 787 6.534 -21.156 -12.496 1.00 0.00 H new ATOM 0 HB2 ALA A 787 6.091 -22.258 -13.822 1.00 0.00 H new ATOM 0 HB3 ALA A 787 7.786 -21.759 -13.608 1.00 0.00 H new ATOM 99 N HIS A 788 6.749 -17.956 -13.675 1.00 0.00 N ATOM 100 CA HIS A 788 7.484 -16.765 -13.267 1.00 0.00 C ATOM 101 C HIS A 788 7.656 -16.743 -11.754 1.00 0.00 C ATOM 102 O HIS A 788 6.999 -17.499 -11.037 1.00 0.00 O ATOM 103 CB HIS A 788 6.772 -15.487 -13.750 1.00 0.00 C ATOM 104 CG HIS A 788 5.562 -15.087 -12.948 1.00 0.00 C ATOM 105 ND1 HIS A 788 4.320 -15.659 -13.109 1.00 0.00 N ATOM 106 CD2 HIS A 788 5.416 -14.152 -11.979 1.00 0.00 C ATOM 107 CE1 HIS A 788 3.465 -15.094 -12.276 1.00 0.00 C ATOM 108 NE2 HIS A 788 4.105 -14.175 -11.578 1.00 0.00 N ATOM 0 H HIS A 788 5.734 -17.851 -13.675 1.00 0.00 H new ATOM 0 HA HIS A 788 8.471 -16.796 -13.730 1.00 0.00 H new ATOM 0 HB2 HIS A 788 7.487 -14.664 -13.735 1.00 0.00 H new ATOM 0 HB3 HIS A 788 6.470 -15.628 -14.788 1.00 0.00 H new ATOM 0 HD2 HIS A 788 6.191 -13.506 -11.593 1.00 0.00 H new ATOM 0 HE1 HIS A 788 2.418 -15.342 -12.182 1.00 0.00 H new ATOM 0 HE2 HIS A 788 3.693 -13.580 -10.859 1.00 0.00 H new ATOM 116 N ALA A 789 8.531 -15.875 -11.271 1.00 0.00 N ATOM 117 CA ALA A 789 8.761 -15.736 -9.842 1.00 0.00 C ATOM 118 C ALA A 789 8.004 -14.531 -9.292 1.00 0.00 C ATOM 119 O ALA A 789 7.793 -13.546 -10.000 1.00 0.00 O ATOM 120 CB ALA A 789 10.249 -15.604 -9.555 1.00 0.00 C ATOM 0 H ALA A 789 9.096 -15.254 -11.851 1.00 0.00 H new ATOM 0 HA ALA A 789 8.390 -16.632 -9.345 1.00 0.00 H new ATOM 0 HB1 ALA A 789 10.405 -15.501 -8.481 1.00 0.00 H new ATOM 0 HB2 ALA A 789 10.769 -16.493 -9.913 1.00 0.00 H new ATOM 0 HB3 ALA A 789 10.641 -14.724 -10.065 1.00 0.00 H new ATOM 126 N THR A 790 7.590 -14.618 -8.037 1.00 0.00 N ATOM 127 CA THR A 790 6.858 -13.536 -7.396 1.00 0.00 C ATOM 128 C THR A 790 7.820 -12.602 -6.671 1.00 0.00 C ATOM 129 O THR A 790 7.608 -11.389 -6.613 1.00 0.00 O ATOM 130 CB THR A 790 5.831 -14.082 -6.385 1.00 0.00 C ATOM 131 OG1 THR A 790 5.026 -15.096 -7.001 1.00 0.00 O ATOM 132 CG2 THR A 790 4.936 -12.970 -5.862 1.00 0.00 C ATOM 0 H THR A 790 7.749 -15.430 -7.440 1.00 0.00 H new ATOM 0 HA THR A 790 6.330 -12.988 -8.176 1.00 0.00 H new ATOM 0 HB THR A 790 6.379 -14.510 -5.546 1.00 0.00 H new ATOM 0 HG1 THR A 790 4.377 -15.439 -6.351 1.00 0.00 H new ATOM 0 HG21 THR A 790 4.221 -13.383 -5.151 1.00 0.00 H new ATOM 0 HG22 THR A 790 5.546 -12.215 -5.366 1.00 0.00 H new ATOM 0 HG23 THR A 790 4.399 -12.514 -6.694 1.00 0.00 H new ATOM 140 N GLY A 791 8.875 -13.179 -6.115 1.00 0.00 N ATOM 141 CA GLY A 791 9.845 -12.397 -5.384 1.00 0.00 C ATOM 142 C GLY A 791 9.671 -12.543 -3.889 1.00 0.00 C ATOM 143 O GLY A 791 10.275 -13.425 -3.274 1.00 0.00 O ATOM 0 H GLY A 791 9.075 -14.178 -6.158 1.00 0.00 H new ATOM 0 HA2 GLY A 791 10.851 -12.710 -5.665 1.00 0.00 H new ATOM 0 HA3 GLY A 791 9.749 -11.347 -5.661 1.00 0.00 H new ATOM 147 N ALA A 792 8.834 -11.678 -3.312 1.00 0.00 N ATOM 148 CA ALA A 792 8.546 -11.696 -1.877 1.00 0.00 C ATOM 149 C ALA A 792 9.808 -11.426 -1.061 1.00 0.00 C ATOM 150 O ALA A 792 9.924 -11.845 0.094 1.00 0.00 O ATOM 151 CB ALA A 792 7.912 -13.023 -1.475 1.00 0.00 C ATOM 0 H ALA A 792 8.339 -10.948 -3.824 1.00 0.00 H new ATOM 0 HA ALA A 792 7.835 -10.898 -1.664 1.00 0.00 H new ATOM 0 HB1 ALA A 792 7.705 -13.018 -0.405 1.00 0.00 H new ATOM 0 HB2 ALA A 792 6.981 -13.162 -2.024 1.00 0.00 H new ATOM 0 HB3 ALA A 792 8.596 -13.839 -1.708 1.00 0.00 H new ATOM 157 N GLY A 793 10.738 -10.705 -1.667 1.00 0.00 N ATOM 158 CA GLY A 793 11.978 -10.360 -1.009 1.00 0.00 C ATOM 159 C GLY A 793 12.475 -9.011 -1.473 1.00 0.00 C ATOM 160 O GLY A 793 12.180 -8.614 -2.597 1.00 0.00 O ATOM 0 H GLY A 793 10.652 -10.348 -2.619 1.00 0.00 H new ATOM 0 HA2 GLY A 793 11.830 -10.346 0.071 1.00 0.00 H new ATOM 0 HA3 GLY A 793 12.730 -11.121 -1.218 1.00 0.00 H new ATOM 164 N PRO A 794 13.223 -8.281 -0.634 1.00 0.00 N ATOM 165 CA PRO A 794 13.685 -6.928 -0.960 1.00 0.00 C ATOM 166 C PRO A 794 14.667 -6.913 -2.128 1.00 0.00 C ATOM 167 O PRO A 794 15.829 -7.303 -1.989 1.00 0.00 O ATOM 168 CB PRO A 794 14.374 -6.449 0.325 1.00 0.00 C ATOM 169 CG PRO A 794 13.947 -7.406 1.388 1.00 0.00 C ATOM 170 CD PRO A 794 13.683 -8.709 0.692 1.00 0.00 C ATOM 0 HA PRO A 794 12.859 -6.290 -1.273 1.00 0.00 H new ATOM 0 HB2 PRO A 794 15.458 -6.447 0.211 1.00 0.00 H new ATOM 0 HB3 PRO A 794 14.077 -5.430 0.573 1.00 0.00 H new ATOM 0 HG2 PRO A 794 14.723 -7.519 2.146 1.00 0.00 H new ATOM 0 HG3 PRO A 794 13.053 -7.048 1.898 1.00 0.00 H new ATOM 0 HD2 PRO A 794 14.581 -9.324 0.630 1.00 0.00 H new ATOM 0 HD3 PRO A 794 12.928 -9.299 1.211 1.00 0.00 H new ATOM 178 N ALA A 795 14.185 -6.483 -3.282 1.00 0.00 N ATOM 179 CA ALA A 795 15.013 -6.381 -4.472 1.00 0.00 C ATOM 180 C ALA A 795 15.261 -4.929 -4.824 1.00 0.00 C ATOM 181 O ALA A 795 15.828 -4.603 -5.869 1.00 0.00 O ATOM 182 CB ALA A 795 14.357 -7.109 -5.631 1.00 0.00 C ATOM 0 H ALA A 795 13.216 -6.197 -3.420 1.00 0.00 H new ATOM 0 HA ALA A 795 15.975 -6.850 -4.269 1.00 0.00 H new ATOM 0 HB1 ALA A 795 14.987 -7.025 -6.517 1.00 0.00 H new ATOM 0 HB2 ALA A 795 14.229 -8.161 -5.375 1.00 0.00 H new ATOM 0 HB3 ALA A 795 13.383 -6.665 -5.835 1.00 0.00 H new ATOM 188 N GLY A 796 14.845 -4.071 -3.927 1.00 0.00 N ATOM 189 CA GLY A 796 14.980 -2.645 -4.125 1.00 0.00 C ATOM 190 C GLY A 796 14.946 -1.881 -2.820 1.00 0.00 C ATOM 191 O GLY A 796 15.935 -1.251 -2.442 1.00 0.00 O ATOM 0 H GLY A 796 14.406 -4.335 -3.045 1.00 0.00 H new ATOM 0 HA2 GLY A 796 15.918 -2.439 -4.640 1.00 0.00 H new ATOM 0 HA3 GLY A 796 14.177 -2.292 -4.772 1.00 0.00 H new ATOM 195 N ARG A 797 13.816 -1.952 -2.117 1.00 0.00 N ATOM 196 CA ARG A 797 13.643 -1.227 -0.864 1.00 0.00 C ATOM 197 C ARG A 797 12.269 -1.514 -0.254 1.00 0.00 C ATOM 198 O ARG A 797 12.166 -2.194 0.766 1.00 0.00 O ATOM 199 CB ARG A 797 13.819 0.279 -1.091 1.00 0.00 C ATOM 200 CG ARG A 797 14.200 1.054 0.161 1.00 0.00 C ATOM 201 CD ARG A 797 15.393 0.426 0.870 1.00 0.00 C ATOM 202 NE ARG A 797 16.471 0.061 -0.055 1.00 0.00 N ATOM 203 CZ ARG A 797 17.765 0.056 0.266 1.00 0.00 C ATOM 204 NH1 ARG A 797 18.166 0.485 1.454 1.00 0.00 N ATOM 205 NH2 ARG A 797 18.664 -0.382 -0.610 1.00 0.00 N ATOM 0 H ARG A 797 13.007 -2.506 -2.397 1.00 0.00 H new ATOM 0 HA ARG A 797 14.406 -1.569 -0.165 1.00 0.00 H new ATOM 0 HB2 ARG A 797 14.586 0.434 -1.849 1.00 0.00 H new ATOM 0 HB3 ARG A 797 12.890 0.687 -1.489 1.00 0.00 H new ATOM 0 HG2 ARG A 797 14.436 2.084 -0.106 1.00 0.00 H new ATOM 0 HG3 ARG A 797 13.349 1.088 0.841 1.00 0.00 H new ATOM 0 HD2 ARG A 797 15.778 1.124 1.613 1.00 0.00 H new ATOM 0 HD3 ARG A 797 15.064 -0.463 1.408 1.00 0.00 H new ATOM 0 HE ARG A 797 16.214 -0.206 -1.005 1.00 0.00 H new ATOM 0 HH11 ARG A 797 17.483 0.823 2.132 1.00 0.00 H new ATOM 0 HH12 ARG A 797 19.158 0.477 1.691 1.00 0.00 H new ATOM 0 HH21 ARG A 797 18.363 -0.714 -1.527 1.00 0.00 H new ATOM 0 HH22 ARG A 797 19.654 -0.386 -0.366 1.00 0.00 H new ATOM 219 N TYR A 798 11.212 -1.010 -0.888 1.00 0.00 N ATOM 220 CA TYR A 798 9.859 -1.186 -0.363 1.00 0.00 C ATOM 221 C TYR A 798 9.130 -2.285 -1.125 1.00 0.00 C ATOM 222 O TYR A 798 7.981 -2.589 -0.828 1.00 0.00 O ATOM 223 CB TYR A 798 9.028 0.098 -0.486 1.00 0.00 C ATOM 224 CG TYR A 798 9.761 1.387 -0.191 1.00 0.00 C ATOM 225 CD1 TYR A 798 10.492 1.512 0.980 1.00 0.00 C ATOM 226 CD2 TYR A 798 9.748 2.458 -1.076 1.00 0.00 C ATOM 227 CE1 TYR A 798 11.185 2.666 1.271 1.00 0.00 C ATOM 228 CE2 TYR A 798 10.444 3.620 -0.792 1.00 0.00 C ATOM 229 CZ TYR A 798 11.050 3.795 0.317 1.00 0.00 C ATOM 230 OH TYR A 798 11.865 4.858 0.674 1.00 0.00 O ATOM 0 H TYR A 798 11.265 -0.481 -1.758 1.00 0.00 H new ATOM 0 HA TYR A 798 9.965 -1.450 0.689 1.00 0.00 H new ATOM 0 HB2 TYR A 798 8.627 0.153 -1.498 1.00 0.00 H new ATOM 0 HB3 TYR A 798 8.176 0.023 0.190 1.00 0.00 H new ATOM 0 HD1 TYR A 798 10.519 0.688 1.678 1.00 0.00 H new ATOM 0 HD2 TYR A 798 9.188 2.383 -1.996 1.00 0.00 H new ATOM 0 HE1 TYR A 798 11.800 2.746 2.155 1.00 0.00 H new ATOM 0 HE2 TYR A 798 10.475 4.405 -1.534 1.00 0.00 H new ATOM 0 HH TYR A 798 12.779 4.687 0.365 1.00 0.00 H new ATOM 240 N ASP A 799 9.826 -2.900 -2.072 1.00 0.00 N ATOM 241 CA ASP A 799 9.197 -3.768 -3.064 1.00 0.00 C ATOM 242 C ASP A 799 8.626 -5.039 -2.443 1.00 0.00 C ATOM 243 O ASP A 799 7.668 -5.612 -2.961 1.00 0.00 O ATOM 244 CB ASP A 799 10.217 -4.128 -4.138 1.00 0.00 C ATOM 245 CG ASP A 799 11.451 -4.769 -3.542 1.00 0.00 C ATOM 246 OD1 ASP A 799 12.246 -4.049 -2.892 1.00 0.00 O ATOM 247 OD2 ASP A 799 11.629 -5.987 -3.708 1.00 0.00 O ATOM 0 H ASP A 799 10.837 -2.813 -2.176 1.00 0.00 H new ATOM 0 HA ASP A 799 8.362 -3.222 -3.503 1.00 0.00 H new ATOM 0 HB2 ASP A 799 9.763 -4.810 -4.857 1.00 0.00 H new ATOM 0 HB3 ASP A 799 10.502 -3.230 -4.686 1.00 0.00 H new ATOM 252 N GLN A 800 9.207 -5.478 -1.338 1.00 0.00 N ATOM 253 CA GLN A 800 8.710 -6.654 -0.641 1.00 0.00 C ATOM 254 C GLN A 800 7.395 -6.324 0.062 1.00 0.00 C ATOM 255 O GLN A 800 6.417 -7.074 -0.021 1.00 0.00 O ATOM 256 CB GLN A 800 9.739 -7.149 0.374 1.00 0.00 C ATOM 257 CG GLN A 800 9.349 -8.451 1.051 1.00 0.00 C ATOM 258 CD GLN A 800 10.320 -8.854 2.140 1.00 0.00 C ATOM 259 OE1 GLN A 800 10.925 -8.005 2.797 1.00 0.00 O ATOM 260 NE2 GLN A 800 10.489 -10.150 2.329 1.00 0.00 N ATOM 0 H GLN A 800 10.020 -5.040 -0.905 1.00 0.00 H new ATOM 0 HA GLN A 800 8.536 -7.445 -1.370 1.00 0.00 H new ATOM 0 HB2 GLN A 800 10.697 -7.283 -0.129 1.00 0.00 H new ATOM 0 HB3 GLN A 800 9.883 -6.383 1.135 1.00 0.00 H new ATOM 0 HG2 GLN A 800 8.351 -8.350 1.478 1.00 0.00 H new ATOM 0 HG3 GLN A 800 9.297 -9.243 0.304 1.00 0.00 H new ATOM 0 HE21 GLN A 800 9.968 -10.820 1.763 1.00 0.00 H new ATOM 0 HE22 GLN A 800 11.140 -10.481 3.041 1.00 0.00 H new ATOM 269 N ALA A 801 7.377 -5.186 0.739 1.00 0.00 N ATOM 270 CA ALA A 801 6.205 -4.760 1.484 1.00 0.00 C ATOM 271 C ALA A 801 5.100 -4.281 0.549 1.00 0.00 C ATOM 272 O ALA A 801 3.921 -4.557 0.781 1.00 0.00 O ATOM 273 CB ALA A 801 6.579 -3.675 2.478 1.00 0.00 C ATOM 0 H ALA A 801 8.165 -4.540 0.787 1.00 0.00 H new ATOM 0 HA ALA A 801 5.821 -5.619 2.035 1.00 0.00 H new ATOM 0 HB1 ALA A 801 5.691 -3.365 3.029 1.00 0.00 H new ATOM 0 HB2 ALA A 801 7.323 -4.061 3.175 1.00 0.00 H new ATOM 0 HB3 ALA A 801 6.992 -2.819 1.944 1.00 0.00 H new ATOM 279 N THR A 802 5.479 -3.578 -0.514 1.00 0.00 N ATOM 280 CA THR A 802 4.505 -3.077 -1.472 1.00 0.00 C ATOM 281 C THR A 802 3.792 -4.224 -2.168 1.00 0.00 C ATOM 282 O THR A 802 2.566 -4.236 -2.238 1.00 0.00 O ATOM 283 CB THR A 802 5.143 -2.155 -2.531 1.00 0.00 C ATOM 284 OG1 THR A 802 6.271 -2.797 -3.132 1.00 0.00 O ATOM 285 CG2 THR A 802 5.566 -0.829 -1.919 1.00 0.00 C ATOM 0 H THR A 802 6.448 -3.345 -0.731 1.00 0.00 H new ATOM 0 HA THR A 802 3.786 -2.489 -0.902 1.00 0.00 H new ATOM 0 HB THR A 802 4.394 -1.955 -3.298 1.00 0.00 H new ATOM 0 HG1 THR A 802 6.195 -2.746 -4.108 1.00 0.00 H new ATOM 0 HG21 THR A 802 6.013 -0.199 -2.688 1.00 0.00 H new ATOM 0 HG22 THR A 802 4.694 -0.327 -1.500 1.00 0.00 H new ATOM 0 HG23 THR A 802 6.295 -1.009 -1.129 1.00 0.00 H new ATOM 293 N ASP A 803 4.559 -5.199 -2.659 1.00 0.00 N ATOM 294 CA ASP A 803 3.981 -6.349 -3.356 1.00 0.00 C ATOM 295 C ASP A 803 2.959 -7.039 -2.466 1.00 0.00 C ATOM 296 O ASP A 803 1.934 -7.528 -2.940 1.00 0.00 O ATOM 297 CB ASP A 803 5.066 -7.346 -3.768 1.00 0.00 C ATOM 298 CG ASP A 803 4.533 -8.426 -4.694 1.00 0.00 C ATOM 299 OD1 ASP A 803 4.559 -8.231 -5.925 1.00 0.00 O ATOM 300 OD2 ASP A 803 4.084 -9.477 -4.189 1.00 0.00 O ATOM 0 H ASP A 803 5.576 -5.216 -2.588 1.00 0.00 H new ATOM 0 HA ASP A 803 3.489 -5.985 -4.258 1.00 0.00 H new ATOM 0 HB2 ASP A 803 5.877 -6.813 -4.264 1.00 0.00 H new ATOM 0 HB3 ASP A 803 5.488 -7.810 -2.876 1.00 0.00 H new ATOM 305 N THR A 804 3.237 -7.051 -1.168 1.00 0.00 N ATOM 306 CA THR A 804 2.297 -7.571 -0.193 1.00 0.00 C ATOM 307 C THR A 804 0.987 -6.785 -0.254 1.00 0.00 C ATOM 308 O THR A 804 -0.082 -7.363 -0.448 1.00 0.00 O ATOM 309 CB THR A 804 2.875 -7.507 1.234 1.00 0.00 C ATOM 310 OG1 THR A 804 4.139 -8.186 1.282 1.00 0.00 O ATOM 311 CG2 THR A 804 1.918 -8.137 2.236 1.00 0.00 C ATOM 0 H THR A 804 4.110 -6.705 -0.769 1.00 0.00 H new ATOM 0 HA THR A 804 2.107 -8.616 -0.438 1.00 0.00 H new ATOM 0 HB THR A 804 3.014 -6.459 1.499 1.00 0.00 H new ATOM 0 HG1 THR A 804 4.814 -7.654 0.812 1.00 0.00 H new ATOM 0 HG21 THR A 804 2.348 -8.080 3.236 1.00 0.00 H new ATOM 0 HG22 THR A 804 0.969 -7.602 2.218 1.00 0.00 H new ATOM 0 HG23 THR A 804 1.751 -9.181 1.972 1.00 0.00 H new ATOM 319 N ILE A 805 1.081 -5.462 -0.125 1.00 0.00 N ATOM 320 CA ILE A 805 -0.094 -4.596 -0.187 1.00 0.00 C ATOM 321 C ILE A 805 -0.828 -4.761 -1.521 1.00 0.00 C ATOM 322 O ILE A 805 -2.043 -4.950 -1.538 1.00 0.00 O ATOM 323 CB ILE A 805 0.273 -3.107 0.014 1.00 0.00 C ATOM 324 CG1 ILE A 805 0.765 -2.860 1.445 1.00 0.00 C ATOM 325 CG2 ILE A 805 -0.918 -2.210 -0.306 1.00 0.00 C ATOM 326 CD1 ILE A 805 1.181 -1.429 1.703 1.00 0.00 C ATOM 0 H ILE A 805 1.960 -4.967 0.023 1.00 0.00 H new ATOM 0 HA ILE A 805 -0.750 -4.902 0.628 1.00 0.00 H new ATOM 0 HB ILE A 805 1.081 -2.860 -0.674 1.00 0.00 H new ATOM 0 HG12 ILE A 805 -0.026 -3.131 2.144 1.00 0.00 H new ATOM 0 HG13 ILE A 805 1.610 -3.518 1.648 1.00 0.00 H new ATOM 0 HG21 ILE A 805 -0.638 -1.167 -0.158 1.00 0.00 H new ATOM 0 HG22 ILE A 805 -1.219 -2.361 -1.343 1.00 0.00 H new ATOM 0 HG23 ILE A 805 -1.749 -2.460 0.354 1.00 0.00 H new ATOM 0 HD11 ILE A 805 1.517 -1.328 2.735 1.00 0.00 H new ATOM 0 HD12 ILE A 805 1.993 -1.159 1.028 1.00 0.00 H new ATOM 0 HD13 ILE A 805 0.332 -0.767 1.532 1.00 0.00 H new ATOM 338 N LEU A 806 -0.087 -4.701 -2.629 1.00 0.00 N ATOM 339 CA LEU A 806 -0.677 -4.871 -3.960 1.00 0.00 C ATOM 340 C LEU A 806 -1.484 -6.167 -4.036 1.00 0.00 C ATOM 341 O LEU A 806 -2.631 -6.173 -4.486 1.00 0.00 O ATOM 342 CB LEU A 806 0.397 -4.875 -5.060 1.00 0.00 C ATOM 343 CG LEU A 806 0.809 -3.500 -5.613 1.00 0.00 C ATOM 344 CD1 LEU A 806 -0.405 -2.612 -5.814 1.00 0.00 C ATOM 345 CD2 LEU A 806 1.822 -2.818 -4.715 1.00 0.00 C ATOM 0 H LEU A 806 0.920 -4.537 -2.632 1.00 0.00 H new ATOM 0 HA LEU A 806 -1.340 -4.022 -4.125 1.00 0.00 H new ATOM 0 HB2 LEU A 806 1.287 -5.367 -4.668 1.00 0.00 H new ATOM 0 HB3 LEU A 806 0.036 -5.483 -5.889 1.00 0.00 H new ATOM 0 HG LEU A 806 1.281 -3.667 -6.581 1.00 0.00 H new ATOM 0 HD11 LEU A 806 -0.088 -1.645 -6.206 1.00 0.00 H new ATOM 0 HD12 LEU A 806 -1.088 -3.084 -6.521 1.00 0.00 H new ATOM 0 HD13 LEU A 806 -0.913 -2.468 -4.860 1.00 0.00 H new ATOM 0 HD21 LEU A 806 2.089 -1.850 -5.138 1.00 0.00 H new ATOM 0 HD22 LEU A 806 1.392 -2.675 -3.724 1.00 0.00 H new ATOM 0 HD23 LEU A 806 2.715 -3.438 -4.637 1.00 0.00 H new ATOM 357 N THR A 807 -0.883 -7.253 -3.562 1.00 0.00 N ATOM 358 CA THR A 807 -1.509 -8.564 -3.614 1.00 0.00 C ATOM 359 C THR A 807 -2.723 -8.648 -2.685 1.00 0.00 C ATOM 360 O THR A 807 -3.742 -9.231 -3.042 1.00 0.00 O ATOM 361 CB THR A 807 -0.492 -9.664 -3.258 1.00 0.00 C ATOM 362 OG1 THR A 807 0.658 -9.541 -4.107 1.00 0.00 O ATOM 363 CG2 THR A 807 -1.097 -11.050 -3.424 1.00 0.00 C ATOM 0 H THR A 807 0.043 -7.248 -3.135 1.00 0.00 H new ATOM 0 HA THR A 807 -1.857 -8.719 -4.635 1.00 0.00 H new ATOM 0 HB THR A 807 -0.205 -9.540 -2.214 1.00 0.00 H new ATOM 0 HG1 THR A 807 1.144 -8.720 -3.883 1.00 0.00 H new ATOM 0 HG21 THR A 807 -0.354 -11.805 -3.165 1.00 0.00 H new ATOM 0 HG22 THR A 807 -1.961 -11.151 -2.767 1.00 0.00 H new ATOM 0 HG23 THR A 807 -1.410 -11.189 -4.459 1.00 0.00 H new ATOM 371 N VAL A 808 -2.623 -8.058 -1.501 1.00 0.00 N ATOM 372 CA VAL A 808 -3.753 -8.047 -0.578 1.00 0.00 C ATOM 373 C VAL A 808 -4.896 -7.214 -1.157 1.00 0.00 C ATOM 374 O VAL A 808 -6.060 -7.599 -1.063 1.00 0.00 O ATOM 375 CB VAL A 808 -3.364 -7.504 0.818 1.00 0.00 C ATOM 376 CG1 VAL A 808 -4.577 -7.445 1.739 1.00 0.00 C ATOM 377 CG2 VAL A 808 -2.275 -8.363 1.442 1.00 0.00 C ATOM 0 H VAL A 808 -1.785 -7.587 -1.160 1.00 0.00 H new ATOM 0 HA VAL A 808 -4.076 -9.080 -0.451 1.00 0.00 H new ATOM 0 HB VAL A 808 -2.982 -6.492 0.688 1.00 0.00 H new ATOM 0 HG11 VAL A 808 -4.276 -7.060 2.713 1.00 0.00 H new ATOM 0 HG12 VAL A 808 -5.331 -6.787 1.306 1.00 0.00 H new ATOM 0 HG13 VAL A 808 -4.993 -8.445 1.857 1.00 0.00 H new ATOM 0 HG21 VAL A 808 -2.015 -7.965 2.423 1.00 0.00 H new ATOM 0 HG22 VAL A 808 -2.635 -9.386 1.549 1.00 0.00 H new ATOM 0 HG23 VAL A 808 -1.393 -8.354 0.802 1.00 0.00 H new ATOM 387 N THR A 809 -4.542 -6.094 -1.780 1.00 0.00 N ATOM 388 CA THR A 809 -5.512 -5.186 -2.385 1.00 0.00 C ATOM 389 C THR A 809 -6.408 -5.901 -3.397 1.00 0.00 C ATOM 390 O THR A 809 -7.637 -5.871 -3.284 1.00 0.00 O ATOM 391 CB THR A 809 -4.804 -4.019 -3.095 1.00 0.00 C ATOM 392 OG1 THR A 809 -4.027 -3.271 -2.154 1.00 0.00 O ATOM 393 CG2 THR A 809 -5.811 -3.106 -3.777 1.00 0.00 C ATOM 0 H THR A 809 -3.574 -5.790 -1.880 1.00 0.00 H new ATOM 0 HA THR A 809 -6.130 -4.806 -1.572 1.00 0.00 H new ATOM 0 HB THR A 809 -4.145 -4.434 -3.858 1.00 0.00 H new ATOM 0 HG1 THR A 809 -3.271 -3.815 -1.848 1.00 0.00 H new ATOM 0 HG21 THR A 809 -5.285 -2.289 -4.271 1.00 0.00 H new ATOM 0 HG22 THR A 809 -6.375 -3.675 -4.516 1.00 0.00 H new ATOM 0 HG23 THR A 809 -6.495 -2.699 -3.033 1.00 0.00 H new ATOM 401 N GLU A 810 -5.788 -6.551 -4.375 1.00 0.00 N ATOM 402 CA GLU A 810 -6.525 -7.244 -5.424 1.00 0.00 C ATOM 403 C GLU A 810 -7.419 -8.331 -4.832 1.00 0.00 C ATOM 404 O GLU A 810 -8.450 -8.684 -5.404 1.00 0.00 O ATOM 405 CB GLU A 810 -5.556 -7.830 -6.460 1.00 0.00 C ATOM 406 CG GLU A 810 -4.465 -8.700 -5.857 1.00 0.00 C ATOM 407 CD GLU A 810 -3.422 -9.137 -6.866 1.00 0.00 C ATOM 408 OE1 GLU A 810 -2.569 -8.305 -7.247 1.00 0.00 O ATOM 409 OE2 GLU A 810 -3.436 -10.319 -7.269 1.00 0.00 O ATOM 0 H GLU A 810 -4.774 -6.612 -4.463 1.00 0.00 H new ATOM 0 HA GLU A 810 -7.168 -6.523 -5.928 1.00 0.00 H new ATOM 0 HB2 GLU A 810 -6.122 -8.421 -7.180 1.00 0.00 H new ATOM 0 HB3 GLU A 810 -5.092 -7.013 -7.013 1.00 0.00 H new ATOM 0 HG2 GLU A 810 -3.975 -8.151 -5.053 1.00 0.00 H new ATOM 0 HG3 GLU A 810 -4.920 -9.583 -5.409 1.00 0.00 H new ATOM 416 N ASN A 811 -7.036 -8.835 -3.666 1.00 0.00 N ATOM 417 CA ASN A 811 -7.777 -9.907 -3.023 1.00 0.00 C ATOM 418 C ASN A 811 -9.118 -9.435 -2.470 1.00 0.00 C ATOM 419 O ASN A 811 -10.014 -10.249 -2.269 1.00 0.00 O ATOM 420 CB ASN A 811 -6.955 -10.574 -1.917 1.00 0.00 C ATOM 421 CG ASN A 811 -5.814 -11.404 -2.470 1.00 0.00 C ATOM 422 OD1 ASN A 811 -5.861 -11.859 -3.613 1.00 0.00 O ATOM 423 ND2 ASN A 811 -4.789 -11.623 -1.659 1.00 0.00 N ATOM 0 H ASN A 811 -6.217 -8.517 -3.148 1.00 0.00 H new ATOM 0 HA ASN A 811 -7.980 -10.645 -3.799 1.00 0.00 H new ATOM 0 HB2 ASN A 811 -6.555 -9.808 -1.252 1.00 0.00 H new ATOM 0 HB3 ASN A 811 -7.606 -11.209 -1.316 1.00 0.00 H new ATOM 0 HD21 ASN A 811 -4.000 -12.187 -1.975 1.00 0.00 H new ATOM 0 HD22 ASN A 811 -4.789 -11.228 -0.719 1.00 0.00 H new ATOM 430 N ILE A 812 -9.269 -8.133 -2.227 1.00 0.00 N ATOM 431 CA ILE A 812 -10.555 -7.605 -1.764 1.00 0.00 C ATOM 432 C ILE A 812 -11.644 -7.880 -2.799 1.00 0.00 C ATOM 433 O ILE A 812 -12.767 -8.240 -2.453 1.00 0.00 O ATOM 434 CB ILE A 812 -10.508 -6.082 -1.449 1.00 0.00 C ATOM 435 CG1 ILE A 812 -9.852 -5.822 -0.093 1.00 0.00 C ATOM 436 CG2 ILE A 812 -11.904 -5.471 -1.474 1.00 0.00 C ATOM 437 CD1 ILE A 812 -8.344 -5.835 -0.124 1.00 0.00 C ATOM 0 H ILE A 812 -8.534 -7.435 -2.340 1.00 0.00 H new ATOM 0 HA ILE A 812 -10.785 -8.121 -0.832 1.00 0.00 H new ATOM 0 HB ILE A 812 -9.907 -5.608 -2.225 1.00 0.00 H new ATOM 0 HG12 ILE A 812 -10.188 -4.855 0.282 1.00 0.00 H new ATOM 0 HG13 ILE A 812 -10.196 -6.576 0.615 1.00 0.00 H new ATOM 0 HG21 ILE A 812 -11.839 -4.406 -1.250 1.00 0.00 H new ATOM 0 HG22 ILE A 812 -12.344 -5.608 -2.462 1.00 0.00 H new ATOM 0 HG23 ILE A 812 -12.529 -5.961 -0.728 1.00 0.00 H new ATOM 0 HD11 ILE A 812 -7.958 -5.643 0.877 1.00 0.00 H new ATOM 0 HD12 ILE A 812 -7.996 -6.809 -0.466 1.00 0.00 H new ATOM 0 HD13 ILE A 812 -7.987 -5.062 -0.805 1.00 0.00 H new ATOM 449 N PHE A 813 -11.289 -7.743 -4.071 1.00 0.00 N ATOM 450 CA PHE A 813 -12.234 -7.975 -5.155 1.00 0.00 C ATOM 451 C PHE A 813 -12.563 -9.459 -5.277 1.00 0.00 C ATOM 452 O PHE A 813 -13.649 -9.830 -5.715 1.00 0.00 O ATOM 453 CB PHE A 813 -11.681 -7.427 -6.470 1.00 0.00 C ATOM 454 CG PHE A 813 -11.550 -5.931 -6.472 1.00 0.00 C ATOM 455 CD1 PHE A 813 -12.595 -5.127 -6.900 1.00 0.00 C ATOM 456 CD2 PHE A 813 -10.371 -5.327 -6.059 1.00 0.00 C ATOM 457 CE1 PHE A 813 -12.467 -3.752 -6.916 1.00 0.00 C ATOM 458 CE2 PHE A 813 -10.238 -3.952 -6.070 1.00 0.00 C ATOM 459 CZ PHE A 813 -11.327 -3.160 -6.448 1.00 0.00 C ATOM 0 H PHE A 813 -10.354 -7.473 -4.376 1.00 0.00 H new ATOM 0 HA PHE A 813 -13.159 -7.445 -4.927 1.00 0.00 H new ATOM 0 HB2 PHE A 813 -10.705 -7.872 -6.661 1.00 0.00 H new ATOM 0 HB3 PHE A 813 -12.335 -7.730 -7.288 1.00 0.00 H new ATOM 0 HD1 PHE A 813 -13.520 -5.581 -7.225 1.00 0.00 H new ATOM 0 HD2 PHE A 813 -9.547 -5.940 -5.725 1.00 0.00 H new ATOM 0 HE1 PHE A 813 -13.271 -3.142 -7.300 1.00 0.00 H new ATOM 0 HE2 PHE A 813 -9.302 -3.493 -5.789 1.00 0.00 H new ATOM 0 HZ PHE A 813 -11.268 -2.084 -6.370 1.00 0.00 H new ATOM 469 N SER A 814 -11.628 -10.307 -4.873 1.00 0.00 N ATOM 470 CA SER A 814 -11.873 -11.739 -4.833 1.00 0.00 C ATOM 471 C SER A 814 -12.700 -12.086 -3.595 1.00 0.00 C ATOM 472 O SER A 814 -13.422 -13.081 -3.570 1.00 0.00 O ATOM 473 CB SER A 814 -10.544 -12.505 -4.830 1.00 0.00 C ATOM 474 OG SER A 814 -10.746 -13.900 -4.994 1.00 0.00 O ATOM 0 H SER A 814 -10.695 -10.028 -4.569 1.00 0.00 H new ATOM 0 HA SER A 814 -12.433 -12.032 -5.721 1.00 0.00 H new ATOM 0 HB2 SER A 814 -9.906 -12.132 -5.632 1.00 0.00 H new ATOM 0 HB3 SER A 814 -10.019 -12.320 -3.893 1.00 0.00 H new ATOM 0 HG SER A 814 -9.880 -14.359 -4.989 1.00 0.00 H new ATOM 480 N SER A 815 -12.597 -11.241 -2.575 1.00 0.00 N ATOM 481 CA SER A 815 -13.334 -11.427 -1.333 1.00 0.00 C ATOM 482 C SER A 815 -14.756 -10.878 -1.450 1.00 0.00 C ATOM 483 O SER A 815 -15.542 -10.981 -0.508 1.00 0.00 O ATOM 484 CB SER A 815 -12.603 -10.741 -0.179 1.00 0.00 C ATOM 485 OG SER A 815 -11.258 -11.184 -0.090 1.00 0.00 O ATOM 0 H SER A 815 -12.003 -10.412 -2.586 1.00 0.00 H new ATOM 0 HA SER A 815 -13.396 -12.497 -1.133 1.00 0.00 H new ATOM 0 HB2 SER A 815 -12.624 -9.661 -0.322 1.00 0.00 H new ATOM 0 HB3 SER A 815 -13.120 -10.949 0.758 1.00 0.00 H new ATOM 0 HG SER A 815 -10.708 -10.693 -0.736 1.00 0.00 H new ATOM 491 N MET A 816 -15.067 -10.274 -2.600 1.00 0.00 N ATOM 492 CA MET A 816 -16.397 -9.722 -2.860 1.00 0.00 C ATOM 493 C MET A 816 -17.484 -10.754 -2.579 1.00 0.00 C ATOM 494 O MET A 816 -17.668 -11.707 -3.344 1.00 0.00 O ATOM 495 CB MET A 816 -16.503 -9.244 -4.304 1.00 0.00 C ATOM 496 CG MET A 816 -15.965 -7.845 -4.514 1.00 0.00 C ATOM 497 SD MET A 816 -16.993 -6.596 -3.727 1.00 0.00 S ATOM 498 CE MET A 816 -16.008 -5.139 -4.035 1.00 0.00 C ATOM 0 H MET A 816 -14.409 -10.155 -3.371 1.00 0.00 H new ATOM 0 HA MET A 816 -16.542 -8.874 -2.190 1.00 0.00 H new ATOM 0 HB2 MET A 816 -15.960 -9.935 -4.949 1.00 0.00 H new ATOM 0 HB3 MET A 816 -17.548 -9.274 -4.613 1.00 0.00 H new ATOM 0 HG2 MET A 816 -14.952 -7.783 -4.115 1.00 0.00 H new ATOM 0 HG3 MET A 816 -15.900 -7.639 -5.582 1.00 0.00 H new ATOM 0 HE1 MET A 816 -16.567 -4.252 -3.738 1.00 0.00 H new ATOM 0 HE2 MET A 816 -15.084 -5.196 -3.459 1.00 0.00 H new ATOM 0 HE3 MET A 816 -15.770 -5.079 -5.097 1.00 0.00 H new ATOM 508 N GLY A 817 -18.186 -10.568 -1.476 1.00 0.00 N ATOM 509 CA GLY A 817 -19.195 -11.518 -1.069 1.00 0.00 C ATOM 510 C GLY A 817 -19.028 -11.923 0.377 1.00 0.00 C ATOM 511 O GLY A 817 -20.004 -12.235 1.060 1.00 0.00 O ATOM 0 H GLY A 817 -18.074 -9.770 -0.851 1.00 0.00 H new ATOM 0 HA2 GLY A 817 -20.184 -11.083 -1.214 1.00 0.00 H new ATOM 0 HA3 GLY A 817 -19.140 -12.402 -1.704 1.00 0.00 H new ATOM 515 N ASP A 818 -17.791 -11.915 0.852 1.00 0.00 N ATOM 516 CA ASP A 818 -17.509 -12.221 2.246 1.00 0.00 C ATOM 517 C ASP A 818 -17.218 -10.931 2.995 1.00 0.00 C ATOM 518 O ASP A 818 -16.138 -10.356 2.867 1.00 0.00 O ATOM 519 CB ASP A 818 -16.325 -13.181 2.377 1.00 0.00 C ATOM 520 CG ASP A 818 -16.225 -13.785 3.765 1.00 0.00 C ATOM 521 OD1 ASP A 818 -15.940 -13.046 4.734 1.00 0.00 O ATOM 522 OD2 ASP A 818 -16.460 -15.005 3.900 1.00 0.00 O ATOM 0 H ASP A 818 -16.966 -11.700 0.292 1.00 0.00 H new ATOM 0 HA ASP A 818 -18.383 -12.710 2.676 1.00 0.00 H new ATOM 0 HB2 ASP A 818 -16.424 -13.980 1.642 1.00 0.00 H new ATOM 0 HB3 ASP A 818 -15.402 -12.649 2.147 1.00 0.00 H new ATOM 527 N ALA A 819 -18.189 -10.484 3.776 1.00 0.00 N ATOM 528 CA ALA A 819 -18.106 -9.193 4.439 1.00 0.00 C ATOM 529 C ALA A 819 -16.958 -9.153 5.443 1.00 0.00 C ATOM 530 O ALA A 819 -16.129 -8.242 5.414 1.00 0.00 O ATOM 531 CB ALA A 819 -19.426 -8.878 5.121 1.00 0.00 C ATOM 0 H ALA A 819 -19.048 -11.000 3.967 1.00 0.00 H new ATOM 0 HA ALA A 819 -17.904 -8.434 3.684 1.00 0.00 H new ATOM 0 HB1 ALA A 819 -19.358 -7.909 5.616 1.00 0.00 H new ATOM 0 HB2 ALA A 819 -20.222 -8.850 4.377 1.00 0.00 H new ATOM 0 HB3 ALA A 819 -19.647 -9.648 5.860 1.00 0.00 H new ATOM 537 N GLY A 820 -16.907 -10.148 6.315 1.00 0.00 N ATOM 538 CA GLY A 820 -15.846 -10.221 7.306 1.00 0.00 C ATOM 539 C GLY A 820 -14.458 -10.240 6.686 1.00 0.00 C ATOM 540 O GLY A 820 -13.522 -9.650 7.229 1.00 0.00 O ATOM 0 H GLY A 820 -17.583 -10.911 6.357 1.00 0.00 H new ATOM 0 HA2 GLY A 820 -15.926 -9.368 7.980 1.00 0.00 H new ATOM 0 HA3 GLY A 820 -15.981 -11.118 7.910 1.00 0.00 H new ATOM 544 N GLU A 821 -14.327 -10.912 5.546 1.00 0.00 N ATOM 545 CA GLU A 821 -13.041 -11.026 4.875 1.00 0.00 C ATOM 546 C GLU A 821 -12.616 -9.692 4.282 1.00 0.00 C ATOM 547 O GLU A 821 -11.472 -9.266 4.445 1.00 0.00 O ATOM 548 CB GLU A 821 -13.094 -12.089 3.774 1.00 0.00 C ATOM 549 CG GLU A 821 -11.725 -12.479 3.251 1.00 0.00 C ATOM 550 CD GLU A 821 -10.852 -13.076 4.335 1.00 0.00 C ATOM 551 OE1 GLU A 821 -10.408 -12.331 5.228 1.00 0.00 O ATOM 552 OE2 GLU A 821 -10.581 -14.292 4.285 1.00 0.00 O ATOM 0 H GLU A 821 -15.096 -11.384 5.070 1.00 0.00 H new ATOM 0 HA GLU A 821 -12.305 -11.327 5.621 1.00 0.00 H new ATOM 0 HB2 GLU A 821 -13.595 -12.977 4.160 1.00 0.00 H new ATOM 0 HB3 GLU A 821 -13.699 -11.716 2.947 1.00 0.00 H new ATOM 0 HG2 GLU A 821 -11.838 -13.198 2.440 1.00 0.00 H new ATOM 0 HG3 GLU A 821 -11.233 -11.601 2.832 1.00 0.00 H new ATOM 559 N MET A 822 -13.546 -9.025 3.608 1.00 0.00 N ATOM 560 CA MET A 822 -13.263 -7.736 2.985 1.00 0.00 C ATOM 561 C MET A 822 -12.806 -6.721 4.030 1.00 0.00 C ATOM 562 O MET A 822 -11.885 -5.939 3.787 1.00 0.00 O ATOM 563 CB MET A 822 -14.500 -7.211 2.254 1.00 0.00 C ATOM 564 CG MET A 822 -14.951 -8.091 1.097 1.00 0.00 C ATOM 565 SD MET A 822 -16.508 -7.545 0.365 1.00 0.00 S ATOM 566 CE MET A 822 -16.063 -5.900 -0.181 1.00 0.00 C ATOM 0 H MET A 822 -14.502 -9.355 3.479 1.00 0.00 H new ATOM 0 HA MET A 822 -12.460 -7.878 2.262 1.00 0.00 H new ATOM 0 HB2 MET A 822 -15.319 -7.117 2.967 1.00 0.00 H new ATOM 0 HB3 MET A 822 -14.290 -6.210 1.876 1.00 0.00 H new ATOM 0 HG2 MET A 822 -14.177 -8.098 0.329 1.00 0.00 H new ATOM 0 HG3 MET A 822 -15.061 -9.117 1.449 1.00 0.00 H new ATOM 0 HE1 MET A 822 -16.806 -5.539 -0.893 1.00 0.00 H new ATOM 0 HE2 MET A 822 -16.027 -5.229 0.677 1.00 0.00 H new ATOM 0 HE3 MET A 822 -15.085 -5.928 -0.661 1.00 0.00 H new ATOM 576 N VAL A 823 -13.443 -6.750 5.194 1.00 0.00 N ATOM 577 CA VAL A 823 -13.073 -5.861 6.288 1.00 0.00 C ATOM 578 C VAL A 823 -11.701 -6.235 6.847 1.00 0.00 C ATOM 579 O VAL A 823 -10.914 -5.365 7.222 1.00 0.00 O ATOM 580 CB VAL A 823 -14.121 -5.886 7.424 1.00 0.00 C ATOM 581 CG1 VAL A 823 -13.705 -4.981 8.576 1.00 0.00 C ATOM 582 CG2 VAL A 823 -15.488 -5.473 6.897 1.00 0.00 C ATOM 0 H VAL A 823 -14.218 -7.379 5.405 1.00 0.00 H new ATOM 0 HA VAL A 823 -13.034 -4.850 5.882 1.00 0.00 H new ATOM 0 HB VAL A 823 -14.182 -6.907 7.800 1.00 0.00 H new ATOM 0 HG11 VAL A 823 -14.461 -5.019 9.360 1.00 0.00 H new ATOM 0 HG12 VAL A 823 -12.749 -5.319 8.977 1.00 0.00 H new ATOM 0 HG13 VAL A 823 -13.606 -3.957 8.217 1.00 0.00 H new ATOM 0 HG21 VAL A 823 -16.214 -5.496 7.710 1.00 0.00 H new ATOM 0 HG22 VAL A 823 -15.431 -4.463 6.490 1.00 0.00 H new ATOM 0 HG23 VAL A 823 -15.799 -6.163 6.113 1.00 0.00 H new ATOM 592 N ARG A 824 -11.406 -7.531 6.882 1.00 0.00 N ATOM 593 CA ARG A 824 -10.127 -7.999 7.404 1.00 0.00 C ATOM 594 C ARG A 824 -8.997 -7.609 6.463 1.00 0.00 C ATOM 595 O ARG A 824 -7.984 -7.068 6.901 1.00 0.00 O ATOM 596 CB ARG A 824 -10.129 -9.515 7.627 1.00 0.00 C ATOM 597 CG ARG A 824 -8.836 -10.026 8.249 1.00 0.00 C ATOM 598 CD ARG A 824 -8.926 -11.491 8.648 1.00 0.00 C ATOM 599 NE ARG A 824 -9.049 -12.385 7.499 1.00 0.00 N ATOM 600 CZ ARG A 824 -8.535 -13.613 7.457 1.00 0.00 C ATOM 601 NH1 ARG A 824 -7.797 -14.062 8.464 1.00 0.00 N ATOM 602 NH2 ARG A 824 -8.747 -14.385 6.400 1.00 0.00 N ATOM 0 H ARG A 824 -12.030 -8.270 6.558 1.00 0.00 H new ATOM 0 HA ARG A 824 -9.969 -7.520 8.370 1.00 0.00 H new ATOM 0 HB2 ARG A 824 -10.966 -9.781 8.272 1.00 0.00 H new ATOM 0 HB3 ARG A 824 -10.290 -10.017 6.673 1.00 0.00 H new ATOM 0 HG2 ARG A 824 -8.018 -9.894 7.541 1.00 0.00 H new ATOM 0 HG3 ARG A 824 -8.596 -9.427 9.127 1.00 0.00 H new ATOM 0 HD2 ARG A 824 -8.039 -11.762 9.220 1.00 0.00 H new ATOM 0 HD3 ARG A 824 -9.784 -11.632 9.305 1.00 0.00 H new ATOM 0 HE ARG A 824 -9.558 -12.049 6.681 1.00 0.00 H new ATOM 0 HH11 ARG A 824 -7.622 -13.466 9.273 1.00 0.00 H new ATOM 0 HH12 ARG A 824 -7.405 -15.003 8.429 1.00 0.00 H new ATOM 0 HH21 ARG A 824 -9.304 -14.038 5.619 1.00 0.00 H new ATOM 0 HH22 ARG A 824 -8.353 -15.325 6.368 1.00 0.00 H new ATOM 616 N GLN A 825 -9.187 -7.866 5.175 1.00 0.00 N ATOM 617 CA GLN A 825 -8.188 -7.524 4.168 1.00 0.00 C ATOM 618 C GLN A 825 -7.873 -6.031 4.199 1.00 0.00 C ATOM 619 O GLN A 825 -6.717 -5.629 4.065 1.00 0.00 O ATOM 620 CB GLN A 825 -8.667 -7.928 2.772 1.00 0.00 C ATOM 621 CG GLN A 825 -8.774 -9.432 2.563 1.00 0.00 C ATOM 622 CD GLN A 825 -7.448 -10.143 2.761 1.00 0.00 C ATOM 623 OE1 GLN A 825 -7.127 -10.589 3.862 1.00 0.00 O ATOM 624 NE2 GLN A 825 -6.667 -10.245 1.698 1.00 0.00 N ATOM 0 H GLN A 825 -10.025 -8.311 4.802 1.00 0.00 H new ATOM 0 HA GLN A 825 -7.277 -8.076 4.400 1.00 0.00 H new ATOM 0 HB2 GLN A 825 -9.642 -7.476 2.589 1.00 0.00 H new ATOM 0 HB3 GLN A 825 -7.981 -7.517 2.031 1.00 0.00 H new ATOM 0 HG2 GLN A 825 -9.509 -9.840 3.257 1.00 0.00 H new ATOM 0 HG3 GLN A 825 -9.142 -9.630 1.556 1.00 0.00 H new ATOM 0 HE21 GLN A 825 -6.971 -9.861 0.803 1.00 0.00 H new ATOM 0 HE22 GLN A 825 -5.761 -10.707 1.773 1.00 0.00 H new ATOM 633 N ALA A 826 -8.905 -5.216 4.393 1.00 0.00 N ATOM 634 CA ALA A 826 -8.733 -3.772 4.491 1.00 0.00 C ATOM 635 C ALA A 826 -7.880 -3.405 5.701 1.00 0.00 C ATOM 636 O ALA A 826 -7.002 -2.546 5.619 1.00 0.00 O ATOM 637 CB ALA A 826 -10.084 -3.084 4.576 1.00 0.00 C ATOM 0 H ALA A 826 -9.870 -5.532 4.485 1.00 0.00 H new ATOM 0 HA ALA A 826 -8.218 -3.431 3.593 1.00 0.00 H new ATOM 0 HB1 ALA A 826 -9.939 -2.006 4.649 1.00 0.00 H new ATOM 0 HB2 ALA A 826 -10.666 -3.313 3.683 1.00 0.00 H new ATOM 0 HB3 ALA A 826 -10.618 -3.439 5.457 1.00 0.00 H new ATOM 643 N ARG A 827 -8.133 -4.068 6.822 1.00 0.00 N ATOM 644 CA ARG A 827 -7.386 -3.803 8.044 1.00 0.00 C ATOM 645 C ARG A 827 -5.962 -4.344 7.937 1.00 0.00 C ATOM 646 O ARG A 827 -5.044 -3.828 8.578 1.00 0.00 O ATOM 647 CB ARG A 827 -8.104 -4.400 9.255 1.00 0.00 C ATOM 648 CG ARG A 827 -9.425 -3.711 9.569 1.00 0.00 C ATOM 649 CD ARG A 827 -10.092 -4.298 10.804 1.00 0.00 C ATOM 650 NE ARG A 827 -10.467 -5.699 10.617 1.00 0.00 N ATOM 651 CZ ARG A 827 -10.094 -6.685 11.434 1.00 0.00 C ATOM 652 NH1 ARG A 827 -9.345 -6.426 12.500 1.00 0.00 N ATOM 653 NH2 ARG A 827 -10.493 -7.927 11.196 1.00 0.00 N ATOM 0 H ARG A 827 -8.847 -4.791 6.910 1.00 0.00 H new ATOM 0 HA ARG A 827 -7.328 -2.723 8.180 1.00 0.00 H new ATOM 0 HB2 ARG A 827 -8.288 -5.459 9.074 1.00 0.00 H new ATOM 0 HB3 ARG A 827 -7.451 -4.334 10.125 1.00 0.00 H new ATOM 0 HG2 ARG A 827 -9.251 -2.646 9.722 1.00 0.00 H new ATOM 0 HG3 ARG A 827 -10.096 -3.805 8.715 1.00 0.00 H new ATOM 0 HD2 ARG A 827 -9.415 -4.215 11.654 1.00 0.00 H new ATOM 0 HD3 ARG A 827 -10.981 -3.715 11.046 1.00 0.00 H new ATOM 0 HE ARG A 827 -11.049 -5.936 9.814 1.00 0.00 H new ATOM 0 HH11 ARG A 827 -9.052 -5.469 12.697 1.00 0.00 H new ATOM 0 HH12 ARG A 827 -9.063 -7.184 13.121 1.00 0.00 H new ATOM 0 HH21 ARG A 827 -11.084 -8.127 10.389 1.00 0.00 H new ATOM 0 HH22 ARG A 827 -10.209 -8.682 11.820 1.00 0.00 H new ATOM 667 N ILE A 828 -5.781 -5.381 7.128 1.00 0.00 N ATOM 668 CA ILE A 828 -4.450 -5.892 6.833 1.00 0.00 C ATOM 669 C ILE A 828 -3.690 -4.886 5.975 1.00 0.00 C ATOM 670 O ILE A 828 -2.502 -4.644 6.188 1.00 0.00 O ATOM 671 CB ILE A 828 -4.504 -7.263 6.120 1.00 0.00 C ATOM 672 CG1 ILE A 828 -5.130 -8.314 7.044 1.00 0.00 C ATOM 673 CG2 ILE A 828 -3.111 -7.701 5.683 1.00 0.00 C ATOM 674 CD1 ILE A 828 -5.267 -9.684 6.411 1.00 0.00 C ATOM 0 H ILE A 828 -6.539 -5.883 6.666 1.00 0.00 H new ATOM 0 HA ILE A 828 -3.930 -6.035 7.780 1.00 0.00 H new ATOM 0 HB ILE A 828 -5.124 -7.164 5.229 1.00 0.00 H new ATOM 0 HG12 ILE A 828 -4.522 -8.400 7.945 1.00 0.00 H new ATOM 0 HG13 ILE A 828 -6.116 -7.968 7.356 1.00 0.00 H new ATOM 0 HG21 ILE A 828 -3.174 -8.668 5.184 1.00 0.00 H new ATOM 0 HG22 ILE A 828 -2.697 -6.964 4.995 1.00 0.00 H new ATOM 0 HG23 ILE A 828 -2.465 -7.785 6.557 1.00 0.00 H new ATOM 0 HD11 ILE A 828 -5.718 -10.372 7.126 1.00 0.00 H new ATOM 0 HD12 ILE A 828 -5.900 -9.614 5.526 1.00 0.00 H new ATOM 0 HD13 ILE A 828 -4.282 -10.052 6.124 1.00 0.00 H new ATOM 686 N LEU A 829 -4.392 -4.284 5.018 1.00 0.00 N ATOM 687 CA LEU A 829 -3.819 -3.216 4.205 1.00 0.00 C ATOM 688 C LEU A 829 -3.384 -2.057 5.086 1.00 0.00 C ATOM 689 O LEU A 829 -2.266 -1.567 4.965 1.00 0.00 O ATOM 690 CB LEU A 829 -4.822 -2.723 3.161 1.00 0.00 C ATOM 691 CG LEU A 829 -5.065 -3.675 1.993 1.00 0.00 C ATOM 692 CD1 LEU A 829 -6.109 -3.102 1.052 1.00 0.00 C ATOM 693 CD2 LEU A 829 -3.766 -3.940 1.252 1.00 0.00 C ATOM 0 H LEU A 829 -5.358 -4.518 4.787 1.00 0.00 H new ATOM 0 HA LEU A 829 -2.949 -3.619 3.687 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -5.774 -2.531 3.657 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -4.471 -1.770 2.765 1.00 0.00 H new ATOM 0 HG LEU A 829 -5.439 -4.621 2.385 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -6.271 -3.793 0.224 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -7.045 -2.957 1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -5.762 -2.145 0.663 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -3.953 -4.620 0.421 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -3.368 -3.001 0.869 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -3.044 -4.389 1.933 1.00 0.00 H new ATOM 705 N ALA A 830 -4.269 -1.638 5.984 1.00 0.00 N ATOM 706 CA ALA A 830 -3.961 -0.566 6.924 1.00 0.00 C ATOM 707 C ALA A 830 -2.705 -0.893 7.725 1.00 0.00 C ATOM 708 O ALA A 830 -1.844 -0.039 7.927 1.00 0.00 O ATOM 709 CB ALA A 830 -5.138 -0.328 7.859 1.00 0.00 C ATOM 0 H ALA A 830 -5.208 -2.025 6.081 1.00 0.00 H new ATOM 0 HA ALA A 830 -3.776 0.345 6.355 1.00 0.00 H new ATOM 0 HB1 ALA A 830 -4.893 0.475 8.555 1.00 0.00 H new ATOM 0 HB2 ALA A 830 -6.015 -0.048 7.276 1.00 0.00 H new ATOM 0 HB3 ALA A 830 -5.349 -1.240 8.417 1.00 0.00 H new ATOM 715 N GLN A 831 -2.604 -2.143 8.154 1.00 0.00 N ATOM 716 CA GLN A 831 -1.451 -2.621 8.908 1.00 0.00 C ATOM 717 C GLN A 831 -0.176 -2.546 8.066 1.00 0.00 C ATOM 718 O GLN A 831 0.835 -1.988 8.499 1.00 0.00 O ATOM 719 CB GLN A 831 -1.705 -4.060 9.358 1.00 0.00 C ATOM 720 CG GLN A 831 -0.539 -4.705 10.086 1.00 0.00 C ATOM 721 CD GLN A 831 -0.839 -6.136 10.485 1.00 0.00 C ATOM 722 OE1 GLN A 831 -1.991 -6.488 10.753 1.00 0.00 O ATOM 723 NE2 GLN A 831 0.187 -6.973 10.514 1.00 0.00 N ATOM 0 H GLN A 831 -3.317 -2.854 7.990 1.00 0.00 H new ATOM 0 HA GLN A 831 -1.312 -1.984 9.781 1.00 0.00 H new ATOM 0 HB2 GLN A 831 -2.578 -4.075 10.011 1.00 0.00 H new ATOM 0 HB3 GLN A 831 -1.950 -4.663 8.484 1.00 0.00 H new ATOM 0 HG2 GLN A 831 0.343 -4.685 9.446 1.00 0.00 H new ATOM 0 HG3 GLN A 831 -0.301 -4.123 10.976 1.00 0.00 H new ATOM 0 HE21 GLN A 831 1.124 -6.640 10.285 1.00 0.00 H new ATOM 0 HE22 GLN A 831 0.041 -7.951 10.765 1.00 0.00 H new ATOM 732 N ALA A 832 -0.240 -3.098 6.860 1.00 0.00 N ATOM 733 CA ALA A 832 0.907 -3.129 5.961 1.00 0.00 C ATOM 734 C ALA A 832 1.315 -1.726 5.535 1.00 0.00 C ATOM 735 O ALA A 832 2.499 -1.384 5.547 1.00 0.00 O ATOM 736 CB ALA A 832 0.596 -3.982 4.746 1.00 0.00 C ATOM 0 H ALA A 832 -1.081 -3.533 6.480 1.00 0.00 H new ATOM 0 HA ALA A 832 1.746 -3.570 6.499 1.00 0.00 H new ATOM 0 HB1 ALA A 832 1.460 -3.998 4.082 1.00 0.00 H new ATOM 0 HB2 ALA A 832 0.365 -4.998 5.065 1.00 0.00 H new ATOM 0 HB3 ALA A 832 -0.261 -3.564 4.217 1.00 0.00 H new ATOM 742 N THR A 833 0.327 -0.918 5.173 1.00 0.00 N ATOM 743 CA THR A 833 0.567 0.459 4.788 1.00 0.00 C ATOM 744 C THR A 833 1.292 1.219 5.894 1.00 0.00 C ATOM 745 O THR A 833 2.198 2.007 5.628 1.00 0.00 O ATOM 746 CB THR A 833 -0.755 1.184 4.448 1.00 0.00 C ATOM 747 OG1 THR A 833 -1.293 0.677 3.221 1.00 0.00 O ATOM 748 CG2 THR A 833 -0.556 2.690 4.344 1.00 0.00 C ATOM 0 H THR A 833 -0.653 -1.199 5.139 1.00 0.00 H new ATOM 0 HA THR A 833 1.197 0.439 3.898 1.00 0.00 H new ATOM 0 HB THR A 833 -1.458 0.993 5.259 1.00 0.00 H new ATOM 0 HG1 THR A 833 -1.987 1.286 2.892 1.00 0.00 H new ATOM 0 HG21 THR A 833 -1.506 3.167 4.104 1.00 0.00 H new ATOM 0 HG22 THR A 833 -0.187 3.075 5.295 1.00 0.00 H new ATOM 0 HG23 THR A 833 0.168 2.908 3.559 1.00 0.00 H new ATOM 756 N SER A 834 0.917 0.941 7.133 1.00 0.00 N ATOM 757 CA SER A 834 1.481 1.659 8.273 1.00 0.00 C ATOM 758 C SER A 834 2.970 1.364 8.417 1.00 0.00 C ATOM 759 O SER A 834 3.749 2.232 8.815 1.00 0.00 O ATOM 760 CB SER A 834 0.736 1.300 9.559 1.00 0.00 C ATOM 761 OG SER A 834 -0.628 1.675 9.476 1.00 0.00 O ATOM 0 H SER A 834 0.229 0.229 7.377 1.00 0.00 H new ATOM 0 HA SER A 834 1.361 2.727 8.093 1.00 0.00 H new ATOM 0 HB2 SER A 834 0.812 0.228 9.741 1.00 0.00 H new ATOM 0 HB3 SER A 834 1.204 1.801 10.407 1.00 0.00 H new ATOM 0 HG SER A 834 -1.027 1.283 8.671 1.00 0.00 H new ATOM 767 N ASP A 835 3.367 0.145 8.068 1.00 0.00 N ATOM 768 CA ASP A 835 4.772 -0.233 8.108 1.00 0.00 C ATOM 769 C ASP A 835 5.537 0.477 6.997 1.00 0.00 C ATOM 770 O ASP A 835 6.678 0.905 7.186 1.00 0.00 O ATOM 771 CB ASP A 835 4.927 -1.750 7.976 1.00 0.00 C ATOM 772 CG ASP A 835 6.379 -2.192 8.001 1.00 0.00 C ATOM 773 OD1 ASP A 835 7.018 -2.092 9.068 1.00 0.00 O ATOM 774 OD2 ASP A 835 6.891 -2.642 6.949 1.00 0.00 O ATOM 0 H ASP A 835 2.738 -0.594 7.756 1.00 0.00 H new ATOM 0 HA ASP A 835 5.185 0.070 9.070 1.00 0.00 H new ATOM 0 HB2 ASP A 835 4.388 -2.239 8.788 1.00 0.00 H new ATOM 0 HB3 ASP A 835 4.467 -2.079 7.044 1.00 0.00 H new ATOM 779 N LEU A 836 4.893 0.620 5.845 1.00 0.00 N ATOM 780 CA LEU A 836 5.501 1.312 4.715 1.00 0.00 C ATOM 781 C LEU A 836 5.599 2.809 4.965 1.00 0.00 C ATOM 782 O LEU A 836 6.595 3.426 4.604 1.00 0.00 O ATOM 783 CB LEU A 836 4.731 1.048 3.423 1.00 0.00 C ATOM 784 CG LEU A 836 5.167 -0.205 2.668 1.00 0.00 C ATOM 785 CD1 LEU A 836 4.387 -0.342 1.373 1.00 0.00 C ATOM 786 CD2 LEU A 836 6.662 -0.162 2.385 1.00 0.00 C ATOM 0 H LEU A 836 3.952 0.267 5.669 1.00 0.00 H new ATOM 0 HA LEU A 836 6.510 0.915 4.605 1.00 0.00 H new ATOM 0 HB2 LEU A 836 3.670 0.964 3.659 1.00 0.00 H new ATOM 0 HB3 LEU A 836 4.844 1.910 2.766 1.00 0.00 H new ATOM 0 HG LEU A 836 4.958 -1.074 3.292 1.00 0.00 H new ATOM 0 HD11 LEU A 836 4.710 -1.240 0.847 1.00 0.00 H new ATOM 0 HD12 LEU A 836 3.322 -0.415 1.595 1.00 0.00 H new ATOM 0 HD13 LEU A 836 4.568 0.531 0.745 1.00 0.00 H new ATOM 0 HD21 LEU A 836 6.956 -1.063 1.846 1.00 0.00 H new ATOM 0 HD22 LEU A 836 6.893 0.715 1.780 1.00 0.00 H new ATOM 0 HD23 LEU A 836 7.209 -0.107 3.326 1.00 0.00 H new ATOM 798 N VAL A 837 4.576 3.389 5.582 1.00 0.00 N ATOM 799 CA VAL A 837 4.600 4.810 5.911 1.00 0.00 C ATOM 800 C VAL A 837 5.834 5.141 6.747 1.00 0.00 C ATOM 801 O VAL A 837 6.509 6.139 6.501 1.00 0.00 O ATOM 802 CB VAL A 837 3.319 5.250 6.660 1.00 0.00 C ATOM 803 CG1 VAL A 837 3.424 6.696 7.124 1.00 0.00 C ATOM 804 CG2 VAL A 837 2.098 5.073 5.771 1.00 0.00 C ATOM 0 H VAL A 837 3.725 2.902 5.863 1.00 0.00 H new ATOM 0 HA VAL A 837 4.642 5.361 4.972 1.00 0.00 H new ATOM 0 HB VAL A 837 3.211 4.617 7.541 1.00 0.00 H new ATOM 0 HG11 VAL A 837 2.510 6.978 7.647 1.00 0.00 H new ATOM 0 HG12 VAL A 837 4.275 6.801 7.798 1.00 0.00 H new ATOM 0 HG13 VAL A 837 3.563 7.346 6.260 1.00 0.00 H new ATOM 0 HG21 VAL A 837 1.205 5.387 6.312 1.00 0.00 H new ATOM 0 HG22 VAL A 837 2.210 5.681 4.873 1.00 0.00 H new ATOM 0 HG23 VAL A 837 2.002 4.024 5.490 1.00 0.00 H new ATOM 814 N ASN A 838 6.139 4.280 7.711 1.00 0.00 N ATOM 815 CA ASN A 838 7.337 4.444 8.528 1.00 0.00 C ATOM 816 C ASN A 838 8.591 4.226 7.687 1.00 0.00 C ATOM 817 O ASN A 838 9.516 5.040 7.709 1.00 0.00 O ATOM 818 CB ASN A 838 7.348 3.453 9.698 1.00 0.00 C ATOM 819 CG ASN A 838 6.185 3.630 10.655 1.00 0.00 C ATOM 820 OD1 ASN A 838 5.662 4.728 10.832 1.00 0.00 O ATOM 821 ND2 ASN A 838 5.780 2.542 11.291 1.00 0.00 N ATOM 0 H ASN A 838 5.575 3.463 7.946 1.00 0.00 H new ATOM 0 HA ASN A 838 7.328 5.461 8.921 1.00 0.00 H new ATOM 0 HB2 ASN A 838 7.331 2.437 9.303 1.00 0.00 H new ATOM 0 HB3 ASN A 838 8.282 3.565 10.249 1.00 0.00 H new ATOM 0 HD21 ASN A 838 5.008 2.597 11.955 1.00 0.00 H new ATOM 0 HD22 ASN A 838 6.240 1.648 11.117 1.00 0.00 H new ATOM 828 N ALA A 839 8.607 3.125 6.940 1.00 0.00 N ATOM 829 CA ALA A 839 9.767 2.740 6.141 1.00 0.00 C ATOM 830 C ALA A 839 10.117 3.798 5.101 1.00 0.00 C ATOM 831 O ALA A 839 11.262 4.239 5.022 1.00 0.00 O ATOM 832 CB ALA A 839 9.517 1.400 5.464 1.00 0.00 C ATOM 0 H ALA A 839 7.821 2.478 6.872 1.00 0.00 H new ATOM 0 HA ALA A 839 10.617 2.650 6.817 1.00 0.00 H new ATOM 0 HB1 ALA A 839 10.389 1.124 4.871 1.00 0.00 H new ATOM 0 HB2 ALA A 839 9.337 0.637 6.222 1.00 0.00 H new ATOM 0 HB3 ALA A 839 8.646 1.478 4.814 1.00 0.00 H new ATOM 838 N ILE A 840 9.129 4.204 4.315 1.00 0.00 N ATOM 839 CA ILE A 840 9.336 5.187 3.257 1.00 0.00 C ATOM 840 C ILE A 840 9.770 6.527 3.843 1.00 0.00 C ATOM 841 O ILE A 840 10.683 7.175 3.332 1.00 0.00 O ATOM 842 CB ILE A 840 8.054 5.378 2.414 1.00 0.00 C ATOM 843 CG1 ILE A 840 7.625 4.048 1.787 1.00 0.00 C ATOM 844 CG2 ILE A 840 8.274 6.428 1.336 1.00 0.00 C ATOM 845 CD1 ILE A 840 6.321 4.127 1.023 1.00 0.00 C ATOM 0 H ILE A 840 8.170 3.866 4.390 1.00 0.00 H new ATOM 0 HA ILE A 840 10.126 4.809 2.608 1.00 0.00 H new ATOM 0 HB ILE A 840 7.257 5.724 3.072 1.00 0.00 H new ATOM 0 HG12 ILE A 840 8.410 3.704 1.113 1.00 0.00 H new ATOM 0 HG13 ILE A 840 7.530 3.300 2.574 1.00 0.00 H new ATOM 0 HG21 ILE A 840 7.361 6.548 0.753 1.00 0.00 H new ATOM 0 HG22 ILE A 840 8.535 7.378 1.802 1.00 0.00 H new ATOM 0 HG23 ILE A 840 9.084 6.111 0.679 1.00 0.00 H new ATOM 0 HD11 ILE A 840 6.083 3.148 0.608 1.00 0.00 H new ATOM 0 HD12 ILE A 840 5.523 4.440 1.697 1.00 0.00 H new ATOM 0 HD13 ILE A 840 6.417 4.851 0.213 1.00 0.00 H new ATOM 857 N LYS A 841 9.125 6.926 4.932 1.00 0.00 N ATOM 858 CA LYS A 841 9.443 8.185 5.591 1.00 0.00 C ATOM 859 C LYS A 841 10.880 8.180 6.099 1.00 0.00 C ATOM 860 O LYS A 841 11.617 9.151 5.920 1.00 0.00 O ATOM 861 CB LYS A 841 8.479 8.421 6.753 1.00 0.00 C ATOM 862 CG LYS A 841 8.649 9.765 7.436 1.00 0.00 C ATOM 863 CD LYS A 841 7.665 9.928 8.582 1.00 0.00 C ATOM 864 CE LYS A 841 6.223 9.915 8.095 1.00 0.00 C ATOM 865 NZ LYS A 841 5.261 10.001 9.222 1.00 0.00 N ATOM 0 H LYS A 841 8.377 6.394 5.378 1.00 0.00 H new ATOM 0 HA LYS A 841 9.337 8.992 4.866 1.00 0.00 H new ATOM 0 HB2 LYS A 841 7.456 8.339 6.385 1.00 0.00 H new ATOM 0 HB3 LYS A 841 8.616 7.631 7.491 1.00 0.00 H new ATOM 0 HG2 LYS A 841 9.668 9.858 7.812 1.00 0.00 H new ATOM 0 HG3 LYS A 841 8.502 10.565 6.711 1.00 0.00 H new ATOM 0 HD2 LYS A 841 7.812 9.125 9.304 1.00 0.00 H new ATOM 0 HD3 LYS A 841 7.865 10.865 9.102 1.00 0.00 H new ATOM 0 HE2 LYS A 841 6.061 10.751 7.414 1.00 0.00 H new ATOM 0 HE3 LYS A 841 6.039 9.002 7.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 4.290 9.989 8.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 5.398 9.190 9.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 5.420 10.884 9.748 1.00 0.00 H new ATOM 879 N ALA A 842 11.273 7.075 6.715 1.00 0.00 N ATOM 880 CA ALA A 842 12.607 6.944 7.285 1.00 0.00 C ATOM 881 C ALA A 842 13.662 6.801 6.195 1.00 0.00 C ATOM 882 O ALA A 842 14.780 7.299 6.331 1.00 0.00 O ATOM 883 CB ALA A 842 12.657 5.760 8.236 1.00 0.00 C ATOM 0 H ALA A 842 10.683 6.251 6.834 1.00 0.00 H new ATOM 0 HA ALA A 842 12.828 7.854 7.843 1.00 0.00 H new ATOM 0 HB1 ALA A 842 13.659 5.672 8.656 1.00 0.00 H new ATOM 0 HB2 ALA A 842 11.938 5.910 9.042 1.00 0.00 H new ATOM 0 HB3 ALA A 842 12.410 4.847 7.694 1.00 0.00 H new ATOM 889 N ASP A 843 13.304 6.131 5.108 1.00 0.00 N ATOM 890 CA ASP A 843 14.225 5.947 3.998 1.00 0.00 C ATOM 891 C ASP A 843 14.424 7.268 3.267 1.00 0.00 C ATOM 892 O ASP A 843 15.520 7.575 2.795 1.00 0.00 O ATOM 893 CB ASP A 843 13.710 4.867 3.044 1.00 0.00 C ATOM 894 CG ASP A 843 14.672 4.582 1.907 1.00 0.00 C ATOM 895 OD1 ASP A 843 15.838 4.250 2.183 1.00 0.00 O ATOM 896 OD2 ASP A 843 14.262 4.693 0.730 1.00 0.00 O ATOM 0 H ASP A 843 12.386 5.708 4.973 1.00 0.00 H new ATOM 0 HA ASP A 843 15.188 5.616 4.388 1.00 0.00 H new ATOM 0 HB2 ASP A 843 13.533 3.948 3.603 1.00 0.00 H new ATOM 0 HB3 ASP A 843 12.750 5.179 2.633 1.00 0.00 H new ATOM 901 N ALA A 844 13.364 8.065 3.216 1.00 0.00 N ATOM 902 CA ALA A 844 13.434 9.407 2.653 1.00 0.00 C ATOM 903 C ALA A 844 14.378 10.283 3.468 1.00 0.00 C ATOM 904 O ALA A 844 15.025 11.180 2.932 1.00 0.00 O ATOM 905 CB ALA A 844 12.051 10.034 2.598 1.00 0.00 C ATOM 0 H ALA A 844 12.440 7.803 3.560 1.00 0.00 H new ATOM 0 HA ALA A 844 13.823 9.331 1.638 1.00 0.00 H new ATOM 0 HB1 ALA A 844 12.122 11.036 2.175 1.00 0.00 H new ATOM 0 HB2 ALA A 844 11.399 9.422 1.975 1.00 0.00 H new ATOM 0 HB3 ALA A 844 11.638 10.094 3.605 1.00 0.00 H new ATOM 911 N GLU A 845 14.457 10.007 4.768 1.00 0.00 N ATOM 912 CA GLU A 845 15.367 10.726 5.655 1.00 0.00 C ATOM 913 C GLU A 845 16.818 10.423 5.297 1.00 0.00 C ATOM 914 O GLU A 845 17.714 11.228 5.553 1.00 0.00 O ATOM 915 CB GLU A 845 15.115 10.343 7.116 1.00 0.00 C ATOM 916 CG GLU A 845 13.744 10.743 7.630 1.00 0.00 C ATOM 917 CD GLU A 845 13.529 12.239 7.593 1.00 0.00 C ATOM 918 OE1 GLU A 845 14.020 12.935 8.504 1.00 0.00 O ATOM 919 OE2 GLU A 845 12.866 12.727 6.658 1.00 0.00 O ATOM 0 H GLU A 845 13.900 9.289 5.231 1.00 0.00 H new ATOM 0 HA GLU A 845 15.182 11.793 5.528 1.00 0.00 H new ATOM 0 HB2 GLU A 845 15.232 9.265 7.224 1.00 0.00 H new ATOM 0 HB3 GLU A 845 15.877 10.810 7.740 1.00 0.00 H new ATOM 0 HG2 GLU A 845 12.977 10.253 7.030 1.00 0.00 H new ATOM 0 HG3 GLU A 845 13.624 10.387 8.653 1.00 0.00 H new ATOM 926 N GLY A 846 17.036 9.259 4.703 1.00 0.00 N ATOM 927 CA GLY A 846 18.375 8.859 4.322 1.00 0.00 C ATOM 928 C GLY A 846 18.775 9.407 2.969 1.00 0.00 C ATOM 929 O GLY A 846 19.957 9.407 2.619 1.00 0.00 O ATOM 0 H GLY A 846 16.307 8.582 4.477 1.00 0.00 H new ATOM 0 HA2 GLY A 846 19.083 9.204 5.075 1.00 0.00 H new ATOM 0 HA3 GLY A 846 18.435 7.771 4.303 1.00 0.00 H new ATOM 933 N GLU A 847 17.792 9.869 2.209 1.00 0.00 N ATOM 934 CA GLU A 847 18.051 10.446 0.899 1.00 0.00 C ATOM 935 C GLU A 847 18.536 11.887 1.038 1.00 0.00 C ATOM 936 O GLU A 847 17.937 12.693 1.750 1.00 0.00 O ATOM 937 CB GLU A 847 16.790 10.381 0.025 1.00 0.00 C ATOM 938 CG GLU A 847 16.953 11.022 -1.348 1.00 0.00 C ATOM 939 CD GLU A 847 18.082 10.417 -2.167 1.00 0.00 C ATOM 940 OE1 GLU A 847 19.256 10.718 -1.884 1.00 0.00 O ATOM 941 OE2 GLU A 847 17.797 9.624 -3.089 1.00 0.00 O ATOM 0 H GLU A 847 16.808 9.855 2.478 1.00 0.00 H new ATOM 0 HA GLU A 847 18.835 9.865 0.413 1.00 0.00 H new ATOM 0 HB2 GLU A 847 16.504 9.337 -0.104 1.00 0.00 H new ATOM 0 HB3 GLU A 847 15.971 10.873 0.550 1.00 0.00 H new ATOM 0 HG2 GLU A 847 16.019 10.922 -1.901 1.00 0.00 H new ATOM 0 HG3 GLU A 847 17.136 12.089 -1.223 1.00 0.00 H new ATOM 948 N SER A 848 19.622 12.195 0.350 1.00 0.00 N ATOM 949 CA SER A 848 20.224 13.515 0.406 1.00 0.00 C ATOM 950 C SER A 848 19.571 14.436 -0.626 1.00 0.00 C ATOM 951 O SER A 848 19.743 15.658 -0.587 1.00 0.00 O ATOM 952 CB SER A 848 21.735 13.402 0.157 1.00 0.00 C ATOM 953 OG SER A 848 22.402 14.633 0.388 1.00 0.00 O ATOM 0 H SER A 848 20.109 11.539 -0.261 1.00 0.00 H new ATOM 0 HA SER A 848 20.063 13.945 1.395 1.00 0.00 H new ATOM 0 HB2 SER A 848 22.154 12.634 0.808 1.00 0.00 H new ATOM 0 HB3 SER A 848 21.911 13.081 -0.870 1.00 0.00 H new ATOM 0 HG SER A 848 21.822 15.375 0.118 1.00 0.00 H new ATOM 959 N ASP A 849 18.811 13.846 -1.543 1.00 0.00 N ATOM 960 CA ASP A 849 18.109 14.617 -2.559 1.00 0.00 C ATOM 961 C ASP A 849 16.760 15.066 -2.018 1.00 0.00 C ATOM 962 O ASP A 849 15.919 14.237 -1.674 1.00 0.00 O ATOM 963 CB ASP A 849 17.902 13.793 -3.832 1.00 0.00 C ATOM 964 CG ASP A 849 17.421 14.646 -4.988 1.00 0.00 C ATOM 965 OD1 ASP A 849 16.198 14.840 -5.122 1.00 0.00 O ATOM 966 OD2 ASP A 849 18.270 15.129 -5.769 1.00 0.00 O ATOM 0 H ASP A 849 18.667 12.838 -1.602 1.00 0.00 H new ATOM 0 HA ASP A 849 18.717 15.487 -2.809 1.00 0.00 H new ATOM 0 HB2 ASP A 849 18.838 13.307 -4.105 1.00 0.00 H new ATOM 0 HB3 ASP A 849 17.177 13.003 -3.638 1.00 0.00 H new ATOM 971 N LEU A 850 16.559 16.372 -1.935 1.00 0.00 N ATOM 972 CA LEU A 850 15.347 16.917 -1.344 1.00 0.00 C ATOM 973 C LEU A 850 14.122 16.595 -2.197 1.00 0.00 C ATOM 974 O LEU A 850 13.069 16.246 -1.670 1.00 0.00 O ATOM 975 CB LEU A 850 15.481 18.425 -1.177 1.00 0.00 C ATOM 976 CG LEU A 850 15.246 18.958 0.240 1.00 0.00 C ATOM 977 CD1 LEU A 850 13.836 18.647 0.708 1.00 0.00 C ATOM 978 CD2 LEU A 850 16.270 18.374 1.202 1.00 0.00 C ATOM 0 H LEU A 850 17.219 17.074 -2.269 1.00 0.00 H new ATOM 0 HA LEU A 850 15.211 16.455 -0.366 1.00 0.00 H new ATOM 0 HB2 LEU A 850 16.481 18.720 -1.496 1.00 0.00 H new ATOM 0 HB3 LEU A 850 14.775 18.911 -1.850 1.00 0.00 H new ATOM 0 HG LEU A 850 15.365 20.041 0.222 1.00 0.00 H new ATOM 0 HD11 LEU A 850 13.693 19.035 1.716 1.00 0.00 H new ATOM 0 HD12 LEU A 850 13.118 19.114 0.034 1.00 0.00 H new ATOM 0 HD13 LEU A 850 13.683 17.568 0.710 1.00 0.00 H new ATOM 0 HD21 LEU A 850 16.090 18.762 2.205 1.00 0.00 H new ATOM 0 HD22 LEU A 850 16.182 17.288 1.212 1.00 0.00 H new ATOM 0 HD23 LEU A 850 17.273 18.653 0.879 1.00 0.00 H new ATOM 990 N GLU A 851 14.267 16.699 -3.511 1.00 0.00 N ATOM 991 CA GLU A 851 13.164 16.410 -4.420 1.00 0.00 C ATOM 992 C GLU A 851 12.722 14.959 -4.277 1.00 0.00 C ATOM 993 O GLU A 851 11.532 14.666 -4.151 1.00 0.00 O ATOM 994 CB GLU A 851 13.570 16.682 -5.868 1.00 0.00 C ATOM 995 CG GLU A 851 13.985 18.117 -6.131 1.00 0.00 C ATOM 996 CD GLU A 851 14.385 18.341 -7.572 1.00 0.00 C ATOM 997 OE1 GLU A 851 15.572 18.142 -7.901 1.00 0.00 O ATOM 998 OE2 GLU A 851 13.514 18.708 -8.388 1.00 0.00 O ATOM 0 H GLU A 851 15.133 16.980 -3.971 1.00 0.00 H new ATOM 0 HA GLU A 851 12.333 17.065 -4.158 1.00 0.00 H new ATOM 0 HB2 GLU A 851 14.395 16.021 -6.134 1.00 0.00 H new ATOM 0 HB3 GLU A 851 12.736 16.430 -6.522 1.00 0.00 H new ATOM 0 HG2 GLU A 851 13.161 18.784 -5.876 1.00 0.00 H new ATOM 0 HG3 GLU A 851 14.819 18.377 -5.479 1.00 0.00 H new ATOM 1005 N ASN A 852 13.695 14.059 -4.282 1.00 0.00 N ATOM 1006 CA ASN A 852 13.415 12.636 -4.171 1.00 0.00 C ATOM 1007 C ASN A 852 12.836 12.299 -2.803 1.00 0.00 C ATOM 1008 O ASN A 852 11.901 11.505 -2.697 1.00 0.00 O ATOM 1009 CB ASN A 852 14.679 11.810 -4.407 1.00 0.00 C ATOM 1010 CG ASN A 852 14.382 10.328 -4.499 1.00 0.00 C ATOM 1011 OD1 ASN A 852 13.333 9.918 -5.001 1.00 0.00 O ATOM 1012 ND2 ASN A 852 15.294 9.506 -4.012 1.00 0.00 N ATOM 0 H ASN A 852 14.685 14.290 -4.362 1.00 0.00 H new ATOM 0 HA ASN A 852 12.681 12.387 -4.937 1.00 0.00 H new ATOM 0 HB2 ASN A 852 15.161 12.140 -5.327 1.00 0.00 H new ATOM 0 HB3 ASN A 852 15.385 11.988 -3.596 1.00 0.00 H new ATOM 0 HD21 ASN A 852 15.141 8.498 -4.044 1.00 0.00 H new ATOM 0 HD22 ASN A 852 16.151 9.879 -3.604 1.00 0.00 H new ATOM 1019 N SER A 853 13.373 12.918 -1.755 1.00 0.00 N ATOM 1020 CA SER A 853 12.920 12.619 -0.405 1.00 0.00 C ATOM 1021 C SER A 853 11.492 13.117 -0.201 1.00 0.00 C ATOM 1022 O SER A 853 10.680 12.454 0.442 1.00 0.00 O ATOM 1023 CB SER A 853 13.866 13.218 0.640 1.00 0.00 C ATOM 1024 OG SER A 853 14.157 14.570 0.359 1.00 0.00 O ATOM 0 H SER A 853 14.111 13.619 -1.815 1.00 0.00 H new ATOM 0 HA SER A 853 12.928 11.537 -0.274 1.00 0.00 H new ATOM 0 HB2 SER A 853 13.414 13.140 1.629 1.00 0.00 H new ATOM 0 HB3 SER A 853 14.792 12.643 0.666 1.00 0.00 H new ATOM 0 HG SER A 853 14.904 14.619 -0.273 1.00 0.00 H new ATOM 1030 N ARG A 854 11.185 14.274 -0.780 1.00 0.00 N ATOM 1031 CA ARG A 854 9.832 14.812 -0.736 1.00 0.00 C ATOM 1032 C ARG A 854 8.873 13.927 -1.522 1.00 0.00 C ATOM 1033 O ARG A 854 7.717 13.766 -1.139 1.00 0.00 O ATOM 1034 CB ARG A 854 9.787 16.236 -1.287 1.00 0.00 C ATOM 1035 CG ARG A 854 10.453 17.262 -0.389 1.00 0.00 C ATOM 1036 CD ARG A 854 10.330 18.658 -0.971 1.00 0.00 C ATOM 1037 NE ARG A 854 8.932 19.050 -1.145 1.00 0.00 N ATOM 1038 CZ ARG A 854 8.488 19.819 -2.138 1.00 0.00 C ATOM 1039 NH1 ARG A 854 9.323 20.247 -3.075 1.00 0.00 N ATOM 1040 NH2 ARG A 854 7.201 20.138 -2.203 1.00 0.00 N ATOM 0 H ARG A 854 11.855 14.855 -1.284 1.00 0.00 H new ATOM 0 HA ARG A 854 9.521 14.833 0.309 1.00 0.00 H new ATOM 0 HB2 ARG A 854 10.271 16.253 -2.264 1.00 0.00 H new ATOM 0 HB3 ARG A 854 8.747 16.523 -1.442 1.00 0.00 H new ATOM 0 HG2 ARG A 854 9.996 17.235 0.600 1.00 0.00 H new ATOM 0 HG3 ARG A 854 11.506 17.009 -0.261 1.00 0.00 H new ATOM 0 HD2 ARG A 854 10.829 19.371 -0.315 1.00 0.00 H new ATOM 0 HD3 ARG A 854 10.842 18.698 -1.933 1.00 0.00 H new ATOM 0 HE ARG A 854 8.253 18.713 -0.462 1.00 0.00 H new ATOM 0 HH11 ARG A 854 10.309 19.988 -3.037 1.00 0.00 H new ATOM 0 HH12 ARG A 854 8.980 20.836 -3.834 1.00 0.00 H new ATOM 0 HH21 ARG A 854 6.554 19.794 -1.493 1.00 0.00 H new ATOM 0 HH22 ARG A 854 6.859 20.727 -2.963 1.00 0.00 H new ATOM 1054 N LYS A 855 9.356 13.358 -2.622 1.00 0.00 N ATOM 1055 CA LYS A 855 8.548 12.448 -3.421 1.00 0.00 C ATOM 1056 C LYS A 855 8.212 11.200 -2.613 1.00 0.00 C ATOM 1057 O LYS A 855 7.085 10.712 -2.646 1.00 0.00 O ATOM 1058 CB LYS A 855 9.270 12.068 -4.718 1.00 0.00 C ATOM 1059 CG LYS A 855 8.450 11.156 -5.619 1.00 0.00 C ATOM 1060 CD LYS A 855 9.152 10.871 -6.937 1.00 0.00 C ATOM 1061 CE LYS A 855 10.481 10.165 -6.728 1.00 0.00 C ATOM 1062 NZ LYS A 855 11.125 9.812 -8.021 1.00 0.00 N ATOM 0 H LYS A 855 10.299 13.511 -2.978 1.00 0.00 H new ATOM 0 HA LYS A 855 7.621 12.956 -3.688 1.00 0.00 H new ATOM 0 HB2 LYS A 855 9.522 12.977 -5.265 1.00 0.00 H new ATOM 0 HB3 LYS A 855 10.210 11.574 -4.471 1.00 0.00 H new ATOM 0 HG2 LYS A 855 8.255 10.216 -5.102 1.00 0.00 H new ATOM 0 HG3 LYS A 855 7.482 11.617 -5.817 1.00 0.00 H new ATOM 0 HD2 LYS A 855 8.509 10.256 -7.566 1.00 0.00 H new ATOM 0 HD3 LYS A 855 9.318 11.807 -7.470 1.00 0.00 H new ATOM 0 HE2 LYS A 855 11.148 10.807 -6.153 1.00 0.00 H new ATOM 0 HE3 LYS A 855 10.324 9.260 -6.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 855 12.029 9.332 -7.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 855 10.499 9.179 -8.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 855 11.297 10.678 -8.571 1.00 0.00 H new ATOM 1076 N LEU A 856 9.195 10.700 -1.873 1.00 0.00 N ATOM 1077 CA LEU A 856 8.982 9.560 -0.990 1.00 0.00 C ATOM 1078 C LEU A 856 8.004 9.923 0.125 1.00 0.00 C ATOM 1079 O LEU A 856 7.049 9.191 0.392 1.00 0.00 O ATOM 1080 CB LEU A 856 10.314 9.088 -0.397 1.00 0.00 C ATOM 1081 CG LEU A 856 11.281 8.451 -1.398 1.00 0.00 C ATOM 1082 CD1 LEU A 856 12.616 8.149 -0.738 1.00 0.00 C ATOM 1083 CD2 LEU A 856 10.679 7.181 -1.975 1.00 0.00 C ATOM 0 H LEU A 856 10.147 11.066 -1.867 1.00 0.00 H new ATOM 0 HA LEU A 856 8.553 8.746 -1.575 1.00 0.00 H new ATOM 0 HB2 LEU A 856 10.808 9.940 0.070 1.00 0.00 H new ATOM 0 HB3 LEU A 856 10.107 8.367 0.394 1.00 0.00 H new ATOM 0 HG LEU A 856 11.452 9.159 -2.209 1.00 0.00 H new ATOM 0 HD11 LEU A 856 13.288 7.697 -1.467 1.00 0.00 H new ATOM 0 HD12 LEU A 856 13.055 9.074 -0.365 1.00 0.00 H new ATOM 0 HD13 LEU A 856 12.464 7.459 0.092 1.00 0.00 H new ATOM 0 HD21 LEU A 856 11.377 6.738 -2.685 1.00 0.00 H new ATOM 0 HD22 LEU A 856 10.482 6.473 -1.170 1.00 0.00 H new ATOM 0 HD23 LEU A 856 9.745 7.420 -2.484 1.00 0.00 H new ATOM 1095 N LEU A 857 8.233 11.070 0.756 1.00 0.00 N ATOM 1096 CA LEU A 857 7.381 11.535 1.845 1.00 0.00 C ATOM 1097 C LEU A 857 5.936 11.720 1.387 1.00 0.00 C ATOM 1098 O LEU A 857 5.003 11.283 2.067 1.00 0.00 O ATOM 1099 CB LEU A 857 7.918 12.845 2.424 1.00 0.00 C ATOM 1100 CG LEU A 857 9.252 12.725 3.161 1.00 0.00 C ATOM 1101 CD1 LEU A 857 9.707 14.084 3.670 1.00 0.00 C ATOM 1102 CD2 LEU A 857 9.131 11.736 4.307 1.00 0.00 C ATOM 0 H LEU A 857 9.005 11.697 0.531 1.00 0.00 H new ATOM 0 HA LEU A 857 7.394 10.770 2.621 1.00 0.00 H new ATOM 0 HB2 LEU A 857 8.031 13.564 1.613 1.00 0.00 H new ATOM 0 HB3 LEU A 857 7.176 13.253 3.110 1.00 0.00 H new ATOM 0 HG LEU A 857 10.003 12.356 2.463 1.00 0.00 H new ATOM 0 HD11 LEU A 857 10.658 13.977 4.192 1.00 0.00 H new ATOM 0 HD12 LEU A 857 9.829 14.766 2.828 1.00 0.00 H new ATOM 0 HD13 LEU A 857 8.960 14.484 4.356 1.00 0.00 H new ATOM 0 HD21 LEU A 857 10.088 11.659 4.824 1.00 0.00 H new ATOM 0 HD22 LEU A 857 8.368 12.080 5.005 1.00 0.00 H new ATOM 0 HD23 LEU A 857 8.851 10.758 3.916 1.00 0.00 H new ATOM 1114 N SER A 858 5.755 12.360 0.239 1.00 0.00 N ATOM 1115 CA SER A 858 4.424 12.597 -0.296 1.00 0.00 C ATOM 1116 C SER A 858 3.757 11.285 -0.695 1.00 0.00 C ATOM 1117 O SER A 858 2.577 11.085 -0.428 1.00 0.00 O ATOM 1118 CB SER A 858 4.483 13.558 -1.487 1.00 0.00 C ATOM 1119 OG SER A 858 5.445 13.138 -2.440 1.00 0.00 O ATOM 0 H SER A 858 6.514 12.723 -0.338 1.00 0.00 H new ATOM 0 HA SER A 858 3.822 13.058 0.487 1.00 0.00 H new ATOM 0 HB2 SER A 858 3.502 13.617 -1.959 1.00 0.00 H new ATOM 0 HB3 SER A 858 4.729 14.560 -1.136 1.00 0.00 H new ATOM 0 HG SER A 858 6.319 13.519 -2.213 1.00 0.00 H new ATOM 1125 N ALA A 859 4.523 10.387 -1.312 1.00 0.00 N ATOM 1126 CA ALA A 859 4.005 9.081 -1.712 1.00 0.00 C ATOM 1127 C ALA A 859 3.475 8.312 -0.507 1.00 0.00 C ATOM 1128 O ALA A 859 2.388 7.734 -0.556 1.00 0.00 O ATOM 1129 CB ALA A 859 5.080 8.273 -2.423 1.00 0.00 C ATOM 0 H ALA A 859 5.504 10.540 -1.545 1.00 0.00 H new ATOM 0 HA ALA A 859 3.178 9.245 -2.403 1.00 0.00 H new ATOM 0 HB1 ALA A 859 4.675 7.304 -2.713 1.00 0.00 H new ATOM 0 HB2 ALA A 859 5.409 8.809 -3.313 1.00 0.00 H new ATOM 0 HB3 ALA A 859 5.927 8.126 -1.753 1.00 0.00 H new ATOM 1135 N ALA A 860 4.242 8.322 0.578 1.00 0.00 N ATOM 1136 CA ALA A 860 3.838 7.657 1.813 1.00 0.00 C ATOM 1137 C ALA A 860 2.587 8.308 2.394 1.00 0.00 C ATOM 1138 O ALA A 860 1.695 7.628 2.900 1.00 0.00 O ATOM 1139 CB ALA A 860 4.973 7.683 2.827 1.00 0.00 C ATOM 0 H ALA A 860 5.150 8.785 0.628 1.00 0.00 H new ATOM 0 HA ALA A 860 3.604 6.618 1.581 1.00 0.00 H new ATOM 0 HB1 ALA A 860 4.655 7.183 3.742 1.00 0.00 H new ATOM 0 HB2 ALA A 860 5.841 7.168 2.415 1.00 0.00 H new ATOM 0 HB3 ALA A 860 5.237 8.717 3.051 1.00 0.00 H new ATOM 1145 N LYS A 861 2.525 9.632 2.304 1.00 0.00 N ATOM 1146 CA LYS A 861 1.380 10.377 2.808 1.00 0.00 C ATOM 1147 C LYS A 861 0.142 10.113 1.944 1.00 0.00 C ATOM 1148 O LYS A 861 -0.962 9.934 2.463 1.00 0.00 O ATOM 1149 CB LYS A 861 1.698 11.873 2.847 1.00 0.00 C ATOM 1150 CG LYS A 861 0.668 12.687 3.605 1.00 0.00 C ATOM 1151 CD LYS A 861 1.036 14.160 3.653 1.00 0.00 C ATOM 1152 CE LYS A 861 0.008 14.959 4.433 1.00 0.00 C ATOM 1153 NZ LYS A 861 -1.351 14.850 3.838 1.00 0.00 N ATOM 0 H LYS A 861 3.254 10.210 1.887 1.00 0.00 H new ATOM 0 HA LYS A 861 1.166 10.040 3.822 1.00 0.00 H new ATOM 0 HB2 LYS A 861 2.675 12.017 3.308 1.00 0.00 H new ATOM 0 HB3 LYS A 861 1.768 12.249 1.826 1.00 0.00 H new ATOM 0 HG2 LYS A 861 -0.307 12.571 3.131 1.00 0.00 H new ATOM 0 HG3 LYS A 861 0.576 12.302 4.621 1.00 0.00 H new ATOM 0 HD2 LYS A 861 2.017 14.277 4.114 1.00 0.00 H new ATOM 0 HD3 LYS A 861 1.111 14.552 2.639 1.00 0.00 H new ATOM 0 HE2 LYS A 861 -0.018 14.607 5.464 1.00 0.00 H new ATOM 0 HE3 LYS A 861 0.308 16.006 4.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 861 -1.972 15.571 4.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 861 -1.293 14.998 2.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 861 -1.739 13.905 4.031 1.00 0.00 H new ATOM 1167 N ILE A 862 0.341 10.089 0.628 1.00 0.00 N ATOM 1168 CA ILE A 862 -0.724 9.744 -0.308 1.00 0.00 C ATOM 1169 C ILE A 862 -1.238 8.339 -0.019 1.00 0.00 C ATOM 1170 O ILE A 862 -2.446 8.106 0.060 1.00 0.00 O ATOM 1171 CB ILE A 862 -0.232 9.823 -1.776 1.00 0.00 C ATOM 1172 CG1 ILE A 862 0.072 11.276 -2.157 1.00 0.00 C ATOM 1173 CG2 ILE A 862 -1.256 9.221 -2.733 1.00 0.00 C ATOM 1174 CD1 ILE A 862 0.634 11.437 -3.555 1.00 0.00 C ATOM 0 H ILE A 862 1.234 10.305 0.185 1.00 0.00 H new ATOM 0 HA ILE A 862 -1.531 10.465 -0.176 1.00 0.00 H new ATOM 0 HB ILE A 862 0.685 9.240 -1.858 1.00 0.00 H new ATOM 0 HG12 ILE A 862 -0.843 11.863 -2.073 1.00 0.00 H new ATOM 0 HG13 ILE A 862 0.782 11.689 -1.440 1.00 0.00 H new ATOM 0 HG21 ILE A 862 -0.884 9.291 -3.755 1.00 0.00 H new ATOM 0 HG22 ILE A 862 -1.422 8.174 -2.477 1.00 0.00 H new ATOM 0 HG23 ILE A 862 -2.196 9.767 -2.651 1.00 0.00 H new ATOM 0 HD11 ILE A 862 0.824 12.492 -3.752 1.00 0.00 H new ATOM 0 HD12 ILE A 862 1.567 10.879 -3.639 1.00 0.00 H new ATOM 0 HD13 ILE A 862 -0.083 11.056 -4.282 1.00 0.00 H new ATOM 1186 N LEU A 863 -0.301 7.417 0.160 1.00 0.00 N ATOM 1187 CA LEU A 863 -0.617 6.038 0.492 1.00 0.00 C ATOM 1188 C LEU A 863 -1.468 5.952 1.754 1.00 0.00 C ATOM 1189 O LEU A 863 -2.535 5.335 1.755 1.00 0.00 O ATOM 1190 CB LEU A 863 0.675 5.240 0.682 1.00 0.00 C ATOM 1191 CG LEU A 863 0.508 3.897 1.385 1.00 0.00 C ATOM 1192 CD1 LEU A 863 -0.555 3.061 0.694 1.00 0.00 C ATOM 1193 CD2 LEU A 863 1.836 3.158 1.443 1.00 0.00 C ATOM 0 H LEU A 863 0.698 7.606 0.079 1.00 0.00 H new ATOM 0 HA LEU A 863 -1.191 5.615 -0.333 1.00 0.00 H new ATOM 0 HB2 LEU A 863 1.124 5.067 -0.296 1.00 0.00 H new ATOM 0 HB3 LEU A 863 1.378 5.847 1.253 1.00 0.00 H new ATOM 0 HG LEU A 863 0.179 4.079 2.408 1.00 0.00 H new ATOM 0 HD11 LEU A 863 -0.660 2.107 1.210 1.00 0.00 H new ATOM 0 HD12 LEU A 863 -1.507 3.592 0.716 1.00 0.00 H new ATOM 0 HD13 LEU A 863 -0.263 2.884 -0.341 1.00 0.00 H new ATOM 0 HD21 LEU A 863 1.699 2.202 1.948 1.00 0.00 H new ATOM 0 HD22 LEU A 863 2.200 2.985 0.430 1.00 0.00 H new ATOM 0 HD23 LEU A 863 2.562 3.757 1.992 1.00 0.00 H new ATOM 1205 N ALA A 864 -0.990 6.579 2.820 1.00 0.00 N ATOM 1206 CA ALA A 864 -1.664 6.526 4.108 1.00 0.00 C ATOM 1207 C ALA A 864 -3.110 7.000 4.005 1.00 0.00 C ATOM 1208 O ALA A 864 -3.976 6.540 4.752 1.00 0.00 O ATOM 1209 CB ALA A 864 -0.895 7.350 5.128 1.00 0.00 C ATOM 0 H ALA A 864 -0.133 7.133 2.817 1.00 0.00 H new ATOM 0 HA ALA A 864 -1.689 5.487 4.437 1.00 0.00 H new ATOM 0 HB1 ALA A 864 -1.405 7.306 6.090 1.00 0.00 H new ATOM 0 HB2 ALA A 864 0.113 6.950 5.233 1.00 0.00 H new ATOM 0 HB3 ALA A 864 -0.841 8.386 4.793 1.00 0.00 H new ATOM 1215 N ASP A 865 -3.376 7.899 3.067 1.00 0.00 N ATOM 1216 CA ASP A 865 -4.727 8.412 2.876 1.00 0.00 C ATOM 1217 C ASP A 865 -5.541 7.502 1.977 1.00 0.00 C ATOM 1218 O ASP A 865 -6.707 7.222 2.259 1.00 0.00 O ATOM 1219 CB ASP A 865 -4.697 9.838 2.310 1.00 0.00 C ATOM 1220 CG ASP A 865 -6.080 10.393 2.009 1.00 0.00 C ATOM 1221 OD1 ASP A 865 -6.707 10.981 2.916 1.00 0.00 O ATOM 1222 OD2 ASP A 865 -6.535 10.275 0.851 1.00 0.00 O ATOM 0 H ASP A 865 -2.680 8.286 2.430 1.00 0.00 H new ATOM 0 HA ASP A 865 -5.209 8.439 3.853 1.00 0.00 H new ATOM 0 HB2 ASP A 865 -4.197 10.494 3.022 1.00 0.00 H new ATOM 0 HB3 ASP A 865 -4.102 9.847 1.396 1.00 0.00 H new ATOM 1227 N ALA A 866 -4.921 7.025 0.909 1.00 0.00 N ATOM 1228 CA ALA A 866 -5.575 6.088 0.011 1.00 0.00 C ATOM 1229 C ALA A 866 -6.017 4.848 0.777 1.00 0.00 C ATOM 1230 O ALA A 866 -7.005 4.208 0.432 1.00 0.00 O ATOM 1231 CB ALA A 866 -4.646 5.714 -1.131 1.00 0.00 C ATOM 0 H ALA A 866 -3.967 7.271 0.644 1.00 0.00 H new ATOM 0 HA ALA A 866 -6.459 6.564 -0.412 1.00 0.00 H new ATOM 0 HB1 ALA A 866 -5.150 5.012 -1.795 1.00 0.00 H new ATOM 0 HB2 ALA A 866 -4.376 6.611 -1.689 1.00 0.00 H new ATOM 0 HB3 ALA A 866 -3.744 5.251 -0.730 1.00 0.00 H new ATOM 1237 N THR A 867 -5.282 4.535 1.841 1.00 0.00 N ATOM 1238 CA THR A 867 -5.602 3.404 2.691 1.00 0.00 C ATOM 1239 C THR A 867 -6.840 3.691 3.537 1.00 0.00 C ATOM 1240 O THR A 867 -7.733 2.855 3.631 1.00 0.00 O ATOM 1241 CB THR A 867 -4.421 3.049 3.612 1.00 0.00 C ATOM 1242 OG1 THR A 867 -3.222 2.915 2.838 1.00 0.00 O ATOM 1243 CG2 THR A 867 -4.685 1.749 4.357 1.00 0.00 C ATOM 0 H THR A 867 -4.455 5.057 2.132 1.00 0.00 H new ATOM 0 HA THR A 867 -5.806 2.555 2.038 1.00 0.00 H new ATOM 0 HB THR A 867 -4.304 3.853 4.339 1.00 0.00 H new ATOM 0 HG1 THR A 867 -2.965 3.790 2.479 1.00 0.00 H new ATOM 0 HG21 THR A 867 -3.836 1.520 5.001 1.00 0.00 H new ATOM 0 HG22 THR A 867 -5.584 1.854 4.965 1.00 0.00 H new ATOM 0 HG23 THR A 867 -4.825 0.940 3.640 1.00 0.00 H new ATOM 1251 N ALA A 868 -6.893 4.874 4.140 1.00 0.00 N ATOM 1252 CA ALA A 868 -8.050 5.285 4.926 1.00 0.00 C ATOM 1253 C ALA A 868 -9.314 5.239 4.077 1.00 0.00 C ATOM 1254 O ALA A 868 -10.335 4.689 4.491 1.00 0.00 O ATOM 1255 CB ALA A 868 -7.839 6.681 5.495 1.00 0.00 C ATOM 0 H ALA A 868 -6.145 5.567 4.099 1.00 0.00 H new ATOM 0 HA ALA A 868 -8.168 4.589 5.757 1.00 0.00 H new ATOM 0 HB1 ALA A 868 -8.712 6.972 6.079 1.00 0.00 H new ATOM 0 HB2 ALA A 868 -6.957 6.683 6.136 1.00 0.00 H new ATOM 0 HB3 ALA A 868 -7.696 7.389 4.679 1.00 0.00 H new ATOM 1261 N LYS A 869 -9.226 5.803 2.876 1.00 0.00 N ATOM 1262 CA LYS A 869 -10.335 5.782 1.925 1.00 0.00 C ATOM 1263 C LYS A 869 -10.724 4.347 1.603 1.00 0.00 C ATOM 1264 O LYS A 869 -11.905 3.991 1.594 1.00 0.00 O ATOM 1265 CB LYS A 869 -9.937 6.507 0.639 1.00 0.00 C ATOM 1266 CG LYS A 869 -9.475 7.937 0.865 1.00 0.00 C ATOM 1267 CD LYS A 869 -10.590 8.799 1.425 1.00 0.00 C ATOM 1268 CE LYS A 869 -11.702 8.993 0.409 1.00 0.00 C ATOM 1269 NZ LYS A 869 -12.844 9.754 0.977 1.00 0.00 N ATOM 0 H LYS A 869 -8.393 6.283 2.536 1.00 0.00 H new ATOM 0 HA LYS A 869 -11.188 6.290 2.374 1.00 0.00 H new ATOM 0 HB2 LYS A 869 -9.139 5.949 0.149 1.00 0.00 H new ATOM 0 HB3 LYS A 869 -10.787 6.512 -0.043 1.00 0.00 H new ATOM 0 HG2 LYS A 869 -8.629 7.943 1.552 1.00 0.00 H new ATOM 0 HG3 LYS A 869 -9.124 8.360 -0.076 1.00 0.00 H new ATOM 0 HD2 LYS A 869 -10.994 8.335 2.325 1.00 0.00 H new ATOM 0 HD3 LYS A 869 -10.190 9.769 1.719 1.00 0.00 H new ATOM 0 HE2 LYS A 869 -11.311 9.521 -0.461 1.00 0.00 H new ATOM 0 HE3 LYS A 869 -12.051 8.020 0.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 -13.582 9.865 0.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 -13.234 9.238 1.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 -12.517 10.692 1.285 1.00 0.00 H new ATOM 1283 N MET A 870 -9.705 3.541 1.343 1.00 0.00 N ATOM 1284 CA MET A 870 -9.865 2.125 1.050 1.00 0.00 C ATOM 1285 C MET A 870 -10.579 1.398 2.190 1.00 0.00 C ATOM 1286 O MET A 870 -11.551 0.677 1.970 1.00 0.00 O ATOM 1287 CB MET A 870 -8.481 1.514 0.812 1.00 0.00 C ATOM 1288 CG MET A 870 -8.477 0.007 0.695 1.00 0.00 C ATOM 1289 SD MET A 870 -9.534 -0.581 -0.629 1.00 0.00 S ATOM 1290 CE MET A 870 -9.225 -2.334 -0.509 1.00 0.00 C ATOM 0 H MET A 870 -8.735 3.855 1.329 1.00 0.00 H new ATOM 0 HA MET A 870 -10.481 2.014 0.158 1.00 0.00 H new ATOM 0 HB2 MET A 870 -8.062 1.938 -0.100 1.00 0.00 H new ATOM 0 HB3 MET A 870 -7.823 1.805 1.631 1.00 0.00 H new ATOM 0 HG2 MET A 870 -7.458 -0.338 0.522 1.00 0.00 H new ATOM 0 HG3 MET A 870 -8.806 -0.428 1.639 1.00 0.00 H new ATOM 0 HE1 MET A 870 -9.933 -2.872 -1.139 1.00 0.00 H new ATOM 0 HE2 MET A 870 -8.209 -2.548 -0.840 1.00 0.00 H new ATOM 0 HE3 MET A 870 -9.344 -2.654 0.526 1.00 0.00 H new ATOM 1300 N VAL A 871 -10.090 1.605 3.403 1.00 0.00 N ATOM 1301 CA VAL A 871 -10.632 0.949 4.584 1.00 0.00 C ATOM 1302 C VAL A 871 -12.099 1.319 4.809 1.00 0.00 C ATOM 1303 O VAL A 871 -12.941 0.438 4.996 1.00 0.00 O ATOM 1304 CB VAL A 871 -9.794 1.297 5.836 1.00 0.00 C ATOM 1305 CG1 VAL A 871 -10.486 0.858 7.115 1.00 0.00 C ATOM 1306 CG2 VAL A 871 -8.419 0.653 5.739 1.00 0.00 C ATOM 0 H VAL A 871 -9.308 2.231 3.597 1.00 0.00 H new ATOM 0 HA VAL A 871 -10.580 -0.126 4.414 1.00 0.00 H new ATOM 0 HB VAL A 871 -9.686 2.381 5.872 1.00 0.00 H new ATOM 0 HG11 VAL A 871 -9.866 1.120 7.972 1.00 0.00 H new ATOM 0 HG12 VAL A 871 -11.450 1.360 7.198 1.00 0.00 H new ATOM 0 HG13 VAL A 871 -10.639 -0.221 7.094 1.00 0.00 H new ATOM 0 HG21 VAL A 871 -7.836 0.904 6.625 1.00 0.00 H new ATOM 0 HG22 VAL A 871 -8.528 -0.429 5.671 1.00 0.00 H new ATOM 0 HG23 VAL A 871 -7.906 1.022 4.851 1.00 0.00 H new ATOM 1316 N GLU A 872 -12.404 2.613 4.772 1.00 0.00 N ATOM 1317 CA GLU A 872 -13.774 3.082 4.975 1.00 0.00 C ATOM 1318 C GLU A 872 -14.705 2.514 3.907 1.00 0.00 C ATOM 1319 O GLU A 872 -15.870 2.215 4.174 1.00 0.00 O ATOM 1320 CB GLU A 872 -13.837 4.610 4.947 1.00 0.00 C ATOM 1321 CG GLU A 872 -12.979 5.281 6.006 1.00 0.00 C ATOM 1322 CD GLU A 872 -13.119 6.789 5.996 1.00 0.00 C ATOM 1323 OE1 GLU A 872 -13.279 7.369 4.903 1.00 0.00 O ATOM 1324 OE2 GLU A 872 -13.056 7.407 7.080 1.00 0.00 O ATOM 0 H GLU A 872 -11.724 3.355 4.604 1.00 0.00 H new ATOM 0 HA GLU A 872 -14.101 2.732 5.954 1.00 0.00 H new ATOM 0 HB2 GLU A 872 -13.522 4.959 3.964 1.00 0.00 H new ATOM 0 HB3 GLU A 872 -14.872 4.924 5.080 1.00 0.00 H new ATOM 0 HG2 GLU A 872 -13.257 4.900 6.989 1.00 0.00 H new ATOM 0 HG3 GLU A 872 -11.934 5.015 5.845 1.00 0.00 H new ATOM 1331 N ALA A 873 -14.180 2.365 2.699 1.00 0.00 N ATOM 1332 CA ALA A 873 -14.950 1.828 1.591 1.00 0.00 C ATOM 1333 C ALA A 873 -15.208 0.340 1.784 1.00 0.00 C ATOM 1334 O ALA A 873 -16.339 -0.128 1.630 1.00 0.00 O ATOM 1335 CB ALA A 873 -14.228 2.079 0.280 1.00 0.00 C ATOM 0 H ALA A 873 -13.219 2.611 2.463 1.00 0.00 H new ATOM 0 HA ALA A 873 -15.913 2.337 1.561 1.00 0.00 H new ATOM 0 HB1 ALA A 873 -14.816 1.672 -0.543 1.00 0.00 H new ATOM 0 HB2 ALA A 873 -14.097 3.152 0.136 1.00 0.00 H new ATOM 0 HB3 ALA A 873 -13.252 1.594 0.304 1.00 0.00 H new ATOM 1341 N ALA A 874 -14.157 -0.392 2.137 1.00 0.00 N ATOM 1342 CA ALA A 874 -14.253 -1.829 2.357 1.00 0.00 C ATOM 1343 C ALA A 874 -15.233 -2.148 3.478 1.00 0.00 C ATOM 1344 O ALA A 874 -16.062 -3.043 3.343 1.00 0.00 O ATOM 1345 CB ALA A 874 -12.884 -2.412 2.668 1.00 0.00 C ATOM 0 H ALA A 874 -13.222 -0.009 2.278 1.00 0.00 H new ATOM 0 HA ALA A 874 -14.628 -2.285 1.441 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -12.974 -3.486 2.830 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -12.211 -2.226 1.831 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -12.484 -1.942 3.567 1.00 0.00 H new ATOM 1351 N LYS A 875 -15.146 -1.403 4.575 1.00 0.00 N ATOM 1352 CA LYS A 875 -16.039 -1.602 5.715 1.00 0.00 C ATOM 1353 C LYS A 875 -17.502 -1.480 5.300 1.00 0.00 C ATOM 1354 O LYS A 875 -18.340 -2.292 5.696 1.00 0.00 O ATOM 1355 CB LYS A 875 -15.740 -0.581 6.816 1.00 0.00 C ATOM 1356 CG LYS A 875 -14.393 -0.773 7.494 1.00 0.00 C ATOM 1357 CD LYS A 875 -14.087 0.371 8.451 1.00 0.00 C ATOM 1358 CE LYS A 875 -15.135 0.486 9.548 1.00 0.00 C ATOM 1359 NZ LYS A 875 -14.916 1.684 10.398 1.00 0.00 N ATOM 0 H LYS A 875 -14.465 -0.654 4.700 1.00 0.00 H new ATOM 0 HA LYS A 875 -15.865 -2.609 6.094 1.00 0.00 H new ATOM 0 HB2 LYS A 875 -15.779 0.421 6.388 1.00 0.00 H new ATOM 0 HB3 LYS A 875 -16.525 -0.636 7.570 1.00 0.00 H new ATOM 0 HG2 LYS A 875 -14.389 -1.717 8.039 1.00 0.00 H new ATOM 0 HG3 LYS A 875 -13.609 -0.838 6.739 1.00 0.00 H new ATOM 0 HD2 LYS A 875 -13.106 0.216 8.900 1.00 0.00 H new ATOM 0 HD3 LYS A 875 -14.039 1.307 7.895 1.00 0.00 H new ATOM 0 HE2 LYS A 875 -16.127 0.536 9.099 1.00 0.00 H new ATOM 0 HE3 LYS A 875 -15.111 -0.409 10.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 875 -15.650 1.727 11.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 875 -13.980 1.625 10.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 875 -14.965 2.540 9.810 1.00 0.00 H new ATOM 1373 N GLY A 876 -17.799 -0.472 4.492 1.00 0.00 N ATOM 1374 CA GLY A 876 -19.165 -0.239 4.076 1.00 0.00 C ATOM 1375 C GLY A 876 -19.631 -1.215 3.015 1.00 0.00 C ATOM 1376 O GLY A 876 -20.765 -1.687 3.061 1.00 0.00 O ATOM 0 H GLY A 876 -17.117 0.188 4.118 1.00 0.00 H new ATOM 0 HA2 GLY A 876 -19.821 -0.312 4.943 1.00 0.00 H new ATOM 0 HA3 GLY A 876 -19.255 0.777 3.693 1.00 0.00 H new ATOM 1380 N ALA A 877 -18.750 -1.532 2.071 1.00 0.00 N ATOM 1381 CA ALA A 877 -19.098 -2.414 0.962 1.00 0.00 C ATOM 1382 C ALA A 877 -19.225 -3.856 1.426 1.00 0.00 C ATOM 1383 O ALA A 877 -19.961 -4.649 0.839 1.00 0.00 O ATOM 1384 CB ALA A 877 -18.053 -2.307 -0.138 1.00 0.00 C ATOM 0 H ALA A 877 -17.789 -1.191 2.052 1.00 0.00 H new ATOM 0 HA ALA A 877 -20.065 -2.100 0.569 1.00 0.00 H new ATOM 0 HB1 ALA A 877 -18.322 -2.969 -0.961 1.00 0.00 H new ATOM 0 HB2 ALA A 877 -18.008 -1.279 -0.499 1.00 0.00 H new ATOM 0 HB3 ALA A 877 -17.079 -2.596 0.256 1.00 0.00 H new ATOM 1390 N ALA A 878 -18.494 -4.190 2.473 1.00 0.00 N ATOM 1391 CA ALA A 878 -18.518 -5.532 3.014 1.00 0.00 C ATOM 1392 C ALA A 878 -19.685 -5.716 3.970 1.00 0.00 C ATOM 1393 O ALA A 878 -20.599 -6.492 3.699 1.00 0.00 O ATOM 1394 CB ALA A 878 -17.212 -5.832 3.722 1.00 0.00 C ATOM 0 H ALA A 878 -17.875 -3.546 2.966 1.00 0.00 H new ATOM 0 HA ALA A 878 -18.645 -6.229 2.186 1.00 0.00 H new ATOM 0 HB1 ALA A 878 -17.241 -6.844 4.125 1.00 0.00 H new ATOM 0 HB2 ALA A 878 -16.387 -5.746 3.015 1.00 0.00 H new ATOM 0 HB3 ALA A 878 -17.068 -5.121 4.536 1.00 0.00 H new ATOM 1400 N ALA A 879 -19.652 -4.985 5.083 1.00 0.00 N ATOM 1401 CA ALA A 879 -20.646 -5.146 6.138 1.00 0.00 C ATOM 1402 C ALA A 879 -22.051 -4.885 5.614 1.00 0.00 C ATOM 1403 O ALA A 879 -23.014 -5.510 6.058 1.00 0.00 O ATOM 1404 CB ALA A 879 -20.328 -4.233 7.308 1.00 0.00 C ATOM 0 H ALA A 879 -18.946 -4.275 5.276 1.00 0.00 H new ATOM 0 HA ALA A 879 -20.609 -6.179 6.485 1.00 0.00 H new ATOM 0 HB1 ALA A 879 -21.079 -4.365 8.087 1.00 0.00 H new ATOM 0 HB2 ALA A 879 -19.344 -4.481 7.706 1.00 0.00 H new ATOM 0 HB3 ALA A 879 -20.332 -3.196 6.972 1.00 0.00 H new ATOM 1410 N HIS A 880 -22.170 -3.938 4.695 1.00 0.00 N ATOM 1411 CA HIS A 880 -23.415 -3.729 3.972 1.00 0.00 C ATOM 1412 C HIS A 880 -23.252 -4.214 2.532 1.00 0.00 C ATOM 1413 O HIS A 880 -22.976 -3.421 1.633 1.00 0.00 O ATOM 1414 CB HIS A 880 -23.830 -2.254 4.010 1.00 0.00 C ATOM 1415 CG HIS A 880 -24.099 -1.749 5.395 1.00 0.00 C ATOM 1416 ND1 HIS A 880 -23.434 -0.676 5.956 1.00 0.00 N ATOM 1417 CD2 HIS A 880 -24.966 -2.185 6.340 1.00 0.00 C ATOM 1418 CE1 HIS A 880 -23.879 -0.480 7.182 1.00 0.00 C ATOM 1419 NE2 HIS A 880 -24.807 -1.381 7.438 1.00 0.00 N ATOM 0 H HIS A 880 -21.418 -3.301 4.432 1.00 0.00 H new ATOM 0 HA HIS A 880 -24.207 -4.303 4.453 1.00 0.00 H new ATOM 0 HB2 HIS A 880 -23.043 -1.651 3.557 1.00 0.00 H new ATOM 0 HB3 HIS A 880 -24.724 -2.120 3.402 1.00 0.00 H new ATOM 0 HD2 HIS A 880 -25.654 -3.012 6.246 1.00 0.00 H new ATOM 0 HE1 HIS A 880 -23.541 0.288 7.861 1.00 0.00 H new ATOM 0 HE2 HIS A 880 -25.324 -1.466 8.313 1.00 0.00 H new ATOM 1427 N PRO A 881 -23.413 -5.529 2.301 1.00 0.00 N ATOM 1428 CA PRO A 881 -23.108 -6.149 1.005 1.00 0.00 C ATOM 1429 C PRO A 881 -24.033 -5.670 -0.115 1.00 0.00 C ATOM 1430 O PRO A 881 -23.671 -5.691 -1.293 1.00 0.00 O ATOM 1431 CB PRO A 881 -23.318 -7.645 1.261 1.00 0.00 C ATOM 1432 CG PRO A 881 -24.238 -7.711 2.428 1.00 0.00 C ATOM 1433 CD PRO A 881 -23.919 -6.513 3.275 1.00 0.00 C ATOM 0 HA PRO A 881 -22.103 -5.894 0.669 1.00 0.00 H new ATOM 0 HB2 PRO A 881 -23.750 -8.138 0.390 1.00 0.00 H new ATOM 0 HB3 PRO A 881 -22.373 -8.145 1.474 1.00 0.00 H new ATOM 0 HG2 PRO A 881 -25.279 -7.695 2.105 1.00 0.00 H new ATOM 0 HG3 PRO A 881 -24.092 -8.635 2.988 1.00 0.00 H new ATOM 0 HD2 PRO A 881 -24.802 -6.144 3.797 1.00 0.00 H new ATOM 0 HD3 PRO A 881 -23.173 -6.746 4.035 1.00 0.00 H new ATOM 1441 N ASP A 882 -25.228 -5.229 0.263 1.00 0.00 N ATOM 1442 CA ASP A 882 -26.242 -4.824 -0.708 1.00 0.00 C ATOM 1443 C ASP A 882 -25.932 -3.464 -1.309 1.00 0.00 C ATOM 1444 O ASP A 882 -26.349 -3.169 -2.427 1.00 0.00 O ATOM 1445 CB ASP A 882 -27.630 -4.784 -0.065 1.00 0.00 C ATOM 1446 CG ASP A 882 -28.082 -6.138 0.435 1.00 0.00 C ATOM 1447 OD1 ASP A 882 -28.527 -6.965 -0.389 1.00 0.00 O ATOM 1448 OD2 ASP A 882 -27.992 -6.383 1.654 1.00 0.00 O ATOM 0 H ASP A 882 -25.520 -5.142 1.236 1.00 0.00 H new ATOM 0 HA ASP A 882 -26.232 -5.568 -1.504 1.00 0.00 H new ATOM 0 HB2 ASP A 882 -27.620 -4.079 0.766 1.00 0.00 H new ATOM 0 HB3 ASP A 882 -28.352 -4.410 -0.791 1.00 0.00 H new ATOM 1453 N SER A 883 -25.195 -2.643 -0.571 1.00 0.00 N ATOM 1454 CA SER A 883 -24.931 -1.271 -0.981 1.00 0.00 C ATOM 1455 C SER A 883 -24.055 -1.212 -2.232 1.00 0.00 C ATOM 1456 O SER A 883 -22.831 -1.340 -2.154 1.00 0.00 O ATOM 1457 CB SER A 883 -24.272 -0.505 0.163 1.00 0.00 C ATOM 1458 OG SER A 883 -25.106 -0.490 1.310 1.00 0.00 O ATOM 0 H SER A 883 -24.769 -2.906 0.318 1.00 0.00 H new ATOM 0 HA SER A 883 -25.885 -0.805 -1.227 1.00 0.00 H new ATOM 0 HB2 SER A 883 -23.315 -0.965 0.410 1.00 0.00 H new ATOM 0 HB3 SER A 883 -24.062 0.517 -0.152 1.00 0.00 H new ATOM 0 HG SER A 883 -24.663 0.005 2.030 1.00 0.00 H new ATOM 1464 N GLU A 884 -24.696 -1.016 -3.381 1.00 0.00 N ATOM 1465 CA GLU A 884 -23.999 -0.910 -4.656 1.00 0.00 C ATOM 1466 C GLU A 884 -23.077 0.307 -4.668 1.00 0.00 C ATOM 1467 O GLU A 884 -21.972 0.259 -5.209 1.00 0.00 O ATOM 1468 CB GLU A 884 -25.017 -0.816 -5.797 1.00 0.00 C ATOM 1469 CG GLU A 884 -24.395 -0.789 -7.184 1.00 0.00 C ATOM 1470 CD GLU A 884 -23.578 -2.029 -7.480 1.00 0.00 C ATOM 1471 OE1 GLU A 884 -24.174 -3.063 -7.837 1.00 0.00 O ATOM 1472 OE2 GLU A 884 -22.336 -1.975 -7.353 1.00 0.00 O ATOM 0 H GLU A 884 -25.710 -0.927 -3.453 1.00 0.00 H new ATOM 0 HA GLU A 884 -23.387 -1.801 -4.795 1.00 0.00 H new ATOM 0 HB2 GLU A 884 -25.698 -1.665 -5.733 1.00 0.00 H new ATOM 0 HB3 GLU A 884 -25.616 0.085 -5.662 1.00 0.00 H new ATOM 0 HG2 GLU A 884 -25.184 -0.691 -7.930 1.00 0.00 H new ATOM 0 HG3 GLU A 884 -23.759 0.091 -7.276 1.00 0.00 H new ATOM 1479 N GLU A 885 -23.526 1.395 -4.052 1.00 0.00 N ATOM 1480 CA GLU A 885 -22.730 2.612 -3.998 1.00 0.00 C ATOM 1481 C GLU A 885 -21.442 2.382 -3.222 1.00 0.00 C ATOM 1482 O GLU A 885 -20.386 2.884 -3.604 1.00 0.00 O ATOM 1483 CB GLU A 885 -23.523 3.762 -3.383 1.00 0.00 C ATOM 1484 CG GLU A 885 -24.653 4.243 -4.272 1.00 0.00 C ATOM 1485 CD GLU A 885 -24.178 4.543 -5.677 1.00 0.00 C ATOM 1486 OE1 GLU A 885 -23.515 5.585 -5.879 1.00 0.00 O ATOM 1487 OE2 GLU A 885 -24.438 3.729 -6.580 1.00 0.00 O ATOM 0 H GLU A 885 -24.431 1.458 -3.586 1.00 0.00 H new ATOM 0 HA GLU A 885 -22.473 2.885 -5.021 1.00 0.00 H new ATOM 0 HB2 GLU A 885 -23.933 3.442 -2.425 1.00 0.00 H new ATOM 0 HB3 GLU A 885 -22.848 4.594 -3.180 1.00 0.00 H new ATOM 0 HG2 GLU A 885 -25.435 3.484 -4.308 1.00 0.00 H new ATOM 0 HG3 GLU A 885 -25.098 5.139 -3.840 1.00 0.00 H new ATOM 1494 N GLN A 886 -21.530 1.610 -2.146 1.00 0.00 N ATOM 1495 CA GLN A 886 -20.355 1.265 -1.362 1.00 0.00 C ATOM 1496 C GLN A 886 -19.398 0.410 -2.181 1.00 0.00 C ATOM 1497 O GLN A 886 -18.182 0.536 -2.052 1.00 0.00 O ATOM 1498 CB GLN A 886 -20.746 0.533 -0.079 1.00 0.00 C ATOM 1499 CG GLN A 886 -21.360 1.437 0.979 1.00 0.00 C ATOM 1500 CD GLN A 886 -20.414 2.532 1.437 1.00 0.00 C ATOM 1501 OE1 GLN A 886 -20.846 3.618 1.816 1.00 0.00 O ATOM 1502 NE2 GLN A 886 -19.116 2.259 1.411 1.00 0.00 N ATOM 0 H GLN A 886 -22.402 1.212 -1.798 1.00 0.00 H new ATOM 0 HA GLN A 886 -19.852 2.193 -1.088 1.00 0.00 H new ATOM 0 HB2 GLN A 886 -21.455 -0.258 -0.324 1.00 0.00 H new ATOM 0 HB3 GLN A 886 -19.862 0.050 0.337 1.00 0.00 H new ATOM 0 HG2 GLN A 886 -22.268 1.890 0.581 1.00 0.00 H new ATOM 0 HG3 GLN A 886 -21.655 0.835 1.838 1.00 0.00 H new ATOM 0 HE21 GLN A 886 -18.793 1.346 1.090 1.00 0.00 H new ATOM 0 HE22 GLN A 886 -18.441 2.962 1.712 1.00 0.00 H new ATOM 1511 N GLN A 887 -19.954 -0.446 -3.034 1.00 0.00 N ATOM 1512 CA GLN A 887 -19.142 -1.285 -3.905 1.00 0.00 C ATOM 1513 C GLN A 887 -18.296 -0.412 -4.827 1.00 0.00 C ATOM 1514 O GLN A 887 -17.089 -0.610 -4.945 1.00 0.00 O ATOM 1515 CB GLN A 887 -20.017 -2.228 -4.737 1.00 0.00 C ATOM 1516 CG GLN A 887 -20.955 -3.097 -3.911 1.00 0.00 C ATOM 1517 CD GLN A 887 -20.236 -3.918 -2.857 1.00 0.00 C ATOM 1518 OE1 GLN A 887 -19.076 -4.291 -3.024 1.00 0.00 O ATOM 1519 NE2 GLN A 887 -20.923 -4.211 -1.765 1.00 0.00 N ATOM 0 H GLN A 887 -20.960 -0.575 -3.139 1.00 0.00 H new ATOM 0 HA GLN A 887 -18.488 -1.892 -3.279 1.00 0.00 H new ATOM 0 HB2 GLN A 887 -20.608 -1.636 -5.435 1.00 0.00 H new ATOM 0 HB3 GLN A 887 -19.372 -2.873 -5.333 1.00 0.00 H new ATOM 0 HG2 GLN A 887 -21.695 -2.461 -3.425 1.00 0.00 H new ATOM 0 HG3 GLN A 887 -21.499 -3.768 -4.576 1.00 0.00 H new ATOM 0 HE21 GLN A 887 -21.884 -3.883 -1.663 1.00 0.00 H new ATOM 0 HE22 GLN A 887 -20.492 -4.765 -1.025 1.00 0.00 H new ATOM 1528 N GLN A 888 -18.934 0.569 -5.459 1.00 0.00 N ATOM 1529 CA GLN A 888 -18.225 1.503 -6.328 1.00 0.00 C ATOM 1530 C GLN A 888 -17.221 2.333 -5.534 1.00 0.00 C ATOM 1531 O GLN A 888 -16.096 2.553 -5.986 1.00 0.00 O ATOM 1532 CB GLN A 888 -19.198 2.423 -7.062 1.00 0.00 C ATOM 1533 CG GLN A 888 -18.488 3.456 -7.921 1.00 0.00 C ATOM 1534 CD GLN A 888 -17.571 2.825 -8.952 1.00 0.00 C ATOM 1535 OE1 GLN A 888 -17.848 1.746 -9.473 1.00 0.00 O ATOM 1536 NE2 GLN A 888 -16.448 3.473 -9.223 1.00 0.00 N ATOM 0 H GLN A 888 -19.937 0.738 -5.386 1.00 0.00 H new ATOM 0 HA GLN A 888 -17.684 0.913 -7.068 1.00 0.00 H new ATOM 0 HB2 GLN A 888 -19.856 1.823 -7.691 1.00 0.00 H new ATOM 0 HB3 GLN A 888 -19.830 2.933 -6.335 1.00 0.00 H new ATOM 0 HG2 GLN A 888 -19.230 4.073 -8.429 1.00 0.00 H new ATOM 0 HG3 GLN A 888 -17.907 4.119 -7.280 1.00 0.00 H new ATOM 0 HE21 GLN A 888 -16.253 4.366 -8.771 1.00 0.00 H new ATOM 0 HE22 GLN A 888 -15.778 3.079 -9.884 1.00 0.00 H new ATOM 1545 N ARG A 889 -17.630 2.789 -4.354 1.00 0.00 N ATOM 1546 CA ARG A 889 -16.741 3.549 -3.481 1.00 0.00 C ATOM 1547 C ARG A 889 -15.481 2.749 -3.185 1.00 0.00 C ATOM 1548 O ARG A 889 -14.380 3.291 -3.166 1.00 0.00 O ATOM 1549 CB ARG A 889 -17.438 3.914 -2.168 1.00 0.00 C ATOM 1550 CG ARG A 889 -18.525 4.966 -2.313 1.00 0.00 C ATOM 1551 CD ARG A 889 -19.184 5.260 -0.975 1.00 0.00 C ATOM 1552 NE ARG A 889 -20.199 6.309 -1.067 1.00 0.00 N ATOM 1553 CZ ARG A 889 -20.768 6.876 -0.005 1.00 0.00 C ATOM 1554 NH1 ARG A 889 -20.430 6.482 1.218 1.00 0.00 N ATOM 1555 NH2 ARG A 889 -21.680 7.828 -0.161 1.00 0.00 N ATOM 0 H ARG A 889 -18.568 2.646 -3.981 1.00 0.00 H new ATOM 0 HA ARG A 889 -16.472 4.470 -3.998 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -17.875 3.013 -1.739 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -16.691 4.274 -1.461 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -18.097 5.882 -2.720 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -19.276 4.622 -3.024 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -19.643 4.348 -0.592 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -18.421 5.560 -0.256 1.00 0.00 H new ATOM 0 HE ARG A 889 -20.486 6.623 -1.994 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -19.735 5.746 1.343 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -20.865 6.916 2.032 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -21.948 8.129 -1.098 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -22.113 8.259 0.656 1.00 0.00 H new ATOM 1569 N LEU A 890 -15.655 1.451 -2.971 1.00 0.00 N ATOM 1570 CA LEU A 890 -14.538 0.562 -2.706 1.00 0.00 C ATOM 1571 C LEU A 890 -13.669 0.391 -3.944 1.00 0.00 C ATOM 1572 O LEU A 890 -12.449 0.352 -3.843 1.00 0.00 O ATOM 1573 CB LEU A 890 -15.037 -0.798 -2.222 1.00 0.00 C ATOM 1574 CG LEU A 890 -13.945 -1.846 -1.991 1.00 0.00 C ATOM 1575 CD1 LEU A 890 -12.940 -1.354 -0.961 1.00 0.00 C ATOM 1576 CD2 LEU A 890 -14.562 -3.155 -1.544 1.00 0.00 C ATOM 0 H LEU A 890 -16.566 0.991 -2.977 1.00 0.00 H new ATOM 0 HA LEU A 890 -13.931 1.013 -1.921 1.00 0.00 H new ATOM 0 HB2 LEU A 890 -15.585 -0.656 -1.291 1.00 0.00 H new ATOM 0 HB3 LEU A 890 -15.745 -1.189 -2.953 1.00 0.00 H new ATOM 0 HG LEU A 890 -13.419 -2.011 -2.931 1.00 0.00 H new ATOM 0 HD11 LEU A 890 -12.172 -2.113 -0.811 1.00 0.00 H new ATOM 0 HD12 LEU A 890 -12.476 -0.434 -1.316 1.00 0.00 H new ATOM 0 HD13 LEU A 890 -13.450 -1.163 -0.017 1.00 0.00 H new ATOM 0 HD21 LEU A 890 -13.775 -3.892 -1.383 1.00 0.00 H new ATOM 0 HD22 LEU A 890 -15.110 -3.000 -0.614 1.00 0.00 H new ATOM 0 HD23 LEU A 890 -15.246 -3.516 -2.312 1.00 0.00 H new ATOM 1588 N ARG A 891 -14.300 0.294 -5.107 1.00 0.00 N ATOM 1589 CA ARG A 891 -13.568 0.102 -6.356 1.00 0.00 C ATOM 1590 C ARG A 891 -12.563 1.224 -6.576 1.00 0.00 C ATOM 1591 O ARG A 891 -11.367 0.978 -6.712 1.00 0.00 O ATOM 1592 CB ARG A 891 -14.525 0.026 -7.545 1.00 0.00 C ATOM 1593 CG ARG A 891 -15.464 -1.164 -7.501 1.00 0.00 C ATOM 1594 CD ARG A 891 -16.259 -1.288 -8.788 1.00 0.00 C ATOM 1595 NE ARG A 891 -15.400 -1.602 -9.928 1.00 0.00 N ATOM 1596 CZ ARG A 891 -15.852 -1.867 -11.154 1.00 0.00 C ATOM 1597 NH1 ARG A 891 -17.150 -1.771 -11.424 1.00 0.00 N ATOM 1598 NH2 ARG A 891 -15.003 -2.205 -12.117 1.00 0.00 N ATOM 0 H ARG A 891 -15.313 0.345 -5.213 1.00 0.00 H new ATOM 0 HA ARG A 891 -13.029 -0.842 -6.278 1.00 0.00 H new ATOM 0 HB2 ARG A 891 -15.115 0.941 -7.583 1.00 0.00 H new ATOM 0 HB3 ARG A 891 -13.943 -0.016 -8.466 1.00 0.00 H new ATOM 0 HG2 ARG A 891 -14.891 -2.076 -7.336 1.00 0.00 H new ATOM 0 HG3 ARG A 891 -16.147 -1.060 -6.658 1.00 0.00 H new ATOM 0 HD2 ARG A 891 -17.013 -2.067 -8.676 1.00 0.00 H new ATOM 0 HD3 ARG A 891 -16.790 -0.355 -8.979 1.00 0.00 H new ATOM 0 HE ARG A 891 -14.392 -1.620 -9.776 1.00 0.00 H new ATOM 0 HH11 ARG A 891 -17.804 -1.494 -10.692 1.00 0.00 H new ATOM 0 HH12 ARG A 891 -17.492 -1.975 -12.363 1.00 0.00 H new ATOM 0 HH21 ARG A 891 -14.004 -2.262 -11.919 1.00 0.00 H new ATOM 0 HH22 ARG A 891 -15.350 -2.408 -13.055 1.00 0.00 H new ATOM 1612 N GLU A 892 -13.049 2.458 -6.576 1.00 0.00 N ATOM 1613 CA GLU A 892 -12.191 3.613 -6.818 1.00 0.00 C ATOM 1614 C GLU A 892 -11.199 3.819 -5.677 1.00 0.00 C ATOM 1615 O GLU A 892 -10.079 4.288 -5.896 1.00 0.00 O ATOM 1616 CB GLU A 892 -13.032 4.872 -7.027 1.00 0.00 C ATOM 1617 CG GLU A 892 -14.082 5.101 -5.955 1.00 0.00 C ATOM 1618 CD GLU A 892 -14.777 6.435 -6.101 1.00 0.00 C ATOM 1619 OE1 GLU A 892 -15.621 6.580 -7.011 1.00 0.00 O ATOM 1620 OE2 GLU A 892 -14.483 7.354 -5.308 1.00 0.00 O ATOM 0 H GLU A 892 -14.030 2.686 -6.412 1.00 0.00 H new ATOM 0 HA GLU A 892 -11.620 3.418 -7.726 1.00 0.00 H new ATOM 0 HB2 GLU A 892 -12.369 5.737 -7.062 1.00 0.00 H new ATOM 0 HB3 GLU A 892 -13.526 4.809 -7.997 1.00 0.00 H new ATOM 0 HG2 GLU A 892 -14.822 4.302 -6.000 1.00 0.00 H new ATOM 0 HG3 GLU A 892 -13.612 5.045 -4.973 1.00 0.00 H new ATOM 1627 N ALA A 893 -11.614 3.471 -4.466 1.00 0.00 N ATOM 1628 CA ALA A 893 -10.738 3.564 -3.305 1.00 0.00 C ATOM 1629 C ALA A 893 -9.607 2.548 -3.398 1.00 0.00 C ATOM 1630 O ALA A 893 -8.441 2.889 -3.206 1.00 0.00 O ATOM 1631 CB ALA A 893 -11.522 3.358 -2.019 1.00 0.00 C ATOM 0 H ALA A 893 -12.551 3.122 -4.262 1.00 0.00 H new ATOM 0 HA ALA A 893 -10.306 4.565 -3.291 1.00 0.00 H new ATOM 0 HB1 ALA A 893 -10.848 3.432 -1.166 1.00 0.00 H new ATOM 0 HB2 ALA A 893 -12.295 4.122 -1.938 1.00 0.00 H new ATOM 0 HB3 ALA A 893 -11.987 2.372 -2.030 1.00 0.00 H new ATOM 1637 N ALA A 894 -9.958 1.305 -3.710 1.00 0.00 N ATOM 1638 CA ALA A 894 -8.980 0.233 -3.830 1.00 0.00 C ATOM 1639 C ALA A 894 -8.026 0.493 -4.984 1.00 0.00 C ATOM 1640 O ALA A 894 -6.829 0.246 -4.872 1.00 0.00 O ATOM 1641 CB ALA A 894 -9.669 -1.111 -4.007 1.00 0.00 C ATOM 0 H ALA A 894 -10.920 1.015 -3.885 1.00 0.00 H new ATOM 0 HA ALA A 894 -8.402 0.206 -2.907 1.00 0.00 H new ATOM 0 HB1 ALA A 894 -8.918 -1.896 -4.094 1.00 0.00 H new ATOM 0 HB2 ALA A 894 -10.304 -1.311 -3.144 1.00 0.00 H new ATOM 0 HB3 ALA A 894 -10.280 -1.091 -4.910 1.00 0.00 H new ATOM 1647 N GLU A 895 -8.559 0.997 -6.092 1.00 0.00 N ATOM 1648 CA GLU A 895 -7.728 1.352 -7.235 1.00 0.00 C ATOM 1649 C GLU A 895 -6.778 2.486 -6.867 1.00 0.00 C ATOM 1650 O GLU A 895 -5.618 2.494 -7.279 1.00 0.00 O ATOM 1651 CB GLU A 895 -8.590 1.746 -8.435 1.00 0.00 C ATOM 1652 CG GLU A 895 -9.370 0.583 -9.027 1.00 0.00 C ATOM 1653 CD GLU A 895 -10.141 0.970 -10.271 1.00 0.00 C ATOM 1654 OE1 GLU A 895 -9.500 1.322 -11.285 1.00 0.00 O ATOM 1655 OE2 GLU A 895 -11.389 0.908 -10.251 1.00 0.00 O ATOM 0 H GLU A 895 -9.556 1.168 -6.222 1.00 0.00 H new ATOM 0 HA GLU A 895 -7.139 0.478 -7.513 1.00 0.00 H new ATOM 0 HB2 GLU A 895 -9.289 2.525 -8.130 1.00 0.00 H new ATOM 0 HB3 GLU A 895 -7.951 2.175 -9.207 1.00 0.00 H new ATOM 0 HG2 GLU A 895 -8.681 -0.226 -9.269 1.00 0.00 H new ATOM 0 HG3 GLU A 895 -10.064 0.198 -8.280 1.00 0.00 H new ATOM 1662 N GLY A 896 -7.271 3.432 -6.075 1.00 0.00 N ATOM 1663 CA GLY A 896 -6.432 4.518 -5.598 1.00 0.00 C ATOM 1664 C GLY A 896 -5.363 4.024 -4.643 1.00 0.00 C ATOM 1665 O GLY A 896 -4.204 4.426 -4.734 1.00 0.00 O ATOM 0 H GLY A 896 -8.238 3.467 -5.754 1.00 0.00 H new ATOM 0 HA2 GLY A 896 -5.961 5.013 -6.447 1.00 0.00 H new ATOM 0 HA3 GLY A 896 -7.051 5.263 -5.098 1.00 0.00 H new ATOM 1669 N LEU A 897 -5.761 3.143 -3.730 1.00 0.00 N ATOM 1670 CA LEU A 897 -4.837 2.528 -2.786 1.00 0.00 C ATOM 1671 C LEU A 897 -3.786 1.714 -3.539 1.00 0.00 C ATOM 1672 O LEU A 897 -2.589 1.800 -3.252 1.00 0.00 O ATOM 1673 CB LEU A 897 -5.624 1.650 -1.795 1.00 0.00 C ATOM 1674 CG LEU A 897 -4.831 1.024 -0.634 1.00 0.00 C ATOM 1675 CD1 LEU A 897 -4.157 -0.270 -1.060 1.00 0.00 C ATOM 1676 CD2 LEU A 897 -3.801 2.002 -0.096 1.00 0.00 C ATOM 0 H LEU A 897 -6.728 2.837 -3.625 1.00 0.00 H new ATOM 0 HA LEU A 897 -4.317 3.302 -2.221 1.00 0.00 H new ATOM 0 HB2 LEU A 897 -6.426 2.254 -1.371 1.00 0.00 H new ATOM 0 HB3 LEU A 897 -6.095 0.844 -2.357 1.00 0.00 H new ATOM 0 HG LEU A 897 -5.539 0.791 0.161 1.00 0.00 H new ATOM 0 HD11 LEU A 897 -3.605 -0.687 -0.218 1.00 0.00 H new ATOM 0 HD12 LEU A 897 -4.913 -0.983 -1.387 1.00 0.00 H new ATOM 0 HD13 LEU A 897 -3.469 -0.069 -1.881 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -3.252 1.538 0.724 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -3.106 2.272 -0.891 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -4.305 2.898 0.266 1.00 0.00 H new ATOM 1688 N ARG A 898 -4.247 0.935 -4.511 1.00 0.00 N ATOM 1689 CA ARG A 898 -3.360 0.147 -5.353 1.00 0.00 C ATOM 1690 C ARG A 898 -2.370 1.053 -6.074 1.00 0.00 C ATOM 1691 O ARG A 898 -1.167 0.811 -6.046 1.00 0.00 O ATOM 1692 CB ARG A 898 -4.172 -0.660 -6.369 1.00 0.00 C ATOM 1693 CG ARG A 898 -3.322 -1.526 -7.287 1.00 0.00 C ATOM 1694 CD ARG A 898 -4.177 -2.304 -8.273 1.00 0.00 C ATOM 1695 NE ARG A 898 -4.934 -1.425 -9.163 1.00 0.00 N ATOM 1696 CZ ARG A 898 -5.942 -1.834 -9.935 1.00 0.00 C ATOM 1697 NH1 ARG A 898 -6.299 -3.117 -9.945 1.00 0.00 N ATOM 1698 NH2 ARG A 898 -6.585 -0.962 -10.705 1.00 0.00 N ATOM 0 H ARG A 898 -5.237 0.833 -4.735 1.00 0.00 H new ATOM 0 HA ARG A 898 -2.804 -0.544 -4.720 1.00 0.00 H new ATOM 0 HB2 ARG A 898 -4.876 -1.297 -5.834 1.00 0.00 H new ATOM 0 HB3 ARG A 898 -4.762 0.027 -6.976 1.00 0.00 H new ATOM 0 HG2 ARG A 898 -2.618 -0.897 -7.832 1.00 0.00 H new ATOM 0 HG3 ARG A 898 -2.732 -2.221 -6.689 1.00 0.00 H new ATOM 0 HD2 ARG A 898 -3.539 -2.958 -8.868 1.00 0.00 H new ATOM 0 HD3 ARG A 898 -4.868 -2.945 -7.725 1.00 0.00 H new ATOM 0 HE ARG A 898 -4.676 -0.439 -9.196 1.00 0.00 H new ATOM 0 HH11 ARG A 898 -5.801 -3.789 -9.361 1.00 0.00 H new ATOM 0 HH12 ARG A 898 -7.070 -3.427 -10.536 1.00 0.00 H new ATOM 0 HH21 ARG A 898 -6.308 0.020 -10.705 1.00 0.00 H new ATOM 0 HH22 ARG A 898 -7.356 -1.274 -11.295 1.00 0.00 H new ATOM 1712 N MET A 899 -2.887 2.106 -6.695 1.00 0.00 N ATOM 1713 CA MET A 899 -2.056 3.054 -7.430 1.00 0.00 C ATOM 1714 C MET A 899 -1.035 3.718 -6.514 1.00 0.00 C ATOM 1715 O MET A 899 0.143 3.798 -6.850 1.00 0.00 O ATOM 1716 CB MET A 899 -2.925 4.124 -8.092 1.00 0.00 C ATOM 1717 CG MET A 899 -2.130 5.163 -8.865 1.00 0.00 C ATOM 1718 SD MET A 899 -3.166 6.489 -9.521 1.00 0.00 S ATOM 1719 CE MET A 899 -4.241 5.566 -10.617 1.00 0.00 C ATOM 0 H MET A 899 -3.883 2.326 -6.705 1.00 0.00 H new ATOM 0 HA MET A 899 -1.520 2.498 -8.199 1.00 0.00 H new ATOM 0 HB2 MET A 899 -3.629 3.640 -8.769 1.00 0.00 H new ATOM 0 HB3 MET A 899 -3.514 4.627 -7.325 1.00 0.00 H new ATOM 0 HG2 MET A 899 -1.369 5.591 -8.213 1.00 0.00 H new ATOM 0 HG3 MET A 899 -1.607 4.676 -9.688 1.00 0.00 H new ATOM 0 HE1 MET A 899 -4.726 6.251 -11.313 1.00 0.00 H new ATOM 0 HE2 MET A 899 -3.653 4.837 -11.175 1.00 0.00 H new ATOM 0 HE3 MET A 899 -5.000 5.047 -10.031 1.00 0.00 H new ATOM 1729 N ALA A 900 -1.492 4.190 -5.357 1.00 0.00 N ATOM 1730 CA ALA A 900 -0.615 4.856 -4.397 1.00 0.00 C ATOM 1731 C ALA A 900 0.511 3.930 -3.957 1.00 0.00 C ATOM 1732 O ALA A 900 1.681 4.320 -3.933 1.00 0.00 O ATOM 1733 CB ALA A 900 -1.413 5.331 -3.193 1.00 0.00 C ATOM 0 H ALA A 900 -2.466 4.124 -5.061 1.00 0.00 H new ATOM 0 HA ALA A 900 -0.170 5.723 -4.886 1.00 0.00 H new ATOM 0 HB1 ALA A 900 -0.746 5.825 -2.486 1.00 0.00 H new ATOM 0 HB2 ALA A 900 -2.181 6.033 -3.519 1.00 0.00 H new ATOM 0 HB3 ALA A 900 -1.885 4.476 -2.709 1.00 0.00 H new ATOM 1739 N THR A 901 0.155 2.699 -3.626 1.00 0.00 N ATOM 1740 CA THR A 901 1.131 1.710 -3.201 1.00 0.00 C ATOM 1741 C THR A 901 2.054 1.327 -4.352 1.00 0.00 C ATOM 1742 O THR A 901 3.268 1.218 -4.183 1.00 0.00 O ATOM 1743 CB THR A 901 0.436 0.447 -2.670 1.00 0.00 C ATOM 1744 OG1 THR A 901 -0.534 0.805 -1.680 1.00 0.00 O ATOM 1745 CG2 THR A 901 1.455 -0.510 -2.071 1.00 0.00 C ATOM 0 H THR A 901 -0.807 2.361 -3.644 1.00 0.00 H new ATOM 0 HA THR A 901 1.722 2.157 -2.402 1.00 0.00 H new ATOM 0 HB THR A 901 -0.064 -0.051 -3.501 1.00 0.00 H new ATOM 0 HG1 THR A 901 -1.326 1.180 -2.119 1.00 0.00 H new ATOM 0 HG21 THR A 901 0.945 -1.399 -1.700 1.00 0.00 H new ATOM 0 HG22 THR A 901 2.177 -0.798 -2.835 1.00 0.00 H new ATOM 0 HG23 THR A 901 1.975 -0.020 -1.248 1.00 0.00 H new ATOM 1753 N ASN A 902 1.467 1.131 -5.526 1.00 0.00 N ATOM 1754 CA ASN A 902 2.216 0.764 -6.716 1.00 0.00 C ATOM 1755 C ASN A 902 3.234 1.852 -7.061 1.00 0.00 C ATOM 1756 O ASN A 902 4.367 1.566 -7.448 1.00 0.00 O ATOM 1757 CB ASN A 902 1.260 0.550 -7.894 1.00 0.00 C ATOM 1758 CG ASN A 902 1.958 0.040 -9.138 1.00 0.00 C ATOM 1759 OD1 ASN A 902 2.445 0.815 -9.956 1.00 0.00 O ATOM 1760 ND2 ASN A 902 1.987 -1.274 -9.304 1.00 0.00 N ATOM 0 H ASN A 902 0.462 1.222 -5.677 1.00 0.00 H new ATOM 0 HA ASN A 902 2.750 -0.165 -6.518 1.00 0.00 H new ATOM 0 HB2 ASN A 902 0.486 -0.159 -7.602 1.00 0.00 H new ATOM 0 HB3 ASN A 902 0.760 1.491 -8.125 1.00 0.00 H new ATOM 0 HD21 ASN A 902 2.425 -1.674 -10.134 1.00 0.00 H new ATOM 0 HD22 ASN A 902 1.571 -1.886 -8.602 1.00 0.00 H new ATOM 1767 N ALA A 903 2.820 3.109 -6.904 1.00 0.00 N ATOM 1768 CA ALA A 903 3.700 4.245 -7.142 1.00 0.00 C ATOM 1769 C ALA A 903 4.834 4.270 -6.125 1.00 0.00 C ATOM 1770 O ALA A 903 5.994 4.464 -6.484 1.00 0.00 O ATOM 1771 CB ALA A 903 2.914 5.548 -7.095 1.00 0.00 C ATOM 0 H ALA A 903 1.876 3.363 -6.612 1.00 0.00 H new ATOM 0 HA ALA A 903 4.134 4.138 -8.136 1.00 0.00 H new ATOM 0 HB1 ALA A 903 3.588 6.386 -7.275 1.00 0.00 H new ATOM 0 HB2 ALA A 903 2.140 5.534 -7.862 1.00 0.00 H new ATOM 0 HB3 ALA A 903 2.451 5.659 -6.114 1.00 0.00 H new ATOM 1777 N ALA A 904 4.493 4.058 -4.858 1.00 0.00 N ATOM 1778 CA ALA A 904 5.492 3.984 -3.796 1.00 0.00 C ATOM 1779 C ALA A 904 6.461 2.834 -4.057 1.00 0.00 C ATOM 1780 O ALA A 904 7.648 2.922 -3.746 1.00 0.00 O ATOM 1781 CB ALA A 904 4.819 3.819 -2.443 1.00 0.00 C ATOM 0 H ALA A 904 3.532 3.934 -4.541 1.00 0.00 H new ATOM 0 HA ALA A 904 6.057 4.916 -3.786 1.00 0.00 H new ATOM 0 HB1 ALA A 904 5.578 3.766 -1.663 1.00 0.00 H new ATOM 0 HB2 ALA A 904 4.165 4.671 -2.255 1.00 0.00 H new ATOM 0 HB3 ALA A 904 4.230 2.902 -2.439 1.00 0.00 H new ATOM 1787 N ALA A 905 5.934 1.761 -4.636 1.00 0.00 N ATOM 1788 CA ALA A 905 6.737 0.613 -5.036 1.00 0.00 C ATOM 1789 C ALA A 905 7.784 1.020 -6.065 1.00 0.00 C ATOM 1790 O ALA A 905 8.949 0.631 -5.983 1.00 0.00 O ATOM 1791 CB ALA A 905 5.837 -0.471 -5.611 1.00 0.00 C ATOM 0 H ALA A 905 4.940 1.663 -4.841 1.00 0.00 H new ATOM 0 HA ALA A 905 7.251 0.226 -4.156 1.00 0.00 H new ATOM 0 HB1 ALA A 905 6.443 -1.327 -5.908 1.00 0.00 H new ATOM 0 HB2 ALA A 905 5.115 -0.782 -4.856 1.00 0.00 H new ATOM 0 HB3 ALA A 905 5.308 -0.081 -6.481 1.00 0.00 H new ATOM 1797 N GLN A 906 7.355 1.826 -7.024 1.00 0.00 N ATOM 1798 CA GLN A 906 8.221 2.273 -8.102 1.00 0.00 C ATOM 1799 C GLN A 906 9.182 3.352 -7.600 1.00 0.00 C ATOM 1800 O GLN A 906 10.271 3.539 -8.143 1.00 0.00 O ATOM 1801 CB GLN A 906 7.365 2.811 -9.250 1.00 0.00 C ATOM 1802 CG GLN A 906 7.998 2.647 -10.618 1.00 0.00 C ATOM 1803 CD GLN A 906 8.300 1.196 -10.941 1.00 0.00 C ATOM 1804 OE1 GLN A 906 9.402 0.710 -10.692 1.00 0.00 O ATOM 1805 NE2 GLN A 906 7.315 0.488 -11.472 1.00 0.00 N ATOM 0 H GLN A 906 6.402 2.186 -7.076 1.00 0.00 H new ATOM 0 HA GLN A 906 8.813 1.431 -8.461 1.00 0.00 H new ATOM 0 HB2 GLN A 906 6.402 2.300 -9.242 1.00 0.00 H new ATOM 0 HB3 GLN A 906 7.166 3.869 -9.077 1.00 0.00 H new ATOM 0 HG2 GLN A 906 7.330 3.055 -11.377 1.00 0.00 H new ATOM 0 HG3 GLN A 906 8.920 3.226 -10.661 1.00 0.00 H new ATOM 0 HE21 GLN A 906 6.415 0.929 -11.663 1.00 0.00 H new ATOM 0 HE22 GLN A 906 7.456 -0.498 -11.690 1.00 0.00 H new ATOM 1814 N ASN A 907 8.771 4.045 -6.544 1.00 0.00 N ATOM 1815 CA ASN A 907 9.585 5.098 -5.943 1.00 0.00 C ATOM 1816 C ASN A 907 10.668 4.523 -5.041 1.00 0.00 C ATOM 1817 O ASN A 907 11.515 5.257 -4.545 1.00 0.00 O ATOM 1818 CB ASN A 907 8.716 6.074 -5.138 1.00 0.00 C ATOM 1819 CG ASN A 907 7.948 7.045 -6.012 1.00 0.00 C ATOM 1820 OD1 ASN A 907 8.381 7.390 -7.111 1.00 0.00 O ATOM 1821 ND2 ASN A 907 6.808 7.506 -5.522 1.00 0.00 N ATOM 0 H ASN A 907 7.873 3.896 -6.083 1.00 0.00 H new ATOM 0 HA ASN A 907 10.063 5.635 -6.762 1.00 0.00 H new ATOM 0 HB2 ASN A 907 8.012 5.507 -4.529 1.00 0.00 H new ATOM 0 HB3 ASN A 907 9.350 6.635 -4.452 1.00 0.00 H new ATOM 0 HD21 ASN A 907 6.254 8.172 -6.060 1.00 0.00 H new ATOM 0 HD22 ASN A 907 6.484 7.195 -4.606 1.00 0.00 H new ATOM 1828 N ALA A 908 10.632 3.211 -4.824 1.00 0.00 N ATOM 1829 CA ALA A 908 11.628 2.545 -3.994 1.00 0.00 C ATOM 1830 C ALA A 908 13.030 2.766 -4.546 1.00 0.00 C ATOM 1831 O ALA A 908 13.370 2.273 -5.623 1.00 0.00 O ATOM 1832 CB ALA A 908 11.326 1.059 -3.895 1.00 0.00 C ATOM 0 H ALA A 908 9.923 2.589 -5.212 1.00 0.00 H new ATOM 0 HA ALA A 908 11.584 2.978 -2.995 1.00 0.00 H new ATOM 0 HB1 ALA A 908 12.078 0.576 -3.272 1.00 0.00 H new ATOM 0 HB2 ALA A 908 10.341 0.917 -3.451 1.00 0.00 H new ATOM 0 HB3 ALA A 908 11.342 0.617 -4.891 1.00 0.00 H new ATOM 1838 N ILE A 909 13.829 3.521 -3.810 1.00 0.00 N ATOM 1839 CA ILE A 909 15.176 3.850 -4.240 1.00 0.00 C ATOM 1840 C ILE A 909 16.138 2.721 -3.902 1.00 0.00 C ATOM 1841 O ILE A 909 16.118 2.186 -2.794 1.00 0.00 O ATOM 1842 CB ILE A 909 15.665 5.160 -3.582 1.00 0.00 C ATOM 1843 CG1 ILE A 909 14.695 6.301 -3.894 1.00 0.00 C ATOM 1844 CG2 ILE A 909 17.072 5.513 -4.049 1.00 0.00 C ATOM 1845 CD1 ILE A 909 14.493 6.544 -5.376 1.00 0.00 C ATOM 0 H ILE A 909 13.566 3.919 -2.908 1.00 0.00 H new ATOM 0 HA ILE A 909 15.152 3.989 -5.321 1.00 0.00 H new ATOM 0 HB ILE A 909 15.696 5.010 -2.503 1.00 0.00 H new ATOM 0 HG12 ILE A 909 13.730 6.081 -3.437 1.00 0.00 H new ATOM 0 HG13 ILE A 909 15.065 7.216 -3.432 1.00 0.00 H new ATOM 0 HG21 ILE A 909 17.392 6.439 -3.571 1.00 0.00 H new ATOM 0 HG22 ILE A 909 17.757 4.709 -3.779 1.00 0.00 H new ATOM 0 HG23 ILE A 909 17.074 5.644 -5.131 1.00 0.00 H new ATOM 0 HD11 ILE A 909 13.793 7.367 -5.518 1.00 0.00 H new ATOM 0 HD12 ILE A 909 15.448 6.797 -5.837 1.00 0.00 H new ATOM 0 HD13 ILE A 909 14.093 5.643 -5.841 1.00 0.00 H new ATOM 1857 N LYS A 910 16.965 2.349 -4.864 1.00 0.00 N ATOM 1858 CA LYS A 910 17.933 1.291 -4.652 1.00 0.00 C ATOM 1859 C LYS A 910 19.248 1.870 -4.157 1.00 0.00 C ATOM 1860 O LYS A 910 19.886 2.672 -4.841 1.00 0.00 O ATOM 1861 CB LYS A 910 18.161 0.494 -5.936 1.00 0.00 C ATOM 1862 CG LYS A 910 16.900 -0.159 -6.479 1.00 0.00 C ATOM 1863 CD LYS A 910 17.200 -1.103 -7.635 1.00 0.00 C ATOM 1864 CE LYS A 910 17.731 -2.452 -7.157 1.00 0.00 C ATOM 1865 NZ LYS A 910 19.071 -2.355 -6.519 1.00 0.00 N ATOM 0 H LYS A 910 16.984 2.763 -5.796 1.00 0.00 H new ATOM 0 HA LYS A 910 17.536 0.615 -3.895 1.00 0.00 H new ATOM 0 HB2 LYS A 910 18.573 1.157 -6.697 1.00 0.00 H new ATOM 0 HB3 LYS A 910 18.907 -0.278 -5.747 1.00 0.00 H new ATOM 0 HG2 LYS A 910 16.404 -0.710 -5.680 1.00 0.00 H new ATOM 0 HG3 LYS A 910 16.206 0.613 -6.812 1.00 0.00 H new ATOM 0 HD2 LYS A 910 16.293 -1.258 -8.219 1.00 0.00 H new ATOM 0 HD3 LYS A 910 17.931 -0.641 -8.298 1.00 0.00 H new ATOM 0 HE2 LYS A 910 17.026 -2.883 -6.446 1.00 0.00 H new ATOM 0 HE3 LYS A 910 17.786 -3.136 -8.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 910 19.540 -3.283 -6.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 910 19.649 -1.657 -7.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 910 18.963 -2.058 -5.528 1.00 0.00 H new ATOM 1879 N LYS A 911 19.629 1.488 -2.954 1.00 0.00 N ATOM 1880 CA LYS A 911 20.897 1.896 -2.384 1.00 0.00 C ATOM 1881 C LYS A 911 21.725 0.663 -2.059 1.00 0.00 C ATOM 1882 O LYS A 911 22.454 0.186 -2.954 1.00 0.00 O ATOM 1883 CB LYS A 911 20.674 2.739 -1.125 1.00 0.00 C ATOM 1884 CG LYS A 911 20.034 4.098 -1.388 1.00 0.00 C ATOM 1885 CD LYS A 911 21.073 5.185 -1.662 1.00 0.00 C ATOM 1886 CE LYS A 911 21.788 4.997 -2.994 1.00 0.00 C ATOM 1887 NZ LYS A 911 20.871 5.158 -4.155 1.00 0.00 N ATOM 1888 OXT LYS A 911 21.617 0.154 -0.924 1.00 0.00 O ATOM 0 H LYS A 911 19.071 0.888 -2.346 1.00 0.00 H new ATOM 0 HA LYS A 911 21.434 2.508 -3.109 1.00 0.00 H new ATOM 0 HB2 LYS A 911 20.043 2.180 -0.434 1.00 0.00 H new ATOM 0 HB3 LYS A 911 21.632 2.891 -0.629 1.00 0.00 H new ATOM 0 HG2 LYS A 911 19.359 4.020 -2.240 1.00 0.00 H new ATOM 0 HG3 LYS A 911 19.429 4.385 -0.528 1.00 0.00 H new ATOM 0 HD2 LYS A 911 20.584 6.159 -1.652 1.00 0.00 H new ATOM 0 HD3 LYS A 911 21.809 5.189 -0.858 1.00 0.00 H new ATOM 0 HE2 LYS A 911 22.601 5.719 -3.073 1.00 0.00 H new ATOM 0 HE3 LYS A 911 22.239 4.005 -3.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 911 21.424 5.393 -5.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 911 20.353 4.270 -4.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 911 20.194 5.923 -3.959 1.00 0.00 H new TER 1902 LYS A 911