USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 996 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 834 LYS NZ :NH3+ 172:sc= 0.697 (180deg=0.582) USER MOD Set 1.2: A 879 TYR OH : rot -174:sc= 1.33 USER MOD Set 2.1: A 830 MET CE :methyl 152:sc= 0 (180deg=-0.097) USER MOD Set 2.2: A 859 TYR OH : rot 173:sc= 0.0969 USER MOD Set 3.1: A 808 THR OG1 : rot -100:sc= -0.0292 USER MOD Set 3.2: A 810 GLN : amide:sc= 0.494 X(o=0.46,f=0.69) USER MOD Set 4.1: A 763 SER OG : rot -87:sc= 1.36 USER MOD Set 4.2: A 765 THR OG1 : rot 37:sc= 0.769 USER MOD Set 5.1: A 756 ASN : amide:sc= 0.635 K(o=0.46,f=1.2) USER MOD Set 5.2: A 762 HIS : no HD1:sc= -0.178 K(o=0.46,f=1.2) USER MOD Set 6.1: A 754 SER OG : rot -101:sc= 0.672 USER MOD Set 6.2: A 774 CYS SG : rot 180:sc= 0.564 USER MOD Single : A 742 SER OG : rot -25:sc= 0.0517 USER MOD Single : A 744 SER OG : rot -114:sc= 0.715 USER MOD Single : A 745 GLN : amide:sc= -0.52 K(o=-0.52,f=0) USER MOD Single : A 747 GLN : amide:sc= -0.0834 K(o=-0.083,f=-2.8!) USER MOD Single : A 748 MET CE :methyl 136:sc= -1.38 (180deg=-3.71!) USER MOD Single : A 749 ASN : amide:sc= 0.00257 X(o=0.0026,f=0) USER MOD Single : A 757 HIS : no HD1:sc= -0.298 K(o=-0.3,f=-1) USER MOD Single : A 772 LYS NZ :NH3+ -160:sc= 1.09 (180deg=1.02) USER MOD Single : A 777 SER OG : rot 132:sc= 1.32 USER MOD Single : A 780 TYR OH : rot 180:sc= -0.246 USER MOD Single : A 784 ASN : amide:sc= 0.0469 K(o=0.047,f=-1.1) USER MOD Single : A 787 GLN : amide:sc= -0.0427 X(o=-0.043,f=-0.041) USER MOD Single : A 796 MET CE :methyl -161:sc= -0.0401 (180deg=-0.374) USER MOD Single : A 797 SER OG : rot 180:sc= 0 USER MOD Single : A 802 ASN : amide:sc= -1.03 K(o=-1,f=0) USER MOD Single : A 816 MET CE :methyl 143:sc= -2.52 (180deg=-6.05!) USER MOD Single : A 817 SER OG : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot -90:sc= 0.888 USER MOD Single : A 823 THR OG1 : rot 180:sc= -0.0952 USER MOD Single : A 825 THR OG1 : rot 171:sc= 1.37 USER MOD Single : A 828 GLN : amide:sc= -0.304 X(o=-0.3,f=-0.00084) USER MOD Single : A 832 SER OG : rot 102:sc= 1.28 USER MOD Single : A 840 LYS NZ :NH3+ -121:sc= 0.0453 (180deg=-0.0726) USER MOD Single : A 841 ASN : amide:sc= 0.0481 K(o=0.048,f=-2.2!) USER MOD Single : A 842 TYR OH : rot 180:sc= 0 USER MOD Single : A 844 THR OG1 : rot -61:sc= 0.654 USER MOD Single : A 845 MET CE :methyl 156:sc= -0.0682 (180deg=-0.728) USER MOD Single : A 856 GLN : amide:sc= -0.718 K(o=-0.72,f=-5.5!) USER MOD Single : A 860 CYS SG : rot 17:sc= 1.51 USER MOD Single : A 864 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 867 TYR OH : rot 88:sc= 0.476 USER MOD Single : A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 881 SER OG : rot -50:sc= 0.523 USER MOD ----------------------------------------------------------------- ATOM 21 N SER A 742 -0.640 -10.622 -6.910 1.00 25.00 N ATOM 22 CA SER A 742 -1.492 -9.455 -6.671 1.00 25.00 C ATOM 23 C SER A 742 -1.688 -9.418 -5.157 1.00 25.00 C ATOM 24 O SER A 742 -0.920 -10.061 -4.434 1.00 25.00 O ATOM 25 CB SER A 742 -2.827 -9.591 -7.409 1.00 25.00 C ATOM 26 OG SER A 742 -3.527 -10.750 -6.995 1.00 25.00 O ATOM 0 HA SER A 742 -1.044 -8.533 -7.042 1.00 25.00 H new ATOM 0 HB2 SER A 742 -3.439 -8.708 -7.224 1.00 25.00 H new ATOM 0 HB3 SER A 742 -2.648 -9.636 -8.483 1.00 25.00 H new ATOM 0 HG SER A 742 -2.890 -11.414 -6.659 1.00 25.00 H new ATOM 32 N ILE A 743 -2.709 -8.721 -4.671 1.00 25.00 N ATOM 33 CA ILE A 743 -2.991 -8.697 -3.236 1.00 25.00 C ATOM 34 C ILE A 743 -3.238 -10.130 -2.718 1.00 25.00 C ATOM 35 O ILE A 743 -3.783 -10.987 -3.423 1.00 25.00 O ATOM 36 CB ILE A 743 -4.191 -7.764 -2.889 1.00 25.00 C ATOM 37 CG1 ILE A 743 -3.792 -6.917 -1.670 1.00 25.00 C ATOM 38 CG2 ILE A 743 -5.509 -8.574 -2.659 1.00 25.00 C ATOM 39 CD1 ILE A 743 -4.937 -6.365 -0.835 1.00 25.00 C ATOM 0 H ILE A 743 -3.351 -8.170 -5.241 1.00 25.00 H new ATOM 0 HA ILE A 743 -2.116 -8.286 -2.734 1.00 25.00 H new ATOM 0 HB ILE A 743 -4.409 -7.103 -3.728 1.00 25.00 H new ATOM 0 HG12 ILE A 743 -3.157 -7.523 -1.024 1.00 25.00 H new ATOM 0 HG13 ILE A 743 -3.186 -6.080 -2.017 1.00 25.00 H new ATOM 0 HG21 ILE A 743 -6.321 -7.887 -2.420 1.00 25.00 H new ATOM 0 HG22 ILE A 743 -5.758 -9.129 -3.564 1.00 25.00 H new ATOM 0 HG23 ILE A 743 -5.368 -9.271 -1.833 1.00 25.00 H new ATOM 0 HD11 ILE A 743 -4.535 -5.785 -0.004 1.00 25.00 H new ATOM 0 HD12 ILE A 743 -5.564 -5.724 -1.455 1.00 25.00 H new ATOM 0 HD13 ILE A 743 -5.534 -7.190 -0.446 1.00 25.00 H new ATOM 51 N SER A 744 -2.794 -10.394 -1.501 1.00 25.00 N ATOM 52 CA SER A 744 -2.914 -11.712 -0.902 1.00 25.00 C ATOM 53 C SER A 744 -4.129 -11.773 0.008 1.00 25.00 C ATOM 54 O SER A 744 -4.688 -10.741 0.397 1.00 25.00 O ATOM 55 CB SER A 744 -1.650 -12.026 -0.103 1.00 25.00 C ATOM 56 OG SER A 744 -1.594 -11.247 1.074 1.00 25.00 O ATOM 0 H SER A 744 -2.342 -9.703 -0.902 1.00 25.00 H new ATOM 0 HA SER A 744 -3.037 -12.451 -1.694 1.00 25.00 H new ATOM 0 HB2 SER A 744 -1.631 -13.085 0.155 1.00 25.00 H new ATOM 0 HB3 SER A 744 -0.770 -11.832 -0.715 1.00 25.00 H new ATOM 0 HG SER A 744 -0.838 -10.626 1.019 1.00 25.00 H new ATOM 62 N GLN A 745 -4.507 -12.981 0.402 1.00 25.00 N ATOM 63 CA GLN A 745 -5.614 -13.164 1.335 1.00 25.00 C ATOM 64 C GLN A 745 -5.254 -12.624 2.716 1.00 25.00 C ATOM 65 O GLN A 745 -6.129 -12.245 3.478 1.00 25.00 O ATOM 66 CB GLN A 745 -5.981 -14.647 1.450 1.00 25.00 C ATOM 67 CG GLN A 745 -6.778 -15.182 0.257 1.00 25.00 C ATOM 68 CD GLN A 745 -8.282 -15.203 0.510 1.00 25.00 C ATOM 69 OE1 GLN A 745 -8.926 -16.221 0.341 1.00 25.00 O ATOM 70 NE2 GLN A 745 -8.839 -14.085 0.904 1.00 25.00 N ATOM 0 H GLN A 745 -4.066 -13.847 0.092 1.00 25.00 H new ATOM 0 HA GLN A 745 -6.470 -12.610 0.949 1.00 25.00 H new ATOM 0 HB2 GLN A 745 -5.066 -15.231 1.555 1.00 25.00 H new ATOM 0 HB3 GLN A 745 -6.562 -14.798 2.360 1.00 25.00 H new ATOM 0 HG2 GLN A 745 -6.570 -14.566 -0.618 1.00 25.00 H new ATOM 0 HG3 GLN A 745 -6.440 -16.192 0.024 1.00 25.00 H new ATOM 0 HE21 GLN A 745 -8.269 -13.250 1.036 1.00 25.00 H new ATOM 0 HE22 GLN A 745 -9.843 -14.050 1.079 1.00 25.00 H new ATOM 79 N GLU A 746 -3.968 -12.570 3.028 1.00 25.00 N ATOM 80 CA GLU A 746 -3.531 -12.060 4.327 1.00 25.00 C ATOM 81 C GLU A 746 -3.481 -10.545 4.315 1.00 25.00 C ATOM 82 O GLU A 746 -3.925 -9.909 5.265 1.00 25.00 O ATOM 83 CB GLU A 746 -2.166 -12.623 4.700 1.00 25.00 C ATOM 84 CG GLU A 746 -2.230 -14.073 5.127 1.00 25.00 C ATOM 85 CD GLU A 746 -0.871 -14.600 5.562 1.00 25.00 C ATOM 86 OE1 GLU A 746 -0.106 -15.044 4.683 1.00 25.00 O ATOM 87 OE2 GLU A 746 -0.573 -14.581 6.779 1.00 25.00 O ATOM 0 H GLU A 746 -3.213 -12.868 2.410 1.00 25.00 H new ATOM 0 HA GLU A 746 -4.255 -12.383 5.075 1.00 25.00 H new ATOM 0 HB2 GLU A 746 -1.493 -12.529 3.848 1.00 25.00 H new ATOM 0 HB3 GLU A 746 -1.741 -12.029 5.509 1.00 25.00 H new ATOM 0 HG2 GLU A 746 -2.939 -14.178 5.948 1.00 25.00 H new ATOM 0 HG3 GLU A 746 -2.606 -14.678 4.302 1.00 25.00 H new ATOM 94 N GLN A 747 -3.026 -9.968 3.209 1.00 25.00 N ATOM 95 CA GLN A 747 -2.967 -8.515 3.078 1.00 25.00 C ATOM 96 C GLN A 747 -4.348 -7.922 3.232 1.00 25.00 C ATOM 97 O GLN A 747 -4.528 -6.914 3.891 1.00 25.00 O ATOM 98 CB GLN A 747 -2.424 -8.101 1.705 1.00 25.00 C ATOM 99 CG GLN A 747 -2.172 -6.597 1.565 1.00 25.00 C ATOM 100 CD GLN A 747 -1.117 -6.107 2.525 1.00 25.00 C ATOM 101 OE1 GLN A 747 0.057 -6.295 2.299 1.00 25.00 O ATOM 102 NE2 GLN A 747 -1.538 -5.515 3.609 1.00 25.00 N ATOM 0 H GLN A 747 -2.693 -10.481 2.392 1.00 25.00 H new ATOM 0 HA GLN A 747 -2.301 -8.146 3.858 1.00 25.00 H new ATOM 0 HB2 GLN A 747 -1.492 -8.635 1.518 1.00 25.00 H new ATOM 0 HB3 GLN A 747 -3.131 -8.414 0.936 1.00 25.00 H new ATOM 0 HG2 GLN A 747 -1.863 -6.375 0.543 1.00 25.00 H new ATOM 0 HG3 GLN A 747 -3.102 -6.056 1.742 1.00 25.00 H new ATOM 0 HE21 GLN A 747 -2.537 -5.377 3.759 1.00 25.00 H new ATOM 0 HE22 GLN A 747 -0.868 -5.190 4.306 1.00 25.00 H new ATOM 111 N MET A 748 -5.340 -8.554 2.623 1.00 25.00 N ATOM 112 CA MET A 748 -6.690 -8.026 2.673 1.00 25.00 C ATOM 113 C MET A 748 -7.264 -8.246 4.059 1.00 25.00 C ATOM 114 O MET A 748 -8.216 -7.592 4.453 1.00 25.00 O ATOM 115 CB MET A 748 -7.584 -8.677 1.617 1.00 25.00 C ATOM 116 CG MET A 748 -7.849 -10.126 1.827 1.00 25.00 C ATOM 117 SD MET A 748 -9.425 -10.666 1.115 1.00 25.00 S ATOM 118 CE MET A 748 -9.360 -9.958 -0.540 1.00 25.00 C ATOM 0 H MET A 748 -5.236 -9.421 2.096 1.00 25.00 H new ATOM 0 HA MET A 748 -6.653 -6.958 2.457 1.00 25.00 H new ATOM 0 HB2 MET A 748 -8.537 -8.148 1.593 1.00 25.00 H new ATOM 0 HB3 MET A 748 -7.121 -8.545 0.639 1.00 25.00 H new ATOM 0 HG2 MET A 748 -7.039 -10.706 1.385 1.00 25.00 H new ATOM 0 HG3 MET A 748 -7.847 -10.339 2.896 1.00 25.00 H new ATOM 0 HE1 MET A 748 -9.698 -10.698 -1.266 1.00 25.00 H new ATOM 0 HE2 MET A 748 -10.007 -9.082 -0.587 1.00 25.00 H new ATOM 0 HE3 MET A 748 -8.336 -9.665 -0.770 1.00 25.00 H new ATOM 128 N ASN A 749 -6.695 -9.192 4.788 1.00 25.00 N ATOM 129 CA ASN A 749 -7.214 -9.547 6.092 1.00 25.00 C ATOM 130 C ASN A 749 -6.755 -8.532 7.123 1.00 25.00 C ATOM 131 O ASN A 749 -7.539 -8.091 7.949 1.00 25.00 O ATOM 132 CB ASN A 749 -6.788 -10.969 6.478 1.00 25.00 C ATOM 133 CG ASN A 749 -6.344 -11.080 7.915 1.00 25.00 C ATOM 134 OD1 ASN A 749 -7.156 -11.206 8.819 1.00 25.00 O ATOM 135 ND2 ASN A 749 -5.055 -11.061 8.127 1.00 25.00 N ATOM 0 H ASN A 749 -5.875 -9.725 4.497 1.00 25.00 H new ATOM 0 HA ASN A 749 -8.303 -9.532 6.057 1.00 25.00 H new ATOM 0 HB2 ASN A 749 -7.621 -11.651 6.307 1.00 25.00 H new ATOM 0 HB3 ASN A 749 -5.975 -11.289 5.826 1.00 25.00 H new ATOM 0 HD21 ASN A 749 -4.693 -11.153 9.076 1.00 25.00 H new ATOM 0 HD22 ASN A 749 -4.411 -10.954 7.343 1.00 25.00 H new ATOM 142 N GLU A 750 -5.498 -8.127 7.061 1.00 25.00 N ATOM 143 CA GLU A 750 -5.005 -7.124 7.994 1.00 25.00 C ATOM 144 C GLU A 750 -5.435 -5.728 7.544 1.00 25.00 C ATOM 145 O GLU A 750 -5.806 -4.897 8.363 1.00 25.00 O ATOM 146 CB GLU A 750 -3.486 -7.244 8.174 1.00 25.00 C ATOM 147 CG GLU A 750 -2.650 -7.127 6.905 1.00 25.00 C ATOM 148 CD GLU A 750 -1.344 -7.896 7.040 1.00 25.00 C ATOM 149 OE1 GLU A 750 -0.632 -7.688 8.045 1.00 25.00 O ATOM 150 OE2 GLU A 750 -1.100 -8.797 6.206 1.00 25.00 O ATOM 0 H GLU A 750 -4.811 -8.468 6.389 1.00 25.00 H new ATOM 0 HA GLU A 750 -5.448 -7.299 8.974 1.00 25.00 H new ATOM 0 HB2 GLU A 750 -3.161 -6.472 8.872 1.00 25.00 H new ATOM 0 HB3 GLU A 750 -3.270 -8.206 8.640 1.00 25.00 H new ATOM 0 HG2 GLU A 750 -3.216 -7.510 6.056 1.00 25.00 H new ATOM 0 HG3 GLU A 750 -2.439 -6.078 6.700 1.00 25.00 H new ATOM 157 N PHE A 751 -5.481 -5.487 6.242 1.00 25.00 N ATOM 158 CA PHE A 751 -5.909 -4.186 5.732 1.00 25.00 C ATOM 159 C PHE A 751 -7.403 -3.916 5.923 1.00 25.00 C ATOM 160 O PHE A 751 -7.819 -2.763 6.007 1.00 25.00 O ATOM 161 CB PHE A 751 -5.565 -4.056 4.257 1.00 25.00 C ATOM 162 CG PHE A 751 -6.060 -2.794 3.645 1.00 25.00 C ATOM 163 CD1 PHE A 751 -5.659 -1.535 4.134 1.00 25.00 C ATOM 164 CD2 PHE A 751 -6.954 -2.854 2.578 1.00 25.00 C ATOM 165 CE1 PHE A 751 -6.164 -0.352 3.549 1.00 25.00 C ATOM 166 CE2 PHE A 751 -7.441 -1.692 1.988 1.00 25.00 C ATOM 167 CZ PHE A 751 -7.053 -0.440 2.467 1.00 25.00 C ATOM 0 H PHE A 751 -5.231 -6.166 5.523 1.00 25.00 H new ATOM 0 HA PHE A 751 -5.369 -3.443 6.319 1.00 25.00 H new ATOM 0 HB2 PHE A 751 -4.483 -4.109 4.138 1.00 25.00 H new ATOM 0 HB3 PHE A 751 -5.987 -4.903 3.717 1.00 25.00 H new ATOM 0 HD1 PHE A 751 -4.964 -1.474 4.958 1.00 25.00 H new ATOM 0 HD2 PHE A 751 -7.273 -3.816 2.204 1.00 25.00 H new ATOM 0 HE1 PHE A 751 -5.868 0.613 3.932 1.00 25.00 H new ATOM 0 HE2 PHE A 751 -8.124 -1.759 1.154 1.00 25.00 H new ATOM 0 HZ PHE A 751 -7.436 0.459 2.006 1.00 25.00 H new ATOM 177 N ARG A 752 -8.222 -4.951 6.081 1.00 25.00 N ATOM 178 CA ARG A 752 -9.638 -4.742 6.373 1.00 25.00 C ATOM 179 C ARG A 752 -9.758 -3.972 7.669 1.00 25.00 C ATOM 180 O ARG A 752 -10.755 -3.342 7.873 1.00 25.00 O ATOM 181 CB ARG A 752 -10.419 -6.072 6.459 1.00 25.00 C ATOM 182 CG ARG A 752 -10.329 -6.824 7.792 1.00 25.00 C ATOM 183 CD ARG A 752 -11.499 -6.512 8.734 1.00 25.00 C ATOM 184 NE ARG A 752 -11.340 -7.201 10.026 1.00 25.00 N ATOM 185 CZ ARG A 752 -11.736 -8.440 10.295 1.00 25.00 C ATOM 186 NH1 ARG A 752 -12.340 -9.196 9.409 1.00 25.00 N ATOM 187 NH2 ARG A 752 -11.521 -8.929 11.485 1.00 25.00 N ATOM 0 H ARG A 752 -7.937 -5.928 6.013 1.00 25.00 H new ATOM 0 HA ARG A 752 -10.079 -4.174 5.554 1.00 25.00 H new ATOM 0 HB2 ARG A 752 -11.469 -5.867 6.251 1.00 25.00 H new ATOM 0 HB3 ARG A 752 -10.061 -6.732 5.669 1.00 25.00 H new ATOM 0 HG2 ARG A 752 -10.302 -7.896 7.597 1.00 25.00 H new ATOM 0 HG3 ARG A 752 -9.392 -6.566 8.286 1.00 25.00 H new ATOM 0 HD2 ARG A 752 -11.561 -5.436 8.898 1.00 25.00 H new ATOM 0 HD3 ARG A 752 -12.436 -6.818 8.268 1.00 25.00 H new ATOM 0 HE ARG A 752 -10.887 -6.682 10.779 1.00 25.00 H new ATOM 0 HH11 ARG A 752 -12.522 -8.837 8.472 1.00 25.00 H new ATOM 0 HH12 ARG A 752 -12.628 -10.143 9.658 1.00 25.00 H new ATOM 0 HH21 ARG A 752 -11.055 -8.362 12.193 1.00 25.00 H new ATOM 0 HH22 ARG A 752 -11.819 -9.879 11.708 1.00 25.00 H new ATOM 201 N ALA A 753 -8.740 -3.990 8.527 1.00 25.00 N ATOM 202 CA ALA A 753 -8.778 -3.250 9.788 1.00 25.00 C ATOM 203 C ALA A 753 -8.878 -1.739 9.548 1.00 25.00 C ATOM 204 O ALA A 753 -9.401 -1.011 10.391 1.00 25.00 O ATOM 205 CB ALA A 753 -7.550 -3.567 10.618 1.00 25.00 C ATOM 0 H ALA A 753 -7.876 -4.510 8.372 1.00 25.00 H new ATOM 0 HA ALA A 753 -9.669 -3.563 10.332 1.00 25.00 H new ATOM 0 HB1 ALA A 753 -7.590 -3.010 11.554 1.00 25.00 H new ATOM 0 HB2 ALA A 753 -7.522 -4.635 10.832 1.00 25.00 H new ATOM 0 HB3 ALA A 753 -6.654 -3.284 10.065 1.00 25.00 H new ATOM 211 N SER A 754 -8.460 -1.274 8.378 1.00 25.00 N ATOM 212 CA SER A 754 -8.593 0.135 8.029 1.00 25.00 C ATOM 213 C SER A 754 -10.061 0.564 7.993 1.00 25.00 C ATOM 214 O SER A 754 -10.375 1.744 8.148 1.00 25.00 O ATOM 215 CB SER A 754 -7.902 0.436 6.699 1.00 25.00 C ATOM 216 OG SER A 754 -7.016 1.530 6.849 1.00 25.00 O ATOM 0 H SER A 754 -8.027 -1.850 7.656 1.00 25.00 H new ATOM 0 HA SER A 754 -8.098 0.717 8.807 1.00 25.00 H new ATOM 0 HB2 SER A 754 -7.354 -0.442 6.358 1.00 25.00 H new ATOM 0 HB3 SER A 754 -8.647 0.663 5.936 1.00 25.00 H new ATOM 0 HG SER A 754 -7.436 2.342 6.495 1.00 25.00 H new ATOM 222 N PHE A 755 -10.957 -0.416 7.920 1.00 25.00 N ATOM 223 CA PHE A 755 -12.412 -0.158 8.016 1.00 25.00 C ATOM 224 C PHE A 755 -12.842 0.561 9.291 1.00 25.00 C ATOM 225 O PHE A 755 -13.900 1.165 9.320 1.00 25.00 O ATOM 226 CB PHE A 755 -13.221 -1.461 7.889 1.00 25.00 C ATOM 227 CG PHE A 755 -13.474 -2.194 9.219 1.00 25.00 C ATOM 228 CD1 PHE A 755 -12.422 -2.574 10.080 1.00 25.00 C ATOM 229 CD2 PHE A 755 -14.783 -2.521 9.595 1.00 25.00 C ATOM 230 CE1 PHE A 755 -12.673 -3.274 11.284 1.00 25.00 C ATOM 231 CE2 PHE A 755 -15.051 -3.216 10.801 1.00 25.00 C ATOM 232 CZ PHE A 755 -13.992 -3.593 11.644 1.00 25.00 C ATOM 0 H PHE A 755 -10.713 -1.399 7.795 1.00 25.00 H new ATOM 0 HA PHE A 755 -12.624 0.509 7.181 1.00 25.00 H new ATOM 0 HB2 PHE A 755 -14.182 -1.233 7.427 1.00 25.00 H new ATOM 0 HB3 PHE A 755 -12.695 -2.135 7.213 1.00 25.00 H new ATOM 0 HD1 PHE A 755 -11.405 -2.326 9.815 1.00 25.00 H new ATOM 0 HD2 PHE A 755 -15.604 -2.238 8.953 1.00 25.00 H new ATOM 0 HE1 PHE A 755 -11.852 -3.562 11.924 1.00 25.00 H new ATOM 0 HE2 PHE A 755 -16.069 -3.456 11.072 1.00 25.00 H new ATOM 0 HZ PHE A 755 -14.191 -4.125 12.563 1.00 25.00 H new ATOM 242 N ASN A 756 -12.043 0.452 10.346 1.00 25.00 N ATOM 243 CA ASN A 756 -12.339 1.128 11.617 1.00 25.00 C ATOM 244 C ASN A 756 -11.250 2.129 12.001 1.00 25.00 C ATOM 245 O ASN A 756 -11.417 2.898 12.933 1.00 25.00 O ATOM 246 CB ASN A 756 -12.566 0.107 12.748 1.00 25.00 C ATOM 247 CG ASN A 756 -11.330 -0.127 13.606 1.00 25.00 C ATOM 248 OD1 ASN A 756 -11.311 0.196 14.773 1.00 25.00 O ATOM 249 ND2 ASN A 756 -10.321 -0.722 13.041 1.00 25.00 N ATOM 0 H ASN A 756 -11.183 -0.097 10.353 1.00 25.00 H new ATOM 0 HA ASN A 756 -13.261 1.691 11.472 1.00 25.00 H new ATOM 0 HB2 ASN A 756 -13.380 0.455 13.384 1.00 25.00 H new ATOM 0 HB3 ASN A 756 -12.883 -0.841 12.314 1.00 25.00 H new ATOM 0 HD21 ASN A 756 -9.482 -0.929 13.583 1.00 25.00 H new ATOM 0 HD22 ASN A 756 -10.368 -0.981 12.056 1.00 25.00 H new ATOM 256 N HIS A 757 -10.141 2.121 11.270 1.00 25.00 N ATOM 257 CA HIS A 757 -9.002 2.987 11.599 1.00 25.00 C ATOM 258 C HIS A 757 -9.323 4.467 11.391 1.00 25.00 C ATOM 259 O HIS A 757 -9.082 5.294 12.261 1.00 25.00 O ATOM 260 CB HIS A 757 -7.796 2.609 10.732 1.00 25.00 C ATOM 261 CG HIS A 757 -6.500 3.197 11.204 1.00 25.00 C ATOM 262 ND1 HIS A 757 -6.252 4.542 11.333 1.00 25.00 N ATOM 263 CD2 HIS A 757 -5.341 2.590 11.581 1.00 25.00 C ATOM 264 CE1 HIS A 757 -5.005 4.697 11.761 1.00 25.00 C ATOM 265 NE2 HIS A 757 -4.401 3.539 11.932 1.00 25.00 N ATOM 0 H HIS A 757 -10.001 1.531 10.450 1.00 25.00 H new ATOM 0 HA HIS A 757 -8.775 2.837 12.655 1.00 25.00 H new ATOM 0 HB2 HIS A 757 -7.704 1.523 10.709 1.00 25.00 H new ATOM 0 HB3 HIS A 757 -7.980 2.935 9.708 1.00 25.00 H new ATOM 0 HD2 HIS A 757 -5.180 1.522 11.602 1.00 25.00 H new ATOM 0 HE1 HIS A 757 -4.542 5.655 11.946 1.00 25.00 H new ATOM 0 HE2 HIS A 757 -3.447 3.378 12.254 1.00 25.00 H new ATOM 273 N PHE A 758 -9.823 4.802 10.211 1.00 25.00 N ATOM 274 CA PHE A 758 -10.150 6.194 9.882 1.00 25.00 C ATOM 275 C PHE A 758 -11.637 6.435 9.932 1.00 25.00 C ATOM 276 O PHE A 758 -12.103 7.519 9.590 1.00 25.00 O ATOM 277 CB PHE A 758 -9.634 6.543 8.496 1.00 25.00 C ATOM 278 CG PHE A 758 -8.262 7.133 8.505 1.00 25.00 C ATOM 279 CD1 PHE A 758 -7.126 6.304 8.515 1.00 25.00 C ATOM 280 CD2 PHE A 758 -8.094 8.529 8.482 1.00 25.00 C ATOM 281 CE1 PHE A 758 -5.830 6.861 8.507 1.00 25.00 C ATOM 282 CE2 PHE A 758 -6.801 9.100 8.478 1.00 25.00 C ATOM 283 CZ PHE A 758 -5.667 8.265 8.491 1.00 25.00 C ATOM 0 H PHE A 758 -10.013 4.136 9.463 1.00 25.00 H new ATOM 0 HA PHE A 758 -9.668 6.829 10.626 1.00 25.00 H new ATOM 0 HB2 PHE A 758 -9.631 5.643 7.881 1.00 25.00 H new ATOM 0 HB3 PHE A 758 -10.321 7.247 8.027 1.00 25.00 H new ATOM 0 HD1 PHE A 758 -7.247 5.231 8.529 1.00 25.00 H new ATOM 0 HD2 PHE A 758 -8.962 9.172 8.467 1.00 25.00 H new ATOM 0 HE1 PHE A 758 -4.964 6.216 8.513 1.00 25.00 H new ATOM 0 HE2 PHE A 758 -6.683 10.173 8.465 1.00 25.00 H new ATOM 0 HZ PHE A 758 -4.677 8.696 8.489 1.00 25.00 H new ATOM 293 N ASP A 759 -12.383 5.403 10.296 1.00 25.00 N ATOM 294 CA ASP A 759 -13.837 5.491 10.341 1.00 25.00 C ATOM 295 C ASP A 759 -14.301 6.601 11.242 1.00 25.00 C ATOM 296 O ASP A 759 -14.246 6.511 12.463 1.00 25.00 O ATOM 297 CB ASP A 759 -14.469 4.175 10.727 1.00 25.00 C ATOM 298 CG ASP A 759 -15.926 4.106 10.320 1.00 25.00 C ATOM 299 OD1 ASP A 759 -16.571 5.166 10.157 1.00 50.00 O ATOM 300 OD2 ASP A 759 -16.440 3.009 10.133 1.00 50.00 O ATOM 0 H ASP A 759 -12.007 4.494 10.565 1.00 25.00 H new ATOM 0 HA ASP A 759 -14.169 5.728 9.330 1.00 25.00 H new ATOM 0 HB2 ASP A 759 -13.922 3.358 10.257 1.00 25.00 H new ATOM 0 HB3 ASP A 759 -14.386 4.035 11.805 1.00 25.00 H new ATOM 305 N ARG A 760 -14.737 7.671 10.598 1.00 25.00 N ATOM 306 CA ARG A 760 -15.104 8.894 11.311 1.00 25.00 C ATOM 307 C ARG A 760 -16.185 8.690 12.323 1.00 25.00 C ATOM 308 O ARG A 760 -16.228 9.390 13.326 1.00 25.00 O ATOM 309 CB ARG A 760 -15.591 9.955 10.346 1.00 25.00 C ATOM 310 CG ARG A 760 -14.531 10.793 9.862 1.00 25.00 C ATOM 311 CD ARG A 760 -15.168 11.680 8.864 1.00 25.00 C ATOM 312 NE ARG A 760 -14.195 12.409 8.034 1.00 25.00 N ATOM 313 CZ ARG A 760 -14.500 13.380 7.179 1.00 25.00 C ATOM 314 NH1 ARG A 760 -15.726 13.804 7.014 1.00 25.00 N ATOM 315 NH2 ARG A 760 -13.561 13.941 6.478 1.00 25.00 N ATOM 0 H ARG A 760 -14.847 7.723 9.585 1.00 25.00 H new ATOM 0 HA ARG A 760 -14.194 9.206 11.824 1.00 25.00 H new ATOM 0 HB2 ARG A 760 -16.082 9.473 9.501 1.00 25.00 H new ATOM 0 HB3 ARG A 760 -16.340 10.573 10.840 1.00 25.00 H new ATOM 0 HG2 ARG A 760 -14.082 11.368 10.672 1.00 25.00 H new ATOM 0 HG3 ARG A 760 -13.734 10.201 9.412 1.00 25.00 H new ATOM 0 HD2 ARG A 760 -15.814 11.085 8.218 1.00 25.00 H new ATOM 0 HD3 ARG A 760 -15.806 12.398 9.380 1.00 25.00 H new ATOM 0 HE ARG A 760 -13.212 12.149 8.122 1.00 25.00 H new ATOM 0 HH11 ARG A 760 -16.486 13.387 7.551 1.00 25.00 H new ATOM 0 HH12 ARG A 760 -15.922 14.552 6.348 1.00 25.00 H new ATOM 0 HH21 ARG A 760 -12.594 13.636 6.585 1.00 25.00 H new ATOM 0 HH22 ARG A 760 -13.791 14.686 5.821 1.00 25.00 H new ATOM 329 N ASP A 761 -17.097 7.788 12.023 1.00 25.00 N ATOM 330 CA ASP A 761 -18.219 7.560 12.908 1.00 25.00 C ATOM 331 C ASP A 761 -18.176 6.148 13.485 1.00 25.00 C ATOM 332 O ASP A 761 -19.035 5.771 14.275 1.00 25.00 O ATOM 333 CB ASP A 761 -19.531 7.824 12.177 1.00 25.00 C ATOM 334 CG ASP A 761 -19.645 7.025 10.917 1.00 25.00 C ATOM 335 OD1 ASP A 761 -19.427 5.819 10.973 1.00 75.00 O ATOM 336 OD2 ASP A 761 -19.755 7.596 9.824 1.00 75.00 O ATOM 0 H ASP A 761 -17.084 7.208 11.184 1.00 25.00 H new ATOM 0 HA ASP A 761 -18.152 8.257 13.743 1.00 25.00 H new ATOM 0 HB2 ASP A 761 -20.366 7.584 12.835 1.00 25.00 H new ATOM 0 HB3 ASP A 761 -19.606 8.885 11.941 1.00 25.00 H new ATOM 341 N HIS A 762 -17.181 5.377 13.054 1.00 25.00 N ATOM 342 CA HIS A 762 -16.975 3.995 13.509 1.00 25.00 C ATOM 343 C HIS A 762 -18.117 3.006 13.168 1.00 25.00 C ATOM 344 O HIS A 762 -18.318 2.006 13.852 1.00 25.00 O ATOM 345 CB HIS A 762 -16.642 3.970 15.006 1.00 25.00 C ATOM 346 CG HIS A 762 -15.657 2.908 15.383 1.00 25.00 C ATOM 347 ND1 HIS A 762 -14.294 3.046 15.290 1.00 25.00 N ATOM 348 CD2 HIS A 762 -15.852 1.651 15.869 1.00 25.00 C ATOM 349 CE1 HIS A 762 -13.733 1.922 15.720 1.00 25.00 C ATOM 350 NE2 HIS A 762 -14.636 1.033 16.083 1.00 25.00 N ATOM 0 H HIS A 762 -16.488 5.691 12.375 1.00 25.00 H new ATOM 0 HA HIS A 762 -16.125 3.627 12.935 1.00 25.00 H new ATOM 0 HB2 HIS A 762 -16.245 4.942 15.298 1.00 25.00 H new ATOM 0 HB3 HIS A 762 -17.561 3.819 15.572 1.00 25.00 H new ATOM 0 HD2 HIS A 762 -16.816 1.203 16.059 1.00 25.00 H new ATOM 0 HE1 HIS A 762 -12.667 1.756 15.767 1.00 25.00 H new ATOM 0 HE2 HIS A 762 -14.472 0.093 16.444 1.00 25.00 H new ATOM 358 N SER A 763 -18.804 3.250 12.058 1.00 25.00 N ATOM 359 CA SER A 763 -19.851 2.361 11.550 1.00 25.00 C ATOM 360 C SER A 763 -19.326 1.022 11.012 1.00 25.00 C ATOM 361 O SER A 763 -20.102 0.126 10.691 1.00 25.00 O ATOM 362 CB SER A 763 -20.605 3.084 10.426 1.00 25.00 C ATOM 363 OG SER A 763 -19.724 3.535 9.384 1.00 25.00 O ATOM 0 H SER A 763 -18.652 4.075 11.478 1.00 25.00 H new ATOM 0 HA SER A 763 -20.499 2.125 12.394 1.00 25.00 H new ATOM 0 HB2 SER A 763 -21.353 2.413 10.002 1.00 25.00 H new ATOM 0 HB3 SER A 763 -21.141 3.938 10.841 1.00 25.00 H new ATOM 0 HG SER A 763 -19.375 4.422 9.612 1.00 25.00 H new ATOM 369 N GLY A 764 -18.016 0.913 10.856 1.00 25.00 N ATOM 370 CA GLY A 764 -17.406 -0.294 10.312 1.00 25.00 C ATOM 371 C GLY A 764 -17.398 -0.197 8.803 1.00 25.00 C ATOM 372 O GLY A 764 -17.287 -1.179 8.072 1.00 25.00 O ATOM 0 H GLY A 764 -17.351 1.648 11.099 1.00 25.00 H new ATOM 0 HA2 GLY A 764 -16.389 -0.406 10.689 1.00 25.00 H new ATOM 0 HA3 GLY A 764 -17.963 -1.175 10.631 1.00 25.00 H new ATOM 376 N THR A 765 -17.589 1.024 8.344 1.00 25.00 N ATOM 377 CA THR A 765 -17.651 1.347 6.928 1.00 25.00 C ATOM 378 C THR A 765 -17.246 2.806 6.747 1.00 25.00 C ATOM 379 O THR A 765 -17.716 3.688 7.480 1.00 25.00 O ATOM 380 CB THR A 765 -19.079 1.190 6.385 1.00 25.00 C ATOM 381 OG1 THR A 765 -20.015 1.574 7.397 1.00 25.00 O ATOM 382 CG2 THR A 765 -19.388 -0.243 5.975 1.00 25.00 C ATOM 0 H THR A 765 -17.708 1.834 8.952 1.00 25.00 H new ATOM 0 HA THR A 765 -16.986 0.670 6.391 1.00 25.00 H new ATOM 0 HB THR A 765 -19.160 1.826 5.503 1.00 25.00 H new ATOM 0 HG1 THR A 765 -19.655 2.330 7.906 1.00 25.00 H new ATOM 0 HG21 THR A 765 -20.409 -0.301 5.598 1.00 25.00 H new ATOM 0 HG22 THR A 765 -18.695 -0.556 5.194 1.00 25.00 H new ATOM 0 HG23 THR A 765 -19.282 -0.899 6.839 1.00 25.00 H new ATOM 390 N LEU A 766 -16.426 3.099 5.756 1.00 25.00 N ATOM 391 CA LEU A 766 -16.024 4.482 5.513 1.00 25.00 C ATOM 392 C LEU A 766 -16.920 5.054 4.420 1.00 25.00 C ATOM 393 O LEU A 766 -17.043 4.476 3.381 1.00 25.00 O ATOM 394 CB LEU A 766 -14.546 4.563 5.093 1.00 25.00 C ATOM 395 CG LEU A 766 -13.434 4.622 6.176 1.00 25.00 C ATOM 396 CD1 LEU A 766 -13.601 5.838 6.943 1.00 25.00 C ATOM 397 CD2 LEU A 766 -13.398 3.448 7.122 1.00 25.00 C ATOM 0 H LEU A 766 -16.028 2.415 5.113 1.00 25.00 H new ATOM 0 HA LEU A 766 -16.133 5.060 6.430 1.00 25.00 H new ATOM 0 HB2 LEU A 766 -14.340 3.698 4.463 1.00 25.00 H new ATOM 0 HB3 LEU A 766 -14.435 5.447 4.466 1.00 25.00 H new ATOM 0 HG LEU A 766 -12.487 4.594 5.637 1.00 25.00 H new ATOM 0 HD11 LEU A 766 -12.827 5.895 7.708 1.00 25.00 H new ATOM 0 HD12 LEU A 766 -13.520 6.700 6.281 1.00 25.00 H new ATOM 0 HD13 LEU A 766 -14.582 5.837 7.418 1.00 25.00 H new ATOM 0 HD21 LEU A 766 -12.588 3.583 7.839 1.00 25.00 H new ATOM 0 HD22 LEU A 766 -14.347 3.381 7.654 1.00 25.00 H new ATOM 0 HD23 LEU A 766 -13.233 2.531 6.557 1.00 25.00 H new ATOM 409 N GLY A 767 -17.575 6.172 4.668 1.00 25.00 N ATOM 410 CA GLY A 767 -18.460 6.775 3.680 1.00 25.00 C ATOM 411 C GLY A 767 -17.631 7.534 2.682 1.00 25.00 C ATOM 412 O GLY A 767 -16.443 7.394 2.706 1.00 25.00 O ATOM 0 H GLY A 767 -17.513 6.685 5.547 1.00 25.00 H new ATOM 0 HA2 GLY A 767 -19.044 6.004 3.177 1.00 25.00 H new ATOM 0 HA3 GLY A 767 -19.169 7.444 4.168 1.00 25.00 H new ATOM 416 N PRO A 768 -18.199 8.373 1.823 1.00 25.00 N ATOM 417 CA PRO A 768 -17.372 9.063 0.824 1.00 25.00 C ATOM 418 C PRO A 768 -16.283 9.964 1.421 1.00 25.00 C ATOM 419 O PRO A 768 -15.096 9.743 1.211 1.00 25.00 O ATOM 420 CB PRO A 768 -18.408 9.880 0.038 1.00 25.00 C ATOM 421 CG PRO A 768 -19.555 10.038 0.994 1.00 25.00 C ATOM 422 CD PRO A 768 -19.614 8.742 1.718 1.00 25.00 C ATOM 0 HA PRO A 768 -16.800 8.359 0.220 1.00 25.00 H new ATOM 0 HB2 PRO A 768 -18.006 10.847 -0.265 1.00 25.00 H new ATOM 0 HB3 PRO A 768 -18.716 9.364 -0.871 1.00 25.00 H new ATOM 0 HG2 PRO A 768 -19.389 10.869 1.680 1.00 25.00 H new ATOM 0 HG3 PRO A 768 -20.487 10.241 0.466 1.00 25.00 H new ATOM 0 HD2 PRO A 768 -20.080 8.845 2.698 1.00 25.00 H new ATOM 0 HD3 PRO A 768 -20.188 7.996 1.169 1.00 25.00 H new ATOM 430 N GLU A 769 -16.693 10.958 2.190 1.00 25.00 N ATOM 431 CA GLU A 769 -15.772 11.925 2.792 1.00 25.00 C ATOM 432 C GLU A 769 -14.917 11.259 3.864 1.00 25.00 C ATOM 433 O GLU A 769 -13.894 11.782 4.284 1.00 25.00 O ATOM 434 CB GLU A 769 -16.576 13.082 3.389 1.00 25.00 C ATOM 435 CG GLU A 769 -16.212 14.450 2.816 1.00 25.00 C ATOM 436 CD GLU A 769 -15.112 15.138 3.608 1.00 25.00 C ATOM 437 OE1 GLU A 769 -15.350 15.473 4.790 1.00 25.00 O ATOM 438 OE2 GLU A 769 -14.004 15.326 3.067 1.00 25.00 O ATOM 0 H GLU A 769 -17.673 11.123 2.419 1.00 25.00 H new ATOM 0 HA GLU A 769 -15.103 12.310 2.022 1.00 25.00 H new ATOM 0 HB2 GLU A 769 -17.637 12.899 3.220 1.00 25.00 H new ATOM 0 HB3 GLU A 769 -16.423 13.099 4.468 1.00 25.00 H new ATOM 0 HG2 GLU A 769 -15.891 14.333 1.781 1.00 25.00 H new ATOM 0 HG3 GLU A 769 -17.099 15.084 2.806 1.00 25.00 H new ATOM 445 N GLU A 770 -15.346 10.094 4.315 1.00 25.00 N ATOM 446 CA GLU A 770 -14.559 9.347 5.294 1.00 25.00 C ATOM 447 C GLU A 770 -13.499 8.493 4.556 1.00 25.00 C ATOM 448 O GLU A 770 -12.334 8.459 4.943 1.00 25.00 O ATOM 449 CB GLU A 770 -15.442 8.434 6.151 1.00 25.00 C ATOM 450 CG GLU A 770 -16.798 8.935 6.623 1.00 25.00 C ATOM 451 CD GLU A 770 -17.503 7.835 7.446 1.00 25.00 C ATOM 452 OE1 GLU A 770 -16.914 7.340 8.414 1.00 50.00 O ATOM 453 OE2 GLU A 770 -18.538 7.304 7.013 1.00 50.00 O ATOM 0 H GLU A 770 -16.217 9.647 4.029 1.00 25.00 H new ATOM 0 HA GLU A 770 -14.074 10.064 5.956 1.00 25.00 H new ATOM 0 HB2 GLU A 770 -15.611 7.518 5.585 1.00 25.00 H new ATOM 0 HB3 GLU A 770 -14.868 8.161 7.036 1.00 25.00 H new ATOM 0 HG2 GLU A 770 -16.674 9.832 7.229 1.00 25.00 H new ATOM 0 HG3 GLU A 770 -17.412 9.211 5.766 1.00 25.00 H new ATOM 460 N PHE A 771 -13.913 7.808 3.497 1.00 25.00 N ATOM 461 CA PHE A 771 -13.043 6.919 2.701 1.00 25.00 C ATOM 462 C PHE A 771 -11.868 7.664 2.133 1.00 25.00 C ATOM 463 O PHE A 771 -10.735 7.193 2.187 1.00 25.00 O ATOM 464 CB PHE A 771 -13.860 6.311 1.549 1.00 25.00 C ATOM 465 CG PHE A 771 -13.049 5.497 0.555 1.00 25.00 C ATOM 466 CD1 PHE A 771 -12.244 4.431 0.987 1.00 25.00 C ATOM 467 CD2 PHE A 771 -13.138 5.766 -0.833 1.00 25.00 C ATOM 468 CE1 PHE A 771 -11.542 3.613 0.057 1.00 25.00 C ATOM 469 CE2 PHE A 771 -12.435 4.964 -1.783 1.00 25.00 C ATOM 470 CZ PHE A 771 -11.644 3.878 -1.330 1.00 25.00 C ATOM 0 H PHE A 771 -14.873 7.848 3.154 1.00 25.00 H new ATOM 0 HA PHE A 771 -12.665 6.135 3.357 1.00 25.00 H new ATOM 0 HB2 PHE A 771 -14.638 5.674 1.970 1.00 25.00 H new ATOM 0 HB3 PHE A 771 -14.363 7.117 1.014 1.00 25.00 H new ATOM 0 HD1 PHE A 771 -12.156 4.228 2.044 1.00 25.00 H new ATOM 0 HD2 PHE A 771 -13.746 6.589 -1.178 1.00 25.00 H new ATOM 0 HE1 PHE A 771 -10.934 2.793 0.408 1.00 25.00 H new ATOM 0 HE2 PHE A 771 -12.505 5.183 -2.838 1.00 25.00 H new ATOM 0 HZ PHE A 771 -11.121 3.255 -2.041 1.00 25.00 H new ATOM 480 N LYS A 772 -12.130 8.861 1.641 1.00 25.00 N ATOM 481 CA LYS A 772 -11.083 9.688 1.077 1.00 25.00 C ATOM 482 C LYS A 772 -10.049 10.079 2.127 1.00 25.00 C ATOM 483 O LYS A 772 -8.943 10.434 1.772 1.00 25.00 O ATOM 484 CB LYS A 772 -11.679 10.917 0.379 1.00 25.00 C ATOM 485 CG LYS A 772 -12.565 11.792 1.247 1.00 25.00 C ATOM 486 CD LYS A 772 -11.828 12.938 1.857 1.00 25.00 C ATOM 487 CE LYS A 772 -11.431 13.949 0.806 1.00 25.00 C ATOM 488 NZ LYS A 772 -12.415 15.075 0.655 1.00 25.00 N ATOM 0 H LYS A 772 -13.059 9.281 1.621 1.00 25.00 H new ATOM 0 HA LYS A 772 -10.559 9.099 0.324 1.00 25.00 H new ATOM 0 HB2 LYS A 772 -10.862 11.526 -0.007 1.00 25.00 H new ATOM 0 HB3 LYS A 772 -12.259 10.580 -0.480 1.00 25.00 H new ATOM 0 HG2 LYS A 772 -13.390 12.175 0.646 1.00 25.00 H new ATOM 0 HG3 LYS A 772 -13.003 11.185 2.039 1.00 25.00 H new ATOM 0 HD2 LYS A 772 -12.454 13.418 2.610 1.00 25.00 H new ATOM 0 HD3 LYS A 772 -10.938 12.571 2.368 1.00 25.00 H new ATOM 0 HE2 LYS A 772 -10.455 14.362 1.061 1.00 25.00 H new ATOM 0 HE3 LYS A 772 -11.322 13.441 -0.152 1.00 25.00 H new ATOM 0 HZ1 LYS A 772 -12.282 15.531 -0.270 1.00 25.00 H new ATOM 0 HZ2 LYS A 772 -13.383 14.701 0.721 1.00 25.00 H new ATOM 0 HZ3 LYS A 772 -12.262 15.774 1.410 1.00 25.00 H new ATOM 502 N ALA A 773 -10.413 10.064 3.408 1.00 25.00 N ATOM 503 CA ALA A 773 -9.481 10.458 4.454 1.00 25.00 C ATOM 504 C ALA A 773 -8.633 9.241 4.843 1.00 25.00 C ATOM 505 O ALA A 773 -7.460 9.365 5.149 1.00 25.00 O ATOM 506 CB ALA A 773 -10.245 10.996 5.672 1.00 25.00 C ATOM 0 H ALA A 773 -11.336 9.786 3.741 1.00 25.00 H new ATOM 0 HA ALA A 773 -8.830 11.252 4.089 1.00 25.00 H new ATOM 0 HB1 ALA A 773 -9.536 11.287 6.447 1.00 25.00 H new ATOM 0 HB2 ALA A 773 -10.836 11.863 5.377 1.00 25.00 H new ATOM 0 HB3 ALA A 773 -10.906 10.220 6.058 1.00 25.00 H new ATOM 512 N CYS A 774 -9.241 8.061 4.801 1.00 25.00 N ATOM 513 CA CYS A 774 -8.522 6.822 5.085 1.00 25.00 C ATOM 514 C CYS A 774 -7.429 6.616 4.057 1.00 25.00 C ATOM 515 O CYS A 774 -6.290 6.301 4.373 1.00 25.00 O ATOM 516 CB CYS A 774 -9.496 5.640 5.031 1.00 25.00 C ATOM 517 SG CYS A 774 -8.764 4.078 5.559 1.00 25.00 S ATOM 0 H CYS A 774 -10.227 7.935 4.574 1.00 25.00 H new ATOM 0 HA CYS A 774 -8.078 6.886 6.078 1.00 25.00 H new ATOM 0 HB2 CYS A 774 -10.357 5.860 5.662 1.00 25.00 H new ATOM 0 HB3 CYS A 774 -9.867 5.532 4.012 1.00 25.00 H new ATOM 0 HG CYS A 774 -9.655 3.134 5.484 1.00 25.00 H new ATOM 523 N LEU A 775 -7.820 6.829 2.816 1.00 25.00 N ATOM 524 CA LEU A 775 -6.962 6.651 1.651 1.00 25.00 C ATOM 525 C LEU A 775 -5.696 7.514 1.618 1.00 25.00 C ATOM 526 O LEU A 775 -4.761 7.214 0.889 1.00 25.00 O ATOM 527 CB LEU A 775 -7.781 6.950 0.409 1.00 25.00 C ATOM 528 CG LEU A 775 -8.605 5.821 -0.222 1.00 25.00 C ATOM 529 CD1 LEU A 775 -9.308 6.430 -1.440 1.00 25.00 C ATOM 530 CD2 LEU A 775 -7.734 4.649 -0.663 1.00 25.00 C ATOM 0 H LEU A 775 -8.763 7.138 2.580 1.00 25.00 H new ATOM 0 HA LEU A 775 -6.609 5.621 1.699 1.00 25.00 H new ATOM 0 HB2 LEU A 775 -8.466 7.762 0.653 1.00 25.00 H new ATOM 0 HB3 LEU A 775 -7.099 7.327 -0.353 1.00 25.00 H new ATOM 0 HG LEU A 775 -9.310 5.424 0.508 1.00 25.00 H new ATOM 0 HD11 LEU A 775 -9.912 5.667 -1.931 1.00 25.00 H new ATOM 0 HD12 LEU A 775 -9.950 7.249 -1.117 1.00 25.00 H new ATOM 0 HD13 LEU A 775 -8.562 6.807 -2.140 1.00 25.00 H new ATOM 0 HD21 LEU A 775 -8.362 3.875 -1.104 1.00 25.00 H new ATOM 0 HD22 LEU A 775 -7.009 4.992 -1.401 1.00 25.00 H new ATOM 0 HD23 LEU A 775 -7.208 4.242 0.200 1.00 25.00 H new ATOM 542 N ILE A 776 -5.669 8.579 2.399 1.00 25.00 N ATOM 543 CA ILE A 776 -4.515 9.470 2.464 1.00 25.00 C ATOM 544 C ILE A 776 -3.316 8.677 2.962 1.00 25.00 C ATOM 545 O ILE A 776 -2.209 8.812 2.451 1.00 25.00 O ATOM 546 CB ILE A 776 -4.772 10.655 3.439 1.00 25.00 C ATOM 547 CG1 ILE A 776 -6.038 11.414 3.016 1.00 25.00 C ATOM 548 CG2 ILE A 776 -3.577 11.612 3.449 1.00 25.00 C ATOM 549 CD1 ILE A 776 -6.456 12.551 3.945 1.00 25.00 C ATOM 0 H ILE A 776 -6.442 8.854 3.006 1.00 25.00 H new ATOM 0 HA ILE A 776 -4.331 9.875 1.469 1.00 25.00 H new ATOM 0 HB ILE A 776 -4.908 10.254 4.443 1.00 25.00 H new ATOM 0 HG12 ILE A 776 -5.881 11.821 2.017 1.00 25.00 H new ATOM 0 HG13 ILE A 776 -6.861 10.703 2.945 1.00 25.00 H new ATOM 0 HG21 ILE A 776 -3.775 12.434 4.137 1.00 25.00 H new ATOM 0 HG22 ILE A 776 -2.684 11.076 3.772 1.00 25.00 H new ATOM 0 HG23 ILE A 776 -3.419 12.008 2.446 1.00 25.00 H new ATOM 0 HD11 ILE A 776 -7.360 13.023 3.559 1.00 25.00 H new ATOM 0 HD12 ILE A 776 -6.651 12.154 4.941 1.00 25.00 H new ATOM 0 HD13 ILE A 776 -5.656 13.289 3.999 1.00 25.00 H new ATOM 561 N SER A 777 -3.556 7.810 3.936 1.00 25.00 N ATOM 562 CA SER A 777 -2.489 6.999 4.520 1.00 25.00 C ATOM 563 C SER A 777 -2.151 5.803 3.649 1.00 25.00 C ATOM 564 O SER A 777 -1.249 5.043 3.967 1.00 25.00 O ATOM 565 CB SER A 777 -2.900 6.505 5.900 1.00 25.00 C ATOM 566 OG SER A 777 -3.145 7.602 6.762 1.00 25.00 O ATOM 0 H SER A 777 -4.478 7.648 4.340 1.00 25.00 H new ATOM 0 HA SER A 777 -1.606 7.633 4.596 1.00 25.00 H new ATOM 0 HB2 SER A 777 -3.795 5.889 5.821 1.00 25.00 H new ATOM 0 HB3 SER A 777 -2.115 5.874 6.317 1.00 25.00 H new ATOM 0 HG SER A 777 -3.996 7.468 7.229 1.00 25.00 H new ATOM 572 N LEU A 778 -2.893 5.636 2.563 1.00 25.00 N ATOM 573 CA LEU A 778 -2.663 4.536 1.636 1.00 25.00 C ATOM 574 C LEU A 778 -2.062 5.048 0.334 1.00 25.00 C ATOM 575 O LEU A 778 -1.699 4.254 -0.518 1.00 25.00 O ATOM 576 CB LEU A 778 -3.964 3.756 1.351 1.00 25.00 C ATOM 577 CG LEU A 778 -4.459 2.734 2.395 1.00 25.00 C ATOM 578 CD1 LEU A 778 -3.345 1.773 2.788 1.00 25.00 C ATOM 579 CD2 LEU A 778 -5.041 3.391 3.647 1.00 25.00 C ATOM 0 H LEU A 778 -3.663 6.251 2.301 1.00 25.00 H new ATOM 0 HA LEU A 778 -1.956 3.853 2.106 1.00 25.00 H new ATOM 0 HB2 LEU A 778 -4.760 4.485 1.199 1.00 25.00 H new ATOM 0 HB3 LEU A 778 -3.832 3.227 0.407 1.00 25.00 H new ATOM 0 HG LEU A 778 -5.266 2.180 1.915 1.00 25.00 H new ATOM 0 HD11 LEU A 778 -3.720 1.063 3.525 1.00 25.00 H new ATOM 0 HD12 LEU A 778 -3.002 1.233 1.905 1.00 25.00 H new ATOM 0 HD13 LEU A 778 -2.514 2.334 3.215 1.00 25.00 H new ATOM 0 HD21 LEU A 778 -5.371 2.620 4.343 1.00 25.00 H new ATOM 0 HD22 LEU A 778 -4.278 4.006 4.123 1.00 25.00 H new ATOM 0 HD23 LEU A 778 -5.889 4.016 3.369 1.00 25.00 H new ATOM 591 N GLY A 779 -1.909 6.361 0.184 1.00 25.00 N ATOM 592 CA GLY A 779 -1.199 6.850 -0.988 1.00 25.00 C ATOM 593 C GLY A 779 -2.055 6.863 -2.240 1.00 25.00 C ATOM 594 O GLY A 779 -1.659 6.404 -3.301 1.00 25.00 O ATOM 0 H GLY A 779 -2.250 7.075 0.828 1.00 25.00 H new ATOM 0 HA2 GLY A 779 -0.838 7.859 -0.792 1.00 25.00 H new ATOM 0 HA3 GLY A 779 -0.322 6.226 -1.161 1.00 25.00 H new ATOM 598 N TYR A 780 -3.257 7.390 -2.091 1.00 25.00 N ATOM 599 CA TYR A 780 -4.235 7.453 -3.177 1.00 25.00 C ATOM 600 C TYR A 780 -3.892 8.293 -4.427 1.00 25.00 C ATOM 601 O TYR A 780 -3.070 9.190 -4.389 1.00 25.00 O ATOM 602 CB TYR A 780 -5.579 7.904 -2.610 1.00 25.00 C ATOM 603 CG TYR A 780 -5.612 9.260 -1.913 1.00 25.00 C ATOM 604 CD1 TYR A 780 -4.451 10.047 -1.741 1.00 25.00 C ATOM 605 CD2 TYR A 780 -6.827 9.762 -1.417 1.00 25.00 C ATOM 606 CE1 TYR A 780 -4.506 11.293 -1.107 1.00 25.00 C ATOM 607 CE2 TYR A 780 -6.892 11.014 -0.794 1.00 25.00 C ATOM 608 CZ TYR A 780 -5.731 11.781 -0.648 1.00 25.00 C ATOM 609 OH TYR A 780 -5.805 13.016 -0.052 1.00 25.00 O ATOM 0 H TYR A 780 -3.589 7.789 -1.213 1.00 25.00 H new ATOM 0 HA TYR A 780 -4.248 6.435 -3.566 1.00 25.00 H new ATOM 0 HB2 TYR A 780 -6.302 7.924 -3.425 1.00 25.00 H new ATOM 0 HB3 TYR A 780 -5.919 7.149 -1.901 1.00 25.00 H new ATOM 0 HD1 TYR A 780 -3.503 9.680 -2.106 1.00 25.00 H new ATOM 0 HD2 TYR A 780 -7.726 9.172 -1.518 1.00 25.00 H new ATOM 0 HE1 TYR A 780 -3.606 11.874 -0.973 1.00 25.00 H new ATOM 0 HE2 TYR A 780 -7.837 11.387 -0.427 1.00 25.00 H new ATOM 0 HH TYR A 780 -6.732 13.199 0.206 1.00 25.00 H new ATOM 619 N ASP A 781 -4.575 7.999 -5.530 1.00 25.00 N ATOM 620 CA ASP A 781 -4.327 8.632 -6.837 1.00 25.00 C ATOM 621 C ASP A 781 -5.122 9.922 -6.979 1.00 25.00 C ATOM 622 O ASP A 781 -5.187 10.529 -8.045 1.00 25.00 O ATOM 623 CB ASP A 781 -4.723 7.671 -7.977 1.00 25.00 C ATOM 624 CG ASP A 781 -6.229 7.368 -8.012 1.00 25.00 C ATOM 625 OD1 ASP A 781 -6.757 6.881 -6.987 1.00 25.00 O ATOM 626 OD2 ASP A 781 -6.871 7.559 -9.069 1.00 25.00 O ATOM 0 H ASP A 781 -5.325 7.308 -5.549 1.00 25.00 H new ATOM 0 HA ASP A 781 -3.263 8.862 -6.899 1.00 25.00 H new ATOM 0 HB2 ASP A 781 -4.423 8.105 -8.931 1.00 25.00 H new ATOM 0 HB3 ASP A 781 -4.173 6.737 -7.865 1.00 25.00 H new ATOM 631 N ILE A 782 -5.740 10.318 -5.883 1.00 25.00 N ATOM 632 CA ILE A 782 -6.588 11.494 -5.837 1.00 25.00 C ATOM 633 C ILE A 782 -6.140 12.390 -4.691 1.00 25.00 C ATOM 634 O ILE A 782 -5.197 12.078 -3.986 1.00 25.00 O ATOM 635 CB ILE A 782 -8.071 11.106 -5.688 1.00 25.00 C ATOM 636 CG1 ILE A 782 -8.262 10.174 -4.471 1.00 25.00 C ATOM 637 CG2 ILE A 782 -8.553 10.533 -7.023 1.00 25.00 C ATOM 638 CD1 ILE A 782 -8.549 8.718 -4.777 1.00 25.00 C ATOM 0 H ILE A 782 -5.667 9.828 -4.991 1.00 25.00 H new ATOM 0 HA ILE A 782 -6.492 12.038 -6.776 1.00 25.00 H new ATOM 0 HB ILE A 782 -8.697 11.972 -5.472 1.00 25.00 H new ATOM 0 HG12 ILE A 782 -7.362 10.223 -3.858 1.00 25.00 H new ATOM 0 HG13 ILE A 782 -9.081 10.564 -3.867 1.00 25.00 H new ATOM 0 HG21 ILE A 782 -9.603 10.251 -6.940 1.00 25.00 H new ATOM 0 HG22 ILE A 782 -8.440 11.285 -7.804 1.00 25.00 H new ATOM 0 HG23 ILE A 782 -7.960 9.654 -7.277 1.00 25.00 H new ATOM 0 HD11 ILE A 782 -8.663 8.166 -3.844 1.00 25.00 H new ATOM 0 HD12 ILE A 782 -9.468 8.643 -5.358 1.00 25.00 H new ATOM 0 HD13 ILE A 782 -7.722 8.297 -5.349 1.00 25.00 H new ATOM 650 N GLY A 783 -6.819 13.507 -4.506 1.00 25.00 N ATOM 651 CA GLY A 783 -6.466 14.432 -3.453 1.00 25.00 C ATOM 652 C GLY A 783 -7.544 15.480 -3.384 1.00 25.00 C ATOM 653 O GLY A 783 -8.613 15.287 -3.952 1.00 25.00 O ATOM 0 H GLY A 783 -7.617 13.793 -5.073 1.00 25.00 H new ATOM 0 HA2 GLY A 783 -6.378 13.911 -2.500 1.00 25.00 H new ATOM 0 HA3 GLY A 783 -5.499 14.891 -3.656 1.00 25.00 H new ATOM 657 N ASN A 784 -7.256 16.602 -2.744 1.00 25.00 N ATOM 658 CA ASN A 784 -8.213 17.709 -2.634 1.00 25.00 C ATOM 659 C ASN A 784 -8.314 18.524 -3.925 1.00 25.00 C ATOM 660 O ASN A 784 -8.961 19.571 -3.957 1.00 25.00 O ATOM 661 CB ASN A 784 -7.792 18.640 -1.495 1.00 25.00 C ATOM 662 CG ASN A 784 -6.466 19.307 -1.760 1.00 25.00 C ATOM 663 OD1 ASN A 784 -5.423 18.701 -1.593 1.00 25.00 O ATOM 664 ND2 ASN A 784 -6.498 20.540 -2.180 1.00 25.00 N ATOM 0 H ASN A 784 -6.361 16.778 -2.287 1.00 25.00 H new ATOM 0 HA ASN A 784 -9.191 17.270 -2.436 1.00 25.00 H new ATOM 0 HB2 ASN A 784 -8.557 19.403 -1.351 1.00 25.00 H new ATOM 0 HB3 ASN A 784 -7.731 18.071 -0.568 1.00 25.00 H new ATOM 0 HD21 ASN A 784 -5.628 21.033 -2.382 1.00 25.00 H new ATOM 0 HD22 ASN A 784 -7.393 21.012 -2.307 1.00 25.00 H new ATOM 671 N ASP A 785 -7.660 18.058 -4.976 1.00 25.00 N ATOM 672 CA ASP A 785 -7.748 18.706 -6.281 1.00 25.00 C ATOM 673 C ASP A 785 -9.189 18.541 -6.772 1.00 25.00 C ATOM 674 O ASP A 785 -9.805 17.495 -6.559 1.00 25.00 O ATOM 675 CB ASP A 785 -6.789 18.043 -7.273 1.00 25.00 C ATOM 676 CG ASP A 785 -6.718 18.764 -8.595 1.00 25.00 C ATOM 677 OD1 ASP A 785 -5.912 19.697 -8.734 1.00 25.00 O ATOM 678 OD2 ASP A 785 -7.525 18.429 -9.487 1.00 25.00 O ATOM 0 H ASP A 785 -7.061 17.233 -4.954 1.00 25.00 H new ATOM 0 HA ASP A 785 -7.476 19.759 -6.201 1.00 25.00 H new ATOM 0 HB2 ASP A 785 -5.792 18.002 -6.834 1.00 25.00 H new ATOM 0 HB3 ASP A 785 -7.105 17.014 -7.443 1.00 25.00 H new ATOM 683 N PRO A 786 -9.737 19.550 -7.464 1.00 25.00 N ATOM 684 CA PRO A 786 -11.116 19.455 -7.954 1.00 25.00 C ATOM 685 C PRO A 786 -11.341 18.327 -8.960 1.00 25.00 C ATOM 686 O PRO A 786 -12.462 17.849 -9.114 1.00 25.00 O ATOM 687 CB PRO A 786 -11.339 20.827 -8.604 1.00 25.00 C ATOM 688 CG PRO A 786 -9.961 21.272 -9.004 1.00 25.00 C ATOM 689 CD PRO A 786 -9.114 20.825 -7.848 1.00 25.00 C ATOM 0 HA PRO A 786 -11.813 19.218 -7.150 1.00 25.00 H new ATOM 0 HB2 PRO A 786 -12.001 20.756 -9.467 1.00 25.00 H new ATOM 0 HB3 PRO A 786 -11.798 21.528 -7.907 1.00 25.00 H new ATOM 0 HG2 PRO A 786 -9.643 20.811 -9.939 1.00 25.00 H new ATOM 0 HG3 PRO A 786 -9.911 22.351 -9.148 1.00 25.00 H new ATOM 0 HD2 PRO A 786 -8.071 20.695 -8.137 1.00 25.00 H new ATOM 0 HD3 PRO A 786 -9.131 21.546 -7.031 1.00 25.00 H new ATOM 697 N GLN A 787 -10.285 17.878 -9.625 1.00 25.00 N ATOM 698 CA GLN A 787 -10.404 16.768 -10.565 1.00 25.00 C ATOM 699 C GLN A 787 -10.292 15.467 -9.785 1.00 25.00 C ATOM 700 O GLN A 787 -11.022 14.521 -10.037 1.00 25.00 O ATOM 701 CB GLN A 787 -9.307 16.840 -11.628 1.00 25.00 C ATOM 702 CG GLN A 787 -9.299 18.124 -12.402 1.00 25.00 C ATOM 703 CD GLN A 787 -8.139 18.189 -13.266 1.00 25.00 C ATOM 704 OE1 GLN A 787 -8.169 18.219 -14.485 1.00 25.00 O ATOM 705 NE2 GLN A 787 -7.076 18.248 -12.595 1.00 25.00 N ATOM 0 H GLN A 787 -9.344 18.260 -9.534 1.00 25.00 H new ATOM 0 HA GLN A 787 -11.366 16.821 -11.074 1.00 25.00 H new ATOM 0 HB2 GLN A 787 -8.338 16.711 -11.146 1.00 25.00 H new ATOM 0 HB3 GLN A 787 -9.431 16.009 -12.322 1.00 25.00 H new ATOM 0 HG2 GLN A 787 -10.208 18.202 -12.998 1.00 25.00 H new ATOM 0 HG3 GLN A 787 -9.295 18.970 -11.714 1.00 25.00 H new ATOM 0 HE21 GLN A 787 -7.114 18.218 -11.576 1.00 25.00 H new ATOM 0 HE22 GLN A 787 -6.177 18.325 -13.070 1.00 25.00 H new ATOM 714 N GLY A 788 -9.404 15.439 -8.799 1.00 25.00 N ATOM 715 CA GLY A 788 -9.228 14.254 -7.985 1.00 25.00 C ATOM 716 C GLY A 788 -10.469 13.900 -7.205 1.00 25.00 C ATOM 717 O GLY A 788 -10.780 12.744 -7.055 1.00 25.00 O ATOM 0 H GLY A 788 -8.800 16.222 -8.548 1.00 25.00 H new ATOM 0 HA2 GLY A 788 -8.953 13.415 -8.625 1.00 25.00 H new ATOM 0 HA3 GLY A 788 -8.401 14.412 -7.293 1.00 25.00 H new ATOM 721 N GLU A 789 -11.226 14.886 -6.765 1.00 25.00 N ATOM 722 CA GLU A 789 -12.479 14.615 -6.048 1.00 25.00 C ATOM 723 C GLU A 789 -13.508 13.934 -6.974 1.00 25.00 C ATOM 724 O GLU A 789 -14.352 13.163 -6.520 1.00 25.00 O ATOM 725 CB GLU A 789 -13.064 15.914 -5.476 1.00 25.00 C ATOM 726 CG GLU A 789 -12.279 16.501 -4.271 1.00 25.00 C ATOM 727 CD GLU A 789 -12.521 15.760 -2.938 1.00 25.00 C ATOM 728 OE1 GLU A 789 -13.400 14.874 -2.867 1.00 25.00 O ATOM 729 OE2 GLU A 789 -11.857 16.118 -1.930 1.00 25.00 O ATOM 0 H GLU A 789 -11.008 15.875 -6.884 1.00 25.00 H new ATOM 0 HA GLU A 789 -12.255 13.937 -5.224 1.00 25.00 H new ATOM 0 HB2 GLU A 789 -13.099 16.661 -6.269 1.00 25.00 H new ATOM 0 HB3 GLU A 789 -14.093 15.729 -5.167 1.00 25.00 H new ATOM 0 HG2 GLU A 789 -11.213 16.477 -4.499 1.00 25.00 H new ATOM 0 HG3 GLU A 789 -12.555 17.548 -4.147 1.00 25.00 H new ATOM 736 N ALA A 790 -13.419 14.174 -8.277 1.00 25.00 N ATOM 737 CA ALA A 790 -14.341 13.541 -9.219 1.00 25.00 C ATOM 738 C ALA A 790 -13.918 12.086 -9.438 1.00 25.00 C ATOM 739 O ALA A 790 -14.750 11.177 -9.497 1.00 25.00 O ATOM 740 CB ALA A 790 -14.348 14.309 -10.549 1.00 25.00 C ATOM 0 H ALA A 790 -12.729 14.793 -8.703 1.00 25.00 H new ATOM 0 HA ALA A 790 -15.351 13.561 -8.810 1.00 25.00 H new ATOM 0 HB1 ALA A 790 -15.038 13.829 -11.243 1.00 25.00 H new ATOM 0 HB2 ALA A 790 -14.666 15.337 -10.374 1.00 25.00 H new ATOM 0 HB3 ALA A 790 -13.345 14.307 -10.975 1.00 25.00 H new ATOM 746 N GLU A 791 -12.617 11.872 -9.528 1.00 25.00 N ATOM 747 CA GLU A 791 -12.070 10.532 -9.733 1.00 25.00 C ATOM 748 C GLU A 791 -12.245 9.708 -8.461 1.00 25.00 C ATOM 749 O GLU A 791 -12.513 8.511 -8.506 1.00 25.00 O ATOM 750 CB GLU A 791 -10.591 10.628 -10.100 1.00 25.00 C ATOM 751 CG GLU A 791 -10.306 11.467 -11.342 1.00 25.00 C ATOM 752 CD GLU A 791 -10.768 10.798 -12.634 1.00 25.00 C ATOM 753 OE1 GLU A 791 -11.993 10.770 -12.900 1.00 25.00 O ATOM 754 OE2 GLU A 791 -9.909 10.260 -13.374 1.00 25.00 O ATOM 0 H GLU A 791 -11.914 12.608 -9.463 1.00 25.00 H new ATOM 0 HA GLU A 791 -12.603 10.043 -10.549 1.00 25.00 H new ATOM 0 HB2 GLU A 791 -10.046 11.052 -9.257 1.00 25.00 H new ATOM 0 HB3 GLU A 791 -10.202 9.622 -10.258 1.00 25.00 H new ATOM 0 HG2 GLU A 791 -10.801 12.433 -11.242 1.00 25.00 H new ATOM 0 HG3 GLU A 791 -9.235 11.663 -11.404 1.00 25.00 H new ATOM 761 N PHE A 792 -12.169 10.376 -7.322 1.00 25.00 N ATOM 762 CA PHE A 792 -12.419 9.736 -6.036 1.00 25.00 C ATOM 763 C PHE A 792 -13.856 9.245 -6.020 1.00 25.00 C ATOM 764 O PHE A 792 -14.122 8.124 -5.602 1.00 25.00 O ATOM 765 CB PHE A 792 -12.159 10.709 -4.876 1.00 25.00 C ATOM 766 CG PHE A 792 -13.189 10.645 -3.787 1.00 25.00 C ATOM 767 CD1 PHE A 792 -13.282 9.524 -2.939 1.00 25.00 C ATOM 768 CD2 PHE A 792 -14.090 11.710 -3.608 1.00 25.00 C ATOM 769 CE1 PHE A 792 -14.278 9.465 -1.941 1.00 25.00 C ATOM 770 CE2 PHE A 792 -15.081 11.658 -2.618 1.00 25.00 C ATOM 771 CZ PHE A 792 -15.179 10.539 -1.792 1.00 25.00 C ATOM 0 H PHE A 792 -11.935 11.367 -7.259 1.00 25.00 H new ATOM 0 HA PHE A 792 -11.739 8.894 -5.905 1.00 25.00 H new ATOM 0 HB2 PHE A 792 -11.179 10.496 -4.449 1.00 25.00 H new ATOM 0 HB3 PHE A 792 -12.122 11.725 -5.268 1.00 25.00 H new ATOM 0 HD1 PHE A 792 -12.587 8.705 -3.053 1.00 25.00 H new ATOM 0 HD2 PHE A 792 -14.017 12.581 -4.243 1.00 25.00 H new ATOM 0 HE1 PHE A 792 -14.350 8.602 -1.295 1.00 25.00 H new ATOM 0 HE2 PHE A 792 -15.767 12.483 -2.495 1.00 25.00 H new ATOM 0 HZ PHE A 792 -15.948 10.495 -1.035 1.00 25.00 H new ATOM 781 N ALA A 793 -14.781 10.051 -6.523 1.00 25.00 N ATOM 782 CA ALA A 793 -16.180 9.653 -6.542 1.00 25.00 C ATOM 783 C ALA A 793 -16.428 8.488 -7.511 1.00 25.00 C ATOM 784 O ALA A 793 -17.268 7.624 -7.254 1.00 25.00 O ATOM 785 CB ALA A 793 -17.063 10.855 -6.896 1.00 25.00 C ATOM 0 H ALA A 793 -14.591 10.972 -6.918 1.00 25.00 H new ATOM 0 HA ALA A 793 -16.443 9.302 -5.544 1.00 25.00 H new ATOM 0 HB1 ALA A 793 -18.109 10.547 -6.908 1.00 25.00 H new ATOM 0 HB2 ALA A 793 -16.924 11.640 -6.153 1.00 25.00 H new ATOM 0 HB3 ALA A 793 -16.785 11.234 -7.880 1.00 25.00 H new ATOM 791 N ARG A 794 -15.651 8.427 -8.585 1.00 25.00 N ATOM 792 CA ARG A 794 -15.704 7.292 -9.513 1.00 25.00 C ATOM 793 C ARG A 794 -15.348 6.013 -8.764 1.00 25.00 C ATOM 794 O ARG A 794 -16.008 4.989 -8.922 1.00 25.00 O ATOM 795 CB ARG A 794 -14.736 7.512 -10.660 1.00 25.00 C ATOM 796 CG ARG A 794 -14.768 6.404 -11.670 1.00 25.00 C ATOM 797 CD ARG A 794 -13.791 6.676 -12.760 1.00 25.00 C ATOM 798 NE ARG A 794 -12.408 6.753 -12.245 1.00 25.00 N ATOM 799 CZ ARG A 794 -11.409 7.410 -12.826 1.00 25.00 C ATOM 800 NH1 ARG A 794 -11.551 8.015 -13.974 1.00 25.00 N ATOM 801 NH2 ARG A 794 -10.254 7.480 -12.228 1.00 25.00 N ATOM 0 H ARG A 794 -14.975 9.147 -8.840 1.00 25.00 H new ATOM 0 HA ARG A 794 -16.711 7.204 -9.921 1.00 25.00 H new ATOM 0 HB2 ARG A 794 -14.974 8.454 -11.154 1.00 25.00 H new ATOM 0 HB3 ARG A 794 -13.725 7.606 -10.263 1.00 25.00 H new ATOM 0 HG2 ARG A 794 -14.532 5.455 -11.188 1.00 25.00 H new ATOM 0 HG3 ARG A 794 -15.771 6.309 -12.086 1.00 25.00 H new ATOM 0 HD2 ARG A 794 -13.856 5.890 -13.512 1.00 25.00 H new ATOM 0 HD3 ARG A 794 -14.048 7.613 -13.254 1.00 25.00 H new ATOM 0 HE ARG A 794 -12.204 6.263 -11.374 1.00 25.00 H new ATOM 0 HH11 ARG A 794 -12.451 7.993 -14.454 1.00 25.00 H new ATOM 0 HH12 ARG A 794 -10.762 8.510 -14.391 1.00 25.00 H new ATOM 0 HH21 ARG A 794 -10.121 7.033 -11.321 1.00 25.00 H new ATOM 0 HH22 ARG A 794 -9.482 7.982 -12.667 1.00 25.00 H new ATOM 815 N ILE A 795 -14.321 6.073 -7.931 1.00 25.00 N ATOM 816 CA ILE A 795 -13.899 4.907 -7.165 1.00 25.00 C ATOM 817 C ILE A 795 -14.931 4.621 -6.105 1.00 25.00 C ATOM 818 O ILE A 795 -15.281 3.482 -5.894 1.00 25.00 O ATOM 819 CB ILE A 795 -12.546 5.098 -6.446 1.00 25.00 C ATOM 820 CG1 ILE A 795 -11.440 5.445 -7.445 1.00 25.00 C ATOM 821 CG2 ILE A 795 -12.163 3.803 -5.686 1.00 25.00 C ATOM 822 CD1 ILE A 795 -10.400 6.339 -6.854 1.00 25.00 C ATOM 0 H ILE A 795 -13.765 6.912 -7.767 1.00 25.00 H new ATOM 0 HA ILE A 795 -13.790 4.092 -7.880 1.00 25.00 H new ATOM 0 HB ILE A 795 -12.651 5.922 -5.740 1.00 25.00 H new ATOM 0 HG12 ILE A 795 -10.969 4.526 -7.795 1.00 25.00 H new ATOM 0 HG13 ILE A 795 -11.880 5.930 -8.316 1.00 25.00 H new ATOM 0 HG21 ILE A 795 -11.207 3.946 -5.182 1.00 25.00 H new ATOM 0 HG22 ILE A 795 -12.932 3.573 -4.948 1.00 25.00 H new ATOM 0 HG23 ILE A 795 -12.080 2.977 -6.393 1.00 25.00 H new ATOM 0 HD11 ILE A 795 -9.638 6.555 -7.603 1.00 25.00 H new ATOM 0 HD12 ILE A 795 -10.863 7.270 -6.528 1.00 25.00 H new ATOM 0 HD13 ILE A 795 -9.938 5.845 -5.999 1.00 25.00 H new ATOM 834 N MET A 796 -15.441 5.660 -5.460 1.00 25.00 N ATOM 835 CA MET A 796 -16.437 5.518 -4.394 1.00 25.00 C ATOM 836 C MET A 796 -17.641 4.709 -4.875 1.00 25.00 C ATOM 837 O MET A 796 -18.280 4.006 -4.105 1.00 25.00 O ATOM 838 CB MET A 796 -16.867 6.902 -3.895 1.00 25.00 C ATOM 839 CG MET A 796 -17.228 6.949 -2.420 1.00 25.00 C ATOM 840 SD MET A 796 -18.980 6.662 -2.117 1.00 25.00 S ATOM 841 CE MET A 796 -18.916 5.293 -0.972 1.00 25.00 C ATOM 0 H MET A 796 -15.180 6.626 -5.656 1.00 25.00 H new ATOM 0 HA MET A 796 -15.987 4.973 -3.564 1.00 25.00 H new ATOM 0 HB2 MET A 796 -16.060 7.610 -4.082 1.00 25.00 H new ATOM 0 HB3 MET A 796 -17.725 7.235 -4.478 1.00 25.00 H new ATOM 0 HG2 MET A 796 -16.645 6.200 -1.884 1.00 25.00 H new ATOM 0 HG3 MET A 796 -16.949 7.921 -2.014 1.00 25.00 H new ATOM 0 HE1 MET A 796 -19.883 4.790 -0.952 1.00 25.00 H new ATOM 0 HE2 MET A 796 -18.147 4.589 -1.289 1.00 25.00 H new ATOM 0 HE3 MET A 796 -18.680 5.664 0.025 1.00 25.00 H new ATOM 851 N SER A 797 -17.890 4.752 -6.174 1.00 25.00 N ATOM 852 CA SER A 797 -18.965 3.979 -6.777 1.00 25.00 C ATOM 853 C SER A 797 -18.584 2.504 -6.944 1.00 25.00 C ATOM 854 O SER A 797 -19.441 1.625 -6.808 1.00 25.00 O ATOM 855 CB SER A 797 -19.326 4.572 -8.142 1.00 25.00 C ATOM 856 OG SER A 797 -20.492 3.962 -8.671 1.00 25.00 O ATOM 0 H SER A 797 -17.358 5.318 -6.835 1.00 25.00 H new ATOM 0 HA SER A 797 -19.824 4.029 -6.108 1.00 25.00 H new ATOM 0 HB2 SER A 797 -19.486 5.646 -8.045 1.00 25.00 H new ATOM 0 HB3 SER A 797 -18.494 4.435 -8.833 1.00 25.00 H new ATOM 0 HG SER A 797 -20.702 4.359 -9.542 1.00 25.00 H new ATOM 862 N ILE A 798 -17.316 2.208 -7.224 1.00 25.00 N ATOM 863 CA ILE A 798 -16.908 0.810 -7.422 1.00 25.00 C ATOM 864 C ILE A 798 -16.620 0.134 -6.085 1.00 25.00 C ATOM 865 O ILE A 798 -16.805 -1.072 -5.939 1.00 25.00 O ATOM 866 CB ILE A 798 -15.726 0.645 -8.445 1.00 25.00 C ATOM 867 CG1 ILE A 798 -14.364 1.028 -7.834 1.00 25.00 C ATOM 868 CG2 ILE A 798 -16.024 1.489 -9.716 1.00 25.00 C ATOM 869 CD1 ILE A 798 -13.149 0.663 -8.703 1.00 25.00 C ATOM 0 H ILE A 798 -16.567 2.894 -7.318 1.00 25.00 H new ATOM 0 HA ILE A 798 -17.753 0.296 -7.881 1.00 25.00 H new ATOM 0 HB ILE A 798 -15.656 -0.409 -8.715 1.00 25.00 H new ATOM 0 HG12 ILE A 798 -14.352 2.102 -7.649 1.00 25.00 H new ATOM 0 HG13 ILE A 798 -14.263 0.537 -6.866 1.00 25.00 H new ATOM 0 HG21 ILE A 798 -15.206 1.377 -10.427 1.00 25.00 H new ATOM 0 HG22 ILE A 798 -16.952 1.144 -10.172 1.00 25.00 H new ATOM 0 HG23 ILE A 798 -16.124 2.539 -9.440 1.00 25.00 H new ATOM 0 HD11 ILE A 798 -12.234 0.969 -8.196 1.00 25.00 H new ATOM 0 HD12 ILE A 798 -13.130 -0.414 -8.868 1.00 25.00 H new ATOM 0 HD13 ILE A 798 -13.221 1.176 -9.662 1.00 25.00 H new ATOM 881 N VAL A 799 -16.277 0.933 -5.081 1.00 25.00 N ATOM 882 CA VAL A 799 -16.034 0.422 -3.735 1.00 25.00 C ATOM 883 C VAL A 799 -17.321 0.514 -2.918 1.00 25.00 C ATOM 884 O VAL A 799 -17.334 0.407 -1.692 1.00 25.00 O ATOM 885 CB VAL A 799 -14.838 1.126 -3.038 1.00 25.00 C ATOM 886 CG1 VAL A 799 -13.582 0.955 -3.886 1.00 25.00 C ATOM 887 CG2 VAL A 799 -15.103 2.602 -2.792 1.00 25.00 C ATOM 0 H VAL A 799 -16.160 1.942 -5.174 1.00 25.00 H new ATOM 0 HA VAL A 799 -15.744 -0.626 -3.810 1.00 25.00 H new ATOM 0 HB VAL A 799 -14.698 0.657 -2.064 1.00 25.00 H new ATOM 0 HG11 VAL A 799 -12.743 1.449 -3.397 1.00 25.00 H new ATOM 0 HG12 VAL A 799 -13.362 -0.106 -4.000 1.00 25.00 H new ATOM 0 HG13 VAL A 799 -13.743 1.400 -4.868 1.00 25.00 H new ATOM 0 HG21 VAL A 799 -14.238 3.050 -2.303 1.00 25.00 H new ATOM 0 HG22 VAL A 799 -15.282 3.103 -3.743 1.00 25.00 H new ATOM 0 HG23 VAL A 799 -15.979 2.713 -2.153 1.00 25.00 H new ATOM 897 N ASP A 800 -18.422 0.581 -3.646 1.00 25.00 N ATOM 898 CA ASP A 800 -19.750 0.406 -3.083 1.00 25.00 C ATOM 899 C ASP A 800 -20.432 -0.752 -3.832 1.00 25.00 C ATOM 900 O ASP A 800 -21.434 -0.563 -4.527 1.00 25.00 O ATOM 901 CB ASP A 800 -20.566 1.688 -3.207 1.00 25.00 C ATOM 902 CG ASP A 800 -21.937 1.548 -2.596 1.00 25.00 C ATOM 903 OD1 ASP A 800 -22.132 0.621 -1.779 1.00 25.00 O ATOM 904 OD2 ASP A 800 -22.844 2.320 -2.952 1.00 25.00 O ATOM 0 H ASP A 800 -18.420 0.759 -4.650 1.00 25.00 H new ATOM 0 HA ASP A 800 -19.678 0.174 -2.020 1.00 25.00 H new ATOM 0 HB2 ASP A 800 -20.034 2.505 -2.719 1.00 25.00 H new ATOM 0 HB3 ASP A 800 -20.664 1.955 -4.259 1.00 25.00 H new ATOM 909 N PRO A 801 -19.887 -1.979 -3.708 1.00 25.00 N ATOM 910 CA PRO A 801 -20.474 -3.122 -4.418 1.00 25.00 C ATOM 911 C PRO A 801 -21.828 -3.573 -3.876 1.00 25.00 C ATOM 912 O PRO A 801 -22.445 -4.471 -4.430 1.00 25.00 O ATOM 913 CB PRO A 801 -19.433 -4.225 -4.186 1.00 25.00 C ATOM 914 CG PRO A 801 -18.828 -3.879 -2.880 1.00 25.00 C ATOM 915 CD PRO A 801 -18.695 -2.397 -2.947 1.00 25.00 C ATOM 0 HA PRO A 801 -20.675 -2.874 -5.460 1.00 25.00 H new ATOM 0 HB2 PRO A 801 -19.896 -5.212 -4.162 1.00 25.00 H new ATOM 0 HB3 PRO A 801 -18.686 -4.242 -4.980 1.00 25.00 H new ATOM 0 HG2 PRO A 801 -19.461 -4.189 -2.049 1.00 25.00 H new ATOM 0 HG3 PRO A 801 -17.862 -4.364 -2.743 1.00 25.00 H new ATOM 0 HD2 PRO A 801 -18.676 -1.950 -1.953 1.00 25.00 H new ATOM 0 HD3 PRO A 801 -17.774 -2.099 -3.448 1.00 25.00 H new ATOM 923 N ASN A 802 -22.267 -2.995 -2.765 1.00 25.00 N ATOM 924 CA ASN A 802 -23.499 -3.428 -2.109 1.00 25.00 C ATOM 925 C ASN A 802 -24.558 -2.336 -2.250 1.00 25.00 C ATOM 926 O ASN A 802 -25.686 -2.501 -1.807 1.00 25.00 O ATOM 927 CB ASN A 802 -23.227 -3.711 -0.629 1.00 25.00 C ATOM 928 CG ASN A 802 -22.690 -5.102 -0.374 1.00 25.00 C ATOM 929 OD1 ASN A 802 -23.161 -5.794 0.505 1.00 25.00 O ATOM 930 ND2 ASN A 802 -21.682 -5.492 -1.095 1.00 25.00 N ATOM 0 H ASN A 802 -21.789 -2.225 -2.297 1.00 25.00 H new ATOM 0 HA ASN A 802 -23.861 -4.342 -2.580 1.00 25.00 H new ATOM 0 HB2 ASN A 802 -22.513 -2.979 -0.252 1.00 25.00 H new ATOM 0 HB3 ASN A 802 -24.150 -3.576 -0.065 1.00 25.00 H new ATOM 0 HD21 ASN A 802 -21.261 -6.406 -0.931 1.00 25.00 H new ATOM 0 HD22 ASN A 802 -21.312 -4.884 -1.826 1.00 25.00 H new ATOM 937 N ARG A 803 -24.168 -1.229 -2.880 1.00 25.00 N ATOM 938 CA ARG A 803 -25.051 -0.082 -3.150 1.00 25.00 C ATOM 939 C ARG A 803 -25.686 0.491 -1.884 1.00 25.00 C ATOM 940 O ARG A 803 -26.850 0.879 -1.872 1.00 25.00 O ATOM 941 CB ARG A 803 -26.097 -0.452 -4.209 1.00 25.00 C ATOM 942 CG ARG A 803 -25.460 -0.842 -5.546 1.00 25.00 C ATOM 943 CD ARG A 803 -24.891 0.389 -6.267 1.00 25.00 C ATOM 944 NE ARG A 803 -23.435 0.289 -6.482 1.00 25.00 N ATOM 945 CZ ARG A 803 -22.844 -0.198 -7.566 1.00 25.00 C ATOM 946 NH1 ARG A 803 -23.522 -0.667 -8.587 1.00 25.00 N ATOM 947 NH2 ARG A 803 -21.546 -0.206 -7.635 1.00 25.00 N ATOM 0 H ARG A 803 -23.217 -1.096 -3.224 1.00 25.00 H new ATOM 0 HA ARG A 803 -24.432 0.721 -3.550 1.00 25.00 H new ATOM 0 HB2 ARG A 803 -26.704 -1.280 -3.843 1.00 25.00 H new ATOM 0 HB3 ARG A 803 -26.769 0.392 -4.362 1.00 25.00 H new ATOM 0 HG2 ARG A 803 -24.665 -1.567 -5.376 1.00 25.00 H new ATOM 0 HG3 ARG A 803 -26.203 -1.327 -6.179 1.00 25.00 H new ATOM 0 HD2 ARG A 803 -25.391 0.507 -7.228 1.00 25.00 H new ATOM 0 HD3 ARG A 803 -25.109 1.283 -5.682 1.00 25.00 H new ATOM 0 HE ARG A 803 -22.830 0.623 -5.732 1.00 25.00 H new ATOM 0 HH11 ARG A 803 -24.542 -0.666 -8.566 1.00 25.00 H new ATOM 0 HH12 ARG A 803 -23.029 -1.033 -9.402 1.00 25.00 H new ATOM 0 HH21 ARG A 803 -20.992 0.160 -6.861 1.00 25.00 H new ATOM 0 HH22 ARG A 803 -21.082 -0.578 -8.463 1.00 25.00 H new ATOM 961 N LEU A 804 -24.880 0.568 -0.835 1.00 25.00 N ATOM 962 CA LEU A 804 -25.289 1.137 0.449 1.00 25.00 C ATOM 963 C LEU A 804 -24.675 2.520 0.652 1.00 25.00 C ATOM 964 O LEU A 804 -25.008 3.224 1.598 1.00 25.00 O ATOM 965 CB LEU A 804 -24.910 0.207 1.616 1.00 25.00 C ATOM 966 CG LEU A 804 -23.868 -0.897 1.377 1.00 25.00 C ATOM 967 CD1 LEU A 804 -22.461 -0.363 1.251 1.00 25.00 C ATOM 968 CD2 LEU A 804 -23.895 -1.922 2.492 1.00 25.00 C ATOM 0 H LEU A 804 -23.916 0.236 -0.847 1.00 25.00 H new ATOM 0 HA LEU A 804 -26.374 1.239 0.434 1.00 25.00 H new ATOM 0 HB2 LEU A 804 -24.546 0.833 2.431 1.00 25.00 H new ATOM 0 HB3 LEU A 804 -25.824 -0.273 1.966 1.00 25.00 H new ATOM 0 HG LEU A 804 -24.144 -1.360 0.430 1.00 25.00 H new ATOM 0 HD11 LEU A 804 -21.771 -1.190 1.083 1.00 25.00 H new ATOM 0 HD12 LEU A 804 -22.408 0.329 0.411 1.00 25.00 H new ATOM 0 HD13 LEU A 804 -22.186 0.158 2.168 1.00 25.00 H new ATOM 0 HD21 LEU A 804 -23.148 -2.691 2.297 1.00 25.00 H new ATOM 0 HD22 LEU A 804 -23.674 -1.433 3.441 1.00 25.00 H new ATOM 0 HD23 LEU A 804 -24.883 -2.380 2.541 1.00 25.00 H new ATOM 980 N GLY A 805 -23.793 2.912 -0.255 1.00 25.00 N ATOM 981 CA GLY A 805 -23.187 4.237 -0.197 1.00 25.00 C ATOM 982 C GLY A 805 -22.050 4.348 0.799 1.00 25.00 C ATOM 983 O GLY A 805 -21.691 5.447 1.228 1.00 25.00 O ATOM 0 H GLY A 805 -23.481 2.336 -1.037 1.00 25.00 H new ATOM 0 HA2 GLY A 805 -22.816 4.500 -1.188 1.00 25.00 H new ATOM 0 HA3 GLY A 805 -23.955 4.966 0.060 1.00 25.00 H new ATOM 987 N VAL A 806 -21.477 3.215 1.175 1.00 25.00 N ATOM 988 CA VAL A 806 -20.377 3.186 2.137 1.00 25.00 C ATOM 989 C VAL A 806 -19.344 2.153 1.693 1.00 25.00 C ATOM 990 O VAL A 806 -19.674 1.186 1.012 1.00 25.00 O ATOM 991 CB VAL A 806 -20.859 2.831 3.578 1.00 25.00 C ATOM 992 CG1 VAL A 806 -20.506 3.952 4.552 1.00 25.00 C ATOM 993 CG2 VAL A 806 -22.380 2.582 3.652 1.00 25.00 C ATOM 0 H VAL A 806 -21.755 2.297 0.828 1.00 25.00 H new ATOM 0 HA VAL A 806 -19.942 4.185 2.166 1.00 25.00 H new ATOM 0 HB VAL A 806 -20.346 1.909 3.851 1.00 25.00 H new ATOM 0 HG11 VAL A 806 -20.850 3.687 5.552 1.00 25.00 H new ATOM 0 HG12 VAL A 806 -19.426 4.095 4.566 1.00 25.00 H new ATOM 0 HG13 VAL A 806 -20.990 4.876 4.235 1.00 25.00 H new ATOM 0 HG21 VAL A 806 -22.659 2.339 4.677 1.00 25.00 H new ATOM 0 HG22 VAL A 806 -22.911 3.479 3.334 1.00 25.00 H new ATOM 0 HG23 VAL A 806 -22.645 1.752 2.997 1.00 25.00 H new ATOM 1003 N VAL A 807 -18.092 2.371 2.061 1.00 25.00 N ATOM 1004 CA VAL A 807 -16.993 1.509 1.648 1.00 25.00 C ATOM 1005 C VAL A 807 -16.796 0.439 2.693 1.00 25.00 C ATOM 1006 O VAL A 807 -16.660 0.727 3.883 1.00 25.00 O ATOM 1007 CB VAL A 807 -15.695 2.326 1.479 1.00 25.00 C ATOM 1008 CG1 VAL A 807 -14.550 1.453 0.997 1.00 25.00 C ATOM 1009 CG2 VAL A 807 -15.939 3.468 0.498 1.00 25.00 C ATOM 0 H VAL A 807 -17.807 3.150 2.654 1.00 25.00 H new ATOM 0 HA VAL A 807 -17.234 1.053 0.688 1.00 25.00 H new ATOM 0 HB VAL A 807 -15.413 2.732 2.450 1.00 25.00 H new ATOM 0 HG11 VAL A 807 -13.651 2.059 0.888 1.00 25.00 H new ATOM 0 HG12 VAL A 807 -14.367 0.660 1.722 1.00 25.00 H new ATOM 0 HG13 VAL A 807 -14.809 1.012 0.034 1.00 25.00 H new ATOM 0 HG21 VAL A 807 -15.023 4.046 0.378 1.00 25.00 H new ATOM 0 HG22 VAL A 807 -16.240 3.061 -0.467 1.00 25.00 H new ATOM 0 HG23 VAL A 807 -16.728 4.115 0.881 1.00 25.00 H new ATOM 1019 N THR A 808 -16.825 -0.803 2.248 1.00 25.00 N ATOM 1020 CA THR A 808 -16.739 -1.947 3.144 1.00 25.00 C ATOM 1021 C THR A 808 -15.385 -2.595 3.092 1.00 25.00 C ATOM 1022 O THR A 808 -14.631 -2.364 2.182 1.00 25.00 O ATOM 1023 CB THR A 808 -17.774 -3.026 2.763 1.00 25.00 C ATOM 1024 OG1 THR A 808 -17.203 -3.888 1.784 1.00 25.00 O ATOM 1025 CG2 THR A 808 -19.011 -2.428 2.131 1.00 25.00 C ATOM 0 H THR A 808 -16.908 -1.049 1.262 1.00 25.00 H new ATOM 0 HA THR A 808 -16.931 -1.562 4.146 1.00 25.00 H new ATOM 0 HB THR A 808 -18.045 -3.549 3.680 1.00 25.00 H new ATOM 0 HG1 THR A 808 -17.528 -3.634 0.895 1.00 25.00 H new ATOM 0 HG21 THR A 808 -19.712 -3.224 1.879 1.00 25.00 H new ATOM 0 HG22 THR A 808 -19.481 -1.739 2.833 1.00 25.00 H new ATOM 0 HG23 THR A 808 -18.733 -1.889 1.225 1.00 25.00 H new ATOM 1033 N PHE A 809 -15.108 -3.461 4.047 1.00 25.00 N ATOM 1034 CA PHE A 809 -13.862 -4.216 4.107 1.00 25.00 C ATOM 1035 C PHE A 809 -13.527 -4.935 2.819 1.00 25.00 C ATOM 1036 O PHE A 809 -12.394 -4.896 2.393 1.00 25.00 O ATOM 1037 CB PHE A 809 -13.944 -5.223 5.250 1.00 25.00 C ATOM 1038 CG PHE A 809 -15.354 -5.528 5.681 1.00 25.00 C ATOM 1039 CD1 PHE A 809 -16.100 -6.532 5.033 1.00 25.00 C ATOM 1040 CD2 PHE A 809 -15.951 -4.803 6.734 1.00 25.00 C ATOM 1041 CE1 PHE A 809 -17.435 -6.804 5.420 1.00 25.00 C ATOM 1042 CE2 PHE A 809 -17.283 -5.063 7.129 1.00 25.00 C ATOM 1043 CZ PHE A 809 -18.029 -6.063 6.467 1.00 25.00 C ATOM 0 H PHE A 809 -15.747 -3.666 4.815 1.00 25.00 H new ATOM 0 HA PHE A 809 -13.061 -3.496 4.274 1.00 25.00 H new ATOM 0 HB2 PHE A 809 -13.458 -6.149 4.943 1.00 25.00 H new ATOM 0 HB3 PHE A 809 -13.387 -4.838 6.104 1.00 25.00 H new ATOM 0 HD1 PHE A 809 -15.649 -7.100 4.233 1.00 25.00 H new ATOM 0 HD2 PHE A 809 -15.383 -4.040 7.245 1.00 25.00 H new ATOM 0 HE1 PHE A 809 -17.998 -7.576 4.916 1.00 25.00 H new ATOM 0 HE2 PHE A 809 -17.729 -4.499 7.935 1.00 25.00 H new ATOM 0 HZ PHE A 809 -19.050 -6.261 6.760 1.00 25.00 H new ATOM 1053 N GLN A 810 -14.510 -5.544 2.171 1.00 25.00 N ATOM 1054 CA GLN A 810 -14.250 -6.243 0.914 1.00 25.00 C ATOM 1055 C GLN A 810 -14.061 -5.239 -0.227 1.00 25.00 C ATOM 1056 O GLN A 810 -13.570 -5.581 -1.291 1.00 25.00 O ATOM 1057 CB GLN A 810 -15.395 -7.221 0.601 1.00 25.00 C ATOM 1058 CG GLN A 810 -16.640 -6.570 0.001 1.00 25.00 C ATOM 1059 CD GLN A 810 -17.931 -7.136 0.559 1.00 25.00 C ATOM 1060 OE1 GLN A 810 -18.179 -8.322 0.483 1.00 25.00 O ATOM 1061 NE2 GLN A 810 -18.754 -6.286 1.129 1.00 25.00 N ATOM 0 H GLN A 810 -15.480 -5.571 2.485 1.00 25.00 H new ATOM 0 HA GLN A 810 -13.329 -6.817 1.016 1.00 25.00 H new ATOM 0 HB2 GLN A 810 -15.029 -7.980 -0.090 1.00 25.00 H new ATOM 0 HB3 GLN A 810 -15.677 -7.736 1.519 1.00 25.00 H new ATOM 0 HG2 GLN A 810 -16.609 -5.497 0.189 1.00 25.00 H new ATOM 0 HG3 GLN A 810 -16.628 -6.704 -1.081 1.00 25.00 H new ATOM 0 HE21 GLN A 810 -18.513 -5.296 1.175 1.00 25.00 H new ATOM 0 HE22 GLN A 810 -19.634 -6.616 1.526 1.00 25.00 H new ATOM 1070 N ALA A 811 -14.500 -4.008 0.002 1.00 25.00 N ATOM 1071 CA ALA A 811 -14.432 -2.959 -1.007 1.00 25.00 C ATOM 1072 C ALA A 811 -13.091 -2.234 -0.969 1.00 25.00 C ATOM 1073 O ALA A 811 -12.559 -1.838 -1.988 1.00 25.00 O ATOM 1074 CB ALA A 811 -15.547 -1.983 -0.785 1.00 25.00 C ATOM 0 H ALA A 811 -14.911 -3.710 0.887 1.00 25.00 H new ATOM 0 HA ALA A 811 -14.533 -3.421 -1.989 1.00 25.00 H new ATOM 0 HB1 ALA A 811 -15.498 -1.197 -1.539 1.00 25.00 H new ATOM 0 HB2 ALA A 811 -16.504 -2.500 -0.861 1.00 25.00 H new ATOM 0 HB3 ALA A 811 -15.451 -1.541 0.207 1.00 25.00 H new ATOM 1080 N PHE A 812 -12.564 -2.055 0.233 1.00 25.00 N ATOM 1081 CA PHE A 812 -11.293 -1.343 0.419 1.00 25.00 C ATOM 1082 C PHE A 812 -10.172 -2.023 -0.353 1.00 25.00 C ATOM 1083 O PHE A 812 -9.243 -1.378 -0.838 1.00 25.00 O ATOM 1084 CB PHE A 812 -10.882 -1.301 1.887 1.00 25.00 C ATOM 1085 CG PHE A 812 -11.677 -0.378 2.712 1.00 25.00 C ATOM 1086 CD1 PHE A 812 -11.480 1.012 2.677 1.00 25.00 C ATOM 1087 CD2 PHE A 812 -12.626 -0.908 3.562 1.00 25.00 C ATOM 1088 CE1 PHE A 812 -12.278 1.848 3.477 1.00 25.00 C ATOM 1089 CE2 PHE A 812 -13.435 -0.102 4.348 1.00 25.00 C ATOM 1090 CZ PHE A 812 -13.283 1.266 4.302 1.00 25.00 C ATOM 0 H PHE A 812 -12.990 -2.389 1.097 1.00 25.00 H new ATOM 0 HA PHE A 812 -11.451 -0.329 0.051 1.00 25.00 H new ATOM 0 HB2 PHE A 812 -10.964 -2.305 2.304 1.00 25.00 H new ATOM 0 HB3 PHE A 812 -9.832 -1.014 1.950 1.00 25.00 H new ATOM 0 HD1 PHE A 812 -10.719 1.436 2.039 1.00 25.00 H new ATOM 0 HD2 PHE A 812 -12.742 -1.980 3.616 1.00 25.00 H new ATOM 0 HE1 PHE A 812 -12.131 2.918 3.466 1.00 25.00 H new ATOM 0 HE2 PHE A 812 -14.180 -0.544 4.993 1.00 25.00 H new ATOM 0 HZ PHE A 812 -13.928 1.899 4.893 1.00 25.00 H new ATOM 1100 N ILE A 813 -10.265 -3.340 -0.434 1.00 25.00 N ATOM 1101 CA ILE A 813 -9.236 -4.171 -1.053 1.00 25.00 C ATOM 1102 C ILE A 813 -9.054 -3.799 -2.501 1.00 25.00 C ATOM 1103 O ILE A 813 -7.960 -3.867 -3.037 1.00 25.00 O ATOM 1104 CB ILE A 813 -9.632 -5.661 -0.998 1.00 25.00 C ATOM 1105 CG1 ILE A 813 -10.090 -6.050 0.422 1.00 25.00 C ATOM 1106 CG2 ILE A 813 -8.477 -6.551 -1.484 1.00 25.00 C ATOM 1107 CD1 ILE A 813 -9.191 -5.550 1.610 1.00 25.00 C ATOM 0 H ILE A 813 -11.058 -3.869 -0.072 1.00 25.00 H new ATOM 0 HA ILE A 813 -8.311 -4.006 -0.501 1.00 25.00 H new ATOM 0 HB ILE A 813 -10.474 -5.820 -1.672 1.00 25.00 H new ATOM 0 HG12 ILE A 813 -11.099 -5.666 0.572 1.00 25.00 H new ATOM 0 HG13 ILE A 813 -10.152 -7.137 0.475 1.00 25.00 H new ATOM 0 HG21 ILE A 813 -8.779 -7.597 -1.436 1.00 25.00 H new ATOM 0 HG22 ILE A 813 -8.226 -6.292 -2.513 1.00 25.00 H new ATOM 0 HG23 ILE A 813 -7.606 -6.396 -0.848 1.00 25.00 H new ATOM 0 HD11 ILE A 813 -9.617 -5.887 2.555 1.00 25.00 H new ATOM 0 HD12 ILE A 813 -8.185 -5.955 1.500 1.00 25.00 H new ATOM 0 HD13 ILE A 813 -9.147 -4.461 1.600 1.00 25.00 H new ATOM 1119 N ASP A 814 -10.137 -3.381 -3.121 1.00 25.00 N ATOM 1120 CA ASP A 814 -10.091 -2.954 -4.509 1.00 25.00 C ATOM 1121 C ASP A 814 -8.987 -1.913 -4.714 1.00 25.00 C ATOM 1122 O ASP A 814 -8.131 -2.095 -5.568 1.00 25.00 O ATOM 1123 CB ASP A 814 -11.444 -2.391 -4.937 1.00 25.00 C ATOM 1124 CG ASP A 814 -11.722 -2.614 -6.425 1.00 25.00 C ATOM 1125 OD1 ASP A 814 -10.776 -2.968 -7.176 1.00 25.00 O ATOM 1126 OD2 ASP A 814 -12.882 -2.447 -6.842 1.00 25.00 O ATOM 0 H ASP A 814 -11.060 -3.327 -2.690 1.00 25.00 H new ATOM 0 HA ASP A 814 -9.865 -3.821 -5.130 1.00 25.00 H new ATOM 0 HB2 ASP A 814 -12.233 -2.860 -4.348 1.00 25.00 H new ATOM 0 HB3 ASP A 814 -11.476 -1.323 -4.720 1.00 25.00 H new ATOM 1131 N PHE A 815 -8.942 -0.879 -3.873 1.00 25.00 N ATOM 1132 CA PHE A 815 -7.874 0.128 -3.971 1.00 25.00 C ATOM 1133 C PHE A 815 -6.535 -0.472 -3.563 1.00 25.00 C ATOM 1134 O PHE A 815 -5.529 -0.241 -4.192 1.00 25.00 O ATOM 1135 CB PHE A 815 -8.154 1.355 -3.093 1.00 25.00 C ATOM 1136 CG PHE A 815 -7.462 2.610 -3.576 1.00 25.00 C ATOM 1137 CD1 PHE A 815 -6.042 2.713 -3.640 1.00 25.00 C ATOM 1138 CD2 PHE A 815 -8.237 3.717 -3.990 1.00 25.00 C ATOM 1139 CE1 PHE A 815 -5.439 3.881 -4.132 1.00 25.00 C ATOM 1140 CE2 PHE A 815 -7.631 4.872 -4.466 1.00 25.00 C ATOM 1141 CZ PHE A 815 -6.238 4.953 -4.552 1.00 25.00 C ATOM 0 H PHE A 815 -9.618 -0.714 -3.127 1.00 25.00 H new ATOM 0 HA PHE A 815 -7.840 0.448 -5.012 1.00 25.00 H new ATOM 0 HB2 PHE A 815 -9.229 1.531 -3.060 1.00 25.00 H new ATOM 0 HB3 PHE A 815 -7.835 1.143 -2.073 1.00 25.00 H new ATOM 0 HD1 PHE A 815 -5.427 1.889 -3.309 1.00 25.00 H new ATOM 0 HD2 PHE A 815 -9.314 3.664 -3.935 1.00 25.00 H new ATOM 0 HE1 PHE A 815 -4.363 3.953 -4.187 1.00 25.00 H new ATOM 0 HE2 PHE A 815 -8.238 5.711 -4.771 1.00 25.00 H new ATOM 0 HZ PHE A 815 -5.775 5.846 -4.944 1.00 25.00 H new ATOM 1151 N MET A 816 -6.524 -1.274 -2.517 1.00 25.00 N ATOM 1152 CA MET A 816 -5.276 -1.890 -2.049 1.00 25.00 C ATOM 1153 C MET A 816 -4.619 -2.821 -3.060 1.00 25.00 C ATOM 1154 O MET A 816 -3.442 -3.079 -2.993 1.00 25.00 O ATOM 1155 CB MET A 816 -5.572 -2.717 -0.826 1.00 25.00 C ATOM 1156 CG MET A 816 -4.531 -2.605 0.250 1.00 25.00 C ATOM 1157 SD MET A 816 -4.362 -0.911 0.736 1.00 25.00 S ATOM 1158 CE MET A 816 -2.854 -0.600 0.135 1.00 25.00 C ATOM 0 H MET A 816 -7.351 -1.519 -1.972 1.00 25.00 H new ATOM 0 HA MET A 816 -4.590 -1.064 -1.859 1.00 25.00 H new ATOM 0 HB2 MET A 816 -6.536 -2.413 -0.418 1.00 25.00 H new ATOM 0 HB3 MET A 816 -5.666 -3.762 -1.120 1.00 25.00 H new ATOM 0 HG2 MET A 816 -4.814 -3.214 1.109 1.00 25.00 H new ATOM 0 HG3 MET A 816 -3.577 -2.987 -0.112 1.00 25.00 H new ATOM 0 HE1 MET A 816 -2.820 0.417 -0.254 1.00 25.00 H new ATOM 0 HE2 MET A 816 -2.116 -0.709 0.930 1.00 25.00 H new ATOM 0 HE3 MET A 816 -2.630 -1.303 -0.667 1.00 25.00 H new ATOM 1168 N SER A 817 -5.378 -3.343 -4.001 1.00 25.00 N ATOM 1169 CA SER A 817 -4.792 -4.159 -5.057 1.00 25.00 C ATOM 1170 C SER A 817 -4.222 -3.239 -6.143 1.00 25.00 C ATOM 1171 O SER A 817 -3.351 -3.627 -6.917 1.00 25.00 O ATOM 1172 CB SER A 817 -5.822 -5.143 -5.599 1.00 25.00 C ATOM 1173 OG SER A 817 -5.339 -5.883 -6.710 1.00 25.00 O ATOM 0 H SER A 817 -6.389 -3.222 -4.061 1.00 25.00 H new ATOM 0 HA SER A 817 -3.971 -4.757 -4.662 1.00 25.00 H new ATOM 0 HB2 SER A 817 -6.112 -5.833 -4.806 1.00 25.00 H new ATOM 0 HB3 SER A 817 -6.720 -4.599 -5.892 1.00 25.00 H new ATOM 0 HG SER A 817 -6.035 -6.500 -7.019 1.00 25.00 H new ATOM 1179 N ARG A 818 -4.690 -1.998 -6.164 1.00 25.00 N ATOM 1180 CA ARG A 818 -4.136 -0.967 -7.079 1.00 25.00 C ATOM 1181 C ARG A 818 -2.797 -0.466 -6.556 1.00 25.00 C ATOM 1182 O ARG A 818 -2.032 0.106 -7.310 1.00 25.00 O ATOM 1183 CB ARG A 818 -5.043 0.265 -7.268 1.00 25.00 C ATOM 1184 CG ARG A 818 -6.501 0.000 -7.617 1.00 25.00 C ATOM 1185 CD ARG A 818 -6.713 -0.849 -8.868 1.00 25.00 C ATOM 1186 NE ARG A 818 -7.667 -1.937 -8.578 1.00 25.00 N ATOM 1187 CZ ARG A 818 -7.376 -3.231 -8.536 1.00 25.00 C ATOM 1188 NH1 ARG A 818 -6.179 -3.697 -8.801 1.00 25.00 N ATOM 1189 NH2 ARG A 818 -8.316 -4.072 -8.213 1.00 25.00 N ATOM 0 H ARG A 818 -5.448 -1.666 -5.567 1.00 25.00 H new ATOM 0 HA ARG A 818 -4.042 -1.467 -8.043 1.00 25.00 H new ATOM 0 HB2 ARG A 818 -5.015 0.851 -6.349 1.00 25.00 H new ATOM 0 HB3 ARG A 818 -4.613 0.885 -8.055 1.00 25.00 H new ATOM 0 HG2 ARG A 818 -6.978 -0.497 -6.772 1.00 25.00 H new ATOM 0 HG3 ARG A 818 -7.008 0.956 -7.753 1.00 25.00 H new ATOM 0 HD2 ARG A 818 -7.091 -0.228 -9.680 1.00 25.00 H new ATOM 0 HD3 ARG A 818 -5.762 -1.266 -9.201 1.00 25.00 H new ATOM 0 HE ARG A 818 -8.634 -1.671 -8.394 1.00 25.00 H new ATOM 0 HH11 ARG A 818 -5.426 -3.056 -9.052 1.00 25.00 H new ATOM 0 HH12 ARG A 818 -6.001 -4.700 -8.756 1.00 25.00 H new ATOM 0 HH21 ARG A 818 -9.253 -3.732 -7.999 1.00 25.00 H new ATOM 0 HH22 ARG A 818 -8.115 -5.071 -8.174 1.00 25.00 H new ATOM 1203 N GLU A 819 -2.544 -0.669 -5.265 1.00 25.00 N ATOM 1204 CA GLU A 819 -1.290 -0.244 -4.608 1.00 25.00 C ATOM 1205 C GLU A 819 -0.044 -0.772 -5.365 1.00 25.00 C ATOM 1206 O GLU A 819 1.045 -0.217 -5.289 1.00 25.00 O ATOM 1207 CB GLU A 819 -1.268 -0.749 -3.144 1.00 25.00 C ATOM 1208 CG GLU A 819 0.067 -0.727 -2.493 1.00 25.00 C ATOM 1209 CD GLU A 819 0.031 -0.810 -0.989 1.00 25.00 C ATOM 1210 OE1 GLU A 819 -0.134 -1.942 -0.481 1.00 25.00 O ATOM 1211 OE2 GLU A 819 0.161 0.226 -0.312 1.00 25.00 O ATOM 0 H GLU A 819 -3.199 -1.133 -4.635 1.00 25.00 H new ATOM 0 HA GLU A 819 -1.255 0.845 -4.622 1.00 25.00 H new ATOM 0 HB2 GLU A 819 -1.953 -0.139 -2.555 1.00 25.00 H new ATOM 0 HB3 GLU A 819 -1.650 -1.770 -3.122 1.00 25.00 H new ATOM 0 HG2 GLU A 819 0.658 -1.559 -2.876 1.00 25.00 H new ATOM 0 HG3 GLU A 819 0.583 0.189 -2.781 1.00 25.00 H new ATOM 1218 N THR A 820 -0.244 -1.826 -6.142 1.00 25.00 N ATOM 1219 CA THR A 820 0.802 -2.434 -6.967 1.00 25.00 C ATOM 1220 C THR A 820 1.297 -1.541 -8.131 1.00 25.00 C ATOM 1221 O THR A 820 2.155 -1.957 -8.914 1.00 25.00 O ATOM 1222 CB THR A 820 0.272 -3.761 -7.558 1.00 25.00 C ATOM 1223 OG1 THR A 820 -0.890 -3.501 -8.357 1.00 25.00 O ATOM 1224 CG2 THR A 820 -0.150 -4.725 -6.440 1.00 25.00 C ATOM 0 H THR A 820 -1.147 -2.293 -6.222 1.00 25.00 H new ATOM 0 HA THR A 820 1.655 -2.589 -6.307 1.00 25.00 H new ATOM 0 HB THR A 820 1.071 -4.204 -8.153 1.00 25.00 H new ATOM 0 HG1 THR A 820 -1.692 -3.563 -7.798 1.00 25.00 H new ATOM 0 HG21 THR A 820 -0.520 -5.652 -6.879 1.00 25.00 H new ATOM 0 HG22 THR A 820 0.708 -4.942 -5.803 1.00 25.00 H new ATOM 0 HG23 THR A 820 -0.938 -4.267 -5.843 1.00 25.00 H new ATOM 1232 N ALA A 821 0.772 -0.324 -8.231 1.00 25.00 N ATOM 1233 CA ALA A 821 1.191 0.648 -9.246 1.00 25.00 C ATOM 1234 C ALA A 821 1.769 1.911 -8.578 1.00 25.00 C ATOM 1235 O ALA A 821 1.276 2.364 -7.553 1.00 25.00 O ATOM 1236 CB ALA A 821 -0.003 1.013 -10.138 1.00 25.00 C ATOM 0 H ALA A 821 0.041 0.021 -7.610 1.00 25.00 H new ATOM 0 HA ALA A 821 1.971 0.201 -9.862 1.00 25.00 H new ATOM 0 HB1 ALA A 821 0.313 1.735 -10.891 1.00 25.00 H new ATOM 0 HB2 ALA A 821 -0.377 0.115 -10.631 1.00 25.00 H new ATOM 0 HB3 ALA A 821 -0.794 1.448 -9.527 1.00 25.00 H new ATOM 1242 N ASP A 822 2.822 2.455 -9.172 1.00 25.00 N ATOM 1243 CA ASP A 822 3.530 3.620 -8.630 1.00 25.00 C ATOM 1244 C ASP A 822 2.676 4.897 -8.662 1.00 25.00 C ATOM 1245 O ASP A 822 1.951 5.143 -9.628 1.00 25.00 O ATOM 1246 CB ASP A 822 4.810 3.863 -9.450 1.00 25.00 C ATOM 1247 CG ASP A 822 5.610 2.581 -9.703 1.00 25.00 C ATOM 1248 OD1 ASP A 822 5.224 1.813 -10.623 1.00 25.00 O ATOM 1249 OD2 ASP A 822 6.651 2.359 -9.043 1.00 25.00 O ATOM 0 H ASP A 822 3.215 2.104 -10.046 1.00 25.00 H new ATOM 0 HA ASP A 822 3.764 3.400 -7.588 1.00 25.00 H new ATOM 0 HB2 ASP A 822 4.543 4.313 -10.406 1.00 25.00 H new ATOM 0 HB3 ASP A 822 5.440 4.581 -8.925 1.00 25.00 H new ATOM 1254 N THR A 823 2.764 5.711 -7.613 1.00 25.00 N ATOM 1255 CA THR A 823 2.015 6.974 -7.529 1.00 25.00 C ATOM 1256 C THR A 823 2.792 7.994 -6.684 1.00 25.00 C ATOM 1257 O THR A 823 3.599 7.607 -5.847 1.00 25.00 O ATOM 1258 CB THR A 823 0.620 6.751 -6.879 1.00 25.00 C ATOM 1259 OG1 THR A 823 0.108 5.475 -7.271 1.00 25.00 O ATOM 1260 CG2 THR A 823 -0.375 7.790 -7.327 1.00 25.00 C ATOM 0 H THR A 823 3.350 5.521 -6.800 1.00 25.00 H new ATOM 0 HA THR A 823 1.883 7.350 -8.544 1.00 25.00 H new ATOM 0 HB THR A 823 0.753 6.816 -5.799 1.00 25.00 H new ATOM 0 HG1 THR A 823 -0.770 5.335 -6.860 1.00 25.00 H new ATOM 0 HG21 THR A 823 -1.338 7.601 -6.852 1.00 25.00 H new ATOM 0 HG22 THR A 823 -0.019 8.781 -7.044 1.00 25.00 H new ATOM 0 HG23 THR A 823 -0.489 7.741 -8.410 1.00 25.00 H new ATOM 1268 N ASP A 824 2.533 9.284 -6.879 1.00 25.00 N ATOM 1269 CA ASP A 824 3.206 10.356 -6.126 1.00 25.00 C ATOM 1270 C ASP A 824 3.035 10.195 -4.615 1.00 25.00 C ATOM 1271 O ASP A 824 3.980 10.291 -3.839 1.00 25.00 O ATOM 1272 CB ASP A 824 2.608 11.721 -6.510 1.00 25.00 C ATOM 1273 CG ASP A 824 2.756 12.037 -7.987 1.00 25.00 C ATOM 1274 OD1 ASP A 824 2.035 11.413 -8.798 1.00 25.00 O ATOM 1275 OD2 ASP A 824 3.542 12.943 -8.332 1.00 25.00 O ATOM 0 H ASP A 824 1.853 9.623 -7.560 1.00 25.00 H new ATOM 0 HA ASP A 824 4.265 10.296 -6.377 1.00 25.00 H new ATOM 0 HB2 ASP A 824 1.551 11.736 -6.245 1.00 25.00 H new ATOM 0 HB3 ASP A 824 3.095 12.502 -5.926 1.00 25.00 H new ATOM 1280 N THR A 825 1.802 9.958 -4.206 1.00 25.00 N ATOM 1281 CA THR A 825 1.448 9.808 -2.802 1.00 25.00 C ATOM 1282 C THR A 825 1.879 8.454 -2.259 1.00 25.00 C ATOM 1283 O THR A 825 2.004 8.275 -1.046 1.00 25.00 O ATOM 1284 CB THR A 825 -0.057 9.843 -2.697 1.00 25.00 C ATOM 1285 OG1 THR A 825 -0.556 9.177 -3.853 1.00 25.00 O ATOM 1286 CG2 THR A 825 -0.594 11.240 -2.677 1.00 25.00 C ATOM 0 H THR A 825 1.010 9.863 -4.842 1.00 25.00 H new ATOM 0 HA THR A 825 1.938 10.604 -2.242 1.00 25.00 H new ATOM 0 HB THR A 825 -0.366 9.368 -1.766 1.00 25.00 H new ATOM 0 HG1 THR A 825 -1.523 9.046 -3.763 1.00 25.00 H new ATOM 0 HG21 THR A 825 -1.681 11.211 -2.601 1.00 25.00 H new ATOM 0 HG22 THR A 825 -0.184 11.775 -1.820 1.00 25.00 H new ATOM 0 HG23 THR A 825 -0.309 11.753 -3.596 1.00 25.00 H new ATOM 1294 N ALA A 826 2.073 7.493 -3.152 1.00 25.00 N ATOM 1295 CA ALA A 826 2.425 6.137 -2.756 1.00 25.00 C ATOM 1296 C ALA A 826 3.840 6.094 -2.186 1.00 25.00 C ATOM 1297 O ALA A 826 4.148 5.269 -1.348 1.00 25.00 O ATOM 1298 CB ALA A 826 2.288 5.175 -3.942 1.00 25.00 C ATOM 0 H ALA A 826 1.992 7.629 -4.160 1.00 25.00 H new ATOM 0 HA ALA A 826 1.734 5.817 -1.976 1.00 25.00 H new ATOM 0 HB1 ALA A 826 2.556 4.167 -3.626 1.00 25.00 H new ATOM 0 HB2 ALA A 826 1.258 5.182 -4.299 1.00 25.00 H new ATOM 0 HB3 ALA A 826 2.953 5.491 -4.746 1.00 25.00 H new ATOM 1304 N ASP A 827 4.674 7.036 -2.588 1.00 25.00 N ATOM 1305 CA ASP A 827 6.039 7.126 -2.058 1.00 25.00 C ATOM 1306 C ASP A 827 6.004 7.289 -0.535 1.00 25.00 C ATOM 1307 O ASP A 827 6.847 6.769 0.192 1.00 25.00 O ATOM 1308 CB ASP A 827 6.750 8.329 -2.684 1.00 25.00 C ATOM 1309 CG ASP A 827 8.203 8.438 -2.255 1.00 25.00 C ATOM 1310 OD1 ASP A 827 9.011 7.571 -2.647 1.00 25.00 O ATOM 1311 OD2 ASP A 827 8.546 9.426 -1.566 1.00 25.00 O ATOM 0 H ASP A 827 4.439 7.751 -3.277 1.00 25.00 H new ATOM 0 HA ASP A 827 6.578 6.211 -2.305 1.00 25.00 H new ATOM 0 HB2 ASP A 827 6.701 8.250 -3.770 1.00 25.00 H new ATOM 0 HB3 ASP A 827 6.224 9.242 -2.406 1.00 25.00 H new ATOM 1316 N GLN A 828 4.977 7.973 -0.051 1.00 25.00 N ATOM 1317 CA GLN A 828 4.826 8.217 1.380 1.00 25.00 C ATOM 1318 C GLN A 828 4.464 6.964 2.166 1.00 25.00 C ATOM 1319 O GLN A 828 4.876 6.812 3.311 1.00 25.00 O ATOM 1320 CB GLN A 828 3.703 9.216 1.630 1.00 25.00 C ATOM 1321 CG GLN A 828 3.758 10.485 0.795 1.00 25.00 C ATOM 1322 CD GLN A 828 2.557 11.361 1.065 1.00 25.00 C ATOM 1323 OE1 GLN A 828 2.679 12.530 1.402 1.00 25.00 O ATOM 1324 NE2 GLN A 828 1.384 10.787 0.948 1.00 25.00 N ATOM 0 H GLN A 828 4.235 8.370 -0.627 1.00 25.00 H new ATOM 0 HA GLN A 828 5.795 8.589 1.714 1.00 25.00 H new ATOM 0 HB2 GLN A 828 2.751 8.720 1.443 1.00 25.00 H new ATOM 0 HB3 GLN A 828 3.716 9.494 2.684 1.00 25.00 H new ATOM 0 HG2 GLN A 828 4.672 11.034 1.021 1.00 25.00 H new ATOM 0 HG3 GLN A 828 3.794 10.227 -0.263 1.00 25.00 H new ATOM 0 HE21 GLN A 828 1.321 9.809 0.664 1.00 25.00 H new ATOM 0 HE22 GLN A 828 0.535 11.318 1.141 1.00 25.00 H new ATOM 1333 N VAL A 829 3.630 6.102 1.595 1.00 25.00 N ATOM 1334 CA VAL A 829 3.158 4.926 2.332 1.00 25.00 C ATOM 1335 C VAL A 829 4.267 3.866 2.375 1.00 25.00 C ATOM 1336 O VAL A 829 4.431 3.161 3.375 1.00 25.00 O ATOM 1337 CB VAL A 829 1.798 4.351 1.778 1.00 25.00 C ATOM 1338 CG1 VAL A 829 1.855 4.040 0.313 1.00 25.00 C ATOM 1339 CG2 VAL A 829 1.377 3.104 2.541 1.00 25.00 C ATOM 0 H VAL A 829 3.270 6.188 0.644 1.00 25.00 H new ATOM 0 HA VAL A 829 2.933 5.238 3.352 1.00 25.00 H new ATOM 0 HB VAL A 829 1.058 5.137 1.926 1.00 25.00 H new ATOM 0 HG11 VAL A 829 0.892 3.648 -0.013 1.00 25.00 H new ATOM 0 HG12 VAL A 829 2.084 4.949 -0.243 1.00 25.00 H new ATOM 0 HG13 VAL A 829 2.631 3.297 0.129 1.00 25.00 H new ATOM 0 HG21 VAL A 829 0.436 2.730 2.137 1.00 25.00 H new ATOM 0 HG22 VAL A 829 2.146 2.338 2.439 1.00 25.00 H new ATOM 0 HG23 VAL A 829 1.247 3.349 3.595 1.00 25.00 H new ATOM 1349 N MET A 830 5.090 3.818 1.333 1.00 25.00 N ATOM 1350 CA MET A 830 6.197 2.856 1.265 1.00 25.00 C ATOM 1351 C MET A 830 7.283 3.149 2.297 1.00 25.00 C ATOM 1352 O MET A 830 8.131 2.308 2.568 1.00 25.00 O ATOM 1353 CB MET A 830 6.818 2.855 -0.131 1.00 25.00 C ATOM 1354 CG MET A 830 5.838 2.510 -1.236 1.00 25.00 C ATOM 1355 SD MET A 830 5.105 0.872 -1.057 1.00 25.00 S ATOM 1356 CE MET A 830 3.596 1.120 -2.030 1.00 25.00 C ATOM 0 H MET A 830 5.016 4.432 0.522 1.00 25.00 H new ATOM 0 HA MET A 830 5.776 1.876 1.487 1.00 25.00 H new ATOM 0 HB2 MET A 830 7.244 3.838 -0.330 1.00 25.00 H new ATOM 0 HB3 MET A 830 7.641 2.141 -0.152 1.00 25.00 H new ATOM 0 HG2 MET A 830 5.043 3.256 -1.253 1.00 25.00 H new ATOM 0 HG3 MET A 830 6.350 2.568 -2.197 1.00 25.00 H new ATOM 0 HE1 MET A 830 3.274 0.168 -2.451 1.00 25.00 H new ATOM 0 HE2 MET A 830 2.810 1.517 -1.388 1.00 25.00 H new ATOM 0 HE3 MET A 830 3.795 1.825 -2.837 1.00 25.00 H new ATOM 1366 N ALA A 831 7.188 4.300 2.952 1.00 25.00 N ATOM 1367 CA ALA A 831 8.067 4.650 4.068 1.00 25.00 C ATOM 1368 C ALA A 831 8.026 3.588 5.182 1.00 25.00 C ATOM 1369 O ALA A 831 8.902 3.566 6.051 1.00 25.00 O ATOM 1370 CB ALA A 831 7.693 6.023 4.622 1.00 25.00 C ATOM 0 H ALA A 831 6.500 5.019 2.727 1.00 25.00 H new ATOM 0 HA ALA A 831 9.088 4.685 3.689 1.00 25.00 H new ATOM 0 HB1 ALA A 831 8.354 6.273 5.452 1.00 25.00 H new ATOM 0 HB2 ALA A 831 7.797 6.772 3.837 1.00 25.00 H new ATOM 0 HB3 ALA A 831 6.661 6.005 4.973 1.00 25.00 H new ATOM 1376 N SER A 832 7.013 2.728 5.163 1.00 25.00 N ATOM 1377 CA SER A 832 6.881 1.626 6.112 1.00 25.00 C ATOM 1378 C SER A 832 8.150 0.774 6.240 1.00 25.00 C ATOM 1379 O SER A 832 8.440 0.273 7.325 1.00 25.00 O ATOM 1380 CB SER A 832 5.720 0.732 5.685 1.00 25.00 C ATOM 1381 OG SER A 832 5.981 0.162 4.416 1.00 25.00 O ATOM 0 H SER A 832 6.254 2.776 4.483 1.00 25.00 H new ATOM 0 HA SER A 832 6.700 2.073 7.090 1.00 25.00 H new ATOM 0 HB2 SER A 832 5.569 -0.057 6.422 1.00 25.00 H new ATOM 0 HB3 SER A 832 4.799 1.313 5.648 1.00 25.00 H new ATOM 0 HG SER A 832 6.270 -0.768 4.528 1.00 25.00 H new ATOM 1387 N PHE A 833 8.970 0.676 5.194 1.00 25.00 N ATOM 1388 CA PHE A 833 10.228 -0.069 5.320 1.00 25.00 C ATOM 1389 C PHE A 833 11.200 0.546 6.350 1.00 25.00 C ATOM 1390 O PHE A 833 12.038 -0.156 6.912 1.00 25.00 O ATOM 1391 CB PHE A 833 10.913 -0.311 3.958 1.00 25.00 C ATOM 1392 CG PHE A 833 11.025 0.914 3.063 1.00 25.00 C ATOM 1393 CD1 PHE A 833 11.641 2.110 3.496 1.00 25.00 C ATOM 1394 CD2 PHE A 833 10.551 0.844 1.737 1.00 25.00 C ATOM 1395 CE1 PHE A 833 11.760 3.222 2.626 1.00 25.00 C ATOM 1396 CE2 PHE A 833 10.674 1.950 0.858 1.00 25.00 C ATOM 1397 CZ PHE A 833 11.273 3.140 1.308 1.00 25.00 C ATOM 0 H PHE A 833 8.797 1.087 4.277 1.00 25.00 H new ATOM 0 HA PHE A 833 9.946 -1.046 5.713 1.00 25.00 H new ATOM 0 HB2 PHE A 833 11.914 -0.703 4.137 1.00 25.00 H new ATOM 0 HB3 PHE A 833 10.360 -1.083 3.423 1.00 25.00 H new ATOM 0 HD1 PHE A 833 12.026 2.177 4.503 1.00 25.00 H new ATOM 0 HD2 PHE A 833 10.087 -0.066 1.385 1.00 25.00 H new ATOM 0 HE1 PHE A 833 12.224 4.133 2.974 1.00 25.00 H new ATOM 0 HE2 PHE A 833 10.308 1.878 -0.156 1.00 25.00 H new ATOM 0 HZ PHE A 833 11.359 3.988 0.645 1.00 25.00 H new ATOM 1407 N LYS A 834 11.059 1.831 6.664 1.00 25.00 N ATOM 1408 CA LYS A 834 11.889 2.456 7.702 1.00 25.00 C ATOM 1409 C LYS A 834 11.350 2.027 9.056 1.00 25.00 C ATOM 1410 O LYS A 834 12.108 1.779 9.985 1.00 25.00 O ATOM 1411 CB LYS A 834 11.850 3.993 7.578 1.00 25.00 C ATOM 1412 CG LYS A 834 12.546 4.786 8.722 1.00 25.00 C ATOM 1413 CD LYS A 834 14.040 4.637 8.754 1.00 25.00 C ATOM 1414 CE LYS A 834 14.381 3.865 9.994 1.00 25.00 C ATOM 1415 NZ LYS A 834 15.799 4.003 10.457 1.00 25.00 N ATOM 0 H LYS A 834 10.387 2.458 6.223 1.00 25.00 H new ATOM 0 HA LYS A 834 12.926 2.140 7.588 1.00 25.00 H new ATOM 0 HB2 LYS A 834 12.315 4.274 6.633 1.00 25.00 H new ATOM 0 HB3 LYS A 834 10.808 4.307 7.526 1.00 25.00 H new ATOM 0 HG2 LYS A 834 12.300 5.843 8.618 1.00 25.00 H new ATOM 0 HG3 LYS A 834 12.139 4.456 9.678 1.00 25.00 H new ATOM 0 HD2 LYS A 834 14.394 4.114 7.865 1.00 25.00 H new ATOM 0 HD3 LYS A 834 14.524 5.614 8.763 1.00 25.00 H new ATOM 0 HE2 LYS A 834 13.719 4.188 10.798 1.00 25.00 H new ATOM 0 HE3 LYS A 834 14.174 2.810 9.815 1.00 25.00 H new ATOM 0 HZ1 LYS A 834 15.906 3.549 11.386 1.00 25.00 H new ATOM 0 HZ2 LYS A 834 16.434 3.545 9.772 1.00 25.00 H new ATOM 0 HZ3 LYS A 834 16.042 5.011 10.534 1.00 25.00 H new ATOM 1429 N ILE A 835 10.036 1.944 9.163 1.00 25.00 N ATOM 1430 CA ILE A 835 9.386 1.574 10.416 1.00 25.00 C ATOM 1431 C ILE A 835 9.749 0.126 10.739 1.00 25.00 C ATOM 1432 O ILE A 835 10.092 -0.188 11.877 1.00 25.00 O ATOM 1433 CB ILE A 835 7.830 1.767 10.330 1.00 25.00 C ATOM 1434 CG1 ILE A 835 7.468 3.267 10.440 1.00 25.00 C ATOM 1435 CG2 ILE A 835 7.111 0.999 11.460 1.00 25.00 C ATOM 1436 CD1 ILE A 835 7.563 4.077 9.127 1.00 25.00 C ATOM 0 H ILE A 835 9.391 2.128 8.394 1.00 25.00 H new ATOM 0 HA ILE A 835 9.737 2.226 11.216 1.00 25.00 H new ATOM 0 HB ILE A 835 7.503 1.375 9.367 1.00 25.00 H new ATOM 0 HG12 ILE A 835 6.451 3.349 10.823 1.00 25.00 H new ATOM 0 HG13 ILE A 835 8.125 3.727 11.178 1.00 25.00 H new ATOM 0 HG21 ILE A 835 6.035 1.151 11.376 1.00 25.00 H new ATOM 0 HG22 ILE A 835 7.335 -0.064 11.377 1.00 25.00 H new ATOM 0 HG23 ILE A 835 7.455 1.368 12.426 1.00 25.00 H new ATOM 0 HD11 ILE A 835 7.288 5.114 9.319 1.00 25.00 H new ATOM 0 HD12 ILE A 835 8.584 4.036 8.747 1.00 25.00 H new ATOM 0 HD13 ILE A 835 6.884 3.652 8.388 1.00 25.00 H new ATOM 1448 N LEU A 836 9.740 -0.728 9.726 1.00 25.00 N ATOM 1449 CA LEU A 836 10.127 -2.127 9.893 1.00 25.00 C ATOM 1450 C LEU A 836 11.574 -2.273 10.340 1.00 25.00 C ATOM 1451 O LEU A 836 11.874 -3.046 11.242 1.00 25.00 O ATOM 1452 CB LEU A 836 10.016 -2.852 8.566 1.00 25.00 C ATOM 1453 CG LEU A 836 8.701 -3.471 8.120 1.00 25.00 C ATOM 1454 CD1 LEU A 836 8.903 -3.868 6.667 1.00 25.00 C ATOM 1455 CD2 LEU A 836 8.347 -4.696 8.973 1.00 25.00 C ATOM 0 H LEU A 836 9.468 -0.478 8.775 1.00 25.00 H new ATOM 0 HA LEU A 836 9.461 -2.543 10.649 1.00 25.00 H new ATOM 0 HB2 LEU A 836 10.316 -2.147 7.791 1.00 25.00 H new ATOM 0 HB3 LEU A 836 10.758 -3.650 8.575 1.00 25.00 H new ATOM 0 HG LEU A 836 7.875 -2.769 8.235 1.00 25.00 H new ATOM 0 HD11 LEU A 836 7.989 -4.322 6.283 1.00 25.00 H new ATOM 0 HD12 LEU A 836 9.143 -2.983 6.078 1.00 25.00 H new ATOM 0 HD13 LEU A 836 9.721 -4.584 6.596 1.00 25.00 H new ATOM 0 HD21 LEU A 836 7.402 -5.117 8.630 1.00 25.00 H new ATOM 0 HD22 LEU A 836 9.133 -5.445 8.878 1.00 25.00 H new ATOM 0 HD23 LEU A 836 8.254 -4.398 10.017 1.00 25.00 H new ATOM 1467 N ALA A 837 12.475 -1.559 9.674 1.00 25.00 N ATOM 1468 CA ALA A 837 13.898 -1.667 9.980 1.00 25.00 C ATOM 1469 C ALA A 837 14.139 -1.151 11.409 1.00 25.00 C ATOM 1470 O ALA A 837 14.885 -1.735 12.188 1.00 25.00 O ATOM 1471 CB ALA A 837 14.735 -0.843 8.956 1.00 25.00 C ATOM 0 H ALA A 837 12.249 -0.905 8.925 1.00 25.00 H new ATOM 0 HA ALA A 837 14.210 -2.709 9.911 1.00 25.00 H new ATOM 0 HB1 ALA A 837 15.794 -0.933 9.196 1.00 25.00 H new ATOM 0 HB2 ALA A 837 14.557 -1.224 7.950 1.00 25.00 H new ATOM 0 HB3 ALA A 837 14.439 0.205 9.004 1.00 25.00 H new ATOM 1477 N GLY A 838 13.524 -0.027 11.733 1.00 25.00 N ATOM 1478 CA GLY A 838 13.731 0.588 13.031 1.00 25.00 C ATOM 1479 C GLY A 838 15.069 1.303 13.113 1.00 25.00 C ATOM 1480 O GLY A 838 15.147 2.512 12.875 1.00 25.00 O ATOM 0 H GLY A 838 12.882 0.475 11.120 1.00 25.00 H new ATOM 0 HA2 GLY A 838 12.928 1.298 13.229 1.00 25.00 H new ATOM 0 HA3 GLY A 838 13.680 -0.176 13.807 1.00 25.00 H new ATOM 1484 N ASP A 839 16.123 0.574 13.454 1.00 25.00 N ATOM 1485 CA ASP A 839 17.457 1.156 13.635 1.00 25.00 C ATOM 1486 C ASP A 839 18.479 0.657 12.617 1.00 25.00 C ATOM 1487 O ASP A 839 19.524 1.282 12.423 1.00 25.00 O ATOM 1488 CB ASP A 839 17.976 0.840 15.045 1.00 25.00 C ATOM 1489 CG ASP A 839 18.374 -0.625 15.212 1.00 25.00 C ATOM 1490 OD1 ASP A 839 17.604 -1.516 14.786 1.00 25.00 O ATOM 1491 OD2 ASP A 839 19.455 -0.883 15.780 1.00 25.00 O ATOM 0 H ASP A 839 16.084 -0.433 13.614 1.00 25.00 H new ATOM 0 HA ASP A 839 17.344 2.230 13.487 1.00 25.00 H new ATOM 0 HB2 ASP A 839 18.837 1.473 15.261 1.00 25.00 H new ATOM 0 HB3 ASP A 839 17.206 1.089 15.775 1.00 25.00 H new ATOM 1496 N LYS A 840 18.207 -0.479 11.991 1.00 25.00 N ATOM 1497 CA LYS A 840 19.176 -1.106 11.103 1.00 25.00 C ATOM 1498 C LYS A 840 19.260 -0.345 9.787 1.00 25.00 C ATOM 1499 O LYS A 840 18.322 0.343 9.383 1.00 25.00 O ATOM 1500 CB LYS A 840 18.810 -2.579 10.903 1.00 25.00 C ATOM 1501 CG LYS A 840 17.393 -2.795 10.441 1.00 25.00 C ATOM 1502 CD LYS A 840 16.890 -4.199 10.709 1.00 25.00 C ATOM 1503 CE LYS A 840 17.425 -5.219 9.724 1.00 25.00 C ATOM 1504 NZ LYS A 840 16.835 -6.553 10.027 1.00 25.00 N ATOM 0 H LYS A 840 17.326 -0.985 12.081 1.00 25.00 H new ATOM 0 HA LYS A 840 20.168 -1.069 11.553 1.00 25.00 H new ATOM 0 HB2 LYS A 840 19.491 -3.017 10.174 1.00 25.00 H new ATOM 0 HB3 LYS A 840 18.962 -3.112 11.841 1.00 25.00 H new ATOM 0 HG2 LYS A 840 16.741 -2.080 10.942 1.00 25.00 H new ATOM 0 HG3 LYS A 840 17.330 -2.590 9.372 1.00 25.00 H new ATOM 0 HD2 LYS A 840 17.174 -4.494 11.719 1.00 25.00 H new ATOM 0 HD3 LYS A 840 15.801 -4.202 10.671 1.00 25.00 H new ATOM 0 HE2 LYS A 840 17.177 -4.922 8.705 1.00 25.00 H new ATOM 0 HE3 LYS A 840 18.512 -5.267 9.787 1.00 25.00 H new ATOM 0 HZ1 LYS A 840 17.597 -7.231 10.233 1.00 25.00 H new ATOM 0 HZ2 LYS A 840 16.208 -6.476 10.853 1.00 25.00 H new ATOM 0 HZ3 LYS A 840 16.288 -6.885 9.207 1.00 25.00 H new ATOM 1518 N ASN A 841 20.407 -0.448 9.138 1.00 25.00 N ATOM 1519 CA ASN A 841 20.683 0.296 7.908 1.00 25.00 C ATOM 1520 C ASN A 841 20.232 -0.429 6.646 1.00 25.00 C ATOM 1521 O ASN A 841 20.466 0.052 5.551 1.00 25.00 O ATOM 1522 CB ASN A 841 22.188 0.537 7.783 1.00 25.00 C ATOM 1523 CG ASN A 841 22.933 -0.703 7.524 1.00 25.00 C ATOM 1524 OD1 ASN A 841 22.973 -1.635 8.314 1.00 25.00 O ATOM 1525 ND2 ASN A 841 23.511 -0.730 6.388 1.00 25.00 N ATOM 0 H ASN A 841 21.175 -1.046 9.443 1.00 25.00 H new ATOM 0 HA ASN A 841 20.121 1.226 7.986 1.00 25.00 H new ATOM 0 HB2 ASN A 841 22.374 1.245 6.976 1.00 25.00 H new ATOM 0 HB3 ASN A 841 22.558 0.995 8.700 1.00 25.00 H new ATOM 0 HD21 ASN A 841 24.037 -1.556 6.103 1.00 25.00 H new ATOM 0 HD22 ASN A 841 23.447 0.075 5.764 1.00 25.00 H new ATOM 1532 N TYR A 842 19.626 -1.593 6.793 1.00 25.00 N ATOM 1533 CA TYR A 842 19.179 -2.368 5.638 1.00 25.00 C ATOM 1534 C TYR A 842 17.936 -3.092 6.091 1.00 25.00 C ATOM 1535 O TYR A 842 17.746 -3.254 7.277 1.00 25.00 O ATOM 1536 CB TYR A 842 20.253 -3.375 5.194 1.00 25.00 C ATOM 1537 CG TYR A 842 20.381 -4.580 6.110 1.00 25.00 C ATOM 1538 CD1 TYR A 842 21.211 -4.543 7.247 1.00 25.00 C ATOM 1539 CD2 TYR A 842 19.670 -5.771 5.840 1.00 25.00 C ATOM 1540 CE1 TYR A 842 21.319 -5.672 8.107 1.00 25.00 C ATOM 1541 CE2 TYR A 842 19.784 -6.897 6.684 1.00 25.00 C ATOM 1542 CZ TYR A 842 20.601 -6.838 7.812 1.00 25.00 C ATOM 1543 OH TYR A 842 20.699 -7.932 8.634 1.00 25.00 O ATOM 0 H TYR A 842 19.430 -2.026 7.696 1.00 25.00 H new ATOM 0 HA TYR A 842 18.987 -1.722 4.781 1.00 25.00 H new ATOM 0 HB2 TYR A 842 20.020 -3.720 4.186 1.00 25.00 H new ATOM 0 HB3 TYR A 842 21.215 -2.866 5.142 1.00 25.00 H new ATOM 0 HD1 TYR A 842 21.772 -3.647 7.469 1.00 25.00 H new ATOM 0 HD2 TYR A 842 19.028 -5.821 4.973 1.00 25.00 H new ATOM 0 HE1 TYR A 842 21.951 -5.630 8.982 1.00 25.00 H new ATOM 0 HE2 TYR A 842 19.240 -7.802 6.456 1.00 25.00 H new ATOM 0 HH TYR A 842 20.136 -8.655 8.285 1.00 25.00 H new ATOM 1553 N ILE A 843 17.106 -3.540 5.171 1.00 25.00 N ATOM 1554 CA ILE A 843 15.935 -4.331 5.500 1.00 25.00 C ATOM 1555 C ILE A 843 16.181 -5.724 4.974 1.00 25.00 C ATOM 1556 O ILE A 843 16.876 -5.910 3.977 1.00 25.00 O ATOM 1557 CB ILE A 843 14.639 -3.721 4.869 1.00 25.00 C ATOM 1558 CG1 ILE A 843 13.395 -4.167 5.646 1.00 25.00 C ATOM 1559 CG2 ILE A 843 14.503 -4.037 3.377 1.00 25.00 C ATOM 1560 CD1 ILE A 843 13.251 -3.376 6.873 1.00 25.00 C ATOM 0 H ILE A 843 17.223 -3.366 4.173 1.00 25.00 H new ATOM 0 HA ILE A 843 15.778 -4.344 6.579 1.00 25.00 H new ATOM 0 HB ILE A 843 14.727 -2.637 4.948 1.00 25.00 H new ATOM 0 HG12 ILE A 843 12.508 -4.050 5.024 1.00 25.00 H new ATOM 0 HG13 ILE A 843 13.473 -5.225 5.894 1.00 25.00 H new ATOM 0 HG21 ILE A 843 13.587 -3.589 2.992 1.00 25.00 H new ATOM 0 HG22 ILE A 843 15.359 -3.630 2.839 1.00 25.00 H new ATOM 0 HG23 ILE A 843 14.466 -5.117 3.236 1.00 25.00 H new ATOM 0 HD11 ILE A 843 12.364 -3.703 7.415 1.00 25.00 H new ATOM 0 HD12 ILE A 843 14.131 -3.515 7.501 1.00 25.00 H new ATOM 0 HD13 ILE A 843 13.151 -2.321 6.616 1.00 25.00 H new ATOM 1572 N THR A 844 15.619 -6.716 5.623 1.00 25.00 N ATOM 1573 CA THR A 844 15.671 -8.054 5.070 1.00 25.00 C ATOM 1574 C THR A 844 14.456 -8.184 4.170 1.00 25.00 C ATOM 1575 O THR A 844 13.417 -7.582 4.434 1.00 25.00 O ATOM 1576 CB THR A 844 15.647 -9.158 6.141 1.00 25.00 C ATOM 1577 OG1 THR A 844 14.438 -9.076 6.892 1.00 25.00 O ATOM 1578 CG2 THR A 844 16.814 -9.040 7.096 1.00 25.00 C ATOM 0 H THR A 844 15.130 -6.630 6.514 1.00 25.00 H new ATOM 0 HA THR A 844 16.611 -8.187 4.535 1.00 25.00 H new ATOM 0 HB THR A 844 15.715 -10.115 5.623 1.00 25.00 H new ATOM 0 HG1 THR A 844 14.393 -8.209 7.346 1.00 25.00 H new ATOM 0 HG21 THR A 844 16.760 -9.838 7.837 1.00 25.00 H new ATOM 0 HG22 THR A 844 17.748 -9.123 6.541 1.00 25.00 H new ATOM 0 HG23 THR A 844 16.776 -8.074 7.600 1.00 25.00 H new ATOM 1586 N MET A 845 14.563 -8.995 3.129 1.00 25.00 N ATOM 1587 CA MET A 845 13.428 -9.273 2.259 1.00 25.00 C ATOM 1588 C MET A 845 12.261 -9.803 3.075 1.00 25.00 C ATOM 1589 O MET A 845 11.114 -9.557 2.753 1.00 25.00 O ATOM 1590 CB MET A 845 13.814 -10.330 1.225 1.00 25.00 C ATOM 1591 CG MET A 845 14.911 -9.879 0.307 1.00 25.00 C ATOM 1592 SD MET A 845 15.321 -11.087 -0.942 1.00 25.00 S ATOM 1593 CE MET A 845 16.656 -10.217 -1.743 1.00 25.00 C ATOM 0 H MET A 845 15.424 -9.473 2.865 1.00 25.00 H new ATOM 0 HA MET A 845 13.141 -8.347 1.760 1.00 25.00 H new ATOM 0 HB2 MET A 845 14.129 -11.237 1.741 1.00 25.00 H new ATOM 0 HB3 MET A 845 12.936 -10.589 0.633 1.00 25.00 H new ATOM 0 HG2 MET A 845 14.611 -8.950 -0.179 1.00 25.00 H new ATOM 0 HG3 MET A 845 15.801 -9.658 0.896 1.00 25.00 H new ATOM 0 HE1 MET A 845 17.309 -10.933 -2.243 1.00 25.00 H new ATOM 0 HE2 MET A 845 16.249 -9.523 -2.478 1.00 25.00 H new ATOM 0 HE3 MET A 845 17.228 -9.663 -0.998 1.00 25.00 H new ATOM 1603 N ASP A 846 12.564 -10.542 4.131 1.00 25.00 N ATOM 1604 CA ASP A 846 11.522 -11.166 4.938 1.00 25.00 C ATOM 1605 C ASP A 846 10.790 -10.169 5.837 1.00 25.00 C ATOM 1606 O ASP A 846 9.656 -10.408 6.215 1.00 25.00 O ATOM 1607 CB ASP A 846 12.094 -12.317 5.767 1.00 25.00 C ATOM 1608 CG ASP A 846 11.227 -13.579 5.693 1.00 25.00 C ATOM 1609 OD1 ASP A 846 10.696 -13.890 4.593 1.00 25.00 O ATOM 1610 OD2 ASP A 846 11.143 -14.305 6.703 1.00 25.00 O ATOM 0 H ASP A 846 13.516 -10.725 4.449 1.00 25.00 H new ATOM 0 HA ASP A 846 10.784 -11.562 4.240 1.00 25.00 H new ATOM 0 HB2 ASP A 846 13.099 -12.549 5.416 1.00 25.00 H new ATOM 0 HB3 ASP A 846 12.184 -12.002 6.807 1.00 25.00 H new ATOM 1615 N GLU A 847 11.406 -9.028 6.130 1.00 25.00 N ATOM 1616 CA GLU A 847 10.722 -7.979 6.896 1.00 25.00 C ATOM 1617 C GLU A 847 9.673 -7.333 6.003 1.00 25.00 C ATOM 1618 O GLU A 847 8.543 -7.094 6.426 1.00 25.00 O ATOM 1619 CB GLU A 847 11.711 -6.926 7.434 1.00 25.00 C ATOM 1620 CG GLU A 847 12.319 -7.365 8.775 1.00 25.00 C ATOM 1621 CD GLU A 847 13.686 -6.755 9.077 1.00 25.00 C ATOM 1622 OE1 GLU A 847 14.497 -6.582 8.142 1.00 25.00 O ATOM 1623 OE2 GLU A 847 14.021 -6.606 10.267 1.00 25.00 O ATOM 0 H GLU A 847 12.362 -8.803 5.856 1.00 25.00 H new ATOM 0 HA GLU A 847 10.243 -8.429 7.766 1.00 25.00 H new ATOM 0 HB2 GLU A 847 12.507 -6.766 6.706 1.00 25.00 H new ATOM 0 HB3 GLU A 847 11.198 -5.973 7.560 1.00 25.00 H new ATOM 0 HG2 GLU A 847 11.630 -7.099 9.577 1.00 25.00 H new ATOM 0 HG3 GLU A 847 12.410 -8.451 8.781 1.00 25.00 H new ATOM 1630 N LEU A 848 10.019 -7.129 4.741 1.00 25.00 N ATOM 1631 CA LEU A 848 9.059 -6.596 3.775 1.00 25.00 C ATOM 1632 C LEU A 848 7.944 -7.612 3.605 1.00 25.00 C ATOM 1633 O LEU A 848 6.782 -7.273 3.543 1.00 25.00 O ATOM 1634 CB LEU A 848 9.729 -6.355 2.419 1.00 25.00 C ATOM 1635 CG LEU A 848 10.874 -5.335 2.405 1.00 25.00 C ATOM 1636 CD1 LEU A 848 11.609 -5.439 1.080 1.00 25.00 C ATOM 1637 CD2 LEU A 848 10.361 -3.914 2.611 1.00 25.00 C ATOM 0 H LEU A 848 10.946 -7.321 4.361 1.00 25.00 H new ATOM 0 HA LEU A 848 8.669 -5.646 4.140 1.00 25.00 H new ATOM 0 HB2 LEU A 848 10.113 -7.307 2.052 1.00 25.00 H new ATOM 0 HB3 LEU A 848 8.967 -6.025 1.713 1.00 25.00 H new ATOM 0 HG LEU A 848 11.552 -5.559 3.229 1.00 25.00 H new ATOM 0 HD11 LEU A 848 12.426 -4.717 1.059 1.00 25.00 H new ATOM 0 HD12 LEU A 848 12.011 -6.446 0.965 1.00 25.00 H new ATOM 0 HD13 LEU A 848 10.918 -5.229 0.263 1.00 25.00 H new ATOM 0 HD21 LEU A 848 11.200 -3.218 2.595 1.00 25.00 H new ATOM 0 HD22 LEU A 848 9.664 -3.660 1.813 1.00 25.00 H new ATOM 0 HD23 LEU A 848 9.852 -3.847 3.572 1.00 25.00 H new ATOM 1649 N ARG A 849 8.314 -8.880 3.592 1.00 25.00 N ATOM 1650 CA ARG A 849 7.370 -9.988 3.422 1.00 25.00 C ATOM 1651 C ARG A 849 6.667 -10.325 4.732 1.00 25.00 C ATOM 1652 O ARG A 849 6.288 -11.477 4.957 1.00 25.00 O ATOM 1653 CB ARG A 849 8.123 -11.234 2.942 1.00 25.00 C ATOM 1654 CG ARG A 849 8.627 -11.169 1.506 1.00 25.00 C ATOM 1655 CD ARG A 849 9.742 -12.198 1.260 1.00 25.00 C ATOM 1656 NE ARG A 849 9.560 -13.420 2.064 1.00 25.00 N ATOM 1657 CZ ARG A 849 8.812 -14.462 1.740 1.00 25.00 C ATOM 1658 NH1 ARG A 849 8.139 -14.531 0.615 1.00 25.00 N ATOM 1659 NH2 ARG A 849 8.743 -15.453 2.581 1.00 25.00 N ATOM 0 H ARG A 849 9.283 -9.180 3.699 1.00 25.00 H new ATOM 0 HA ARG A 849 6.624 -9.681 2.689 1.00 25.00 H new ATOM 0 HB2 ARG A 849 8.974 -11.403 3.602 1.00 25.00 H new ATOM 0 HB3 ARG A 849 7.466 -12.098 3.042 1.00 25.00 H new ATOM 0 HG2 ARG A 849 7.801 -11.353 0.819 1.00 25.00 H new ATOM 0 HG3 ARG A 849 9.000 -10.167 1.294 1.00 25.00 H new ATOM 0 HD2 ARG A 849 9.764 -12.461 0.202 1.00 25.00 H new ATOM 0 HD3 ARG A 849 10.707 -11.749 1.497 1.00 25.00 H new ATOM 0 HE ARG A 849 10.057 -13.467 2.953 1.00 25.00 H new ATOM 0 HH11 ARG A 849 8.180 -13.760 -0.052 1.00 25.00 H new ATOM 0 HH12 ARG A 849 7.575 -15.355 0.408 1.00 25.00 H new ATOM 0 HH21 ARG A 849 9.257 -15.412 3.461 1.00 25.00 H new ATOM 0 HH22 ARG A 849 8.175 -16.271 2.360 1.00 25.00 H new ATOM 1673 N ARG A 850 6.505 -9.351 5.615 1.00 25.00 N ATOM 1674 CA ARG A 850 5.874 -9.625 6.903 1.00 25.00 C ATOM 1675 C ARG A 850 4.749 -8.670 7.046 1.00 25.00 C ATOM 1676 O ARG A 850 3.665 -9.013 7.506 1.00 25.00 O ATOM 1677 CB ARG A 850 6.867 -9.470 8.059 1.00 25.00 C ATOM 1678 CG ARG A 850 6.283 -9.790 9.444 1.00 25.00 C ATOM 1679 CD ARG A 850 5.686 -11.198 9.491 1.00 25.00 C ATOM 1680 NE ARG A 850 4.260 -11.198 9.109 1.00 25.00 N ATOM 1681 CZ ARG A 850 3.510 -12.268 8.886 1.00 25.00 C ATOM 1682 NH1 ARG A 850 3.960 -13.488 9.045 1.00 25.00 N ATOM 1683 NH2 ARG A 850 2.281 -12.098 8.482 1.00 25.00 N ATOM 0 H ARG A 850 6.794 -8.383 5.472 1.00 25.00 H new ATOM 0 HA ARG A 850 5.519 -10.655 6.937 1.00 25.00 H new ATOM 0 HB2 ARG A 850 7.721 -10.123 7.878 1.00 25.00 H new ATOM 0 HB3 ARG A 850 7.243 -8.447 8.064 1.00 25.00 H new ATOM 0 HG2 ARG A 850 7.064 -9.700 10.199 1.00 25.00 H new ATOM 0 HG3 ARG A 850 5.514 -9.059 9.693 1.00 25.00 H new ATOM 0 HD2 ARG A 850 6.243 -11.852 8.820 1.00 25.00 H new ATOM 0 HD3 ARG A 850 5.794 -11.606 10.496 1.00 25.00 H new ATOM 0 HE ARG A 850 3.809 -10.289 9.007 1.00 25.00 H new ATOM 0 HH11 ARG A 850 4.921 -13.641 9.351 1.00 25.00 H new ATOM 0 HH12 ARG A 850 3.350 -14.285 8.863 1.00 25.00 H new ATOM 0 HH21 ARG A 850 1.915 -11.156 8.344 1.00 25.00 H new ATOM 0 HH22 ARG A 850 1.686 -12.907 8.304 1.00 25.00 H new ATOM 1697 N GLU A 851 5.008 -7.466 6.601 1.00 25.00 N ATOM 1698 CA GLU A 851 3.964 -6.460 6.575 1.00 25.00 C ATOM 1699 C GLU A 851 3.272 -6.574 5.213 1.00 25.00 C ATOM 1700 O GLU A 851 2.100 -6.244 5.075 1.00 25.00 O ATOM 1701 CB GLU A 851 4.537 -5.068 6.837 1.00 25.00 C ATOM 1702 CG GLU A 851 5.337 -4.509 5.696 1.00 25.00 C ATOM 1703 CD GLU A 851 5.740 -3.053 5.911 1.00 25.00 C ATOM 1704 OE1 GLU A 851 5.479 -2.511 7.008 1.00 25.00 O ATOM 1705 OE2 GLU A 851 6.340 -2.457 4.990 1.00 25.00 O ATOM 0 H GLU A 851 5.917 -7.157 6.256 1.00 25.00 H new ATOM 0 HA GLU A 851 3.234 -6.622 7.368 1.00 25.00 H new ATOM 0 HB2 GLU A 851 3.717 -4.386 7.060 1.00 25.00 H new ATOM 0 HB3 GLU A 851 5.169 -5.108 7.724 1.00 25.00 H new ATOM 0 HG2 GLU A 851 6.234 -5.112 5.558 1.00 25.00 H new ATOM 0 HG3 GLU A 851 4.755 -4.588 4.778 1.00 25.00 H new ATOM 1712 N LEU A 852 3.999 -7.112 4.233 1.00 25.00 N ATOM 1713 CA LEU A 852 3.471 -7.343 2.892 1.00 25.00 C ATOM 1714 C LEU A 852 3.572 -8.829 2.498 1.00 25.00 C ATOM 1715 O LEU A 852 4.425 -9.221 1.710 1.00 25.00 O ATOM 1716 CB LEU A 852 4.207 -6.497 1.817 1.00 25.00 C ATOM 1717 CG LEU A 852 4.663 -5.090 2.213 1.00 25.00 C ATOM 1718 CD1 LEU A 852 5.637 -4.493 1.257 1.00 25.00 C ATOM 1719 CD2 LEU A 852 3.502 -4.137 2.472 1.00 25.00 C ATOM 0 H LEU A 852 4.971 -7.399 4.349 1.00 25.00 H new ATOM 0 HA LEU A 852 2.425 -7.039 2.926 1.00 25.00 H new ATOM 0 HB2 LEU A 852 5.085 -7.056 1.493 1.00 25.00 H new ATOM 0 HB3 LEU A 852 3.549 -6.406 0.952 1.00 25.00 H new ATOM 0 HG LEU A 852 5.188 -5.229 3.158 1.00 25.00 H new ATOM 0 HD11 LEU A 852 5.918 -3.497 1.598 1.00 25.00 H new ATOM 0 HD12 LEU A 852 6.526 -5.122 1.203 1.00 25.00 H new ATOM 0 HD13 LEU A 852 5.181 -4.423 0.269 1.00 25.00 H new ATOM 0 HD21 LEU A 852 3.891 -3.157 2.748 1.00 25.00 H new ATOM 0 HD22 LEU A 852 2.897 -4.046 1.570 1.00 25.00 H new ATOM 0 HD23 LEU A 852 2.887 -4.525 3.284 1.00 25.00 H new ATOM 1731 N PRO A 853 2.629 -9.665 2.951 1.00 25.00 N ATOM 1732 CA PRO A 853 2.573 -10.970 2.267 1.00 25.00 C ATOM 1733 C PRO A 853 2.336 -11.003 0.702 1.00 25.00 C ATOM 1734 O PRO A 853 2.649 -12.015 0.074 1.00 25.00 O ATOM 1735 CB PRO A 853 1.408 -11.672 2.982 1.00 25.00 C ATOM 1736 CG PRO A 853 1.256 -10.933 4.289 1.00 25.00 C ATOM 1737 CD PRO A 853 1.546 -9.521 3.942 1.00 25.00 C ATOM 0 HA PRO A 853 3.558 -11.431 2.334 1.00 25.00 H new ATOM 0 HB2 PRO A 853 0.494 -11.622 2.391 1.00 25.00 H new ATOM 0 HB3 PRO A 853 1.624 -12.728 3.147 1.00 25.00 H new ATOM 0 HG2 PRO A 853 0.251 -11.045 4.696 1.00 25.00 H new ATOM 0 HG3 PRO A 853 1.949 -11.309 5.042 1.00 25.00 H new ATOM 0 HD2 PRO A 853 0.675 -9.016 3.524 1.00 25.00 H new ATOM 0 HD3 PRO A 853 1.862 -8.944 4.811 1.00 25.00 H new ATOM 1745 N PRO A 854 1.721 -9.957 0.071 1.00 25.00 N ATOM 1746 CA PRO A 854 1.424 -10.028 -1.366 1.00 25.00 C ATOM 1747 C PRO A 854 2.545 -9.633 -2.337 1.00 25.00 C ATOM 1748 O PRO A 854 3.695 -9.444 -1.959 1.00 25.00 O ATOM 1749 CB PRO A 854 0.309 -8.993 -1.481 1.00 25.00 C ATOM 1750 CG PRO A 854 0.680 -8.008 -0.608 1.00 25.00 C ATOM 1751 CD PRO A 854 1.170 -8.689 0.581 1.00 25.00 C ATOM 0 HA PRO A 854 1.213 -11.059 -1.649 1.00 25.00 H new ATOM 0 HB2 PRO A 854 0.221 -8.612 -2.499 1.00 25.00 H new ATOM 0 HB3 PRO A 854 -0.659 -9.418 -1.215 1.00 25.00 H new ATOM 0 HG2 PRO A 854 1.454 -7.374 -1.041 1.00 25.00 H new ATOM 0 HG3 PRO A 854 -0.164 -7.362 -0.367 1.00 25.00 H new ATOM 0 HD2 PRO A 854 1.932 -8.100 1.091 1.00 25.00 H new ATOM 0 HD3 PRO A 854 0.368 -8.863 1.299 1.00 25.00 H new ATOM 1759 N ASP A 855 2.136 -9.416 -3.585 1.00 25.00 N ATOM 1760 CA ASP A 855 2.983 -8.901 -4.666 1.00 25.00 C ATOM 1761 C ASP A 855 3.741 -7.629 -4.305 1.00 25.00 C ATOM 1762 O ASP A 855 4.833 -7.389 -4.792 1.00 25.00 O ATOM 1763 CB ASP A 855 2.095 -8.579 -5.861 1.00 25.00 C ATOM 1764 CG ASP A 855 2.886 -8.259 -7.106 1.00 25.00 C ATOM 1765 OD1 ASP A 855 3.354 -9.217 -7.755 1.00 25.00 O ATOM 1766 OD2 ASP A 855 2.974 -7.083 -7.489 1.00 25.00 O ATOM 0 H ASP A 855 1.178 -9.598 -3.884 1.00 25.00 H new ATOM 0 HA ASP A 855 3.721 -9.675 -4.877 1.00 25.00 H new ATOM 0 HB2 ASP A 855 1.439 -9.427 -6.060 1.00 25.00 H new ATOM 0 HB3 ASP A 855 1.455 -7.732 -5.615 1.00 25.00 H new ATOM 1771 N GLN A 856 3.175 -6.824 -3.424 1.00 25.00 N ATOM 1772 CA GLN A 856 3.841 -5.606 -3.003 1.00 25.00 C ATOM 1773 C GLN A 856 5.228 -5.888 -2.402 1.00 25.00 C ATOM 1774 O GLN A 856 6.149 -5.099 -2.583 1.00 25.00 O ATOM 1775 CB GLN A 856 2.970 -4.831 -2.017 1.00 25.00 C ATOM 1776 CG GLN A 856 1.820 -4.054 -2.691 1.00 25.00 C ATOM 1777 CD GLN A 856 0.482 -4.782 -2.683 1.00 25.00 C ATOM 1778 OE1 GLN A 856 0.409 -5.984 -2.914 1.00 25.00 O ATOM 1779 NE2 GLN A 856 -0.581 -4.062 -2.417 1.00 25.00 N ATOM 0 H GLN A 856 2.266 -6.989 -2.991 1.00 25.00 H new ATOM 0 HA GLN A 856 3.993 -4.993 -3.891 1.00 25.00 H new ATOM 0 HB2 GLN A 856 2.551 -5.527 -1.290 1.00 25.00 H new ATOM 0 HB3 GLN A 856 3.596 -4.131 -1.464 1.00 25.00 H new ATOM 0 HG2 GLN A 856 1.701 -3.095 -2.187 1.00 25.00 H new ATOM 0 HG3 GLN A 856 2.098 -3.840 -3.723 1.00 25.00 H new ATOM 0 HE21 GLN A 856 -0.487 -3.064 -2.229 1.00 25.00 H new ATOM 0 HE22 GLN A 856 -1.502 -4.500 -2.398 1.00 25.00 H new ATOM 1788 N ALA A 857 5.418 -7.032 -1.757 1.00 25.00 N ATOM 1789 CA ALA A 857 6.743 -7.367 -1.239 1.00 25.00 C ATOM 1790 C ALA A 857 7.742 -7.574 -2.376 1.00 25.00 C ATOM 1791 O ALA A 857 8.849 -7.066 -2.315 1.00 25.00 O ATOM 1792 CB ALA A 857 6.690 -8.614 -0.364 1.00 25.00 C ATOM 0 H ALA A 857 4.694 -7.729 -1.582 1.00 25.00 H new ATOM 0 HA ALA A 857 7.076 -6.527 -0.630 1.00 25.00 H new ATOM 0 HB1 ALA A 857 7.689 -8.840 0.008 1.00 25.00 H new ATOM 0 HB2 ALA A 857 6.020 -8.439 0.478 1.00 25.00 H new ATOM 0 HB3 ALA A 857 6.322 -9.455 -0.951 1.00 25.00 H new ATOM 1798 N GLU A 858 7.376 -8.332 -3.401 1.00 25.00 N ATOM 1799 CA GLU A 858 8.319 -8.604 -4.491 1.00 25.00 C ATOM 1800 C GLU A 858 8.581 -7.358 -5.308 1.00 25.00 C ATOM 1801 O GLU A 858 9.700 -7.115 -5.735 1.00 25.00 O ATOM 1802 CB GLU A 858 7.858 -9.749 -5.394 1.00 25.00 C ATOM 1803 CG GLU A 858 6.447 -9.679 -5.934 1.00 25.00 C ATOM 1804 CD GLU A 858 6.099 -10.860 -6.833 1.00 25.00 C ATOM 1805 OE1 GLU A 858 6.802 -11.067 -7.850 1.00 25.00 O ATOM 1806 OE2 GLU A 858 5.083 -11.555 -6.572 1.00 25.00 O ATOM 0 H GLU A 858 6.457 -8.763 -3.506 1.00 25.00 H new ATOM 0 HA GLU A 858 9.252 -8.919 -4.023 1.00 25.00 H new ATOM 0 HB2 GLU A 858 8.541 -9.807 -6.241 1.00 25.00 H new ATOM 0 HB3 GLU A 858 7.961 -10.680 -4.837 1.00 25.00 H new ATOM 0 HG2 GLU A 858 5.745 -9.644 -5.101 1.00 25.00 H new ATOM 0 HG3 GLU A 858 6.323 -8.753 -6.495 1.00 25.00 H new ATOM 1813 N TYR A 859 7.558 -6.537 -5.447 1.00 25.00 N ATOM 1814 CA TYR A 859 7.696 -5.225 -6.097 1.00 25.00 C ATOM 1815 C TYR A 859 8.768 -4.410 -5.373 1.00 25.00 C ATOM 1816 O TYR A 859 9.709 -3.914 -6.000 1.00 25.00 O ATOM 1817 CB TYR A 859 6.349 -4.466 -6.112 1.00 25.00 C ATOM 1818 CG TYR A 859 6.400 -3.015 -5.610 1.00 25.00 C ATOM 1819 CD1 TYR A 859 7.145 -2.027 -6.287 1.00 25.00 C ATOM 1820 CD2 TYR A 859 5.705 -2.631 -4.446 1.00 25.00 C ATOM 1821 CE1 TYR A 859 7.183 -0.687 -5.813 1.00 25.00 C ATOM 1822 CE2 TYR A 859 5.742 -1.298 -3.979 1.00 25.00 C ATOM 1823 CZ TYR A 859 6.479 -0.340 -4.666 1.00 25.00 C ATOM 1824 OH TYR A 859 6.526 0.948 -4.205 1.00 25.00 O ATOM 0 H TYR A 859 6.614 -6.746 -5.121 1.00 25.00 H new ATOM 0 HA TYR A 859 7.998 -5.376 -7.133 1.00 25.00 H new ATOM 0 HB2 TYR A 859 5.964 -4.466 -7.132 1.00 25.00 H new ATOM 0 HB3 TYR A 859 5.634 -5.018 -5.502 1.00 25.00 H new ATOM 0 HD1 TYR A 859 7.694 -2.292 -7.178 1.00 25.00 H new ATOM 0 HD2 TYR A 859 5.134 -3.368 -3.901 1.00 25.00 H new ATOM 0 HE1 TYR A 859 7.757 0.059 -6.343 1.00 25.00 H new ATOM 0 HE2 TYR A 859 5.197 -1.023 -3.088 1.00 25.00 H new ATOM 0 HH TYR A 859 5.891 1.054 -3.466 1.00 25.00 H new ATOM 1834 N CYS A 860 8.647 -4.309 -4.058 1.00 25.00 N ATOM 1835 CA CYS A 860 9.596 -3.552 -3.258 1.00 25.00 C ATOM 1836 C CYS A 860 10.982 -4.166 -3.360 1.00 25.00 C ATOM 1837 O CYS A 860 11.951 -3.458 -3.563 1.00 25.00 O ATOM 1838 CB CYS A 860 9.160 -3.529 -1.790 1.00 25.00 C ATOM 1839 SG CYS A 860 7.664 -2.580 -1.468 1.00 25.00 S ATOM 0 H CYS A 860 7.897 -4.744 -3.521 1.00 25.00 H new ATOM 0 HA CYS A 860 9.624 -2.532 -3.641 1.00 25.00 H new ATOM 0 HB2 CYS A 860 9.003 -4.554 -1.455 1.00 25.00 H new ATOM 0 HB3 CYS A 860 9.972 -3.118 -1.190 1.00 25.00 H new ATOM 0 HG CYS A 860 7.031 -2.376 -2.585 1.00 25.00 H new ATOM 1845 N ILE A 861 11.063 -5.485 -3.246 1.00 25.00 N ATOM 1846 CA ILE A 861 12.343 -6.202 -3.276 1.00 25.00 C ATOM 1847 C ILE A 861 13.062 -5.951 -4.594 1.00 25.00 C ATOM 1848 O ILE A 861 14.272 -5.744 -4.619 1.00 25.00 O ATOM 1849 CB ILE A 861 12.109 -7.743 -3.067 1.00 25.00 C ATOM 1850 CG1 ILE A 861 11.807 -8.016 -1.579 1.00 25.00 C ATOM 1851 CG2 ILE A 861 13.326 -8.587 -3.551 1.00 25.00 C ATOM 1852 CD1 ILE A 861 11.185 -9.386 -1.287 1.00 25.00 C ATOM 0 H ILE A 861 10.251 -6.091 -3.130 1.00 25.00 H new ATOM 0 HA ILE A 861 12.968 -5.830 -2.464 1.00 25.00 H new ATOM 0 HB ILE A 861 11.255 -8.047 -3.673 1.00 25.00 H new ATOM 0 HG12 ILE A 861 12.734 -7.926 -1.013 1.00 25.00 H new ATOM 0 HG13 ILE A 861 11.133 -7.242 -1.212 1.00 25.00 H new ATOM 0 HG21 ILE A 861 13.122 -9.645 -3.388 1.00 25.00 H new ATOM 0 HG22 ILE A 861 13.493 -8.409 -4.613 1.00 25.00 H new ATOM 0 HG23 ILE A 861 14.215 -8.298 -2.990 1.00 25.00 H new ATOM 0 HD11 ILE A 861 11.009 -9.485 -0.216 1.00 25.00 H new ATOM 0 HD12 ILE A 861 10.238 -9.477 -1.820 1.00 25.00 H new ATOM 0 HD13 ILE A 861 11.864 -10.172 -1.617 1.00 25.00 H new ATOM 1864 N ALA A 862 12.309 -5.946 -5.680 1.00 25.00 N ATOM 1865 CA ALA A 862 12.872 -5.775 -7.008 1.00 25.00 C ATOM 1866 C ALA A 862 13.507 -4.397 -7.228 1.00 25.00 C ATOM 1867 O ALA A 862 14.459 -4.266 -7.980 1.00 25.00 O ATOM 1868 CB ALA A 862 11.781 -6.008 -8.032 1.00 25.00 C ATOM 0 H ALA A 862 11.295 -6.060 -5.667 1.00 25.00 H new ATOM 0 HA ALA A 862 13.677 -6.502 -7.118 1.00 25.00 H new ATOM 0 HB1 ALA A 862 12.190 -5.883 -9.034 1.00 25.00 H new ATOM 0 HB2 ALA A 862 11.390 -7.020 -7.923 1.00 25.00 H new ATOM 0 HB3 ALA A 862 10.976 -5.290 -7.876 1.00 25.00 H new ATOM 1874 N ARG A 863 12.947 -3.369 -6.609 1.00 25.00 N ATOM 1875 CA ARG A 863 13.470 -2.007 -6.776 1.00 25.00 C ATOM 1876 C ARG A 863 14.452 -1.618 -5.658 1.00 25.00 C ATOM 1877 O ARG A 863 15.066 -0.563 -5.704 1.00 25.00 O ATOM 1878 CB ARG A 863 12.323 -1.001 -6.820 1.00 25.00 C ATOM 1879 CG ARG A 863 11.550 -0.994 -8.128 1.00 25.00 C ATOM 1880 CD ARG A 863 10.144 -1.426 -7.892 1.00 25.00 C ATOM 1881 NE ARG A 863 9.145 -0.620 -8.630 1.00 25.00 N ATOM 1882 CZ ARG A 863 8.180 -1.098 -9.410 1.00 25.00 C ATOM 1883 NH1 ARG A 863 8.063 -2.374 -9.686 1.00 25.00 N ATOM 1884 NH2 ARG A 863 7.306 -0.278 -9.910 1.00 25.00 N ATOM 0 H ARG A 863 12.139 -3.442 -5.991 1.00 25.00 H new ATOM 0 HA ARG A 863 14.015 -1.989 -7.720 1.00 25.00 H new ATOM 0 HB2 ARG A 863 11.633 -1.218 -6.004 1.00 25.00 H new ATOM 0 HB3 ARG A 863 12.723 -0.003 -6.642 1.00 25.00 H new ATOM 0 HG2 ARG A 863 11.564 0.006 -8.563 1.00 25.00 H new ATOM 0 HG3 ARG A 863 12.028 -1.660 -8.846 1.00 25.00 H new ATOM 0 HD2 ARG A 863 10.040 -2.472 -8.182 1.00 25.00 H new ATOM 0 HD3 ARG A 863 9.929 -1.368 -6.825 1.00 25.00 H new ATOM 0 HE ARG A 863 9.202 0.394 -8.531 1.00 25.00 H new ATOM 0 HH11 ARG A 863 8.728 -3.043 -9.297 1.00 25.00 H new ATOM 0 HH12 ARG A 863 7.307 -2.698 -10.289 1.00 25.00 H new ATOM 0 HH21 ARG A 863 7.365 0.719 -9.703 1.00 25.00 H new ATOM 0 HH22 ARG A 863 6.560 -0.631 -10.510 1.00 25.00 H new ATOM 1898 N MET A 864 14.567 -2.440 -4.629 1.00 25.00 N ATOM 1899 CA MET A 864 15.415 -2.105 -3.484 1.00 25.00 C ATOM 1900 C MET A 864 16.893 -2.367 -3.770 1.00 25.00 C ATOM 1901 O MET A 864 17.226 -3.188 -4.616 1.00 25.00 O ATOM 1902 CB MET A 864 14.948 -2.862 -2.261 1.00 25.00 C ATOM 1903 CG MET A 864 15.053 -2.053 -0.997 1.00 25.00 C ATOM 1904 SD MET A 864 13.912 -2.601 0.266 1.00 25.00 S ATOM 1905 CE MET A 864 12.425 -1.652 -0.141 1.00 25.00 C ATOM 0 H MET A 864 14.090 -3.339 -4.557 1.00 25.00 H new ATOM 0 HA MET A 864 15.321 -1.036 -3.293 1.00 25.00 H new ATOM 0 HB2 MET A 864 13.912 -3.170 -2.404 1.00 25.00 H new ATOM 0 HB3 MET A 864 15.540 -3.771 -2.155 1.00 25.00 H new ATOM 0 HG2 MET A 864 16.071 -2.115 -0.613 1.00 25.00 H new ATOM 0 HG3 MET A 864 14.862 -1.004 -1.224 1.00 25.00 H new ATOM 0 HE1 MET A 864 11.633 -1.896 0.567 1.00 25.00 H new ATOM 0 HE2 MET A 864 12.647 -0.586 -0.085 1.00 25.00 H new ATOM 0 HE3 MET A 864 12.099 -1.902 -1.151 1.00 25.00 H new ATOM 1915 N ALA A 865 17.787 -1.639 -3.105 1.00 25.00 N ATOM 1916 CA ALA A 865 19.206 -1.748 -3.429 1.00 25.00 C ATOM 1917 C ALA A 865 19.736 -3.122 -3.005 1.00 25.00 C ATOM 1918 O ALA A 865 19.461 -3.576 -1.901 1.00 25.00 O ATOM 1919 CB ALA A 865 20.014 -0.637 -2.767 1.00 25.00 C ATOM 0 H ALA A 865 17.562 -0.983 -2.357 1.00 25.00 H new ATOM 0 HA ALA A 865 19.318 -1.640 -4.508 1.00 25.00 H new ATOM 0 HB1 ALA A 865 21.066 -0.747 -3.028 1.00 25.00 H new ATOM 0 HB2 ALA A 865 19.653 0.331 -3.114 1.00 25.00 H new ATOM 0 HB3 ALA A 865 19.901 -0.700 -1.685 1.00 25.00 H new ATOM 1925 N PRO A 866 20.509 -3.789 -3.871 1.00 25.00 N ATOM 1926 CA PRO A 866 21.010 -5.148 -3.647 1.00 25.00 C ATOM 1927 C PRO A 866 22.156 -5.242 -2.641 1.00 25.00 C ATOM 1928 O PRO A 866 23.335 -5.180 -2.995 1.00 25.00 O ATOM 1929 CB PRO A 866 21.453 -5.564 -5.047 1.00 25.00 C ATOM 1930 CG PRO A 866 21.896 -4.297 -5.681 1.00 25.00 C ATOM 1931 CD PRO A 866 20.920 -3.277 -5.188 1.00 25.00 C ATOM 0 HA PRO A 866 20.252 -5.792 -3.200 1.00 25.00 H new ATOM 0 HB2 PRO A 866 22.262 -6.294 -5.008 1.00 25.00 H new ATOM 0 HB3 PRO A 866 20.636 -6.023 -5.603 1.00 25.00 H new ATOM 0 HG2 PRO A 866 22.916 -4.043 -5.393 1.00 25.00 H new ATOM 0 HG3 PRO A 866 21.881 -4.370 -6.768 1.00 25.00 H new ATOM 0 HD2 PRO A 866 21.378 -2.291 -5.108 1.00 25.00 H new ATOM 0 HD3 PRO A 866 20.069 -3.179 -5.862 1.00 25.00 H new ATOM 1939 N TYR A 867 21.819 -5.413 -1.374 1.00 25.00 N ATOM 1940 CA TYR A 867 22.843 -5.536 -0.345 1.00 25.00 C ATOM 1941 C TYR A 867 23.194 -7.007 -0.154 1.00 25.00 C ATOM 1942 O TYR A 867 22.484 -7.759 0.500 1.00 25.00 O ATOM 1943 CB TYR A 867 22.334 -4.924 0.960 1.00 25.00 C ATOM 1944 CG TYR A 867 22.783 -3.494 1.151 1.00 25.00 C ATOM 1945 CD1 TYR A 867 22.919 -2.608 0.048 1.00 25.00 C ATOM 1946 CD2 TYR A 867 23.099 -3.016 2.441 1.00 25.00 C ATOM 1947 CE1 TYR A 867 23.396 -1.289 0.242 1.00 25.00 C ATOM 1948 CE2 TYR A 867 23.573 -1.698 2.629 1.00 25.00 C ATOM 1949 CZ TYR A 867 23.723 -0.849 1.534 1.00 25.00 C ATOM 1950 OH TYR A 867 24.195 0.420 1.745 1.00 25.00 O ATOM 0 H TYR A 867 20.859 -5.470 -1.034 1.00 25.00 H new ATOM 0 HA TYR A 867 23.742 -5.000 -0.649 1.00 25.00 H new ATOM 0 HB2 TYR A 867 21.245 -4.963 0.973 1.00 25.00 H new ATOM 0 HB3 TYR A 867 22.685 -5.525 1.799 1.00 25.00 H new ATOM 0 HD1 TYR A 867 22.657 -2.943 -0.945 1.00 25.00 H new ATOM 0 HD2 TYR A 867 22.977 -3.666 3.295 1.00 25.00 H new ATOM 0 HE1 TYR A 867 23.508 -0.624 -0.601 1.00 25.00 H new ATOM 0 HE2 TYR A 867 23.819 -1.349 3.621 1.00 25.00 H new ATOM 0 HH TYR A 867 23.441 1.031 1.881 1.00 25.00 H new ATOM 2048 N GLY A 875 19.346 -12.248 1.742 1.00 25.00 N ATOM 2049 CA GLY A 875 18.119 -11.519 1.487 1.00 25.00 C ATOM 2050 C GLY A 875 18.128 -10.176 2.184 1.00 25.00 C ATOM 2051 O GLY A 875 17.225 -9.892 2.957 1.00 25.00 O ATOM 0 HA2 GLY A 875 17.995 -11.374 0.414 1.00 25.00 H new ATOM 0 HA3 GLY A 875 17.266 -12.105 1.831 1.00 25.00 H new ATOM 2055 N ALA A 876 19.162 -9.378 1.956 1.00 25.00 N ATOM 2056 CA ALA A 876 19.283 -8.042 2.539 1.00 25.00 C ATOM 2057 C ALA A 876 19.183 -7.011 1.417 1.00 25.00 C ATOM 2058 O ALA A 876 19.707 -7.221 0.327 1.00 25.00 O ATOM 2059 CB ALA A 876 20.622 -7.900 3.273 1.00 25.00 C ATOM 0 H ALA A 876 19.947 -9.638 1.358 1.00 25.00 H new ATOM 0 HA ALA A 876 18.483 -7.881 3.262 1.00 25.00 H new ATOM 0 HB1 ALA A 876 20.698 -6.901 3.702 1.00 25.00 H new ATOM 0 HB2 ALA A 876 20.681 -8.642 4.069 1.00 25.00 H new ATOM 0 HB3 ALA A 876 21.440 -8.056 2.570 1.00 25.00 H new ATOM 2065 N LEU A 877 18.498 -5.913 1.684 1.00 25.00 N ATOM 2066 CA LEU A 877 18.365 -4.826 0.722 1.00 25.00 C ATOM 2067 C LEU A 877 18.419 -3.488 1.433 1.00 25.00 C ATOM 2068 O LEU A 877 18.043 -3.395 2.591 1.00 25.00 O ATOM 2069 CB LEU A 877 17.038 -4.936 -0.019 1.00 25.00 C ATOM 2070 CG LEU A 877 16.740 -6.241 -0.773 1.00 25.00 C ATOM 2071 CD1 LEU A 877 15.253 -6.452 -0.812 1.00 25.00 C ATOM 2072 CD2 LEU A 877 17.330 -6.228 -2.187 1.00 25.00 C ATOM 0 H LEU A 877 18.019 -5.747 2.569 1.00 25.00 H new ATOM 0 HA LEU A 877 19.188 -4.897 0.011 1.00 25.00 H new ATOM 0 HB2 LEU A 877 16.238 -4.778 0.704 1.00 25.00 H new ATOM 0 HB3 LEU A 877 16.987 -4.117 -0.736 1.00 25.00 H new ATOM 0 HG LEU A 877 17.214 -7.068 -0.245 1.00 25.00 H new ATOM 0 HD11 LEU A 877 15.031 -7.376 -1.345 1.00 25.00 H new ATOM 0 HD12 LEU A 877 14.868 -6.519 0.206 1.00 25.00 H new ATOM 0 HD13 LEU A 877 14.780 -5.614 -1.325 1.00 25.00 H new ATOM 0 HD21 LEU A 877 17.097 -7.168 -2.687 1.00 25.00 H new ATOM 0 HD22 LEU A 877 16.901 -5.401 -2.753 1.00 25.00 H new ATOM 0 HD23 LEU A 877 18.412 -6.106 -2.129 1.00 25.00 H new ATOM 2084 N ASP A 878 18.839 -2.441 0.749 1.00 25.00 N ATOM 2085 CA ASP A 878 18.837 -1.107 1.353 1.00 25.00 C ATOM 2086 C ASP A 878 17.544 -0.392 1.051 1.00 25.00 C ATOM 2087 O ASP A 878 17.274 -0.008 -0.085 1.00 25.00 O ATOM 2088 CB ASP A 878 20.018 -0.288 0.896 1.00 25.00 C ATOM 2089 CG ASP A 878 20.277 0.894 1.808 1.00 25.00 C ATOM 2090 OD1 ASP A 878 19.290 1.447 2.339 1.00 25.00 O ATOM 2091 OD2 ASP A 878 21.438 1.313 1.953 1.00 25.00 O ATOM 0 H ASP A 878 19.182 -2.478 -0.211 1.00 25.00 H new ATOM 0 HA ASP A 878 18.923 -1.232 2.432 1.00 25.00 H new ATOM 0 HB2 ASP A 878 20.905 -0.920 0.861 1.00 25.00 H new ATOM 0 HB3 ASP A 878 19.841 0.069 -0.118 1.00 25.00 H new ATOM 2096 N TYR A 879 16.734 -0.250 2.087 1.00 25.00 N ATOM 2097 CA TYR A 879 15.418 0.346 1.970 1.00 25.00 C ATOM 2098 C TYR A 879 15.499 1.847 1.662 1.00 25.00 C ATOM 2099 O TYR A 879 14.648 2.388 0.974 1.00 25.00 O ATOM 2100 CB TYR A 879 14.630 0.090 3.253 1.00 25.00 C ATOM 2101 CG TYR A 879 15.248 0.672 4.507 1.00 25.00 C ATOM 2102 CD1 TYR A 879 15.010 2.009 4.876 1.00 25.00 C ATOM 2103 CD2 TYR A 879 16.071 -0.113 5.335 1.00 25.00 C ATOM 2104 CE1 TYR A 879 15.596 2.554 6.042 1.00 25.00 C ATOM 2105 CE2 TYR A 879 16.645 0.423 6.512 1.00 25.00 C ATOM 2106 CZ TYR A 879 16.402 1.755 6.856 1.00 25.00 C ATOM 2107 OH TYR A 879 16.952 2.272 8.004 1.00 25.00 O ATOM 0 H TYR A 879 16.973 -0.546 3.033 1.00 25.00 H new ATOM 0 HA TYR A 879 14.900 -0.119 1.131 1.00 25.00 H new ATOM 0 HB2 TYR A 879 13.628 0.501 3.135 1.00 25.00 H new ATOM 0 HB3 TYR A 879 14.519 -0.986 3.386 1.00 25.00 H new ATOM 0 HD1 TYR A 879 14.372 2.626 4.261 1.00 25.00 H new ATOM 0 HD2 TYR A 879 16.268 -1.141 5.068 1.00 25.00 H new ATOM 0 HE1 TYR A 879 15.420 3.587 6.303 1.00 25.00 H new ATOM 0 HE2 TYR A 879 17.268 -0.195 7.142 1.00 25.00 H new ATOM 0 HH TYR A 879 17.559 1.613 8.401 1.00 25.00 H new ATOM 2117 N MET A 880 16.502 2.522 2.210 1.00 25.00 N ATOM 2118 CA MET A 880 16.644 3.973 2.043 1.00 25.00 C ATOM 2119 C MET A 880 17.516 4.372 0.854 1.00 25.00 C ATOM 2120 O MET A 880 17.352 5.455 0.306 1.00 25.00 O ATOM 2121 CB MET A 880 17.143 4.614 3.343 1.00 25.00 C ATOM 2122 CG MET A 880 18.413 4.014 3.898 1.00 25.00 C ATOM 2123 SD MET A 880 18.866 4.726 5.488 1.00 25.00 S ATOM 2124 CE MET A 880 20.249 3.670 5.902 1.00 25.00 C ATOM 0 H MET A 880 17.233 2.092 2.776 1.00 25.00 H new ATOM 0 HA MET A 880 15.650 4.358 1.815 1.00 25.00 H new ATOM 0 HB2 MET A 880 17.306 5.677 3.168 1.00 25.00 H new ATOM 0 HB3 MET A 880 16.359 4.532 4.096 1.00 25.00 H new ATOM 0 HG2 MET A 880 18.286 2.937 4.008 1.00 25.00 H new ATOM 0 HG3 MET A 880 19.226 4.168 3.188 1.00 25.00 H new ATOM 0 HE1 MET A 880 20.659 3.969 6.867 1.00 25.00 H new ATOM 0 HE2 MET A 880 19.913 2.635 5.956 1.00 25.00 H new ATOM 0 HE3 MET A 880 21.019 3.762 5.136 1.00 25.00 H new ATOM 2134 N SER A 881 18.425 3.496 0.444 1.00 25.00 N ATOM 2135 CA SER A 881 19.286 3.761 -0.717 1.00 25.00 C ATOM 2136 C SER A 881 18.781 2.981 -1.928 1.00 25.00 C ATOM 2137 O SER A 881 19.517 2.763 -2.893 1.00 25.00 O ATOM 2138 CB SER A 881 20.741 3.390 -0.422 1.00 25.00 C ATOM 2139 OG SER A 881 21.604 3.860 -1.446 1.00 25.00 O ATOM 0 H SER A 881 18.590 2.595 0.893 1.00 25.00 H new ATOM 0 HA SER A 881 19.247 4.829 -0.934 1.00 25.00 H new ATOM 0 HB2 SER A 881 21.041 3.816 0.535 1.00 25.00 H new ATOM 0 HB3 SER A 881 20.833 2.308 -0.333 1.00 25.00 H new ATOM 0 HG SER A 881 21.253 3.589 -2.320 1.00 25.00 H new ATOM 2145 N PHE A 882 17.529 2.551 -1.845 1.00 25.00 N ATOM 2146 CA PHE A 882 16.855 1.825 -2.925 1.00 25.00 C ATOM 2147 C PHE A 882 16.982 2.491 -4.300 1.00 25.00 C ATOM 2148 O PHE A 882 17.186 3.704 -4.425 1.00 25.00 O ATOM 2149 CB PHE A 882 15.370 1.656 -2.566 1.00 25.00 C ATOM 2150 CG PHE A 882 14.487 2.774 -3.053 1.00 25.00 C ATOM 2151 CD1 PHE A 882 14.402 3.991 -2.352 1.00 25.00 C ATOM 2152 CD2 PHE A 882 13.712 2.600 -4.217 1.00 25.00 C ATOM 2153 CE1 PHE A 882 13.556 5.034 -2.816 1.00 25.00 C ATOM 2154 CE2 PHE A 882 12.867 3.630 -4.690 1.00 25.00 C ATOM 2155 CZ PHE A 882 12.788 4.849 -3.988 1.00 25.00 C ATOM 0 H PHE A 882 16.944 2.695 -1.022 1.00 25.00 H new ATOM 0 HA PHE A 882 17.354 0.860 -3.012 1.00 25.00 H new ATOM 0 HB2 PHE A 882 15.011 0.716 -2.985 1.00 25.00 H new ATOM 0 HB3 PHE A 882 15.276 1.579 -1.483 1.00 25.00 H new ATOM 0 HD1 PHE A 882 14.985 4.134 -1.454 1.00 25.00 H new ATOM 0 HD2 PHE A 882 13.764 1.666 -4.756 1.00 25.00 H new ATOM 0 HE1 PHE A 882 13.500 5.967 -2.274 1.00 25.00 H new ATOM 0 HE2 PHE A 882 12.284 3.483 -5.587 1.00 25.00 H new ATOM 0 HZ PHE A 882 12.143 5.639 -4.344 1.00 25.00 H new