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+ -125:sc= 1.1 (180deg=0.268) USER MOD Set 1.2: A 879 TYR OH : rot -172:sc= 2.08 USER MOD Set 2.1: A 808 THR OG1 : rot -100:sc= 0.15 USER MOD Set 2.2: A 810 GLN : amide:sc= 0.69 X(o=0.84,f=0.88) USER MOD Set 3.1: A 763 SER OG : rot -85:sc= 1.16 USER MOD Set 3.2: A 765 THR OG1 : rot 33:sc= 0.569 USER MOD Set 4.1: A 756 ASN : amide:sc= 0.814 X(o=0.55,f=0.95) USER MOD Set 4.2: A 762 HIS : no HD1:sc= -0.26 X(o=0.55,f=0.95) USER MOD Set 5.1: A 754 SER OG : rot -96:sc= 0.937 USER MOD Set 5.2: A 774 CYS SG : rot 180:sc= 0.743 USER MOD Single : A 742 SER OG : rot 34:sc= 0.144 USER MOD Single : A 744 SER OG : rot 180:sc= 0.206 USER MOD Single : A 745 GLN : amide:sc= -0.509 K(o=-0.51,f=0) USER MOD Single : A 747 GLN : amide:sc= -0.0428 K(o=-0.043,f=-2.8) USER MOD Single : A 748 MET CE :methyl 136:sc= -2.73! (180deg=-4.74!) USER MOD Single : A 749 ASN : amide:sc=0.000214 X(o=0.00021,f=0) USER MOD Single : A 757 HIS : no HD1:sc= -0.254 X(o=-0.25,f=-0.0061) USER MOD Single : A 772 LYS NZ :NH3+ 142:sc= 0.223 (180deg=-0.00357) USER MOD Single : A 777 SER OG : rot 133:sc= 1.39 USER MOD Single : A 780 TYR OH : rot 180:sc= -0.166 USER MOD Single : A 784 ASN : amide:sc= 0.41 X(o=0.41,f=0) USER MOD Single : A 787 GLN : amide:sc= -0.116 X(o=-0.12,f=-0.038) USER MOD Single : A 796 MET CE :methyl -151:sc= -0.157 (180deg=-0.467) USER MOD Single : A 797 SER OG : rot 180:sc= 0 USER MOD Single : A 802 ASN : amide:sc= -1.67 K(o=-1.7,f=0) USER MOD Single : A 816 MET CE :methyl -175:sc= -0.259 (180deg=-0.313) USER MOD Single : A 817 SER OG : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot -87:sc= 0.831 USER MOD Single : A 823 THR OG1 : rot 180:sc= 0 USER MOD Single : A 825 THR OG1 : rot -145:sc= 1.31 USER MOD Single : A 828 GLN : amide:sc= -0.302 X(o=-0.3,f=-0.02) USER MOD Single : A 830 MET CE :methyl -124:sc= -0.038 (180deg=-0.575) USER MOD Single : A 832 SER OG : rot -62:sc= 1.2 USER MOD Single : A 840 LYS NZ :NH3+ -124:sc= 0.103 (180deg=-0.413) USER MOD Single : A 841 ASN : amide:sc= 0.0399 K(o=0.04,f=-1.9!) USER MOD Single : A 842 TYR OH : rot 180:sc= 0 USER MOD Single : A 844 THR OG1 : rot -66:sc= 0.464 USER MOD Single : A 845 MET CE :methyl 127:sc= -0.205 (180deg=-1.67) USER MOD Single : A 856 GLN : amide:sc= -2.34 K(o=-2.3,f=-6.1!) USER MOD Single : A 859 TYR OH : rot 180:sc= 0 USER MOD Single : A 860 CYS SG : rot 16:sc= 1.16 USER MOD Single : A 864 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 867 TYR OH : rot 126:sc= 0.791 USER MOD Single : A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 881 SER OG : rot -45:sc= 0.424 USER MOD ----------------------------------------------------------------- ATOM 21 N SER A 742 -0.988 -10.642 -7.322 1.00 25.00 N ATOM 22 CA SER A 742 -1.591 -9.424 -6.764 1.00 25.00 C ATOM 23 C SER A 742 -1.819 -9.541 -5.245 1.00 25.00 C ATOM 24 O SER A 742 -0.945 -10.025 -4.517 1.00 25.00 O ATOM 25 CB SER A 742 -2.883 -9.071 -7.512 1.00 25.00 C ATOM 26 OG SER A 742 -2.643 -9.004 -8.909 1.00 25.00 O ATOM 0 HA SER A 742 -0.887 -8.604 -6.908 1.00 25.00 H new ATOM 0 HB2 SER A 742 -3.648 -9.819 -7.303 1.00 25.00 H new ATOM 0 HB3 SER A 742 -3.267 -8.115 -7.156 1.00 25.00 H new ATOM 0 HG SER A 742 -1.968 -9.670 -9.157 1.00 25.00 H new ATOM 32 N ILE A 743 -2.945 -9.037 -4.755 1.00 25.00 N ATOM 33 CA ILE A 743 -3.220 -9.035 -3.324 1.00 25.00 C ATOM 34 C ILE A 743 -3.390 -10.459 -2.761 1.00 25.00 C ATOM 35 O ILE A 743 -3.910 -11.361 -3.417 1.00 25.00 O ATOM 36 CB ILE A 743 -4.452 -8.149 -3.007 1.00 25.00 C ATOM 37 CG1 ILE A 743 -4.104 -7.300 -1.783 1.00 25.00 C ATOM 38 CG2 ILE A 743 -5.761 -8.982 -2.856 1.00 25.00 C ATOM 39 CD1 ILE A 743 -5.261 -6.863 -0.938 1.00 25.00 C ATOM 0 H ILE A 743 -3.682 -8.625 -5.327 1.00 25.00 H new ATOM 0 HA ILE A 743 -2.352 -8.606 -2.824 1.00 25.00 H new ATOM 0 HB ILE A 743 -4.672 -7.484 -3.842 1.00 25.00 H new ATOM 0 HG12 ILE A 743 -3.415 -7.866 -1.156 1.00 25.00 H new ATOM 0 HG13 ILE A 743 -3.570 -6.412 -2.121 1.00 25.00 H new ATOM 0 HG21 ILE A 743 -6.594 -8.314 -2.635 1.00 25.00 H new ATOM 0 HG22 ILE A 743 -5.961 -9.516 -3.785 1.00 25.00 H new ATOM 0 HG23 ILE A 743 -5.644 -9.699 -2.043 1.00 25.00 H new ATOM 0 HD11 ILE A 743 -4.896 -6.269 -0.100 1.00 25.00 H new ATOM 0 HD12 ILE A 743 -5.944 -6.262 -1.539 1.00 25.00 H new ATOM 0 HD13 ILE A 743 -5.786 -7.740 -0.559 1.00 25.00 H new ATOM 51 N SER A 744 -2.940 -10.645 -1.531 1.00 25.00 N ATOM 52 CA SER A 744 -3.036 -11.929 -0.851 1.00 25.00 C ATOM 53 C SER A 744 -4.336 -12.005 -0.073 1.00 25.00 C ATOM 54 O SER A 744 -4.902 -10.983 0.328 1.00 25.00 O ATOM 55 CB SER A 744 -1.848 -12.101 0.108 1.00 25.00 C ATOM 56 OG SER A 744 -1.977 -13.274 0.898 1.00 25.00 O ATOM 0 H SER A 744 -2.498 -9.912 -0.975 1.00 25.00 H new ATOM 0 HA SER A 744 -3.016 -12.727 -1.594 1.00 25.00 H new ATOM 0 HB2 SER A 744 -0.922 -12.148 -0.465 1.00 25.00 H new ATOM 0 HB3 SER A 744 -1.777 -11.230 0.759 1.00 25.00 H new ATOM 0 HG SER A 744 -1.204 -13.353 1.495 1.00 25.00 H new ATOM 62 N GLN A 745 -4.767 -13.226 0.210 1.00 25.00 N ATOM 63 CA GLN A 745 -5.930 -13.456 1.056 1.00 25.00 C ATOM 64 C GLN A 745 -5.650 -12.937 2.461 1.00 25.00 C ATOM 65 O GLN A 745 -6.563 -12.556 3.177 1.00 25.00 O ATOM 66 CB GLN A 745 -6.252 -14.953 1.123 1.00 25.00 C ATOM 67 CG GLN A 745 -6.922 -15.502 -0.136 1.00 25.00 C ATOM 68 CD GLN A 745 -8.437 -15.595 -0.005 1.00 25.00 C ATOM 69 OE1 GLN A 745 -9.019 -16.637 -0.243 1.00 25.00 O ATOM 70 NE2 GLN A 745 -9.072 -14.513 0.371 1.00 25.00 N ATOM 0 H GLN A 745 -4.326 -14.078 -0.136 1.00 25.00 H new ATOM 0 HA GLN A 745 -6.783 -12.928 0.631 1.00 25.00 H new ATOM 0 HB2 GLN A 745 -5.329 -15.505 1.301 1.00 25.00 H new ATOM 0 HB3 GLN A 745 -6.903 -15.136 1.978 1.00 25.00 H new ATOM 0 HG2 GLN A 745 -6.674 -14.862 -0.983 1.00 25.00 H new ATOM 0 HG3 GLN A 745 -6.519 -16.491 -0.355 1.00 25.00 H new ATOM 0 HE21 GLN A 745 -8.552 -13.657 0.562 1.00 25.00 H new ATOM 0 HE22 GLN A 745 -10.087 -14.527 0.473 1.00 25.00 H new ATOM 79 N GLU A 746 -4.385 -12.901 2.847 1.00 25.00 N ATOM 80 CA GLU A 746 -4.017 -12.425 4.174 1.00 25.00 C ATOM 81 C GLU A 746 -3.963 -10.917 4.185 1.00 25.00 C ATOM 82 O GLU A 746 -4.445 -10.294 5.124 1.00 25.00 O ATOM 83 CB GLU A 746 -2.681 -13.020 4.583 1.00 25.00 C ATOM 84 CG GLU A 746 -2.807 -14.505 4.835 1.00 25.00 C ATOM 85 CD GLU A 746 -1.471 -15.163 5.114 1.00 25.00 C ATOM 86 OE1 GLU A 746 -0.598 -15.122 4.219 1.00 25.00 O ATOM 87 OE2 GLU A 746 -1.312 -15.769 6.194 1.00 25.00 O ATOM 0 H GLU A 746 -3.599 -13.193 2.266 1.00 25.00 H new ATOM 0 HA GLU A 746 -4.770 -12.744 4.894 1.00 25.00 H new ATOM 0 HB2 GLU A 746 -1.944 -12.841 3.800 1.00 25.00 H new ATOM 0 HB3 GLU A 746 -2.317 -12.524 5.483 1.00 25.00 H new ATOM 0 HG2 GLU A 746 -3.474 -14.671 5.681 1.00 25.00 H new ATOM 0 HG3 GLU A 746 -3.268 -14.979 3.968 1.00 25.00 H new ATOM 94 N GLN A 747 -3.479 -10.330 3.098 1.00 25.00 N ATOM 95 CA GLN A 747 -3.447 -8.878 2.985 1.00 25.00 C ATOM 96 C GLN A 747 -4.843 -8.307 3.067 1.00 25.00 C ATOM 97 O GLN A 747 -5.063 -7.303 3.718 1.00 25.00 O ATOM 98 CB GLN A 747 -2.807 -8.425 1.675 1.00 25.00 C ATOM 99 CG GLN A 747 -2.596 -6.896 1.600 1.00 25.00 C ATOM 100 CD GLN A 747 -1.590 -6.389 2.611 1.00 25.00 C ATOM 101 OE1 GLN A 747 -0.399 -6.469 2.395 1.00 25.00 O ATOM 102 NE2 GLN A 747 -2.067 -5.870 3.709 1.00 25.00 N ATOM 0 H GLN A 747 -3.107 -10.830 2.291 1.00 25.00 H new ATOM 0 HA GLN A 747 -2.844 -8.510 3.815 1.00 25.00 H new ATOM 0 HB2 GLN A 747 -1.846 -8.925 1.555 1.00 25.00 H new ATOM 0 HB3 GLN A 747 -3.436 -8.740 0.842 1.00 25.00 H new ATOM 0 HG2 GLN A 747 -2.262 -6.629 0.597 1.00 25.00 H new ATOM 0 HG3 GLN A 747 -3.550 -6.394 1.762 1.00 25.00 H new ATOM 0 HE21 GLN A 747 -3.075 -5.821 3.854 1.00 25.00 H new ATOM 0 HE22 GLN A 747 -1.431 -5.514 4.423 1.00 25.00 H new ATOM 111 N MET A 748 -5.808 -8.945 2.424 1.00 25.00 N ATOM 112 CA MET A 748 -7.159 -8.423 2.454 1.00 25.00 C ATOM 113 C MET A 748 -7.758 -8.672 3.821 1.00 25.00 C ATOM 114 O MET A 748 -8.695 -8.002 4.219 1.00 25.00 O ATOM 115 CB MET A 748 -8.033 -9.045 1.368 1.00 25.00 C ATOM 116 CG MET A 748 -8.274 -10.514 1.503 1.00 25.00 C ATOM 117 SD MET A 748 -9.721 -11.073 0.564 1.00 25.00 S ATOM 118 CE MET A 748 -9.478 -10.272 -1.037 1.00 25.00 C ATOM 0 H MET A 748 -5.684 -9.804 1.888 1.00 25.00 H new ATOM 0 HA MET A 748 -7.118 -7.352 2.257 1.00 25.00 H new ATOM 0 HB2 MET A 748 -8.996 -8.535 1.364 1.00 25.00 H new ATOM 0 HB3 MET A 748 -7.569 -8.857 0.400 1.00 25.00 H new ATOM 0 HG2 MET A 748 -7.392 -11.056 1.161 1.00 25.00 H new ATOM 0 HG3 MET A 748 -8.411 -10.761 2.556 1.00 25.00 H new ATOM 0 HE1 MET A 748 -9.687 -10.984 -1.835 1.00 25.00 H new ATOM 0 HE2 MET A 748 -10.153 -9.420 -1.124 1.00 25.00 H new ATOM 0 HE3 MET A 748 -8.447 -9.928 -1.119 1.00 25.00 H new ATOM 128 N ASN A 749 -7.207 -9.629 4.549 1.00 25.00 N ATOM 129 CA ASN A 749 -7.748 -9.974 5.846 1.00 25.00 C ATOM 130 C ASN A 749 -7.268 -9.016 6.927 1.00 25.00 C ATOM 131 O ASN A 749 -8.019 -8.671 7.830 1.00 25.00 O ATOM 132 CB ASN A 749 -7.421 -11.426 6.207 1.00 25.00 C ATOM 133 CG ASN A 749 -7.016 -11.594 7.651 1.00 25.00 C ATOM 134 OD1 ASN A 749 -7.853 -11.758 8.527 1.00 25.00 O ATOM 135 ND2 ASN A 749 -5.733 -11.572 7.901 1.00 25.00 N ATOM 0 H ASN A 749 -6.393 -10.174 4.265 1.00 25.00 H new ATOM 0 HA ASN A 749 -8.832 -9.878 5.786 1.00 25.00 H new ATOM 0 HB2 ASN A 749 -8.291 -12.051 6.004 1.00 25.00 H new ATOM 0 HB3 ASN A 749 -6.616 -11.782 5.565 1.00 25.00 H new ATOM 0 HD21 ASN A 749 -5.397 -11.694 8.856 1.00 25.00 H new ATOM 0 HD22 ASN A 749 -5.068 -11.432 7.141 1.00 25.00 H new ATOM 142 N GLU A 750 -6.040 -8.543 6.822 1.00 25.00 N ATOM 143 CA GLU A 750 -5.549 -7.550 7.769 1.00 25.00 C ATOM 144 C GLU A 750 -5.977 -6.150 7.323 1.00 25.00 C ATOM 145 O GLU A 750 -6.331 -5.315 8.141 1.00 25.00 O ATOM 146 CB GLU A 750 -4.033 -7.672 7.943 1.00 25.00 C ATOM 147 CG GLU A 750 -3.220 -7.468 6.683 1.00 25.00 C ATOM 148 CD GLU A 750 -1.901 -8.209 6.746 1.00 25.00 C ATOM 149 OE1 GLU A 750 -1.211 -8.107 7.778 1.00 25.00 O ATOM 150 OE2 GLU A 750 -1.605 -8.968 5.800 1.00 25.00 O ATOM 0 H GLU A 750 -5.371 -8.822 6.104 1.00 25.00 H new ATOM 0 HA GLU A 750 -5.991 -7.732 8.748 1.00 25.00 H new ATOM 0 HB2 GLU A 750 -3.709 -6.944 8.687 1.00 25.00 H new ATOM 0 HB3 GLU A 750 -3.808 -8.660 8.345 1.00 25.00 H new ATOM 0 HG2 GLU A 750 -3.791 -7.813 5.821 1.00 25.00 H new ATOM 0 HG3 GLU A 750 -3.034 -6.404 6.537 1.00 25.00 H new ATOM 157 N PHE A 751 -6.034 -5.909 6.021 1.00 25.00 N ATOM 158 CA PHE A 751 -6.456 -4.603 5.516 1.00 25.00 C ATOM 159 C PHE A 751 -7.952 -4.359 5.679 1.00 25.00 C ATOM 160 O PHE A 751 -8.386 -3.217 5.789 1.00 25.00 O ATOM 161 CB PHE A 751 -6.073 -4.447 4.053 1.00 25.00 C ATOM 162 CG PHE A 751 -6.446 -3.122 3.479 1.00 25.00 C ATOM 163 CD1 PHE A 751 -5.884 -1.934 3.976 1.00 25.00 C ATOM 164 CD2 PHE A 751 -7.366 -3.049 2.430 1.00 25.00 C ATOM 165 CE1 PHE A 751 -6.248 -0.689 3.419 1.00 25.00 C ATOM 166 CE2 PHE A 751 -7.706 -1.817 1.861 1.00 25.00 C ATOM 167 CZ PHE A 751 -7.158 -0.638 2.351 1.00 25.00 C ATOM 0 H PHE A 751 -5.797 -6.590 5.299 1.00 25.00 H new ATOM 0 HA PHE A 751 -5.935 -3.859 6.118 1.00 25.00 H new ATOM 0 HB2 PHE A 751 -4.997 -4.589 3.950 1.00 25.00 H new ATOM 0 HB3 PHE A 751 -6.555 -5.234 3.473 1.00 25.00 H new ATOM 0 HD1 PHE A 751 -5.171 -1.973 4.787 1.00 25.00 H new ATOM 0 HD2 PHE A 751 -7.820 -3.954 2.054 1.00 25.00 H new ATOM 0 HE1 PHE A 751 -5.827 0.224 3.814 1.00 25.00 H new ATOM 0 HE2 PHE A 751 -8.400 -1.782 1.034 1.00 25.00 H new ATOM 0 HZ PHE A 751 -7.430 0.311 1.913 1.00 25.00 H new ATOM 177 N ARG A 752 -8.753 -5.412 5.792 1.00 25.00 N ATOM 178 CA ARG A 752 -10.174 -5.227 6.083 1.00 25.00 C ATOM 179 C ARG A 752 -10.320 -4.581 7.447 1.00 25.00 C ATOM 180 O ARG A 752 -11.343 -4.006 7.714 1.00 25.00 O ATOM 181 CB ARG A 752 -10.961 -6.554 6.043 1.00 25.00 C ATOM 182 CG ARG A 752 -10.765 -7.460 7.240 1.00 25.00 C ATOM 183 CD ARG A 752 -11.897 -7.367 8.248 1.00 25.00 C ATOM 184 NE ARG A 752 -11.564 -8.143 9.452 1.00 25.00 N ATOM 185 CZ ARG A 752 -12.243 -8.120 10.593 1.00 25.00 C ATOM 186 NH1 ARG A 752 -13.307 -7.370 10.763 1.00 25.00 N ATOM 187 NH2 ARG A 752 -11.836 -8.861 11.585 1.00 25.00 N ATOM 0 H ARG A 752 -8.455 -6.382 5.690 1.00 25.00 H new ATOM 0 HA ARG A 752 -10.593 -4.584 5.309 1.00 25.00 H new ATOM 0 HB2 ARG A 752 -12.023 -6.325 5.952 1.00 25.00 H new ATOM 0 HB3 ARG A 752 -10.674 -7.100 5.144 1.00 25.00 H new ATOM 0 HG2 ARG A 752 -10.675 -8.491 6.897 1.00 25.00 H new ATOM 0 HG3 ARG A 752 -9.826 -7.205 7.732 1.00 25.00 H new ATOM 0 HD2 ARG A 752 -12.073 -6.325 8.514 1.00 25.00 H new ATOM 0 HD3 ARG A 752 -12.820 -7.743 7.807 1.00 25.00 H new ATOM 0 HE ARG A 752 -10.744 -8.748 9.407 1.00 25.00 H new ATOM 0 HH11 ARG A 752 -13.640 -6.777 10.003 1.00 25.00 H new ATOM 0 HH12 ARG A 752 -13.801 -7.381 11.655 1.00 25.00 H new ATOM 0 HH21 ARG A 752 -11.008 -9.447 11.478 1.00 25.00 H new ATOM 0 HH22 ARG A 752 -12.346 -8.855 12.468 1.00 25.00 H new ATOM 201 N ALA A 753 -9.303 -4.658 8.304 1.00 25.00 N ATOM 202 CA ALA A 753 -9.364 -4.029 9.623 1.00 25.00 C ATOM 203 C ALA A 753 -9.295 -2.509 9.480 1.00 25.00 C ATOM 204 O ALA A 753 -9.779 -1.779 10.339 1.00 25.00 O ATOM 205 CB ALA A 753 -8.227 -4.526 10.504 1.00 25.00 C ATOM 0 H ALA A 753 -8.430 -5.148 8.110 1.00 25.00 H new ATOM 0 HA ALA A 753 -10.309 -4.299 10.095 1.00 25.00 H new ATOM 0 HB1 ALA A 753 -8.288 -4.047 11.481 1.00 25.00 H new ATOM 0 HB2 ALA A 753 -8.305 -5.607 10.624 1.00 25.00 H new ATOM 0 HB3 ALA A 753 -7.272 -4.280 10.039 1.00 25.00 H new ATOM 211 N SER A 754 -8.762 -2.028 8.366 1.00 25.00 N ATOM 212 CA SER A 754 -8.707 -0.595 8.108 1.00 25.00 C ATOM 213 C SER A 754 -10.117 -0.002 7.987 1.00 25.00 C ATOM 214 O SER A 754 -10.302 1.206 8.124 1.00 25.00 O ATOM 215 CB SER A 754 -7.859 -0.271 6.871 1.00 25.00 C ATOM 216 OG SER A 754 -7.444 1.084 6.896 1.00 25.00 O ATOM 0 H SER A 754 -8.362 -2.607 7.627 1.00 25.00 H new ATOM 0 HA SER A 754 -8.219 -0.129 8.964 1.00 25.00 H new ATOM 0 HB2 SER A 754 -6.987 -0.924 6.839 1.00 25.00 H new ATOM 0 HB3 SER A 754 -8.436 -0.465 5.966 1.00 25.00 H new ATOM 0 HG SER A 754 -8.063 1.626 6.364 1.00 25.00 H new ATOM 222 N PHE A 755 -11.119 -0.869 7.856 1.00 25.00 N ATOM 223 CA PHE A 755 -12.532 -0.441 7.893 1.00 25.00 C ATOM 224 C PHE A 755 -12.930 0.299 9.171 1.00 25.00 C ATOM 225 O PHE A 755 -13.897 1.036 9.171 1.00 25.00 O ATOM 226 CB PHE A 755 -13.464 -1.650 7.708 1.00 25.00 C ATOM 227 CG PHE A 755 -13.860 -2.359 9.012 1.00 25.00 C ATOM 228 CD1 PHE A 755 -12.900 -2.910 9.884 1.00 25.00 C ATOM 229 CD2 PHE A 755 -15.209 -2.485 9.352 1.00 25.00 C ATOM 230 CE1 PHE A 755 -13.283 -3.581 11.071 1.00 25.00 C ATOM 231 CE2 PHE A 755 -15.612 -3.145 10.543 1.00 25.00 C ATOM 232 CZ PHE A 755 -14.644 -3.696 11.400 1.00 25.00 C ATOM 0 H PHE A 755 -10.988 -1.872 7.723 1.00 25.00 H new ATOM 0 HA PHE A 755 -12.640 0.265 7.070 1.00 25.00 H new ATOM 0 HB2 PHE A 755 -14.370 -1.319 7.200 1.00 25.00 H new ATOM 0 HB3 PHE A 755 -12.976 -2.371 7.052 1.00 25.00 H new ATOM 0 HD1 PHE A 755 -11.851 -2.819 9.642 1.00 25.00 H new ATOM 0 HD2 PHE A 755 -15.961 -2.072 8.696 1.00 25.00 H new ATOM 0 HE1 PHE A 755 -12.531 -4.003 11.721 1.00 25.00 H new ATOM 0 HE2 PHE A 755 -16.661 -3.223 10.790 1.00 25.00 H new ATOM 0 HZ PHE A 755 -14.944 -4.204 12.305 1.00 25.00 H new ATOM 242 N ASN A 756 -12.200 0.075 10.259 1.00 25.00 N ATOM 243 CA ASN A 756 -12.485 0.753 11.531 1.00 25.00 C ATOM 244 C ASN A 756 -11.335 1.676 11.937 1.00 25.00 C ATOM 245 O ASN A 756 -11.419 2.381 12.928 1.00 25.00 O ATOM 246 CB ASN A 756 -12.792 -0.272 12.640 1.00 25.00 C ATOM 247 CG ASN A 756 -11.589 -0.592 13.514 1.00 25.00 C ATOM 248 OD1 ASN A 756 -11.577 -0.298 14.690 1.00 25.00 O ATOM 249 ND2 ASN A 756 -10.605 -1.231 12.954 1.00 25.00 N ATOM 0 H ASN A 756 -11.408 -0.567 10.292 1.00 25.00 H new ATOM 0 HA ASN A 756 -13.370 1.373 11.389 1.00 25.00 H new ATOM 0 HB2 ASN A 756 -13.596 0.112 13.268 1.00 25.00 H new ATOM 0 HB3 ASN A 756 -13.156 -1.193 12.184 1.00 25.00 H new ATOM 0 HD21 ASN A 756 -9.791 -1.500 13.507 1.00 25.00 H new ATOM 0 HD22 ASN A 756 -10.647 -1.463 11.962 1.00 25.00 H new ATOM 256 N HIS A 757 -10.264 1.662 11.151 1.00 25.00 N ATOM 257 CA HIS A 757 -9.066 2.450 11.463 1.00 25.00 C ATOM 258 C HIS A 757 -9.310 3.950 11.301 1.00 25.00 C ATOM 259 O HIS A 757 -9.067 4.728 12.214 1.00 25.00 O ATOM 260 CB HIS A 757 -7.922 2.015 10.535 1.00 25.00 C ATOM 261 CG HIS A 757 -6.628 2.729 10.777 1.00 25.00 C ATOM 262 ND1 HIS A 757 -5.589 2.757 9.880 1.00 25.00 N ATOM 263 CD2 HIS A 757 -6.192 3.458 11.843 1.00 25.00 C ATOM 264 CE1 HIS A 757 -4.601 3.472 10.410 1.00 25.00 C ATOM 265 NE2 HIS A 757 -4.911 3.917 11.611 1.00 25.00 N ATOM 0 H HIS A 757 -10.196 1.116 10.292 1.00 25.00 H new ATOM 0 HA HIS A 757 -8.805 2.268 12.505 1.00 25.00 H new ATOM 0 HB2 HIS A 757 -7.760 0.944 10.654 1.00 25.00 H new ATOM 0 HB3 HIS A 757 -8.226 2.178 9.501 1.00 25.00 H new ATOM 0 HD2 HIS A 757 -6.765 3.649 12.738 1.00 25.00 H new ATOM 0 HE1 HIS A 757 -3.660 3.664 9.917 1.00 25.00 H new ATOM 0 HE2 HIS A 757 -4.330 4.479 12.234 1.00 25.00 H new ATOM 273 N PHE A 758 -9.770 4.348 10.124 1.00 25.00 N ATOM 274 CA PHE A 758 -9.988 5.765 9.823 1.00 25.00 C ATOM 275 C PHE A 758 -11.456 6.137 9.857 1.00 25.00 C ATOM 276 O PHE A 758 -11.824 7.265 9.526 1.00 25.00 O ATOM 277 CB PHE A 758 -9.427 6.084 8.447 1.00 25.00 C ATOM 278 CG PHE A 758 -8.082 6.734 8.486 1.00 25.00 C ATOM 279 CD1 PHE A 758 -6.913 5.956 8.534 1.00 25.00 C ATOM 280 CD2 PHE A 758 -7.972 8.136 8.450 1.00 25.00 C ATOM 281 CE1 PHE A 758 -5.641 6.569 8.548 1.00 25.00 C ATOM 282 CE2 PHE A 758 -6.703 8.762 8.463 1.00 25.00 C ATOM 283 CZ PHE A 758 -5.536 7.975 8.511 1.00 25.00 C ATOM 0 H PHE A 758 -10.001 3.714 9.359 1.00 25.00 H new ATOM 0 HA PHE A 758 -9.477 6.345 10.591 1.00 25.00 H new ATOM 0 HB2 PHE A 758 -9.359 5.163 7.869 1.00 25.00 H new ATOM 0 HB3 PHE A 758 -10.123 6.739 7.923 1.00 25.00 H new ATOM 0 HD1 PHE A 758 -6.988 4.879 8.560 1.00 25.00 H new ATOM 0 HD2 PHE A 758 -8.866 8.741 8.412 1.00 25.00 H new ATOM 0 HE1 PHE A 758 -4.749 5.961 8.587 1.00 25.00 H new ATOM 0 HE2 PHE A 758 -6.630 9.839 8.436 1.00 25.00 H new ATOM 0 HZ PHE A 758 -4.564 8.446 8.519 1.00 25.00 H new ATOM 293 N ASP A 759 -12.293 5.170 10.202 1.00 25.00 N ATOM 294 CA ASP A 759 -13.738 5.374 10.247 1.00 25.00 C ATOM 295 C ASP A 759 -14.138 6.539 11.126 1.00 25.00 C ATOM 296 O ASP A 759 -14.091 6.473 12.348 1.00 25.00 O ATOM 297 CB ASP A 759 -14.462 4.104 10.643 1.00 25.00 C ATOM 298 CG ASP A 759 -15.904 4.095 10.162 1.00 25.00 C ATOM 299 OD1 ASP A 759 -16.461 5.173 9.857 1.00 50.00 O ATOM 300 OD2 ASP A 759 -16.489 3.018 10.064 1.00 50.00 O ATOM 0 H ASP A 759 -11.996 4.228 10.457 1.00 25.00 H new ATOM 0 HA ASP A 759 -14.047 5.634 9.234 1.00 25.00 H new ATOM 0 HB2 ASP A 759 -13.937 3.243 10.229 1.00 25.00 H new ATOM 0 HB3 ASP A 759 -14.441 3.998 11.728 1.00 25.00 H new ATOM 305 N ARG A 760 -14.499 7.623 10.453 1.00 25.00 N ATOM 306 CA ARG A 760 -14.800 8.903 11.105 1.00 25.00 C ATOM 307 C ARG A 760 -15.876 8.777 12.165 1.00 25.00 C ATOM 308 O ARG A 760 -15.850 9.486 13.162 1.00 25.00 O ATOM 309 CB ARG A 760 -15.273 9.908 10.051 1.00 25.00 C ATOM 310 CG ARG A 760 -14.496 11.161 9.936 1.00 25.00 C ATOM 311 CD ARG A 760 -14.302 11.303 8.456 1.00 25.00 C ATOM 312 NE ARG A 760 -13.826 12.628 8.026 1.00 25.00 N ATOM 313 CZ ARG A 760 -12.561 13.029 8.027 1.00 25.00 C ATOM 314 NH1 ARG A 760 -11.578 12.273 8.457 1.00 25.00 N ATOM 315 NH2 ARG A 760 -12.289 14.220 7.584 1.00 25.00 N ATOM 0 H ARG A 760 -14.593 7.646 9.438 1.00 25.00 H new ATOM 0 HA ARG A 760 -13.885 9.239 11.592 1.00 25.00 H new ATOM 0 HB2 ARG A 760 -15.266 9.412 9.080 1.00 25.00 H new ATOM 0 HB3 ARG A 760 -16.309 10.168 10.269 1.00 25.00 H new ATOM 0 HG2 ARG A 760 -15.035 12.010 10.356 1.00 25.00 H new ATOM 0 HG3 ARG A 760 -13.544 11.096 10.463 1.00 25.00 H new ATOM 0 HD2 ARG A 760 -13.589 10.549 8.122 1.00 25.00 H new ATOM 0 HD3 ARG A 760 -15.247 11.091 7.957 1.00 25.00 H new ATOM 0 HE ARG A 760 -14.527 13.293 7.700 1.00 25.00 H new ATOM 0 HH11 ARG A 760 -11.772 11.336 8.809 1.00 25.00 H new ATOM 0 HH12 ARG A 760 -10.620 12.623 8.439 1.00 25.00 H new ATOM 0 HH21 ARG A 760 -13.040 14.822 7.246 1.00 25.00 H new ATOM 0 HH22 ARG A 760 -11.325 14.553 7.574 1.00 25.00 H new ATOM 329 N ASP A 761 -16.852 7.922 11.908 1.00 25.00 N ATOM 330 CA ASP A 761 -17.973 7.729 12.827 1.00 25.00 C ATOM 331 C ASP A 761 -17.989 6.311 13.399 1.00 25.00 C ATOM 332 O ASP A 761 -18.848 5.983 14.210 1.00 25.00 O ATOM 333 CB ASP A 761 -19.285 8.052 12.111 1.00 25.00 C ATOM 334 CG ASP A 761 -19.449 7.265 10.845 1.00 25.00 C ATOM 335 OD1 ASP A 761 -19.103 6.087 10.861 1.00 50.00 O ATOM 336 OD2 ASP A 761 -19.749 7.825 9.779 1.00 50.00 O ATOM 0 H ASP A 761 -16.895 7.346 11.068 1.00 25.00 H new ATOM 0 HA ASP A 761 -17.854 8.410 13.670 1.00 25.00 H new ATOM 0 HB2 ASP A 761 -20.122 7.843 12.778 1.00 25.00 H new ATOM 0 HB3 ASP A 761 -19.319 9.117 11.882 1.00 25.00 H new ATOM 341 N HIS A 762 -17.061 5.474 12.936 1.00 25.00 N ATOM 342 CA HIS A 762 -16.966 4.072 13.374 1.00 25.00 C ATOM 343 C HIS A 762 -18.213 3.211 13.057 1.00 25.00 C ATOM 344 O HIS A 762 -18.516 2.246 13.752 1.00 25.00 O ATOM 345 CB HIS A 762 -16.596 4.000 14.864 1.00 25.00 C ATOM 346 CG HIS A 762 -15.760 2.810 15.220 1.00 25.00 C ATOM 347 ND1 HIS A 762 -14.388 2.779 15.154 1.00 25.00 N ATOM 348 CD2 HIS A 762 -16.120 1.574 15.665 1.00 25.00 C ATOM 349 CE1 HIS A 762 -13.980 1.581 15.559 1.00 25.00 C ATOM 350 NE2 HIS A 762 -14.994 0.801 15.876 1.00 25.00 N ATOM 0 H HIS A 762 -16.355 5.742 12.250 1.00 25.00 H new ATOM 0 HA HIS A 762 -16.167 3.628 12.781 1.00 25.00 H new ATOM 0 HB2 HIS A 762 -16.058 4.907 15.140 1.00 25.00 H new ATOM 0 HB3 HIS A 762 -17.511 3.980 15.456 1.00 25.00 H new ATOM 0 HD2 HIS A 762 -17.136 1.246 15.829 1.00 25.00 H new ATOM 0 HE1 HIS A 762 -12.944 1.283 15.621 1.00 25.00 H new ATOM 0 HE2 HIS A 762 -14.956 -0.164 16.205 1.00 25.00 H new ATOM 358 N SER A 763 -18.884 3.525 11.955 1.00 25.00 N ATOM 359 CA SER A 763 -20.029 2.761 11.464 1.00 25.00 C ATOM 360 C SER A 763 -19.643 1.378 10.931 1.00 25.00 C ATOM 361 O SER A 763 -20.502 0.551 10.640 1.00 25.00 O ATOM 362 CB SER A 763 -20.711 3.559 10.344 1.00 25.00 C ATOM 363 OG SER A 763 -19.808 3.876 9.272 1.00 25.00 O ATOM 0 H SER A 763 -18.647 4.326 11.369 1.00 25.00 H new ATOM 0 HA SER A 763 -20.701 2.602 12.307 1.00 25.00 H new ATOM 0 HB2 SER A 763 -21.550 2.985 9.951 1.00 25.00 H new ATOM 0 HB3 SER A 763 -21.121 4.481 10.756 1.00 25.00 H new ATOM 0 HG SER A 763 -19.318 4.697 9.489 1.00 25.00 H new ATOM 369 N GLY A 764 -18.351 1.152 10.755 1.00 25.00 N ATOM 370 CA GLY A 764 -17.857 -0.116 10.237 1.00 25.00 C ATOM 371 C GLY A 764 -17.819 -0.042 8.730 1.00 25.00 C ATOM 372 O GLY A 764 -17.762 -1.044 8.020 1.00 25.00 O ATOM 0 H GLY A 764 -17.621 1.833 10.964 1.00 25.00 H new ATOM 0 HA2 GLY A 764 -16.862 -0.323 10.630 1.00 25.00 H new ATOM 0 HA3 GLY A 764 -18.503 -0.933 10.559 1.00 25.00 H new ATOM 376 N THR A 765 -17.910 1.182 8.245 1.00 25.00 N ATOM 377 CA THR A 765 -17.912 1.484 6.823 1.00 25.00 C ATOM 378 C THR A 765 -17.400 2.908 6.632 1.00 25.00 C ATOM 379 O THR A 765 -17.818 3.831 7.346 1.00 25.00 O ATOM 380 CB THR A 765 -19.333 1.423 6.248 1.00 25.00 C ATOM 381 OG1 THR A 765 -20.257 1.920 7.222 1.00 25.00 O ATOM 382 CG2 THR A 765 -19.747 0.007 5.876 1.00 25.00 C ATOM 0 H THR A 765 -17.986 2.009 8.837 1.00 25.00 H new ATOM 0 HA THR A 765 -17.284 0.753 6.314 1.00 25.00 H new ATOM 0 HB THR A 765 -19.343 2.030 5.343 1.00 25.00 H new ATOM 0 HG1 THR A 765 -19.829 2.627 7.748 1.00 25.00 H new ATOM 0 HG21 THR A 765 -20.760 0.018 5.474 1.00 25.00 H new ATOM 0 HG22 THR A 765 -19.063 -0.387 5.124 1.00 25.00 H new ATOM 0 HG23 THR A 765 -19.715 -0.626 6.763 1.00 25.00 H new ATOM 390 N LEU A 766 -16.536 3.128 5.658 1.00 25.00 N ATOM 391 CA LEU A 766 -16.029 4.478 5.411 1.00 25.00 C ATOM 392 C LEU A 766 -16.881 5.130 4.322 1.00 25.00 C ATOM 393 O LEU A 766 -17.047 4.578 3.273 1.00 25.00 O ATOM 394 CB LEU A 766 -14.548 4.444 4.992 1.00 25.00 C ATOM 395 CG LEU A 766 -13.429 4.434 6.073 1.00 25.00 C ATOM 396 CD1 LEU A 766 -13.519 5.656 6.844 1.00 25.00 C ATOM 397 CD2 LEU A 766 -13.463 3.268 7.025 1.00 25.00 C ATOM 0 H LEU A 766 -16.172 2.409 5.032 1.00 25.00 H new ATOM 0 HA LEU A 766 -16.094 5.062 6.329 1.00 25.00 H new ATOM 0 HB2 LEU A 766 -14.407 3.558 4.373 1.00 25.00 H new ATOM 0 HB3 LEU A 766 -14.373 5.310 4.353 1.00 25.00 H new ATOM 0 HG LEU A 766 -12.491 4.345 5.525 1.00 25.00 H new ATOM 0 HD11 LEU A 766 -12.740 5.663 7.606 1.00 25.00 H new ATOM 0 HD12 LEU A 766 -13.388 6.513 6.184 1.00 25.00 H new ATOM 0 HD13 LEU A 766 -14.496 5.713 7.323 1.00 25.00 H new ATOM 0 HD21 LEU A 766 -12.643 3.356 7.737 1.00 25.00 H new ATOM 0 HD22 LEU A 766 -14.411 3.265 7.562 1.00 25.00 H new ATOM 0 HD23 LEU A 766 -13.360 2.338 6.465 1.00 25.00 H new ATOM 409 N GLY A 767 -17.451 6.291 4.589 1.00 25.00 N ATOM 410 CA GLY A 767 -18.294 6.978 3.621 1.00 25.00 C ATOM 411 C GLY A 767 -17.431 7.722 2.635 1.00 25.00 C ATOM 412 O GLY A 767 -16.260 7.459 2.584 1.00 25.00 O ATOM 0 H GLY A 767 -17.345 6.783 5.476 1.00 25.00 H new ATOM 0 HA2 GLY A 767 -18.924 6.259 3.098 1.00 25.00 H new ATOM 0 HA3 GLY A 767 -18.960 7.673 4.133 1.00 25.00 H new ATOM 416 N PRO A 768 -17.949 8.674 1.864 1.00 25.00 N ATOM 417 CA PRO A 768 -17.096 9.333 0.866 1.00 25.00 C ATOM 418 C PRO A 768 -15.904 10.111 1.448 1.00 25.00 C ATOM 419 O PRO A 768 -14.755 9.787 1.174 1.00 25.00 O ATOM 420 CB PRO A 768 -18.081 10.259 0.139 1.00 25.00 C ATOM 421 CG PRO A 768 -19.176 10.492 1.133 1.00 25.00 C ATOM 422 CD PRO A 768 -19.323 9.190 1.845 1.00 25.00 C ATOM 0 HA PRO A 768 -16.603 8.605 0.222 1.00 25.00 H new ATOM 0 HB2 PRO A 768 -17.605 11.195 -0.154 1.00 25.00 H new ATOM 0 HB3 PRO A 768 -18.463 9.797 -0.772 1.00 25.00 H new ATOM 0 HG2 PRO A 768 -18.919 11.295 1.824 1.00 25.00 H new ATOM 0 HG3 PRO A 768 -20.104 10.781 0.640 1.00 25.00 H new ATOM 0 HD2 PRO A 768 -19.720 9.322 2.852 1.00 25.00 H new ATOM 0 HD3 PRO A 768 -20.001 8.516 1.321 1.00 25.00 H new ATOM 430 N GLU A 769 -16.178 11.112 2.274 1.00 25.00 N ATOM 431 CA GLU A 769 -15.131 11.960 2.860 1.00 25.00 C ATOM 432 C GLU A 769 -14.308 11.145 3.853 1.00 25.00 C ATOM 433 O GLU A 769 -13.184 11.485 4.212 1.00 25.00 O ATOM 434 CB GLU A 769 -15.802 13.128 3.600 1.00 25.00 C ATOM 435 CG GLU A 769 -14.861 14.222 4.105 1.00 25.00 C ATOM 436 CD GLU A 769 -15.427 14.924 5.329 1.00 25.00 C ATOM 437 OE1 GLU A 769 -16.541 15.470 5.244 1.00 25.00 O ATOM 438 OE2 GLU A 769 -14.775 14.876 6.401 1.00 25.00 O ATOM 0 H GLU A 769 -17.124 11.364 2.560 1.00 25.00 H new ATOM 0 HA GLU A 769 -14.477 12.337 2.073 1.00 25.00 H new ATOM 0 HB2 GLU A 769 -16.534 13.584 2.933 1.00 25.00 H new ATOM 0 HB3 GLU A 769 -16.352 12.727 4.451 1.00 25.00 H new ATOM 0 HG2 GLU A 769 -13.893 13.786 4.350 1.00 25.00 H new ATOM 0 HG3 GLU A 769 -14.691 14.951 3.313 1.00 25.00 H new ATOM 445 N GLU A 770 -14.880 10.044 4.290 1.00 25.00 N ATOM 446 CA GLU A 770 -14.192 9.197 5.244 1.00 25.00 C ATOM 447 C GLU A 770 -13.218 8.261 4.495 1.00 25.00 C ATOM 448 O GLU A 770 -12.063 8.114 4.877 1.00 25.00 O ATOM 449 CB GLU A 770 -15.179 8.369 6.075 1.00 25.00 C ATOM 450 CG GLU A 770 -16.490 9.002 6.521 1.00 25.00 C ATOM 451 CD GLU A 770 -17.282 8.002 7.393 1.00 25.00 C ATOM 452 OE1 GLU A 770 -16.768 7.569 8.426 1.00 50.00 O ATOM 453 OE2 GLU A 770 -18.305 7.460 6.938 1.00 50.00 O ATOM 0 H GLU A 770 -15.804 9.717 4.007 1.00 25.00 H new ATOM 0 HA GLU A 770 -13.636 9.837 5.929 1.00 25.00 H new ATOM 0 HB2 GLU A 770 -15.425 7.477 5.499 1.00 25.00 H new ATOM 0 HB3 GLU A 770 -14.655 8.036 6.970 1.00 25.00 H new ATOM 0 HG2 GLU A 770 -16.291 9.913 7.085 1.00 25.00 H new ATOM 0 HG3 GLU A 770 -17.081 9.288 5.651 1.00 25.00 H new ATOM 460 N PHE A 771 -13.694 7.638 3.424 1.00 25.00 N ATOM 461 CA PHE A 771 -12.899 6.693 2.620 1.00 25.00 C ATOM 462 C PHE A 771 -11.686 7.356 2.045 1.00 25.00 C ATOM 463 O PHE A 771 -10.590 6.801 2.068 1.00 25.00 O ATOM 464 CB PHE A 771 -13.757 6.151 1.468 1.00 25.00 C ATOM 465 CG PHE A 771 -13.002 5.291 0.472 1.00 25.00 C ATOM 466 CD1 PHE A 771 -12.256 4.182 0.906 1.00 25.00 C ATOM 467 CD2 PHE A 771 -13.073 5.569 -0.914 1.00 25.00 C ATOM 468 CE1 PHE A 771 -11.600 3.331 -0.021 1.00 25.00 C ATOM 469 CE2 PHE A 771 -12.412 4.732 -1.863 1.00 25.00 C ATOM 470 CZ PHE A 771 -11.683 3.602 -1.409 1.00 25.00 C ATOM 0 H PHE A 771 -14.645 7.769 3.080 1.00 25.00 H new ATOM 0 HA PHE A 771 -12.579 5.881 3.274 1.00 25.00 H new ATOM 0 HB2 PHE A 771 -14.576 5.566 1.886 1.00 25.00 H new ATOM 0 HB3 PHE A 771 -14.204 6.992 0.938 1.00 25.00 H new ATOM 0 HD1 PHE A 771 -12.181 3.974 1.963 1.00 25.00 H new ATOM 0 HD2 PHE A 771 -13.634 6.425 -1.258 1.00 25.00 H new ATOM 0 HE1 PHE A 771 -11.038 2.478 0.331 1.00 25.00 H new ATOM 0 HE2 PHE A 771 -12.466 4.957 -2.918 1.00 25.00 H new ATOM 0 HZ PHE A 771 -11.194 2.951 -2.119 1.00 25.00 H new ATOM 480 N LYS A 772 -11.869 8.574 1.570 1.00 25.00 N ATOM 481 CA LYS A 772 -10.791 9.312 0.972 1.00 25.00 C ATOM 482 C LYS A 772 -9.741 9.641 2.025 1.00 25.00 C ATOM 483 O LYS A 772 -8.609 9.896 1.681 1.00 25.00 O ATOM 484 CB LYS A 772 -11.336 10.541 0.236 1.00 25.00 C ATOM 485 CG LYS A 772 -12.047 11.557 1.104 1.00 25.00 C ATOM 486 CD LYS A 772 -11.142 12.646 1.597 1.00 25.00 C ATOM 487 CE LYS A 772 -10.620 13.521 0.446 1.00 25.00 C ATOM 488 NZ LYS A 772 -11.190 14.911 0.415 1.00 25.00 N ATOM 0 H LYS A 772 -12.761 9.068 1.591 1.00 25.00 H new ATOM 0 HA LYS A 772 -10.290 8.706 0.217 1.00 25.00 H new ATOM 0 HB2 LYS A 772 -10.508 11.037 -0.270 1.00 25.00 H new ATOM 0 HB3 LYS A 772 -12.026 10.204 -0.538 1.00 25.00 H new ATOM 0 HG2 LYS A 772 -12.865 12.001 0.537 1.00 25.00 H new ATOM 0 HG3 LYS A 772 -12.492 11.048 1.959 1.00 25.00 H new ATOM 0 HD2 LYS A 772 -11.679 13.269 2.312 1.00 25.00 H new ATOM 0 HD3 LYS A 772 -10.299 12.205 2.129 1.00 25.00 H new ATOM 0 HE2 LYS A 772 -9.535 13.588 0.520 1.00 25.00 H new ATOM 0 HE3 LYS A 772 -10.845 13.028 -0.500 1.00 25.00 H new ATOM 0 HZ1 LYS A 772 -10.449 15.584 0.131 1.00 25.00 H new ATOM 0 HZ2 LYS A 772 -11.973 14.950 -0.268 1.00 25.00 H new ATOM 0 HZ3 LYS A 772 -11.542 15.163 1.360 1.00 25.00 H new ATOM 502 N ALA A 773 -10.124 9.679 3.303 1.00 25.00 N ATOM 503 CA ALA A 773 -9.176 10.023 4.358 1.00 25.00 C ATOM 504 C ALA A 773 -8.400 8.770 4.769 1.00 25.00 C ATOM 505 O ALA A 773 -7.224 8.836 5.089 1.00 25.00 O ATOM 506 CB ALA A 773 -9.915 10.619 5.562 1.00 25.00 C ATOM 0 H ALA A 773 -11.070 9.479 3.627 1.00 25.00 H new ATOM 0 HA ALA A 773 -8.475 10.771 3.986 1.00 25.00 H new ATOM 0 HB1 ALA A 773 -9.196 10.871 6.342 1.00 25.00 H new ATOM 0 HB2 ALA A 773 -10.446 11.519 5.253 1.00 25.00 H new ATOM 0 HB3 ALA A 773 -10.628 9.891 5.948 1.00 25.00 H new ATOM 512 N CYS A 774 -9.067 7.624 4.724 1.00 25.00 N ATOM 513 CA CYS A 774 -8.420 6.347 5.026 1.00 25.00 C ATOM 514 C CYS A 774 -7.327 6.086 4.010 1.00 25.00 C ATOM 515 O CYS A 774 -6.212 5.701 4.341 1.00 25.00 O ATOM 516 CB CYS A 774 -9.458 5.219 4.961 1.00 25.00 C ATOM 517 SG CYS A 774 -8.810 3.608 5.469 1.00 25.00 S ATOM 0 H CYS A 774 -10.055 7.549 4.482 1.00 25.00 H new ATOM 0 HA CYS A 774 -7.988 6.385 6.026 1.00 25.00 H new ATOM 0 HB2 CYS A 774 -10.304 5.478 5.598 1.00 25.00 H new ATOM 0 HB3 CYS A 774 -9.837 5.144 3.942 1.00 25.00 H new ATOM 0 HG CYS A 774 -9.752 2.716 5.386 1.00 25.00 H new ATOM 523 N LEU A 775 -7.683 6.327 2.764 1.00 25.00 N ATOM 524 CA LEU A 775 -6.809 6.112 1.617 1.00 25.00 C ATOM 525 C LEU A 775 -5.511 6.932 1.603 1.00 25.00 C ATOM 526 O LEU A 775 -4.565 6.585 0.905 1.00 25.00 O ATOM 527 CB LEU A 775 -7.598 6.454 0.364 1.00 25.00 C ATOM 528 CG LEU A 775 -8.498 5.386 -0.269 1.00 25.00 C ATOM 529 CD1 LEU A 775 -9.182 6.050 -1.479 1.00 25.00 C ATOM 530 CD2 LEU A 775 -7.699 4.178 -0.728 1.00 25.00 C ATOM 0 H LEU A 775 -8.604 6.685 2.511 1.00 25.00 H new ATOM 0 HA LEU A 775 -6.495 5.070 1.671 1.00 25.00 H new ATOM 0 HB2 LEU A 775 -8.224 7.315 0.596 1.00 25.00 H new ATOM 0 HB3 LEU A 775 -6.885 6.774 -0.396 1.00 25.00 H new ATOM 0 HG LEU A 775 -9.222 5.026 0.462 1.00 25.00 H new ATOM 0 HD11 LEU A 775 -9.837 5.329 -1.968 1.00 25.00 H new ATOM 0 HD12 LEU A 775 -9.770 6.904 -1.141 1.00 25.00 H new ATOM 0 HD13 LEU A 775 -8.424 6.388 -2.185 1.00 25.00 H new ATOM 0 HD21 LEU A 775 -8.372 3.444 -1.171 1.00 25.00 H new ATOM 0 HD22 LEU A 775 -6.963 4.489 -1.469 1.00 25.00 H new ATOM 0 HD23 LEU A 775 -7.188 3.734 0.126 1.00 25.00 H new ATOM 542 N ILE A 776 -5.458 8.005 2.376 1.00 25.00 N ATOM 543 CA ILE A 776 -4.276 8.861 2.440 1.00 25.00 C ATOM 544 C ILE A 776 -3.101 8.046 2.960 1.00 25.00 C ATOM 545 O ILE A 776 -1.977 8.177 2.485 1.00 25.00 O ATOM 546 CB ILE A 776 -4.500 10.072 3.395 1.00 25.00 C ATOM 547 CG1 ILE A 776 -5.731 10.870 2.945 1.00 25.00 C ATOM 548 CG2 ILE A 776 -3.266 10.991 3.409 1.00 25.00 C ATOM 549 CD1 ILE A 776 -6.108 12.046 3.837 1.00 25.00 C ATOM 0 H ILE A 776 -6.226 8.309 2.975 1.00 25.00 H new ATOM 0 HA ILE A 776 -4.077 9.240 1.438 1.00 25.00 H new ATOM 0 HB ILE A 776 -4.661 9.690 4.403 1.00 25.00 H new ATOM 0 HG12 ILE A 776 -5.553 11.243 1.937 1.00 25.00 H new ATOM 0 HG13 ILE A 776 -6.582 10.191 2.888 1.00 25.00 H new ATOM 0 HG21 ILE A 776 -3.444 11.830 4.082 1.00 25.00 H new ATOM 0 HG22 ILE A 776 -2.398 10.429 3.752 1.00 25.00 H new ATOM 0 HG23 ILE A 776 -3.081 11.367 2.403 1.00 25.00 H new ATOM 0 HD11 ILE A 776 -6.990 12.542 3.431 1.00 25.00 H new ATOM 0 HD12 ILE A 776 -6.325 11.685 4.842 1.00 25.00 H new ATOM 0 HD13 ILE A 776 -5.279 12.753 3.876 1.00 25.00 H new ATOM 561 N SER A 777 -3.379 7.177 3.921 1.00 25.00 N ATOM 562 CA SER A 777 -2.331 6.369 4.544 1.00 25.00 C ATOM 563 C SER A 777 -1.919 5.187 3.683 1.00 25.00 C ATOM 564 O SER A 777 -0.995 4.468 4.032 1.00 25.00 O ATOM 565 CB SER A 777 -2.807 5.863 5.900 1.00 25.00 C ATOM 566 OG SER A 777 -3.077 6.961 6.755 1.00 25.00 O ATOM 0 H SER A 777 -4.316 7.011 4.288 1.00 25.00 H new ATOM 0 HA SER A 777 -1.458 7.011 4.662 1.00 25.00 H new ATOM 0 HB2 SER A 777 -3.704 5.257 5.777 1.00 25.00 H new ATOM 0 HB3 SER A 777 -2.047 5.221 6.346 1.00 25.00 H new ATOM 0 HG SER A 777 -3.948 6.834 7.185 1.00 25.00 H new ATOM 572 N LEU A 778 -2.612 4.991 2.570 1.00 25.00 N ATOM 573 CA LEU A 778 -2.296 3.902 1.651 1.00 25.00 C ATOM 574 C LEU A 778 -1.591 4.451 0.416 1.00 25.00 C ATOM 575 O LEU A 778 -1.006 3.699 -0.336 1.00 25.00 O ATOM 576 CB LEU A 778 -3.566 3.133 1.232 1.00 25.00 C ATOM 577 CG LEU A 778 -4.197 2.135 2.227 1.00 25.00 C ATOM 578 CD1 LEU A 778 -3.198 1.055 2.646 1.00 25.00 C ATOM 579 CD2 LEU A 778 -4.764 2.832 3.476 1.00 25.00 C ATOM 0 H LEU A 778 -3.398 5.572 2.280 1.00 25.00 H new ATOM 0 HA LEU A 778 -1.635 3.206 2.168 1.00 25.00 H new ATOM 0 HB2 LEU A 778 -4.328 3.870 0.976 1.00 25.00 H new ATOM 0 HB3 LEU A 778 -3.333 2.585 0.319 1.00 25.00 H new ATOM 0 HG LEU A 778 -5.026 1.664 1.699 1.00 25.00 H new ATOM 0 HD11 LEU A 778 -3.675 0.370 3.346 1.00 25.00 H new ATOM 0 HD12 LEU A 778 -2.869 0.503 1.766 1.00 25.00 H new ATOM 0 HD13 LEU A 778 -2.337 1.522 3.125 1.00 25.00 H new ATOM 0 HD21 LEU A 778 -5.196 2.087 4.144 1.00 25.00 H new ATOM 0 HD22 LEU A 778 -3.963 3.361 3.992 1.00 25.00 H new ATOM 0 HD23 LEU A 778 -5.535 3.543 3.178 1.00 25.00 H new ATOM 591 N GLY A 779 -1.614 5.764 0.211 1.00 25.00 N ATOM 592 CA GLY A 779 -0.921 6.299 -0.951 1.00 25.00 C ATOM 593 C GLY A 779 -1.785 6.206 -2.193 1.00 25.00 C ATOM 594 O GLY A 779 -1.395 5.690 -3.228 1.00 25.00 O ATOM 0 H GLY A 779 -2.082 6.449 0.805 1.00 25.00 H new ATOM 0 HA2 GLY A 779 -0.650 7.339 -0.770 1.00 25.00 H new ATOM 0 HA3 GLY A 779 0.008 5.751 -1.109 1.00 25.00 H new ATOM 598 N TYR A 780 -2.990 6.729 -2.062 1.00 25.00 N ATOM 599 CA TYR A 780 -3.959 6.769 -3.154 1.00 25.00 C ATOM 600 C TYR A 780 -3.543 7.541 -4.427 1.00 25.00 C ATOM 601 O TYR A 780 -2.626 8.348 -4.411 1.00 25.00 O ATOM 602 CB TYR A 780 -5.296 7.302 -2.627 1.00 25.00 C ATOM 603 CG TYR A 780 -5.277 8.669 -1.943 1.00 25.00 C ATOM 604 CD1 TYR A 780 -4.093 9.418 -1.798 1.00 25.00 C ATOM 605 CD2 TYR A 780 -6.468 9.217 -1.435 1.00 25.00 C ATOM 606 CE1 TYR A 780 -4.098 10.682 -1.178 1.00 25.00 C ATOM 607 CE2 TYR A 780 -6.483 10.484 -0.827 1.00 25.00 C ATOM 608 CZ TYR A 780 -5.296 11.213 -0.709 1.00 25.00 C ATOM 609 OH TYR A 780 -5.293 12.463 -0.140 1.00 25.00 O ATOM 0 H TYR A 780 -3.331 7.141 -1.193 1.00 25.00 H new ATOM 0 HA TYR A 780 -4.035 5.735 -3.492 1.00 25.00 H new ATOM 0 HB2 TYR A 780 -5.994 7.351 -3.463 1.00 25.00 H new ATOM 0 HB3 TYR A 780 -5.696 6.575 -1.920 1.00 25.00 H new ATOM 0 HD1 TYR A 780 -3.163 9.015 -2.170 1.00 25.00 H new ATOM 0 HD2 TYR A 780 -7.387 8.655 -1.513 1.00 25.00 H new ATOM 0 HE1 TYR A 780 -3.178 11.236 -1.067 1.00 25.00 H new ATOM 0 HE2 TYR A 780 -7.409 10.893 -0.452 1.00 25.00 H new ATOM 0 HH TYR A 780 -6.203 12.698 0.138 1.00 25.00 H new ATOM 619 N ASP A 781 -4.254 7.282 -5.521 1.00 25.00 N ATOM 620 CA ASP A 781 -3.962 7.858 -6.846 1.00 25.00 C ATOM 621 C ASP A 781 -4.737 9.152 -7.060 1.00 25.00 C ATOM 622 O ASP A 781 -4.831 9.675 -8.168 1.00 25.00 O ATOM 623 CB ASP A 781 -4.324 6.849 -7.958 1.00 25.00 C ATOM 624 CG ASP A 781 -5.838 6.610 -8.086 1.00 25.00 C ATOM 625 OD1 ASP A 781 -6.493 6.351 -7.050 1.00 25.00 O ATOM 626 OD2 ASP A 781 -6.356 6.591 -9.227 1.00 25.00 O ATOM 0 H ASP A 781 -5.061 6.659 -5.520 1.00 25.00 H new ATOM 0 HA ASP A 781 -2.895 8.079 -6.890 1.00 25.00 H new ATOM 0 HB2 ASP A 781 -3.938 7.213 -8.910 1.00 25.00 H new ATOM 0 HB3 ASP A 781 -3.828 5.900 -7.755 1.00 25.00 H new ATOM 631 N ILE A 782 -5.294 9.652 -5.974 1.00 25.00 N ATOM 632 CA ILE A 782 -6.064 10.886 -5.970 1.00 25.00 C ATOM 633 C ILE A 782 -5.515 11.772 -4.876 1.00 25.00 C ATOM 634 O ILE A 782 -4.736 11.325 -4.055 1.00 25.00 O ATOM 635 CB ILE A 782 -7.566 10.630 -5.747 1.00 25.00 C ATOM 636 CG1 ILE A 782 -7.787 9.728 -4.514 1.00 25.00 C ATOM 637 CG2 ILE A 782 -8.157 10.106 -7.051 1.00 25.00 C ATOM 638 CD1 ILE A 782 -8.235 8.300 -4.807 1.00 25.00 C ATOM 0 H ILE A 782 -5.225 9.209 -5.058 1.00 25.00 H new ATOM 0 HA ILE A 782 -5.971 11.367 -6.944 1.00 25.00 H new ATOM 0 HB ILE A 782 -8.102 11.548 -5.504 1.00 25.00 H new ATOM 0 HG12 ILE A 782 -6.858 9.688 -3.946 1.00 25.00 H new ATOM 0 HG13 ILE A 782 -8.533 10.198 -3.873 1.00 25.00 H new ATOM 0 HG21 ILE A 782 -9.222 9.917 -6.918 1.00 25.00 H new ATOM 0 HG22 ILE A 782 -8.016 10.847 -7.838 1.00 25.00 H new ATOM 0 HG23 ILE A 782 -7.656 9.179 -7.331 1.00 25.00 H new ATOM 0 HD11 ILE A 782 -8.359 7.758 -3.869 1.00 25.00 H new ATOM 0 HD12 ILE A 782 -9.184 8.319 -5.343 1.00 25.00 H new ATOM 0 HD13 ILE A 782 -7.483 7.801 -5.418 1.00 25.00 H new ATOM 650 N GLY A 783 -5.928 13.026 -4.848 1.00 25.00 N ATOM 651 CA GLY A 783 -5.467 13.921 -3.813 1.00 25.00 C ATOM 652 C GLY A 783 -6.499 14.973 -3.503 1.00 25.00 C ATOM 653 O GLY A 783 -7.627 14.909 -3.985 1.00 25.00 O ATOM 0 H GLY A 783 -6.573 13.440 -5.522 1.00 25.00 H new ATOM 0 HA2 GLY A 783 -5.241 13.352 -2.911 1.00 25.00 H new ATOM 0 HA3 GLY A 783 -4.540 14.399 -4.129 1.00 25.00 H new ATOM 657 N ASN A 784 -6.113 15.953 -2.701 1.00 25.00 N ATOM 658 CA ASN A 784 -7.013 17.040 -2.315 1.00 25.00 C ATOM 659 C ASN A 784 -6.992 18.129 -3.399 1.00 25.00 C ATOM 660 O ASN A 784 -6.698 19.297 -3.136 1.00 25.00 O ATOM 661 CB ASN A 784 -6.600 17.588 -0.940 1.00 25.00 C ATOM 662 CG ASN A 784 -7.728 18.311 -0.235 1.00 25.00 C ATOM 663 OD1 ASN A 784 -8.367 17.759 0.649 1.00 25.00 O ATOM 664 ND2 ASN A 784 -7.967 19.537 -0.604 1.00 25.00 N ATOM 0 H ASN A 784 -5.178 16.022 -2.300 1.00 25.00 H new ATOM 0 HA ASN A 784 -8.036 16.673 -2.230 1.00 25.00 H new ATOM 0 HB2 ASN A 784 -6.255 16.765 -0.314 1.00 25.00 H new ATOM 0 HB3 ASN A 784 -5.758 18.270 -1.063 1.00 25.00 H new ATOM 0 HD21 ASN A 784 -8.709 20.070 -0.151 1.00 25.00 H new ATOM 0 HD22 ASN A 784 -7.412 19.964 -1.346 1.00 25.00 H new ATOM 671 N ASP A 785 -7.274 17.720 -4.625 1.00 25.00 N ATOM 672 CA ASP A 785 -7.298 18.617 -5.776 1.00 25.00 C ATOM 673 C ASP A 785 -8.623 18.394 -6.506 1.00 25.00 C ATOM 674 O ASP A 785 -9.307 17.400 -6.263 1.00 25.00 O ATOM 675 CB ASP A 785 -6.090 18.369 -6.685 1.00 25.00 C ATOM 676 CG ASP A 785 -6.371 17.370 -7.750 1.00 25.00 C ATOM 677 OD1 ASP A 785 -6.442 16.175 -7.441 1.00 25.00 O ATOM 678 OD2 ASP A 785 -6.625 17.789 -8.897 1.00 25.00 O ATOM 0 H ASP A 785 -7.495 16.751 -4.854 1.00 25.00 H new ATOM 0 HA ASP A 785 -7.229 19.657 -5.458 1.00 25.00 H new ATOM 0 HB2 ASP A 785 -5.787 19.310 -7.145 1.00 25.00 H new ATOM 0 HB3 ASP A 785 -5.250 18.025 -6.081 1.00 25.00 H new ATOM 683 N PRO A 786 -9.038 19.335 -7.370 1.00 25.00 N ATOM 684 CA PRO A 786 -10.384 19.200 -7.930 1.00 25.00 C ATOM 685 C PRO A 786 -10.520 18.094 -8.963 1.00 25.00 C ATOM 686 O PRO A 786 -11.632 17.704 -9.307 1.00 25.00 O ATOM 687 CB PRO A 786 -10.623 20.572 -8.563 1.00 25.00 C ATOM 688 CG PRO A 786 -9.274 21.010 -8.984 1.00 25.00 C ATOM 689 CD PRO A 786 -8.366 20.547 -7.872 1.00 25.00 C ATOM 0 HA PRO A 786 -11.108 18.919 -7.165 1.00 25.00 H new ATOM 0 HB2 PRO A 786 -11.305 20.507 -9.411 1.00 25.00 H new ATOM 0 HB3 PRO A 786 -11.065 21.269 -7.851 1.00 25.00 H new ATOM 0 HG2 PRO A 786 -8.992 20.566 -9.939 1.00 25.00 H new ATOM 0 HG3 PRO A 786 -9.229 22.092 -9.110 1.00 25.00 H new ATOM 0 HD2 PRO A 786 -7.362 20.329 -8.236 1.00 25.00 H new ATOM 0 HD3 PRO A 786 -8.265 21.303 -7.093 1.00 25.00 H new ATOM 697 N GLN A 787 -9.404 17.583 -9.464 1.00 25.00 N ATOM 698 CA GLN A 787 -9.462 16.512 -10.447 1.00 25.00 C ATOM 699 C GLN A 787 -9.526 15.202 -9.690 1.00 25.00 C ATOM 700 O GLN A 787 -10.330 14.334 -10.003 1.00 25.00 O ATOM 701 CB GLN A 787 -8.232 16.527 -11.356 1.00 25.00 C ATOM 702 CG GLN A 787 -7.983 17.839 -12.027 1.00 25.00 C ATOM 703 CD GLN A 787 -6.746 17.803 -12.757 1.00 25.00 C ATOM 704 OE1 GLN A 787 -6.620 17.927 -13.965 1.00 25.00 O ATOM 705 NE2 GLN A 787 -5.781 17.675 -11.970 1.00 25.00 N ATOM 0 H GLN A 787 -8.463 17.886 -9.211 1.00 25.00 H new ATOM 0 HA GLN A 787 -10.338 16.642 -11.082 1.00 25.00 H new ATOM 0 HB2 GLN A 787 -7.355 16.261 -10.766 1.00 25.00 H new ATOM 0 HB3 GLN A 787 -8.348 15.757 -12.119 1.00 25.00 H new ATOM 0 HG2 GLN A 787 -8.805 18.070 -12.704 1.00 25.00 H new ATOM 0 HG3 GLN A 787 -7.950 18.635 -11.283 1.00 25.00 H new ATOM 0 HE21 GLN A 787 -5.949 17.575 -10.969 1.00 25.00 H new ATOM 0 HE22 GLN A 787 -4.827 17.671 -12.330 1.00 25.00 H new ATOM 714 N GLY A 788 -8.695 15.070 -8.667 1.00 25.00 N ATOM 715 CA GLY A 788 -8.642 13.832 -7.924 1.00 25.00 C ATOM 716 C GLY A 788 -9.895 13.575 -7.136 1.00 25.00 C ATOM 717 O GLY A 788 -10.285 12.446 -6.988 1.00 25.00 O ATOM 0 H GLY A 788 -8.059 15.797 -8.340 1.00 25.00 H new ATOM 0 HA2 GLY A 788 -8.476 13.005 -8.615 1.00 25.00 H new ATOM 0 HA3 GLY A 788 -7.789 13.856 -7.245 1.00 25.00 H new ATOM 721 N GLU A 789 -10.577 14.609 -6.684 1.00 25.00 N ATOM 722 CA GLU A 789 -11.837 14.406 -5.959 1.00 25.00 C ATOM 723 C GLU A 789 -12.919 13.834 -6.894 1.00 25.00 C ATOM 724 O GLU A 789 -13.829 13.132 -6.452 1.00 25.00 O ATOM 725 CB GLU A 789 -12.321 15.715 -5.330 1.00 25.00 C ATOM 726 CG GLU A 789 -11.460 16.191 -4.140 1.00 25.00 C ATOM 727 CD GLU A 789 -11.848 15.545 -2.806 1.00 25.00 C ATOM 728 OE1 GLU A 789 -11.708 14.314 -2.648 1.00 25.00 O ATOM 729 OE2 GLU A 789 -12.229 16.292 -1.874 1.00 25.00 O ATOM 0 H GLU A 789 -10.296 15.583 -6.797 1.00 25.00 H new ATOM 0 HA GLU A 789 -11.652 13.687 -5.161 1.00 25.00 H new ATOM 0 HB2 GLU A 789 -12.330 16.493 -6.094 1.00 25.00 H new ATOM 0 HB3 GLU A 789 -13.350 15.587 -4.994 1.00 25.00 H new ATOM 0 HG2 GLU A 789 -10.413 15.972 -4.349 1.00 25.00 H new ATOM 0 HG3 GLU A 789 -11.547 17.274 -4.049 1.00 25.00 H new ATOM 736 N ALA A 790 -12.806 14.091 -8.191 1.00 25.00 N ATOM 737 CA ALA A 790 -13.772 13.560 -9.150 1.00 25.00 C ATOM 738 C ALA A 790 -13.468 12.078 -9.390 1.00 25.00 C ATOM 739 O ALA A 790 -14.367 11.242 -9.484 1.00 25.00 O ATOM 740 CB ALA A 790 -13.696 14.350 -10.461 1.00 25.00 C ATOM 0 H ALA A 790 -12.064 14.658 -8.602 1.00 25.00 H new ATOM 0 HA ALA A 790 -14.783 13.658 -8.754 1.00 25.00 H new ATOM 0 HB1 ALA A 790 -14.419 13.948 -11.171 1.00 25.00 H new ATOM 0 HB2 ALA A 790 -13.922 15.399 -10.268 1.00 25.00 H new ATOM 0 HB3 ALA A 790 -12.693 14.266 -10.879 1.00 25.00 H new ATOM 746 N GLU A 791 -12.188 11.761 -9.458 1.00 25.00 N ATOM 747 CA GLU A 791 -11.737 10.389 -9.666 1.00 25.00 C ATOM 748 C GLU A 791 -11.958 9.562 -8.410 1.00 25.00 C ATOM 749 O GLU A 791 -12.327 8.395 -8.470 1.00 25.00 O ATOM 750 CB GLU A 791 -10.261 10.402 -10.018 1.00 25.00 C ATOM 751 CG GLU A 791 -9.973 11.168 -11.278 1.00 25.00 C ATOM 752 CD GLU A 791 -10.669 10.554 -12.490 1.00 25.00 C ATOM 753 OE1 GLU A 791 -10.553 9.322 -12.686 1.00 25.00 O ATOM 754 OE2 GLU A 791 -11.410 11.272 -13.190 1.00 25.00 O ATOM 0 H GLU A 791 -11.432 12.440 -9.372 1.00 25.00 H new ATOM 0 HA GLU A 791 -12.309 9.942 -10.479 1.00 25.00 H new ATOM 0 HB2 GLU A 791 -9.699 10.841 -9.194 1.00 25.00 H new ATOM 0 HB3 GLU A 791 -9.910 9.377 -10.133 1.00 25.00 H new ATOM 0 HG2 GLU A 791 -10.299 12.201 -11.157 1.00 25.00 H new ATOM 0 HG3 GLU A 791 -8.897 11.191 -11.451 1.00 25.00 H new ATOM 761 N PHE A 792 -11.802 10.199 -7.264 1.00 25.00 N ATOM 762 CA PHE A 792 -12.098 9.562 -5.988 1.00 25.00 C ATOM 763 C PHE A 792 -13.568 9.181 -5.999 1.00 25.00 C ATOM 764 O PHE A 792 -13.921 8.076 -5.608 1.00 25.00 O ATOM 765 CB PHE A 792 -11.774 10.485 -4.802 1.00 25.00 C ATOM 766 CG PHE A 792 -12.841 10.509 -3.747 1.00 25.00 C ATOM 767 CD1 PHE A 792 -13.092 9.377 -2.946 1.00 25.00 C ATOM 768 CD2 PHE A 792 -13.619 11.665 -3.558 1.00 25.00 C ATOM 769 CE1 PHE A 792 -14.129 9.397 -1.991 1.00 25.00 C ATOM 770 CE2 PHE A 792 -14.648 11.691 -2.605 1.00 25.00 C ATOM 771 CZ PHE A 792 -14.907 10.560 -1.831 1.00 25.00 C ATOM 0 H PHE A 792 -11.471 11.161 -7.188 1.00 25.00 H new ATOM 0 HA PHE A 792 -11.475 8.677 -5.862 1.00 25.00 H new ATOM 0 HB2 PHE A 792 -10.835 10.165 -4.350 1.00 25.00 H new ATOM 0 HB3 PHE A 792 -11.620 11.498 -5.173 1.00 25.00 H new ATOM 0 HD1 PHE A 792 -12.487 8.490 -3.064 1.00 25.00 H new ATOM 0 HD2 PHE A 792 -13.422 12.544 -4.154 1.00 25.00 H new ATOM 0 HE1 PHE A 792 -14.326 8.525 -1.385 1.00 25.00 H new ATOM 0 HE2 PHE A 792 -15.239 12.585 -2.471 1.00 25.00 H new ATOM 0 HZ PHE A 792 -15.707 10.576 -1.106 1.00 25.00 H new ATOM 781 N ALA A 793 -14.426 10.055 -6.507 1.00 25.00 N ATOM 782 CA ALA A 793 -15.847 9.749 -6.566 1.00 25.00 C ATOM 783 C ALA A 793 -16.154 8.638 -7.582 1.00 25.00 C ATOM 784 O ALA A 793 -17.054 7.822 -7.371 1.00 25.00 O ATOM 785 CB ALA A 793 -16.649 11.016 -6.882 1.00 25.00 C ATOM 0 H ALA A 793 -14.167 10.969 -6.879 1.00 25.00 H new ATOM 0 HA ALA A 793 -16.147 9.377 -5.586 1.00 25.00 H new ATOM 0 HB1 ALA A 793 -17.711 10.774 -6.923 1.00 25.00 H new ATOM 0 HB2 ALA A 793 -16.477 11.759 -6.104 1.00 25.00 H new ATOM 0 HB3 ALA A 793 -16.331 11.418 -7.844 1.00 25.00 H new ATOM 791 N ARG A 794 -15.364 8.561 -8.645 1.00 25.00 N ATOM 792 CA ARG A 794 -15.472 7.462 -9.611 1.00 25.00 C ATOM 793 C ARG A 794 -15.195 6.140 -8.898 1.00 25.00 C ATOM 794 O ARG A 794 -15.890 5.152 -9.123 1.00 25.00 O ATOM 795 CB ARG A 794 -14.495 7.672 -10.763 1.00 25.00 C ATOM 796 CG ARG A 794 -14.605 6.607 -11.809 1.00 25.00 C ATOM 797 CD ARG A 794 -13.759 6.922 -13.014 1.00 25.00 C ATOM 798 NE ARG A 794 -12.334 7.140 -12.693 1.00 25.00 N ATOM 799 CZ ARG A 794 -11.433 6.206 -12.408 1.00 25.00 C ATOM 800 NH1 ARG A 794 -11.720 4.927 -12.374 1.00 25.00 N ATOM 801 NH2 ARG A 794 -10.217 6.579 -12.146 1.00 25.00 N ATOM 0 H ARG A 794 -14.639 9.244 -8.865 1.00 25.00 H new ATOM 0 HA ARG A 794 -16.479 7.438 -10.027 1.00 25.00 H new ATOM 0 HB2 ARG A 794 -14.679 8.645 -11.219 1.00 25.00 H new ATOM 0 HB3 ARG A 794 -13.477 7.690 -10.373 1.00 25.00 H new ATOM 0 HG2 ARG A 794 -14.297 5.650 -11.388 1.00 25.00 H new ATOM 0 HG3 ARG A 794 -15.646 6.501 -12.113 1.00 25.00 H new ATOM 0 HD2 ARG A 794 -13.841 6.104 -13.729 1.00 25.00 H new ATOM 0 HD3 ARG A 794 -14.154 7.813 -13.502 1.00 25.00 H new ATOM 0 HE ARG A 794 -12.008 8.107 -12.690 1.00 25.00 H new ATOM 0 HH11 ARG A 794 -12.670 4.612 -12.572 1.00 25.00 H new ATOM 0 HH12 ARG A 794 -10.993 4.247 -12.150 1.00 25.00 H new ATOM 0 HH21 ARG A 794 -9.973 7.569 -12.162 1.00 25.00 H new ATOM 0 HH22 ARG A 794 -9.506 5.882 -11.924 1.00 25.00 H new ATOM 815 N ILE A 795 -14.214 6.128 -8.009 1.00 25.00 N ATOM 816 CA ILE A 795 -13.891 4.928 -7.248 1.00 25.00 C ATOM 817 C ILE A 795 -14.965 4.693 -6.209 1.00 25.00 C ATOM 818 O ILE A 795 -15.390 3.577 -6.024 1.00 25.00 O ATOM 819 CB ILE A 795 -12.539 5.014 -6.501 1.00 25.00 C ATOM 820 CG1 ILE A 795 -11.393 5.266 -7.483 1.00 25.00 C ATOM 821 CG2 ILE A 795 -12.272 3.695 -5.733 1.00 25.00 C ATOM 822 CD1 ILE A 795 -10.301 6.099 -6.890 1.00 25.00 C ATOM 0 H ILE A 795 -13.627 6.935 -7.796 1.00 25.00 H new ATOM 0 HA ILE A 795 -13.826 4.117 -7.973 1.00 25.00 H new ATOM 0 HB ILE A 795 -12.592 5.845 -5.797 1.00 25.00 H new ATOM 0 HG12 ILE A 795 -10.981 4.311 -7.808 1.00 25.00 H new ATOM 0 HG13 ILE A 795 -11.783 5.763 -8.371 1.00 25.00 H new ATOM 0 HG21 ILE A 795 -11.318 3.765 -5.210 1.00 25.00 H new ATOM 0 HG22 ILE A 795 -13.070 3.527 -5.010 1.00 25.00 H new ATOM 0 HG23 ILE A 795 -12.239 2.864 -6.438 1.00 25.00 H new ATOM 0 HD11 ILE A 795 -9.514 6.247 -7.629 1.00 25.00 H new ATOM 0 HD12 ILE A 795 -10.704 7.067 -6.590 1.00 25.00 H new ATOM 0 HD13 ILE A 795 -9.889 5.591 -6.018 1.00 25.00 H new ATOM 834 N MET A 796 -15.431 5.749 -5.559 1.00 25.00 N ATOM 835 CA MET A 796 -16.465 5.651 -4.520 1.00 25.00 C ATOM 836 C MET A 796 -17.712 4.941 -5.053 1.00 25.00 C ATOM 837 O MET A 796 -18.436 4.285 -4.316 1.00 25.00 O ATOM 838 CB MET A 796 -16.810 7.053 -4.002 1.00 25.00 C ATOM 839 CG MET A 796 -17.113 7.113 -2.515 1.00 25.00 C ATOM 840 SD MET A 796 -18.860 6.901 -2.154 1.00 25.00 S ATOM 841 CE MET A 796 -18.789 5.703 -0.847 1.00 25.00 C ATOM 0 H MET A 796 -15.108 6.701 -5.731 1.00 25.00 H new ATOM 0 HA MET A 796 -16.078 5.055 -3.693 1.00 25.00 H new ATOM 0 HB2 MET A 796 -15.978 7.723 -4.219 1.00 25.00 H new ATOM 0 HB3 MET A 796 -17.673 7.429 -4.552 1.00 25.00 H new ATOM 0 HG2 MET A 796 -16.543 6.339 -2.001 1.00 25.00 H new ATOM 0 HG3 MET A 796 -16.778 8.071 -2.119 1.00 25.00 H new ATOM 0 HE1 MET A 796 -19.696 5.099 -0.858 1.00 25.00 H new ATOM 0 HE2 MET A 796 -17.922 5.059 -0.991 1.00 25.00 H new ATOM 0 HE3 MET A 796 -18.706 6.215 0.112 1.00 25.00 H new ATOM 851 N SER A 797 -17.900 5.017 -6.361 1.00 25.00 N ATOM 852 CA SER A 797 -19.005 4.346 -7.031 1.00 25.00 C ATOM 853 C SER A 797 -18.733 2.853 -7.229 1.00 25.00 C ATOM 854 O SER A 797 -19.668 2.048 -7.235 1.00 25.00 O ATOM 855 CB SER A 797 -19.252 5.005 -8.391 1.00 25.00 C ATOM 856 OG SER A 797 -20.415 4.483 -9.013 1.00 25.00 O ATOM 0 H SER A 797 -17.293 5.544 -6.988 1.00 25.00 H new ATOM 0 HA SER A 797 -19.887 4.442 -6.397 1.00 25.00 H new ATOM 0 HB2 SER A 797 -19.359 6.082 -8.262 1.00 25.00 H new ATOM 0 HB3 SER A 797 -18.389 4.845 -9.037 1.00 25.00 H new ATOM 0 HG SER A 797 -20.549 4.923 -9.878 1.00 25.00 H new ATOM 862 N ILE A 798 -17.470 2.463 -7.385 1.00 25.00 N ATOM 863 CA ILE A 798 -17.141 1.044 -7.593 1.00 25.00 C ATOM 864 C ILE A 798 -16.893 0.315 -6.270 1.00 25.00 C ATOM 865 O ILE A 798 -17.127 -0.885 -6.168 1.00 25.00 O ATOM 866 CB ILE A 798 -15.980 0.830 -8.628 1.00 25.00 C ATOM 867 CG1 ILE A 798 -14.606 1.200 -8.043 1.00 25.00 C ATOM 868 CG2 ILE A 798 -16.278 1.662 -9.909 1.00 25.00 C ATOM 869 CD1 ILE A 798 -13.409 0.867 -8.945 1.00 25.00 C ATOM 0 H ILE A 798 -16.667 3.092 -7.373 1.00 25.00 H new ATOM 0 HA ILE A 798 -18.022 0.587 -8.043 1.00 25.00 H new ATOM 0 HB ILE A 798 -15.936 -0.230 -8.880 1.00 25.00 H new ATOM 0 HG12 ILE A 798 -14.594 2.269 -7.828 1.00 25.00 H new ATOM 0 HG13 ILE A 798 -14.481 0.682 -7.092 1.00 25.00 H new ATOM 0 HG21 ILE A 798 -15.475 1.517 -10.632 1.00 25.00 H new ATOM 0 HG22 ILE A 798 -17.222 1.334 -10.345 1.00 25.00 H new ATOM 0 HG23 ILE A 798 -16.346 2.718 -9.649 1.00 25.00 H new ATOM 0 HD11 ILE A 798 -12.485 1.164 -8.448 1.00 25.00 H new ATOM 0 HD12 ILE A 798 -13.388 -0.205 -9.140 1.00 25.00 H new ATOM 0 HD13 ILE A 798 -13.503 1.406 -9.888 1.00 25.00 H new ATOM 881 N VAL A 799 -16.528 1.060 -5.235 1.00 25.00 N ATOM 882 CA VAL A 799 -16.307 0.495 -3.901 1.00 25.00 C ATOM 883 C VAL A 799 -17.595 0.580 -3.082 1.00 25.00 C ATOM 884 O VAL A 799 -17.600 0.504 -1.853 1.00 25.00 O ATOM 885 CB VAL A 799 -15.105 1.152 -3.170 1.00 25.00 C ATOM 886 CG1 VAL A 799 -13.837 0.952 -3.990 1.00 25.00 C ATOM 887 CG2 VAL A 799 -15.338 2.631 -2.915 1.00 25.00 C ATOM 0 H VAL A 799 -16.376 2.067 -5.290 1.00 25.00 H new ATOM 0 HA VAL A 799 -16.041 -0.555 -4.018 1.00 25.00 H new ATOM 0 HB VAL A 799 -14.995 0.668 -2.199 1.00 25.00 H new ATOM 0 HG11 VAL A 799 -12.994 1.414 -3.475 1.00 25.00 H new ATOM 0 HG12 VAL A 799 -13.647 -0.114 -4.112 1.00 25.00 H new ATOM 0 HG13 VAL A 799 -13.961 1.413 -4.970 1.00 25.00 H new ATOM 0 HG21 VAL A 799 -14.474 3.052 -2.402 1.00 25.00 H new ATOM 0 HG22 VAL A 799 -15.483 3.146 -3.865 1.00 25.00 H new ATOM 0 HG23 VAL A 799 -16.225 2.758 -2.295 1.00 25.00 H new ATOM 897 N ASP A 800 -18.701 0.645 -3.802 1.00 25.00 N ATOM 898 CA ASP A 800 -20.032 0.542 -3.217 1.00 25.00 C ATOM 899 C ASP A 800 -20.778 -0.646 -3.864 1.00 25.00 C ATOM 900 O ASP A 800 -21.819 -0.482 -4.503 1.00 25.00 O ATOM 901 CB ASP A 800 -20.792 1.850 -3.420 1.00 25.00 C ATOM 902 CG ASP A 800 -22.169 1.814 -2.806 1.00 25.00 C ATOM 903 OD1 ASP A 800 -22.390 1.007 -1.875 1.00 25.00 O ATOM 904 OD2 ASP A 800 -23.053 2.564 -3.262 1.00 25.00 O ATOM 0 H ASP A 800 -18.704 0.771 -4.814 1.00 25.00 H new ATOM 0 HA ASP A 800 -19.956 0.364 -2.144 1.00 25.00 H new ATOM 0 HB2 ASP A 800 -20.223 2.670 -2.982 1.00 25.00 H new ATOM 0 HB3 ASP A 800 -20.878 2.056 -4.487 1.00 25.00 H new ATOM 909 N PRO A 801 -20.244 -1.877 -3.714 1.00 25.00 N ATOM 910 CA PRO A 801 -20.898 -3.027 -4.352 1.00 25.00 C ATOM 911 C PRO A 801 -22.241 -3.412 -3.738 1.00 25.00 C ATOM 912 O PRO A 801 -22.923 -4.289 -4.248 1.00 25.00 O ATOM 913 CB PRO A 801 -19.881 -4.153 -4.128 1.00 25.00 C ATOM 914 CG PRO A 801 -19.198 -3.779 -2.867 1.00 25.00 C ATOM 915 CD PRO A 801 -19.024 -2.304 -3.001 1.00 25.00 C ATOM 0 HA PRO A 801 -21.140 -2.812 -5.393 1.00 25.00 H new ATOM 0 HB2 PRO A 801 -20.372 -5.122 -4.043 1.00 25.00 H new ATOM 0 HB3 PRO A 801 -19.177 -4.224 -4.957 1.00 25.00 H new ATOM 0 HG2 PRO A 801 -19.796 -4.037 -1.993 1.00 25.00 H new ATOM 0 HG3 PRO A 801 -18.241 -4.290 -2.760 1.00 25.00 H new ATOM 0 HD2 PRO A 801 -18.937 -1.820 -2.028 1.00 25.00 H new ATOM 0 HD3 PRO A 801 -18.123 -2.055 -3.562 1.00 25.00 H new ATOM 923 N ASN A 802 -22.600 -2.799 -2.618 1.00 25.00 N ATOM 924 CA ASN A 802 -23.820 -3.161 -1.901 1.00 25.00 C ATOM 925 C ASN A 802 -24.858 -2.054 -2.089 1.00 25.00 C ATOM 926 O ASN A 802 -25.981 -2.165 -1.616 1.00 25.00 O ATOM 927 CB ASN A 802 -23.513 -3.343 -0.408 1.00 25.00 C ATOM 928 CG ASN A 802 -22.931 -4.697 -0.070 1.00 25.00 C ATOM 929 OD1 ASN A 802 -23.217 -5.253 0.971 1.00 25.00 O ATOM 930 ND2 ASN A 802 -22.085 -5.203 -0.909 1.00 25.00 N ATOM 0 H ASN A 802 -22.064 -2.047 -2.184 1.00 25.00 H new ATOM 0 HA ASN A 802 -24.212 -4.099 -2.295 1.00 25.00 H new ATOM 0 HB2 ASN A 802 -22.815 -2.568 -0.092 1.00 25.00 H new ATOM 0 HB3 ASN A 802 -24.430 -3.198 0.163 1.00 25.00 H new ATOM 0 HD21 ASN A 802 -21.636 -6.096 -0.705 1.00 25.00 H new ATOM 0 HD22 ASN A 802 -21.868 -4.709 -1.775 1.00 25.00 H new ATOM 937 N ARG A 803 -24.453 -0.993 -2.786 1.00 25.00 N ATOM 938 CA ARG A 803 -25.316 0.158 -3.107 1.00 25.00 C ATOM 939 C ARG A 803 -25.926 0.816 -1.873 1.00 25.00 C ATOM 940 O ARG A 803 -27.081 1.227 -1.869 1.00 25.00 O ATOM 941 CB ARG A 803 -26.374 -0.239 -4.144 1.00 25.00 C ATOM 942 CG ARG A 803 -25.740 -0.721 -5.455 1.00 25.00 C ATOM 943 CD ARG A 803 -25.121 0.448 -6.233 1.00 25.00 C ATOM 944 NE ARG A 803 -23.933 0.023 -6.992 1.00 25.00 N ATOM 945 CZ ARG A 803 -22.797 0.711 -7.090 1.00 25.00 C ATOM 946 NH1 ARG A 803 -22.613 1.871 -6.515 1.00 25.00 N ATOM 947 NH2 ARG A 803 -21.815 0.215 -7.786 1.00 25.00 N ATOM 0 H ARG A 803 -23.505 -0.901 -3.151 1.00 25.00 H new ATOM 0 HA ARG A 803 -24.680 0.925 -3.549 1.00 25.00 H new ATOM 0 HB2 ARG A 803 -27.005 -1.028 -3.735 1.00 25.00 H new ATOM 0 HB3 ARG A 803 -27.022 0.614 -4.346 1.00 25.00 H new ATOM 0 HG2 ARG A 803 -24.973 -1.465 -5.239 1.00 25.00 H new ATOM 0 HG3 ARG A 803 -26.496 -1.211 -6.069 1.00 25.00 H new ATOM 0 HD2 ARG A 803 -25.861 0.864 -6.917 1.00 25.00 H new ATOM 0 HD3 ARG A 803 -24.846 1.243 -5.540 1.00 25.00 H new ATOM 0 HE ARG A 803 -23.984 -0.870 -7.482 1.00 25.00 H new ATOM 0 HH11 ARG A 803 -23.360 2.289 -5.960 1.00 25.00 H new ATOM 0 HH12 ARG A 803 -21.723 2.357 -6.621 1.00 25.00 H new ATOM 0 HH21 ARG A 803 -21.922 -0.689 -8.247 1.00 25.00 H new ATOM 0 HH22 ARG A 803 -20.939 0.730 -7.870 1.00 25.00 H new ATOM 961 N LEU A 804 -25.098 0.940 -0.848 1.00 25.00 N ATOM 962 CA LEU A 804 -25.462 1.594 0.408 1.00 25.00 C ATOM 963 C LEU A 804 -24.776 2.956 0.530 1.00 25.00 C ATOM 964 O LEU A 804 -25.075 3.729 1.432 1.00 25.00 O ATOM 965 CB LEU A 804 -25.112 0.704 1.614 1.00 25.00 C ATOM 966 CG LEU A 804 -24.108 -0.444 1.415 1.00 25.00 C ATOM 967 CD1 LEU A 804 -22.687 0.036 1.209 1.00 25.00 C ATOM 968 CD2 LEU A 804 -24.124 -1.410 2.585 1.00 25.00 C ATOM 0 H LEU A 804 -24.141 0.586 -0.861 1.00 25.00 H new ATOM 0 HA LEU A 804 -26.541 1.752 0.403 1.00 25.00 H new ATOM 0 HB2 LEU A 804 -24.724 1.351 2.401 1.00 25.00 H new ATOM 0 HB3 LEU A 804 -26.040 0.271 1.986 1.00 25.00 H new ATOM 0 HG LEU A 804 -24.435 -0.951 0.507 1.00 25.00 H new ATOM 0 HD11 LEU A 804 -22.029 -0.822 1.075 1.00 25.00 H new ATOM 0 HD12 LEU A 804 -22.642 0.670 0.323 1.00 25.00 H new ATOM 0 HD13 LEU A 804 -22.366 0.607 2.080 1.00 25.00 H new ATOM 0 HD21 LEU A 804 -23.402 -2.207 2.408 1.00 25.00 H new ATOM 0 HD22 LEU A 804 -23.861 -0.878 3.499 1.00 25.00 H new ATOM 0 HD23 LEU A 804 -25.121 -1.839 2.689 1.00 25.00 H new ATOM 980 N GLY A 805 -23.870 3.251 -0.392 1.00 25.00 N ATOM 981 CA GLY A 805 -23.194 4.543 -0.398 1.00 25.00 C ATOM 982 C GLY A 805 -22.071 4.646 0.614 1.00 25.00 C ATOM 983 O GLY A 805 -21.707 5.743 1.047 1.00 25.00 O ATOM 0 H GLY A 805 -23.587 2.619 -1.141 1.00 25.00 H new ATOM 0 HA2 GLY A 805 -22.792 4.728 -1.394 1.00 25.00 H new ATOM 0 HA3 GLY A 805 -23.925 5.327 -0.198 1.00 25.00 H new ATOM 987 N VAL A 806 -21.522 3.507 1.010 1.00 25.00 N ATOM 988 CA VAL A 806 -20.437 3.463 1.991 1.00 25.00 C ATOM 989 C VAL A 806 -19.454 2.364 1.584 1.00 25.00 C ATOM 990 O VAL A 806 -19.825 1.423 0.888 1.00 25.00 O ATOM 991 CB VAL A 806 -20.955 3.170 3.436 1.00 25.00 C ATOM 992 CG1 VAL A 806 -20.501 4.261 4.398 1.00 25.00 C ATOM 993 CG2 VAL A 806 -22.491 3.069 3.509 1.00 25.00 C ATOM 0 H VAL A 806 -21.810 2.591 0.666 1.00 25.00 H new ATOM 0 HA VAL A 806 -19.956 4.441 2.004 1.00 25.00 H new ATOM 0 HB VAL A 806 -20.532 2.206 3.719 1.00 25.00 H new ATOM 0 HG11 VAL A 806 -20.871 4.040 5.399 1.00 25.00 H new ATOM 0 HG12 VAL A 806 -19.412 4.302 4.414 1.00 25.00 H new ATOM 0 HG13 VAL A 806 -20.895 5.223 4.070 1.00 25.00 H new ATOM 0 HG21 VAL A 806 -22.794 2.864 4.536 1.00 25.00 H new ATOM 0 HG22 VAL A 806 -22.933 4.009 3.181 1.00 25.00 H new ATOM 0 HG23 VAL A 806 -22.834 2.261 2.862 1.00 25.00 H new ATOM 1003 N VAL A 807 -18.201 2.494 1.993 1.00 25.00 N ATOM 1004 CA VAL A 807 -17.154 1.560 1.594 1.00 25.00 C ATOM 1005 C VAL A 807 -17.015 0.477 2.638 1.00 25.00 C ATOM 1006 O VAL A 807 -16.853 0.752 3.828 1.00 25.00 O ATOM 1007 CB VAL A 807 -15.808 2.296 1.415 1.00 25.00 C ATOM 1008 CG1 VAL A 807 -14.712 1.352 0.934 1.00 25.00 C ATOM 1009 CG2 VAL A 807 -15.989 3.439 0.421 1.00 25.00 C ATOM 0 H VAL A 807 -17.881 3.243 2.606 1.00 25.00 H new ATOM 0 HA VAL A 807 -17.430 1.111 0.640 1.00 25.00 H new ATOM 0 HB VAL A 807 -15.500 2.690 2.383 1.00 25.00 H new ATOM 0 HG11 VAL A 807 -13.780 1.905 0.819 1.00 25.00 H new ATOM 0 HG12 VAL A 807 -14.573 0.554 1.663 1.00 25.00 H new ATOM 0 HG13 VAL A 807 -14.998 0.921 -0.025 1.00 25.00 H new ATOM 0 HG21 VAL A 807 -15.041 3.962 0.291 1.00 25.00 H new ATOM 0 HG22 VAL A 807 -16.317 3.038 -0.538 1.00 25.00 H new ATOM 0 HG23 VAL A 807 -16.738 4.135 0.799 1.00 25.00 H new ATOM 1019 N THR A 808 -17.113 -0.760 2.187 1.00 25.00 N ATOM 1020 CA THR A 808 -17.074 -1.920 3.071 1.00 25.00 C ATOM 1021 C THR A 808 -15.767 -2.654 2.975 1.00 25.00 C ATOM 1022 O THR A 808 -15.012 -2.438 2.063 1.00 25.00 O ATOM 1023 CB THR A 808 -18.179 -2.937 2.708 1.00 25.00 C ATOM 1024 OG1 THR A 808 -17.666 -3.846 1.737 1.00 25.00 O ATOM 1025 CG2 THR A 808 -19.372 -2.276 2.073 1.00 25.00 C ATOM 0 H THR A 808 -17.222 -0.993 1.200 1.00 25.00 H new ATOM 0 HA THR A 808 -17.217 -1.528 4.078 1.00 25.00 H new ATOM 0 HB THR A 808 -18.480 -3.427 3.634 1.00 25.00 H new ATOM 0 HG1 THR A 808 -17.977 -3.583 0.846 1.00 25.00 H new ATOM 0 HG21 THR A 808 -20.122 -3.030 1.835 1.00 25.00 H new ATOM 0 HG22 THR A 808 -19.796 -1.548 2.765 1.00 25.00 H new ATOM 0 HG23 THR A 808 -19.064 -1.770 1.158 1.00 25.00 H new ATOM 1033 N PHE A 809 -15.533 -3.575 3.891 1.00 25.00 N ATOM 1034 CA PHE A 809 -14.331 -4.404 3.903 1.00 25.00 C ATOM 1035 C PHE A 809 -14.036 -5.076 2.576 1.00 25.00 C ATOM 1036 O PHE A 809 -12.908 -5.048 2.122 1.00 25.00 O ATOM 1037 CB PHE A 809 -14.471 -5.470 4.987 1.00 25.00 C ATOM 1038 CG PHE A 809 -15.902 -5.850 5.280 1.00 25.00 C ATOM 1039 CD1 PHE A 809 -16.542 -6.862 4.534 1.00 25.00 C ATOM 1040 CD2 PHE A 809 -16.627 -5.192 6.297 1.00 25.00 C ATOM 1041 CE1 PHE A 809 -17.892 -7.205 4.786 1.00 25.00 C ATOM 1042 CE2 PHE A 809 -17.978 -5.526 6.556 1.00 25.00 C ATOM 1043 CZ PHE A 809 -18.613 -6.531 5.794 1.00 25.00 C ATOM 0 H PHE A 809 -16.175 -3.775 4.658 1.00 25.00 H new ATOM 0 HA PHE A 809 -13.493 -3.737 4.105 1.00 25.00 H new ATOM 0 HB2 PHE A 809 -13.923 -6.361 4.681 1.00 25.00 H new ATOM 0 HB3 PHE A 809 -14.005 -5.108 5.903 1.00 25.00 H new ATOM 0 HD1 PHE A 809 -15.995 -7.381 3.761 1.00 25.00 H new ATOM 0 HD2 PHE A 809 -16.145 -4.425 6.885 1.00 25.00 H new ATOM 0 HE1 PHE A 809 -18.370 -7.982 4.207 1.00 25.00 H new ATOM 0 HE2 PHE A 809 -18.522 -5.013 7.335 1.00 25.00 H new ATOM 0 HZ PHE A 809 -19.646 -6.783 5.982 1.00 25.00 H new ATOM 1053 N GLN A 810 -15.047 -5.636 1.932 1.00 25.00 N ATOM 1054 CA GLN A 810 -14.841 -6.304 0.650 1.00 25.00 C ATOM 1055 C GLN A 810 -14.621 -5.271 -0.452 1.00 25.00 C ATOM 1056 O GLN A 810 -14.156 -5.593 -1.534 1.00 25.00 O ATOM 1057 CB GLN A 810 -16.040 -7.216 0.330 1.00 25.00 C ATOM 1058 CG GLN A 810 -17.277 -6.481 -0.171 1.00 25.00 C ATOM 1059 CD GLN A 810 -18.570 -7.015 0.424 1.00 25.00 C ATOM 1060 OE1 GLN A 810 -18.917 -8.162 0.231 1.00 25.00 O ATOM 1061 NE2 GLN A 810 -19.286 -6.179 1.143 1.00 25.00 N ATOM 0 H GLN A 810 -16.010 -5.644 2.268 1.00 25.00 H new ATOM 0 HA GLN A 810 -13.949 -6.928 0.710 1.00 25.00 H new ATOM 0 HB2 GLN A 810 -15.736 -7.944 -0.422 1.00 25.00 H new ATOM 0 HB3 GLN A 810 -16.304 -7.776 1.227 1.00 25.00 H new ATOM 0 HG2 GLN A 810 -17.184 -5.422 0.068 1.00 25.00 H new ATOM 0 HG3 GLN A 810 -17.324 -6.560 -1.257 1.00 25.00 H new ATOM 0 HE21 GLN A 810 -18.963 -5.222 1.284 1.00 25.00 H new ATOM 0 HE22 GLN A 810 -20.164 -6.488 1.560 1.00 25.00 H new ATOM 1070 N ALA A 811 -15.000 -4.032 -0.169 1.00 25.00 N ATOM 1071 CA ALA A 811 -14.864 -2.951 -1.134 1.00 25.00 C ATOM 1072 C ALA A 811 -13.474 -2.331 -1.076 1.00 25.00 C ATOM 1073 O ALA A 811 -12.922 -1.929 -2.078 1.00 25.00 O ATOM 1074 CB ALA A 811 -15.898 -1.912 -0.871 1.00 25.00 C ATOM 0 H ALA A 811 -15.405 -3.751 0.724 1.00 25.00 H new ATOM 0 HA ALA A 811 -15.006 -3.363 -2.133 1.00 25.00 H new ATOM 0 HB1 ALA A 811 -15.794 -1.104 -1.595 1.00 25.00 H new ATOM 0 HB2 ALA A 811 -16.890 -2.355 -0.961 1.00 25.00 H new ATOM 0 HB3 ALA A 811 -15.768 -1.516 0.136 1.00 25.00 H new ATOM 1080 N PHE A 812 -12.930 -2.231 0.127 1.00 25.00 N ATOM 1081 CA PHE A 812 -11.617 -1.605 0.319 1.00 25.00 C ATOM 1082 C PHE A 812 -10.527 -2.322 -0.468 1.00 25.00 C ATOM 1083 O PHE A 812 -9.571 -1.707 -0.935 1.00 25.00 O ATOM 1084 CB PHE A 812 -11.206 -1.605 1.787 1.00 25.00 C ATOM 1085 CG PHE A 812 -11.943 -0.644 2.621 1.00 25.00 C ATOM 1086 CD1 PHE A 812 -11.649 0.731 2.606 1.00 25.00 C ATOM 1087 CD2 PHE A 812 -12.936 -1.118 3.457 1.00 25.00 C ATOM 1088 CE1 PHE A 812 -12.390 1.610 3.410 1.00 25.00 C ATOM 1089 CE2 PHE A 812 -13.687 -0.267 4.251 1.00 25.00 C ATOM 1090 CZ PHE A 812 -13.436 1.089 4.227 1.00 25.00 C ATOM 0 H PHE A 812 -13.368 -2.570 0.983 1.00 25.00 H new ATOM 0 HA PHE A 812 -11.720 -0.581 -0.041 1.00 25.00 H new ATOM 0 HB2 PHE A 812 -11.350 -2.606 2.193 1.00 25.00 H new ATOM 0 HB3 PHE A 812 -10.141 -1.385 1.854 1.00 25.00 H new ATOM 0 HD1 PHE A 812 -10.856 1.109 1.978 1.00 25.00 H new ATOM 0 HD2 PHE A 812 -13.132 -2.180 3.492 1.00 25.00 H new ATOM 0 HE1 PHE A 812 -12.171 2.668 3.410 1.00 25.00 H new ATOM 0 HE2 PHE A 812 -14.466 -0.663 4.886 1.00 25.00 H new ATOM 0 HZ PHE A 812 -14.033 1.758 4.829 1.00 25.00 H new ATOM 1100 N ILE A 813 -10.669 -3.633 -0.591 1.00 25.00 N ATOM 1101 CA ILE A 813 -9.649 -4.471 -1.227 1.00 25.00 C ATOM 1102 C ILE A 813 -9.478 -4.077 -2.676 1.00 25.00 C ATOM 1103 O ILE A 813 -8.386 -4.129 -3.237 1.00 25.00 O ATOM 1104 CB ILE A 813 -10.047 -5.959 -1.183 1.00 25.00 C ATOM 1105 CG1 ILE A 813 -10.488 -6.365 0.240 1.00 25.00 C ATOM 1106 CG2 ILE A 813 -8.884 -6.843 -1.710 1.00 25.00 C ATOM 1107 CD1 ILE A 813 -9.588 -5.853 1.420 1.00 25.00 C ATOM 0 H ILE A 813 -11.484 -4.148 -0.258 1.00 25.00 H new ATOM 0 HA ILE A 813 -8.719 -4.324 -0.678 1.00 25.00 H new ATOM 0 HB ILE A 813 -10.903 -6.117 -1.840 1.00 25.00 H new ATOM 0 HG12 ILE A 813 -11.503 -6.001 0.401 1.00 25.00 H new ATOM 0 HG13 ILE A 813 -10.529 -7.453 0.288 1.00 25.00 H new ATOM 0 HG21 ILE A 813 -9.179 -7.892 -1.673 1.00 25.00 H new ATOM 0 HG22 ILE A 813 -8.654 -6.566 -2.739 1.00 25.00 H new ATOM 0 HG23 ILE A 813 -8.002 -6.692 -1.088 1.00 25.00 H new ATOM 0 HD11 ILE A 813 -9.998 -6.201 2.368 1.00 25.00 H new ATOM 0 HD12 ILE A 813 -8.576 -6.238 1.299 1.00 25.00 H new ATOM 0 HD13 ILE A 813 -9.565 -4.763 1.413 1.00 25.00 H new ATOM 1119 N ASP A 814 -10.577 -3.640 -3.256 1.00 25.00 N ATOM 1120 CA ASP A 814 -10.588 -3.162 -4.629 1.00 25.00 C ATOM 1121 C ASP A 814 -9.476 -2.141 -4.862 1.00 25.00 C ATOM 1122 O ASP A 814 -8.770 -2.229 -5.854 1.00 25.00 O ATOM 1123 CB ASP A 814 -11.938 -2.530 -4.950 1.00 25.00 C ATOM 1124 CG ASP A 814 -12.212 -2.473 -6.447 1.00 25.00 C ATOM 1125 OD1 ASP A 814 -11.515 -3.166 -7.224 1.00 25.00 O ATOM 1126 OD2 ASP A 814 -13.091 -1.694 -6.858 1.00 25.00 O ATOM 0 H ASP A 814 -11.486 -3.605 -2.794 1.00 25.00 H new ATOM 0 HA ASP A 814 -10.419 -4.015 -5.286 1.00 25.00 H new ATOM 0 HB2 ASP A 814 -12.728 -3.099 -4.460 1.00 25.00 H new ATOM 0 HB3 ASP A 814 -11.971 -1.521 -4.539 1.00 25.00 H new ATOM 1131 N PHE A 815 -9.264 -1.226 -3.916 1.00 25.00 N ATOM 1132 CA PHE A 815 -8.148 -0.276 -4.024 1.00 25.00 C ATOM 1133 C PHE A 815 -6.826 -0.937 -3.640 1.00 25.00 C ATOM 1134 O PHE A 815 -5.832 -0.767 -4.311 1.00 25.00 O ATOM 1135 CB PHE A 815 -8.351 0.958 -3.142 1.00 25.00 C ATOM 1136 CG PHE A 815 -7.575 2.168 -3.615 1.00 25.00 C ATOM 1137 CD1 PHE A 815 -6.148 2.186 -3.652 1.00 25.00 C ATOM 1138 CD2 PHE A 815 -8.272 3.318 -4.048 1.00 25.00 C ATOM 1139 CE1 PHE A 815 -5.468 3.314 -4.132 1.00 25.00 C ATOM 1140 CE2 PHE A 815 -7.590 4.431 -4.510 1.00 25.00 C ATOM 1141 CZ PHE A 815 -6.192 4.430 -4.566 1.00 25.00 C ATOM 0 H PHE A 815 -9.837 -1.120 -3.079 1.00 25.00 H new ATOM 0 HA PHE A 815 -8.117 0.040 -5.067 1.00 25.00 H new ATOM 0 HB2 PHE A 815 -9.412 1.205 -3.113 1.00 25.00 H new ATOM 0 HB3 PHE A 815 -8.051 0.719 -2.121 1.00 25.00 H new ATOM 0 HD1 PHE A 815 -5.590 1.327 -3.309 1.00 25.00 H new ATOM 0 HD2 PHE A 815 -9.352 3.329 -4.018 1.00 25.00 H new ATOM 0 HE1 PHE A 815 -4.389 3.322 -4.167 1.00 25.00 H new ATOM 0 HE2 PHE A 815 -8.140 5.304 -4.829 1.00 25.00 H new ATOM 0 HZ PHE A 815 -5.669 5.295 -4.946 1.00 25.00 H new ATOM 1151 N MET A 816 -6.821 -1.710 -2.568 1.00 25.00 N ATOM 1152 CA MET A 816 -5.602 -2.377 -2.098 1.00 25.00 C ATOM 1153 C MET A 816 -4.881 -3.216 -3.165 1.00 25.00 C ATOM 1154 O MET A 816 -3.680 -3.354 -3.141 1.00 25.00 O ATOM 1155 CB MET A 816 -5.971 -3.317 -0.975 1.00 25.00 C ATOM 1156 CG MET A 816 -5.060 -3.298 0.242 1.00 25.00 C ATOM 1157 SD MET A 816 -3.376 -3.774 -0.031 1.00 25.00 S ATOM 1158 CE MET A 816 -2.640 -2.246 0.196 1.00 25.00 C ATOM 0 H MET A 816 -7.647 -1.897 -1.999 1.00 25.00 H new ATOM 0 HA MET A 816 -4.924 -1.579 -1.795 1.00 25.00 H new ATOM 0 HB2 MET A 816 -6.984 -3.080 -0.649 1.00 25.00 H new ATOM 0 HB3 MET A 816 -5.993 -4.332 -1.371 1.00 25.00 H new ATOM 0 HG2 MET A 816 -5.068 -2.291 0.659 1.00 25.00 H new ATOM 0 HG3 MET A 816 -5.484 -3.959 0.997 1.00 25.00 H new ATOM 0 HE1 MET A 816 -1.575 -2.319 -0.023 1.00 25.00 H new ATOM 0 HE2 MET A 816 -3.099 -1.518 -0.473 1.00 25.00 H new ATOM 0 HE3 MET A 816 -2.777 -1.926 1.229 1.00 25.00 H new ATOM 1168 N SER A 817 -5.602 -3.797 -4.107 1.00 25.00 N ATOM 1169 CA SER A 817 -4.933 -4.565 -5.161 1.00 25.00 C ATOM 1170 C SER A 817 -4.320 -3.637 -6.217 1.00 25.00 C ATOM 1171 O SER A 817 -3.436 -4.039 -6.970 1.00 25.00 O ATOM 1172 CB SER A 817 -5.877 -5.576 -5.795 1.00 25.00 C ATOM 1173 OG SER A 817 -5.212 -6.330 -6.796 1.00 25.00 O ATOM 0 H SER A 817 -6.619 -3.760 -4.172 1.00 25.00 H new ATOM 0 HA SER A 817 -4.120 -5.123 -4.697 1.00 25.00 H new ATOM 0 HB2 SER A 817 -6.267 -6.246 -5.029 1.00 25.00 H new ATOM 0 HB3 SER A 817 -6.731 -5.058 -6.231 1.00 25.00 H new ATOM 0 HG SER A 817 -5.837 -6.975 -7.189 1.00 25.00 H new ATOM 1179 N ARG A 818 -4.797 -2.400 -6.272 1.00 25.00 N ATOM 1180 CA ARG A 818 -4.248 -1.380 -7.206 1.00 25.00 C ATOM 1181 C ARG A 818 -2.903 -0.886 -6.701 1.00 25.00 C ATOM 1182 O ARG A 818 -2.117 -0.352 -7.463 1.00 25.00 O ATOM 1183 CB ARG A 818 -5.146 -0.140 -7.362 1.00 25.00 C ATOM 1184 CG ARG A 818 -6.627 -0.402 -7.517 1.00 25.00 C ATOM 1185 CD ARG A 818 -7.004 -1.252 -8.720 1.00 25.00 C ATOM 1186 NE ARG A 818 -8.444 -1.553 -8.670 1.00 25.00 N ATOM 1187 CZ ARG A 818 -9.406 -0.825 -9.221 1.00 25.00 C ATOM 1188 NH1 ARG A 818 -9.158 0.259 -9.919 1.00 25.00 N ATOM 1189 NH2 ARG A 818 -10.642 -1.189 -9.059 1.00 25.00 N ATOM 0 H ARG A 818 -5.562 -2.062 -5.688 1.00 25.00 H new ATOM 0 HA ARG A 818 -4.173 -1.881 -8.171 1.00 25.00 H new ATOM 0 HB2 ARG A 818 -5.001 0.500 -6.491 1.00 25.00 H new ATOM 0 HB3 ARG A 818 -4.805 0.422 -8.231 1.00 25.00 H new ATOM 0 HG2 ARG A 818 -6.991 -0.894 -6.615 1.00 25.00 H new ATOM 0 HG3 ARG A 818 -7.145 0.554 -7.590 1.00 25.00 H new ATOM 0 HD2 ARG A 818 -6.763 -0.724 -9.643 1.00 25.00 H new ATOM 0 HD3 ARG A 818 -6.427 -2.177 -8.722 1.00 25.00 H new ATOM 0 HE ARG A 818 -8.727 -2.395 -8.168 1.00 25.00 H new ATOM 0 HH11 ARG A 818 -8.196 0.570 -10.054 1.00 25.00 H new ATOM 0 HH12 ARG A 818 -9.927 0.791 -10.326 1.00 25.00 H new ATOM 0 HH21 ARG A 818 -10.861 -2.023 -8.515 1.00 25.00 H new ATOM 0 HH22 ARG A 818 -11.394 -0.640 -9.476 1.00 25.00 H new ATOM 1203 N GLU A 819 -2.680 -1.066 -5.405 1.00 25.00 N ATOM 1204 CA GLU A 819 -1.452 -0.659 -4.701 1.00 25.00 C ATOM 1205 C GLU A 819 -0.182 -1.218 -5.383 1.00 25.00 C ATOM 1206 O GLU A 819 0.926 -0.750 -5.180 1.00 25.00 O ATOM 1207 CB GLU A 819 -1.535 -1.239 -3.288 1.00 25.00 C ATOM 1208 CG GLU A 819 -0.473 -0.835 -2.286 1.00 25.00 C ATOM 1209 CD GLU A 819 -0.953 0.183 -1.245 1.00 25.00 C ATOM 1210 OE1 GLU A 819 -2.123 0.634 -1.309 1.00 25.00 O ATOM 1211 OE2 GLU A 819 -0.199 0.397 -0.274 1.00 25.00 O ATOM 0 H GLU A 819 -3.362 -1.511 -4.790 1.00 25.00 H new ATOM 0 HA GLU A 819 -1.381 0.429 -4.706 1.00 25.00 H new ATOM 0 HB2 GLU A 819 -2.505 -0.967 -2.873 1.00 25.00 H new ATOM 0 HB3 GLU A 819 -1.517 -2.326 -3.372 1.00 25.00 H new ATOM 0 HG2 GLU A 819 -0.117 -1.727 -1.770 1.00 25.00 H new ATOM 0 HG3 GLU A 819 0.378 -0.416 -2.823 1.00 25.00 H new ATOM 1218 N THR A 820 -0.373 -2.247 -6.197 1.00 25.00 N ATOM 1219 CA THR A 820 0.708 -2.905 -6.928 1.00 25.00 C ATOM 1220 C THR A 820 1.250 -2.072 -8.107 1.00 25.00 C ATOM 1221 O THR A 820 2.099 -2.546 -8.867 1.00 25.00 O ATOM 1222 CB THR A 820 0.211 -4.270 -7.459 1.00 25.00 C ATOM 1223 OG1 THR A 820 -0.907 -4.073 -8.334 1.00 25.00 O ATOM 1224 CG2 THR A 820 -0.261 -5.158 -6.305 1.00 25.00 C ATOM 0 H THR A 820 -1.291 -2.655 -6.372 1.00 25.00 H new ATOM 0 HA THR A 820 1.530 -3.030 -6.224 1.00 25.00 H new ATOM 0 HB THR A 820 1.039 -4.745 -7.985 1.00 25.00 H new ATOM 0 HG1 THR A 820 -1.734 -4.057 -7.809 1.00 25.00 H new ATOM 0 HG21 THR A 820 -0.607 -6.114 -6.699 1.00 25.00 H new ATOM 0 HG22 THR A 820 0.566 -5.328 -5.615 1.00 25.00 H new ATOM 0 HG23 THR A 820 -1.078 -4.666 -5.778 1.00 25.00 H new ATOM 1232 N ALA A 821 0.773 -0.840 -8.241 1.00 25.00 N ATOM 1233 CA ALA A 821 1.234 0.090 -9.278 1.00 25.00 C ATOM 1234 C ALA A 821 1.817 1.367 -8.639 1.00 25.00 C ATOM 1235 O ALA A 821 1.461 1.732 -7.528 1.00 25.00 O ATOM 1236 CB ALA A 821 0.069 0.442 -10.213 1.00 25.00 C ATOM 0 H ALA A 821 0.052 -0.451 -7.633 1.00 25.00 H new ATOM 0 HA ALA A 821 2.022 -0.390 -9.858 1.00 25.00 H new ATOM 0 HB1 ALA A 821 0.415 1.133 -10.982 1.00 25.00 H new ATOM 0 HB2 ALA A 821 -0.307 -0.466 -10.684 1.00 25.00 H new ATOM 0 HB3 ALA A 821 -0.730 0.910 -9.638 1.00 25.00 H new ATOM 1242 N ASP A 822 2.723 2.021 -9.358 1.00 25.00 N ATOM 1243 CA ASP A 822 3.417 3.221 -8.866 1.00 25.00 C ATOM 1244 C ASP A 822 2.502 4.423 -8.613 1.00 25.00 C ATOM 1245 O ASP A 822 1.498 4.613 -9.303 1.00 25.00 O ATOM 1246 CB ASP A 822 4.463 3.658 -9.897 1.00 25.00 C ATOM 1247 CG ASP A 822 5.565 2.643 -10.074 1.00 25.00 C ATOM 1248 OD1 ASP A 822 5.395 1.688 -10.865 1.00 25.00 O ATOM 1249 OD2 ASP A 822 6.621 2.795 -9.431 1.00 25.00 O ATOM 0 H ASP A 822 3.002 1.740 -10.298 1.00 25.00 H new ATOM 0 HA ASP A 822 3.856 2.933 -7.911 1.00 25.00 H new ATOM 0 HB2 ASP A 822 3.973 3.828 -10.856 1.00 25.00 H new ATOM 0 HB3 ASP A 822 4.897 4.609 -9.588 1.00 25.00 H new ATOM 1254 N THR A 823 2.902 5.276 -7.675 1.00 25.00 N ATOM 1255 CA THR A 823 2.193 6.529 -7.396 1.00 25.00 C ATOM 1256 C THR A 823 3.142 7.620 -6.930 1.00 25.00 C ATOM 1257 O THR A 823 4.300 7.354 -6.635 1.00 25.00 O ATOM 1258 CB THR A 823 1.157 6.370 -6.285 1.00 25.00 C ATOM 1259 OG1 THR A 823 0.922 4.982 -6.039 1.00 25.00 O ATOM 1260 CG2 THR A 823 -0.135 7.037 -6.671 1.00 25.00 C ATOM 0 H THR A 823 3.722 5.123 -7.088 1.00 25.00 H new ATOM 0 HA THR A 823 1.713 6.797 -8.337 1.00 25.00 H new ATOM 0 HB THR A 823 1.541 6.842 -5.381 1.00 25.00 H new ATOM 0 HG1 THR A 823 0.258 4.884 -5.325 1.00 25.00 H new ATOM 0 HG21 THR A 823 -0.862 6.914 -5.868 1.00 25.00 H new ATOM 0 HG22 THR A 823 0.041 8.099 -6.842 1.00 25.00 H new ATOM 0 HG23 THR A 823 -0.521 6.582 -7.583 1.00 25.00 H new ATOM 1268 N ASP A 824 2.637 8.841 -6.821 1.00 25.00 N ATOM 1269 CA ASP A 824 3.412 9.957 -6.289 1.00 25.00 C ATOM 1270 C ASP A 824 3.286 10.016 -4.765 1.00 25.00 C ATOM 1271 O ASP A 824 4.246 10.276 -4.042 1.00 25.00 O ATOM 1272 CB ASP A 824 2.931 11.270 -6.913 1.00 25.00 C ATOM 1273 CG ASP A 824 1.531 11.663 -6.460 1.00 25.00 C ATOM 1274 OD1 ASP A 824 0.610 10.819 -6.569 1.00 25.00 O ATOM 1275 OD2 ASP A 824 1.351 12.803 -5.989 1.00 25.00 O ATOM 0 H ASP A 824 1.686 9.087 -7.096 1.00 25.00 H new ATOM 0 HA ASP A 824 4.462 9.809 -6.542 1.00 25.00 H new ATOM 0 HB2 ASP A 824 3.628 12.067 -6.654 1.00 25.00 H new ATOM 0 HB3 ASP A 824 2.943 11.176 -7.999 1.00 25.00 H new ATOM 1280 N THR A 825 2.103 9.670 -4.289 1.00 25.00 N ATOM 1281 CA THR A 825 1.799 9.533 -2.869 1.00 25.00 C ATOM 1282 C THR A 825 2.576 8.372 -2.273 1.00 25.00 C ATOM 1283 O THR A 825 2.689 8.250 -1.053 1.00 25.00 O ATOM 1284 CB THR A 825 0.326 9.250 -2.686 1.00 25.00 C ATOM 1285 OG1 THR A 825 -0.052 8.268 -3.645 1.00 25.00 O ATOM 1286 CG2 THR A 825 -0.506 10.482 -2.908 1.00 25.00 C ATOM 0 H THR A 825 1.305 9.471 -4.892 1.00 25.00 H new ATOM 0 HA THR A 825 2.075 10.462 -2.371 1.00 25.00 H new ATOM 0 HB THR A 825 0.157 8.907 -1.665 1.00 25.00 H new ATOM 0 HG1 THR A 825 -0.969 8.440 -3.946 1.00 25.00 H new ATOM 0 HG21 THR A 825 -1.559 10.240 -2.768 1.00 25.00 H new ATOM 0 HG22 THR A 825 -0.213 11.252 -2.195 1.00 25.00 H new ATOM 0 HG23 THR A 825 -0.350 10.849 -3.923 1.00 25.00 H new ATOM 1294 N ALA A 826 3.054 7.487 -3.135 1.00 25.00 N ATOM 1295 CA ALA A 826 3.789 6.298 -2.726 1.00 25.00 C ATOM 1296 C ALA A 826 5.021 6.620 -1.855 1.00 25.00 C ATOM 1297 O ALA A 826 5.450 5.797 -1.058 1.00 25.00 O ATOM 1298 CB ALA A 826 4.202 5.499 -3.972 1.00 25.00 C ATOM 0 H ALA A 826 2.942 7.574 -4.145 1.00 25.00 H new ATOM 0 HA ALA A 826 3.124 5.701 -2.103 1.00 25.00 H new ATOM 0 HB1 ALA A 826 4.752 4.609 -3.667 1.00 25.00 H new ATOM 0 HB2 ALA A 826 3.311 5.203 -4.526 1.00 25.00 H new ATOM 0 HB3 ALA A 826 4.836 6.118 -4.607 1.00 25.00 H new ATOM 1304 N ASP A 827 5.533 7.839 -1.947 1.00 25.00 N ATOM 1305 CA ASP A 827 6.656 8.271 -1.102 1.00 25.00 C ATOM 1306 C ASP A 827 6.280 8.178 0.379 1.00 25.00 C ATOM 1307 O ASP A 827 7.087 7.808 1.234 1.00 25.00 O ATOM 1308 CB ASP A 827 7.013 9.723 -1.428 1.00 25.00 C ATOM 1309 CG ASP A 827 8.184 10.238 -0.601 1.00 25.00 C ATOM 1310 OD1 ASP A 827 9.324 9.778 -0.818 1.00 25.00 O ATOM 1311 OD2 ASP A 827 7.964 11.142 0.238 1.00 25.00 O ATOM 0 H ASP A 827 5.195 8.551 -2.595 1.00 25.00 H new ATOM 0 HA ASP A 827 7.507 7.619 -1.299 1.00 25.00 H new ATOM 0 HB2 ASP A 827 7.257 9.804 -2.487 1.00 25.00 H new ATOM 0 HB3 ASP A 827 6.143 10.355 -1.252 1.00 25.00 H new ATOM 1316 N GLN A 828 5.026 8.483 0.675 1.00 25.00 N ATOM 1317 CA GLN A 828 4.537 8.480 2.047 1.00 25.00 C ATOM 1318 C GLN A 828 4.483 7.071 2.611 1.00 25.00 C ATOM 1319 O GLN A 828 4.801 6.850 3.777 1.00 25.00 O ATOM 1320 CB GLN A 828 3.119 9.040 2.110 1.00 25.00 C ATOM 1321 CG GLN A 828 2.903 10.365 1.387 1.00 25.00 C ATOM 1322 CD GLN A 828 1.439 10.747 1.379 1.00 25.00 C ATOM 1323 OE1 GLN A 828 1.056 11.828 1.808 1.00 25.00 O ATOM 1324 NE2 GLN A 828 0.614 9.847 0.914 1.00 25.00 N ATOM 0 H GLN A 828 4.324 8.737 -0.020 1.00 25.00 H new ATOM 0 HA GLN A 828 5.227 9.093 2.627 1.00 25.00 H new ATOM 0 HB2 GLN A 828 2.437 8.301 1.690 1.00 25.00 H new ATOM 0 HB3 GLN A 828 2.844 9.168 3.157 1.00 25.00 H new ATOM 0 HG2 GLN A 828 3.484 11.148 1.874 1.00 25.00 H new ATOM 0 HG3 GLN A 828 3.268 10.288 0.363 1.00 25.00 H new ATOM 0 HE21 GLN A 828 0.973 8.958 0.565 1.00 25.00 H new ATOM 0 HE22 GLN A 828 -0.389 10.033 0.900 1.00 25.00 H new ATOM 1333 N VAL A 829 4.024 6.123 1.803 1.00 25.00 N ATOM 1334 CA VAL A 829 3.857 4.760 2.293 1.00 25.00 C ATOM 1335 C VAL A 829 5.226 4.080 2.379 1.00 25.00 C ATOM 1336 O VAL A 829 5.489 3.326 3.309 1.00 25.00 O ATOM 1337 CB VAL A 829 2.818 3.923 1.452 1.00 25.00 C ATOM 1338 CG1 VAL A 829 3.218 3.795 0.004 1.00 25.00 C ATOM 1339 CG2 VAL A 829 2.636 2.537 2.053 1.00 25.00 C ATOM 0 H VAL A 829 3.766 6.267 0.827 1.00 25.00 H new ATOM 0 HA VAL A 829 3.427 4.809 3.293 1.00 25.00 H new ATOM 0 HB VAL A 829 1.875 4.468 1.490 1.00 25.00 H new ATOM 0 HG11 VAL A 829 2.469 3.210 -0.530 1.00 25.00 H new ATOM 0 HG12 VAL A 829 3.290 4.787 -0.443 1.00 25.00 H new ATOM 0 HG13 VAL A 829 4.184 3.296 -0.064 1.00 25.00 H new ATOM 0 HG21 VAL A 829 1.916 1.975 1.459 1.00 25.00 H new ATOM 0 HG22 VAL A 829 3.592 2.013 2.056 1.00 25.00 H new ATOM 0 HG23 VAL A 829 2.270 2.629 3.076 1.00 25.00 H new ATOM 1349 N MET A 830 6.132 4.414 1.470 1.00 25.00 N ATOM 1350 CA MET A 830 7.483 3.848 1.488 1.00 25.00 C ATOM 1351 C MET A 830 8.281 4.294 2.713 1.00 25.00 C ATOM 1352 O MET A 830 9.229 3.624 3.127 1.00 25.00 O ATOM 1353 CB MET A 830 8.239 4.262 0.232 1.00 25.00 C ATOM 1354 CG MET A 830 7.803 3.523 -1.028 1.00 25.00 C ATOM 1355 SD MET A 830 8.756 4.049 -2.477 1.00 25.00 S ATOM 1356 CE MET A 830 10.380 3.300 -2.161 1.00 25.00 C ATOM 0 H MET A 830 5.961 5.073 0.710 1.00 25.00 H new ATOM 0 HA MET A 830 7.373 2.764 1.528 1.00 25.00 H new ATOM 0 HB2 MET A 830 8.106 5.333 0.077 1.00 25.00 H new ATOM 0 HB3 MET A 830 9.304 4.093 0.389 1.00 25.00 H new ATOM 0 HG2 MET A 830 7.926 2.450 -0.881 1.00 25.00 H new ATOM 0 HG3 MET A 830 6.742 3.701 -1.206 1.00 25.00 H new ATOM 0 HE1 MET A 830 11.147 4.075 -2.174 1.00 25.00 H new ATOM 0 HE2 MET A 830 10.373 2.813 -1.186 1.00 25.00 H new ATOM 0 HE3 MET A 830 10.597 2.562 -2.933 1.00 25.00 H new ATOM 1366 N ALA A 831 7.875 5.394 3.332 1.00 25.00 N ATOM 1367 CA ALA A 831 8.533 5.869 4.546 1.00 25.00 C ATOM 1368 C ALA A 831 8.436 4.823 5.672 1.00 25.00 C ATOM 1369 O ALA A 831 9.277 4.792 6.578 1.00 25.00 O ATOM 1370 CB ALA A 831 7.910 7.197 4.989 1.00 25.00 C ATOM 0 H ALA A 831 7.097 5.973 3.017 1.00 25.00 H new ATOM 0 HA ALA A 831 9.589 6.027 4.329 1.00 25.00 H new ATOM 0 HB1 ALA A 831 8.405 7.547 5.895 1.00 25.00 H new ATOM 0 HB2 ALA A 831 8.033 7.938 4.199 1.00 25.00 H new ATOM 0 HB3 ALA A 831 6.848 7.052 5.188 1.00 25.00 H new ATOM 1376 N SER A 832 7.437 3.950 5.595 1.00 25.00 N ATOM 1377 CA SER A 832 7.242 2.895 6.592 1.00 25.00 C ATOM 1378 C SER A 832 8.428 1.948 6.684 1.00 25.00 C ATOM 1379 O SER A 832 8.683 1.394 7.748 1.00 25.00 O ATOM 1380 CB SER A 832 5.999 2.073 6.257 1.00 25.00 C ATOM 1381 OG SER A 832 6.171 1.406 5.022 1.00 25.00 O ATOM 0 H SER A 832 6.743 3.950 4.847 1.00 25.00 H new ATOM 0 HA SER A 832 7.128 3.399 7.552 1.00 25.00 H new ATOM 0 HB2 SER A 832 5.811 1.347 7.048 1.00 25.00 H new ATOM 0 HB3 SER A 832 5.126 2.724 6.208 1.00 25.00 H new ATOM 0 HG SER A 832 6.279 2.066 4.306 1.00 25.00 H new ATOM 1387 N PHE A 833 9.194 1.796 5.611 1.00 25.00 N ATOM 1388 CA PHE A 833 10.339 0.885 5.622 1.00 25.00 C ATOM 1389 C PHE A 833 11.384 1.311 6.656 1.00 25.00 C ATOM 1390 O PHE A 833 12.111 0.480 7.195 1.00 25.00 O ATOM 1391 CB PHE A 833 10.991 0.809 4.243 1.00 25.00 C ATOM 1392 CG PHE A 833 10.034 0.464 3.126 1.00 25.00 C ATOM 1393 CD1 PHE A 833 8.923 -0.389 3.335 1.00 25.00 C ATOM 1394 CD2 PHE A 833 10.243 0.998 1.841 1.00 25.00 C ATOM 1395 CE1 PHE A 833 8.031 -0.680 2.281 1.00 25.00 C ATOM 1396 CE2 PHE A 833 9.359 0.704 0.781 1.00 25.00 C ATOM 1397 CZ PHE A 833 8.248 -0.128 1.005 1.00 25.00 C ATOM 0 H PHE A 833 9.048 2.285 4.728 1.00 25.00 H new ATOM 0 HA PHE A 833 9.960 -0.100 5.894 1.00 25.00 H new ATOM 0 HB2 PHE A 833 11.460 1.768 4.022 1.00 25.00 H new ATOM 0 HB3 PHE A 833 11.786 0.063 4.269 1.00 25.00 H new ATOM 0 HD1 PHE A 833 8.757 -0.821 4.311 1.00 25.00 H new ATOM 0 HD2 PHE A 833 11.092 1.642 1.663 1.00 25.00 H new ATOM 0 HE1 PHE A 833 7.183 -1.326 2.454 1.00 25.00 H new ATOM 0 HE2 PHE A 833 9.536 1.118 -0.201 1.00 25.00 H new ATOM 0 HZ PHE A 833 7.562 -0.343 0.199 1.00 25.00 H new ATOM 1407 N LYS A 834 11.439 2.599 6.979 1.00 25.00 N ATOM 1408 CA LYS A 834 12.369 3.072 8.008 1.00 25.00 C ATOM 1409 C LYS A 834 11.886 2.633 9.386 1.00 25.00 C ATOM 1410 O LYS A 834 12.692 2.308 10.252 1.00 25.00 O ATOM 1411 CB LYS A 834 12.510 4.605 7.959 1.00 25.00 C ATOM 1412 CG LYS A 834 13.412 5.212 9.064 1.00 25.00 C ATOM 1413 CD LYS A 834 14.850 4.761 8.994 1.00 25.00 C ATOM 1414 CE LYS A 834 15.261 4.423 10.397 1.00 25.00 C ATOM 1415 NZ LYS A 834 16.364 3.411 10.471 1.00 25.00 N ATOM 0 H LYS A 834 10.863 3.326 6.554 1.00 25.00 H new ATOM 0 HA LYS A 834 13.348 2.634 7.815 1.00 25.00 H new ATOM 0 HB2 LYS A 834 12.912 4.888 6.986 1.00 25.00 H new ATOM 0 HB3 LYS A 834 11.518 5.049 8.035 1.00 25.00 H new ATOM 0 HG2 LYS A 834 13.378 6.299 8.991 1.00 25.00 H new ATOM 0 HG3 LYS A 834 13.005 4.945 10.039 1.00 25.00 H new ATOM 0 HD2 LYS A 834 14.953 3.895 8.341 1.00 25.00 H new ATOM 0 HD3 LYS A 834 15.483 5.547 8.583 1.00 25.00 H new ATOM 0 HE2 LYS A 834 15.581 5.334 10.903 1.00 25.00 H new ATOM 0 HE3 LYS A 834 14.395 4.044 10.939 1.00 25.00 H new ATOM 0 HZ1 LYS A 834 16.064 2.613 11.066 1.00 25.00 H new ATOM 0 HZ2 LYS A 834 16.583 3.066 9.515 1.00 25.00 H new ATOM 0 HZ3 LYS A 834 17.211 3.851 10.883 1.00 25.00 H new ATOM 1429 N ILE A 835 10.578 2.614 9.579 1.00 25.00 N ATOM 1430 CA ILE A 835 9.990 2.216 10.860 1.00 25.00 C ATOM 1431 C ILE A 835 10.174 0.708 11.001 1.00 25.00 C ATOM 1432 O ILE A 835 10.534 0.215 12.066 1.00 25.00 O ATOM 1433 CB ILE A 835 8.466 2.597 10.954 1.00 25.00 C ATOM 1434 CG1 ILE A 835 8.302 4.128 11.059 1.00 25.00 C ATOM 1435 CG2 ILE A 835 7.812 1.964 12.208 1.00 25.00 C ATOM 1436 CD1 ILE A 835 8.202 4.866 9.742 1.00 25.00 C ATOM 0 H ILE A 835 9.895 2.870 8.866 1.00 25.00 H new ATOM 0 HA ILE A 835 10.490 2.748 11.670 1.00 25.00 H new ATOM 0 HB ILE A 835 7.981 2.221 10.053 1.00 25.00 H new ATOM 0 HG12 ILE A 835 7.407 4.340 11.643 1.00 25.00 H new ATOM 0 HG13 ILE A 835 9.149 4.529 11.616 1.00 25.00 H new ATOM 0 HG21 ILE A 835 6.759 2.243 12.249 1.00 25.00 H new ATOM 0 HG22 ILE A 835 7.898 0.879 12.155 1.00 25.00 H new ATOM 0 HG23 ILE A 835 8.318 2.325 13.104 1.00 25.00 H new ATOM 0 HD11 ILE A 835 8.089 5.934 9.931 1.00 25.00 H new ATOM 0 HD12 ILE A 835 9.107 4.694 9.159 1.00 25.00 H new ATOM 0 HD13 ILE A 835 7.338 4.503 9.186 1.00 25.00 H new ATOM 1448 N LEU A 836 9.981 0.000 9.897 1.00 25.00 N ATOM 1449 CA LEU A 836 10.151 -1.449 9.842 1.00 25.00 C ATOM 1450 C LEU A 836 11.592 -1.842 10.193 1.00 25.00 C ATOM 1451 O LEU A 836 11.825 -2.775 10.953 1.00 25.00 O ATOM 1452 CB LEU A 836 9.824 -1.921 8.421 1.00 25.00 C ATOM 1453 CG LEU A 836 8.932 -3.148 8.187 1.00 25.00 C ATOM 1454 CD1 LEU A 836 9.144 -3.584 6.743 1.00 25.00 C ATOM 1455 CD2 LEU A 836 9.190 -4.329 9.112 1.00 25.00 C ATOM 0 H LEU A 836 9.701 0.415 9.008 1.00 25.00 H new ATOM 0 HA LEU A 836 9.484 -1.918 10.565 1.00 25.00 H new ATOM 0 HB2 LEU A 836 9.357 -1.082 7.904 1.00 25.00 H new ATOM 0 HB3 LEU A 836 10.773 -2.115 7.921 1.00 25.00 H new ATOM 0 HG LEU A 836 7.907 -2.845 8.403 1.00 25.00 H new ATOM 0 HD11 LEU A 836 8.527 -4.457 6.532 1.00 25.00 H new ATOM 0 HD12 LEU A 836 8.864 -2.771 6.073 1.00 25.00 H new ATOM 0 HD13 LEU A 836 10.193 -3.836 6.589 1.00 25.00 H new ATOM 0 HD21 LEU A 836 8.508 -5.142 8.863 1.00 25.00 H new ATOM 0 HD22 LEU A 836 10.219 -4.668 8.990 1.00 25.00 H new ATOM 0 HD23 LEU A 836 9.028 -4.024 10.146 1.00 25.00 H new ATOM 1467 N ALA A 837 12.555 -1.106 9.647 1.00 25.00 N ATOM 1468 CA ALA A 837 13.970 -1.348 9.929 1.00 25.00 C ATOM 1469 C ALA A 837 14.285 -0.970 11.388 1.00 25.00 C ATOM 1470 O ALA A 837 15.032 -1.651 12.080 1.00 25.00 O ATOM 1471 CB ALA A 837 14.854 -0.509 8.949 1.00 25.00 C ATOM 0 H ALA A 837 12.382 -0.333 9.004 1.00 25.00 H new ATOM 0 HA ALA A 837 14.190 -2.406 9.786 1.00 25.00 H new ATOM 0 HB1 ALA A 837 15.907 -0.692 9.162 1.00 25.00 H new ATOM 0 HB2 ALA A 837 14.636 -0.801 7.922 1.00 25.00 H new ATOM 0 HB3 ALA A 837 14.636 0.551 9.079 1.00 25.00 H new ATOM 1477 N GLY A 838 13.739 0.147 11.837 1.00 25.00 N ATOM 1478 CA GLY A 838 14.022 0.633 13.175 1.00 25.00 C ATOM 1479 C GLY A 838 15.332 1.397 13.226 1.00 25.00 C ATOM 1480 O GLY A 838 15.348 2.614 13.049 1.00 25.00 O ATOM 0 H GLY A 838 13.100 0.731 11.297 1.00 25.00 H new ATOM 0 HA2 GLY A 838 13.210 1.280 13.507 1.00 25.00 H new ATOM 0 HA3 GLY A 838 14.063 -0.208 13.867 1.00 25.00 H new ATOM 1484 N ASP A 839 16.438 0.702 13.458 1.00 25.00 N ATOM 1485 CA ASP A 839 17.755 1.343 13.583 1.00 25.00 C ATOM 1486 C ASP A 839 18.729 0.954 12.474 1.00 25.00 C ATOM 1487 O ASP A 839 19.740 1.621 12.261 1.00 25.00 O ATOM 1488 CB ASP A 839 18.388 0.974 14.930 1.00 25.00 C ATOM 1489 CG ASP A 839 18.874 -0.473 14.974 1.00 25.00 C ATOM 1490 OD1 ASP A 839 18.118 -1.377 14.545 1.00 25.00 O ATOM 1491 OD2 ASP A 839 20.013 -0.703 15.425 1.00 25.00 O ATOM 0 H ASP A 839 16.456 -0.312 13.565 1.00 25.00 H new ATOM 0 HA ASP A 839 17.577 2.416 13.506 1.00 25.00 H new ATOM 0 HB2 ASP A 839 19.227 1.641 15.128 1.00 25.00 H new ATOM 0 HB3 ASP A 839 17.660 1.133 15.725 1.00 25.00 H new ATOM 1496 N LYS A 840 18.448 -0.145 11.790 1.00 25.00 N ATOM 1497 CA LYS A 840 19.384 -0.708 10.822 1.00 25.00 C ATOM 1498 C LYS A 840 19.354 0.105 9.540 1.00 25.00 C ATOM 1499 O LYS A 840 18.376 0.791 9.253 1.00 25.00 O ATOM 1500 CB LYS A 840 19.055 -2.186 10.585 1.00 25.00 C ATOM 1501 CG LYS A 840 17.596 -2.441 10.286 1.00 25.00 C ATOM 1502 CD LYS A 840 17.172 -3.866 10.546 1.00 25.00 C ATOM 1503 CE LYS A 840 17.685 -4.849 9.512 1.00 25.00 C ATOM 1504 NZ LYS A 840 17.170 -6.210 9.837 1.00 25.00 N ATOM 0 H LYS A 840 17.577 -0.668 11.886 1.00 25.00 H new ATOM 0 HA LYS A 840 20.401 -0.658 11.212 1.00 25.00 H new ATOM 0 HB2 LYS A 840 19.657 -2.555 9.755 1.00 25.00 H new ATOM 0 HB3 LYS A 840 19.342 -2.759 11.466 1.00 25.00 H new ATOM 0 HG2 LYS A 840 16.986 -1.772 10.892 1.00 25.00 H new ATOM 0 HG3 LYS A 840 17.398 -2.195 9.243 1.00 25.00 H new ATOM 0 HD2 LYS A 840 17.528 -4.168 11.531 1.00 25.00 H new ATOM 0 HD3 LYS A 840 16.083 -3.914 10.572 1.00 25.00 H new ATOM 0 HE2 LYS A 840 17.359 -4.551 8.515 1.00 25.00 H new ATOM 0 HE3 LYS A 840 18.775 -4.851 9.503 1.00 25.00 H new ATOM 0 HZ1 LYS A 840 17.968 -6.869 9.934 1.00 25.00 H new ATOM 0 HZ2 LYS A 840 16.639 -6.176 10.730 1.00 25.00 H new ATOM 0 HZ3 LYS A 840 16.543 -6.535 9.074 1.00 25.00 H new ATOM 1518 N ASN A 841 20.440 0.050 8.782 1.00 25.00 N ATOM 1519 CA ASN A 841 20.577 0.837 7.552 1.00 25.00 C ATOM 1520 C ASN A 841 20.068 0.103 6.321 1.00 25.00 C ATOM 1521 O ASN A 841 20.149 0.621 5.223 1.00 25.00 O ATOM 1522 CB ASN A 841 22.049 1.176 7.308 1.00 25.00 C ATOM 1523 CG ASN A 841 22.836 0.003 6.929 1.00 25.00 C ATOM 1524 OD1 ASN A 841 23.001 -0.962 7.659 1.00 25.00 O ATOM 1525 ND2 ASN A 841 23.312 0.073 5.750 1.00 25.00 N ATOM 0 H ASN A 841 21.248 -0.535 8.995 1.00 25.00 H new ATOM 0 HA ASN A 841 19.976 1.735 7.699 1.00 25.00 H new ATOM 0 HB2 ASN A 841 22.120 1.928 6.522 1.00 25.00 H new ATOM 0 HB3 ASN A 841 22.472 1.618 8.210 1.00 25.00 H new ATOM 0 HD21 ASN A 841 23.861 -0.701 5.375 1.00 25.00 H new ATOM 0 HD22 ASN A 841 23.145 0.903 5.181 1.00 25.00 H new ATOM 1532 N TYR A 842 19.576 -1.110 6.498 1.00 25.00 N ATOM 1533 CA TYR A 842 19.086 -1.901 5.376 1.00 25.00 C ATOM 1534 C TYR A 842 17.898 -2.660 5.924 1.00 25.00 C ATOM 1535 O TYR A 842 17.792 -2.807 7.121 1.00 25.00 O ATOM 1536 CB TYR A 842 20.170 -2.866 4.865 1.00 25.00 C ATOM 1537 CG TYR A 842 20.414 -4.046 5.782 1.00 25.00 C ATOM 1538 CD1 TYR A 842 19.679 -5.239 5.627 1.00 25.00 C ATOM 1539 CD2 TYR A 842 21.375 -3.981 6.806 1.00 25.00 C ATOM 1540 CE1 TYR A 842 19.888 -6.344 6.482 1.00 25.00 C ATOM 1541 CE2 TYR A 842 21.586 -5.088 7.677 1.00 25.00 C ATOM 1542 CZ TYR A 842 20.835 -6.257 7.505 1.00 25.00 C ATOM 1543 OH TYR A 842 21.029 -7.322 8.346 1.00 25.00 O ATOM 0 H TYR A 842 19.504 -1.571 7.405 1.00 25.00 H new ATOM 0 HA TYR A 842 18.814 -1.277 4.525 1.00 25.00 H new ATOM 0 HB2 TYR A 842 19.881 -3.235 3.881 1.00 25.00 H new ATOM 0 HB3 TYR A 842 21.103 -2.317 4.738 1.00 25.00 H new ATOM 0 HD1 TYR A 842 18.943 -5.309 4.840 1.00 25.00 H new ATOM 0 HD2 TYR A 842 21.960 -3.082 6.934 1.00 25.00 H new ATOM 0 HE1 TYR A 842 19.318 -7.251 6.345 1.00 25.00 H new ATOM 0 HE2 TYR A 842 22.321 -5.026 8.466 1.00 25.00 H new ATOM 0 HH TYR A 842 21.723 -7.099 9.001 1.00 25.00 H new ATOM 1553 N ILE A 843 17.023 -3.145 5.066 1.00 25.00 N ATOM 1554 CA ILE A 843 15.889 -3.960 5.468 1.00 25.00 C ATOM 1555 C ILE A 843 16.142 -5.332 4.883 1.00 25.00 C ATOM 1556 O ILE A 843 16.791 -5.461 3.853 1.00 25.00 O ATOM 1557 CB ILE A 843 14.551 -3.354 4.933 1.00 25.00 C ATOM 1558 CG1 ILE A 843 13.358 -3.853 5.752 1.00 25.00 C ATOM 1559 CG2 ILE A 843 14.341 -3.610 3.446 1.00 25.00 C ATOM 1560 CD1 ILE A 843 13.193 -3.018 6.947 1.00 25.00 C ATOM 0 H ILE A 843 17.078 -2.984 4.060 1.00 25.00 H new ATOM 0 HA ILE A 843 15.790 -4.005 6.553 1.00 25.00 H new ATOM 0 HB ILE A 843 14.626 -2.273 5.054 1.00 25.00 H new ATOM 0 HG12 ILE A 843 12.452 -3.822 5.147 1.00 25.00 H new ATOM 0 HG13 ILE A 843 13.513 -4.892 6.042 1.00 25.00 H new ATOM 0 HG21 ILE A 843 13.397 -3.167 3.130 1.00 25.00 H new ATOM 0 HG22 ILE A 843 15.159 -3.163 2.881 1.00 25.00 H new ATOM 0 HG23 ILE A 843 14.317 -4.684 3.261 1.00 25.00 H new ATOM 0 HD11 ILE A 843 12.343 -3.377 7.527 1.00 25.00 H new ATOM 0 HD12 ILE A 843 14.096 -3.071 7.556 1.00 25.00 H new ATOM 0 HD13 ILE A 843 13.018 -1.985 6.647 1.00 25.00 H new ATOM 1572 N THR A 844 15.665 -6.368 5.528 1.00 25.00 N ATOM 1573 CA THR A 844 15.785 -7.693 4.949 1.00 25.00 C ATOM 1574 C THR A 844 14.553 -7.897 4.081 1.00 25.00 C ATOM 1575 O THR A 844 13.499 -7.319 4.344 1.00 25.00 O ATOM 1576 CB THR A 844 15.856 -8.810 6.009 1.00 25.00 C ATOM 1577 OG1 THR A 844 14.686 -8.773 6.821 1.00 25.00 O ATOM 1578 CG2 THR A 844 17.061 -8.659 6.906 1.00 25.00 C ATOM 0 H THR A 844 15.199 -6.328 6.434 1.00 25.00 H new ATOM 0 HA THR A 844 16.714 -7.753 4.383 1.00 25.00 H new ATOM 0 HB THR A 844 15.933 -9.759 5.478 1.00 25.00 H new ATOM 0 HG1 THR A 844 14.674 -7.941 7.339 1.00 25.00 H new ATOM 0 HG21 THR A 844 17.073 -9.466 7.638 1.00 25.00 H new ATOM 0 HG22 THR A 844 17.969 -8.701 6.305 1.00 25.00 H new ATOM 0 HG23 THR A 844 17.012 -7.701 7.423 1.00 25.00 H new ATOM 1586 N MET A 845 14.661 -8.759 3.084 1.00 25.00 N ATOM 1587 CA MET A 845 13.510 -9.130 2.267 1.00 25.00 C ATOM 1588 C MET A 845 12.431 -9.722 3.161 1.00 25.00 C ATOM 1589 O MET A 845 11.252 -9.567 2.910 1.00 25.00 O ATOM 1590 CB MET A 845 13.918 -10.171 1.226 1.00 25.00 C ATOM 1591 CG MET A 845 14.976 -9.675 0.285 1.00 25.00 C ATOM 1592 SD MET A 845 15.384 -10.837 -1.006 1.00 25.00 S ATOM 1593 CE MET A 845 16.603 -9.867 -1.847 1.00 25.00 C ATOM 0 H MET A 845 15.533 -9.217 2.818 1.00 25.00 H new ATOM 0 HA MET A 845 13.133 -8.242 1.760 1.00 25.00 H new ATOM 0 HB2 MET A 845 14.282 -11.063 1.736 1.00 25.00 H new ATOM 0 HB3 MET A 845 13.040 -10.467 0.653 1.00 25.00 H new ATOM 0 HG2 MET A 845 14.639 -8.743 -0.169 1.00 25.00 H new ATOM 0 HG3 MET A 845 15.877 -9.445 0.853 1.00 25.00 H new ATOM 0 HE1 MET A 845 17.520 -10.447 -1.953 1.00 25.00 H new ATOM 0 HE2 MET A 845 16.231 -9.592 -2.834 1.00 25.00 H new ATOM 0 HE3 MET A 845 16.810 -8.964 -1.272 1.00 25.00 H new ATOM 1603 N ASP A 846 12.865 -10.396 4.214 1.00 25.00 N ATOM 1604 CA ASP A 846 11.970 -11.035 5.169 1.00 25.00 C ATOM 1605 C ASP A 846 11.149 -10.011 5.960 1.00 25.00 C ATOM 1606 O ASP A 846 10.005 -10.263 6.293 1.00 25.00 O ATOM 1607 CB ASP A 846 12.802 -11.891 6.128 1.00 25.00 C ATOM 1608 CG ASP A 846 11.960 -12.875 6.918 1.00 25.00 C ATOM 1609 OD1 ASP A 846 10.893 -13.302 6.431 1.00 25.00 O ATOM 1610 OD2 ASP A 846 12.378 -13.243 8.035 1.00 25.00 O ATOM 0 H ASP A 846 13.854 -10.517 4.433 1.00 25.00 H new ATOM 0 HA ASP A 846 11.265 -11.656 4.617 1.00 25.00 H new ATOM 0 HB2 ASP A 846 13.555 -12.438 5.560 1.00 25.00 H new ATOM 0 HB3 ASP A 846 13.336 -11.239 6.820 1.00 25.00 H new ATOM 1615 N GLU A 847 11.718 -8.842 6.231 1.00 25.00 N ATOM 1616 CA GLU A 847 10.993 -7.793 6.958 1.00 25.00 C ATOM 1617 C GLU A 847 9.912 -7.174 6.075 1.00 25.00 C ATOM 1618 O GLU A 847 8.803 -6.922 6.532 1.00 25.00 O ATOM 1619 CB GLU A 847 11.961 -6.720 7.489 1.00 25.00 C ATOM 1620 CG GLU A 847 12.631 -7.173 8.803 1.00 25.00 C ATOM 1621 CD GLU A 847 13.985 -6.526 9.076 1.00 25.00 C ATOM 1622 OE1 GLU A 847 14.744 -6.275 8.116 1.00 25.00 O ATOM 1623 OE2 GLU A 847 14.373 -6.430 10.255 1.00 25.00 O ATOM 0 H GLU A 847 12.670 -8.593 5.963 1.00 25.00 H new ATOM 0 HA GLU A 847 10.504 -8.250 7.818 1.00 25.00 H new ATOM 0 HB2 GLU A 847 12.726 -6.514 6.740 1.00 25.00 H new ATOM 0 HB3 GLU A 847 11.420 -5.789 7.656 1.00 25.00 H new ATOM 0 HG2 GLU A 847 11.961 -6.950 9.634 1.00 25.00 H new ATOM 0 HG3 GLU A 847 12.758 -8.255 8.778 1.00 25.00 H new ATOM 1630 N LEU A 848 10.196 -7.011 4.791 1.00 25.00 N ATOM 1631 CA LEU A 848 9.175 -6.527 3.859 1.00 25.00 C ATOM 1632 C LEU A 848 8.097 -7.596 3.736 1.00 25.00 C ATOM 1633 O LEU A 848 6.912 -7.313 3.713 1.00 25.00 O ATOM 1634 CB LEU A 848 9.784 -6.252 2.482 1.00 25.00 C ATOM 1635 CG LEU A 848 10.823 -5.123 2.441 1.00 25.00 C ATOM 1636 CD1 LEU A 848 11.533 -5.162 1.102 1.00 25.00 C ATOM 1637 CD2 LEU A 848 10.180 -3.751 2.653 1.00 25.00 C ATOM 0 H LEU A 848 11.106 -7.201 4.371 1.00 25.00 H new ATOM 0 HA LEU A 848 8.752 -5.595 4.235 1.00 25.00 H new ATOM 0 HB2 LEU A 848 10.251 -7.168 2.120 1.00 25.00 H new ATOM 0 HB3 LEU A 848 8.979 -6.009 1.788 1.00 25.00 H new ATOM 0 HG LEU A 848 11.534 -5.276 3.253 1.00 25.00 H new ATOM 0 HD11 LEU A 848 12.274 -4.364 1.060 1.00 25.00 H new ATOM 0 HD12 LEU A 848 12.029 -6.125 0.981 1.00 25.00 H new ATOM 0 HD13 LEU A 848 10.807 -5.025 0.301 1.00 25.00 H new ATOM 0 HD21 LEU A 848 10.949 -2.979 2.617 1.00 25.00 H new ATOM 0 HD22 LEU A 848 9.445 -3.568 1.869 1.00 25.00 H new ATOM 0 HD23 LEU A 848 9.687 -3.727 3.625 1.00 25.00 H new ATOM 1649 N ARG A 849 8.524 -8.847 3.736 1.00 25.00 N ATOM 1650 CA ARG A 849 7.624 -10.001 3.667 1.00 25.00 C ATOM 1651 C ARG A 849 7.068 -10.339 5.047 1.00 25.00 C ATOM 1652 O ARG A 849 6.823 -11.507 5.360 1.00 25.00 O ATOM 1653 CB ARG A 849 8.386 -11.204 3.110 1.00 25.00 C ATOM 1654 CG ARG A 849 8.735 -11.065 1.640 1.00 25.00 C ATOM 1655 CD ARG A 849 9.697 -12.158 1.207 1.00 25.00 C ATOM 1656 NE ARG A 849 9.097 -13.493 1.367 1.00 25.00 N ATOM 1657 CZ ARG A 849 8.294 -14.087 0.490 1.00 25.00 C ATOM 1658 NH1 ARG A 849 7.955 -13.529 -0.648 1.00 25.00 N ATOM 1659 NH2 ARG A 849 7.817 -15.267 0.769 1.00 25.00 N ATOM 0 H ARG A 849 9.511 -9.100 3.784 1.00 25.00 H new ATOM 0 HA ARG A 849 6.789 -9.755 3.011 1.00 25.00 H new ATOM 0 HB2 ARG A 849 9.303 -11.341 3.683 1.00 25.00 H new ATOM 0 HB3 ARG A 849 7.785 -12.103 3.250 1.00 25.00 H new ATOM 0 HG2 ARG A 849 7.827 -11.116 1.040 1.00 25.00 H new ATOM 0 HG3 ARG A 849 9.183 -10.088 1.459 1.00 25.00 H new ATOM 0 HD2 ARG A 849 9.978 -12.006 0.165 1.00 25.00 H new ATOM 0 HD3 ARG A 849 10.612 -12.095 1.797 1.00 25.00 H new ATOM 0 HE ARG A 849 9.316 -14.005 2.222 1.00 25.00 H new ATOM 0 HH11 ARG A 849 8.311 -12.604 -0.888 1.00 25.00 H new ATOM 0 HH12 ARG A 849 7.336 -14.021 -1.293 1.00 25.00 H new ATOM 0 HH21 ARG A 849 8.061 -15.721 1.649 1.00 25.00 H new ATOM 0 HH22 ARG A 849 7.199 -15.737 0.107 1.00 25.00 H new ATOM 1673 N ARG A 850 6.878 -9.327 5.880 1.00 25.00 N ATOM 1674 CA ARG A 850 6.325 -9.544 7.213 1.00 25.00 C ATOM 1675 C ARG A 850 5.131 -8.660 7.324 1.00 25.00 C ATOM 1676 O ARG A 850 4.115 -9.032 7.886 1.00 25.00 O ATOM 1677 CB ARG A 850 7.336 -9.180 8.294 1.00 25.00 C ATOM 1678 CG ARG A 850 6.878 -9.542 9.701 1.00 25.00 C ATOM 1679 CD ARG A 850 6.890 -11.055 9.945 1.00 25.00 C ATOM 1680 NE ARG A 850 8.254 -11.553 10.192 1.00 25.00 N ATOM 1681 CZ ARG A 850 9.048 -12.137 9.297 1.00 25.00 C ATOM 1682 NH1 ARG A 850 8.694 -12.363 8.059 1.00 25.00 N ATOM 1683 NH2 ARG A 850 10.235 -12.498 9.679 1.00 25.00 N ATOM 0 H ARG A 850 7.096 -8.355 5.662 1.00 25.00 H new ATOM 0 HA ARG A 850 6.067 -10.594 7.352 1.00 25.00 H new ATOM 0 HB2 ARG A 850 8.278 -9.687 8.085 1.00 25.00 H new ATOM 0 HB3 ARG A 850 7.534 -8.109 8.249 1.00 25.00 H new ATOM 0 HG2 ARG A 850 7.526 -9.054 10.429 1.00 25.00 H new ATOM 0 HG3 ARG A 850 5.871 -9.158 9.863 1.00 25.00 H new ATOM 0 HD2 ARG A 850 6.255 -11.292 10.799 1.00 25.00 H new ATOM 0 HD3 ARG A 850 6.466 -11.567 9.081 1.00 25.00 H new ATOM 0 HE ARG A 850 8.624 -11.440 11.136 1.00 25.00 H new ATOM 0 HH11 ARG A 850 7.767 -12.088 7.735 1.00 25.00 H new ATOM 0 HH12 ARG A 850 9.345 -12.815 7.417 1.00 25.00 H new ATOM 0 HH21 ARG A 850 10.534 -12.332 10.640 1.00 25.00 H new ATOM 0 HH22 ARG A 850 10.868 -12.948 9.018 1.00 25.00 H new ATOM 1697 N GLU A 851 5.277 -7.479 6.759 1.00 25.00 N ATOM 1698 CA GLU A 851 4.204 -6.511 6.756 1.00 25.00 C ATOM 1699 C GLU A 851 3.419 -6.652 5.440 1.00 25.00 C ATOM 1700 O GLU A 851 2.259 -6.264 5.361 1.00 25.00 O ATOM 1701 CB GLU A 851 4.785 -5.103 6.963 1.00 25.00 C ATOM 1702 CG GLU A 851 5.556 -4.572 5.781 1.00 25.00 C ATOM 1703 CD GLU A 851 5.961 -3.110 5.927 1.00 25.00 C ATOM 1704 OE1 GLU A 851 5.699 -2.507 6.992 1.00 25.00 O ATOM 1705 OE2 GLU A 851 6.572 -2.573 4.976 1.00 25.00 O ATOM 0 H GLU A 851 6.131 -7.168 6.296 1.00 25.00 H new ATOM 0 HA GLU A 851 3.508 -6.687 7.576 1.00 25.00 H new ATOM 0 HB2 GLU A 851 3.970 -4.416 7.189 1.00 25.00 H new ATOM 0 HB3 GLU A 851 5.441 -5.117 7.834 1.00 25.00 H new ATOM 0 HG2 GLU A 851 6.452 -5.177 5.640 1.00 25.00 H new ATOM 0 HG3 GLU A 851 4.951 -4.685 4.882 1.00 25.00 H new ATOM 1712 N LEU A 852 4.051 -7.253 4.429 1.00 25.00 N ATOM 1713 CA LEU A 852 3.420 -7.477 3.119 1.00 25.00 C ATOM 1714 C LEU A 852 3.438 -8.966 2.706 1.00 25.00 C ATOM 1715 O LEU A 852 4.290 -9.396 1.930 1.00 25.00 O ATOM 1716 CB LEU A 852 4.117 -6.653 2.002 1.00 25.00 C ATOM 1717 CG LEU A 852 4.625 -5.256 2.378 1.00 25.00 C ATOM 1718 CD1 LEU A 852 5.566 -4.660 1.392 1.00 25.00 C ATOM 1719 CD2 LEU A 852 3.501 -4.276 2.713 1.00 25.00 C ATOM 0 H LEU A 852 5.009 -7.598 4.491 1.00 25.00 H new ATOM 0 HA LEU A 852 2.386 -7.151 3.231 1.00 25.00 H new ATOM 0 HB2 LEU A 852 4.963 -7.232 1.632 1.00 25.00 H new ATOM 0 HB3 LEU A 852 3.417 -6.547 1.173 1.00 25.00 H new ATOM 0 HG LEU A 852 5.199 -5.429 3.288 1.00 25.00 H new ATOM 0 HD11 LEU A 852 5.876 -3.673 1.735 1.00 25.00 H new ATOM 0 HD12 LEU A 852 6.442 -5.301 1.292 1.00 25.00 H new ATOM 0 HD13 LEU A 852 5.071 -4.569 0.425 1.00 25.00 H new ATOM 0 HD21 LEU A 852 3.928 -3.307 2.970 1.00 25.00 H new ATOM 0 HD22 LEU A 852 2.845 -4.166 1.850 1.00 25.00 H new ATOM 0 HD23 LEU A 852 2.927 -4.656 3.558 1.00 25.00 H new ATOM 1731 N PRO A 853 2.445 -9.756 3.145 1.00 25.00 N ATOM 1732 CA PRO A 853 2.302 -11.062 2.469 1.00 25.00 C ATOM 1733 C PRO A 853 2.149 -11.084 0.897 1.00 25.00 C ATOM 1734 O PRO A 853 2.564 -12.060 0.268 1.00 25.00 O ATOM 1735 CB PRO A 853 1.030 -11.640 3.115 1.00 25.00 C ATOM 1736 CG PRO A 853 0.904 -10.923 4.420 1.00 25.00 C ATOM 1737 CD PRO A 853 1.367 -9.533 4.129 1.00 25.00 C ATOM 0 HA PRO A 853 3.230 -11.618 2.602 1.00 25.00 H new ATOM 0 HB2 PRO A 853 0.156 -11.472 2.486 1.00 25.00 H new ATOM 0 HB3 PRO A 853 1.115 -12.717 3.262 1.00 25.00 H new ATOM 0 HG2 PRO A 853 -0.125 -10.932 4.780 1.00 25.00 H new ATOM 0 HG3 PRO A 853 1.515 -11.392 5.191 1.00 25.00 H new ATOM 0 HD2 PRO A 853 0.567 -8.915 3.721 1.00 25.00 H new ATOM 0 HD3 PRO A 853 1.732 -9.031 5.025 1.00 25.00 H new ATOM 1745 N PRO A 854 1.498 -10.069 0.260 1.00 25.00 N ATOM 1746 CA PRO A 854 1.240 -10.110 -1.187 1.00 25.00 C ATOM 1747 C PRO A 854 2.386 -9.693 -2.117 1.00 25.00 C ATOM 1748 O PRO A 854 3.517 -9.479 -1.693 1.00 25.00 O ATOM 1749 CB PRO A 854 0.122 -9.077 -1.319 1.00 25.00 C ATOM 1750 CG PRO A 854 0.444 -8.113 -0.378 1.00 25.00 C ATOM 1751 CD PRO A 854 0.859 -8.861 0.810 1.00 25.00 C ATOM 0 HA PRO A 854 1.039 -11.137 -1.493 1.00 25.00 H new ATOM 0 HB2 PRO A 854 0.083 -8.657 -2.324 1.00 25.00 H new ATOM 0 HB3 PRO A 854 -0.855 -9.518 -1.120 1.00 25.00 H new ATOM 0 HG2 PRO A 854 1.245 -7.466 -0.735 1.00 25.00 H new ATOM 0 HG3 PRO A 854 -0.411 -7.473 -0.162 1.00 25.00 H new ATOM 0 HD2 PRO A 854 1.553 -8.285 1.423 1.00 25.00 H new ATOM 0 HD3 PRO A 854 0.007 -9.112 1.442 1.00 25.00 H new ATOM 1759 N ASP A 855 2.035 -9.496 -3.387 1.00 25.00 N ATOM 1760 CA ASP A 855 2.953 -9.013 -4.427 1.00 25.00 C ATOM 1761 C ASP A 855 3.629 -7.702 -4.086 1.00 25.00 C ATOM 1762 O ASP A 855 4.695 -7.395 -4.607 1.00 25.00 O ATOM 1763 CB ASP A 855 2.197 -8.775 -5.732 1.00 25.00 C ATOM 1764 CG ASP A 855 1.968 -10.035 -6.505 1.00 25.00 C ATOM 1765 OD1 ASP A 855 1.983 -11.131 -5.911 1.00 25.00 O ATOM 1766 OD2 ASP A 855 1.738 -9.951 -7.727 1.00 25.00 O ATOM 0 H ASP A 855 1.091 -9.669 -3.731 1.00 25.00 H new ATOM 0 HA ASP A 855 3.710 -9.792 -4.515 1.00 25.00 H new ATOM 0 HB2 ASP A 855 1.236 -8.310 -5.511 1.00 25.00 H new ATOM 0 HB3 ASP A 855 2.757 -8.072 -6.349 1.00 25.00 H new ATOM 1771 N GLN A 856 3.034 -6.921 -3.205 1.00 25.00 N ATOM 1772 CA GLN A 856 3.647 -5.672 -2.805 1.00 25.00 C ATOM 1773 C GLN A 856 5.038 -5.928 -2.197 1.00 25.00 C ATOM 1774 O GLN A 856 5.940 -5.123 -2.388 1.00 25.00 O ATOM 1775 CB GLN A 856 2.737 -4.907 -1.831 1.00 25.00 C ATOM 1776 CG GLN A 856 1.552 -4.180 -2.536 1.00 25.00 C ATOM 1777 CD GLN A 856 0.259 -4.988 -2.546 1.00 25.00 C ATOM 1778 OE1 GLN A 856 0.255 -6.179 -2.818 1.00 25.00 O ATOM 1779 NE2 GLN A 856 -0.841 -4.338 -2.272 1.00 25.00 N ATOM 0 H GLN A 856 2.140 -7.126 -2.759 1.00 25.00 H new ATOM 0 HA GLN A 856 3.779 -5.048 -3.689 1.00 25.00 H new ATOM 0 HB2 GLN A 856 2.339 -5.604 -1.093 1.00 25.00 H new ATOM 0 HB3 GLN A 856 3.333 -4.173 -1.288 1.00 25.00 H new ATOM 0 HG2 GLN A 856 1.372 -3.228 -2.036 1.00 25.00 H new ATOM 0 HG3 GLN A 856 1.836 -3.952 -3.563 1.00 25.00 H new ATOM 0 HE21 GLN A 856 -0.804 -3.343 -2.049 1.00 25.00 H new ATOM 0 HE22 GLN A 856 -1.737 -4.825 -2.281 1.00 25.00 H new ATOM 1788 N ALA A 857 5.259 -7.080 -1.567 1.00 25.00 N ATOM 1789 CA ALA A 857 6.595 -7.401 -1.065 1.00 25.00 C ATOM 1790 C ALA A 857 7.606 -7.547 -2.201 1.00 25.00 C ATOM 1791 O ALA A 857 8.695 -7.009 -2.120 1.00 25.00 O ATOM 1792 CB ALA A 857 6.574 -8.685 -0.227 1.00 25.00 C ATOM 0 H ALA A 857 4.550 -7.792 -1.394 1.00 25.00 H new ATOM 0 HA ALA A 857 6.905 -6.568 -0.434 1.00 25.00 H new ATOM 0 HB1 ALA A 857 7.580 -8.901 0.134 1.00 25.00 H new ATOM 0 HB2 ALA A 857 5.904 -8.554 0.623 1.00 25.00 H new ATOM 0 HB3 ALA A 857 6.223 -9.515 -0.841 1.00 25.00 H new ATOM 1798 N GLU A 858 7.273 -8.298 -3.241 1.00 25.00 N ATOM 1799 CA GLU A 858 8.237 -8.530 -4.322 1.00 25.00 C ATOM 1800 C GLU A 858 8.465 -7.275 -5.133 1.00 25.00 C ATOM 1801 O GLU A 858 9.581 -6.991 -5.542 1.00 25.00 O ATOM 1802 CB GLU A 858 7.825 -9.687 -5.229 1.00 25.00 C ATOM 1803 CG GLU A 858 6.415 -9.665 -5.780 1.00 25.00 C ATOM 1804 CD GLU A 858 6.061 -10.937 -6.554 1.00 25.00 C ATOM 1805 OE1 GLU A 858 6.021 -12.026 -5.934 1.00 25.00 O ATOM 1806 OE2 GLU A 858 5.752 -10.853 -7.762 1.00 25.00 O ATOM 0 H GLU A 858 6.367 -8.750 -3.365 1.00 25.00 H new ATOM 0 HA GLU A 858 9.177 -8.809 -3.845 1.00 25.00 H new ATOM 0 HB2 GLU A 858 8.516 -9.719 -6.071 1.00 25.00 H new ATOM 0 HB3 GLU A 858 7.956 -10.615 -4.673 1.00 25.00 H new ATOM 0 HG2 GLU A 858 5.711 -9.537 -4.958 1.00 25.00 H new ATOM 0 HG3 GLU A 858 6.299 -8.802 -6.436 1.00 25.00 H new ATOM 1813 N TYR A 859 7.414 -6.495 -5.286 1.00 25.00 N ATOM 1814 CA TYR A 859 7.515 -5.174 -5.926 1.00 25.00 C ATOM 1815 C TYR A 859 8.535 -4.327 -5.166 1.00 25.00 C ATOM 1816 O TYR A 859 9.469 -3.783 -5.760 1.00 25.00 O ATOM 1817 CB TYR A 859 6.140 -4.468 -5.970 1.00 25.00 C ATOM 1818 CG TYR A 859 6.125 -3.015 -5.477 1.00 25.00 C ATOM 1819 CD1 TYR A 859 6.825 -1.994 -6.161 1.00 25.00 C ATOM 1820 CD2 TYR A 859 5.405 -2.654 -4.316 1.00 25.00 C ATOM 1821 CE1 TYR A 859 6.801 -0.651 -5.685 1.00 25.00 C ATOM 1822 CE2 TYR A 859 5.372 -1.314 -3.856 1.00 25.00 C ATOM 1823 CZ TYR A 859 6.071 -0.329 -4.545 1.00 25.00 C ATOM 1824 OH TYR A 859 6.056 0.968 -4.101 1.00 25.00 O ATOM 0 H TYR A 859 6.473 -6.743 -4.979 1.00 25.00 H new ATOM 0 HA TYR A 859 7.846 -5.303 -6.956 1.00 25.00 H new ATOM 0 HB2 TYR A 859 5.774 -4.488 -6.996 1.00 25.00 H new ATOM 0 HB3 TYR A 859 5.436 -5.044 -5.369 1.00 25.00 H new ATOM 0 HD1 TYR A 859 7.384 -2.235 -7.053 1.00 25.00 H new ATOM 0 HD2 TYR A 859 4.869 -3.415 -3.768 1.00 25.00 H new ATOM 0 HE1 TYR A 859 7.350 0.117 -6.209 1.00 25.00 H new ATOM 0 HE2 TYR A 859 4.805 -1.059 -2.973 1.00 25.00 H new ATOM 0 HH TYR A 859 5.501 1.032 -3.296 1.00 25.00 H new ATOM 1834 N CYS A 860 8.389 -4.252 -3.853 1.00 25.00 N ATOM 1835 CA CYS A 860 9.297 -3.465 -3.036 1.00 25.00 C ATOM 1836 C CYS A 860 10.708 -4.018 -3.120 1.00 25.00 C ATOM 1837 O CYS A 860 11.651 -3.265 -3.281 1.00 25.00 O ATOM 1838 CB CYS A 860 8.839 -3.466 -1.579 1.00 25.00 C ATOM 1839 SG CYS A 860 7.299 -2.580 -1.300 1.00 25.00 S ATOM 0 H CYS A 860 7.652 -4.726 -3.331 1.00 25.00 H new ATOM 0 HA CYS A 860 9.292 -2.443 -3.415 1.00 25.00 H new ATOM 0 HB2 CYS A 860 8.719 -4.497 -1.247 1.00 25.00 H new ATOM 0 HB3 CYS A 860 9.620 -3.021 -0.962 1.00 25.00 H new ATOM 0 HG CYS A 860 6.698 -2.387 -2.436 1.00 25.00 H new ATOM 1845 N ILE A 861 10.843 -5.334 -3.033 1.00 25.00 N ATOM 1846 CA ILE A 861 12.151 -5.993 -3.052 1.00 25.00 C ATOM 1847 C ILE A 861 12.876 -5.698 -4.353 1.00 25.00 C ATOM 1848 O ILE A 861 14.076 -5.439 -4.359 1.00 25.00 O ATOM 1849 CB ILE A 861 11.991 -7.546 -2.872 1.00 25.00 C ATOM 1850 CG1 ILE A 861 11.686 -7.864 -1.396 1.00 25.00 C ATOM 1851 CG2 ILE A 861 13.256 -8.319 -3.359 1.00 25.00 C ATOM 1852 CD1 ILE A 861 11.157 -9.273 -1.137 1.00 25.00 C ATOM 0 H ILE A 861 10.056 -5.977 -2.947 1.00 25.00 H new ATOM 0 HA ILE A 861 12.740 -5.602 -2.222 1.00 25.00 H new ATOM 0 HB ILE A 861 11.158 -7.880 -3.491 1.00 25.00 H new ATOM 0 HG12 ILE A 861 12.596 -7.721 -0.813 1.00 25.00 H new ATOM 0 HG13 ILE A 861 10.955 -7.144 -1.028 1.00 25.00 H new ATOM 0 HG21 ILE A 861 13.105 -9.389 -3.218 1.00 25.00 H new ATOM 0 HG22 ILE A 861 13.424 -8.113 -4.416 1.00 25.00 H new ATOM 0 HG23 ILE A 861 14.124 -7.996 -2.784 1.00 25.00 H new ATOM 0 HD11 ILE A 861 10.972 -9.402 -0.071 1.00 25.00 H new ATOM 0 HD12 ILE A 861 10.227 -9.419 -1.687 1.00 25.00 H new ATOM 0 HD13 ILE A 861 11.894 -10.005 -1.469 1.00 25.00 H new ATOM 1864 N ALA A 862 12.140 -5.729 -5.449 1.00 25.00 N ATOM 1865 CA ALA A 862 12.720 -5.537 -6.766 1.00 25.00 C ATOM 1866 C ALA A 862 13.341 -4.148 -6.940 1.00 25.00 C ATOM 1867 O ALA A 862 14.414 -4.008 -7.510 1.00 25.00 O ATOM 1868 CB ALA A 862 11.638 -5.766 -7.814 1.00 25.00 C ATOM 0 H ALA A 862 11.132 -5.886 -5.453 1.00 25.00 H new ATOM 0 HA ALA A 862 13.530 -6.256 -6.888 1.00 25.00 H new ATOM 0 HB1 ALA A 862 12.060 -5.625 -8.809 1.00 25.00 H new ATOM 0 HB2 ALA A 862 11.253 -6.782 -7.724 1.00 25.00 H new ATOM 0 HB3 ALA A 862 10.826 -5.055 -7.660 1.00 25.00 H new ATOM 1874 N ARG A 863 12.650 -3.120 -6.472 1.00 25.00 N ATOM 1875 CA ARG A 863 13.124 -1.744 -6.635 1.00 25.00 C ATOM 1876 C ARG A 863 14.116 -1.355 -5.548 1.00 25.00 C ATOM 1877 O ARG A 863 14.770 -0.325 -5.640 1.00 25.00 O ATOM 1878 CB ARG A 863 11.936 -0.774 -6.622 1.00 25.00 C ATOM 1879 CG ARG A 863 11.173 -0.722 -7.933 1.00 25.00 C ATOM 1880 CD ARG A 863 9.892 -1.514 -7.858 1.00 25.00 C ATOM 1881 NE ARG A 863 9.017 -1.307 -9.027 1.00 25.00 N ATOM 1882 CZ ARG A 863 8.249 -0.241 -9.239 1.00 25.00 C ATOM 1883 NH1 ARG A 863 8.231 0.783 -8.432 1.00 25.00 N ATOM 1884 NH2 ARG A 863 7.486 -0.210 -10.291 1.00 25.00 N ATOM 0 H ARG A 863 11.762 -3.206 -5.977 1.00 25.00 H new ATOM 0 HA ARG A 863 13.638 -1.685 -7.594 1.00 25.00 H new ATOM 0 HB2 ARG A 863 11.251 -1.064 -5.825 1.00 25.00 H new ATOM 0 HB3 ARG A 863 12.298 0.226 -6.383 1.00 25.00 H new ATOM 0 HG2 ARG A 863 10.947 0.315 -8.183 1.00 25.00 H new ATOM 0 HG3 ARG A 863 11.798 -1.114 -8.735 1.00 25.00 H new ATOM 0 HD2 ARG A 863 10.131 -2.574 -7.773 1.00 25.00 H new ATOM 0 HD3 ARG A 863 9.352 -1.236 -6.953 1.00 25.00 H new ATOM 0 HE ARG A 863 8.999 -2.043 -9.733 1.00 25.00 H new ATOM 0 HH11 ARG A 863 8.821 0.787 -7.600 1.00 25.00 H new ATOM 0 HH12 ARG A 863 7.627 1.580 -8.633 1.00 25.00 H new ATOM 0 HH21 ARG A 863 7.481 -0.996 -10.941 1.00 25.00 H new ATOM 0 HH22 ARG A 863 6.892 0.600 -10.466 1.00 25.00 H new ATOM 1898 N MET A 864 14.219 -2.154 -4.505 1.00 25.00 N ATOM 1899 CA MET A 864 15.118 -1.829 -3.409 1.00 25.00 C ATOM 1900 C MET A 864 16.566 -2.151 -3.777 1.00 25.00 C ATOM 1901 O MET A 864 16.818 -3.010 -4.611 1.00 25.00 O ATOM 1902 CB MET A 864 14.692 -2.555 -2.160 1.00 25.00 C ATOM 1903 CG MET A 864 14.873 -1.733 -0.918 1.00 25.00 C ATOM 1904 SD MET A 864 13.795 -2.260 0.404 1.00 25.00 S ATOM 1905 CE MET A 864 12.265 -1.358 0.047 1.00 25.00 C ATOM 0 H MET A 864 13.699 -3.024 -4.390 1.00 25.00 H new ATOM 0 HA MET A 864 15.064 -0.758 -3.216 1.00 25.00 H new ATOM 0 HB2 MET A 864 13.644 -2.841 -2.251 1.00 25.00 H new ATOM 0 HB3 MET A 864 15.267 -3.476 -2.067 1.00 25.00 H new ATOM 0 HG2 MET A 864 15.910 -1.801 -0.588 1.00 25.00 H new ATOM 0 HG3 MET A 864 14.679 -0.685 -1.147 1.00 25.00 H new ATOM 0 HE1 MET A 864 11.515 -1.601 0.800 1.00 25.00 H new ATOM 0 HE2 MET A 864 12.462 -0.286 0.064 1.00 25.00 H new ATOM 0 HE3 MET A 864 11.896 -1.643 -0.938 1.00 25.00 H new ATOM 1915 N ALA A 865 17.522 -1.431 -3.197 1.00 25.00 N ATOM 1916 CA ALA A 865 18.917 -1.603 -3.591 1.00 25.00 C ATOM 1917 C ALA A 865 19.409 -2.993 -3.192 1.00 25.00 C ATOM 1918 O ALA A 865 19.256 -3.392 -2.046 1.00 25.00 O ATOM 1919 CB ALA A 865 19.789 -0.542 -2.962 1.00 25.00 C ATOM 0 H ALA A 865 17.362 -0.736 -2.467 1.00 25.00 H new ATOM 0 HA ALA A 865 18.981 -1.500 -4.674 1.00 25.00 H new ATOM 0 HB1 ALA A 865 20.824 -0.691 -3.271 1.00 25.00 H new ATOM 0 HB2 ALA A 865 19.453 0.443 -3.284 1.00 25.00 H new ATOM 0 HB3 ALA A 865 19.721 -0.611 -1.876 1.00 25.00 H new ATOM 1925 N PRO A 866 20.015 -3.735 -4.127 1.00 25.00 N ATOM 1926 CA PRO A 866 20.446 -5.113 -3.878 1.00 25.00 C ATOM 1927 C PRO A 866 21.696 -5.246 -3.003 1.00 25.00 C ATOM 1928 O PRO A 866 22.819 -5.345 -3.501 1.00 25.00 O ATOM 1929 CB PRO A 866 20.697 -5.631 -5.292 1.00 25.00 C ATOM 1930 CG PRO A 866 21.151 -4.433 -6.044 1.00 25.00 C ATOM 1931 CD PRO A 866 20.284 -3.334 -5.520 1.00 25.00 C ATOM 0 HA PRO A 866 19.702 -5.671 -3.309 1.00 25.00 H new ATOM 0 HB2 PRO A 866 21.453 -6.416 -5.300 1.00 25.00 H new ATOM 0 HB3 PRO A 866 19.792 -6.055 -5.727 1.00 25.00 H new ATOM 0 HG2 PRO A 866 22.207 -4.227 -5.869 1.00 25.00 H new ATOM 0 HG3 PRO A 866 21.025 -4.564 -7.119 1.00 25.00 H new ATOM 0 HD2 PRO A 866 20.788 -2.369 -5.569 1.00 25.00 H new ATOM 0 HD3 PRO A 866 19.363 -3.242 -6.095 1.00 25.00 H new ATOM 1939 N TYR A 867 21.518 -5.278 -1.691 1.00 25.00 N ATOM 1940 CA TYR A 867 22.665 -5.434 -0.804 1.00 25.00 C ATOM 1941 C TYR A 867 22.882 -6.928 -0.590 1.00 25.00 C ATOM 1942 O TYR A 867 22.267 -7.556 0.262 1.00 25.00 O ATOM 1943 CB TYR A 867 22.391 -4.716 0.526 1.00 25.00 C ATOM 1944 CG TYR A 867 22.689 -3.227 0.491 1.00 25.00 C ATOM 1945 CD1 TYR A 867 22.823 -2.527 -0.740 1.00 25.00 C ATOM 1946 CD2 TYR A 867 22.855 -2.500 1.694 1.00 25.00 C ATOM 1947 CE1 TYR A 867 23.147 -1.163 -0.762 1.00 25.00 C ATOM 1948 CE2 TYR A 867 23.172 -1.116 1.664 1.00 25.00 C ATOM 1949 CZ TYR A 867 23.320 -0.465 0.432 1.00 25.00 C ATOM 1950 OH TYR A 867 23.602 0.874 0.399 1.00 25.00 O ATOM 0 H TYR A 867 20.615 -5.200 -1.224 1.00 25.00 H new ATOM 0 HA TYR A 867 23.562 -4.992 -1.238 1.00 25.00 H new ATOM 0 HB2 TYR A 867 21.346 -4.862 0.798 1.00 25.00 H new ATOM 0 HB3 TYR A 867 22.992 -5.179 1.309 1.00 25.00 H new ATOM 0 HD1 TYR A 867 22.673 -3.054 -1.671 1.00 25.00 H new ATOM 0 HD2 TYR A 867 22.740 -3.002 2.643 1.00 25.00 H new ATOM 0 HE1 TYR A 867 23.263 -0.652 -1.706 1.00 25.00 H new ATOM 0 HE2 TYR A 867 23.298 -0.568 2.586 1.00 25.00 H new ATOM 0 HH TYR A 867 22.952 1.359 0.950 1.00 25.00 H new ATOM 2048 N GLY A 875 19.441 -11.891 1.374 1.00 25.00 N ATOM 2049 CA GLY A 875 18.224 -11.106 1.289 1.00 25.00 C ATOM 2050 C GLY A 875 18.240 -9.814 2.087 1.00 25.00 C ATOM 2051 O GLY A 875 17.325 -9.572 2.860 1.00 25.00 O ATOM 0 HA2 GLY A 875 18.035 -10.867 0.242 1.00 25.00 H new ATOM 0 HA3 GLY A 875 17.390 -11.718 1.632 1.00 25.00 H new ATOM 2055 N ALA A 876 19.239 -8.970 1.872 1.00 25.00 N ATOM 2056 CA ALA A 876 19.301 -7.645 2.478 1.00 25.00 C ATOM 2057 C ALA A 876 19.147 -6.614 1.358 1.00 25.00 C ATOM 2058 O ALA A 876 19.605 -6.829 0.240 1.00 25.00 O ATOM 2059 CB ALA A 876 20.635 -7.459 3.199 1.00 25.00 C ATOM 0 H ALA A 876 20.034 -9.185 1.270 1.00 25.00 H new ATOM 0 HA ALA A 876 18.506 -7.522 3.214 1.00 25.00 H new ATOM 0 HB1 ALA A 876 20.671 -6.466 3.648 1.00 25.00 H new ATOM 0 HB2 ALA A 876 20.735 -8.214 3.979 1.00 25.00 H new ATOM 0 HB3 ALA A 876 21.452 -7.564 2.485 1.00 25.00 H new ATOM 2065 N LEU A 877 18.450 -5.529 1.645 1.00 25.00 N ATOM 2066 CA LEU A 877 18.240 -4.458 0.681 1.00 25.00 C ATOM 2067 C LEU A 877 18.293 -3.105 1.357 1.00 25.00 C ATOM 2068 O LEU A 877 17.837 -2.968 2.474 1.00 25.00 O ATOM 2069 CB LEU A 877 16.868 -4.600 0.038 1.00 25.00 C ATOM 2070 CG LEU A 877 16.496 -5.931 -0.625 1.00 25.00 C ATOM 2071 CD1 LEU A 877 15.004 -6.077 -0.578 1.00 25.00 C ATOM 2072 CD2 LEU A 877 17.007 -6.003 -2.058 1.00 25.00 C ATOM 0 H LEU A 877 18.013 -5.363 2.552 1.00 25.00 H new ATOM 0 HA LEU A 877 19.029 -4.529 -0.068 1.00 25.00 H new ATOM 0 HB2 LEU A 877 16.121 -4.394 0.805 1.00 25.00 H new ATOM 0 HB3 LEU A 877 16.775 -3.819 -0.716 1.00 25.00 H new ATOM 0 HG LEU A 877 16.968 -6.751 -0.084 1.00 25.00 H new ATOM 0 HD11 LEU A 877 14.716 -7.019 -1.045 1.00 25.00 H new ATOM 0 HD12 LEU A 877 14.670 -6.069 0.460 1.00 25.00 H new ATOM 0 HD13 LEU A 877 14.540 -5.249 -1.114 1.00 25.00 H new ATOM 0 HD21 LEU A 877 16.725 -6.960 -2.497 1.00 25.00 H new ATOM 0 HD22 LEU A 877 16.569 -5.193 -2.642 1.00 25.00 H new ATOM 0 HD23 LEU A 877 18.093 -5.907 -2.062 1.00 25.00 H new ATOM 2084 N ASP A 878 18.776 -2.083 0.681 1.00 25.00 N ATOM 2085 CA ASP A 878 18.744 -0.741 1.267 1.00 25.00 C ATOM 2086 C ASP A 878 17.426 -0.048 0.990 1.00 25.00 C ATOM 2087 O ASP A 878 17.126 0.313 -0.146 1.00 25.00 O ATOM 2088 CB ASP A 878 19.903 0.094 0.789 1.00 25.00 C ATOM 2089 CG ASP A 878 20.222 1.219 1.752 1.00 25.00 C ATOM 2090 OD1 ASP A 878 19.255 1.873 2.190 1.00 25.00 O ATOM 2091 OD2 ASP A 878 21.407 1.471 2.063 1.00 25.00 O ATOM 0 H ASP A 878 19.187 -2.142 -0.251 1.00 25.00 H new ATOM 0 HA ASP A 878 18.839 -0.856 2.347 1.00 25.00 H new ATOM 0 HB2 ASP A 878 20.781 -0.540 0.667 1.00 25.00 H new ATOM 0 HB3 ASP A 878 19.671 0.510 -0.192 1.00 25.00 H new ATOM 2096 N TYR A 879 16.633 0.099 2.042 1.00 25.00 N ATOM 2097 CA TYR A 879 15.302 0.678 1.934 1.00 25.00 C ATOM 2098 C TYR A 879 15.380 2.156 1.530 1.00 25.00 C ATOM 2099 O TYR A 879 14.543 2.645 0.784 1.00 25.00 O ATOM 2100 CB TYR A 879 14.530 0.501 3.246 1.00 25.00 C ATOM 2101 CG TYR A 879 15.214 1.078 4.463 1.00 25.00 C ATOM 2102 CD1 TYR A 879 15.059 2.436 4.808 1.00 25.00 C ATOM 2103 CD2 TYR A 879 16.023 0.270 5.277 1.00 25.00 C ATOM 2104 CE1 TYR A 879 15.730 2.975 5.928 1.00 25.00 C ATOM 2105 CE2 TYR A 879 16.682 0.800 6.401 1.00 25.00 C ATOM 2106 CZ TYR A 879 16.540 2.152 6.710 1.00 25.00 C ATOM 2107 OH TYR A 879 17.198 2.661 7.793 1.00 25.00 O ATOM 0 H TYR A 879 16.892 -0.178 2.989 1.00 25.00 H new ATOM 0 HA TYR A 879 14.760 0.149 1.150 1.00 25.00 H new ATOM 0 HB2 TYR A 879 13.550 0.967 3.141 1.00 25.00 H new ATOM 0 HB3 TYR A 879 14.360 -0.563 3.411 1.00 25.00 H new ATOM 0 HD1 TYR A 879 14.421 3.070 4.210 1.00 25.00 H new ATOM 0 HD2 TYR A 879 16.142 -0.776 5.036 1.00 25.00 H new ATOM 0 HE1 TYR A 879 15.616 4.020 6.178 1.00 25.00 H new ATOM 0 HE2 TYR A 879 17.295 0.163 7.021 1.00 25.00 H new ATOM 0 HH TYR A 879 17.813 1.986 8.149 1.00 25.00 H new ATOM 2117 N MET A 880 16.367 2.871 2.062 1.00 25.00 N ATOM 2118 CA MET A 880 16.515 4.307 1.809 1.00 25.00 C ATOM 2119 C MET A 880 17.365 4.630 0.579 1.00 25.00 C ATOM 2120 O MET A 880 17.157 5.649 -0.063 1.00 25.00 O ATOM 2121 CB MET A 880 17.045 5.018 3.062 1.00 25.00 C ATOM 2122 CG MET A 880 18.359 4.485 3.590 1.00 25.00 C ATOM 2123 SD MET A 880 18.867 5.271 5.127 1.00 25.00 S ATOM 2124 CE MET A 880 20.356 4.336 5.460 1.00 25.00 C ATOM 0 H MET A 880 17.082 2.479 2.675 1.00 25.00 H new ATOM 0 HA MET A 880 15.520 4.687 1.579 1.00 25.00 H new ATOM 0 HB2 MET A 880 17.164 6.078 2.837 1.00 25.00 H new ATOM 0 HB3 MET A 880 16.296 4.941 3.850 1.00 25.00 H new ATOM 0 HG2 MET A 880 18.272 3.410 3.749 1.00 25.00 H new ATOM 0 HG3 MET A 880 19.134 4.634 2.838 1.00 25.00 H new ATOM 0 HE1 MET A 880 20.809 4.691 6.385 1.00 25.00 H new ATOM 0 HE2 MET A 880 20.107 3.279 5.560 1.00 25.00 H new ATOM 0 HE3 MET A 880 21.060 4.467 4.638 1.00 25.00 H new ATOM 2134 N SER A 881 18.311 3.760 0.247 1.00 25.00 N ATOM 2135 CA SER A 881 19.185 3.970 -0.917 1.00 25.00 C ATOM 2136 C SER A 881 18.689 3.166 -2.117 1.00 25.00 C ATOM 2137 O SER A 881 19.437 2.912 -3.062 1.00 25.00 O ATOM 2138 CB SER A 881 20.631 3.587 -0.590 1.00 25.00 C ATOM 2139 OG SER A 881 21.517 4.053 -1.593 1.00 25.00 O ATOM 0 H SER A 881 18.498 2.900 0.763 1.00 25.00 H new ATOM 0 HA SER A 881 19.156 5.030 -1.170 1.00 25.00 H new ATOM 0 HB2 SER A 881 20.914 4.008 0.375 1.00 25.00 H new ATOM 0 HB3 SER A 881 20.713 2.504 -0.501 1.00 25.00 H new ATOM 0 HG SER A 881 21.143 3.857 -2.477 1.00 25.00 H new ATOM 2145 N PHE A 882 17.428 2.760 -2.048 1.00 25.00 N ATOM 2146 CA PHE A 882 16.752 2.024 -3.121 1.00 25.00 C ATOM 2147 C PHE A 882 16.907 2.621 -4.527 1.00 25.00 C ATOM 2148 O PHE A 882 17.204 3.804 -4.705 1.00 25.00 O ATOM 2149 CB PHE A 882 15.254 1.927 -2.796 1.00 25.00 C ATOM 2150 CG PHE A 882 14.471 3.159 -3.162 1.00 25.00 C ATOM 2151 CD1 PHE A 882 14.482 4.298 -2.335 1.00 25.00 C ATOM 2152 CD2 PHE A 882 13.710 3.182 -4.349 1.00 25.00 C ATOM 2153 CE1 PHE A 882 13.751 5.459 -2.693 1.00 25.00 C ATOM 2154 CE2 PHE A 882 12.977 4.333 -4.718 1.00 25.00 C ATOM 2155 CZ PHE A 882 12.997 5.475 -3.887 1.00 25.00 C ATOM 0 H PHE A 882 16.834 2.932 -1.237 1.00 25.00 H new ATOM 0 HA PHE A 882 17.239 1.049 -3.154 1.00 25.00 H new ATOM 0 HB2 PHE A 882 14.833 1.071 -3.322 1.00 25.00 H new ATOM 0 HB3 PHE A 882 15.135 1.736 -1.730 1.00 25.00 H new ATOM 0 HD1 PHE A 882 15.053 4.287 -1.418 1.00 25.00 H new ATOM 0 HD2 PHE A 882 13.687 2.309 -4.984 1.00 25.00 H new ATOM 0 HE1 PHE A 882 13.771 6.329 -2.054 1.00 25.00 H new ATOM 0 HE2 PHE A 882 12.403 4.339 -5.633 1.00 25.00 H new ATOM 0 HZ PHE A 882 12.438 6.357 -4.164 1.00 25.00 H new