USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=35 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+ -139:sc= 1.25 (180deg=0.378) USER MOD Set 1.2: A 879 TYR OH : rot 169:sc= 1.93 USER MOD Set 1.3: A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 816 MET CE :methyl -161:sc= -1.28 (180deg=-1.94) USER MOD Set 2.2: A 856 GLN : amide:sc= -1.05 K(o=-2.3,f=-7.5!) USER MOD Set 3.1: A 808 THR OG1 : rot -149:sc= 0.802 USER MOD Set 3.2: A 810 GLN :FLIP amide:sc= 0.315 F(o=-0.33,f=1.1) USER MOD Set 4.1: A 754 SER OG : rot -104:sc= 1.02 USER MOD Set 4.2: A 774 CYS SG : rot 180:sc= 0.859 USER MOD Set 5.1: A 772 LYS NZ :NH3+ -131:sc= 1.31 (180deg=-0.126) USER MOD Set 5.2: A 784 ASN : amide:sc= 0.403 K(o=1.7,f=-1.2) USER MOD Set 6.1: A 763 SER OG : rot -87:sc= 0.973 USER MOD Set 6.2: A 765 THR OG1 : rot 37:sc= 0.511 USER MOD Single : A 742 SER OG : rot 40:sc= 0.371 USER MOD Single : A 744 SER OG : rot 124:sc= 0.439 USER MOD Single : A 745 GLN :FLIP amide:sc= 0 F(o=-0.54,f=0) USER MOD Single : A 747 GLN : amide:sc= -0.0639 K(o=-0.064,f=-2.5) USER MOD Single : A 748 MET CE :methyl 153:sc= -3.16! (180deg=-3.63!) USER MOD Single : A 749 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 756 ASN : amide:sc= 0.339 K(o=0.34,f=-0.54) USER MOD Single : A 757 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 762 HIS : no HE2:sc= 0.0941 K(o=0.094,f=-1.3) USER MOD Single : A 777 SER OG : rot 136:sc= 1.47 USER MOD Single : A 780 TYR OH : rot 180:sc= -0.0695 USER MOD Single : A 787 GLN : amide:sc= -0.15 X(o=-0.15,f=-0.0082) USER MOD Single : A 796 MET CE :methyl -170:sc= -0.0773 (180deg=-0.212) USER MOD Single : A 797 SER OG : rot -28:sc= 0.174 USER MOD Single : A 802 ASN :FLIP amide:sc= 0 F(o=-1.4,f=0) USER MOD Single : A 817 SER OG : rot -27:sc= 0.0183 USER MOD Single : A 820 THR OG1 : rot -90:sc= 0.85 USER MOD Single : A 823 THR OG1 : rot 154:sc= 0.204 USER MOD Single : A 825 THR OG1 : rot -164:sc= 1.04 USER MOD Single : A 828 GLN : amide:sc= -0.201 X(o=-0.2,f=-0.0014) USER MOD Single : A 830 MET CE :methyl 178:sc= -0.0024 (180deg=-0.0231) USER MOD Single : A 832 SER OG : rot 136:sc= 1.1 USER MOD Single : A 840 LYS NZ :NH3+ -126:sc= 0.242 (180deg=-0.233) USER MOD Single : A 841 ASN : amide:sc= -0.337 K(o=-0.34,f=-1.9) USER MOD Single : A 842 TYR OH : rot 180:sc= 0 USER MOD Single : A 844 THR OG1 : rot -57:sc= 0.995 USER MOD Single : A 845 MET CE :methyl -115:sc= -0.195 (180deg=-2.39!) USER MOD Single : A 859 TYR OH : rot -80:sc= 0.00524 USER MOD Single : A 860 CYS SG : rot 17:sc= 1.29 USER MOD Single : A 864 MET CE :methyl 165:sc= -0.109 (180deg=-0.411) USER MOD Single : A 867 TYR OH : rot 66:sc= 0.502 USER MOD Single : A 881 SER OG : rot -42:sc= 0.482 USER MOD ----------------------------------------------------------------- ATOM 21 N SER A 742 -1.186 -10.778 -7.108 1.00 25.00 N ATOM 22 CA SER A 742 -1.561 -9.536 -6.421 1.00 25.00 C ATOM 23 C SER A 742 -1.854 -9.620 -4.904 1.00 25.00 C ATOM 24 O SER A 742 -1.015 -10.042 -4.114 1.00 25.00 O ATOM 25 CB SER A 742 -2.748 -8.919 -7.161 1.00 25.00 C ATOM 26 OG SER A 742 -2.499 -8.930 -8.556 1.00 25.00 O ATOM 0 HA SER A 742 -0.668 -8.912 -6.457 1.00 25.00 H new ATOM 0 HB2 SER A 742 -3.657 -9.478 -6.940 1.00 25.00 H new ATOM 0 HB3 SER A 742 -2.911 -7.897 -6.819 1.00 25.00 H new ATOM 0 HG SER A 742 -2.060 -9.770 -8.803 1.00 25.00 H new ATOM 32 N ILE A 743 -3.033 -9.189 -4.479 1.00 25.00 N ATOM 33 CA ILE A 743 -3.342 -9.180 -3.055 1.00 25.00 C ATOM 34 C ILE A 743 -3.394 -10.608 -2.477 1.00 25.00 C ATOM 35 O ILE A 743 -3.803 -11.560 -3.152 1.00 25.00 O ATOM 36 CB ILE A 743 -4.663 -8.426 -2.775 1.00 25.00 C ATOM 37 CG1 ILE A 743 -4.444 -7.550 -1.547 1.00 25.00 C ATOM 38 CG2 ILE A 743 -5.869 -9.389 -2.582 1.00 25.00 C ATOM 39 CD1 ILE A 743 -5.679 -6.959 -0.971 1.00 25.00 C ATOM 0 H ILE A 743 -3.779 -8.847 -5.085 1.00 25.00 H new ATOM 0 HA ILE A 743 -2.535 -8.648 -2.552 1.00 25.00 H new ATOM 0 HB ILE A 743 -4.920 -7.812 -3.639 1.00 25.00 H new ATOM 0 HG12 ILE A 743 -3.951 -8.145 -0.778 1.00 25.00 H new ATOM 0 HG13 ILE A 743 -3.762 -6.742 -1.812 1.00 25.00 H new ATOM 0 HG21 ILE A 743 -6.771 -8.808 -2.388 1.00 25.00 H new ATOM 0 HG22 ILE A 743 -6.007 -9.984 -3.485 1.00 25.00 H new ATOM 0 HG23 ILE A 743 -5.675 -10.050 -1.738 1.00 25.00 H new ATOM 0 HD11 ILE A 743 -5.421 -6.353 -0.102 1.00 25.00 H new ATOM 0 HD12 ILE A 743 -6.166 -6.333 -1.719 1.00 25.00 H new ATOM 0 HD13 ILE A 743 -6.357 -7.757 -0.669 1.00 25.00 H new ATOM 51 N SER A 744 -2.973 -10.756 -1.230 1.00 25.00 N ATOM 52 CA SER A 744 -3.025 -12.043 -0.546 1.00 25.00 C ATOM 53 C SER A 744 -4.262 -12.121 0.334 1.00 25.00 C ATOM 54 O SER A 744 -4.889 -11.104 0.646 1.00 25.00 O ATOM 55 CB SER A 744 -1.769 -12.252 0.300 1.00 25.00 C ATOM 56 OG SER A 744 -1.743 -11.359 1.394 1.00 25.00 O ATOM 0 H SER A 744 -2.589 -9.997 -0.667 1.00 25.00 H new ATOM 0 HA SER A 744 -3.074 -12.830 -1.298 1.00 25.00 H new ATOM 0 HB2 SER A 744 -1.737 -13.279 0.663 1.00 25.00 H new ATOM 0 HB3 SER A 744 -0.882 -12.104 -0.316 1.00 25.00 H new ATOM 0 HG SER A 744 -1.662 -11.866 2.229 1.00 25.00 H new ATOM 62 N GLN A 745 -4.602 -13.329 0.756 1.00 25.00 N ATOM 63 CA GLN A 745 -5.747 -13.535 1.639 1.00 25.00 C ATOM 64 C GLN A 745 -5.535 -12.855 2.984 1.00 25.00 C ATOM 65 O GLN A 745 -6.483 -12.401 3.605 1.00 25.00 O ATOM 66 CB GLN A 745 -5.976 -15.030 1.871 1.00 25.00 C ATOM 67 CG GLN A 745 -6.744 -15.723 0.749 1.00 25.00 C ATOM 68 CD GLN A 745 -8.237 -15.829 1.037 1.00 25.00 C ATOM 69 OE1 GLN A 745 -8.871 -14.723 1.334 1.00 25.00 O flip ATOM 70 NE2 GLN A 745 -8.803 -16.906 0.987 1.00 25.00 N flip ATOM 0 H GLN A 745 -4.104 -14.183 0.504 1.00 25.00 H new ATOM 0 HA GLN A 745 -6.619 -13.096 1.154 1.00 25.00 H new ATOM 0 HB2 GLN A 745 -5.010 -15.520 1.993 1.00 25.00 H new ATOM 0 HB3 GLN A 745 -6.521 -15.163 2.806 1.00 25.00 H new ATOM 0 HG2 GLN A 745 -6.595 -15.174 -0.181 1.00 25.00 H new ATOM 0 HG3 GLN A 745 -6.335 -16.722 0.598 1.00 25.00 H new ATOM 0 HE21 GLN A 745 -8.277 -17.748 0.752 1.00 25.00 H new ATOM 0 HE22 GLN A 745 -9.803 -16.966 1.180 1.00 25.00 H new ATOM 79 N GLU A 746 -4.295 -12.774 3.433 1.00 25.00 N ATOM 80 CA GLU A 746 -4.019 -12.154 4.726 1.00 25.00 C ATOM 81 C GLU A 746 -3.995 -10.647 4.600 1.00 25.00 C ATOM 82 O GLU A 746 -4.445 -9.950 5.503 1.00 25.00 O ATOM 83 CB GLU A 746 -2.708 -12.655 5.321 1.00 25.00 C ATOM 84 CG GLU A 746 -2.819 -14.080 5.827 1.00 25.00 C ATOM 85 CD GLU A 746 -1.703 -14.432 6.790 1.00 25.00 C ATOM 86 OE1 GLU A 746 -0.532 -14.431 6.369 1.00 25.00 O ATOM 87 OE2 GLU A 746 -2.005 -14.702 7.973 1.00 25.00 O ATOM 0 H GLU A 746 -3.474 -13.121 2.936 1.00 25.00 H new ATOM 0 HA GLU A 746 -4.824 -12.439 5.404 1.00 25.00 H new ATOM 0 HB2 GLU A 746 -1.923 -12.599 4.567 1.00 25.00 H new ATOM 0 HB3 GLU A 746 -2.409 -12.002 6.141 1.00 25.00 H new ATOM 0 HG2 GLU A 746 -3.781 -14.214 6.323 1.00 25.00 H new ATOM 0 HG3 GLU A 746 -2.798 -14.767 4.981 1.00 25.00 H new ATOM 94 N GLN A 747 -3.501 -10.138 3.478 1.00 25.00 N ATOM 95 CA GLN A 747 -3.469 -8.695 3.261 1.00 25.00 C ATOM 96 C GLN A 747 -4.875 -8.125 3.302 1.00 25.00 C ATOM 97 O GLN A 747 -5.116 -7.093 3.891 1.00 25.00 O ATOM 98 CB GLN A 747 -2.860 -8.360 1.900 1.00 25.00 C ATOM 99 CG GLN A 747 -2.712 -6.868 1.656 1.00 25.00 C ATOM 100 CD GLN A 747 -1.738 -6.227 2.613 1.00 25.00 C ATOM 101 OE1 GLN A 747 -0.537 -6.370 2.473 1.00 25.00 O ATOM 102 NE2 GLN A 747 -2.251 -5.537 3.586 1.00 25.00 N ATOM 0 H GLN A 747 -3.121 -10.694 2.712 1.00 25.00 H new ATOM 0 HA GLN A 747 -2.860 -8.259 4.053 1.00 25.00 H new ATOM 0 HB2 GLN A 747 -1.881 -8.832 1.822 1.00 25.00 H new ATOM 0 HB3 GLN A 747 -3.484 -8.789 1.116 1.00 25.00 H new ATOM 0 HG2 GLN A 747 -2.376 -6.701 0.633 1.00 25.00 H new ATOM 0 HG3 GLN A 747 -3.685 -6.387 1.755 1.00 25.00 H new ATOM 0 HE21 GLN A 747 -3.263 -5.443 3.666 1.00 25.00 H new ATOM 0 HE22 GLN A 747 -1.641 -5.089 4.270 1.00 25.00 H new ATOM 111 N MET A 748 -5.818 -8.808 2.678 1.00 25.00 N ATOM 112 CA MET A 748 -7.182 -8.300 2.617 1.00 25.00 C ATOM 113 C MET A 748 -7.830 -8.454 3.972 1.00 25.00 C ATOM 114 O MET A 748 -8.804 -7.792 4.282 1.00 25.00 O ATOM 115 CB MET A 748 -8.021 -9.025 1.557 1.00 25.00 C ATOM 116 CG MET A 748 -8.241 -10.497 1.806 1.00 25.00 C ATOM 117 SD MET A 748 -9.629 -11.195 0.855 1.00 25.00 S ATOM 118 CE MET A 748 -9.518 -10.318 -0.744 1.00 25.00 C ATOM 0 H MET A 748 -5.671 -9.703 2.212 1.00 25.00 H new ATOM 0 HA MET A 748 -7.137 -7.248 2.334 1.00 25.00 H new ATOM 0 HB2 MET A 748 -8.993 -8.536 1.489 1.00 25.00 H new ATOM 0 HB3 MET A 748 -7.535 -8.906 0.589 1.00 25.00 H new ATOM 0 HG2 MET A 748 -7.330 -11.040 1.555 1.00 25.00 H new ATOM 0 HG3 MET A 748 -8.424 -10.654 2.869 1.00 25.00 H new ATOM 0 HE1 MET A 748 -9.944 -10.940 -1.531 1.00 25.00 H new ATOM 0 HE2 MET A 748 -10.070 -9.380 -0.684 1.00 25.00 H new ATOM 0 HE3 MET A 748 -8.473 -10.109 -0.973 1.00 25.00 H new ATOM 128 N ASN A 749 -7.290 -9.347 4.781 1.00 25.00 N ATOM 129 CA ASN A 749 -7.885 -9.641 6.066 1.00 25.00 C ATOM 130 C ASN A 749 -7.444 -8.619 7.094 1.00 25.00 C ATOM 131 O ASN A 749 -8.237 -8.174 7.910 1.00 25.00 O ATOM 132 CB ASN A 749 -7.536 -11.061 6.500 1.00 25.00 C ATOM 133 CG ASN A 749 -7.210 -11.163 7.969 1.00 25.00 C ATOM 134 OD1 ASN A 749 -8.093 -11.239 8.810 1.00 25.00 O ATOM 135 ND2 ASN A 749 -5.941 -11.178 8.280 1.00 25.00 N ATOM 0 H ASN A 749 -6.445 -9.877 4.570 1.00 25.00 H new ATOM 0 HA ASN A 749 -8.970 -9.579 5.979 1.00 25.00 H new ATOM 0 HB2 ASN A 749 -8.373 -11.721 6.272 1.00 25.00 H new ATOM 0 HB3 ASN A 749 -6.684 -11.414 5.919 1.00 25.00 H new ATOM 0 HD21 ASN A 749 -5.656 -11.255 9.256 1.00 25.00 H new ATOM 0 HD22 ASN A 749 -5.235 -11.112 7.546 1.00 25.00 H new ATOM 142 N GLU A 750 -6.186 -8.225 7.051 1.00 25.00 N ATOM 143 CA GLU A 750 -5.718 -7.212 7.977 1.00 25.00 C ATOM 144 C GLU A 750 -6.211 -5.842 7.487 1.00 25.00 C ATOM 145 O GLU A 750 -6.620 -5.004 8.280 1.00 25.00 O ATOM 146 CB GLU A 750 -4.193 -7.304 8.156 1.00 25.00 C ATOM 147 CG GLU A 750 -3.346 -6.871 6.964 1.00 25.00 C ATOM 148 CD GLU A 750 -3.008 -5.386 7.035 1.00 25.00 C ATOM 149 OE1 GLU A 750 -2.379 -4.971 8.030 1.00 25.00 O ATOM 150 OE2 GLU A 750 -3.383 -4.639 6.112 1.00 25.00 O ATOM 0 H GLU A 750 -5.484 -8.580 6.402 1.00 25.00 H new ATOM 0 HA GLU A 750 -6.130 -7.370 8.974 1.00 25.00 H new ATOM 0 HB2 GLU A 750 -3.912 -6.695 9.015 1.00 25.00 H new ATOM 0 HB3 GLU A 750 -3.939 -8.335 8.400 1.00 25.00 H new ATOM 0 HG2 GLU A 750 -2.426 -7.455 6.938 1.00 25.00 H new ATOM 0 HG3 GLU A 750 -3.883 -7.080 6.039 1.00 25.00 H new ATOM 157 N PHE A 751 -6.216 -5.626 6.177 1.00 25.00 N ATOM 158 CA PHE A 751 -6.655 -4.352 5.614 1.00 25.00 C ATOM 159 C PHE A 751 -8.146 -4.110 5.752 1.00 25.00 C ATOM 160 O PHE A 751 -8.595 -2.970 5.794 1.00 25.00 O ATOM 161 CB PHE A 751 -6.290 -4.274 4.144 1.00 25.00 C ATOM 162 CG PHE A 751 -6.717 -3.007 3.493 1.00 25.00 C ATOM 163 CD1 PHE A 751 -6.220 -1.766 3.924 1.00 25.00 C ATOM 164 CD2 PHE A 751 -7.624 -3.042 2.435 1.00 25.00 C ATOM 165 CE1 PHE A 751 -6.632 -0.575 3.289 1.00 25.00 C ATOM 166 CE2 PHE A 751 -8.009 -1.873 1.782 1.00 25.00 C ATOM 167 CZ PHE A 751 -7.523 -0.631 2.208 1.00 25.00 C ATOM 0 H PHE A 751 -5.922 -6.315 5.484 1.00 25.00 H new ATOM 0 HA PHE A 751 -6.140 -3.581 6.188 1.00 25.00 H new ATOM 0 HB2 PHE A 751 -5.210 -4.381 4.040 1.00 25.00 H new ATOM 0 HB3 PHE A 751 -6.745 -5.114 3.620 1.00 25.00 H new ATOM 0 HD1 PHE A 751 -5.520 -1.723 4.745 1.00 25.00 H new ATOM 0 HD2 PHE A 751 -8.034 -3.989 2.117 1.00 25.00 H new ATOM 0 HE1 PHE A 751 -6.261 0.378 3.635 1.00 25.00 H new ATOM 0 HE2 PHE A 751 -8.686 -1.925 0.942 1.00 25.00 H new ATOM 0 HZ PHE A 751 -7.832 0.275 1.709 1.00 25.00 H new ATOM 177 N ARG A 752 -8.945 -5.161 5.850 1.00 25.00 N ATOM 178 CA ARG A 752 -10.376 -4.971 6.049 1.00 25.00 C ATOM 179 C ARG A 752 -10.604 -4.286 7.383 1.00 25.00 C ATOM 180 O ARG A 752 -11.649 -3.716 7.580 1.00 25.00 O ATOM 181 CB ARG A 752 -11.150 -6.297 5.986 1.00 25.00 C ATOM 182 CG ARG A 752 -11.059 -7.190 7.205 1.00 25.00 C ATOM 183 CD ARG A 752 -12.334 -7.148 8.038 1.00 25.00 C ATOM 184 NE ARG A 752 -12.276 -8.137 9.128 1.00 25.00 N ATOM 185 CZ ARG A 752 -11.710 -7.943 10.316 1.00 25.00 C ATOM 186 NH1 ARG A 752 -11.137 -6.813 10.649 1.00 25.00 N ATOM 187 NH2 ARG A 752 -11.720 -8.912 11.186 1.00 25.00 N ATOM 0 H ARG A 752 -8.639 -6.132 5.797 1.00 25.00 H new ATOM 0 HA ARG A 752 -10.754 -4.346 5.240 1.00 25.00 H new ATOM 0 HB2 ARG A 752 -12.201 -6.071 5.807 1.00 25.00 H new ATOM 0 HB3 ARG A 752 -10.793 -6.860 5.123 1.00 25.00 H new ATOM 0 HG2 ARG A 752 -10.865 -8.215 6.890 1.00 25.00 H new ATOM 0 HG3 ARG A 752 -10.214 -6.880 7.820 1.00 25.00 H new ATOM 0 HD2 ARG A 752 -12.470 -6.149 8.453 1.00 25.00 H new ATOM 0 HD3 ARG A 752 -13.196 -7.350 7.403 1.00 25.00 H new ATOM 0 HE ARG A 752 -12.706 -9.046 8.958 1.00 25.00 H new ATOM 0 HH11 ARG A 752 -11.113 -6.038 9.986 1.00 25.00 H new ATOM 0 HH12 ARG A 752 -10.715 -6.708 11.572 1.00 25.00 H new ATOM 0 HH21 ARG A 752 -12.157 -9.803 10.952 1.00 25.00 H new ATOM 0 HH22 ARG A 752 -11.290 -8.780 12.102 1.00 25.00 H new ATOM 201 N ALA A 753 -9.628 -4.330 8.290 1.00 25.00 N ATOM 202 CA ALA A 753 -9.732 -3.654 9.584 1.00 25.00 C ATOM 203 C ALA A 753 -9.629 -2.143 9.389 1.00 25.00 C ATOM 204 O ALA A 753 -10.071 -1.375 10.237 1.00 25.00 O ATOM 205 CB ALA A 753 -8.638 -4.134 10.518 1.00 25.00 C ATOM 0 H ALA A 753 -8.750 -4.830 8.151 1.00 25.00 H new ATOM 0 HA ALA A 753 -10.698 -3.891 10.029 1.00 25.00 H new ATOM 0 HB1 ALA A 753 -8.728 -3.623 11.476 1.00 25.00 H new ATOM 0 HB2 ALA A 753 -8.735 -5.209 10.670 1.00 25.00 H new ATOM 0 HB3 ALA A 753 -7.664 -3.916 10.080 1.00 25.00 H new ATOM 211 N SER A 754 -9.079 -1.713 8.266 1.00 25.00 N ATOM 212 CA SER A 754 -8.999 -0.290 7.971 1.00 25.00 C ATOM 213 C SER A 754 -10.403 0.314 7.846 1.00 25.00 C ATOM 214 O SER A 754 -10.578 1.529 7.936 1.00 25.00 O ATOM 215 CB SER A 754 -8.144 -0.012 6.735 1.00 25.00 C ATOM 216 OG SER A 754 -7.686 1.327 6.738 1.00 25.00 O ATOM 0 H SER A 754 -8.684 -2.321 7.549 1.00 25.00 H new ATOM 0 HA SER A 754 -8.499 0.199 8.807 1.00 25.00 H new ATOM 0 HB2 SER A 754 -7.293 -0.693 6.714 1.00 25.00 H new ATOM 0 HB3 SER A 754 -8.726 -0.201 5.833 1.00 25.00 H new ATOM 0 HG SER A 754 -8.204 1.851 6.092 1.00 25.00 H new ATOM 222 N PHE A 755 -11.413 -0.544 7.695 1.00 25.00 N ATOM 223 CA PHE A 755 -12.820 -0.090 7.716 1.00 25.00 C ATOM 224 C PHE A 755 -13.206 0.675 8.976 1.00 25.00 C ATOM 225 O PHE A 755 -14.160 1.433 8.960 1.00 25.00 O ATOM 226 CB PHE A 755 -13.788 -1.257 7.553 1.00 25.00 C ATOM 227 CG PHE A 755 -14.136 -1.989 8.865 1.00 25.00 C ATOM 228 CD1 PHE A 755 -13.145 -2.526 9.704 1.00 25.00 C ATOM 229 CD2 PHE A 755 -15.472 -2.140 9.250 1.00 25.00 C ATOM 230 CE1 PHE A 755 -13.480 -3.216 10.897 1.00 25.00 C ATOM 231 CE2 PHE A 755 -15.826 -2.817 10.445 1.00 25.00 C ATOM 232 CZ PHE A 755 -14.825 -3.359 11.265 1.00 25.00 C ATOM 0 H PHE A 755 -11.294 -1.548 7.558 1.00 25.00 H new ATOM 0 HA PHE A 755 -12.896 0.593 6.870 1.00 25.00 H new ATOM 0 HB2 PHE A 755 -14.709 -0.888 7.103 1.00 25.00 H new ATOM 0 HB3 PHE A 755 -13.357 -1.975 6.855 1.00 25.00 H new ATOM 0 HD1 PHE A 755 -12.106 -2.411 9.435 1.00 25.00 H new ATOM 0 HD2 PHE A 755 -16.251 -1.732 8.623 1.00 25.00 H new ATOM 0 HE1 PHE A 755 -12.701 -3.630 11.520 1.00 25.00 H new ATOM 0 HE2 PHE A 755 -16.865 -2.915 10.723 1.00 25.00 H new ATOM 0 HZ PHE A 755 -15.089 -3.882 12.172 1.00 25.00 H new ATOM 242 N ASN A 756 -12.478 0.454 10.062 1.00 25.00 N ATOM 243 CA ASN A 756 -12.720 1.172 11.318 1.00 25.00 C ATOM 244 C ASN A 756 -11.554 2.104 11.663 1.00 25.00 C ATOM 245 O ASN A 756 -11.689 2.990 12.487 1.00 25.00 O ATOM 246 CB ASN A 756 -12.995 0.184 12.466 1.00 25.00 C ATOM 247 CG ASN A 756 -11.737 -0.296 13.161 1.00 25.00 C ATOM 248 OD1 ASN A 756 -11.166 0.377 13.993 1.00 25.00 O ATOM 249 ND2 ASN A 756 -11.314 -1.476 12.825 1.00 25.00 N ATOM 0 H ASN A 756 -11.712 -0.218 10.104 1.00 25.00 H new ATOM 0 HA ASN A 756 -13.606 1.792 11.182 1.00 25.00 H new ATOM 0 HB2 ASN A 756 -13.646 0.661 13.198 1.00 25.00 H new ATOM 0 HB3 ASN A 756 -13.535 -0.677 12.073 1.00 25.00 H new ATOM 0 HD21 ASN A 756 -10.479 -1.863 13.264 1.00 25.00 H new ATOM 0 HD22 ASN A 756 -11.817 -2.017 12.122 1.00 25.00 H new ATOM 256 N HIS A 757 -10.415 1.895 11.013 1.00 25.00 N ATOM 257 CA HIS A 757 -9.193 2.645 11.316 1.00 25.00 C ATOM 258 C HIS A 757 -9.327 4.141 11.061 1.00 25.00 C ATOM 259 O HIS A 757 -9.006 4.954 11.920 1.00 25.00 O ATOM 260 CB HIS A 757 -8.040 2.108 10.459 1.00 25.00 C ATOM 261 CG HIS A 757 -6.715 2.731 10.766 1.00 25.00 C ATOM 262 ND1 HIS A 757 -6.317 3.145 12.013 1.00 25.00 N ATOM 263 CD2 HIS A 757 -5.667 3.029 9.946 1.00 25.00 C ATOM 264 CE1 HIS A 757 -5.091 3.647 11.913 1.00 25.00 C ATOM 265 NE2 HIS A 757 -4.645 3.602 10.675 1.00 25.00 N ATOM 0 H HIS A 757 -10.308 1.208 10.267 1.00 25.00 H new ATOM 0 HA HIS A 757 -8.999 2.508 12.380 1.00 25.00 H new ATOM 0 HB2 HIS A 757 -7.965 1.030 10.602 1.00 25.00 H new ATOM 0 HB3 HIS A 757 -8.274 2.274 9.407 1.00 25.00 H new ATOM 0 HD2 HIS A 757 -5.641 2.844 8.882 1.00 25.00 H new ATOM 0 HE1 HIS A 757 -4.529 4.044 12.746 1.00 25.00 H new ATOM 0 HE2 HIS A 757 -3.740 3.921 10.330 1.00 25.00 H new ATOM 273 N PHE A 758 -9.789 4.493 9.871 1.00 25.00 N ATOM 274 CA PHE A 758 -9.942 5.899 9.496 1.00 25.00 C ATOM 275 C PHE A 758 -11.386 6.338 9.538 1.00 25.00 C ATOM 276 O PHE A 758 -11.704 7.479 9.209 1.00 25.00 O ATOM 277 CB PHE A 758 -9.394 6.122 8.097 1.00 25.00 C ATOM 278 CG PHE A 758 -8.054 6.784 8.080 1.00 25.00 C ATOM 279 CD1 PHE A 758 -6.878 6.017 8.141 1.00 25.00 C ATOM 280 CD2 PHE A 758 -7.957 8.185 7.991 1.00 25.00 C ATOM 281 CE1 PHE A 758 -5.611 6.637 8.108 1.00 25.00 C ATOM 282 CE2 PHE A 758 -6.693 8.820 7.961 1.00 25.00 C ATOM 283 CZ PHE A 758 -5.518 8.043 8.017 1.00 25.00 C ATOM 0 H PHE A 758 -10.065 3.830 9.147 1.00 25.00 H new ATOM 0 HA PHE A 758 -9.384 6.494 10.220 1.00 25.00 H new ATOM 0 HB2 PHE A 758 -9.323 5.162 7.586 1.00 25.00 H new ATOM 0 HB3 PHE A 758 -10.099 6.732 7.532 1.00 25.00 H new ATOM 0 HD1 PHE A 758 -6.945 4.942 8.214 1.00 25.00 H new ATOM 0 HD2 PHE A 758 -8.856 8.781 7.945 1.00 25.00 H new ATOM 0 HE1 PHE A 758 -4.714 6.037 8.152 1.00 25.00 H new ATOM 0 HE2 PHE A 758 -6.629 9.896 7.895 1.00 25.00 H new ATOM 0 HZ PHE A 758 -4.550 8.521 7.990 1.00 25.00 H new ATOM 293 N ASP A 759 -12.263 5.420 9.922 1.00 25.00 N ATOM 294 CA ASP A 759 -13.695 5.696 9.998 1.00 25.00 C ATOM 295 C ASP A 759 -14.028 6.888 10.871 1.00 25.00 C ATOM 296 O ASP A 759 -14.010 6.838 12.093 1.00 25.00 O ATOM 297 CB ASP A 759 -14.467 4.466 10.421 1.00 25.00 C ATOM 298 CG ASP A 759 -15.915 4.517 9.969 1.00 25.00 C ATOM 299 OD1 ASP A 759 -16.433 5.619 9.686 1.00 50.00 O ATOM 300 OD2 ASP A 759 -16.549 3.463 9.881 1.00 50.00 O ATOM 0 H ASP A 759 -12.007 4.469 10.188 1.00 25.00 H new ATOM 0 HA ASP A 759 -14.009 5.966 8.990 1.00 25.00 H new ATOM 0 HB2 ASP A 759 -13.989 3.578 10.006 1.00 25.00 H new ATOM 0 HB3 ASP A 759 -14.430 4.370 11.506 1.00 25.00 H new ATOM 305 N ARG A 760 -14.324 7.973 10.174 1.00 25.00 N ATOM 306 CA ARG A 760 -14.585 9.281 10.766 1.00 25.00 C ATOM 307 C ARG A 760 -15.700 9.267 11.801 1.00 25.00 C ATOM 308 O ARG A 760 -15.683 10.055 12.738 1.00 25.00 O ATOM 309 CB ARG A 760 -14.933 10.223 9.617 1.00 25.00 C ATOM 310 CG ARG A 760 -15.080 11.660 9.937 1.00 25.00 C ATOM 311 CD ARG A 760 -15.293 12.281 8.600 1.00 25.00 C ATOM 312 NE ARG A 760 -15.655 13.709 8.653 1.00 25.00 N ATOM 313 CZ ARG A 760 -15.987 14.442 7.596 1.00 25.00 C ATOM 314 NH1 ARG A 760 -16.029 13.939 6.397 1.00 25.00 N ATOM 315 NH2 ARG A 760 -16.284 15.703 7.737 1.00 25.00 N ATOM 0 H ARG A 760 -14.392 7.972 9.156 1.00 25.00 H new ATOM 0 HA ARG A 760 -13.698 9.608 11.309 1.00 25.00 H new ATOM 0 HB2 ARG A 760 -14.160 10.125 8.855 1.00 25.00 H new ATOM 0 HB3 ARG A 760 -15.866 9.880 9.171 1.00 25.00 H new ATOM 0 HG2 ARG A 760 -15.922 11.841 10.605 1.00 25.00 H new ATOM 0 HG3 ARG A 760 -14.192 12.057 10.429 1.00 25.00 H new ATOM 0 HD2 ARG A 760 -14.384 12.169 8.010 1.00 25.00 H new ATOM 0 HD3 ARG A 760 -16.080 11.736 8.079 1.00 25.00 H new ATOM 0 HE ARG A 760 -15.650 14.166 9.565 1.00 25.00 H new ATOM 0 HH11 ARG A 760 -15.803 12.955 6.248 1.00 25.00 H new ATOM 0 HH12 ARG A 760 -16.288 14.528 5.606 1.00 25.00 H new ATOM 0 HH21 ARG A 760 -16.262 16.132 8.662 1.00 25.00 H new ATOM 0 HH22 ARG A 760 -16.538 16.261 6.922 1.00 25.00 H new ATOM 329 N ASP A 761 -16.665 8.382 11.619 1.00 25.00 N ATOM 330 CA ASP A 761 -17.792 8.260 12.547 1.00 25.00 C ATOM 331 C ASP A 761 -17.887 6.848 13.134 1.00 25.00 C ATOM 332 O ASP A 761 -18.776 6.570 13.931 1.00 25.00 O ATOM 333 CB ASP A 761 -19.092 8.645 11.837 1.00 25.00 C ATOM 334 CG ASP A 761 -19.297 7.866 10.568 1.00 25.00 C ATOM 335 OD1 ASP A 761 -18.923 6.693 10.542 1.00 50.00 O ATOM 336 OD2 ASP A 761 -19.792 8.401 9.566 1.00 50.00 O ATOM 0 H ASP A 761 -16.696 7.731 10.834 1.00 25.00 H new ATOM 0 HA ASP A 761 -17.626 8.944 13.379 1.00 25.00 H new ATOM 0 HB2 ASP A 761 -19.935 8.474 12.507 1.00 25.00 H new ATOM 0 HB3 ASP A 761 -19.078 9.711 11.609 1.00 25.00 H new ATOM 341 N HIS A 762 -16.976 5.969 12.721 1.00 25.00 N ATOM 342 CA HIS A 762 -16.955 4.568 13.176 1.00 25.00 C ATOM 343 C HIS A 762 -18.265 3.795 12.862 1.00 25.00 C ATOM 344 O HIS A 762 -18.712 2.937 13.623 1.00 25.00 O ATOM 345 CB HIS A 762 -16.576 4.492 14.667 1.00 25.00 C ATOM 346 CG HIS A 762 -15.917 3.203 15.061 1.00 25.00 C ATOM 347 ND1 HIS A 762 -16.586 2.021 15.242 1.00 25.00 N ATOM 348 CD2 HIS A 762 -14.611 2.912 15.316 1.00 25.00 C ATOM 349 CE1 HIS A 762 -15.709 1.092 15.598 1.00 25.00 C ATOM 350 NE2 HIS A 762 -14.486 1.577 15.661 1.00 25.00 N ATOM 0 H HIS A 762 -16.231 6.200 12.064 1.00 25.00 H new ATOM 0 HA HIS A 762 -16.183 4.058 12.599 1.00 25.00 H new ATOM 0 HB2 HIS A 762 -15.906 5.319 14.904 1.00 25.00 H new ATOM 0 HB3 HIS A 762 -17.475 4.628 15.268 1.00 25.00 H new ATOM 0 HD1 HIS A 762 -17.589 1.879 15.123 1.00 25.00 H new ATOM 0 HD2 HIS A 762 -13.795 3.617 15.258 1.00 25.00 H new ATOM 0 HE1 HIS A 762 -15.966 0.065 15.810 1.00 25.00 H new ATOM 358 N SER A 763 -18.864 4.092 11.714 1.00 25.00 N ATOM 359 CA SER A 763 -20.061 3.403 11.239 1.00 25.00 C ATOM 360 C SER A 763 -19.764 1.992 10.718 1.00 25.00 C ATOM 361 O SER A 763 -20.674 1.224 10.424 1.00 25.00 O ATOM 362 CB SER A 763 -20.700 4.233 10.119 1.00 25.00 C ATOM 363 OG SER A 763 -19.799 4.452 9.024 1.00 25.00 O ATOM 0 H SER A 763 -18.532 4.821 11.083 1.00 25.00 H new ATOM 0 HA SER A 763 -20.739 3.298 12.086 1.00 25.00 H new ATOM 0 HB2 SER A 763 -21.593 3.724 9.756 1.00 25.00 H new ATOM 0 HB3 SER A 763 -21.022 5.194 10.520 1.00 25.00 H new ATOM 0 HG SER A 763 -19.254 5.247 9.202 1.00 25.00 H new ATOM 369 N GLY A 764 -18.488 1.660 10.585 1.00 25.00 N ATOM 370 CA GLY A 764 -18.082 0.344 10.110 1.00 25.00 C ATOM 371 C GLY A 764 -18.007 0.378 8.601 1.00 25.00 C ATOM 372 O GLY A 764 -17.981 -0.641 7.914 1.00 25.00 O ATOM 0 H GLY A 764 -17.712 2.287 10.800 1.00 25.00 H new ATOM 0 HA2 GLY A 764 -17.114 0.072 10.531 1.00 25.00 H new ATOM 0 HA3 GLY A 764 -18.795 -0.413 10.436 1.00 25.00 H new ATOM 376 N THR A 765 -17.996 1.592 8.085 1.00 25.00 N ATOM 377 CA THR A 765 -17.952 1.855 6.658 1.00 25.00 C ATOM 378 C THR A 765 -17.388 3.240 6.471 1.00 25.00 C ATOM 379 O THR A 765 -17.783 4.187 7.173 1.00 25.00 O ATOM 380 CB THR A 765 -19.364 1.866 6.059 1.00 25.00 C ATOM 381 OG1 THR A 765 -20.276 2.420 7.013 1.00 25.00 O ATOM 382 CG2 THR A 765 -19.839 0.481 5.697 1.00 25.00 C ATOM 0 H THR A 765 -18.018 2.438 8.655 1.00 25.00 H new ATOM 0 HA THR A 765 -17.355 1.083 6.173 1.00 25.00 H new ATOM 0 HB THR A 765 -19.329 2.465 5.149 1.00 25.00 H new ATOM 0 HG1 THR A 765 -19.835 3.144 7.505 1.00 25.00 H new ATOM 0 HG21 THR A 765 -20.843 0.539 5.277 1.00 25.00 H new ATOM 0 HG22 THR A 765 -19.163 0.045 4.962 1.00 25.00 H new ATOM 0 HG23 THR A 765 -19.855 -0.143 6.590 1.00 25.00 H new ATOM 390 N LEU A 766 -16.486 3.417 5.526 1.00 25.00 N ATOM 391 CA LEU A 766 -15.967 4.754 5.320 1.00 25.00 C ATOM 392 C LEU A 766 -16.911 5.384 4.330 1.00 25.00 C ATOM 393 O LEU A 766 -17.375 4.723 3.435 1.00 25.00 O ATOM 394 CB LEU A 766 -14.537 4.746 4.792 1.00 25.00 C ATOM 395 CG LEU A 766 -13.368 4.696 5.818 1.00 25.00 C ATOM 396 CD1 LEU A 766 -13.385 5.919 6.586 1.00 25.00 C ATOM 397 CD2 LEU A 766 -13.380 3.524 6.781 1.00 25.00 C ATOM 0 H LEU A 766 -16.112 2.691 4.915 1.00 25.00 H new ATOM 0 HA LEU A 766 -15.916 5.308 6.257 1.00 25.00 H new ATOM 0 HB2 LEU A 766 -14.433 3.887 4.129 1.00 25.00 H new ATOM 0 HB3 LEU A 766 -14.404 5.639 4.181 1.00 25.00 H new ATOM 0 HG LEU A 766 -12.463 4.571 5.223 1.00 25.00 H new ATOM 0 HD11 LEU A 766 -12.572 5.904 7.312 1.00 25.00 H new ATOM 0 HD12 LEU A 766 -13.259 6.770 5.917 1.00 25.00 H new ATOM 0 HD13 LEU A 766 -14.337 6.007 7.109 1.00 25.00 H new ATOM 0 HD21 LEU A 766 -12.521 3.592 7.448 1.00 25.00 H new ATOM 0 HD22 LEU A 766 -14.298 3.545 7.368 1.00 25.00 H new ATOM 0 HD23 LEU A 766 -13.330 2.591 6.219 1.00 25.00 H new ATOM 409 N GLY A 767 -17.208 6.655 4.503 1.00 25.00 N ATOM 410 CA GLY A 767 -18.080 7.359 3.583 1.00 25.00 C ATOM 411 C GLY A 767 -17.205 7.984 2.535 1.00 25.00 C ATOM 412 O GLY A 767 -16.047 7.649 2.475 1.00 25.00 O ATOM 0 H GLY A 767 -16.858 7.224 5.274 1.00 25.00 H new ATOM 0 HA2 GLY A 767 -18.795 6.673 3.129 1.00 25.00 H new ATOM 0 HA3 GLY A 767 -18.658 8.121 4.107 1.00 25.00 H new ATOM 416 N PRO A 768 -17.703 8.893 1.707 1.00 25.00 N ATOM 417 CA PRO A 768 -16.866 9.460 0.647 1.00 25.00 C ATOM 418 C PRO A 768 -15.670 10.268 1.171 1.00 25.00 C ATOM 419 O PRO A 768 -14.522 9.900 0.941 1.00 25.00 O ATOM 420 CB PRO A 768 -17.856 10.326 -0.141 1.00 25.00 C ATOM 421 CG PRO A 768 -18.938 10.641 0.831 1.00 25.00 C ATOM 422 CD PRO A 768 -19.065 9.438 1.695 1.00 25.00 C ATOM 0 HA PRO A 768 -16.386 8.689 0.044 1.00 25.00 H new ATOM 0 HB2 PRO A 768 -17.380 11.234 -0.512 1.00 25.00 H new ATOM 0 HB3 PRO A 768 -18.245 9.793 -1.008 1.00 25.00 H new ATOM 0 HG2 PRO A 768 -18.689 11.523 1.422 1.00 25.00 H new ATOM 0 HG3 PRO A 768 -19.875 10.855 0.318 1.00 25.00 H new ATOM 0 HD2 PRO A 768 -19.405 9.696 2.698 1.00 25.00 H new ATOM 0 HD3 PRO A 768 -19.782 8.724 1.289 1.00 25.00 H new ATOM 430 N GLU A 769 -15.934 11.350 1.892 1.00 25.00 N ATOM 431 CA GLU A 769 -14.869 12.205 2.432 1.00 25.00 C ATOM 432 C GLU A 769 -14.031 11.440 3.444 1.00 25.00 C ATOM 433 O GLU A 769 -12.930 11.841 3.802 1.00 25.00 O ATOM 434 CB GLU A 769 -15.462 13.415 3.148 1.00 25.00 C ATOM 435 CG GLU A 769 -16.137 14.440 2.259 1.00 25.00 C ATOM 436 CD GLU A 769 -16.542 15.682 3.054 1.00 25.00 C ATOM 437 OE1 GLU A 769 -16.834 15.542 4.269 1.00 25.00 O ATOM 438 OE2 GLU A 769 -16.562 16.785 2.483 1.00 25.00 O ATOM 0 H GLU A 769 -16.878 11.662 2.120 1.00 25.00 H new ATOM 0 HA GLU A 769 -14.253 12.525 1.592 1.00 25.00 H new ATOM 0 HB2 GLU A 769 -16.189 13.061 3.879 1.00 25.00 H new ATOM 0 HB3 GLU A 769 -14.666 13.911 3.704 1.00 25.00 H new ATOM 0 HG2 GLU A 769 -15.462 14.726 1.452 1.00 25.00 H new ATOM 0 HG3 GLU A 769 -17.019 13.998 1.795 1.00 25.00 H new ATOM 445 N GLU A 770 -14.570 10.334 3.919 1.00 25.00 N ATOM 446 CA GLU A 770 -13.863 9.524 4.896 1.00 25.00 C ATOM 447 C GLU A 770 -12.939 8.500 4.204 1.00 25.00 C ATOM 448 O GLU A 770 -11.784 8.346 4.582 1.00 25.00 O ATOM 449 CB GLU A 770 -14.833 8.772 5.806 1.00 25.00 C ATOM 450 CG GLU A 770 -16.153 9.421 6.223 1.00 25.00 C ATOM 451 CD GLU A 770 -16.987 8.385 6.999 1.00 25.00 C ATOM 452 OE1 GLU A 770 -16.398 7.614 7.760 1.00 50.00 O ATOM 453 OE2 GLU A 770 -18.208 8.274 6.830 1.00 50.00 O ATOM 0 H GLU A 770 -15.486 9.977 3.649 1.00 25.00 H new ATOM 0 HA GLU A 770 -13.265 10.209 5.497 1.00 25.00 H new ATOM 0 HB2 GLU A 770 -15.077 7.831 5.312 1.00 25.00 H new ATOM 0 HB3 GLU A 770 -14.293 8.522 6.719 1.00 25.00 H new ATOM 0 HG2 GLU A 770 -15.964 10.297 6.844 1.00 25.00 H new ATOM 0 HG3 GLU A 770 -16.699 9.765 5.345 1.00 25.00 H new ATOM 460 N PHE A 771 -13.429 7.784 3.199 1.00 25.00 N ATOM 461 CA PHE A 771 -12.615 6.757 2.491 1.00 25.00 C ATOM 462 C PHE A 771 -11.469 7.402 1.775 1.00 25.00 C ATOM 463 O PHE A 771 -10.422 6.799 1.652 1.00 25.00 O ATOM 464 CB PHE A 771 -13.537 5.972 1.548 1.00 25.00 C ATOM 465 CG PHE A 771 -12.835 5.252 0.397 1.00 25.00 C ATOM 466 CD1 PHE A 771 -12.451 5.948 -0.643 1.00 25.00 C ATOM 467 CD2 PHE A 771 -12.663 3.910 0.351 1.00 25.00 C ATOM 468 CE1 PHE A 771 -12.074 5.324 -1.889 1.00 25.00 C ATOM 469 CE2 PHE A 771 -12.130 3.240 -0.703 1.00 25.00 C ATOM 470 CZ PHE A 771 -11.868 3.939 -1.879 1.00 25.00 C ATOM 0 H PHE A 771 -14.380 7.882 2.844 1.00 25.00 H new ATOM 0 HA PHE A 771 -12.176 6.057 3.201 1.00 25.00 H new ATOM 0 HB2 PHE A 771 -14.087 5.235 2.134 1.00 25.00 H new ATOM 0 HB3 PHE A 771 -14.272 6.660 1.130 1.00 25.00 H new ATOM 0 HD1 PHE A 771 -12.415 7.025 -0.566 1.00 25.00 H new ATOM 0 HD2 PHE A 771 -12.971 3.333 1.211 1.00 25.00 H new ATOM 0 HE1 PHE A 771 -11.956 5.903 -2.793 1.00 25.00 H new ATOM 0 HE2 PHE A 771 -11.913 2.184 -0.631 1.00 25.00 H new ATOM 0 HZ PHE A 771 -11.515 3.426 -2.761 1.00 25.00 H new ATOM 480 N LYS A 772 -11.648 8.631 1.312 1.00 25.00 N ATOM 481 CA LYS A 772 -10.571 9.310 0.626 1.00 25.00 C ATOM 482 C LYS A 772 -9.487 9.666 1.632 1.00 25.00 C ATOM 483 O LYS A 772 -8.356 9.875 1.244 1.00 25.00 O ATOM 484 CB LYS A 772 -11.095 10.528 -0.142 1.00 25.00 C ATOM 485 CG LYS A 772 -11.683 11.634 0.710 1.00 25.00 C ATOM 486 CD LYS A 772 -10.667 12.679 1.124 1.00 25.00 C ATOM 487 CE LYS A 772 -10.065 13.407 -0.099 1.00 25.00 C ATOM 488 NZ LYS A 772 -9.862 14.887 0.059 1.00 25.00 N ATOM 0 H LYS A 772 -12.513 9.165 1.399 1.00 25.00 H new ATOM 0 HA LYS A 772 -10.130 8.651 -0.122 1.00 25.00 H new ATOM 0 HB2 LYS A 772 -10.277 10.943 -0.731 1.00 25.00 H new ATOM 0 HB3 LYS A 772 -11.856 10.192 -0.846 1.00 25.00 H new ATOM 0 HG2 LYS A 772 -12.488 12.119 0.158 1.00 25.00 H new ATOM 0 HG3 LYS A 772 -12.128 11.197 1.604 1.00 25.00 H new ATOM 0 HD2 LYS A 772 -11.141 13.406 1.783 1.00 25.00 H new ATOM 0 HD3 LYS A 772 -9.869 12.204 1.694 1.00 25.00 H new ATOM 0 HE2 LYS A 772 -9.104 12.950 -0.334 1.00 25.00 H new ATOM 0 HE3 LYS A 772 -10.716 13.238 -0.956 1.00 25.00 H new ATOM 0 HZ1 LYS A 772 -10.260 15.382 -0.765 1.00 25.00 H new ATOM 0 HZ2 LYS A 772 -10.341 15.213 0.923 1.00 25.00 H new ATOM 0 HZ3 LYS A 772 -8.845 15.092 0.128 1.00 25.00 H new ATOM 502 N ALA A 773 -9.838 9.742 2.917 1.00 25.00 N ATOM 503 CA ALA A 773 -8.857 10.061 3.952 1.00 25.00 C ATOM 504 C ALA A 773 -8.160 8.759 4.352 1.00 25.00 C ATOM 505 O ALA A 773 -6.974 8.742 4.643 1.00 25.00 O ATOM 506 CB ALA A 773 -9.538 10.715 5.164 1.00 25.00 C ATOM 0 H ALA A 773 -10.785 9.588 3.262 1.00 25.00 H new ATOM 0 HA ALA A 773 -8.126 10.775 3.573 1.00 25.00 H new ATOM 0 HB1 ALA A 773 -8.789 10.944 5.922 1.00 25.00 H new ATOM 0 HB2 ALA A 773 -10.031 11.635 4.851 1.00 25.00 H new ATOM 0 HB3 ALA A 773 -10.277 10.030 5.579 1.00 25.00 H new ATOM 512 N CYS A 774 -8.917 7.670 4.337 1.00 25.00 N ATOM 513 CA CYS A 774 -8.370 6.352 4.615 1.00 25.00 C ATOM 514 C CYS A 774 -7.318 6.023 3.573 1.00 25.00 C ATOM 515 O CYS A 774 -6.213 5.621 3.895 1.00 25.00 O ATOM 516 CB CYS A 774 -9.500 5.304 4.573 1.00 25.00 C ATOM 517 SG CYS A 774 -8.941 3.612 4.858 1.00 25.00 S ATOM 0 H CYS A 774 -9.917 7.676 4.134 1.00 25.00 H new ATOM 0 HA CYS A 774 -7.915 6.341 5.606 1.00 25.00 H new ATOM 0 HB2 CYS A 774 -10.248 5.560 5.324 1.00 25.00 H new ATOM 0 HB3 CYS A 774 -9.993 5.354 3.602 1.00 25.00 H new ATOM 0 HG CYS A 774 -9.958 2.804 4.806 1.00 25.00 H new ATOM 523 N LEU A 775 -7.685 6.208 2.326 1.00 25.00 N ATOM 524 CA LEU A 775 -6.816 5.881 1.212 1.00 25.00 C ATOM 525 C LEU A 775 -5.469 6.647 1.161 1.00 25.00 C ATOM 526 O LEU A 775 -4.540 6.224 0.476 1.00 25.00 O ATOM 527 CB LEU A 775 -7.575 6.167 -0.063 1.00 25.00 C ATOM 528 CG LEU A 775 -8.340 5.016 -0.724 1.00 25.00 C ATOM 529 CD1 LEU A 775 -9.043 5.651 -1.874 1.00 25.00 C ATOM 530 CD2 LEU A 775 -7.380 3.932 -1.225 1.00 25.00 C ATOM 0 H LEU A 775 -8.591 6.588 2.052 1.00 25.00 H new ATOM 0 HA LEU A 775 -6.547 4.832 1.337 1.00 25.00 H new ATOM 0 HB2 LEU A 775 -8.288 6.964 0.146 1.00 25.00 H new ATOM 0 HB3 LEU A 775 -6.865 6.557 -0.792 1.00 25.00 H new ATOM 0 HG LEU A 775 -9.022 4.526 -0.029 1.00 25.00 H new ATOM 0 HD11 LEU A 775 -9.620 4.897 -2.409 1.00 25.00 H new ATOM 0 HD12 LEU A 775 -9.714 6.428 -1.507 1.00 25.00 H new ATOM 0 HD13 LEU A 775 -8.310 6.094 -2.549 1.00 25.00 H new ATOM 0 HD21 LEU A 775 -7.950 3.127 -1.690 1.00 25.00 H new ATOM 0 HD22 LEU A 775 -6.696 4.362 -1.957 1.00 25.00 H new ATOM 0 HD23 LEU A 775 -6.810 3.535 -0.385 1.00 25.00 H new ATOM 542 N ILE A 776 -5.355 7.757 1.867 1.00 25.00 N ATOM 543 CA ILE A 776 -4.123 8.564 1.880 1.00 25.00 C ATOM 544 C ILE A 776 -2.992 7.722 2.437 1.00 25.00 C ATOM 545 O ILE A 776 -1.858 7.780 1.971 1.00 25.00 O ATOM 546 CB ILE A 776 -4.232 9.815 2.814 1.00 25.00 C ATOM 547 CG1 ILE A 776 -5.462 10.652 2.453 1.00 25.00 C ATOM 548 CG2 ILE A 776 -2.952 10.697 2.717 1.00 25.00 C ATOM 549 CD1 ILE A 776 -5.703 11.872 3.326 1.00 25.00 C ATOM 0 H ILE A 776 -6.103 8.133 2.449 1.00 25.00 H new ATOM 0 HA ILE A 776 -3.951 8.890 0.854 1.00 25.00 H new ATOM 0 HB ILE A 776 -4.333 9.456 3.838 1.00 25.00 H new ATOM 0 HG12 ILE A 776 -5.365 10.981 1.418 1.00 25.00 H new ATOM 0 HG13 ILE A 776 -6.343 10.012 2.503 1.00 25.00 H new ATOM 0 HG21 ILE A 776 -3.054 11.559 3.376 1.00 25.00 H new ATOM 0 HG22 ILE A 776 -2.083 10.111 3.017 1.00 25.00 H new ATOM 0 HG23 ILE A 776 -2.822 11.038 1.690 1.00 25.00 H new ATOM 0 HD11 ILE A 776 -6.598 12.393 2.985 1.00 25.00 H new ATOM 0 HD12 ILE A 776 -5.839 11.558 4.361 1.00 25.00 H new ATOM 0 HD13 ILE A 776 -4.846 12.542 3.260 1.00 25.00 H new ATOM 561 N SER A 777 -3.315 6.940 3.457 1.00 25.00 N ATOM 562 CA SER A 777 -2.295 6.165 4.162 1.00 25.00 C ATOM 563 C SER A 777 -1.866 4.943 3.389 1.00 25.00 C ATOM 564 O SER A 777 -0.923 4.265 3.772 1.00 25.00 O ATOM 565 CB SER A 777 -2.814 5.749 5.533 1.00 25.00 C ATOM 566 OG SER A 777 -3.057 6.898 6.326 1.00 25.00 O ATOM 0 H SER A 777 -4.263 6.823 3.815 1.00 25.00 H new ATOM 0 HA SER A 777 -1.421 6.807 4.272 1.00 25.00 H new ATOM 0 HB2 SER A 777 -3.732 5.171 5.424 1.00 25.00 H new ATOM 0 HB3 SER A 777 -2.087 5.103 6.026 1.00 25.00 H new ATOM 0 HG SER A 777 -3.914 6.799 6.791 1.00 25.00 H new ATOM 572 N LEU A 778 -2.576 4.667 2.308 1.00 25.00 N ATOM 573 CA LEU A 778 -2.307 3.502 1.483 1.00 25.00 C ATOM 574 C LEU A 778 -1.546 3.910 0.225 1.00 25.00 C ATOM 575 O LEU A 778 -0.965 3.074 -0.443 1.00 25.00 O ATOM 576 CB LEU A 778 -3.619 2.799 1.126 1.00 25.00 C ATOM 577 CG LEU A 778 -4.256 1.865 2.182 1.00 25.00 C ATOM 578 CD1 LEU A 778 -3.322 0.726 2.588 1.00 25.00 C ATOM 579 CD2 LEU A 778 -4.697 2.625 3.450 1.00 25.00 C ATOM 0 H LEU A 778 -3.352 5.242 1.979 1.00 25.00 H new ATOM 0 HA LEU A 778 -1.685 2.804 2.043 1.00 25.00 H new ATOM 0 HB2 LEU A 778 -4.351 3.567 0.875 1.00 25.00 H new ATOM 0 HB3 LEU A 778 -3.448 2.214 0.223 1.00 25.00 H new ATOM 0 HG LEU A 778 -5.138 1.445 1.698 1.00 25.00 H new ATOM 0 HD11 LEU A 778 -3.815 0.099 3.331 1.00 25.00 H new ATOM 0 HD12 LEU A 778 -3.077 0.126 1.711 1.00 25.00 H new ATOM 0 HD13 LEU A 778 -2.407 1.139 3.012 1.00 25.00 H new ATOM 0 HD21 LEU A 778 -5.138 1.924 4.159 1.00 25.00 H new ATOM 0 HD22 LEU A 778 -3.831 3.106 3.905 1.00 25.00 H new ATOM 0 HD23 LEU A 778 -5.434 3.382 3.183 1.00 25.00 H new ATOM 591 N GLY A 779 -1.530 5.200 -0.095 1.00 25.00 N ATOM 592 CA GLY A 779 -0.761 5.629 -1.255 1.00 25.00 C ATOM 593 C GLY A 779 -1.624 5.694 -2.495 1.00 25.00 C ATOM 594 O GLY A 779 -1.326 5.129 -3.543 1.00 25.00 O ATOM 0 H GLY A 779 -2.019 5.939 0.409 1.00 25.00 H new ATOM 0 HA2 GLY A 779 -0.324 6.609 -1.062 1.00 25.00 H new ATOM 0 HA3 GLY A 779 0.066 4.939 -1.421 1.00 25.00 H new ATOM 598 N TYR A 780 -2.730 6.398 -2.346 1.00 25.00 N ATOM 599 CA TYR A 780 -3.729 6.529 -3.400 1.00 25.00 C ATOM 600 C TYR A 780 -3.342 7.298 -4.685 1.00 25.00 C ATOM 601 O TYR A 780 -2.435 8.119 -4.712 1.00 25.00 O ATOM 602 CB TYR A 780 -5.013 7.106 -2.799 1.00 25.00 C ATOM 603 CG TYR A 780 -4.923 8.490 -2.177 1.00 25.00 C ATOM 604 CD1 TYR A 780 -3.699 9.180 -2.049 1.00 25.00 C ATOM 605 CD2 TYR A 780 -6.087 9.122 -1.709 1.00 25.00 C ATOM 606 CE1 TYR A 780 -3.643 10.466 -1.483 1.00 25.00 C ATOM 607 CE2 TYR A 780 -6.041 10.409 -1.163 1.00 25.00 C ATOM 608 CZ TYR A 780 -4.816 11.082 -1.058 1.00 25.00 C ATOM 609 OH TYR A 780 -4.773 12.351 -0.531 1.00 25.00 O ATOM 0 H TYR A 780 -2.966 6.899 -1.489 1.00 25.00 H new ATOM 0 HA TYR A 780 -3.854 5.511 -3.769 1.00 25.00 H new ATOM 0 HB2 TYR A 780 -5.770 7.135 -3.582 1.00 25.00 H new ATOM 0 HB3 TYR A 780 -5.370 6.414 -2.036 1.00 25.00 H new ATOM 0 HD1 TYR A 780 -2.788 8.712 -2.392 1.00 25.00 H new ATOM 0 HD2 TYR A 780 -7.033 8.605 -1.772 1.00 25.00 H new ATOM 0 HE1 TYR A 780 -2.695 10.973 -1.379 1.00 25.00 H new ATOM 0 HE2 TYR A 780 -6.949 10.884 -0.822 1.00 25.00 H new ATOM 0 HH TYR A 780 -5.678 12.634 -0.285 1.00 25.00 H new ATOM 619 N ASP A 781 -4.090 6.992 -5.741 1.00 25.00 N ATOM 620 CA ASP A 781 -3.911 7.513 -7.112 1.00 25.00 C ATOM 621 C ASP A 781 -4.598 8.872 -7.304 1.00 25.00 C ATOM 622 O ASP A 781 -4.761 9.377 -8.406 1.00 25.00 O ATOM 623 CB ASP A 781 -4.558 6.489 -8.061 1.00 25.00 C ATOM 624 CG ASP A 781 -4.195 6.704 -9.526 1.00 25.00 C ATOM 625 OD1 ASP A 781 -3.074 7.159 -9.824 1.00 25.00 O ATOM 626 OD2 ASP A 781 -5.055 6.385 -10.385 1.00 25.00 O ATOM 0 H ASP A 781 -4.876 6.345 -5.672 1.00 25.00 H new ATOM 0 HA ASP A 781 -2.849 7.655 -7.312 1.00 25.00 H new ATOM 0 HB2 ASP A 781 -4.253 5.486 -7.763 1.00 25.00 H new ATOM 0 HB3 ASP A 781 -5.641 6.539 -7.952 1.00 25.00 H new ATOM 631 N ILE A 782 -5.026 9.447 -6.196 1.00 25.00 N ATOM 632 CA ILE A 782 -5.757 10.708 -6.190 1.00 25.00 C ATOM 633 C ILE A 782 -5.176 11.598 -5.114 1.00 25.00 C ATOM 634 O ILE A 782 -4.371 11.154 -4.318 1.00 25.00 O ATOM 635 CB ILE A 782 -7.265 10.481 -5.933 1.00 25.00 C ATOM 636 CG1 ILE A 782 -7.473 9.557 -4.718 1.00 25.00 C ATOM 637 CG2 ILE A 782 -7.902 9.991 -7.222 1.00 25.00 C ATOM 638 CD1 ILE A 782 -7.956 8.125 -5.027 1.00 25.00 C ATOM 0 H ILE A 782 -4.877 9.053 -5.267 1.00 25.00 H new ATOM 0 HA ILE A 782 -5.657 11.181 -7.167 1.00 25.00 H new ATOM 0 HB ILE A 782 -7.768 11.409 -5.662 1.00 25.00 H new ATOM 0 HG12 ILE A 782 -6.532 9.491 -4.173 1.00 25.00 H new ATOM 0 HG13 ILE A 782 -8.196 10.026 -4.051 1.00 25.00 H new ATOM 0 HG21 ILE A 782 -8.967 9.825 -7.061 1.00 25.00 H new ATOM 0 HG22 ILE A 782 -7.765 10.739 -8.003 1.00 25.00 H new ATOM 0 HG23 ILE A 782 -7.431 9.057 -7.528 1.00 25.00 H new ATOM 0 HD11 ILE A 782 -8.066 7.569 -4.096 1.00 25.00 H new ATOM 0 HD12 ILE A 782 -8.917 8.168 -5.540 1.00 25.00 H new ATOM 0 HD13 ILE A 782 -7.227 7.624 -5.664 1.00 25.00 H new ATOM 650 N GLY A 783 -5.593 12.850 -5.079 1.00 25.00 N ATOM 651 CA GLY A 783 -5.106 13.761 -4.066 1.00 25.00 C ATOM 652 C GLY A 783 -6.141 14.815 -3.756 1.00 25.00 C ATOM 653 O GLY A 783 -7.300 14.673 -4.136 1.00 25.00 O ATOM 0 H GLY A 783 -6.262 13.254 -5.735 1.00 25.00 H new ATOM 0 HA2 GLY A 783 -4.860 13.208 -3.160 1.00 25.00 H new ATOM 0 HA3 GLY A 783 -4.187 14.236 -4.408 1.00 25.00 H new ATOM 657 N ASN A 784 -5.728 15.876 -3.078 1.00 25.00 N ATOM 658 CA ASN A 784 -6.642 16.950 -2.669 1.00 25.00 C ATOM 659 C ASN A 784 -6.804 17.975 -3.795 1.00 25.00 C ATOM 660 O ASN A 784 -6.689 19.180 -3.584 1.00 25.00 O ATOM 661 CB ASN A 784 -6.118 17.634 -1.400 1.00 25.00 C ATOM 662 CG ASN A 784 -6.074 16.701 -0.219 1.00 25.00 C ATOM 663 OD1 ASN A 784 -7.077 16.100 0.160 1.00 25.00 O ATOM 664 ND2 ASN A 784 -4.915 16.562 0.369 1.00 25.00 N ATOM 0 H ASN A 784 -4.759 16.023 -2.794 1.00 25.00 H new ATOM 0 HA ASN A 784 -7.618 16.513 -2.457 1.00 25.00 H new ATOM 0 HB2 ASN A 784 -5.118 18.024 -1.588 1.00 25.00 H new ATOM 0 HB3 ASN A 784 -6.754 18.487 -1.162 1.00 25.00 H new ATOM 0 HD21 ASN A 784 -4.821 15.938 1.171 1.00 25.00 H new ATOM 0 HD22 ASN A 784 -4.104 17.077 0.026 1.00 25.00 H new ATOM 671 N ASP A 785 -7.059 17.470 -4.989 1.00 25.00 N ATOM 672 CA ASP A 785 -7.202 18.291 -6.185 1.00 25.00 C ATOM 673 C ASP A 785 -8.592 18.048 -6.734 1.00 25.00 C ATOM 674 O ASP A 785 -9.144 16.970 -6.552 1.00 25.00 O ATOM 675 CB ASP A 785 -6.181 17.877 -7.247 1.00 25.00 C ATOM 676 CG ASP A 785 -4.765 18.214 -6.852 1.00 25.00 C ATOM 677 OD1 ASP A 785 -4.158 17.458 -6.065 1.00 25.00 O ATOM 678 OD2 ASP A 785 -4.259 19.242 -7.344 1.00 25.00 O ATOM 0 H ASP A 785 -7.174 16.471 -5.160 1.00 25.00 H new ATOM 0 HA ASP A 785 -7.041 19.340 -5.936 1.00 25.00 H new ATOM 0 HB2 ASP A 785 -6.260 16.804 -7.423 1.00 25.00 H new ATOM 0 HB3 ASP A 785 -6.420 18.373 -8.188 1.00 25.00 H new ATOM 683 N PRO A 786 -9.176 19.028 -7.441 1.00 25.00 N ATOM 684 CA PRO A 786 -10.529 18.792 -7.955 1.00 25.00 C ATOM 685 C PRO A 786 -10.533 17.715 -9.034 1.00 25.00 C ATOM 686 O PRO A 786 -11.549 17.081 -9.292 1.00 25.00 O ATOM 687 CB PRO A 786 -10.929 20.162 -8.511 1.00 25.00 C ATOM 688 CG PRO A 786 -9.631 20.794 -8.900 1.00 25.00 C ATOM 689 CD PRO A 786 -8.663 20.354 -7.828 1.00 25.00 C ATOM 0 HA PRO A 786 -11.222 18.425 -7.198 1.00 25.00 H new ATOM 0 HB2 PRO A 786 -11.597 20.065 -9.367 1.00 25.00 H new ATOM 0 HB3 PRO A 786 -11.453 20.757 -7.764 1.00 25.00 H new ATOM 0 HG2 PRO A 786 -9.308 20.463 -9.887 1.00 25.00 H new ATOM 0 HG3 PRO A 786 -9.714 21.880 -8.939 1.00 25.00 H new ATOM 0 HD2 PRO A 786 -7.642 20.297 -8.205 1.00 25.00 H new ATOM 0 HD3 PRO A 786 -8.653 21.045 -6.985 1.00 25.00 H new ATOM 697 N GLN A 787 -9.377 17.501 -9.648 1.00 25.00 N ATOM 698 CA GLN A 787 -9.227 16.456 -10.646 1.00 25.00 C ATOM 699 C GLN A 787 -9.264 15.106 -9.935 1.00 25.00 C ATOM 700 O GLN A 787 -9.962 14.194 -10.350 1.00 25.00 O ATOM 701 CB GLN A 787 -7.902 16.620 -11.400 1.00 25.00 C ATOM 702 CG GLN A 787 -7.741 17.960 -12.062 1.00 25.00 C ATOM 703 CD GLN A 787 -6.490 18.023 -12.798 1.00 25.00 C ATOM 704 OE1 GLN A 787 -6.397 18.165 -14.003 1.00 25.00 O ATOM 705 NE2 GLN A 787 -5.492 17.922 -12.032 1.00 25.00 N ATOM 0 H GLN A 787 -8.529 18.040 -9.470 1.00 25.00 H new ATOM 0 HA GLN A 787 -10.037 16.520 -11.373 1.00 25.00 H new ATOM 0 HB2 GLN A 787 -7.077 16.468 -10.703 1.00 25.00 H new ATOM 0 HB3 GLN A 787 -7.827 15.840 -12.158 1.00 25.00 H new ATOM 0 HG2 GLN A 787 -8.576 18.139 -12.739 1.00 25.00 H new ATOM 0 HG3 GLN A 787 -7.766 18.748 -11.309 1.00 25.00 H new ATOM 0 HE21 GLN A 787 -5.629 17.804 -11.028 1.00 25.00 H new ATOM 0 HE22 GLN A 787 -4.548 17.958 -12.417 1.00 25.00 H new ATOM 714 N GLY A 788 -8.514 14.995 -8.845 1.00 25.00 N ATOM 715 CA GLY A 788 -8.461 13.750 -8.105 1.00 25.00 C ATOM 716 C GLY A 788 -9.763 13.437 -7.413 1.00 25.00 C ATOM 717 O GLY A 788 -10.104 12.290 -7.267 1.00 25.00 O ATOM 0 H GLY A 788 -7.941 15.746 -8.461 1.00 25.00 H new ATOM 0 HA2 GLY A 788 -8.210 12.936 -8.785 1.00 25.00 H new ATOM 0 HA3 GLY A 788 -7.663 13.804 -7.365 1.00 25.00 H new ATOM 721 N GLU A 789 -10.507 14.447 -6.999 1.00 25.00 N ATOM 722 CA GLU A 789 -11.802 14.222 -6.347 1.00 25.00 C ATOM 723 C GLU A 789 -12.783 13.550 -7.315 1.00 25.00 C ATOM 724 O GLU A 789 -13.652 12.789 -6.897 1.00 25.00 O ATOM 725 CB GLU A 789 -12.404 15.545 -5.856 1.00 25.00 C ATOM 726 CG GLU A 789 -11.737 16.137 -4.601 1.00 25.00 C ATOM 727 CD GLU A 789 -11.952 15.302 -3.339 1.00 25.00 C ATOM 728 OE1 GLU A 789 -13.026 14.685 -3.184 1.00 25.00 O ATOM 729 OE2 GLU A 789 -11.034 15.275 -2.486 1.00 25.00 O ATOM 0 H GLU A 789 -10.246 15.428 -7.098 1.00 25.00 H new ATOM 0 HA GLU A 789 -11.633 13.568 -5.491 1.00 25.00 H new ATOM 0 HB2 GLU A 789 -12.341 16.276 -6.662 1.00 25.00 H new ATOM 0 HB3 GLU A 789 -13.463 15.390 -5.648 1.00 25.00 H new ATOM 0 HG2 GLU A 789 -10.667 16.237 -4.782 1.00 25.00 H new ATOM 0 HG3 GLU A 789 -12.127 17.141 -4.433 1.00 25.00 H new ATOM 736 N ALA A 790 -12.645 13.814 -8.609 1.00 25.00 N ATOM 737 CA ALA A 790 -13.556 13.235 -9.593 1.00 25.00 C ATOM 738 C ALA A 790 -13.218 11.755 -9.759 1.00 25.00 C ATOM 739 O ALA A 790 -14.095 10.895 -9.857 1.00 25.00 O ATOM 740 CB ALA A 790 -13.422 13.973 -10.932 1.00 25.00 C ATOM 0 H ALA A 790 -11.921 14.417 -8.999 1.00 25.00 H new ATOM 0 HA ALA A 790 -14.587 13.337 -9.253 1.00 25.00 H new ATOM 0 HB1 ALA A 790 -14.105 13.534 -11.659 1.00 25.00 H new ATOM 0 HB2 ALA A 790 -13.667 15.026 -10.793 1.00 25.00 H new ATOM 0 HB3 ALA A 790 -12.398 13.884 -11.296 1.00 25.00 H new ATOM 746 N GLU A 791 -11.929 11.474 -9.776 1.00 25.00 N ATOM 747 CA GLU A 791 -11.441 10.111 -9.925 1.00 25.00 C ATOM 748 C GLU A 791 -11.713 9.324 -8.650 1.00 25.00 C ATOM 749 O GLU A 791 -12.037 8.140 -8.691 1.00 25.00 O ATOM 750 CB GLU A 791 -9.944 10.144 -10.211 1.00 25.00 C ATOM 751 CG GLU A 791 -9.586 10.920 -11.463 1.00 25.00 C ATOM 752 CD GLU A 791 -10.097 10.233 -12.720 1.00 25.00 C ATOM 753 OE1 GLU A 791 -9.391 9.343 -13.246 1.00 25.00 O ATOM 754 OE2 GLU A 791 -11.216 10.556 -13.179 1.00 25.00 O ATOM 0 H GLU A 791 -11.194 12.176 -9.688 1.00 25.00 H new ATOM 0 HA GLU A 791 -11.957 9.625 -10.753 1.00 25.00 H new ATOM 0 HB2 GLU A 791 -9.429 10.587 -9.359 1.00 25.00 H new ATOM 0 HB3 GLU A 791 -9.578 9.122 -10.309 1.00 25.00 H new ATOM 0 HG2 GLU A 791 -10.007 11.924 -11.401 1.00 25.00 H new ATOM 0 HG3 GLU A 791 -8.503 11.031 -11.524 1.00 25.00 H new ATOM 761 N PHE A 792 -11.600 9.993 -7.513 1.00 25.00 N ATOM 762 CA PHE A 792 -11.885 9.372 -6.227 1.00 25.00 C ATOM 763 C PHE A 792 -13.355 8.985 -6.204 1.00 25.00 C ATOM 764 O PHE A 792 -13.699 7.885 -5.771 1.00 25.00 O ATOM 765 CB PHE A 792 -11.549 10.312 -5.062 1.00 25.00 C ATOM 766 CG PHE A 792 -12.600 10.341 -4.001 1.00 25.00 C ATOM 767 CD1 PHE A 792 -12.817 9.224 -3.169 1.00 25.00 C ATOM 768 CD2 PHE A 792 -13.401 11.483 -3.835 1.00 25.00 C ATOM 769 CE1 PHE A 792 -13.841 9.243 -2.209 1.00 25.00 C ATOM 770 CE2 PHE A 792 -14.417 11.512 -2.878 1.00 25.00 C ATOM 771 CZ PHE A 792 -14.644 10.394 -2.074 1.00 25.00 C ATOM 0 H PHE A 792 -11.312 10.970 -7.454 1.00 25.00 H new ATOM 0 HA PHE A 792 -11.262 8.486 -6.104 1.00 25.00 H new ATOM 0 HB2 PHE A 792 -10.603 10.004 -4.617 1.00 25.00 H new ATOM 0 HB3 PHE A 792 -11.406 11.321 -5.449 1.00 25.00 H new ATOM 0 HD1 PHE A 792 -12.192 8.349 -3.271 1.00 25.00 H new ATOM 0 HD2 PHE A 792 -13.229 12.350 -4.456 1.00 25.00 H new ATOM 0 HE1 PHE A 792 -14.012 8.383 -1.579 1.00 25.00 H new ATOM 0 HE2 PHE A 792 -15.025 12.397 -2.760 1.00 25.00 H new ATOM 0 HZ PHE A 792 -15.440 10.411 -1.344 1.00 25.00 H new ATOM 781 N ALA A 793 -14.220 9.870 -6.688 1.00 25.00 N ATOM 782 CA ALA A 793 -15.649 9.593 -6.737 1.00 25.00 C ATOM 783 C ALA A 793 -15.918 8.354 -7.594 1.00 25.00 C ATOM 784 O ALA A 793 -16.859 7.613 -7.336 1.00 25.00 O ATOM 785 CB ALA A 793 -16.410 10.807 -7.280 1.00 25.00 C ATOM 0 H ALA A 793 -13.955 10.785 -7.052 1.00 25.00 H new ATOM 0 HA ALA A 793 -16.004 9.394 -5.726 1.00 25.00 H new ATOM 0 HB1 ALA A 793 -17.477 10.584 -7.310 1.00 25.00 H new ATOM 0 HB2 ALA A 793 -16.237 11.665 -6.631 1.00 25.00 H new ATOM 0 HB3 ALA A 793 -16.059 11.037 -8.286 1.00 25.00 H new ATOM 791 N ARG A 794 -15.087 8.112 -8.602 1.00 25.00 N ATOM 792 CA ARG A 794 -15.240 6.910 -9.421 1.00 25.00 C ATOM 793 C ARG A 794 -14.964 5.664 -8.593 1.00 25.00 C ATOM 794 O ARG A 794 -15.706 4.698 -8.698 1.00 25.00 O ATOM 795 CB ARG A 794 -14.323 6.932 -10.639 1.00 25.00 C ATOM 796 CG ARG A 794 -14.654 5.815 -11.620 1.00 25.00 C ATOM 797 CD ARG A 794 -13.743 5.824 -12.821 1.00 25.00 C ATOM 798 NE ARG A 794 -12.335 5.586 -12.444 1.00 25.00 N ATOM 799 CZ ARG A 794 -11.323 6.412 -12.698 1.00 25.00 C ATOM 800 NH1 ARG A 794 -11.490 7.531 -13.340 1.00 25.00 N ATOM 801 NH2 ARG A 794 -10.121 6.113 -12.291 1.00 25.00 N ATOM 0 H ARG A 794 -14.313 8.719 -8.870 1.00 25.00 H new ATOM 0 HA ARG A 794 -16.270 6.890 -9.776 1.00 25.00 H new ATOM 0 HB2 ARG A 794 -14.411 7.895 -11.142 1.00 25.00 H new ATOM 0 HB3 ARG A 794 -13.287 6.835 -10.315 1.00 25.00 H new ATOM 0 HG2 ARG A 794 -14.575 4.853 -11.113 1.00 25.00 H new ATOM 0 HG3 ARG A 794 -15.688 5.918 -11.949 1.00 25.00 H new ATOM 0 HD2 ARG A 794 -14.065 5.058 -13.527 1.00 25.00 H new ATOM 0 HD3 ARG A 794 -13.825 6.783 -13.332 1.00 25.00 H new ATOM 0 HE ARG A 794 -12.121 4.720 -11.950 1.00 25.00 H new ATOM 0 HH11 ARG A 794 -12.419 7.798 -13.666 1.00 25.00 H new ATOM 0 HH12 ARG A 794 -10.692 8.141 -13.518 1.00 25.00 H new ATOM 0 HH21 ARG A 794 -9.957 5.247 -11.778 1.00 25.00 H new ATOM 0 HH22 ARG A 794 -9.345 6.745 -12.485 1.00 25.00 H new ATOM 815 N ILE A 795 -13.930 5.659 -7.763 1.00 25.00 N ATOM 816 CA ILE A 795 -13.682 4.474 -6.947 1.00 25.00 C ATOM 817 C ILE A 795 -14.828 4.358 -5.973 1.00 25.00 C ATOM 818 O ILE A 795 -15.373 3.290 -5.782 1.00 25.00 O ATOM 819 CB ILE A 795 -12.369 4.459 -6.142 1.00 25.00 C ATOM 820 CG1 ILE A 795 -11.153 4.614 -7.067 1.00 25.00 C ATOM 821 CG2 ILE A 795 -12.280 3.101 -5.408 1.00 25.00 C ATOM 822 CD1 ILE A 795 -10.323 5.837 -6.766 1.00 25.00 C ATOM 0 H ILE A 795 -13.272 6.428 -7.637 1.00 25.00 H new ATOM 0 HA ILE A 795 -13.594 3.642 -7.646 1.00 25.00 H new ATOM 0 HB ILE A 795 -12.366 5.291 -5.437 1.00 25.00 H new ATOM 0 HG12 ILE A 795 -10.525 3.727 -6.981 1.00 25.00 H new ATOM 0 HG13 ILE A 795 -11.496 4.662 -8.101 1.00 25.00 H new ATOM 0 HG21 ILE A 795 -11.358 3.061 -4.828 1.00 25.00 H new ATOM 0 HG22 ILE A 795 -13.134 2.992 -4.740 1.00 25.00 H new ATOM 0 HG23 ILE A 795 -12.285 2.292 -6.138 1.00 25.00 H new ATOM 0 HD11 ILE A 795 -9.481 5.884 -7.457 1.00 25.00 H new ATOM 0 HD12 ILE A 795 -10.937 6.730 -6.880 1.00 25.00 H new ATOM 0 HD13 ILE A 795 -9.951 5.781 -5.743 1.00 25.00 H new ATOM 834 N MET A 796 -15.204 5.477 -5.377 1.00 25.00 N ATOM 835 CA MET A 796 -16.302 5.521 -4.422 1.00 25.00 C ATOM 836 C MET A 796 -17.591 4.920 -5.015 1.00 25.00 C ATOM 837 O MET A 796 -18.410 4.360 -4.299 1.00 25.00 O ATOM 838 CB MET A 796 -16.518 6.970 -3.990 1.00 25.00 C ATOM 839 CG MET A 796 -16.791 7.134 -2.522 1.00 25.00 C ATOM 840 SD MET A 796 -18.541 7.102 -2.182 1.00 25.00 S ATOM 841 CE MET A 796 -18.643 5.774 -1.126 1.00 25.00 C ATOM 0 H MET A 796 -14.758 6.380 -5.540 1.00 25.00 H new ATOM 0 HA MET A 796 -16.045 4.915 -3.553 1.00 25.00 H new ATOM 0 HB2 MET A 796 -15.635 7.552 -4.252 1.00 25.00 H new ATOM 0 HB3 MET A 796 -17.353 7.386 -4.553 1.00 25.00 H new ATOM 0 HG2 MET A 796 -16.296 6.338 -1.966 1.00 25.00 H new ATOM 0 HG3 MET A 796 -16.368 8.076 -2.174 1.00 25.00 H new ATOM 0 HE1 MET A 796 -19.690 5.517 -0.965 1.00 25.00 H new ATOM 0 HE2 MET A 796 -18.123 4.921 -1.562 1.00 25.00 H new ATOM 0 HE3 MET A 796 -18.182 6.031 -0.172 1.00 25.00 H new ATOM 851 N SER A 797 -17.737 5.028 -6.331 1.00 25.00 N ATOM 852 CA SER A 797 -18.899 4.517 -7.055 1.00 25.00 C ATOM 853 C SER A 797 -18.799 3.030 -7.410 1.00 25.00 C ATOM 854 O SER A 797 -19.814 2.396 -7.728 1.00 25.00 O ATOM 855 CB SER A 797 -19.085 5.318 -8.343 1.00 25.00 C ATOM 856 OG SER A 797 -20.240 4.889 -9.042 1.00 25.00 O ATOM 0 H SER A 797 -17.046 5.477 -6.933 1.00 25.00 H new ATOM 0 HA SER A 797 -19.752 4.629 -6.386 1.00 25.00 H new ATOM 0 HB2 SER A 797 -19.171 6.379 -8.107 1.00 25.00 H new ATOM 0 HB3 SER A 797 -18.207 5.202 -8.978 1.00 25.00 H new ATOM 0 HG SER A 797 -20.413 3.946 -8.841 1.00 25.00 H new ATOM 862 N ILE A 798 -17.597 2.463 -7.387 1.00 25.00 N ATOM 863 CA ILE A 798 -17.443 1.029 -7.658 1.00 25.00 C ATOM 864 C ILE A 798 -17.414 0.224 -6.358 1.00 25.00 C ATOM 865 O ILE A 798 -17.706 -0.971 -6.353 1.00 25.00 O ATOM 866 CB ILE A 798 -16.241 0.691 -8.599 1.00 25.00 C ATOM 867 CG1 ILE A 798 -14.886 0.910 -7.907 1.00 25.00 C ATOM 868 CG2 ILE A 798 -16.358 1.528 -9.904 1.00 25.00 C ATOM 869 CD1 ILE A 798 -13.668 0.335 -8.670 1.00 25.00 C ATOM 0 H ILE A 798 -16.728 2.959 -7.188 1.00 25.00 H new ATOM 0 HA ILE A 798 -18.327 0.725 -8.218 1.00 25.00 H new ATOM 0 HB ILE A 798 -16.285 -0.369 -8.850 1.00 25.00 H new ATOM 0 HG12 ILE A 798 -14.735 1.980 -7.764 1.00 25.00 H new ATOM 0 HG13 ILE A 798 -14.923 0.458 -6.916 1.00 25.00 H new ATOM 0 HG21 ILE A 798 -15.521 1.295 -10.562 1.00 25.00 H new ATOM 0 HG22 ILE A 798 -17.294 1.287 -10.408 1.00 25.00 H new ATOM 0 HG23 ILE A 798 -16.341 2.590 -9.658 1.00 25.00 H new ATOM 0 HD11 ILE A 798 -12.757 0.537 -8.106 1.00 25.00 H new ATOM 0 HD12 ILE A 798 -13.789 -0.742 -8.790 1.00 25.00 H new ATOM 0 HD13 ILE A 798 -13.599 0.804 -9.651 1.00 25.00 H new ATOM 881 N VAL A 799 -17.070 0.881 -5.258 1.00 25.00 N ATOM 882 CA VAL A 799 -16.913 0.222 -3.969 1.00 25.00 C ATOM 883 C VAL A 799 -18.183 0.279 -3.133 1.00 25.00 C ATOM 884 O VAL A 799 -18.152 0.030 -1.928 1.00 25.00 O ATOM 885 CB VAL A 799 -15.733 0.834 -3.152 1.00 25.00 C ATOM 886 CG1 VAL A 799 -14.420 0.622 -3.903 1.00 25.00 C ATOM 887 CG2 VAL A 799 -15.982 2.302 -2.846 1.00 25.00 C ATOM 0 H VAL A 799 -16.892 1.885 -5.235 1.00 25.00 H new ATOM 0 HA VAL A 799 -16.693 -0.822 -4.191 1.00 25.00 H new ATOM 0 HB VAL A 799 -15.662 0.322 -2.193 1.00 25.00 H new ATOM 0 HG11 VAL A 799 -13.599 1.051 -3.329 1.00 25.00 H new ATOM 0 HG12 VAL A 799 -14.248 -0.445 -4.040 1.00 25.00 H new ATOM 0 HG13 VAL A 799 -14.475 1.109 -4.877 1.00 25.00 H new ATOM 0 HG21 VAL A 799 -15.144 2.702 -2.276 1.00 25.00 H new ATOM 0 HG22 VAL A 799 -16.084 2.856 -3.779 1.00 25.00 H new ATOM 0 HG23 VAL A 799 -16.898 2.402 -2.263 1.00 25.00 H new ATOM 897 N ASP A 800 -19.322 0.532 -3.761 1.00 25.00 N ATOM 898 CA ASP A 800 -20.597 0.385 -3.062 1.00 25.00 C ATOM 899 C ASP A 800 -21.428 -0.740 -3.714 1.00 25.00 C ATOM 900 O ASP A 800 -22.529 -0.514 -4.209 1.00 25.00 O ATOM 901 CB ASP A 800 -21.355 1.719 -2.913 1.00 25.00 C ATOM 902 CG ASP A 800 -21.993 2.196 -4.209 1.00 25.00 C ATOM 903 OD1 ASP A 800 -21.291 2.285 -5.230 1.00 25.00 O ATOM 904 OD2 ASP A 800 -23.213 2.471 -4.201 1.00 25.00 O ATOM 0 H ASP A 800 -19.394 0.834 -4.733 1.00 25.00 H new ATOM 0 HA ASP A 800 -20.395 0.082 -2.034 1.00 25.00 H new ATOM 0 HB2 ASP A 800 -22.130 1.606 -2.155 1.00 25.00 H new ATOM 0 HB3 ASP A 800 -20.665 2.483 -2.553 1.00 25.00 H new ATOM 909 N PRO A 801 -20.925 -1.998 -3.685 1.00 25.00 N ATOM 910 CA PRO A 801 -21.664 -3.095 -4.313 1.00 25.00 C ATOM 911 C PRO A 801 -22.937 -3.445 -3.563 1.00 25.00 C ATOM 912 O PRO A 801 -23.766 -4.219 -4.029 1.00 25.00 O ATOM 913 CB PRO A 801 -20.669 -4.249 -4.237 1.00 25.00 C ATOM 914 CG PRO A 801 -19.866 -3.947 -3.040 1.00 25.00 C ATOM 915 CD PRO A 801 -19.683 -2.498 -3.065 1.00 25.00 C ATOM 0 HA PRO A 801 -21.994 -2.848 -5.322 1.00 25.00 H new ATOM 0 HB2 PRO A 801 -21.177 -5.209 -4.145 1.00 25.00 H new ATOM 0 HB3 PRO A 801 -20.048 -4.301 -5.132 1.00 25.00 H new ATOM 0 HG2 PRO A 801 -20.377 -4.265 -2.131 1.00 25.00 H new ATOM 0 HG3 PRO A 801 -18.908 -4.467 -3.066 1.00 25.00 H new ATOM 0 HD2 PRO A 801 -19.546 -2.095 -2.062 1.00 25.00 H new ATOM 0 HD3 PRO A 801 -18.804 -2.216 -3.645 1.00 25.00 H new ATOM 923 N ASN A 802 -23.093 -2.867 -2.380 1.00 25.00 N ATOM 924 CA ASN A 802 -24.270 -3.114 -1.541 1.00 25.00 C ATOM 925 C ASN A 802 -25.232 -1.935 -1.759 1.00 25.00 C ATOM 926 O ASN A 802 -26.320 -1.892 -1.205 1.00 25.00 O ATOM 927 CB ASN A 802 -23.890 -3.221 -0.054 1.00 25.00 C ATOM 928 CG ASN A 802 -23.283 -4.557 0.326 1.00 25.00 C ATOM 929 OD1 ASN A 802 -22.402 -5.066 -0.483 1.00 25.00 O flip ATOM 930 ND2 ASN A 802 -23.599 -5.105 1.357 1.00 25.00 N flip ATOM 0 H ASN A 802 -22.418 -2.219 -1.973 1.00 25.00 H new ATOM 0 HA ASN A 802 -24.734 -4.061 -1.817 1.00 25.00 H new ATOM 0 HB2 ASN A 802 -23.182 -2.428 0.189 1.00 25.00 H new ATOM 0 HB3 ASN A 802 -24.780 -3.051 0.552 1.00 25.00 H new ATOM 0 HD21 ASN A 802 -24.294 -4.678 1.969 1.00 25.00 H new ATOM 0 HD22 ASN A 802 -23.170 -5.994 1.614 1.00 25.00 H new ATOM 937 N ARG A 803 -24.781 -0.987 -2.576 1.00 25.00 N ATOM 938 CA ARG A 803 -25.532 0.218 -2.973 1.00 25.00 C ATOM 939 C ARG A 803 -26.067 1.029 -1.807 1.00 25.00 C ATOM 940 O ARG A 803 -27.148 1.597 -1.851 1.00 25.00 O ATOM 941 CB ARG A 803 -26.623 -0.149 -3.986 1.00 25.00 C ATOM 942 CG ARG A 803 -26.044 -0.812 -5.254 1.00 25.00 C ATOM 943 CD ARG A 803 -25.183 0.179 -6.060 1.00 25.00 C ATOM 944 NE ARG A 803 -24.528 -0.457 -7.217 1.00 25.00 N ATOM 945 CZ ARG A 803 -23.373 -0.063 -7.749 1.00 25.00 C ATOM 946 NH1 ARG A 803 -22.682 0.941 -7.279 1.00 25.00 N ATOM 947 NH2 ARG A 803 -22.897 -0.706 -8.778 1.00 25.00 N ATOM 0 H ARG A 803 -23.853 -1.030 -2.998 1.00 25.00 H new ATOM 0 HA ARG A 803 -24.821 0.888 -3.456 1.00 25.00 H new ATOM 0 HB2 ARG A 803 -27.337 -0.826 -3.518 1.00 25.00 H new ATOM 0 HB3 ARG A 803 -27.172 0.750 -4.267 1.00 25.00 H new ATOM 0 HG2 ARG A 803 -25.441 -1.675 -4.973 1.00 25.00 H new ATOM 0 HG3 ARG A 803 -26.858 -1.181 -5.878 1.00 25.00 H new ATOM 0 HD2 ARG A 803 -25.809 1.001 -6.407 1.00 25.00 H new ATOM 0 HD3 ARG A 803 -24.424 0.610 -5.408 1.00 25.00 H new ATOM 0 HE ARG A 803 -24.994 -1.259 -7.642 1.00 25.00 H new ATOM 0 HH11 ARG A 803 -23.023 1.460 -6.470 1.00 25.00 H new ATOM 0 HH12 ARG A 803 -21.802 1.206 -7.721 1.00 25.00 H new ATOM 0 HH21 ARG A 803 -23.408 -1.499 -9.165 1.00 25.00 H new ATOM 0 HH22 ARG A 803 -22.013 -0.416 -9.196 1.00 25.00 H new ATOM 961 N LEU A 804 -25.252 1.078 -0.768 1.00 25.00 N ATOM 962 CA LEU A 804 -25.539 1.856 0.433 1.00 25.00 C ATOM 963 C LEU A 804 -24.803 3.205 0.392 1.00 25.00 C ATOM 964 O LEU A 804 -25.073 4.082 1.203 1.00 25.00 O ATOM 965 CB LEU A 804 -25.178 1.050 1.700 1.00 25.00 C ATOM 966 CG LEU A 804 -24.174 -0.109 1.556 1.00 25.00 C ATOM 967 CD1 LEU A 804 -22.761 0.346 1.204 1.00 25.00 C ATOM 968 CD2 LEU A 804 -24.109 -0.951 2.815 1.00 25.00 C ATOM 0 H LEU A 804 -24.365 0.577 -0.730 1.00 25.00 H new ATOM 0 HA LEU A 804 -26.608 2.065 0.467 1.00 25.00 H new ATOM 0 HB2 LEU A 804 -24.780 1.747 2.438 1.00 25.00 H new ATOM 0 HB3 LEU A 804 -26.102 0.643 2.112 1.00 25.00 H new ATOM 0 HG LEU A 804 -24.554 -0.703 0.725 1.00 25.00 H new ATOM 0 HD11 LEU A 804 -22.109 -0.524 1.119 1.00 25.00 H new ATOM 0 HD12 LEU A 804 -22.777 0.882 0.255 1.00 25.00 H new ATOM 0 HD13 LEU A 804 -22.386 1.006 1.986 1.00 25.00 H new ATOM 0 HD21 LEU A 804 -23.390 -1.759 2.676 1.00 25.00 H new ATOM 0 HD22 LEU A 804 -23.797 -0.328 3.653 1.00 25.00 H new ATOM 0 HD23 LEU A 804 -25.093 -1.372 3.022 1.00 25.00 H new ATOM 980 N GLY A 805 -23.883 3.363 -0.559 1.00 25.00 N ATOM 981 CA GLY A 805 -23.169 4.628 -0.725 1.00 25.00 C ATOM 982 C GLY A 805 -22.140 4.892 0.353 1.00 25.00 C ATOM 983 O GLY A 805 -21.769 6.029 0.627 1.00 25.00 O ATOM 0 H GLY A 805 -23.616 2.636 -1.222 1.00 25.00 H new ATOM 0 HA2 GLY A 805 -22.674 4.631 -1.696 1.00 25.00 H new ATOM 0 HA3 GLY A 805 -23.891 5.444 -0.733 1.00 25.00 H new ATOM 987 N VAL A 806 -21.673 3.823 0.966 1.00 25.00 N ATOM 988 CA VAL A 806 -20.635 3.874 1.990 1.00 25.00 C ATOM 989 C VAL A 806 -19.710 2.770 1.490 1.00 25.00 C ATOM 990 O VAL A 806 -20.138 2.001 0.634 1.00 25.00 O ATOM 991 CB VAL A 806 -21.176 3.634 3.441 1.00 25.00 C ATOM 992 CG1 VAL A 806 -20.690 4.744 4.388 1.00 25.00 C ATOM 993 CG2 VAL A 806 -22.699 3.596 3.490 1.00 25.00 C ATOM 0 H VAL A 806 -22.005 2.879 0.768 1.00 25.00 H new ATOM 0 HA VAL A 806 -20.155 4.846 2.101 1.00 25.00 H new ATOM 0 HB VAL A 806 -20.791 2.665 3.758 1.00 25.00 H new ATOM 0 HG11 VAL A 806 -21.075 4.561 5.391 1.00 25.00 H new ATOM 0 HG12 VAL A 806 -19.600 4.749 4.413 1.00 25.00 H new ATOM 0 HG13 VAL A 806 -21.049 5.709 4.032 1.00 25.00 H new ATOM 0 HG21 VAL A 806 -23.026 3.427 4.516 1.00 25.00 H new ATOM 0 HG22 VAL A 806 -23.098 4.545 3.133 1.00 25.00 H new ATOM 0 HG23 VAL A 806 -23.063 2.788 2.856 1.00 25.00 H new ATOM 1003 N VAL A 807 -18.467 2.697 1.959 1.00 25.00 N ATOM 1004 CA VAL A 807 -17.473 1.850 1.338 1.00 25.00 C ATOM 1005 C VAL A 807 -17.246 0.539 1.951 1.00 25.00 C ATOM 1006 O VAL A 807 -17.726 0.175 0.903 1.00 25.00 O ATOM 1007 CB VAL A 807 -16.099 2.549 1.281 1.00 25.00 C ATOM 1008 CG1 VAL A 807 -15.003 1.627 0.648 1.00 25.00 C ATOM 1009 CG2 VAL A 807 -16.231 3.846 0.488 1.00 25.00 C ATOM 0 H VAL A 807 -18.131 3.218 2.769 1.00 25.00 H new ATOM 0 HA VAL A 807 -17.908 1.675 0.354 1.00 25.00 H new ATOM 0 HB VAL A 807 -15.781 2.769 2.300 1.00 25.00 H new ATOM 0 HG11 VAL A 807 -14.050 2.156 0.626 1.00 25.00 H new ATOM 0 HG12 VAL A 807 -14.901 0.721 1.245 1.00 25.00 H new ATOM 0 HG13 VAL A 807 -15.294 1.361 -0.368 1.00 25.00 H new ATOM 0 HG21 VAL A 807 -15.263 4.345 0.444 1.00 25.00 H new ATOM 0 HG22 VAL A 807 -16.570 3.621 -0.523 1.00 25.00 H new ATOM 0 HG23 VAL A 807 -16.954 4.499 0.976 1.00 25.00 H new ATOM 1019 N THR A 808 -17.209 -0.716 2.063 1.00 25.00 N ATOM 1020 CA THR A 808 -17.164 -1.503 3.261 1.00 25.00 C ATOM 1021 C THR A 808 -15.833 -2.215 3.125 1.00 25.00 C ATOM 1022 O THR A 808 -15.143 -2.068 2.135 1.00 25.00 O ATOM 1023 CB THR A 808 -18.311 -2.577 3.297 1.00 25.00 C ATOM 1024 OG1 THR A 808 -17.822 -3.807 2.762 1.00 25.00 O ATOM 1025 CG2 THR A 808 -19.510 -2.164 2.450 1.00 25.00 C ATOM 0 H THR A 808 -17.209 -1.309 1.233 1.00 25.00 H new ATOM 0 HA THR A 808 -17.281 -0.900 4.161 1.00 25.00 H new ATOM 0 HB THR A 808 -18.623 -2.678 4.337 1.00 25.00 H new ATOM 0 HG1 THR A 808 -18.556 -4.289 2.327 1.00 25.00 H new ATOM 0 HG21 THR A 808 -20.277 -2.936 2.505 1.00 25.00 H new ATOM 0 HG22 THR A 808 -19.914 -1.224 2.825 1.00 25.00 H new ATOM 0 HG23 THR A 808 -19.197 -2.037 1.414 1.00 25.00 H new ATOM 1033 N PHE A 809 -15.492 -3.010 4.108 1.00 25.00 N ATOM 1034 CA PHE A 809 -14.290 -3.828 4.114 1.00 25.00 C ATOM 1035 C PHE A 809 -14.060 -4.646 2.858 1.00 25.00 C ATOM 1036 O PHE A 809 -12.941 -4.743 2.392 1.00 25.00 O ATOM 1037 CB PHE A 809 -14.436 -4.791 5.288 1.00 25.00 C ATOM 1038 CG PHE A 809 -15.875 -5.043 5.667 1.00 25.00 C ATOM 1039 CD1 PHE A 809 -16.636 -6.023 4.996 1.00 25.00 C ATOM 1040 CD2 PHE A 809 -16.482 -4.289 6.687 1.00 25.00 C ATOM 1041 CE1 PHE A 809 -17.996 -6.228 5.321 1.00 25.00 C ATOM 1042 CE2 PHE A 809 -17.838 -4.487 7.024 1.00 25.00 C ATOM 1043 CZ PHE A 809 -18.599 -5.454 6.332 1.00 25.00 C ATOM 0 H PHE A 809 -16.054 -3.114 4.953 1.00 25.00 H new ATOM 0 HA PHE A 809 -13.436 -3.154 4.184 1.00 25.00 H new ATOM 0 HB2 PHE A 809 -13.961 -5.739 5.035 1.00 25.00 H new ATOM 0 HB3 PHE A 809 -13.904 -4.388 6.150 1.00 25.00 H new ATOM 0 HD1 PHE A 809 -16.174 -6.623 4.226 1.00 25.00 H new ATOM 0 HD2 PHE A 809 -15.903 -3.549 7.219 1.00 25.00 H new ATOM 0 HE1 PHE A 809 -18.571 -6.976 4.796 1.00 25.00 H new ATOM 0 HE2 PHE A 809 -18.292 -3.901 7.809 1.00 25.00 H new ATOM 0 HZ PHE A 809 -19.641 -5.600 6.577 1.00 25.00 H new ATOM 1053 N GLN A 810 -15.113 -5.238 2.316 1.00 25.00 N ATOM 1054 CA GLN A 810 -14.983 -6.088 1.138 1.00 25.00 C ATOM 1055 C GLN A 810 -14.803 -5.236 -0.108 1.00 25.00 C ATOM 1056 O GLN A 810 -14.421 -5.724 -1.160 1.00 25.00 O ATOM 1057 CB GLN A 810 -16.216 -6.998 1.006 1.00 25.00 C ATOM 1058 CG GLN A 810 -17.505 -6.277 0.562 1.00 25.00 C ATOM 1059 CD GLN A 810 -18.703 -6.554 1.463 1.00 25.00 C ATOM 1060 OE1 GLN A 810 -19.581 -5.587 1.580 1.00 25.00 O flip ATOM 1061 NE2 GLN A 810 -18.826 -7.610 2.049 1.00 25.00 N flip ATOM 0 H GLN A 810 -16.065 -5.147 2.670 1.00 25.00 H new ATOM 0 HA GLN A 810 -14.101 -6.718 1.250 1.00 25.00 H new ATOM 0 HB2 GLN A 810 -15.992 -7.788 0.289 1.00 25.00 H new ATOM 0 HB3 GLN A 810 -16.398 -7.481 1.966 1.00 25.00 H new ATOM 0 HG2 GLN A 810 -17.320 -5.203 0.538 1.00 25.00 H new ATOM 0 HG3 GLN A 810 -17.749 -6.581 -0.456 1.00 25.00 H new ATOM 0 HE21 GLN A 810 -18.124 -8.341 1.935 1.00 25.00 H new ATOM 0 HE22 GLN A 810 -19.631 -7.766 2.655 1.00 25.00 H new ATOM 1070 N ALA A 811 -15.112 -3.956 0.030 1.00 25.00 N ATOM 1071 CA ALA A 811 -15.064 -3.028 -1.079 1.00 25.00 C ATOM 1072 C ALA A 811 -13.713 -2.359 -1.170 1.00 25.00 C ATOM 1073 O ALA A 811 -13.179 -2.143 -2.233 1.00 25.00 O ATOM 1074 CB ALA A 811 -16.105 -2.024 -0.891 1.00 25.00 C ATOM 0 H ALA A 811 -15.402 -3.536 0.913 1.00 25.00 H new ATOM 0 HA ALA A 811 -15.228 -3.573 -2.008 1.00 25.00 H new ATOM 0 HB1 ALA A 811 -16.082 -1.316 -1.720 1.00 25.00 H new ATOM 0 HB2 ALA A 811 -17.079 -2.512 -0.858 1.00 25.00 H new ATOM 0 HB3 ALA A 811 -15.933 -1.492 0.045 1.00 25.00 H new ATOM 1080 N PHE A 812 -13.174 -2.028 -0.012 1.00 25.00 N ATOM 1081 CA PHE A 812 -11.839 -1.412 0.065 1.00 25.00 C ATOM 1082 C PHE A 812 -10.771 -2.238 -0.650 1.00 25.00 C ATOM 1083 O PHE A 812 -9.802 -1.694 -1.177 1.00 25.00 O ATOM 1084 CB PHE A 812 -11.334 -1.273 1.487 1.00 25.00 C ATOM 1085 CG PHE A 812 -11.979 -0.231 2.264 1.00 25.00 C ATOM 1086 CD1 PHE A 812 -11.690 1.146 2.067 1.00 25.00 C ATOM 1087 CD2 PHE A 812 -12.883 -0.628 3.220 1.00 25.00 C ATOM 1088 CE1 PHE A 812 -12.363 2.135 2.822 1.00 25.00 C ATOM 1089 CE2 PHE A 812 -13.551 0.257 3.991 1.00 25.00 C ATOM 1090 CZ PHE A 812 -13.354 1.616 3.827 1.00 25.00 C ATOM 0 H PHE A 812 -13.628 -2.169 0.891 1.00 25.00 H new ATOM 0 HA PHE A 812 -11.980 -0.438 -0.404 1.00 25.00 H new ATOM 0 HB2 PHE A 812 -11.469 -2.225 2.000 1.00 25.00 H new ATOM 0 HB3 PHE A 812 -10.262 -1.075 1.459 1.00 25.00 H new ATOM 0 HD1 PHE A 812 -10.951 1.440 1.336 1.00 25.00 H new ATOM 0 HD2 PHE A 812 -13.065 -1.683 3.359 1.00 25.00 H new ATOM 0 HE1 PHE A 812 -12.178 3.190 2.686 1.00 25.00 H new ATOM 0 HE2 PHE A 812 -14.243 -0.099 4.740 1.00 25.00 H new ATOM 0 HZ PHE A 812 -13.919 2.313 4.428 1.00 25.00 H new ATOM 1100 N ILE A 813 -10.950 -3.554 -0.638 1.00 25.00 N ATOM 1101 CA ILE A 813 -9.978 -4.495 -1.212 1.00 25.00 C ATOM 1102 C ILE A 813 -9.734 -4.175 -2.673 1.00 25.00 C ATOM 1103 O ILE A 813 -8.630 -4.316 -3.184 1.00 25.00 O ATOM 1104 CB ILE A 813 -10.497 -5.953 -1.117 1.00 25.00 C ATOM 1105 CG1 ILE A 813 -10.856 -6.326 0.338 1.00 25.00 C ATOM 1106 CG2 ILE A 813 -9.463 -6.947 -1.696 1.00 25.00 C ATOM 1107 CD1 ILE A 813 -9.847 -5.873 1.440 1.00 25.00 C ATOM 0 H ILE A 813 -11.770 -4.005 -0.232 1.00 25.00 H new ATOM 0 HA ILE A 813 -9.053 -4.397 -0.644 1.00 25.00 H new ATOM 0 HB ILE A 813 -11.406 -6.019 -1.715 1.00 25.00 H new ATOM 0 HG12 ILE A 813 -11.831 -5.897 0.570 1.00 25.00 H new ATOM 0 HG13 ILE A 813 -10.962 -7.409 0.397 1.00 25.00 H new ATOM 0 HG21 ILE A 813 -9.851 -7.963 -1.617 1.00 25.00 H new ATOM 0 HG22 ILE A 813 -9.277 -6.710 -2.743 1.00 25.00 H new ATOM 0 HG23 ILE A 813 -8.531 -6.870 -1.136 1.00 25.00 H new ATOM 0 HD11 ILE A 813 -10.208 -6.192 2.418 1.00 25.00 H new ATOM 0 HD12 ILE A 813 -8.873 -6.323 1.248 1.00 25.00 H new ATOM 0 HD13 ILE A 813 -9.755 -4.787 1.425 1.00 25.00 H new ATOM 1119 N ASP A 814 -10.789 -3.729 -3.322 1.00 25.00 N ATOM 1120 CA ASP A 814 -10.740 -3.305 -4.719 1.00 25.00 C ATOM 1121 C ASP A 814 -9.531 -2.389 -4.954 1.00 25.00 C ATOM 1122 O ASP A 814 -8.715 -2.638 -5.843 1.00 25.00 O ATOM 1123 CB ASP A 814 -12.045 -2.583 -5.067 1.00 25.00 C ATOM 1124 CG ASP A 814 -12.338 -2.601 -6.562 1.00 25.00 C ATOM 1125 OD1 ASP A 814 -11.571 -1.983 -7.328 1.00 25.00 O ATOM 1126 OD2 ASP A 814 -13.330 -3.242 -6.968 1.00 25.00 O ATOM 0 H ASP A 814 -11.714 -3.647 -2.899 1.00 25.00 H new ATOM 0 HA ASP A 814 -10.630 -4.177 -5.364 1.00 25.00 H new ATOM 0 HB2 ASP A 814 -12.871 -3.052 -4.532 1.00 25.00 H new ATOM 0 HB3 ASP A 814 -11.989 -1.550 -4.723 1.00 25.00 H new ATOM 1131 N PHE A 815 -9.388 -1.355 -4.133 1.00 25.00 N ATOM 1132 CA PHE A 815 -8.229 -0.462 -4.257 1.00 25.00 C ATOM 1133 C PHE A 815 -6.946 -1.153 -3.792 1.00 25.00 C ATOM 1134 O PHE A 815 -5.914 -1.044 -4.424 1.00 25.00 O ATOM 1135 CB PHE A 815 -8.422 0.817 -3.445 1.00 25.00 C ATOM 1136 CG PHE A 815 -7.597 1.978 -3.949 1.00 25.00 C ATOM 1137 CD1 PHE A 815 -6.184 1.966 -3.873 1.00 25.00 C ATOM 1138 CD2 PHE A 815 -8.230 3.107 -4.501 1.00 25.00 C ATOM 1139 CE1 PHE A 815 -5.429 3.051 -4.368 1.00 25.00 C ATOM 1140 CE2 PHE A 815 -7.488 4.180 -4.980 1.00 25.00 C ATOM 1141 CZ PHE A 815 -6.091 4.157 -4.928 1.00 25.00 C ATOM 0 H PHE A 815 -10.041 -1.113 -3.388 1.00 25.00 H new ATOM 0 HA PHE A 815 -8.141 -0.207 -5.313 1.00 25.00 H new ATOM 0 HB2 PHE A 815 -9.476 1.095 -3.463 1.00 25.00 H new ATOM 0 HB3 PHE A 815 -8.162 0.621 -2.405 1.00 25.00 H new ATOM 0 HD1 PHE A 815 -5.679 1.119 -3.432 1.00 25.00 H new ATOM 0 HD2 PHE A 815 -9.308 3.140 -4.553 1.00 25.00 H new ATOM 0 HE1 PHE A 815 -4.350 3.031 -4.317 1.00 25.00 H new ATOM 0 HE2 PHE A 815 -7.995 5.038 -5.396 1.00 25.00 H new ATOM 0 HZ PHE A 815 -5.522 4.988 -5.318 1.00 25.00 H new ATOM 1151 N MET A 816 -7.017 -1.876 -2.688 1.00 25.00 N ATOM 1152 CA MET A 816 -5.857 -2.583 -2.141 1.00 25.00 C ATOM 1153 C MET A 816 -5.178 -3.526 -3.142 1.00 25.00 C ATOM 1154 O MET A 816 -3.984 -3.719 -3.111 1.00 25.00 O ATOM 1155 CB MET A 816 -6.326 -3.430 -0.979 1.00 25.00 C ATOM 1156 CG MET A 816 -5.441 -3.443 0.234 1.00 25.00 C ATOM 1157 SD MET A 816 -3.824 -4.061 -0.017 1.00 25.00 S ATOM 1158 CE MET A 816 -3.023 -2.701 0.385 1.00 25.00 C ATOM 0 H MET A 816 -7.872 -1.993 -2.144 1.00 25.00 H new ATOM 0 HA MET A 816 -5.131 -1.821 -1.857 1.00 25.00 H new ATOM 0 HB2 MET A 816 -7.314 -3.081 -0.678 1.00 25.00 H new ATOM 0 HB3 MET A 816 -6.443 -4.456 -1.328 1.00 25.00 H new ATOM 0 HG2 MET A 816 -5.366 -2.426 0.618 1.00 25.00 H new ATOM 0 HG3 MET A 816 -5.923 -4.041 1.007 1.00 25.00 H new ATOM 0 HE1 MET A 816 -2.010 -2.744 -0.015 1.00 25.00 H new ATOM 0 HE2 MET A 816 -3.541 -1.837 -0.031 1.00 25.00 H new ATOM 0 HE3 MET A 816 -2.981 -2.611 1.470 1.00 25.00 H new ATOM 1168 N SER A 817 -5.927 -4.137 -4.040 1.00 25.00 N ATOM 1169 CA SER A 817 -5.299 -5.028 -5.010 1.00 25.00 C ATOM 1170 C SER A 817 -4.662 -4.215 -6.141 1.00 25.00 C ATOM 1171 O SER A 817 -3.782 -4.706 -6.851 1.00 25.00 O ATOM 1172 CB SER A 817 -6.278 -6.070 -5.535 1.00 25.00 C ATOM 1173 OG SER A 817 -5.625 -6.968 -6.421 1.00 25.00 O ATOM 0 H SER A 817 -6.939 -4.042 -4.123 1.00 25.00 H new ATOM 0 HA SER A 817 -4.506 -5.580 -4.505 1.00 25.00 H new ATOM 0 HB2 SER A 817 -6.710 -6.623 -4.701 1.00 25.00 H new ATOM 0 HB3 SER A 817 -7.101 -5.576 -6.051 1.00 25.00 H new ATOM 0 HG SER A 817 -4.859 -6.519 -6.836 1.00 25.00 H new ATOM 1179 N ARG A 818 -5.098 -2.972 -6.304 1.00 25.00 N ATOM 1180 CA ARG A 818 -4.515 -2.063 -7.307 1.00 25.00 C ATOM 1181 C ARG A 818 -3.199 -1.481 -6.792 1.00 25.00 C ATOM 1182 O ARG A 818 -2.371 -1.055 -7.581 1.00 25.00 O ATOM 1183 CB ARG A 818 -5.465 -0.898 -7.634 1.00 25.00 C ATOM 1184 CG ARG A 818 -6.758 -1.283 -8.357 1.00 25.00 C ATOM 1185 CD ARG A 818 -6.520 -1.788 -9.783 1.00 25.00 C ATOM 1186 NE ARG A 818 -5.745 -0.818 -10.587 1.00 25.00 N ATOM 1187 CZ ARG A 818 -4.479 -0.965 -10.978 1.00 25.00 C ATOM 1188 NH1 ARG A 818 -3.772 -2.037 -10.712 1.00 25.00 N ATOM 1189 NH2 ARG A 818 -3.910 -0.004 -11.648 1.00 25.00 N ATOM 0 H ARG A 818 -5.855 -2.561 -5.757 1.00 25.00 H new ATOM 0 HA ARG A 818 -4.344 -2.648 -8.211 1.00 25.00 H new ATOM 0 HB2 ARG A 818 -5.726 -0.394 -6.704 1.00 25.00 H new ATOM 0 HB3 ARG A 818 -4.927 -0.176 -8.248 1.00 25.00 H new ATOM 0 HG2 ARG A 818 -7.271 -2.056 -7.785 1.00 25.00 H new ATOM 0 HG3 ARG A 818 -7.421 -0.418 -8.390 1.00 25.00 H new ATOM 0 HD2 ARG A 818 -5.988 -2.739 -9.748 1.00 25.00 H new ATOM 0 HD3 ARG A 818 -7.478 -1.977 -10.266 1.00 25.00 H new ATOM 0 HE ARG A 818 -6.221 0.039 -10.867 1.00 25.00 H new ATOM 0 HH11 ARG A 818 -4.188 -2.804 -10.184 1.00 25.00 H new ATOM 0 HH12 ARG A 818 -2.806 -2.103 -11.033 1.00 25.00 H new ATOM 0 HH21 ARG A 818 -4.432 0.845 -11.866 1.00 25.00 H new ATOM 0 HH22 ARG A 818 -2.942 -0.100 -11.955 1.00 25.00 H new ATOM 1203 N GLU A 819 -3.034 -1.497 -5.476 1.00 25.00 N ATOM 1204 CA GLU A 819 -1.829 -1.017 -4.761 1.00 25.00 C ATOM 1205 C GLU A 819 -0.550 -1.788 -5.146 1.00 25.00 C ATOM 1206 O GLU A 819 0.555 -1.468 -4.735 1.00 25.00 O ATOM 1207 CB GLU A 819 -2.115 -1.172 -3.263 1.00 25.00 C ATOM 1208 CG GLU A 819 -1.051 -0.711 -2.306 1.00 25.00 C ATOM 1209 CD GLU A 819 -1.615 -0.215 -0.985 1.00 25.00 C ATOM 1210 OE1 GLU A 819 -2.773 0.266 -0.955 1.00 25.00 O ATOM 1211 OE2 GLU A 819 -0.907 -0.340 0.037 1.00 25.00 O ATOM 0 H GLU A 819 -3.751 -1.854 -4.844 1.00 25.00 H new ATOM 0 HA GLU A 819 -1.637 0.020 -5.036 1.00 25.00 H new ATOM 0 HB2 GLU A 819 -3.031 -0.627 -3.037 1.00 25.00 H new ATOM 0 HB3 GLU A 819 -2.313 -2.225 -3.065 1.00 25.00 H new ATOM 0 HG2 GLU A 819 -0.361 -1.533 -2.114 1.00 25.00 H new ATOM 0 HG3 GLU A 819 -0.473 0.088 -2.771 1.00 25.00 H new ATOM 1218 N THR A 820 -0.712 -2.813 -5.962 1.00 25.00 N ATOM 1219 CA THR A 820 0.417 -3.583 -6.460 1.00 25.00 C ATOM 1220 C THR A 820 1.144 -2.802 -7.566 1.00 25.00 C ATOM 1221 O THR A 820 2.217 -3.203 -8.023 1.00 25.00 O ATOM 1222 CB THR A 820 -0.068 -4.945 -6.957 1.00 25.00 C ATOM 1223 OG1 THR A 820 -1.121 -4.762 -7.913 1.00 25.00 O ATOM 1224 CG2 THR A 820 -0.631 -5.745 -5.783 1.00 25.00 C ATOM 0 H THR A 820 -1.620 -3.135 -6.297 1.00 25.00 H new ATOM 0 HA THR A 820 1.130 -3.752 -5.653 1.00 25.00 H new ATOM 0 HB THR A 820 0.770 -5.473 -7.412 1.00 25.00 H new ATOM 0 HG1 THR A 820 -1.984 -4.743 -7.449 1.00 25.00 H new ATOM 0 HG21 THR A 820 -0.977 -6.716 -6.137 1.00 25.00 H new ATOM 0 HG22 THR A 820 0.147 -5.888 -5.034 1.00 25.00 H new ATOM 0 HG23 THR A 820 -1.466 -5.202 -5.340 1.00 25.00 H new ATOM 1232 N ALA A 821 0.566 -1.674 -7.963 1.00 25.00 N ATOM 1233 CA ALA A 821 1.203 -0.737 -8.879 1.00 25.00 C ATOM 1234 C ALA A 821 1.645 0.422 -7.986 1.00 25.00 C ATOM 1235 O ALA A 821 0.995 0.708 -6.988 1.00 25.00 O ATOM 1236 CB ALA A 821 0.222 -0.259 -9.944 1.00 25.00 C ATOM 0 H ALA A 821 -0.362 -1.383 -7.657 1.00 25.00 H new ATOM 0 HA ALA A 821 2.035 -1.188 -9.420 1.00 25.00 H new ATOM 0 HB1 ALA A 821 0.724 0.439 -10.614 1.00 25.00 H new ATOM 0 HB2 ALA A 821 -0.140 -1.114 -10.515 1.00 25.00 H new ATOM 0 HB3 ALA A 821 -0.620 0.240 -9.465 1.00 25.00 H new ATOM 1242 N ASP A 822 2.740 1.066 -8.340 1.00 25.00 N ATOM 1243 CA ASP A 822 3.316 2.124 -7.516 1.00 25.00 C ATOM 1244 C ASP A 822 2.771 3.515 -7.840 1.00 25.00 C ATOM 1245 O ASP A 822 2.259 3.764 -8.933 1.00 25.00 O ATOM 1246 CB ASP A 822 4.845 2.084 -7.631 1.00 25.00 C ATOM 1247 CG ASP A 822 5.362 2.299 -9.053 1.00 25.00 C ATOM 1248 OD1 ASP A 822 4.877 1.639 -10.006 1.00 25.00 O ATOM 1249 OD2 ASP A 822 6.302 3.091 -9.211 1.00 25.00 O ATOM 0 H ASP A 822 3.256 0.877 -9.199 1.00 25.00 H new ATOM 0 HA ASP A 822 3.019 1.932 -6.485 1.00 25.00 H new ATOM 0 HB2 ASP A 822 5.269 2.849 -6.981 1.00 25.00 H new ATOM 0 HB3 ASP A 822 5.203 1.121 -7.266 1.00 25.00 H new ATOM 1254 N THR A 823 2.876 4.406 -6.859 1.00 25.00 N ATOM 1255 CA THR A 823 2.345 5.766 -6.956 1.00 25.00 C ATOM 1256 C THR A 823 3.274 6.774 -6.289 1.00 25.00 C ATOM 1257 O THR A 823 4.121 6.395 -5.490 1.00 25.00 O ATOM 1258 CB THR A 823 0.989 5.881 -6.216 1.00 25.00 C ATOM 1259 OG1 THR A 823 0.395 4.589 -6.074 1.00 25.00 O ATOM 1260 CG2 THR A 823 0.033 6.776 -6.970 1.00 25.00 C ATOM 0 H THR A 823 3.333 4.206 -5.969 1.00 25.00 H new ATOM 0 HA THR A 823 2.240 5.976 -8.020 1.00 25.00 H new ATOM 0 HB THR A 823 1.183 6.313 -5.234 1.00 25.00 H new ATOM 0 HG1 THR A 823 -0.197 4.585 -5.293 1.00 25.00 H new ATOM 0 HG21 THR A 823 -0.911 6.839 -6.428 1.00 25.00 H new ATOM 0 HG22 THR A 823 0.465 7.772 -7.064 1.00 25.00 H new ATOM 0 HG23 THR A 823 -0.146 6.363 -7.963 1.00 25.00 H new ATOM 1268 N ASP A 824 3.095 8.058 -6.582 1.00 25.00 N ATOM 1269 CA ASP A 824 3.877 9.123 -5.935 1.00 25.00 C ATOM 1270 C ASP A 824 3.673 9.066 -4.420 1.00 25.00 C ATOM 1271 O ASP A 824 4.581 9.276 -3.621 1.00 25.00 O ATOM 1272 CB ASP A 824 3.412 10.516 -6.402 1.00 25.00 C ATOM 1273 CG ASP A 824 3.809 10.838 -7.837 1.00 25.00 C ATOM 1274 OD1 ASP A 824 4.317 9.954 -8.553 1.00 25.00 O ATOM 1275 OD2 ASP A 824 3.595 12.001 -8.247 1.00 25.00 O ATOM 0 H ASP A 824 2.415 8.394 -7.264 1.00 25.00 H new ATOM 0 HA ASP A 824 4.922 8.969 -6.203 1.00 25.00 H new ATOM 0 HB2 ASP A 824 2.328 10.578 -6.310 1.00 25.00 H new ATOM 0 HB3 ASP A 824 3.832 11.272 -5.739 1.00 25.00 H new ATOM 1280 N THR A 825 2.442 8.781 -4.038 1.00 25.00 N ATOM 1281 CA THR A 825 2.031 8.708 -2.643 1.00 25.00 C ATOM 1282 C THR A 825 2.517 7.428 -1.969 1.00 25.00 C ATOM 1283 O THR A 825 2.542 7.339 -0.741 1.00 25.00 O ATOM 1284 CB THR A 825 0.517 8.734 -2.579 1.00 25.00 C ATOM 1285 OG1 THR A 825 0.023 7.879 -3.607 1.00 25.00 O ATOM 1286 CG2 THR A 825 -0.024 10.113 -2.821 1.00 25.00 C ATOM 0 H THR A 825 1.686 8.590 -4.696 1.00 25.00 H new ATOM 0 HA THR A 825 2.470 9.558 -2.121 1.00 25.00 H new ATOM 0 HB THR A 825 0.204 8.410 -1.587 1.00 25.00 H new ATOM 0 HG1 THR A 825 -0.926 8.067 -3.761 1.00 25.00 H new ATOM 0 HG21 THR A 825 -1.112 10.091 -2.767 1.00 25.00 H new ATOM 0 HG22 THR A 825 0.363 10.794 -2.063 1.00 25.00 H new ATOM 0 HG23 THR A 825 0.284 10.456 -3.809 1.00 25.00 H new ATOM 1294 N ALA A 826 2.886 6.434 -2.763 1.00 25.00 N ATOM 1295 CA ALA A 826 3.340 5.151 -2.237 1.00 25.00 C ATOM 1296 C ALA A 826 4.712 5.293 -1.553 1.00 25.00 C ATOM 1297 O ALA A 826 5.092 4.467 -0.737 1.00 25.00 O ATOM 1298 CB ALA A 826 3.390 4.117 -3.369 1.00 25.00 C ATOM 0 H ALA A 826 2.880 6.490 -3.781 1.00 25.00 H new ATOM 0 HA ALA A 826 2.633 4.808 -1.482 1.00 25.00 H new ATOM 0 HB1 ALA A 826 3.729 3.160 -2.973 1.00 25.00 H new ATOM 0 HB2 ALA A 826 2.395 4.000 -3.799 1.00 25.00 H new ATOM 0 HB3 ALA A 826 4.081 4.456 -4.141 1.00 25.00 H new ATOM 1304 N ASP A 827 5.433 6.360 -1.867 1.00 25.00 N ATOM 1305 CA ASP A 827 6.721 6.645 -1.215 1.00 25.00 C ATOM 1306 C ASP A 827 6.470 6.779 0.300 1.00 25.00 C ATOM 1307 O ASP A 827 7.247 6.328 1.137 1.00 25.00 O ATOM 1308 CB ASP A 827 7.283 7.957 -1.795 1.00 25.00 C ATOM 1309 CG ASP A 827 8.761 8.186 -1.464 1.00 25.00 C ATOM 1310 OD1 ASP A 827 9.202 7.893 -0.338 1.00 25.00 O ATOM 1311 OD2 ASP A 827 9.482 8.683 -2.359 1.00 25.00 O ATOM 0 H ASP A 827 5.156 7.047 -2.568 1.00 25.00 H new ATOM 0 HA ASP A 827 7.442 5.847 -1.390 1.00 25.00 H new ATOM 0 HB2 ASP A 827 7.158 7.950 -2.878 1.00 25.00 H new ATOM 0 HB3 ASP A 827 6.699 8.794 -1.412 1.00 25.00 H new ATOM 1316 N GLN A 828 5.345 7.391 0.644 1.00 25.00 N ATOM 1317 CA GLN A 828 5.005 7.638 2.043 1.00 25.00 C ATOM 1318 C GLN A 828 4.785 6.361 2.842 1.00 25.00 C ATOM 1319 O GLN A 828 5.179 6.277 4.005 1.00 25.00 O ATOM 1320 CB GLN A 828 3.702 8.429 2.147 1.00 25.00 C ATOM 1321 CG GLN A 828 3.610 9.678 1.284 1.00 25.00 C ATOM 1322 CD GLN A 828 2.227 10.288 1.364 1.00 25.00 C ATOM 1323 OE1 GLN A 828 2.060 11.452 1.696 1.00 25.00 O ATOM 1324 NE2 GLN A 828 1.228 9.494 1.070 1.00 25.00 N ATOM 0 H GLN A 828 4.651 7.726 -0.024 1.00 25.00 H new ATOM 0 HA GLN A 828 5.856 8.184 2.449 1.00 25.00 H new ATOM 0 HB2 GLN A 828 2.877 7.768 1.883 1.00 25.00 H new ATOM 0 HB3 GLN A 828 3.558 8.719 3.188 1.00 25.00 H new ATOM 0 HG2 GLN A 828 4.353 10.406 1.610 1.00 25.00 H new ATOM 0 HG3 GLN A 828 3.842 9.428 0.249 1.00 25.00 H new ATOM 0 HE21 GLN A 828 1.408 8.528 0.797 1.00 25.00 H new ATOM 0 HE22 GLN A 828 0.270 9.842 1.114 1.00 25.00 H new ATOM 1333 N VAL A 829 4.130 5.376 2.241 1.00 25.00 N ATOM 1334 CA VAL A 829 3.795 4.156 2.974 1.00 25.00 C ATOM 1335 C VAL A 829 5.064 3.315 3.178 1.00 25.00 C ATOM 1336 O VAL A 829 5.202 2.610 4.180 1.00 25.00 O ATOM 1337 CB VAL A 829 2.610 3.353 2.304 1.00 25.00 C ATOM 1338 CG1 VAL A 829 2.889 3.005 0.863 1.00 25.00 C ATOM 1339 CG2 VAL A 829 2.298 2.089 3.078 1.00 25.00 C ATOM 0 H VAL A 829 3.824 5.393 1.268 1.00 25.00 H new ATOM 0 HA VAL A 829 3.416 4.431 3.958 1.00 25.00 H new ATOM 0 HB VAL A 829 1.744 4.015 2.328 1.00 25.00 H new ATOM 0 HG11 VAL A 829 2.043 2.454 0.451 1.00 25.00 H new ATOM 0 HG12 VAL A 829 3.039 3.920 0.290 1.00 25.00 H new ATOM 0 HG13 VAL A 829 3.786 2.389 0.805 1.00 25.00 H new ATOM 0 HG21 VAL A 829 1.479 1.558 2.593 1.00 25.00 H new ATOM 0 HG22 VAL A 829 3.181 1.450 3.102 1.00 25.00 H new ATOM 0 HG23 VAL A 829 2.010 2.348 4.097 1.00 25.00 H new ATOM 1349 N MET A 830 6.011 3.422 2.252 1.00 25.00 N ATOM 1350 CA MET A 830 7.278 2.689 2.344 1.00 25.00 C ATOM 1351 C MET A 830 8.123 3.128 3.552 1.00 25.00 C ATOM 1352 O MET A 830 9.114 2.484 3.897 1.00 25.00 O ATOM 1353 CB MET A 830 8.084 2.877 1.056 1.00 25.00 C ATOM 1354 CG MET A 830 7.470 2.187 -0.165 1.00 25.00 C ATOM 1355 SD MET A 830 8.410 2.487 -1.693 1.00 25.00 S ATOM 1356 CE MET A 830 9.911 1.512 -1.445 1.00 25.00 C ATOM 0 H MET A 830 5.928 4.011 1.424 1.00 25.00 H new ATOM 0 HA MET A 830 7.032 1.636 2.482 1.00 25.00 H new ATOM 0 HB2 MET A 830 8.178 3.943 0.850 1.00 25.00 H new ATOM 0 HB3 MET A 830 9.092 2.492 1.210 1.00 25.00 H new ATOM 0 HG2 MET A 830 7.417 1.114 0.019 1.00 25.00 H new ATOM 0 HG3 MET A 830 6.447 2.538 -0.299 1.00 25.00 H new ATOM 0 HE1 MET A 830 10.545 1.589 -2.328 1.00 25.00 H new ATOM 0 HE2 MET A 830 10.451 1.890 -0.577 1.00 25.00 H new ATOM 0 HE3 MET A 830 9.644 0.468 -1.280 1.00 25.00 H new ATOM 1366 N ALA A 831 7.726 4.204 4.218 1.00 25.00 N ATOM 1367 CA ALA A 831 8.421 4.659 5.421 1.00 25.00 C ATOM 1368 C ALA A 831 8.373 3.591 6.535 1.00 25.00 C ATOM 1369 O ALA A 831 9.212 3.601 7.447 1.00 25.00 O ATOM 1370 CB ALA A 831 7.802 5.970 5.912 1.00 25.00 C ATOM 0 H ALA A 831 6.928 4.779 3.948 1.00 25.00 H new ATOM 0 HA ALA A 831 9.468 4.827 5.169 1.00 25.00 H new ATOM 0 HB1 ALA A 831 8.323 6.305 6.809 1.00 25.00 H new ATOM 0 HB2 ALA A 831 7.893 6.729 5.135 1.00 25.00 H new ATOM 0 HB3 ALA A 831 6.749 5.811 6.143 1.00 25.00 H new ATOM 1376 N SER A 832 7.417 2.668 6.456 1.00 25.00 N ATOM 1377 CA SER A 832 7.286 1.581 7.437 1.00 25.00 C ATOM 1378 C SER A 832 8.546 0.731 7.486 1.00 25.00 C ATOM 1379 O SER A 832 8.865 0.119 8.504 1.00 25.00 O ATOM 1380 CB SER A 832 6.116 0.670 7.052 1.00 25.00 C ATOM 1381 OG SER A 832 6.339 0.105 5.773 1.00 25.00 O ATOM 0 H SER A 832 6.714 2.648 5.718 1.00 25.00 H new ATOM 0 HA SER A 832 7.117 2.037 8.413 1.00 25.00 H new ATOM 0 HB2 SER A 832 6.002 -0.121 7.793 1.00 25.00 H new ATOM 0 HB3 SER A 832 5.187 1.240 7.049 1.00 25.00 H new ATOM 0 HG SER A 832 6.117 -0.849 5.794 1.00 25.00 H new ATOM 1387 N PHE A 833 9.280 0.699 6.390 1.00 25.00 N ATOM 1388 CA PHE A 833 10.479 -0.112 6.307 1.00 25.00 C ATOM 1389 C PHE A 833 11.577 0.379 7.259 1.00 25.00 C ATOM 1390 O PHE A 833 12.437 -0.396 7.669 1.00 25.00 O ATOM 1391 CB PHE A 833 10.941 -0.170 4.863 1.00 25.00 C ATOM 1392 CG PHE A 833 9.859 -0.620 3.898 1.00 25.00 C ATOM 1393 CD1 PHE A 833 8.795 -1.469 4.308 1.00 25.00 C ATOM 1394 CD2 PHE A 833 9.890 -0.188 2.564 1.00 25.00 C ATOM 1395 CE1 PHE A 833 7.797 -1.863 3.398 1.00 25.00 C ATOM 1396 CE2 PHE A 833 8.889 -0.592 1.652 1.00 25.00 C ATOM 1397 CZ PHE A 833 7.842 -1.425 2.079 1.00 25.00 C ATOM 0 H PHE A 833 9.066 1.226 5.544 1.00 25.00 H new ATOM 0 HA PHE A 833 10.246 -1.125 6.637 1.00 25.00 H new ATOM 0 HB2 PHE A 833 11.296 0.816 4.564 1.00 25.00 H new ATOM 0 HB3 PHE A 833 11.789 -0.851 4.788 1.00 25.00 H new ATOM 0 HD1 PHE A 833 8.752 -1.816 5.330 1.00 25.00 H new ATOM 0 HD2 PHE A 833 10.687 0.460 2.230 1.00 25.00 H new ATOM 0 HE1 PHE A 833 6.994 -2.507 3.725 1.00 25.00 H new ATOM 0 HE2 PHE A 833 8.929 -0.260 0.625 1.00 25.00 H new ATOM 0 HZ PHE A 833 7.072 -1.725 1.383 1.00 25.00 H new ATOM 1407 N LYS A 834 11.548 1.649 7.656 1.00 25.00 N ATOM 1408 CA LYS A 834 12.518 2.128 8.649 1.00 25.00 C ATOM 1409 C LYS A 834 12.151 1.554 10.011 1.00 25.00 C ATOM 1410 O LYS A 834 13.028 1.213 10.804 1.00 25.00 O ATOM 1411 CB LYS A 834 12.547 3.666 8.725 1.00 25.00 C ATOM 1412 CG LYS A 834 13.465 4.236 9.848 1.00 25.00 C ATOM 1413 CD LYS A 834 14.920 3.912 9.661 1.00 25.00 C ATOM 1414 CE LYS A 834 15.472 3.547 11.000 1.00 25.00 C ATOM 1415 NZ LYS A 834 16.829 2.908 10.918 1.00 25.00 N ATOM 0 H LYS A 834 10.887 2.350 7.320 1.00 25.00 H new ATOM 0 HA LYS A 834 13.511 1.795 8.348 1.00 25.00 H new ATOM 0 HB2 LYS A 834 12.881 4.059 7.765 1.00 25.00 H new ATOM 0 HB3 LYS A 834 11.532 4.029 8.883 1.00 25.00 H new ATOM 0 HG2 LYS A 834 13.345 5.319 9.888 1.00 25.00 H new ATOM 0 HG3 LYS A 834 13.135 3.843 10.809 1.00 25.00 H new ATOM 0 HD2 LYS A 834 15.042 3.088 8.958 1.00 25.00 H new ATOM 0 HD3 LYS A 834 15.453 4.767 9.246 1.00 25.00 H new ATOM 0 HE2 LYS A 834 15.534 4.443 11.618 1.00 25.00 H new ATOM 0 HE3 LYS A 834 14.784 2.864 11.497 1.00 25.00 H new ATOM 0 HZ1 LYS A 834 16.882 2.117 11.592 1.00 25.00 H new ATOM 0 HZ2 LYS A 834 16.988 2.552 9.954 1.00 25.00 H new ATOM 0 HZ3 LYS A 834 17.559 3.611 11.152 1.00 25.00 H new ATOM 1429 N ILE A 835 10.858 1.441 10.275 1.00 25.00 N ATOM 1430 CA ILE A 835 10.372 0.914 11.550 1.00 25.00 C ATOM 1431 C ILE A 835 10.788 -0.549 11.649 1.00 25.00 C ATOM 1432 O ILE A 835 11.245 -1.002 12.695 1.00 25.00 O ATOM 1433 CB ILE A 835 8.814 1.054 11.684 1.00 25.00 C ATOM 1434 CG1 ILE A 835 8.437 2.526 11.942 1.00 25.00 C ATOM 1435 CG2 ILE A 835 8.276 0.171 12.826 1.00 25.00 C ATOM 1436 CD1 ILE A 835 8.138 3.340 10.697 1.00 25.00 C ATOM 0 H ILE A 835 10.120 1.707 9.623 1.00 25.00 H new ATOM 0 HA ILE A 835 10.809 1.491 12.365 1.00 25.00 H new ATOM 0 HB ILE A 835 8.362 0.722 10.750 1.00 25.00 H new ATOM 0 HG12 ILE A 835 7.564 2.553 12.593 1.00 25.00 H new ATOM 0 HG13 ILE A 835 9.253 3.005 12.483 1.00 25.00 H new ATOM 0 HG21 ILE A 835 7.195 0.287 12.897 1.00 25.00 H new ATOM 0 HG22 ILE A 835 8.517 -0.873 12.623 1.00 25.00 H new ATOM 0 HG23 ILE A 835 8.736 0.473 13.767 1.00 25.00 H new ATOM 0 HD11 ILE A 835 7.883 4.361 10.982 1.00 25.00 H new ATOM 0 HD12 ILE A 835 9.016 3.352 10.051 1.00 25.00 H new ATOM 0 HD13 ILE A 835 7.300 2.893 10.163 1.00 25.00 H new ATOM 1448 N LEU A 836 10.645 -1.275 10.549 1.00 25.00 N ATOM 1449 CA LEU A 836 11.041 -2.679 10.496 1.00 25.00 C ATOM 1450 C LEU A 836 12.531 -2.851 10.757 1.00 25.00 C ATOM 1451 O LEU A 836 12.936 -3.715 11.524 1.00 25.00 O ATOM 1452 CB LEU A 836 10.777 -3.233 9.109 1.00 25.00 C ATOM 1453 CG LEU A 836 9.401 -3.725 8.692 1.00 25.00 C ATOM 1454 CD1 LEU A 836 9.475 -4.005 7.202 1.00 25.00 C ATOM 1455 CD2 LEU A 836 9.024 -4.999 9.433 1.00 25.00 C ATOM 0 H LEU A 836 10.256 -0.915 9.677 1.00 25.00 H new ATOM 0 HA LEU A 836 10.465 -3.201 11.260 1.00 25.00 H new ATOM 0 HB2 LEU A 836 11.063 -2.456 8.400 1.00 25.00 H new ATOM 0 HB3 LEU A 836 11.466 -4.065 8.965 1.00 25.00 H new ATOM 0 HG LEU A 836 8.644 -2.977 8.928 1.00 25.00 H new ATOM 0 HD11 LEU A 836 8.507 -4.363 6.851 1.00 25.00 H new ATOM 0 HD12 LEU A 836 9.737 -3.089 6.672 1.00 25.00 H new ATOM 0 HD13 LEU A 836 10.234 -4.764 7.012 1.00 25.00 H new ATOM 0 HD21 LEU A 836 8.035 -5.327 9.114 1.00 25.00 H new ATOM 0 HD22 LEU A 836 9.753 -5.778 9.211 1.00 25.00 H new ATOM 0 HD23 LEU A 836 9.014 -4.806 10.506 1.00 25.00 H new ATOM 1467 N ALA A 837 13.341 -2.033 10.093 1.00 25.00 N ATOM 1468 CA ALA A 837 14.791 -2.120 10.223 1.00 25.00 C ATOM 1469 C ALA A 837 15.211 -1.790 11.665 1.00 25.00 C ATOM 1470 O ALA A 837 16.048 -2.457 12.260 1.00 25.00 O ATOM 1471 CB ALA A 837 15.466 -1.133 9.226 1.00 25.00 C ATOM 0 H ALA A 837 13.018 -1.302 9.459 1.00 25.00 H new ATOM 0 HA ALA A 837 15.112 -3.135 9.990 1.00 25.00 H new ATOM 0 HB1 ALA A 837 16.549 -1.200 9.325 1.00 25.00 H new ATOM 0 HB2 ALA A 837 15.178 -1.392 8.207 1.00 25.00 H new ATOM 0 HB3 ALA A 837 15.144 -0.115 9.447 1.00 25.00 H new ATOM 1477 N GLY A 838 14.630 -0.740 12.219 1.00 25.00 N ATOM 1478 CA GLY A 838 14.997 -0.308 13.556 1.00 25.00 C ATOM 1479 C GLY A 838 16.311 0.455 13.561 1.00 25.00 C ATOM 1480 O GLY A 838 16.313 1.682 13.463 1.00 25.00 O ATOM 0 H GLY A 838 13.909 -0.176 11.769 1.00 25.00 H new ATOM 0 HA2 GLY A 838 14.208 0.324 13.963 1.00 25.00 H new ATOM 0 HA3 GLY A 838 15.078 -1.177 14.209 1.00 25.00 H new ATOM 1484 N ASP A 839 17.427 -0.249 13.683 1.00 25.00 N ATOM 1485 CA ASP A 839 18.752 0.381 13.761 1.00 25.00 C ATOM 1486 C ASP A 839 19.661 0.054 12.576 1.00 25.00 C ATOM 1487 O ASP A 839 20.666 0.725 12.353 1.00 25.00 O ATOM 1488 CB ASP A 839 19.459 -0.059 15.050 1.00 25.00 C ATOM 1489 CG ASP A 839 19.905 -1.519 15.008 1.00 25.00 C ATOM 1490 OD1 ASP A 839 19.110 -2.383 14.570 1.00 25.00 O ATOM 1491 OD2 ASP A 839 21.046 -1.801 15.425 1.00 25.00 O ATOM 0 H ASP A 839 17.448 -1.268 13.731 1.00 25.00 H new ATOM 0 HA ASP A 839 18.574 1.456 13.747 1.00 25.00 H new ATOM 0 HB2 ASP A 839 20.328 0.577 15.219 1.00 25.00 H new ATOM 0 HB3 ASP A 839 18.788 0.087 15.896 1.00 25.00 H new ATOM 1496 N LYS A 840 19.321 -0.983 11.826 1.00 25.00 N ATOM 1497 CA LYS A 840 20.189 -1.467 10.755 1.00 25.00 C ATOM 1498 C LYS A 840 20.111 -0.551 9.541 1.00 25.00 C ATOM 1499 O LYS A 840 19.116 0.145 9.332 1.00 25.00 O ATOM 1500 CB LYS A 840 19.833 -2.918 10.416 1.00 25.00 C ATOM 1501 CG LYS A 840 18.375 -3.123 10.116 1.00 25.00 C ATOM 1502 CD LYS A 840 17.930 -4.563 10.250 1.00 25.00 C ATOM 1503 CE LYS A 840 18.340 -5.431 9.076 1.00 25.00 C ATOM 1504 NZ LYS A 840 17.785 -6.804 9.267 1.00 25.00 N ATOM 0 H LYS A 840 18.453 -1.507 11.936 1.00 25.00 H new ATOM 0 HA LYS A 840 21.225 -1.450 11.092 1.00 25.00 H new ATOM 0 HB2 LYS A 840 20.421 -3.236 9.555 1.00 25.00 H new ATOM 0 HB3 LYS A 840 20.118 -3.558 11.251 1.00 25.00 H new ATOM 0 HG2 LYS A 840 17.783 -2.503 10.789 1.00 25.00 H new ATOM 0 HG3 LYS A 840 18.169 -2.780 9.102 1.00 25.00 H new ATOM 0 HD2 LYS A 840 18.349 -4.981 11.165 1.00 25.00 H new ATOM 0 HD3 LYS A 840 16.845 -4.592 10.353 1.00 25.00 H new ATOM 0 HE2 LYS A 840 17.971 -5.002 8.144 1.00 25.00 H new ATOM 0 HE3 LYS A 840 19.427 -5.472 9.000 1.00 25.00 H new ATOM 0 HZ1 LYS A 840 18.554 -7.501 9.201 1.00 25.00 H new ATOM 0 HZ2 LYS A 840 17.337 -6.870 10.203 1.00 25.00 H new ATOM 0 HZ3 LYS A 840 17.077 -6.998 8.530 1.00 25.00 H new ATOM 1518 N ASN A 841 21.175 -0.541 8.751 1.00 25.00 N ATOM 1519 CA ASN A 841 21.278 0.352 7.590 1.00 25.00 C ATOM 1520 C ASN A 841 20.548 -0.157 6.349 1.00 25.00 C ATOM 1521 O ASN A 841 20.485 0.541 5.350 1.00 25.00 O ATOM 1522 CB ASN A 841 22.760 0.590 7.241 1.00 25.00 C ATOM 1523 CG ASN A 841 23.437 -0.627 6.740 1.00 25.00 C ATOM 1524 OD1 ASN A 841 23.199 -1.137 5.670 1.00 25.00 O ATOM 1525 ND2 ASN A 841 24.299 -1.100 7.553 1.00 25.00 N ATOM 0 H ASN A 841 21.987 -1.142 8.888 1.00 25.00 H new ATOM 0 HA ASN A 841 20.790 1.281 7.883 1.00 25.00 H new ATOM 0 HB2 ASN A 841 22.829 1.374 6.487 1.00 25.00 H new ATOM 0 HB3 ASN A 841 23.283 0.952 8.126 1.00 25.00 H new ATOM 0 HD21 ASN A 841 24.820 -1.942 7.310 1.00 25.00 H new ATOM 0 HD22 ASN A 841 24.467 -0.636 8.446 1.00 25.00 H new ATOM 1532 N TYR A 842 20.006 -1.364 6.408 1.00 25.00 N ATOM 1533 CA TYR A 842 19.360 -1.961 5.243 1.00 25.00 C ATOM 1534 C TYR A 842 18.227 -2.818 5.743 1.00 25.00 C ATOM 1535 O TYR A 842 18.194 -3.139 6.909 1.00 25.00 O ATOM 1536 CB TYR A 842 20.362 -2.820 4.456 1.00 25.00 C ATOM 1537 CG TYR A 842 20.765 -4.116 5.149 1.00 25.00 C ATOM 1538 CD1 TYR A 842 19.985 -5.283 5.008 1.00 25.00 C ATOM 1539 CD2 TYR A 842 21.931 -4.188 5.937 1.00 25.00 C ATOM 1540 CE1 TYR A 842 20.365 -6.499 5.628 1.00 25.00 C ATOM 1541 CE2 TYR A 842 22.314 -5.398 6.564 1.00 25.00 C ATOM 1542 CZ TYR A 842 21.534 -6.541 6.404 1.00 25.00 C ATOM 1543 OH TYR A 842 21.939 -7.699 7.009 1.00 25.00 O ATOM 0 H TYR A 842 19.999 -1.949 7.244 1.00 25.00 H new ATOM 0 HA TYR A 842 18.990 -1.183 4.575 1.00 25.00 H new ATOM 0 HB2 TYR A 842 19.930 -3.061 3.485 1.00 25.00 H new ATOM 0 HB3 TYR A 842 21.259 -2.229 4.268 1.00 25.00 H new ATOM 0 HD1 TYR A 842 19.082 -5.249 4.417 1.00 25.00 H new ATOM 0 HD2 TYR A 842 22.542 -3.307 6.065 1.00 25.00 H new ATOM 0 HE1 TYR A 842 19.761 -7.386 5.505 1.00 25.00 H new ATOM 0 HE2 TYR A 842 23.210 -5.435 7.166 1.00 25.00 H new ATOM 0 HH TYR A 842 22.770 -7.537 7.503 1.00 25.00 H new ATOM 1553 N ILE A 843 17.311 -3.201 4.877 1.00 25.00 N ATOM 1554 CA ILE A 843 16.219 -4.087 5.242 1.00 25.00 C ATOM 1555 C ILE A 843 16.405 -5.367 4.461 1.00 25.00 C ATOM 1556 O ILE A 843 16.924 -5.358 3.347 1.00 25.00 O ATOM 1557 CB ILE A 843 14.833 -3.437 4.935 1.00 25.00 C ATOM 1558 CG1 ILE A 843 13.730 -4.108 5.758 1.00 25.00 C ATOM 1559 CG2 ILE A 843 14.506 -3.451 3.445 1.00 25.00 C ATOM 1560 CD1 ILE A 843 13.745 -3.615 7.144 1.00 25.00 C ATOM 0 H ILE A 843 17.301 -2.908 3.900 1.00 25.00 H new ATOM 0 HA ILE A 843 16.233 -4.286 6.314 1.00 25.00 H new ATOM 0 HB ILE A 843 14.890 -2.389 5.229 1.00 25.00 H new ATOM 0 HG12 ILE A 843 12.759 -3.908 5.306 1.00 25.00 H new ATOM 0 HG13 ILE A 843 13.869 -5.189 5.749 1.00 25.00 H new ATOM 0 HG21 ILE A 843 13.533 -2.988 3.282 1.00 25.00 H new ATOM 0 HG22 ILE A 843 15.268 -2.894 2.900 1.00 25.00 H new ATOM 0 HG23 ILE A 843 14.483 -4.480 3.087 1.00 25.00 H new ATOM 0 HD11 ILE A 843 12.954 -4.104 7.713 1.00 25.00 H new ATOM 0 HD12 ILE A 843 14.710 -3.838 7.599 1.00 25.00 H new ATOM 0 HD13 ILE A 843 13.582 -2.537 7.149 1.00 25.00 H new ATOM 1572 N THR A 844 16.001 -6.480 5.029 1.00 25.00 N ATOM 1573 CA THR A 844 16.074 -7.732 4.301 1.00 25.00 C ATOM 1574 C THR A 844 14.768 -7.876 3.540 1.00 25.00 C ATOM 1575 O THR A 844 13.728 -7.386 3.978 1.00 25.00 O ATOM 1576 CB THR A 844 16.255 -8.954 5.221 1.00 25.00 C ATOM 1577 OG1 THR A 844 15.144 -9.054 6.110 1.00 25.00 O ATOM 1578 CG2 THR A 844 17.521 -8.860 6.040 1.00 25.00 C ATOM 0 H THR A 844 15.625 -6.548 5.975 1.00 25.00 H new ATOM 0 HA THR A 844 16.944 -7.705 3.645 1.00 25.00 H new ATOM 0 HB THR A 844 16.321 -9.836 4.583 1.00 25.00 H new ATOM 0 HG1 THR A 844 15.057 -8.222 6.620 1.00 25.00 H new ATOM 0 HG21 THR A 844 17.610 -9.742 6.675 1.00 25.00 H new ATOM 0 HG22 THR A 844 18.382 -8.804 5.374 1.00 25.00 H new ATOM 0 HG23 THR A 844 17.486 -7.966 6.663 1.00 25.00 H new ATOM 1586 N MET A 845 14.810 -8.561 2.409 1.00 25.00 N ATOM 1587 CA MET A 845 13.591 -8.860 1.649 1.00 25.00 C ATOM 1588 C MET A 845 12.558 -9.578 2.522 1.00 25.00 C ATOM 1589 O MET A 845 11.361 -9.431 2.329 1.00 25.00 O ATOM 1590 CB MET A 845 13.921 -9.757 0.455 1.00 25.00 C ATOM 1591 CG MET A 845 14.932 -9.155 -0.485 1.00 25.00 C ATOM 1592 SD MET A 845 15.097 -10.065 -2.017 1.00 25.00 S ATOM 1593 CE MET A 845 16.286 -9.022 -2.837 1.00 25.00 C ATOM 0 H MET A 845 15.668 -8.923 1.992 1.00 25.00 H new ATOM 0 HA MET A 845 13.177 -7.912 1.307 1.00 25.00 H new ATOM 0 HB2 MET A 845 14.300 -10.711 0.821 1.00 25.00 H new ATOM 0 HB3 MET A 845 13.004 -9.968 -0.096 1.00 25.00 H new ATOM 0 HG2 MET A 845 14.644 -8.128 -0.709 1.00 25.00 H new ATOM 0 HG3 MET A 845 15.901 -9.113 0.012 1.00 25.00 H new ATOM 0 HE1 MET A 845 15.830 -8.574 -3.720 1.00 25.00 H new ATOM 0 HE2 MET A 845 16.609 -8.234 -2.157 1.00 25.00 H new ATOM 0 HE3 MET A 845 17.148 -9.618 -3.137 1.00 25.00 H new ATOM 1603 N ASP A 846 13.049 -10.350 3.480 1.00 25.00 N ATOM 1604 CA ASP A 846 12.212 -11.118 4.397 1.00 25.00 C ATOM 1605 C ASP A 846 11.437 -10.208 5.352 1.00 25.00 C ATOM 1606 O ASP A 846 10.290 -10.472 5.671 1.00 25.00 O ATOM 1607 CB ASP A 846 13.108 -12.066 5.201 1.00 25.00 C ATOM 1608 CG ASP A 846 12.328 -13.180 5.876 1.00 25.00 C ATOM 1609 OD1 ASP A 846 11.346 -13.669 5.281 1.00 25.00 O ATOM 1610 OD2 ASP A 846 12.714 -13.580 6.996 1.00 25.00 O ATOM 0 H ASP A 846 14.049 -10.464 3.646 1.00 25.00 H new ATOM 0 HA ASP A 846 11.483 -11.680 3.814 1.00 25.00 H new ATOM 0 HB2 ASP A 846 13.856 -12.502 4.538 1.00 25.00 H new ATOM 0 HB3 ASP A 846 13.647 -11.495 5.958 1.00 25.00 H new ATOM 1615 N GLU A 847 12.059 -9.120 5.795 1.00 25.00 N ATOM 1616 CA GLU A 847 11.388 -8.175 6.696 1.00 25.00 C ATOM 1617 C GLU A 847 10.247 -7.479 5.964 1.00 25.00 C ATOM 1618 O GLU A 847 9.203 -7.196 6.547 1.00 25.00 O ATOM 1619 CB GLU A 847 12.381 -7.140 7.252 1.00 25.00 C ATOM 1620 CG GLU A 847 13.128 -7.660 8.491 1.00 25.00 C ATOM 1621 CD GLU A 847 14.532 -7.070 8.673 1.00 25.00 C ATOM 1622 OE1 GLU A 847 15.224 -6.807 7.667 1.00 25.00 O ATOM 1623 OE2 GLU A 847 14.965 -6.895 9.827 1.00 25.00 O ATOM 0 H GLU A 847 13.017 -8.868 5.551 1.00 25.00 H new ATOM 0 HA GLU A 847 10.981 -8.734 7.539 1.00 25.00 H new ATOM 0 HB2 GLU A 847 13.102 -6.879 6.478 1.00 25.00 H new ATOM 0 HB3 GLU A 847 11.845 -6.227 7.510 1.00 25.00 H new ATOM 0 HG2 GLU A 847 12.535 -7.438 9.378 1.00 25.00 H new ATOM 0 HG3 GLU A 847 13.208 -8.745 8.424 1.00 25.00 H new ATOM 1630 N LEU A 848 10.432 -7.218 4.681 1.00 25.00 N ATOM 1631 CA LEU A 848 9.378 -6.599 3.880 1.00 25.00 C ATOM 1632 C LEU A 848 8.258 -7.606 3.698 1.00 25.00 C ATOM 1633 O LEU A 848 7.081 -7.284 3.816 1.00 25.00 O ATOM 1634 CB LEU A 848 9.925 -6.192 2.508 1.00 25.00 C ATOM 1635 CG LEU A 848 11.121 -5.230 2.540 1.00 25.00 C ATOM 1636 CD1 LEU A 848 11.708 -5.098 1.151 1.00 25.00 C ATOM 1637 CD2 LEU A 848 10.706 -3.880 3.055 1.00 25.00 C ATOM 0 H LEU A 848 11.292 -7.421 4.171 1.00 25.00 H new ATOM 0 HA LEU A 848 9.009 -5.707 4.387 1.00 25.00 H new ATOM 0 HB2 LEU A 848 10.219 -7.093 1.970 1.00 25.00 H new ATOM 0 HB3 LEU A 848 9.121 -5.728 1.937 1.00 25.00 H new ATOM 0 HG LEU A 848 11.876 -5.636 3.214 1.00 25.00 H new ATOM 0 HD11 LEU A 848 12.557 -4.414 1.178 1.00 25.00 H new ATOM 0 HD12 LEU A 848 12.041 -6.076 0.802 1.00 25.00 H new ATOM 0 HD13 LEU A 848 10.950 -4.709 0.471 1.00 25.00 H new ATOM 0 HD21 LEU A 848 11.569 -3.215 3.069 1.00 25.00 H new ATOM 0 HD22 LEU A 848 9.937 -3.463 2.405 1.00 25.00 H new ATOM 0 HD23 LEU A 848 10.310 -3.982 4.065 1.00 25.00 H new ATOM 1649 N ARG A 849 8.640 -8.848 3.437 1.00 25.00 N ATOM 1650 CA ARG A 849 7.701 -9.953 3.263 1.00 25.00 C ATOM 1651 C ARG A 849 7.114 -10.439 4.588 1.00 25.00 C ATOM 1652 O ARG A 849 6.544 -11.523 4.663 1.00 25.00 O ATOM 1653 CB ARG A 849 8.446 -11.097 2.573 1.00 25.00 C ATOM 1654 CG ARG A 849 8.629 -10.838 1.102 1.00 25.00 C ATOM 1655 CD ARG A 849 9.407 -11.948 0.462 1.00 25.00 C ATOM 1656 NE ARG A 849 9.638 -11.706 -0.977 1.00 25.00 N ATOM 1657 CZ ARG A 849 8.734 -11.854 -1.946 1.00 25.00 C ATOM 1658 NH1 ARG A 849 7.496 -12.218 -1.718 1.00 25.00 N ATOM 1659 NH2 ARG A 849 9.085 -11.626 -3.179 1.00 25.00 N ATOM 0 H ARG A 849 9.618 -9.122 3.339 1.00 25.00 H new ATOM 0 HA ARG A 849 6.862 -9.605 2.661 1.00 25.00 H new ATOM 0 HB2 ARG A 849 9.421 -11.231 3.042 1.00 25.00 H new ATOM 0 HB3 ARG A 849 7.894 -12.027 2.712 1.00 25.00 H new ATOM 0 HG2 ARG A 849 7.656 -10.744 0.620 1.00 25.00 H new ATOM 0 HG3 ARG A 849 9.149 -9.891 0.956 1.00 25.00 H new ATOM 0 HD2 ARG A 849 10.366 -12.058 0.969 1.00 25.00 H new ATOM 0 HD3 ARG A 849 8.869 -12.888 0.590 1.00 25.00 H new ATOM 0 HE ARG A 849 10.571 -11.399 -1.253 1.00 25.00 H new ATOM 0 HH11 ARG A 849 7.186 -12.402 -0.764 1.00 25.00 H new ATOM 0 HH12 ARG A 849 6.842 -12.317 -2.495 1.00 25.00 H new ATOM 0 HH21 ARG A 849 10.040 -11.339 -3.393 1.00 25.00 H new ATOM 0 HH22 ARG A 849 8.405 -11.735 -3.931 1.00 25.00 H new ATOM 1673 N ARG A 850 7.245 -9.629 5.630 1.00 25.00 N ATOM 1674 CA ARG A 850 6.770 -10.004 6.966 1.00 25.00 C ATOM 1675 C ARG A 850 5.537 -9.187 7.238 1.00 25.00 C ATOM 1676 O ARG A 850 4.613 -9.628 7.913 1.00 25.00 O ATOM 1677 CB ARG A 850 7.842 -9.706 8.017 1.00 25.00 C ATOM 1678 CG ARG A 850 7.490 -10.159 9.430 1.00 25.00 C ATOM 1679 CD ARG A 850 8.083 -9.208 10.469 1.00 25.00 C ATOM 1680 NE ARG A 850 7.517 -7.847 10.354 1.00 25.00 N ATOM 1681 CZ ARG A 850 6.352 -7.444 10.852 1.00 25.00 C ATOM 1682 NH1 ARG A 850 5.557 -8.243 11.519 1.00 25.00 N ATOM 1683 NH2 ARG A 850 5.972 -6.210 10.665 1.00 25.00 N ATOM 0 H ARG A 850 7.676 -8.706 5.581 1.00 25.00 H new ATOM 0 HA ARG A 850 6.551 -11.071 7.013 1.00 25.00 H new ATOM 0 HB2 ARG A 850 8.771 -10.189 7.716 1.00 25.00 H new ATOM 0 HB3 ARG A 850 8.031 -8.633 8.030 1.00 25.00 H new ATOM 0 HG2 ARG A 850 6.407 -10.200 9.544 1.00 25.00 H new ATOM 0 HG3 ARG A 850 7.866 -11.168 9.597 1.00 25.00 H new ATOM 0 HD2 ARG A 850 7.892 -9.598 11.469 1.00 25.00 H new ATOM 0 HD3 ARG A 850 9.165 -9.163 10.345 1.00 25.00 H new ATOM 0 HE ARG A 850 8.070 -7.155 9.847 1.00 25.00 H new ATOM 0 HH11 ARG A 850 5.824 -9.215 11.673 1.00 25.00 H new ATOM 0 HH12 ARG A 850 4.671 -7.893 11.884 1.00 25.00 H new ATOM 0 HH21 ARG A 850 6.566 -5.567 10.142 1.00 25.00 H new ATOM 0 HH22 ARG A 850 5.080 -5.888 11.042 1.00 25.00 H new ATOM 1697 N GLU A 851 5.530 -7.985 6.692 1.00 25.00 N ATOM 1698 CA GLU A 851 4.383 -7.108 6.819 1.00 25.00 C ATOM 1699 C GLU A 851 3.562 -7.141 5.538 1.00 25.00 C ATOM 1700 O GLU A 851 2.351 -6.960 5.577 1.00 25.00 O ATOM 1701 CB GLU A 851 4.834 -5.696 7.175 1.00 25.00 C ATOM 1702 CG GLU A 851 5.729 -5.005 6.181 1.00 25.00 C ATOM 1703 CD GLU A 851 5.912 -3.542 6.583 1.00 25.00 C ATOM 1704 OE1 GLU A 851 6.197 -3.306 7.783 1.00 25.00 O ATOM 1705 OE2 GLU A 851 5.769 -2.639 5.740 1.00 25.00 O ATOM 0 H GLU A 851 6.306 -7.595 6.157 1.00 25.00 H new ATOM 0 HA GLU A 851 3.744 -7.457 7.630 1.00 25.00 H new ATOM 0 HB2 GLU A 851 3.946 -5.081 7.320 1.00 25.00 H new ATOM 0 HB3 GLU A 851 5.354 -5.735 8.132 1.00 25.00 H new ATOM 0 HG2 GLU A 851 6.697 -5.505 6.140 1.00 25.00 H new ATOM 0 HG3 GLU A 851 5.296 -5.066 5.183 1.00 25.00 H new ATOM 1712 N LEU A 852 4.217 -7.404 4.414 1.00 25.00 N ATOM 1713 CA LEU A 852 3.527 -7.542 3.136 1.00 25.00 C ATOM 1714 C LEU A 852 3.648 -8.979 2.621 1.00 25.00 C ATOM 1715 O LEU A 852 4.506 -9.278 1.800 1.00 25.00 O ATOM 1716 CB LEU A 852 4.102 -6.606 2.050 1.00 25.00 C ATOM 1717 CG LEU A 852 3.857 -5.087 2.006 1.00 25.00 C ATOM 1718 CD1 LEU A 852 3.112 -4.518 3.160 1.00 25.00 C ATOM 1719 CD2 LEU A 852 5.194 -4.370 1.859 1.00 25.00 C ATOM 0 H LEU A 852 5.228 -7.526 4.361 1.00 25.00 H new ATOM 0 HA LEU A 852 2.487 -7.274 3.320 1.00 25.00 H new ATOM 0 HB2 LEU A 852 5.184 -6.739 2.075 1.00 25.00 H new ATOM 0 HB3 LEU A 852 3.754 -6.998 1.094 1.00 25.00 H new ATOM 0 HG LEU A 852 3.207 -4.925 1.146 1.00 25.00 H new ATOM 0 HD11 LEU A 852 2.997 -3.443 3.024 1.00 25.00 H new ATOM 0 HD12 LEU A 852 2.128 -4.983 3.223 1.00 25.00 H new ATOM 0 HD13 LEU A 852 3.664 -4.711 4.080 1.00 25.00 H new ATOM 0 HD21 LEU A 852 5.028 -3.293 1.827 1.00 25.00 H new ATOM 0 HD22 LEU A 852 5.833 -4.614 2.708 1.00 25.00 H new ATOM 0 HD23 LEU A 852 5.679 -4.690 0.937 1.00 25.00 H new ATOM 1731 N PRO A 853 2.766 -9.887 3.066 1.00 25.00 N ATOM 1732 CA PRO A 853 2.790 -11.148 2.307 1.00 25.00 C ATOM 1733 C PRO A 853 2.382 -11.080 0.788 1.00 25.00 C ATOM 1734 O PRO A 853 2.771 -11.971 0.030 1.00 25.00 O ATOM 1735 CB PRO A 853 1.839 -12.044 3.111 1.00 25.00 C ATOM 1736 CG PRO A 853 0.900 -11.103 3.786 1.00 25.00 C ATOM 1737 CD PRO A 853 1.731 -9.892 4.121 1.00 25.00 C ATOM 0 HA PRO A 853 3.815 -11.509 2.221 1.00 25.00 H new ATOM 0 HB2 PRO A 853 1.304 -12.736 2.460 1.00 25.00 H new ATOM 0 HB3 PRO A 853 2.384 -12.646 3.838 1.00 25.00 H new ATOM 0 HG2 PRO A 853 0.067 -10.841 3.133 1.00 25.00 H new ATOM 0 HG3 PRO A 853 0.473 -11.549 4.684 1.00 25.00 H new ATOM 0 HD2 PRO A 853 1.136 -8.979 4.105 1.00 25.00 H new ATOM 0 HD3 PRO A 853 2.171 -9.968 5.115 1.00 25.00 H new ATOM 1745 N PRO A 854 1.602 -10.059 0.321 1.00 25.00 N ATOM 1746 CA PRO A 854 1.292 -10.050 -1.116 1.00 25.00 C ATOM 1747 C PRO A 854 2.374 -9.464 -2.039 1.00 25.00 C ATOM 1748 O PRO A 854 3.500 -9.193 -1.622 1.00 25.00 O ATOM 1749 CB PRO A 854 0.087 -9.118 -1.154 1.00 25.00 C ATOM 1750 CG PRO A 854 0.390 -8.156 -0.192 1.00 25.00 C ATOM 1751 CD PRO A 854 0.932 -8.898 0.946 1.00 25.00 C ATOM 0 HA PRO A 854 1.164 -11.069 -1.480 1.00 25.00 H new ATOM 0 HB2 PRO A 854 -0.045 -8.672 -2.140 1.00 25.00 H new ATOM 0 HB3 PRO A 854 -0.837 -9.646 -0.917 1.00 25.00 H new ATOM 0 HG2 PRO A 854 1.115 -7.436 -0.572 1.00 25.00 H new ATOM 0 HG3 PRO A 854 -0.499 -7.593 0.094 1.00 25.00 H new ATOM 0 HD2 PRO A 854 1.633 -8.293 1.521 1.00 25.00 H new ATOM 0 HD3 PRO A 854 0.144 -9.211 1.631 1.00 25.00 H new ATOM 1759 N ASP A 855 1.985 -9.243 -3.293 1.00 25.00 N ATOM 1760 CA ASP A 855 2.826 -8.621 -4.327 1.00 25.00 C ATOM 1761 C ASP A 855 3.464 -7.309 -3.910 1.00 25.00 C ATOM 1762 O ASP A 855 4.506 -6.930 -4.430 1.00 25.00 O ATOM 1763 CB ASP A 855 1.959 -8.288 -5.546 1.00 25.00 C ATOM 1764 CG ASP A 855 2.468 -8.911 -6.833 1.00 25.00 C ATOM 1765 OD1 ASP A 855 3.499 -9.600 -6.805 1.00 25.00 O ATOM 1766 OD2 ASP A 855 1.824 -8.722 -7.889 1.00 25.00 O ATOM 0 H ASP A 855 1.056 -9.495 -3.631 1.00 25.00 H new ATOM 0 HA ASP A 855 3.615 -9.346 -4.528 1.00 25.00 H new ATOM 0 HB2 ASP A 855 0.940 -8.630 -5.363 1.00 25.00 H new ATOM 0 HB3 ASP A 855 1.915 -7.206 -5.667 1.00 25.00 H new ATOM 1771 N GLN A 856 2.839 -6.605 -2.978 1.00 25.00 N ATOM 1772 CA GLN A 856 3.352 -5.330 -2.516 1.00 25.00 C ATOM 1773 C GLN A 856 4.782 -5.487 -1.983 1.00 25.00 C ATOM 1774 O GLN A 856 5.593 -4.579 -2.116 1.00 25.00 O ATOM 1775 CB GLN A 856 2.399 -4.719 -1.487 1.00 25.00 C ATOM 1776 CG GLN A 856 1.190 -4.004 -2.109 1.00 25.00 C ATOM 1777 CD GLN A 856 -0.055 -4.876 -2.233 1.00 25.00 C ATOM 1778 OE1 GLN A 856 0.031 -6.080 -2.428 1.00 25.00 O ATOM 1779 NE2 GLN A 856 -1.211 -4.276 -2.132 1.00 25.00 N ATOM 0 H GLN A 856 1.973 -6.899 -2.527 1.00 25.00 H new ATOM 0 HA GLN A 856 3.405 -4.635 -3.354 1.00 25.00 H new ATOM 0 HB2 GLN A 856 2.042 -5.507 -0.824 1.00 25.00 H new ATOM 0 HB3 GLN A 856 2.951 -4.010 -0.871 1.00 25.00 H new ATOM 0 HG2 GLN A 856 0.949 -3.129 -1.505 1.00 25.00 H new ATOM 0 HG3 GLN A 856 1.466 -3.641 -3.099 1.00 25.00 H new ATOM 0 HE21 GLN A 856 -1.251 -3.270 -1.969 1.00 25.00 H new ATOM 0 HE22 GLN A 856 -2.074 -4.814 -2.216 1.00 25.00 H new ATOM 1788 N ALA A 857 5.120 -6.642 -1.421 1.00 25.00 N ATOM 1789 CA ALA A 857 6.488 -6.861 -0.959 1.00 25.00 C ATOM 1790 C ALA A 857 7.474 -6.849 -2.120 1.00 25.00 C ATOM 1791 O ALA A 857 8.517 -6.220 -2.040 1.00 25.00 O ATOM 1792 CB ALA A 857 6.598 -8.180 -0.224 1.00 25.00 C ATOM 0 H ALA A 857 4.483 -7.426 -1.276 1.00 25.00 H new ATOM 0 HA ALA A 857 6.736 -6.045 -0.280 1.00 25.00 H new ATOM 0 HB1 ALA A 857 7.625 -8.325 0.112 1.00 25.00 H new ATOM 0 HB2 ALA A 857 5.931 -8.173 0.638 1.00 25.00 H new ATOM 0 HB3 ALA A 857 6.317 -8.994 -0.893 1.00 25.00 H new ATOM 1798 N GLU A 858 7.167 -7.556 -3.196 1.00 25.00 N ATOM 1799 CA GLU A 858 8.114 -7.644 -4.304 1.00 25.00 C ATOM 1800 C GLU A 858 8.146 -6.399 -5.141 1.00 25.00 C ATOM 1801 O GLU A 858 9.184 -6.032 -5.676 1.00 25.00 O ATOM 1802 CB GLU A 858 7.872 -8.856 -5.169 1.00 25.00 C ATOM 1803 CG GLU A 858 6.492 -9.115 -5.643 1.00 25.00 C ATOM 1804 CD GLU A 858 6.439 -10.460 -6.364 1.00 25.00 C ATOM 1805 OE1 GLU A 858 6.347 -11.502 -5.663 1.00 25.00 O ATOM 1806 OE2 GLU A 858 6.521 -10.497 -7.615 1.00 25.00 O ATOM 0 H GLU A 858 6.294 -8.066 -3.329 1.00 25.00 H new ATOM 0 HA GLU A 858 9.095 -7.752 -3.840 1.00 25.00 H new ATOM 0 HB2 GLU A 858 8.515 -8.773 -6.045 1.00 25.00 H new ATOM 0 HB3 GLU A 858 8.203 -9.733 -4.613 1.00 25.00 H new ATOM 0 HG2 GLU A 858 5.802 -9.116 -4.799 1.00 25.00 H new ATOM 0 HG3 GLU A 858 6.173 -8.318 -6.315 1.00 25.00 H new ATOM 1813 N TYR A 859 7.012 -5.738 -5.214 1.00 25.00 N ATOM 1814 CA TYR A 859 6.935 -4.408 -5.828 1.00 25.00 C ATOM 1815 C TYR A 859 7.995 -3.551 -5.148 1.00 25.00 C ATOM 1816 O TYR A 859 8.827 -2.926 -5.811 1.00 25.00 O ATOM 1817 CB TYR A 859 5.527 -3.781 -5.659 1.00 25.00 C ATOM 1818 CG TYR A 859 5.501 -2.354 -5.076 1.00 25.00 C ATOM 1819 CD1 TYR A 859 6.159 -1.278 -5.715 1.00 25.00 C ATOM 1820 CD2 TYR A 859 4.824 -2.079 -3.868 1.00 25.00 C ATOM 1821 CE1 TYR A 859 6.145 0.025 -5.154 1.00 25.00 C ATOM 1822 CE2 TYR A 859 4.795 -0.767 -3.322 1.00 25.00 C ATOM 1823 CZ TYR A 859 5.463 0.266 -3.971 1.00 25.00 C ATOM 1824 OH TYR A 859 5.468 1.530 -3.447 1.00 25.00 O ATOM 0 H TYR A 859 6.123 -6.090 -4.859 1.00 25.00 H new ATOM 0 HA TYR A 859 7.111 -4.474 -6.902 1.00 25.00 H new ATOM 0 HB2 TYR A 859 5.036 -3.766 -6.632 1.00 25.00 H new ATOM 0 HB3 TYR A 859 4.935 -4.429 -5.013 1.00 25.00 H new ATOM 0 HD1 TYR A 859 6.681 -1.451 -6.645 1.00 25.00 H new ATOM 0 HD2 TYR A 859 4.319 -2.880 -3.349 1.00 25.00 H new ATOM 0 HE1 TYR A 859 6.667 0.831 -5.649 1.00 25.00 H new ATOM 0 HE2 TYR A 859 4.256 -0.573 -2.406 1.00 25.00 H new ATOM 0 HH TYR A 859 6.312 1.684 -2.973 1.00 25.00 H new ATOM 1834 N CYS A 860 7.970 -3.539 -3.825 1.00 25.00 N ATOM 1835 CA CYS A 860 8.894 -2.726 -3.052 1.00 25.00 C ATOM 1836 C CYS A 860 10.327 -3.201 -3.241 1.00 25.00 C ATOM 1837 O CYS A 860 11.221 -2.391 -3.400 1.00 25.00 O ATOM 1838 CB CYS A 860 8.526 -2.770 -1.569 1.00 25.00 C ATOM 1839 SG CYS A 860 6.968 -1.966 -1.201 1.00 25.00 S ATOM 0 H CYS A 860 7.317 -4.085 -3.263 1.00 25.00 H new ATOM 0 HA CYS A 860 8.819 -1.699 -3.410 1.00 25.00 H new ATOM 0 HB2 CYS A 860 8.476 -3.810 -1.245 1.00 25.00 H new ATOM 0 HB3 CYS A 860 9.318 -2.294 -0.991 1.00 25.00 H new ATOM 0 HG CYS A 860 6.287 -1.816 -2.298 1.00 25.00 H new ATOM 1845 N ILE A 861 10.532 -4.510 -3.233 1.00 25.00 N ATOM 1846 CA ILE A 861 11.866 -5.106 -3.380 1.00 25.00 C ATOM 1847 C ILE A 861 12.491 -4.688 -4.705 1.00 25.00 C ATOM 1848 O ILE A 861 13.679 -4.391 -4.771 1.00 25.00 O ATOM 1849 CB ILE A 861 11.775 -6.672 -3.302 1.00 25.00 C ATOM 1850 CG1 ILE A 861 11.611 -7.103 -1.834 1.00 25.00 C ATOM 1851 CG2 ILE A 861 13.003 -7.362 -3.957 1.00 25.00 C ATOM 1852 CD1 ILE A 861 11.068 -8.524 -1.627 1.00 25.00 C ATOM 0 H ILE A 861 9.784 -5.195 -3.125 1.00 25.00 H new ATOM 0 HA ILE A 861 12.495 -4.747 -2.565 1.00 25.00 H new ATOM 0 HB ILE A 861 10.902 -6.993 -3.870 1.00 25.00 H new ATOM 0 HG12 ILE A 861 12.579 -7.025 -1.339 1.00 25.00 H new ATOM 0 HG13 ILE A 861 10.942 -6.400 -1.338 1.00 25.00 H new ATOM 0 HG21 ILE A 861 12.897 -8.444 -3.879 1.00 25.00 H new ATOM 0 HG22 ILE A 861 13.063 -7.078 -5.008 1.00 25.00 H new ATOM 0 HG23 ILE A 861 13.913 -7.049 -3.444 1.00 25.00 H new ATOM 0 HD11 ILE A 861 10.989 -8.732 -0.560 1.00 25.00 H new ATOM 0 HD12 ILE A 861 10.083 -8.608 -2.087 1.00 25.00 H new ATOM 0 HD13 ILE A 861 11.746 -9.243 -2.087 1.00 25.00 H new ATOM 1864 N ALA A 862 11.683 -4.657 -5.751 1.00 25.00 N ATOM 1865 CA ALA A 862 12.156 -4.308 -7.081 1.00 25.00 C ATOM 1866 C ALA A 862 12.671 -2.868 -7.138 1.00 25.00 C ATOM 1867 O ALA A 862 13.699 -2.589 -7.728 1.00 25.00 O ATOM 1868 CB ALA A 862 11.017 -4.501 -8.074 1.00 25.00 C ATOM 0 H ALA A 862 10.687 -4.871 -5.704 1.00 25.00 H new ATOM 0 HA ALA A 862 12.992 -4.960 -7.337 1.00 25.00 H new ATOM 0 HB1 ALA A 862 11.360 -4.242 -9.076 1.00 25.00 H new ATOM 0 HB2 ALA A 862 10.693 -5.542 -8.059 1.00 25.00 H new ATOM 0 HB3 ALA A 862 10.181 -3.857 -7.799 1.00 25.00 H new ATOM 1874 N ARG A 863 11.936 -1.953 -6.528 1.00 25.00 N ATOM 1875 CA ARG A 863 12.315 -0.541 -6.520 1.00 25.00 C ATOM 1876 C ARG A 863 13.425 -0.281 -5.506 1.00 25.00 C ATOM 1877 O ARG A 863 14.091 0.740 -5.561 1.00 25.00 O ATOM 1878 CB ARG A 863 11.091 0.326 -6.176 1.00 25.00 C ATOM 1879 CG ARG A 863 10.184 0.644 -7.362 1.00 25.00 C ATOM 1880 CD ARG A 863 9.056 -0.345 -7.451 1.00 25.00 C ATOM 1881 NE ARG A 863 8.100 -0.062 -8.538 1.00 25.00 N ATOM 1882 CZ ARG A 863 7.385 -0.982 -9.179 1.00 25.00 C ATOM 1883 NH1 ARG A 863 7.484 -2.263 -8.903 1.00 25.00 N ATOM 1884 NH2 ARG A 863 6.550 -0.622 -10.105 1.00 25.00 N ATOM 0 H ARG A 863 11.070 -2.159 -6.029 1.00 25.00 H new ATOM 0 HA ARG A 863 12.683 -0.280 -7.512 1.00 25.00 H new ATOM 0 HB2 ARG A 863 10.504 -0.184 -5.413 1.00 25.00 H new ATOM 0 HB3 ARG A 863 11.437 1.263 -5.739 1.00 25.00 H new ATOM 0 HG2 ARG A 863 9.783 1.652 -7.259 1.00 25.00 H new ATOM 0 HG3 ARG A 863 10.764 0.625 -8.285 1.00 25.00 H new ATOM 0 HD2 ARG A 863 9.471 -1.343 -7.595 1.00 25.00 H new ATOM 0 HD3 ARG A 863 8.520 -0.357 -6.502 1.00 25.00 H new ATOM 0 HE ARG A 863 7.978 0.911 -8.819 1.00 25.00 H new ATOM 0 HH11 ARG A 863 8.125 -2.580 -8.176 1.00 25.00 H new ATOM 0 HH12 ARG A 863 6.919 -2.940 -9.416 1.00 25.00 H new ATOM 0 HH21 ARG A 863 6.443 0.365 -10.340 1.00 25.00 H new ATOM 0 HH22 ARG A 863 6.001 -1.326 -10.598 1.00 25.00 H new ATOM 1898 N MET A 864 13.624 -1.187 -4.567 1.00 25.00 N ATOM 1899 CA MET A 864 14.603 -0.962 -3.515 1.00 25.00 C ATOM 1900 C MET A 864 16.058 -1.069 -3.967 1.00 25.00 C ATOM 1901 O MET A 864 16.394 -1.825 -4.871 1.00 25.00 O ATOM 1902 CB MET A 864 14.341 -1.878 -2.345 1.00 25.00 C ATOM 1903 CG MET A 864 14.534 -1.190 -1.016 1.00 25.00 C ATOM 1904 SD MET A 864 13.823 -2.079 0.357 1.00 25.00 S ATOM 1905 CE MET A 864 12.179 -1.393 0.419 1.00 25.00 C ATOM 0 H MET A 864 13.128 -2.076 -4.509 1.00 25.00 H new ATOM 0 HA MET A 864 14.471 0.076 -3.211 1.00 25.00 H new ATOM 0 HB2 MET A 864 13.322 -2.260 -2.408 1.00 25.00 H new ATOM 0 HB3 MET A 864 15.008 -2.738 -2.405 1.00 25.00 H new ATOM 0 HG2 MET A 864 15.601 -1.055 -0.838 1.00 25.00 H new ATOM 0 HG3 MET A 864 14.090 -0.195 -1.063 1.00 25.00 H new ATOM 0 HE1 MET A 864 11.544 -2.026 1.038 1.00 25.00 H new ATOM 0 HE2 MET A 864 12.219 -0.391 0.846 1.00 25.00 H new ATOM 0 HE3 MET A 864 11.768 -1.342 -0.589 1.00 25.00 H new ATOM 1915 N ALA A 865 16.924 -0.287 -3.333 1.00 25.00 N ATOM 1916 CA ALA A 865 18.328 -0.237 -3.725 1.00 25.00 C ATOM 1917 C ALA A 865 19.049 -1.550 -3.364 1.00 25.00 C ATOM 1918 O ALA A 865 18.821 -2.106 -2.303 1.00 25.00 O ATOM 1919 CB ALA A 865 19.012 0.945 -3.062 1.00 25.00 C ATOM 0 H ALA A 865 16.681 0.318 -2.549 1.00 25.00 H new ATOM 0 HA ALA A 865 18.379 -0.113 -4.807 1.00 25.00 H new ATOM 0 HB1 ALA A 865 20.060 0.974 -3.361 1.00 25.00 H new ATOM 0 HB2 ALA A 865 18.522 1.869 -3.369 1.00 25.00 H new ATOM 0 HB3 ALA A 865 18.946 0.843 -1.979 1.00 25.00 H new ATOM 1925 N PRO A 866 19.934 -2.044 -4.244 1.00 25.00 N ATOM 1926 CA PRO A 866 20.648 -3.320 -4.124 1.00 25.00 C ATOM 1927 C PRO A 866 21.818 -3.303 -3.149 1.00 25.00 C ATOM 1928 O PRO A 866 22.952 -2.969 -3.503 1.00 25.00 O ATOM 1929 CB PRO A 866 21.135 -3.560 -5.548 1.00 25.00 C ATOM 1930 CG PRO A 866 21.370 -2.190 -6.093 1.00 25.00 C ATOM 1931 CD PRO A 866 20.290 -1.343 -5.485 1.00 25.00 C ATOM 0 HA PRO A 866 20.001 -4.098 -3.719 1.00 25.00 H new ATOM 0 HB2 PRO A 866 22.048 -4.155 -5.561 1.00 25.00 H new ATOM 0 HB3 PRO A 866 20.393 -4.100 -6.136 1.00 25.00 H new ATOM 0 HG2 PRO A 866 22.360 -1.822 -5.823 1.00 25.00 H new ATOM 0 HG3 PRO A 866 21.313 -2.182 -7.181 1.00 25.00 H new ATOM 0 HD2 PRO A 866 20.644 -0.332 -5.283 1.00 25.00 H new ATOM 0 HD3 PRO A 866 19.432 -1.254 -6.151 1.00 25.00 H new ATOM 1939 N TYR A 867 21.557 -3.676 -1.912 1.00 25.00 N ATOM 1940 CA TYR A 867 22.608 -3.668 -0.909 1.00 25.00 C ATOM 1941 C TYR A 867 23.394 -4.963 -0.836 1.00 25.00 C ATOM 1942 O TYR A 867 22.882 -6.025 -0.495 1.00 25.00 O ATOM 1943 CB TYR A 867 22.029 -3.309 0.443 1.00 25.00 C ATOM 1944 CG TYR A 867 22.388 -1.903 0.828 1.00 25.00 C ATOM 1945 CD1 TYR A 867 22.238 -0.829 -0.096 1.00 25.00 C ATOM 1946 CD2 TYR A 867 22.894 -1.623 2.113 1.00 25.00 C ATOM 1947 CE1 TYR A 867 22.595 0.496 0.289 1.00 25.00 C ATOM 1948 CE2 TYR A 867 23.235 -0.307 2.493 1.00 25.00 C ATOM 1949 CZ TYR A 867 23.082 0.739 1.584 1.00 25.00 C ATOM 1950 OH TYR A 867 23.400 2.014 1.967 1.00 25.00 O ATOM 0 H TYR A 867 20.643 -3.984 -1.579 1.00 25.00 H new ATOM 0 HA TYR A 867 23.326 -2.907 -1.216 1.00 25.00 H new ATOM 0 HB2 TYR A 867 20.945 -3.417 0.418 1.00 25.00 H new ATOM 0 HB3 TYR A 867 22.401 -4.002 1.197 1.00 25.00 H new ATOM 0 HD1 TYR A 867 21.854 -1.019 -1.087 1.00 25.00 H new ATOM 0 HD2 TYR A 867 23.023 -2.430 2.820 1.00 25.00 H new ATOM 0 HE1 TYR A 867 22.491 1.311 -0.413 1.00 25.00 H new ATOM 0 HE2 TYR A 867 23.613 -0.111 3.485 1.00 25.00 H new ATOM 0 HH TYR A 867 22.587 2.560 1.993 1.00 25.00 H new ATOM 2048 N GLY A 875 19.877 -10.711 -0.392 1.00 25.00 N ATOM 2049 CA GLY A 875 18.506 -10.348 -0.071 1.00 25.00 C ATOM 2050 C GLY A 875 18.437 -9.156 0.875 1.00 25.00 C ATOM 2051 O GLY A 875 17.527 -9.060 1.691 1.00 25.00 O ATOM 0 HA2 GLY A 875 17.969 -10.113 -0.990 1.00 25.00 H new ATOM 0 HA3 GLY A 875 18.002 -11.201 0.384 1.00 25.00 H new ATOM 2055 N ALA A 876 19.400 -8.251 0.761 1.00 25.00 N ATOM 2056 CA ALA A 876 19.469 -7.028 1.560 1.00 25.00 C ATOM 2057 C ALA A 876 19.250 -5.843 0.625 1.00 25.00 C ATOM 2058 O ALA A 876 19.799 -5.815 -0.478 1.00 25.00 O ATOM 2059 CB ALA A 876 20.830 -6.915 2.225 1.00 25.00 C ATOM 0 H ALA A 876 20.171 -8.345 0.099 1.00 25.00 H new ATOM 0 HA ALA A 876 18.707 -7.044 2.339 1.00 25.00 H new ATOM 0 HB1 ALA A 876 20.871 -6.001 2.817 1.00 25.00 H new ATOM 0 HB2 ALA A 876 20.990 -7.776 2.874 1.00 25.00 H new ATOM 0 HB3 ALA A 876 21.607 -6.887 1.461 1.00 25.00 H new ATOM 2065 N LEU A 877 18.449 -4.883 1.055 1.00 25.00 N ATOM 2066 CA LEU A 877 18.151 -3.706 0.246 1.00 25.00 C ATOM 2067 C LEU A 877 18.063 -2.433 1.086 1.00 25.00 C ATOM 2068 O LEU A 877 17.757 -2.499 2.262 1.00 25.00 O ATOM 2069 CB LEU A 877 16.818 -3.919 -0.454 1.00 25.00 C ATOM 2070 CG LEU A 877 16.627 -5.181 -1.312 1.00 25.00 C ATOM 2071 CD1 LEU A 877 15.166 -5.548 -1.300 1.00 25.00 C ATOM 2072 CD2 LEU A 877 17.131 -4.984 -2.745 1.00 25.00 C ATOM 0 H LEU A 877 17.989 -4.893 1.965 1.00 25.00 H new ATOM 0 HA LEU A 877 18.963 -3.580 -0.470 1.00 25.00 H new ATOM 0 HB2 LEU A 877 16.040 -3.918 0.309 1.00 25.00 H new ATOM 0 HB3 LEU A 877 16.639 -3.055 -1.093 1.00 25.00 H new ATOM 0 HG LEU A 877 17.220 -5.991 -0.888 1.00 25.00 H new ATOM 0 HD11 LEU A 877 15.010 -6.442 -1.904 1.00 25.00 H new ATOM 0 HD12 LEU A 877 14.848 -5.742 -0.276 1.00 25.00 H new ATOM 0 HD13 LEU A 877 14.581 -4.726 -1.712 1.00 25.00 H new ATOM 0 HD21 LEU A 877 16.976 -5.900 -3.314 1.00 25.00 H new ATOM 0 HD22 LEU A 877 16.582 -4.168 -3.215 1.00 25.00 H new ATOM 0 HD23 LEU A 877 18.194 -4.743 -2.727 1.00 25.00 H new ATOM 2084 N ASP A 878 18.315 -1.275 0.495 1.00 25.00 N ATOM 2085 CA ASP A 878 18.219 -0.011 1.243 1.00 25.00 C ATOM 2086 C ASP A 878 16.820 0.554 1.215 1.00 25.00 C ATOM 2087 O ASP A 878 16.347 1.045 0.193 1.00 25.00 O ATOM 2088 CB ASP A 878 19.191 1.024 0.725 1.00 25.00 C ATOM 2089 CG ASP A 878 19.461 2.116 1.741 1.00 25.00 C ATOM 2090 OD1 ASP A 878 18.525 2.457 2.493 1.00 25.00 O ATOM 2091 OD2 ASP A 878 20.587 2.647 1.780 1.00 25.00 O ATOM 0 H ASP A 878 18.584 -1.174 -0.484 1.00 25.00 H new ATOM 0 HA ASP A 878 18.479 -0.249 2.275 1.00 25.00 H new ATOM 0 HB2 ASP A 878 20.129 0.537 0.459 1.00 25.00 H new ATOM 0 HB3 ASP A 878 18.793 1.469 -0.187 1.00 25.00 H new ATOM 2096 N TYR A 879 16.173 0.483 2.364 1.00 25.00 N ATOM 2097 CA TYR A 879 14.807 0.943 2.520 1.00 25.00 C ATOM 2098 C TYR A 879 14.674 2.458 2.301 1.00 25.00 C ATOM 2099 O TYR A 879 13.663 2.920 1.798 1.00 25.00 O ATOM 2100 CB TYR A 879 14.297 0.568 3.912 1.00 25.00 C ATOM 2101 CG TYR A 879 15.202 0.989 5.047 1.00 25.00 C ATOM 2102 CD1 TYR A 879 15.106 2.275 5.602 1.00 25.00 C ATOM 2103 CD2 TYR A 879 16.153 0.100 5.584 1.00 25.00 C ATOM 2104 CE1 TYR A 879 15.955 2.675 6.651 1.00 25.00 C ATOM 2105 CE2 TYR A 879 16.992 0.489 6.653 1.00 25.00 C ATOM 2106 CZ TYR A 879 16.890 1.776 7.173 1.00 25.00 C ATOM 2107 OH TYR A 879 17.704 2.153 8.208 1.00 25.00 O ATOM 0 H TYR A 879 16.582 0.103 3.218 1.00 25.00 H new ATOM 0 HA TYR A 879 14.203 0.453 1.756 1.00 25.00 H new ATOM 0 HB2 TYR A 879 13.316 1.020 4.060 1.00 25.00 H new ATOM 0 HB3 TYR A 879 14.160 -0.512 3.956 1.00 25.00 H new ATOM 0 HD1 TYR A 879 14.371 2.967 5.219 1.00 25.00 H new ATOM 0 HD2 TYR A 879 16.243 -0.895 5.173 1.00 25.00 H new ATOM 0 HE1 TYR A 879 15.884 3.675 7.052 1.00 25.00 H new ATOM 0 HE2 TYR A 879 17.708 -0.208 7.064 1.00 25.00 H new ATOM 0 HH TYR A 879 18.163 1.365 8.567 1.00 25.00 H new ATOM 2117 N MET A 880 15.686 3.221 2.703 1.00 25.00 N ATOM 2118 CA MET A 880 15.639 4.688 2.625 1.00 25.00 C ATOM 2119 C MET A 880 16.347 5.293 1.415 1.00 25.00 C ATOM 2120 O MET A 880 16.088 6.435 1.060 1.00 25.00 O ATOM 2121 CB MET A 880 16.171 5.298 3.925 1.00 25.00 C ATOM 2122 CG MET A 880 17.591 4.903 4.277 1.00 25.00 C ATOM 2123 SD MET A 880 18.097 5.511 5.897 1.00 25.00 S ATOM 2124 CE MET A 880 19.603 4.539 6.123 1.00 25.00 C ATOM 0 H MET A 880 16.555 2.851 3.089 1.00 25.00 H new ATOM 0 HA MET A 880 14.588 4.942 2.488 1.00 25.00 H new ATOM 0 HB2 MET A 880 16.119 6.384 3.848 1.00 25.00 H new ATOM 0 HB3 MET A 880 15.514 5.005 4.743 1.00 25.00 H new ATOM 0 HG2 MET A 880 17.678 3.817 4.257 1.00 25.00 H new ATOM 0 HG3 MET A 880 18.271 5.291 3.519 1.00 25.00 H new ATOM 0 HE1 MET A 880 20.055 4.787 7.083 1.00 25.00 H new ATOM 0 HE2 MET A 880 19.357 3.477 6.101 1.00 25.00 H new ATOM 0 HE3 MET A 880 20.306 4.766 5.321 1.00 25.00 H new ATOM 2134 N SER A 881 17.240 4.540 0.788 1.00 25.00 N ATOM 2135 CA SER A 881 17.956 5.024 -0.403 1.00 25.00 C ATOM 2136 C SER A 881 17.462 4.296 -1.645 1.00 25.00 C ATOM 2137 O SER A 881 18.138 4.269 -2.677 1.00 25.00 O ATOM 2138 CB SER A 881 19.468 4.845 -0.251 1.00 25.00 C ATOM 2139 OG SER A 881 20.165 5.544 -1.271 1.00 25.00 O ATOM 0 H SER A 881 17.491 3.594 1.076 1.00 25.00 H new ATOM 0 HA SER A 881 17.752 6.089 -0.510 1.00 25.00 H new ATOM 0 HB2 SER A 881 19.785 5.208 0.727 1.00 25.00 H new ATOM 0 HB3 SER A 881 19.719 3.785 -0.294 1.00 25.00 H new ATOM 0 HG SER A 881 19.710 5.411 -2.129 1.00 25.00 H new ATOM 2145 N PHE A 882 16.286 3.701 -1.526 1.00 25.00 N ATOM 2146 CA PHE A 882 15.636 3.008 -2.642 1.00 25.00 C ATOM 2147 C PHE A 882 15.495 3.860 -3.910 1.00 25.00 C ATOM 2148 O PHE A 882 15.543 5.090 -3.878 1.00 25.00 O ATOM 2149 CB PHE A 882 14.245 2.522 -2.205 1.00 25.00 C ATOM 2150 CG PHE A 882 13.178 3.581 -2.241 1.00 25.00 C ATOM 2151 CD1 PHE A 882 13.009 4.486 -1.177 1.00 25.00 C ATOM 2152 CD2 PHE A 882 12.313 3.664 -3.353 1.00 25.00 C ATOM 2153 CE1 PHE A 882 11.979 5.460 -1.216 1.00 25.00 C ATOM 2154 CE2 PHE A 882 11.286 4.628 -3.400 1.00 25.00 C ATOM 2155 CZ PHE A 882 11.115 5.522 -2.326 1.00 25.00 C ATOM 0 H PHE A 882 15.751 3.681 -0.658 1.00 25.00 H new ATOM 0 HA PHE A 882 16.286 2.172 -2.900 1.00 25.00 H new ATOM 0 HB2 PHE A 882 13.943 1.697 -2.850 1.00 25.00 H new ATOM 0 HB3 PHE A 882 14.313 2.126 -1.192 1.00 25.00 H new ATOM 0 HD1 PHE A 882 13.669 4.439 -0.324 1.00 25.00 H new ATOM 0 HD2 PHE A 882 12.440 2.980 -4.179 1.00 25.00 H new ATOM 0 HE1 PHE A 882 11.858 6.153 -0.396 1.00 25.00 H new ATOM 0 HE2 PHE A 882 10.632 4.681 -4.258 1.00 25.00 H new ATOM 0 HZ PHE A 882 10.322 6.255 -2.353 1.00 25.00 H new