USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=33 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+ -175:sc= -0.144 (180deg=-0.251) USER MOD Set 1.2: A 879 TYR OH : rot 160:sc= 1.24 USER MOD Set 1.3: A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 830 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 859 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 860 CYS SG : rot 20:sc= 1.22 USER MOD Set 3.1: A 808 THR OG1 : rot -62:sc= 0.138 USER MOD Set 3.2: A 810 GLN : amide:sc= 0.995 X(o=1.1,f=1) USER MOD Set 4.1: A 763 SER OG : rot -87:sc= 0.798 USER MOD Set 4.2: A 765 THR OG1 : rot 35:sc= 0.38 USER MOD Set 5.1: A 754 SER OG : rot -103:sc= 0.739 USER MOD Set 5.2: A 774 CYS SG : rot 180:sc= 0.634 USER MOD Set 6.1: A 742 SER OG : rot -34:sc= 0.874 USER MOD Set 6.2: A 817 SER OG : rot 99:sc= 0.751 USER MOD Single : A 744 SER OG : rot 138:sc= 0.662 USER MOD Single : A 745 GLN :FLIP amide:sc= 0 F(o=-0.74,f=0) USER MOD Single : A 747 GLN : amide:sc= -0.0912 X(o=-0.091,f=-0.2) USER MOD Single : A 748 MET CE :methyl 136:sc= -1.75 (180deg=-3.28!) USER MOD Single : A 749 ASN : amide:sc= 0.00119 X(o=0.0012,f=0) USER MOD Single : A 756 ASN : amide:sc= 0.263 K(o=0.26,f=-1.2) USER MOD Single : A 757 HIS : no HD1:sc= -0.312 K(o=-0.31,f=-0.96) USER MOD Single : A 762 HIS : no HE2:sc= -0.178 K(o=-0.18,f=-1.6) USER MOD Single : A 772 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0391) USER MOD Single : A 777 SER OG : rot 136:sc= 1.23 USER MOD Single : A 780 TYR OH : rot 180:sc= -0.163 USER MOD Single : A 784 ASN : amide:sc= -0.182 X(o=-0.18,f=-0.17) USER MOD Single : A 787 GLN : amide:sc= -0.378 X(o=-0.38,f=-0.087) USER MOD Single : A 796 MET CE :methyl -162:sc=-0.00726 (180deg=-0.339) USER MOD Single : A 797 SER OG : rot -30:sc= 0.064 USER MOD Single : A 802 ASN :FLIP amide:sc= 0 F(o=-1.6,f=0) USER MOD Single : A 816 MET CE :methyl -161:sc= -0.65 (180deg=-0.875) USER MOD Single : A 820 THR OG1 : rot -85:sc= 0.304 USER MOD Single : A 823 THR OG1 : rot 180:sc= -0.0124 USER MOD Single : A 825 THR OG1 : rot -160:sc= 0.971 USER MOD Single : A 828 GLN : amide:sc= -0.299 X(o=-0.3,f=-0.013) USER MOD Single : A 832 SER OG : rot 89:sc= 0.668 USER MOD Single : A 840 LYS NZ :NH3+ -172:sc= -0.0526 (180deg=-0.217) USER MOD Single : A 841 ASN : amide:sc= -0.406 K(o=-0.41,f=-2.6!) USER MOD Single : A 842 TYR OH : rot 180:sc= 0 USER MOD Single : A 844 THR OG1 : rot 180:sc= 0.314 USER MOD Single : A 845 MET CE :methyl -116:sc= -0.108 (180deg=-1.56!) USER MOD Single : A 856 GLN : amide:sc= -2.92! C(o=-2.9!,f=-4.7!) USER MOD Single : A 864 MET CE :methyl 138:sc= -0.388 (180deg=-0.884) USER MOD Single : A 867 TYR OH : rot 101:sc= 1.23 USER MOD Single : A 881 SER OG : rot -36:sc= 0.488 USER MOD ----------------------------------------------------------------- ATOM 21 N SER A 742 -1.404 -9.954 -6.297 1.00 25.00 N ATOM 22 CA SER A 742 -1.203 -8.565 -5.844 1.00 25.00 C ATOM 23 C SER A 742 -1.557 -8.408 -4.374 1.00 25.00 C ATOM 24 O SER A 742 -0.777 -7.883 -3.588 1.00 25.00 O ATOM 25 CB SER A 742 -2.042 -7.611 -6.695 1.00 25.00 C ATOM 26 OG SER A 742 -3.389 -8.064 -6.772 1.00 25.00 O ATOM 0 HA SER A 742 -0.148 -8.318 -5.963 1.00 25.00 H new ATOM 0 HB2 SER A 742 -2.013 -6.610 -6.265 1.00 25.00 H new ATOM 0 HB3 SER A 742 -1.618 -7.540 -7.697 1.00 25.00 H new ATOM 0 HG SER A 742 -3.405 -9.044 -6.767 1.00 25.00 H new ATOM 32 N ILE A 743 -2.731 -8.896 -4.007 1.00 25.00 N ATOM 33 CA ILE A 743 -3.136 -8.978 -2.637 1.00 25.00 C ATOM 34 C ILE A 743 -3.346 -10.421 -2.199 1.00 25.00 C ATOM 35 O ILE A 743 -3.832 -11.266 -2.959 1.00 25.00 O ATOM 36 CB ILE A 743 -4.373 -8.111 -2.413 1.00 25.00 C ATOM 37 CG1 ILE A 743 -3.977 -7.157 -1.325 1.00 25.00 C ATOM 38 CG2 ILE A 743 -5.659 -8.919 -2.141 1.00 25.00 C ATOM 39 CD1 ILE A 743 -5.094 -6.406 -0.650 1.00 25.00 C ATOM 0 H ILE A 743 -3.426 -9.246 -4.666 1.00 25.00 H new ATOM 0 HA ILE A 743 -2.336 -8.590 -2.007 1.00 25.00 H new ATOM 0 HB ILE A 743 -4.660 -7.568 -3.313 1.00 25.00 H new ATOM 0 HG12 ILE A 743 -3.432 -7.715 -0.564 1.00 25.00 H new ATOM 0 HG13 ILE A 743 -3.282 -6.430 -1.745 1.00 25.00 H new ATOM 0 HG21 ILE A 743 -6.494 -8.235 -1.992 1.00 25.00 H new ATOM 0 HG22 ILE A 743 -5.868 -9.567 -2.992 1.00 25.00 H new ATOM 0 HG23 ILE A 743 -5.524 -9.527 -1.246 1.00 25.00 H new ATOM 0 HD11 ILE A 743 -4.681 -5.750 0.116 1.00 25.00 H new ATOM 0 HD12 ILE A 743 -5.629 -5.809 -1.388 1.00 25.00 H new ATOM 0 HD13 ILE A 743 -5.782 -7.114 -0.188 1.00 25.00 H new ATOM 51 N SER A 744 -2.959 -10.700 -0.966 1.00 25.00 N ATOM 52 CA SER A 744 -3.149 -12.024 -0.377 1.00 25.00 C ATOM 53 C SER A 744 -4.405 -12.019 0.474 1.00 25.00 C ATOM 54 O SER A 744 -4.937 -10.957 0.807 1.00 25.00 O ATOM 55 CB SER A 744 -1.944 -12.430 0.474 1.00 25.00 C ATOM 56 OG SER A 744 -1.857 -11.639 1.642 1.00 25.00 O ATOM 0 H SER A 744 -2.508 -10.026 -0.347 1.00 25.00 H new ATOM 0 HA SER A 744 -3.250 -12.751 -1.183 1.00 25.00 H new ATOM 0 HB2 SER A 744 -2.026 -13.482 0.748 1.00 25.00 H new ATOM 0 HB3 SER A 744 -1.030 -12.324 -0.110 1.00 25.00 H new ATOM 0 HG SER A 744 -1.627 -12.208 2.406 1.00 25.00 H new ATOM 62 N GLN A 745 -4.868 -13.201 0.853 1.00 25.00 N ATOM 63 CA GLN A 745 -6.035 -13.310 1.723 1.00 25.00 C ATOM 64 C GLN A 745 -5.733 -12.678 3.076 1.00 25.00 C ATOM 65 O GLN A 745 -6.603 -12.097 3.700 1.00 25.00 O ATOM 66 CB GLN A 745 -6.424 -14.777 1.918 1.00 25.00 C ATOM 67 CG GLN A 745 -7.149 -15.388 0.721 1.00 25.00 C ATOM 68 CD GLN A 745 -8.664 -15.333 0.863 1.00 25.00 C ATOM 69 OE1 GLN A 745 -9.213 -14.149 0.974 1.00 25.00 O flip ATOM 70 NE2 GLN A 745 -9.324 -16.356 0.875 1.00 25.00 N flip ATOM 0 H GLN A 745 -4.459 -14.093 0.576 1.00 25.00 H new ATOM 0 HA GLN A 745 -6.867 -12.785 1.254 1.00 25.00 H new ATOM 0 HB2 GLN A 745 -5.524 -15.358 2.121 1.00 25.00 H new ATOM 0 HB3 GLN A 745 -7.062 -14.860 2.798 1.00 25.00 H new ATOM 0 HG2 GLN A 745 -6.853 -14.860 -0.186 1.00 25.00 H new ATOM 0 HG3 GLN A 745 -6.836 -16.425 0.603 1.00 25.00 H new ATOM 0 HE21 GLN A 745 -8.863 -17.261 0.786 1.00 25.00 H new ATOM 0 HE22 GLN A 745 -10.338 -16.308 0.974 1.00 25.00 H new ATOM 79 N GLU A 746 -4.493 -12.782 3.516 1.00 25.00 N ATOM 80 CA GLU A 746 -4.097 -12.217 4.802 1.00 25.00 C ATOM 81 C GLU A 746 -3.974 -10.712 4.726 1.00 25.00 C ATOM 82 O GLU A 746 -4.395 -10.014 5.640 1.00 25.00 O ATOM 83 CB GLU A 746 -2.786 -12.837 5.253 1.00 25.00 C ATOM 84 CG GLU A 746 -2.961 -14.293 5.618 1.00 25.00 C ATOM 85 CD GLU A 746 -1.643 -14.970 5.936 1.00 25.00 C ATOM 86 OE1 GLU A 746 -0.786 -15.036 5.028 1.00 25.00 O ATOM 87 OE2 GLU A 746 -1.467 -15.444 7.077 1.00 25.00 O ATOM 0 H GLU A 746 -3.742 -13.249 3.008 1.00 25.00 H new ATOM 0 HA GLU A 746 -4.872 -12.447 5.533 1.00 25.00 H new ATOM 0 HB2 GLU A 746 -2.046 -12.746 4.458 1.00 25.00 H new ATOM 0 HB3 GLU A 746 -2.399 -12.289 6.112 1.00 25.00 H new ATOM 0 HG2 GLU A 746 -3.624 -14.372 6.479 1.00 25.00 H new ATOM 0 HG3 GLU A 746 -3.446 -14.816 4.794 1.00 25.00 H new ATOM 94 N GLN A 747 -3.427 -10.206 3.631 1.00 25.00 N ATOM 95 CA GLN A 747 -3.291 -8.767 3.452 1.00 25.00 C ATOM 96 C GLN A 747 -4.649 -8.091 3.464 1.00 25.00 C ATOM 97 O GLN A 747 -4.821 -7.031 4.051 1.00 25.00 O ATOM 98 CB GLN A 747 -2.601 -8.454 2.125 1.00 25.00 C ATOM 99 CG GLN A 747 -2.309 -6.972 1.918 1.00 25.00 C ATOM 100 CD GLN A 747 -1.355 -6.443 2.945 1.00 25.00 C ATOM 101 OE1 GLN A 747 -0.160 -6.635 2.835 1.00 25.00 O ATOM 102 NE2 GLN A 747 -1.881 -5.794 3.947 1.00 25.00 N ATOM 0 H GLN A 747 -3.072 -10.766 2.856 1.00 25.00 H new ATOM 0 HA GLN A 747 -2.689 -8.389 4.278 1.00 25.00 H new ATOM 0 HB2 GLN A 747 -1.665 -9.010 2.073 1.00 25.00 H new ATOM 0 HB3 GLN A 747 -3.228 -8.809 1.307 1.00 25.00 H new ATOM 0 HG2 GLN A 747 -1.892 -6.819 0.922 1.00 25.00 H new ATOM 0 HG3 GLN A 747 -3.241 -6.408 1.963 1.00 25.00 H new ATOM 0 HE21 GLN A 747 -2.891 -5.659 3.993 1.00 25.00 H new ATOM 0 HE22 GLN A 747 -1.282 -5.421 4.684 1.00 25.00 H new ATOM 111 N MET A 748 -5.636 -8.703 2.825 1.00 25.00 N ATOM 112 CA MET A 748 -6.955 -8.091 2.765 1.00 25.00 C ATOM 113 C MET A 748 -7.615 -8.254 4.121 1.00 25.00 C ATOM 114 O MET A 748 -8.510 -7.508 4.469 1.00 25.00 O ATOM 115 CB MET A 748 -7.826 -8.690 1.655 1.00 25.00 C ATOM 116 CG MET A 748 -8.153 -10.141 1.805 1.00 25.00 C ATOM 117 SD MET A 748 -9.702 -10.603 0.987 1.00 25.00 S ATOM 118 CE MET A 748 -9.508 -9.853 -0.647 1.00 25.00 C ATOM 0 H MET A 748 -5.553 -9.602 2.351 1.00 25.00 H new ATOM 0 HA MET A 748 -6.843 -7.034 2.522 1.00 25.00 H new ATOM 0 HB2 MET A 748 -8.759 -8.128 1.607 1.00 25.00 H new ATOM 0 HB3 MET A 748 -7.318 -8.547 0.701 1.00 25.00 H new ATOM 0 HG2 MET A 748 -7.339 -10.736 1.392 1.00 25.00 H new ATOM 0 HG3 MET A 748 -8.221 -10.385 2.865 1.00 25.00 H new ATOM 0 HE1 MET A 748 -9.828 -10.560 -1.412 1.00 25.00 H new ATOM 0 HE2 MET A 748 -10.118 -8.952 -0.708 1.00 25.00 H new ATOM 0 HE3 MET A 748 -8.461 -9.594 -0.807 1.00 25.00 H new ATOM 128 N ASN A 749 -7.160 -9.231 4.890 1.00 25.00 N ATOM 129 CA ASN A 749 -7.736 -9.494 6.197 1.00 25.00 C ATOM 130 C ASN A 749 -7.264 -8.471 7.220 1.00 25.00 C ATOM 131 O ASN A 749 -8.042 -8.026 8.048 1.00 25.00 O ATOM 132 CB ASN A 749 -7.419 -10.920 6.657 1.00 25.00 C ATOM 133 CG ASN A 749 -7.098 -11.003 8.128 1.00 25.00 C ATOM 134 OD1 ASN A 749 -7.983 -11.079 8.967 1.00 25.00 O ATOM 135 ND2 ASN A 749 -5.829 -11.000 8.443 1.00 25.00 N ATOM 0 H ASN A 749 -6.395 -9.853 4.631 1.00 25.00 H new ATOM 0 HA ASN A 749 -8.819 -9.402 6.111 1.00 25.00 H new ATOM 0 HB2 ASN A 749 -8.270 -11.565 6.439 1.00 25.00 H new ATOM 0 HB3 ASN A 749 -6.575 -11.302 6.084 1.00 25.00 H new ATOM 0 HD21 ASN A 749 -5.546 -11.063 9.421 1.00 25.00 H new ATOM 0 HD22 ASN A 749 -5.122 -10.935 7.711 1.00 25.00 H new ATOM 142 N GLU A 750 -6.007 -8.074 7.168 1.00 25.00 N ATOM 143 CA GLU A 750 -5.546 -7.032 8.080 1.00 25.00 C ATOM 144 C GLU A 750 -5.991 -5.657 7.565 1.00 25.00 C ATOM 145 O GLU A 750 -6.383 -4.799 8.343 1.00 25.00 O ATOM 146 CB GLU A 750 -4.030 -7.093 8.284 1.00 25.00 C ATOM 147 CG GLU A 750 -3.209 -6.964 7.022 1.00 25.00 C ATOM 148 CD GLU A 750 -1.737 -7.043 7.308 1.00 25.00 C ATOM 149 OE1 GLU A 750 -1.295 -8.057 7.889 1.00 25.00 O ATOM 150 OE2 GLU A 750 -1.024 -6.086 6.959 1.00 25.00 O ATOM 0 H GLU A 750 -5.302 -8.440 6.528 1.00 25.00 H new ATOM 0 HA GLU A 750 -6.000 -7.200 9.057 1.00 25.00 H new ATOM 0 HB2 GLU A 750 -3.739 -6.299 8.971 1.00 25.00 H new ATOM 0 HB3 GLU A 750 -3.781 -8.039 8.766 1.00 25.00 H new ATOM 0 HG2 GLU A 750 -3.487 -7.754 6.324 1.00 25.00 H new ATOM 0 HG3 GLU A 750 -3.435 -6.015 6.536 1.00 25.00 H new ATOM 157 N PHE A 751 -5.961 -5.449 6.255 1.00 25.00 N ATOM 158 CA PHE A 751 -6.352 -4.164 5.686 1.00 25.00 C ATOM 159 C PHE A 751 -7.844 -3.877 5.852 1.00 25.00 C ATOM 160 O PHE A 751 -8.257 -2.724 5.942 1.00 25.00 O ATOM 161 CB PHE A 751 -5.971 -4.095 4.215 1.00 25.00 C ATOM 162 CG PHE A 751 -6.410 -2.829 3.548 1.00 25.00 C ATOM 163 CD1 PHE A 751 -6.034 -1.572 4.049 1.00 25.00 C ATOM 164 CD2 PHE A 751 -7.225 -2.885 2.414 1.00 25.00 C ATOM 165 CE1 PHE A 751 -6.481 -0.387 3.420 1.00 25.00 C ATOM 166 CE2 PHE A 751 -7.656 -1.717 1.771 1.00 25.00 C ATOM 167 CZ PHE A 751 -7.291 -0.460 2.273 1.00 25.00 C ATOM 0 H PHE A 751 -5.672 -6.147 5.570 1.00 25.00 H new ATOM 0 HA PHE A 751 -5.810 -3.397 6.240 1.00 25.00 H new ATOM 0 HB2 PHE A 751 -4.889 -4.190 4.122 1.00 25.00 H new ATOM 0 HB3 PHE A 751 -6.411 -4.944 3.693 1.00 25.00 H new ATOM 0 HD1 PHE A 751 -5.399 -1.510 4.921 1.00 25.00 H new ATOM 0 HD2 PHE A 751 -7.528 -3.846 2.026 1.00 25.00 H new ATOM 0 HE1 PHE A 751 -6.200 0.575 3.821 1.00 25.00 H new ATOM 0 HE2 PHE A 751 -8.271 -1.785 0.886 1.00 25.00 H new ATOM 0 HZ PHE A 751 -7.628 0.442 1.784 1.00 25.00 H new ATOM 177 N ARG A 752 -8.669 -4.913 5.930 1.00 25.00 N ATOM 178 CA ARG A 752 -10.100 -4.715 6.161 1.00 25.00 C ATOM 179 C ARG A 752 -10.298 -4.034 7.506 1.00 25.00 C ATOM 180 O ARG A 752 -11.335 -3.468 7.715 1.00 25.00 O ATOM 181 CB ARG A 752 -10.874 -6.052 6.129 1.00 25.00 C ATOM 182 CG ARG A 752 -10.760 -6.910 7.364 1.00 25.00 C ATOM 183 CD ARG A 752 -11.983 -6.813 8.254 1.00 25.00 C ATOM 184 NE ARG A 752 -11.788 -7.612 9.472 1.00 25.00 N ATOM 185 CZ ARG A 752 -12.617 -7.648 10.507 1.00 25.00 C ATOM 186 NH1 ARG A 752 -13.723 -6.941 10.543 1.00 25.00 N ATOM 187 NH2 ARG A 752 -12.326 -8.409 11.525 1.00 25.00 N ATOM 0 H ARG A 752 -8.381 -5.887 5.839 1.00 25.00 H new ATOM 0 HA ARG A 752 -10.493 -4.088 5.361 1.00 25.00 H new ATOM 0 HB2 ARG A 752 -11.928 -5.835 5.957 1.00 25.00 H new ATOM 0 HB3 ARG A 752 -10.524 -6.631 5.274 1.00 25.00 H new ATOM 0 HG2 ARG A 752 -10.611 -7.949 7.068 1.00 25.00 H new ATOM 0 HG3 ARG A 752 -9.878 -6.611 7.930 1.00 25.00 H new ATOM 0 HD2 ARG A 752 -12.168 -5.772 8.519 1.00 25.00 H new ATOM 0 HD3 ARG A 752 -12.863 -7.166 7.716 1.00 25.00 H new ATOM 0 HE ARG A 752 -10.946 -8.186 9.526 1.00 25.00 H new ATOM 0 HH11 ARG A 752 -13.969 -6.338 9.758 1.00 25.00 H new ATOM 0 HH12 ARG A 752 -14.336 -6.994 11.356 1.00 25.00 H new ATOM 0 HH21 ARG A 752 -11.471 -8.966 11.518 1.00 25.00 H new ATOM 0 HH22 ARG A 752 -12.953 -8.448 12.329 1.00 25.00 H new ATOM 201 N ALA A 753 -9.323 -4.079 8.413 1.00 25.00 N ATOM 202 CA ALA A 753 -9.451 -3.424 9.718 1.00 25.00 C ATOM 203 C ALA A 753 -9.417 -1.907 9.553 1.00 25.00 C ATOM 204 O ALA A 753 -9.923 -1.177 10.401 1.00 25.00 O ATOM 205 CB ALA A 753 -8.336 -3.878 10.648 1.00 25.00 C ATOM 0 H ALA A 753 -8.436 -4.561 8.270 1.00 25.00 H new ATOM 0 HA ALA A 753 -10.408 -3.706 10.158 1.00 25.00 H new ATOM 0 HB1 ALA A 753 -8.444 -3.384 11.613 1.00 25.00 H new ATOM 0 HB2 ALA A 753 -8.393 -4.958 10.785 1.00 25.00 H new ATOM 0 HB3 ALA A 753 -7.371 -3.618 10.213 1.00 25.00 H new ATOM 211 N SER A 754 -8.853 -1.428 8.454 1.00 25.00 N ATOM 212 CA SER A 754 -8.833 0.004 8.181 1.00 25.00 C ATOM 213 C SER A 754 -10.264 0.536 8.044 1.00 25.00 C ATOM 214 O SER A 754 -10.507 1.737 8.156 1.00 25.00 O ATOM 215 CB SER A 754 -7.999 0.327 6.941 1.00 25.00 C ATOM 216 OG SER A 754 -7.324 1.560 7.117 1.00 25.00 O ATOM 0 H SER A 754 -8.406 -2.004 7.741 1.00 25.00 H new ATOM 0 HA SER A 754 -8.358 0.505 9.024 1.00 25.00 H new ATOM 0 HB2 SER A 754 -7.277 -0.469 6.761 1.00 25.00 H new ATOM 0 HB3 SER A 754 -8.643 0.378 6.063 1.00 25.00 H new ATOM 0 HG SER A 754 -7.785 2.261 6.611 1.00 25.00 H new ATOM 222 N PHE A 755 -11.213 -0.377 7.851 1.00 25.00 N ATOM 223 CA PHE A 755 -12.643 -0.028 7.824 1.00 25.00 C ATOM 224 C PHE A 755 -13.113 0.677 9.091 1.00 25.00 C ATOM 225 O PHE A 755 -14.109 1.375 9.061 1.00 25.00 O ATOM 226 CB PHE A 755 -13.524 -1.262 7.580 1.00 25.00 C ATOM 227 CG PHE A 755 -13.988 -1.980 8.856 1.00 25.00 C ATOM 228 CD1 PHE A 755 -13.081 -2.522 9.791 1.00 25.00 C ATOM 229 CD2 PHE A 755 -15.353 -2.120 9.104 1.00 25.00 C ATOM 230 CE1 PHE A 755 -13.542 -3.212 10.942 1.00 25.00 C ATOM 231 CE2 PHE A 755 -15.831 -2.795 10.254 1.00 25.00 C ATOM 232 CZ PHE A 755 -14.921 -3.346 11.171 1.00 25.00 C ATOM 0 H PHE A 755 -11.023 -1.369 7.710 1.00 25.00 H new ATOM 0 HA PHE A 755 -12.751 0.668 6.992 1.00 25.00 H new ATOM 0 HB2 PHE A 755 -14.402 -0.958 7.010 1.00 25.00 H new ATOM 0 HB3 PHE A 755 -12.972 -1.969 6.961 1.00 25.00 H new ATOM 0 HD1 PHE A 755 -12.019 -2.410 9.628 1.00 25.00 H new ATOM 0 HD2 PHE A 755 -16.062 -1.704 8.403 1.00 25.00 H new ATOM 0 HE1 PHE A 755 -12.834 -3.633 11.640 1.00 25.00 H new ATOM 0 HE2 PHE A 755 -16.893 -2.886 10.425 1.00 25.00 H new ATOM 0 HZ PHE A 755 -15.279 -3.869 12.046 1.00 25.00 H new ATOM 242 N ASN A 756 -12.407 0.474 10.200 1.00 25.00 N ATOM 243 CA ASN A 756 -12.746 1.140 11.460 1.00 25.00 C ATOM 244 C ASN A 756 -11.685 2.171 11.860 1.00 25.00 C ATOM 245 O ASN A 756 -11.926 3.005 12.715 1.00 25.00 O ATOM 246 CB ASN A 756 -12.956 0.105 12.584 1.00 25.00 C ATOM 247 CG ASN A 756 -11.661 -0.391 13.200 1.00 25.00 C ATOM 248 OD1 ASN A 756 -10.988 0.306 13.928 1.00 25.00 O ATOM 249 ND2 ASN A 756 -11.325 -1.615 12.920 1.00 25.00 N ATOM 0 H ASN A 756 -11.598 -0.145 10.255 1.00 25.00 H new ATOM 0 HA ASN A 756 -13.681 1.678 11.306 1.00 25.00 H new ATOM 0 HB2 ASN A 756 -13.574 0.549 13.365 1.00 25.00 H new ATOM 0 HB3 ASN A 756 -13.509 -0.746 12.185 1.00 25.00 H new ATOM 0 HD21 ASN A 756 -10.474 -2.014 13.317 1.00 25.00 H new ATOM 0 HD22 ASN A 756 -11.912 -2.177 12.304 1.00 25.00 H new ATOM 256 N HIS A 757 -10.514 2.095 11.239 1.00 25.00 N ATOM 257 CA HIS A 757 -9.375 2.939 11.624 1.00 25.00 C ATOM 258 C HIS A 757 -9.607 4.422 11.357 1.00 25.00 C ATOM 259 O HIS A 757 -9.375 5.264 12.216 1.00 25.00 O ATOM 260 CB HIS A 757 -8.129 2.494 10.850 1.00 25.00 C ATOM 261 CG HIS A 757 -6.849 3.060 11.383 1.00 25.00 C ATOM 262 ND1 HIS A 757 -6.531 4.396 11.404 1.00 25.00 N ATOM 263 CD2 HIS A 757 -5.766 2.435 11.925 1.00 25.00 C ATOM 264 CE1 HIS A 757 -5.319 4.530 11.928 1.00 25.00 C ATOM 265 NE2 HIS A 757 -4.807 3.366 12.273 1.00 25.00 N ATOM 0 H HIS A 757 -10.322 1.459 10.465 1.00 25.00 H new ATOM 0 HA HIS A 757 -9.244 2.816 12.699 1.00 25.00 H new ATOM 0 HB2 HIS A 757 -8.070 1.406 10.871 1.00 25.00 H new ATOM 0 HB3 HIS A 757 -8.238 2.788 9.806 1.00 25.00 H new ATOM 0 HD2 HIS A 757 -5.671 1.368 12.062 1.00 25.00 H new ATOM 0 HE1 HIS A 757 -4.815 5.476 12.056 1.00 25.00 H new ATOM 0 HE2 HIS A 757 -3.899 3.191 12.704 1.00 25.00 H new ATOM 273 N PHE A 758 -10.048 4.743 10.151 1.00 25.00 N ATOM 274 CA PHE A 758 -10.276 6.138 9.770 1.00 25.00 C ATOM 275 C PHE A 758 -11.746 6.468 9.765 1.00 25.00 C ATOM 276 O PHE A 758 -12.140 7.586 9.427 1.00 25.00 O ATOM 277 CB PHE A 758 -9.702 6.401 8.387 1.00 25.00 C ATOM 278 CG PHE A 758 -8.368 7.072 8.415 1.00 25.00 C ATOM 279 CD1 PHE A 758 -7.188 6.312 8.502 1.00 25.00 C ATOM 280 CD2 PHE A 758 -8.281 8.473 8.341 1.00 25.00 C ATOM 281 CE1 PHE A 758 -5.926 6.945 8.517 1.00 25.00 C ATOM 282 CE2 PHE A 758 -7.023 9.119 8.354 1.00 25.00 C ATOM 283 CZ PHE A 758 -5.845 8.353 8.441 1.00 25.00 C ATOM 0 H PHE A 758 -10.256 4.064 9.419 1.00 25.00 H new ATOM 0 HA PHE A 758 -9.778 6.770 10.505 1.00 25.00 H new ATOM 0 HB2 PHE A 758 -9.613 5.455 7.853 1.00 25.00 H new ATOM 0 HB3 PHE A 758 -10.400 7.021 7.824 1.00 25.00 H new ATOM 0 HD1 PHE A 758 -7.248 5.235 8.558 1.00 25.00 H new ATOM 0 HD2 PHE A 758 -9.184 9.062 8.274 1.00 25.00 H new ATOM 0 HE1 PHE A 758 -5.025 6.354 8.586 1.00 25.00 H new ATOM 0 HE2 PHE A 758 -6.966 10.196 8.297 1.00 25.00 H new ATOM 0 HZ PHE A 758 -4.882 8.841 8.450 1.00 25.00 H new ATOM 293 N ASP A 759 -12.555 5.481 10.118 1.00 25.00 N ATOM 294 CA ASP A 759 -14.005 5.634 10.137 1.00 25.00 C ATOM 295 C ASP A 759 -14.442 6.772 11.023 1.00 25.00 C ATOM 296 O ASP A 759 -14.445 6.676 12.243 1.00 25.00 O ATOM 297 CB ASP A 759 -14.678 4.337 10.527 1.00 25.00 C ATOM 298 CG ASP A 759 -16.109 4.266 10.036 1.00 25.00 C ATOM 299 OD1 ASP A 759 -16.673 5.307 9.638 1.00 50.00 O ATOM 300 OD2 ASP A 759 -16.684 3.177 10.032 1.00 50.00 O ATOM 0 H ASP A 759 -12.229 4.556 10.398 1.00 25.00 H new ATOM 0 HA ASP A 759 -14.320 5.886 9.125 1.00 25.00 H new ATOM 0 HB2 ASP A 759 -14.113 3.499 10.118 1.00 25.00 H new ATOM 0 HB3 ASP A 759 -14.662 4.233 11.612 1.00 25.00 H new ATOM 305 N ARG A 760 -14.801 7.870 10.374 1.00 25.00 N ATOM 306 CA ARG A 760 -15.126 9.109 11.092 1.00 25.00 C ATOM 307 C ARG A 760 -16.219 8.959 12.076 1.00 25.00 C ATOM 308 O ARG A 760 -16.197 9.600 13.116 1.00 25.00 O ATOM 309 CB ARG A 760 -15.550 10.217 10.147 1.00 25.00 C ATOM 310 CG ARG A 760 -14.470 10.720 9.395 1.00 25.00 C ATOM 311 CD ARG A 760 -15.048 11.796 8.546 1.00 25.00 C ATOM 312 NE ARG A 760 -14.181 12.206 7.425 1.00 25.00 N ATOM 313 CZ ARG A 760 -13.146 13.031 7.504 1.00 25.00 C ATOM 314 NH1 ARG A 760 -12.760 13.575 8.634 1.00 25.00 N ATOM 315 NH2 ARG A 760 -12.484 13.314 6.418 1.00 25.00 N ATOM 0 H ARG A 760 -14.876 7.936 9.359 1.00 25.00 H new ATOM 0 HA ARG A 760 -14.200 9.358 11.610 1.00 25.00 H new ATOM 0 HB2 ARG A 760 -16.317 9.841 9.470 1.00 25.00 H new ATOM 0 HB3 ARG A 760 -16.000 11.028 10.720 1.00 25.00 H new ATOM 0 HG2 ARG A 760 -13.687 11.110 10.045 1.00 25.00 H new ATOM 0 HG3 ARG A 760 -14.018 9.938 8.785 1.00 25.00 H new ATOM 0 HD2 ARG A 760 -16.004 11.456 8.147 1.00 25.00 H new ATOM 0 HD3 ARG A 760 -15.254 12.666 9.170 1.00 25.00 H new ATOM 0 HE ARG A 760 -14.397 11.820 6.506 1.00 25.00 H new ATOM 0 HH11 ARG A 760 -13.262 13.368 9.497 1.00 25.00 H new ATOM 0 HH12 ARG A 760 -11.958 14.205 8.649 1.00 25.00 H new ATOM 0 HH21 ARG A 760 -12.765 12.903 5.528 1.00 25.00 H new ATOM 0 HH22 ARG A 760 -11.685 13.947 6.458 1.00 25.00 H new ATOM 329 N ASP A 761 -17.192 8.137 11.740 1.00 25.00 N ATOM 330 CA ASP A 761 -18.319 7.963 12.618 1.00 25.00 C ATOM 331 C ASP A 761 -18.376 6.537 13.139 1.00 25.00 C ATOM 332 O ASP A 761 -19.339 6.158 13.791 1.00 25.00 O ATOM 333 CB ASP A 761 -19.634 8.340 11.927 1.00 25.00 C ATOM 334 CG ASP A 761 -19.926 7.480 10.721 1.00 25.00 C ATOM 335 OD1 ASP A 761 -19.197 6.499 10.510 1.00 50.00 O ATOM 336 OD2 ASP A 761 -20.851 7.772 9.951 1.00 50.00 O ATOM 0 H ASP A 761 -17.222 7.590 10.880 1.00 25.00 H new ATOM 0 HA ASP A 761 -18.186 8.637 13.464 1.00 25.00 H new ATOM 0 HB2 ASP A 761 -20.453 8.249 12.640 1.00 25.00 H new ATOM 0 HB3 ASP A 761 -19.592 9.385 11.621 1.00 25.00 H new ATOM 341 N HIS A 762 -17.350 5.755 12.805 1.00 25.00 N ATOM 342 CA HIS A 762 -17.254 4.338 13.192 1.00 25.00 C ATOM 343 C HIS A 762 -18.497 3.486 12.849 1.00 25.00 C ATOM 344 O HIS A 762 -18.828 2.514 13.534 1.00 25.00 O ATOM 345 CB HIS A 762 -16.758 4.153 14.650 1.00 25.00 C ATOM 346 CG HIS A 762 -17.722 4.601 15.709 1.00 25.00 C ATOM 347 ND1 HIS A 762 -18.908 3.977 15.994 1.00 25.00 N ATOM 348 CD2 HIS A 762 -17.656 5.646 16.582 1.00 25.00 C ATOM 349 CE1 HIS A 762 -19.496 4.629 16.991 1.00 25.00 C ATOM 350 NE2 HIS A 762 -18.773 5.654 17.396 1.00 25.00 N ATOM 0 H HIS A 762 -16.556 6.083 12.256 1.00 25.00 H new ATOM 0 HA HIS A 762 -16.477 3.925 12.549 1.00 25.00 H new ATOM 0 HB2 HIS A 762 -16.530 3.099 14.809 1.00 25.00 H new ATOM 0 HB3 HIS A 762 -15.825 4.703 14.773 1.00 25.00 H new ATOM 0 HD1 HIS A 762 -19.277 3.152 15.521 1.00 25.00 H new ATOM 0 HD2 HIS A 762 -16.849 6.362 16.630 1.00 25.00 H new ATOM 0 HE1 HIS A 762 -20.449 4.353 17.417 1.00 25.00 H new ATOM 358 N SER A 763 -19.160 3.844 11.755 1.00 25.00 N ATOM 359 CA SER A 763 -20.321 3.120 11.246 1.00 25.00 C ATOM 360 C SER A 763 -19.979 1.708 10.752 1.00 25.00 C ATOM 361 O SER A 763 -20.866 0.897 10.505 1.00 25.00 O ATOM 362 CB SER A 763 -20.939 3.925 10.095 1.00 25.00 C ATOM 363 OG SER A 763 -20.003 4.150 9.032 1.00 25.00 O ATOM 0 H SER A 763 -18.904 4.654 11.190 1.00 25.00 H new ATOM 0 HA SER A 763 -21.023 3.005 12.072 1.00 25.00 H new ATOM 0 HB2 SER A 763 -21.808 3.393 9.706 1.00 25.00 H new ATOM 0 HB3 SER A 763 -21.295 4.883 10.473 1.00 25.00 H new ATOM 0 HG SER A 763 -19.490 4.965 9.215 1.00 25.00 H new ATOM 369 N GLY A 764 -18.694 1.425 10.597 1.00 25.00 N ATOM 370 CA GLY A 764 -18.242 0.116 10.152 1.00 25.00 C ATOM 371 C GLY A 764 -18.112 0.150 8.651 1.00 25.00 C ATOM 372 O GLY A 764 -18.033 -0.876 7.983 1.00 25.00 O ATOM 0 H GLY A 764 -17.941 2.090 10.774 1.00 25.00 H new ATOM 0 HA2 GLY A 764 -17.285 -0.132 10.611 1.00 25.00 H new ATOM 0 HA3 GLY A 764 -18.951 -0.655 10.455 1.00 25.00 H new ATOM 376 N THR A 765 -18.116 1.364 8.127 1.00 25.00 N ATOM 377 CA THR A 765 -18.006 1.629 6.701 1.00 25.00 C ATOM 378 C THR A 765 -17.478 3.050 6.518 1.00 25.00 C ATOM 379 O THR A 765 -17.950 3.973 7.192 1.00 25.00 O ATOM 380 CB THR A 765 -19.379 1.575 6.033 1.00 25.00 C ATOM 381 OG1 THR A 765 -20.362 2.087 6.942 1.00 25.00 O ATOM 382 CG2 THR A 765 -19.779 0.164 5.643 1.00 25.00 C ATOM 0 H THR A 765 -18.197 2.210 8.691 1.00 25.00 H new ATOM 0 HA THR A 765 -17.348 0.882 6.258 1.00 25.00 H new ATOM 0 HB THR A 765 -19.322 2.174 5.124 1.00 25.00 H new ATOM 0 HG1 THR A 765 -19.971 2.813 7.471 1.00 25.00 H new ATOM 0 HG21 THR A 765 -20.762 0.181 5.173 1.00 25.00 H new ATOM 0 HG22 THR A 765 -19.049 -0.241 4.942 1.00 25.00 H new ATOM 0 HG23 THR A 765 -19.814 -0.464 6.534 1.00 25.00 H new ATOM 390 N LEU A 766 -16.537 3.282 5.620 1.00 25.00 N ATOM 391 CA LEU A 766 -16.060 4.660 5.417 1.00 25.00 C ATOM 392 C LEU A 766 -16.959 5.306 4.372 1.00 25.00 C ATOM 393 O LEU A 766 -17.187 4.738 3.358 1.00 25.00 O ATOM 394 CB LEU A 766 -14.595 4.710 4.945 1.00 25.00 C ATOM 395 CG LEU A 766 -13.464 4.772 6.003 1.00 25.00 C ATOM 396 CD1 LEU A 766 -13.592 5.988 6.774 1.00 25.00 C ATOM 397 CD2 LEU A 766 -13.427 3.578 6.923 1.00 25.00 C ATOM 0 H LEU A 766 -16.095 2.573 5.035 1.00 25.00 H new ATOM 0 HA LEU A 766 -16.101 5.192 6.367 1.00 25.00 H new ATOM 0 HB2 LEU A 766 -14.419 3.830 4.327 1.00 25.00 H new ATOM 0 HB3 LEU A 766 -14.488 5.581 4.298 1.00 25.00 H new ATOM 0 HG LEU A 766 -12.521 4.761 5.456 1.00 25.00 H new ATOM 0 HD11 LEU A 766 -12.797 6.032 7.518 1.00 25.00 H new ATOM 0 HD12 LEU A 766 -13.516 6.849 6.110 1.00 25.00 H new ATOM 0 HD13 LEU A 766 -14.560 6.001 7.276 1.00 25.00 H new ATOM 0 HD21 LEU A 766 -12.610 3.693 7.635 1.00 25.00 H new ATOM 0 HD22 LEU A 766 -14.371 3.505 7.462 1.00 25.00 H new ATOM 0 HD23 LEU A 766 -13.273 2.672 6.337 1.00 25.00 H new ATOM 409 N GLY A 767 -17.483 6.491 4.620 1.00 25.00 N ATOM 410 CA GLY A 767 -18.334 7.158 3.646 1.00 25.00 C ATOM 411 C GLY A 767 -17.469 7.860 2.637 1.00 25.00 C ATOM 412 O GLY A 767 -16.292 7.655 2.660 1.00 25.00 O ATOM 0 H GLY A 767 -17.337 7.013 5.484 1.00 25.00 H new ATOM 0 HA2 GLY A 767 -18.978 6.432 3.149 1.00 25.00 H new ATOM 0 HA3 GLY A 767 -18.987 7.874 4.145 1.00 25.00 H new ATOM 416 N PRO A 768 -17.996 8.696 1.753 1.00 25.00 N ATOM 417 CA PRO A 768 -17.168 9.326 0.715 1.00 25.00 C ATOM 418 C PRO A 768 -16.035 10.230 1.237 1.00 25.00 C ATOM 419 O PRO A 768 -14.867 9.993 0.934 1.00 25.00 O ATOM 420 CB PRO A 768 -18.201 10.103 -0.108 1.00 25.00 C ATOM 421 CG PRO A 768 -19.328 10.319 0.827 1.00 25.00 C ATOM 422 CD PRO A 768 -19.401 9.096 1.658 1.00 25.00 C ATOM 0 HA PRO A 768 -16.607 8.583 0.148 1.00 25.00 H new ATOM 0 HB2 PRO A 768 -17.794 11.049 -0.466 1.00 25.00 H new ATOM 0 HB3 PRO A 768 -18.515 9.539 -0.986 1.00 25.00 H new ATOM 0 HG2 PRO A 768 -19.161 11.202 1.444 1.00 25.00 H new ATOM 0 HG3 PRO A 768 -20.260 10.480 0.286 1.00 25.00 H new ATOM 0 HD2 PRO A 768 -19.834 9.296 2.638 1.00 25.00 H new ATOM 0 HD3 PRO A 768 -20.013 8.324 1.191 1.00 25.00 H new ATOM 430 N GLU A 769 -16.353 11.248 2.031 1.00 25.00 N ATOM 431 CA GLU A 769 -15.332 12.173 2.554 1.00 25.00 C ATOM 432 C GLU A 769 -14.483 11.456 3.587 1.00 25.00 C ATOM 433 O GLU A 769 -13.403 11.908 3.980 1.00 25.00 O ATOM 434 CB GLU A 769 -15.949 13.410 3.221 1.00 25.00 C ATOM 435 CG GLU A 769 -16.991 14.151 2.381 1.00 25.00 C ATOM 436 CD GLU A 769 -18.359 13.484 2.423 1.00 25.00 C ATOM 437 OE1 GLU A 769 -18.571 12.600 3.291 1.00 25.00 O ATOM 438 OE2 GLU A 769 -19.214 13.824 1.588 1.00 25.00 O ATOM 0 H GLU A 769 -17.305 11.460 2.330 1.00 25.00 H new ATOM 0 HA GLU A 769 -14.734 12.502 1.704 1.00 25.00 H new ATOM 0 HB2 GLU A 769 -16.412 13.104 4.159 1.00 25.00 H new ATOM 0 HB3 GLU A 769 -15.148 14.105 3.473 1.00 25.00 H new ATOM 0 HG2 GLU A 769 -17.080 15.176 2.740 1.00 25.00 H new ATOM 0 HG3 GLU A 769 -16.648 14.204 1.348 1.00 25.00 H new ATOM 445 N GLU A 770 -14.997 10.336 4.054 1.00 25.00 N ATOM 446 CA GLU A 770 -14.288 9.549 5.058 1.00 25.00 C ATOM 447 C GLU A 770 -13.277 8.617 4.358 1.00 25.00 C ATOM 448 O GLU A 770 -12.116 8.537 4.744 1.00 25.00 O ATOM 449 CB GLU A 770 -15.244 8.709 5.912 1.00 25.00 C ATOM 450 CG GLU A 770 -16.600 9.279 6.330 1.00 25.00 C ATOM 451 CD GLU A 770 -17.361 8.235 7.174 1.00 25.00 C ATOM 452 OE1 GLU A 770 -16.797 7.708 8.135 1.00 50.00 O ATOM 453 OE2 GLU A 770 -18.507 7.883 6.863 1.00 50.00 O ATOM 0 H GLU A 770 -15.894 9.948 3.762 1.00 25.00 H new ATOM 0 HA GLU A 770 -13.773 10.244 5.721 1.00 25.00 H new ATOM 0 HB2 GLU A 770 -15.435 7.784 5.369 1.00 25.00 H new ATOM 0 HB3 GLU A 770 -14.711 8.439 6.824 1.00 25.00 H new ATOM 0 HG2 GLU A 770 -16.460 10.194 6.905 1.00 25.00 H new ATOM 0 HG3 GLU A 770 -17.183 9.543 5.448 1.00 25.00 H new ATOM 460 N PHE A 771 -13.730 7.922 3.323 1.00 25.00 N ATOM 461 CA PHE A 771 -12.924 6.970 2.547 1.00 25.00 C ATOM 462 C PHE A 771 -11.714 7.620 1.947 1.00 25.00 C ATOM 463 O PHE A 771 -10.618 7.062 1.968 1.00 25.00 O ATOM 464 CB PHE A 771 -13.803 6.401 1.422 1.00 25.00 C ATOM 465 CG PHE A 771 -13.063 5.598 0.389 1.00 25.00 C ATOM 466 CD1 PHE A 771 -12.232 4.537 0.763 1.00 25.00 C ATOM 467 CD2 PHE A 771 -13.216 5.894 -0.984 1.00 25.00 C ATOM 468 CE1 PHE A 771 -11.573 3.753 -0.208 1.00 25.00 C ATOM 469 CE2 PHE A 771 -12.558 5.122 -1.969 1.00 25.00 C ATOM 470 CZ PHE A 771 -11.740 4.033 -1.571 1.00 25.00 C ATOM 0 H PHE A 771 -14.690 8.002 2.986 1.00 25.00 H new ATOM 0 HA PHE A 771 -12.577 6.182 3.216 1.00 25.00 H new ATOM 0 HB2 PHE A 771 -14.575 5.772 1.866 1.00 25.00 H new ATOM 0 HB3 PHE A 771 -14.311 7.227 0.924 1.00 25.00 H new ATOM 0 HD1 PHE A 771 -12.093 4.314 1.811 1.00 25.00 H new ATOM 0 HD2 PHE A 771 -13.843 6.720 -1.285 1.00 25.00 H new ATOM 0 HE1 PHE A 771 -10.938 2.935 0.100 1.00 25.00 H new ATOM 0 HE2 PHE A 771 -12.677 5.359 -3.016 1.00 25.00 H new ATOM 0 HZ PHE A 771 -11.249 3.423 -2.315 1.00 25.00 H new ATOM 480 N LYS A 772 -11.905 8.817 1.425 1.00 25.00 N ATOM 481 CA LYS A 772 -10.828 9.527 0.791 1.00 25.00 C ATOM 482 C LYS A 772 -9.779 9.914 1.828 1.00 25.00 C ATOM 483 O LYS A 772 -8.642 10.157 1.473 1.00 25.00 O ATOM 484 CB LYS A 772 -11.395 10.712 0.017 1.00 25.00 C ATOM 485 CG LYS A 772 -12.067 11.770 0.870 1.00 25.00 C ATOM 486 CD LYS A 772 -11.126 12.868 1.296 1.00 25.00 C ATOM 487 CE LYS A 772 -10.517 13.611 0.082 1.00 25.00 C ATOM 488 NZ LYS A 772 -10.076 15.015 0.340 1.00 25.00 N ATOM 0 H LYS A 772 -12.797 9.311 1.431 1.00 25.00 H new ATOM 0 HA LYS A 772 -10.316 8.893 0.067 1.00 25.00 H new ATOM 0 HB2 LYS A 772 -10.587 11.179 -0.546 1.00 25.00 H new ATOM 0 HB3 LYS A 772 -12.117 10.340 -0.710 1.00 25.00 H new ATOM 0 HG2 LYS A 772 -12.896 12.206 0.313 1.00 25.00 H new ATOM 0 HG3 LYS A 772 -12.492 11.299 1.756 1.00 25.00 H new ATOM 0 HD2 LYS A 772 -11.660 13.579 1.926 1.00 25.00 H new ATOM 0 HD3 LYS A 772 -10.325 12.445 1.902 1.00 25.00 H new ATOM 0 HE2 LYS A 772 -9.661 13.041 -0.278 1.00 25.00 H new ATOM 0 HE3 LYS A 772 -11.254 13.622 -0.721 1.00 25.00 H new ATOM 0 HZ1 LYS A 772 -9.593 15.387 -0.502 1.00 25.00 H new ATOM 0 HZ2 LYS A 772 -10.905 15.606 0.553 1.00 25.00 H new ATOM 0 HZ3 LYS A 772 -9.423 15.031 1.149 1.00 25.00 H new ATOM 502 N ALA A 773 -10.156 9.984 3.106 1.00 25.00 N ATOM 503 CA ALA A 773 -9.206 10.369 4.144 1.00 25.00 C ATOM 504 C ALA A 773 -8.437 9.131 4.610 1.00 25.00 C ATOM 505 O ALA A 773 -7.273 9.211 4.966 1.00 25.00 O ATOM 506 CB ALA A 773 -9.936 11.018 5.320 1.00 25.00 C ATOM 0 H ALA A 773 -11.098 9.782 3.441 1.00 25.00 H new ATOM 0 HA ALA A 773 -8.503 11.097 3.738 1.00 25.00 H new ATOM 0 HB1 ALA A 773 -9.214 11.300 6.086 1.00 25.00 H new ATOM 0 HB2 ALA A 773 -10.464 11.907 4.975 1.00 25.00 H new ATOM 0 HB3 ALA A 773 -10.652 10.311 5.739 1.00 25.00 H new ATOM 512 N CYS A 774 -9.102 7.985 4.590 1.00 25.00 N ATOM 513 CA CYS A 774 -8.463 6.722 4.946 1.00 25.00 C ATOM 514 C CYS A 774 -7.351 6.446 3.954 1.00 25.00 C ATOM 515 O CYS A 774 -6.241 6.073 4.307 1.00 25.00 O ATOM 516 CB CYS A 774 -9.493 5.589 4.888 1.00 25.00 C ATOM 517 SG CYS A 774 -8.848 3.990 5.421 1.00 25.00 S ATOM 0 H CYS A 774 -10.085 7.902 4.331 1.00 25.00 H new ATOM 0 HA CYS A 774 -8.057 6.783 5.956 1.00 25.00 H new ATOM 0 HB2 CYS A 774 -10.345 5.853 5.514 1.00 25.00 H new ATOM 0 HB3 CYS A 774 -9.863 5.499 3.867 1.00 25.00 H new ATOM 0 HG CYS A 774 -9.787 3.095 5.341 1.00 25.00 H new ATOM 523 N LEU A 775 -7.692 6.655 2.698 1.00 25.00 N ATOM 524 CA LEU A 775 -6.788 6.439 1.571 1.00 25.00 C ATOM 525 C LEU A 775 -5.492 7.264 1.572 1.00 25.00 C ATOM 526 O LEU A 775 -4.537 6.913 0.893 1.00 25.00 O ATOM 527 CB LEU A 775 -7.553 6.736 0.291 1.00 25.00 C ATOM 528 CG LEU A 775 -8.321 5.578 -0.354 1.00 25.00 C ATOM 529 CD1 LEU A 775 -9.059 6.136 -1.556 1.00 25.00 C ATOM 530 CD2 LEU A 775 -7.397 4.443 -0.798 1.00 25.00 C ATOM 0 H LEU A 775 -8.617 6.984 2.421 1.00 25.00 H new ATOM 0 HA LEU A 775 -6.460 5.403 1.653 1.00 25.00 H new ATOM 0 HB2 LEU A 775 -8.263 7.536 0.500 1.00 25.00 H new ATOM 0 HB3 LEU A 775 -6.845 7.122 -0.443 1.00 25.00 H new ATOM 0 HG LEU A 775 -9.007 5.155 0.380 1.00 25.00 H new ATOM 0 HD11 LEU A 775 -9.619 5.337 -2.042 1.00 25.00 H new ATOM 0 HD12 LEU A 775 -9.748 6.916 -1.230 1.00 25.00 H new ATOM 0 HD13 LEU A 775 -8.341 6.557 -2.260 1.00 25.00 H new ATOM 0 HD21 LEU A 775 -7.989 3.647 -1.249 1.00 25.00 H new ATOM 0 HD22 LEU A 775 -6.682 4.821 -1.528 1.00 25.00 H new ATOM 0 HD23 LEU A 775 -6.861 4.051 0.066 1.00 25.00 H new ATOM 542 N ILE A 776 -5.454 8.344 2.334 1.00 25.00 N ATOM 543 CA ILE A 776 -4.271 9.200 2.416 1.00 25.00 C ATOM 544 C ILE A 776 -3.124 8.378 2.983 1.00 25.00 C ATOM 545 O ILE A 776 -1.990 8.464 2.527 1.00 25.00 O ATOM 546 CB ILE A 776 -4.511 10.420 3.354 1.00 25.00 C ATOM 547 CG1 ILE A 776 -5.739 11.211 2.880 1.00 25.00 C ATOM 548 CG2 ILE A 776 -3.276 11.341 3.374 1.00 25.00 C ATOM 549 CD1 ILE A 776 -6.138 12.378 3.776 1.00 25.00 C ATOM 0 H ILE A 776 -6.235 8.655 2.912 1.00 25.00 H new ATOM 0 HA ILE A 776 -4.044 9.572 1.417 1.00 25.00 H new ATOM 0 HB ILE A 776 -4.686 10.049 4.364 1.00 25.00 H new ATOM 0 HG12 ILE A 776 -5.542 11.592 1.878 1.00 25.00 H new ATOM 0 HG13 ILE A 776 -6.584 10.528 2.801 1.00 25.00 H new ATOM 0 HG21 ILE A 776 -3.464 12.187 4.035 1.00 25.00 H new ATOM 0 HG22 ILE A 776 -2.412 10.783 3.735 1.00 25.00 H new ATOM 0 HG23 ILE A 776 -3.077 11.705 2.366 1.00 25.00 H new ATOM 0 HD11 ILE A 776 -7.014 12.874 3.359 1.00 25.00 H new ATOM 0 HD12 ILE A 776 -6.372 12.007 4.774 1.00 25.00 H new ATOM 0 HD13 ILE A 776 -5.314 13.088 3.837 1.00 25.00 H new ATOM 561 N SER A 777 -3.443 7.565 3.980 1.00 25.00 N ATOM 562 CA SER A 777 -2.440 6.749 4.660 1.00 25.00 C ATOM 563 C SER A 777 -2.084 5.512 3.857 1.00 25.00 C ATOM 564 O SER A 777 -1.206 4.755 4.244 1.00 25.00 O ATOM 565 CB SER A 777 -2.957 6.332 6.031 1.00 25.00 C ATOM 566 OG SER A 777 -3.224 7.481 6.817 1.00 25.00 O ATOM 0 H SER A 777 -4.391 7.451 4.339 1.00 25.00 H new ATOM 0 HA SER A 777 -1.539 7.353 4.768 1.00 25.00 H new ATOM 0 HB2 SER A 777 -3.864 5.737 5.922 1.00 25.00 H new ATOM 0 HB3 SER A 777 -2.221 5.702 6.531 1.00 25.00 H new ATOM 0 HG SER A 777 -4.082 7.370 7.277 1.00 25.00 H new ATOM 572 N LEU A 778 -2.774 5.315 2.743 1.00 25.00 N ATOM 573 CA LEU A 778 -2.514 4.179 1.870 1.00 25.00 C ATOM 574 C LEU A 778 -1.798 4.637 0.611 1.00 25.00 C ATOM 575 O LEU A 778 -1.402 3.817 -0.187 1.00 25.00 O ATOM 576 CB LEU A 778 -3.815 3.446 1.497 1.00 25.00 C ATOM 577 CG LEU A 778 -4.374 2.410 2.494 1.00 25.00 C ATOM 578 CD1 LEU A 778 -3.343 1.330 2.818 1.00 25.00 C ATOM 579 CD2 LEU A 778 -4.869 3.050 3.798 1.00 25.00 C ATOM 0 H LEU A 778 -3.521 5.930 2.421 1.00 25.00 H new ATOM 0 HA LEU A 778 -1.877 3.481 2.414 1.00 25.00 H new ATOM 0 HB2 LEU A 778 -4.586 4.198 1.330 1.00 25.00 H new ATOM 0 HB3 LEU A 778 -3.652 2.940 0.546 1.00 25.00 H new ATOM 0 HG LEU A 778 -5.229 1.953 1.997 1.00 25.00 H new ATOM 0 HD11 LEU A 778 -3.772 0.618 3.523 1.00 25.00 H new ATOM 0 HD12 LEU A 778 -3.061 0.810 1.903 1.00 25.00 H new ATOM 0 HD13 LEU A 778 -2.460 1.791 3.260 1.00 25.00 H new ATOM 0 HD21 LEU A 778 -5.251 2.274 4.462 1.00 25.00 H new ATOM 0 HD22 LEU A 778 -4.043 3.569 4.285 1.00 25.00 H new ATOM 0 HD23 LEU A 778 -5.664 3.761 3.575 1.00 25.00 H new ATOM 591 N GLY A 779 -1.618 5.941 0.427 1.00 25.00 N ATOM 592 CA GLY A 779 -0.841 6.380 -0.721 1.00 25.00 C ATOM 593 C GLY A 779 -1.667 6.415 -1.991 1.00 25.00 C ATOM 594 O GLY A 779 -1.314 5.856 -3.023 1.00 25.00 O ATOM 0 H GLY A 779 -1.981 6.681 1.028 1.00 25.00 H new ATOM 0 HA2 GLY A 779 -0.436 7.373 -0.525 1.00 25.00 H new ATOM 0 HA3 GLY A 779 0.008 5.711 -0.860 1.00 25.00 H new ATOM 598 N TYR A 780 -2.801 7.086 -1.896 1.00 25.00 N ATOM 599 CA TYR A 780 -3.724 7.222 -3.016 1.00 25.00 C ATOM 600 C TYR A 780 -3.260 8.090 -4.201 1.00 25.00 C ATOM 601 O TYR A 780 -2.325 8.874 -4.100 1.00 25.00 O ATOM 602 CB TYR A 780 -5.069 7.729 -2.497 1.00 25.00 C ATOM 603 CG TYR A 780 -5.071 9.097 -1.831 1.00 25.00 C ATOM 604 CD1 TYR A 780 -3.884 9.832 -1.622 1.00 25.00 C ATOM 605 CD2 TYR A 780 -6.282 9.664 -1.407 1.00 25.00 C ATOM 606 CE1 TYR A 780 -3.909 11.099 -1.030 1.00 25.00 C ATOM 607 CE2 TYR A 780 -6.318 10.934 -0.821 1.00 25.00 C ATOM 608 CZ TYR A 780 -5.130 11.656 -0.648 1.00 25.00 C ATOM 609 OH TYR A 780 -5.160 12.916 -0.099 1.00 25.00 O ATOM 0 H TYR A 780 -3.110 7.552 -1.043 1.00 25.00 H new ATOM 0 HA TYR A 780 -3.792 6.220 -3.439 1.00 25.00 H new ATOM 0 HB2 TYR A 780 -5.768 7.756 -3.333 1.00 25.00 H new ATOM 0 HB3 TYR A 780 -5.454 7.002 -1.782 1.00 25.00 H new ATOM 0 HD1 TYR A 780 -2.938 9.408 -1.925 1.00 25.00 H new ATOM 0 HD2 TYR A 780 -7.201 9.111 -1.535 1.00 25.00 H new ATOM 0 HE1 TYR A 780 -2.990 11.642 -0.870 1.00 25.00 H new ATOM 0 HE2 TYR A 780 -7.259 11.357 -0.503 1.00 25.00 H new ATOM 0 HH TYR A 780 -6.086 13.159 0.112 1.00 25.00 H new ATOM 619 N ASP A 781 -3.947 7.941 -5.325 1.00 25.00 N ATOM 620 CA ASP A 781 -3.618 8.641 -6.574 1.00 25.00 C ATOM 621 C ASP A 781 -4.495 9.874 -6.747 1.00 25.00 C ATOM 622 O ASP A 781 -4.497 10.521 -7.794 1.00 25.00 O ATOM 623 CB ASP A 781 -3.845 7.695 -7.767 1.00 25.00 C ATOM 624 CG ASP A 781 -5.321 7.325 -7.955 1.00 25.00 C ATOM 625 OD1 ASP A 781 -5.962 6.885 -6.966 1.00 25.00 O ATOM 626 OD2 ASP A 781 -5.841 7.461 -9.081 1.00 25.00 O ATOM 0 H ASP A 781 -4.757 7.327 -5.404 1.00 25.00 H new ATOM 0 HA ASP A 781 -2.574 8.951 -6.532 1.00 25.00 H new ATOM 0 HB2 ASP A 781 -3.474 8.168 -8.676 1.00 25.00 H new ATOM 0 HB3 ASP A 781 -3.262 6.786 -7.621 1.00 25.00 H new ATOM 631 N ILE A 782 -5.252 10.185 -5.709 1.00 25.00 N ATOM 632 CA ILE A 782 -6.202 11.289 -5.733 1.00 25.00 C ATOM 633 C ILE A 782 -5.990 12.220 -4.547 1.00 25.00 C ATOM 634 O ILE A 782 -5.110 12.014 -3.730 1.00 25.00 O ATOM 635 CB ILE A 782 -7.654 10.779 -5.725 1.00 25.00 C ATOM 636 CG1 ILE A 782 -7.903 9.924 -4.467 1.00 25.00 C ATOM 637 CG2 ILE A 782 -7.946 10.072 -7.062 1.00 25.00 C ATOM 638 CD1 ILE A 782 -8.114 8.491 -4.697 1.00 25.00 C ATOM 0 H ILE A 782 -5.227 9.680 -4.823 1.00 25.00 H new ATOM 0 HA ILE A 782 -6.027 11.840 -6.657 1.00 25.00 H new ATOM 0 HB ILE A 782 -8.367 11.600 -5.656 1.00 25.00 H new ATOM 0 HG12 ILE A 782 -7.052 10.043 -3.796 1.00 25.00 H new ATOM 0 HG13 ILE A 782 -8.776 10.321 -3.948 1.00 25.00 H new ATOM 0 HG21 ILE A 782 -8.973 9.708 -7.064 1.00 25.00 H new ATOM 0 HG22 ILE A 782 -7.809 10.776 -7.883 1.00 25.00 H new ATOM 0 HG23 ILE A 782 -7.263 9.232 -7.186 1.00 25.00 H new ATOM 0 HD11 ILE A 782 -8.279 7.990 -3.743 1.00 25.00 H new ATOM 0 HD12 ILE A 782 -8.985 8.350 -5.337 1.00 25.00 H new ATOM 0 HD13 ILE A 782 -7.235 8.067 -5.182 1.00 25.00 H new ATOM 650 N GLY A 783 -6.824 13.240 -4.458 1.00 25.00 N ATOM 651 CA GLY A 783 -6.751 14.203 -3.383 1.00 25.00 C ATOM 652 C GLY A 783 -7.937 15.102 -3.615 1.00 25.00 C ATOM 653 O GLY A 783 -8.799 14.743 -4.412 1.00 25.00 O ATOM 0 H GLY A 783 -7.569 13.421 -5.130 1.00 25.00 H new ATOM 0 HA2 GLY A 783 -6.803 13.717 -2.408 1.00 25.00 H new ATOM 0 HA3 GLY A 783 -5.816 14.762 -3.411 1.00 25.00 H new ATOM 657 N ASN A 784 -7.995 16.260 -2.971 1.00 25.00 N ATOM 658 CA ASN A 784 -9.103 17.206 -3.186 1.00 25.00 C ATOM 659 C ASN A 784 -8.791 18.098 -4.392 1.00 25.00 C ATOM 660 O ASN A 784 -9.268 19.228 -4.507 1.00 25.00 O ATOM 661 CB ASN A 784 -9.372 18.048 -1.933 1.00 25.00 C ATOM 662 CG ASN A 784 -8.128 18.665 -1.371 1.00 25.00 C ATOM 663 OD1 ASN A 784 -7.579 18.164 -0.403 1.00 25.00 O ATOM 664 ND2 ASN A 784 -7.676 19.735 -1.958 1.00 25.00 N ATOM 0 H ASN A 784 -7.296 16.574 -2.297 1.00 25.00 H new ATOM 0 HA ASN A 784 -10.010 16.638 -3.391 1.00 25.00 H new ATOM 0 HB2 ASN A 784 -10.085 18.836 -2.176 1.00 25.00 H new ATOM 0 HB3 ASN A 784 -9.837 17.421 -1.172 1.00 25.00 H new ATOM 0 HD21 ASN A 784 -6.831 20.189 -1.611 1.00 25.00 H new ATOM 0 HD22 ASN A 784 -8.167 20.120 -2.765 1.00 25.00 H new ATOM 671 N ASP A 785 -7.971 17.565 -5.275 1.00 25.00 N ATOM 672 CA ASP A 785 -7.556 18.226 -6.497 1.00 25.00 C ATOM 673 C ASP A 785 -8.698 18.164 -7.507 1.00 25.00 C ATOM 674 O ASP A 785 -9.539 17.263 -7.439 1.00 25.00 O ATOM 675 CB ASP A 785 -6.331 17.494 -7.039 1.00 25.00 C ATOM 676 CG ASP A 785 -5.181 17.522 -6.062 1.00 25.00 C ATOM 677 OD1 ASP A 785 -5.159 16.666 -5.150 1.00 25.00 O ATOM 678 OD2 ASP A 785 -4.315 18.406 -6.191 1.00 25.00 O ATOM 0 H ASP A 785 -7.564 16.637 -5.160 1.00 25.00 H new ATOM 0 HA ASP A 785 -7.307 19.271 -6.311 1.00 25.00 H new ATOM 0 HB2 ASP A 785 -6.594 16.460 -7.260 1.00 25.00 H new ATOM 0 HB3 ASP A 785 -6.021 17.952 -7.978 1.00 25.00 H new ATOM 683 N PRO A 786 -8.747 19.106 -8.469 1.00 25.00 N ATOM 684 CA PRO A 786 -9.894 19.068 -9.386 1.00 25.00 C ATOM 685 C PRO A 786 -9.949 17.819 -10.260 1.00 25.00 C ATOM 686 O PRO A 786 -11.019 17.404 -10.685 1.00 25.00 O ATOM 687 CB PRO A 786 -9.702 20.335 -10.227 1.00 25.00 C ATOM 688 CG PRO A 786 -8.233 20.579 -10.198 1.00 25.00 C ATOM 689 CD PRO A 786 -7.840 20.226 -8.787 1.00 25.00 C ATOM 0 HA PRO A 786 -10.840 19.031 -8.845 1.00 25.00 H new ATOM 0 HB2 PRO A 786 -10.061 20.194 -11.246 1.00 25.00 H new ATOM 0 HB3 PRO A 786 -10.253 21.177 -9.809 1.00 25.00 H new ATOM 0 HG2 PRO A 786 -7.710 19.959 -10.926 1.00 25.00 H new ATOM 0 HG3 PRO A 786 -7.995 21.616 -10.432 1.00 25.00 H new ATOM 0 HD2 PRO A 786 -6.793 19.931 -8.720 1.00 25.00 H new ATOM 0 HD3 PRO A 786 -7.979 21.066 -8.106 1.00 25.00 H new ATOM 697 N GLN A 787 -8.800 17.209 -10.518 1.00 25.00 N ATOM 698 CA GLN A 787 -8.768 15.972 -11.289 1.00 25.00 C ATOM 699 C GLN A 787 -9.082 14.789 -10.378 1.00 25.00 C ATOM 700 O GLN A 787 -9.845 13.898 -10.732 1.00 25.00 O ATOM 701 CB GLN A 787 -7.377 15.759 -11.904 1.00 25.00 C ATOM 702 CG GLN A 787 -6.941 16.813 -12.876 1.00 25.00 C ATOM 703 CD GLN A 787 -7.797 16.833 -14.041 1.00 25.00 C ATOM 704 OE1 GLN A 787 -8.503 17.765 -14.384 1.00 25.00 O ATOM 705 NE2 GLN A 787 -7.714 15.754 -14.678 1.00 25.00 N ATOM 0 H GLN A 787 -7.888 17.545 -10.209 1.00 25.00 H new ATOM 0 HA GLN A 787 -9.511 16.044 -12.084 1.00 25.00 H new ATOM 0 HB2 GLN A 787 -6.645 15.706 -11.098 1.00 25.00 H new ATOM 0 HB3 GLN A 787 -7.365 14.794 -12.410 1.00 25.00 H new ATOM 0 HG2 GLN A 787 -6.959 17.789 -12.391 1.00 25.00 H new ATOM 0 HG3 GLN A 787 -5.911 16.627 -13.181 1.00 25.00 H new ATOM 0 HE21 GLN A 787 -7.105 15.008 -14.341 1.00 25.00 H new ATOM 0 HE22 GLN A 787 -8.256 15.623 -15.532 1.00 25.00 H new ATOM 714 N GLY A 788 -8.468 14.782 -9.205 1.00 25.00 N ATOM 715 CA GLY A 788 -8.585 13.640 -8.318 1.00 25.00 C ATOM 716 C GLY A 788 -9.922 13.432 -7.654 1.00 25.00 C ATOM 717 O GLY A 788 -10.269 12.312 -7.370 1.00 25.00 O ATOM 0 H GLY A 788 -7.891 15.545 -8.850 1.00 25.00 H new ATOM 0 HA2 GLY A 788 -8.344 12.742 -8.886 1.00 25.00 H new ATOM 0 HA3 GLY A 788 -7.829 13.736 -7.538 1.00 25.00 H new ATOM 721 N GLU A 789 -10.691 14.477 -7.411 1.00 25.00 N ATOM 722 CA GLU A 789 -12.007 14.303 -6.776 1.00 25.00 C ATOM 723 C GLU A 789 -12.935 13.488 -7.685 1.00 25.00 C ATOM 724 O GLU A 789 -13.821 12.772 -7.216 1.00 25.00 O ATOM 725 CB GLU A 789 -12.650 15.659 -6.476 1.00 25.00 C ATOM 726 CG GLU A 789 -12.157 16.316 -5.177 1.00 25.00 C ATOM 727 CD GLU A 789 -12.684 15.624 -3.902 1.00 25.00 C ATOM 728 OE1 GLU A 789 -13.906 15.384 -3.823 1.00 25.00 O ATOM 729 OE2 GLU A 789 -11.880 15.335 -2.974 1.00 25.00 O ATOM 0 H GLU A 789 -10.444 15.441 -7.634 1.00 25.00 H new ATOM 0 HA GLU A 789 -11.859 13.768 -5.838 1.00 25.00 H new ATOM 0 HB2 GLU A 789 -12.453 16.334 -7.309 1.00 25.00 H new ATOM 0 HB3 GLU A 789 -13.731 15.531 -6.418 1.00 25.00 H new ATOM 0 HG2 GLU A 789 -11.067 16.305 -5.164 1.00 25.00 H new ATOM 0 HG3 GLU A 789 -12.465 17.362 -5.168 1.00 25.00 H new ATOM 736 N ALA A 790 -12.727 13.583 -8.991 1.00 25.00 N ATOM 737 CA ALA A 790 -13.577 12.874 -9.941 1.00 25.00 C ATOM 738 C ALA A 790 -13.218 11.389 -9.919 1.00 25.00 C ATOM 739 O ALA A 790 -14.082 10.512 -9.950 1.00 25.00 O ATOM 740 CB ALA A 790 -13.380 13.457 -11.345 1.00 25.00 C ATOM 0 H ALA A 790 -11.984 14.139 -9.415 1.00 25.00 H new ATOM 0 HA ALA A 790 -14.625 12.991 -9.664 1.00 25.00 H new ATOM 0 HB1 ALA A 790 -14.016 12.925 -12.052 1.00 25.00 H new ATOM 0 HB2 ALA A 790 -13.646 14.514 -11.341 1.00 25.00 H new ATOM 0 HB3 ALA A 790 -12.337 13.347 -11.642 1.00 25.00 H new ATOM 746 N GLU A 791 -11.925 11.127 -9.855 1.00 25.00 N ATOM 747 CA GLU A 791 -11.413 9.765 -9.840 1.00 25.00 C ATOM 748 C GLU A 791 -11.688 9.127 -8.486 1.00 25.00 C ATOM 749 O GLU A 791 -11.969 7.941 -8.386 1.00 25.00 O ATOM 750 CB GLU A 791 -9.923 9.773 -10.124 1.00 25.00 C ATOM 751 CG GLU A 791 -9.561 10.432 -11.445 1.00 25.00 C ATOM 752 CD GLU A 791 -10.049 9.642 -12.674 1.00 25.00 C ATOM 753 OE1 GLU A 791 -10.429 8.451 -12.536 1.00 25.00 O ATOM 754 OE2 GLU A 791 -10.064 10.215 -13.782 1.00 25.00 O ATOM 0 H GLU A 791 -11.203 11.846 -9.812 1.00 25.00 H new ATOM 0 HA GLU A 791 -11.915 9.182 -10.612 1.00 25.00 H new ATOM 0 HB2 GLU A 791 -9.410 10.293 -9.315 1.00 25.00 H new ATOM 0 HB3 GLU A 791 -9.556 8.747 -10.127 1.00 25.00 H new ATOM 0 HG2 GLU A 791 -9.989 11.434 -11.472 1.00 25.00 H new ATOM 0 HG3 GLU A 791 -8.478 10.546 -11.502 1.00 25.00 H new ATOM 761 N PHE A 792 -11.641 9.931 -7.439 1.00 25.00 N ATOM 762 CA PHE A 792 -11.984 9.449 -6.116 1.00 25.00 C ATOM 763 C PHE A 792 -13.396 8.886 -6.154 1.00 25.00 C ATOM 764 O PHE A 792 -13.655 7.798 -5.659 1.00 25.00 O ATOM 765 CB PHE A 792 -11.879 10.557 -5.064 1.00 25.00 C ATOM 766 CG PHE A 792 -12.985 10.541 -4.057 1.00 25.00 C ATOM 767 CD1 PHE A 792 -13.091 9.494 -3.121 1.00 25.00 C ATOM 768 CD2 PHE A 792 -13.946 11.563 -4.053 1.00 25.00 C ATOM 769 CE1 PHE A 792 -14.159 9.466 -2.198 1.00 25.00 C ATOM 770 CE2 PHE A 792 -15.016 11.542 -3.128 1.00 25.00 C ATOM 771 CZ PHE A 792 -15.123 10.508 -2.209 1.00 25.00 C ATOM 0 H PHE A 792 -11.371 10.914 -7.479 1.00 25.00 H new ATOM 0 HA PHE A 792 -11.276 8.670 -5.831 1.00 25.00 H new ATOM 0 HB2 PHE A 792 -10.926 10.462 -4.544 1.00 25.00 H new ATOM 0 HB3 PHE A 792 -11.873 11.524 -5.568 1.00 25.00 H new ATOM 0 HD1 PHE A 792 -12.351 8.708 -3.109 1.00 25.00 H new ATOM 0 HD2 PHE A 792 -13.868 12.373 -4.763 1.00 25.00 H new ATOM 0 HE1 PHE A 792 -14.242 8.657 -1.488 1.00 25.00 H new ATOM 0 HE2 PHE A 792 -15.751 12.333 -3.137 1.00 25.00 H new ATOM 0 HZ PHE A 792 -15.940 10.496 -1.502 1.00 25.00 H new ATOM 781 N ALA A 793 -14.311 9.629 -6.758 1.00 25.00 N ATOM 782 CA ALA A 793 -15.700 9.194 -6.832 1.00 25.00 C ATOM 783 C ALA A 793 -15.851 7.928 -7.699 1.00 25.00 C ATOM 784 O ALA A 793 -16.737 7.098 -7.453 1.00 25.00 O ATOM 785 CB ALA A 793 -16.585 10.327 -7.358 1.00 25.00 C ATOM 0 H ALA A 793 -14.121 10.528 -7.201 1.00 25.00 H new ATOM 0 HA ALA A 793 -16.027 8.938 -5.824 1.00 25.00 H new ATOM 0 HB1 ALA A 793 -17.620 9.987 -7.408 1.00 25.00 H new ATOM 0 HB2 ALA A 793 -16.516 11.184 -6.688 1.00 25.00 H new ATOM 0 HB3 ALA A 793 -16.250 10.618 -8.354 1.00 25.00 H new ATOM 791 N ARG A 794 -14.984 7.779 -8.697 1.00 25.00 N ATOM 792 CA ARG A 794 -14.971 6.604 -9.585 1.00 25.00 C ATOM 793 C ARG A 794 -14.637 5.362 -8.760 1.00 25.00 C ATOM 794 O ARG A 794 -15.206 4.308 -8.982 1.00 25.00 O ATOM 795 CB ARG A 794 -13.924 6.834 -10.691 1.00 25.00 C ATOM 796 CG ARG A 794 -13.808 5.767 -11.731 1.00 25.00 C ATOM 797 CD ARG A 794 -12.682 6.219 -12.637 1.00 25.00 C ATOM 798 NE ARG A 794 -12.508 5.409 -13.840 1.00 25.00 N ATOM 799 CZ ARG A 794 -11.602 5.666 -14.777 1.00 25.00 C ATOM 800 NH1 ARG A 794 -10.767 6.674 -14.691 1.00 25.00 N ATOM 801 NH2 ARG A 794 -11.546 4.897 -15.825 1.00 25.00 N ATOM 0 H ARG A 794 -14.266 8.468 -8.919 1.00 25.00 H new ATOM 0 HA ARG A 794 -15.946 6.457 -10.050 1.00 25.00 H new ATOM 0 HB2 ARG A 794 -14.157 7.774 -11.191 1.00 25.00 H new ATOM 0 HB3 ARG A 794 -12.950 6.957 -10.218 1.00 25.00 H new ATOM 0 HG2 ARG A 794 -13.587 4.800 -11.280 1.00 25.00 H new ATOM 0 HG3 ARG A 794 -14.739 5.655 -12.286 1.00 25.00 H new ATOM 0 HD2 ARG A 794 -12.864 7.252 -12.933 1.00 25.00 H new ATOM 0 HD3 ARG A 794 -11.751 6.209 -12.070 1.00 25.00 H new ATOM 0 HE ARG A 794 -13.116 4.600 -13.968 1.00 25.00 H new ATOM 0 HH11 ARG A 794 -10.799 7.295 -13.882 1.00 25.00 H new ATOM 0 HH12 ARG A 794 -10.086 6.837 -15.433 1.00 25.00 H new ATOM 0 HH21 ARG A 794 -12.191 4.112 -15.917 1.00 25.00 H new ATOM 0 HH22 ARG A 794 -10.857 5.079 -16.555 1.00 25.00 H new ATOM 815 N ILE A 795 -13.728 5.502 -7.802 1.00 25.00 N ATOM 816 CA ILE A 795 -13.348 4.399 -6.926 1.00 25.00 C ATOM 817 C ILE A 795 -14.451 4.270 -5.895 1.00 25.00 C ATOM 818 O ILE A 795 -14.816 3.191 -5.474 1.00 25.00 O ATOM 819 CB ILE A 795 -12.067 4.689 -6.167 1.00 25.00 C ATOM 820 CG1 ILE A 795 -10.881 4.897 -7.109 1.00 25.00 C ATOM 821 CG2 ILE A 795 -11.745 3.515 -5.219 1.00 25.00 C ATOM 822 CD1 ILE A 795 -9.915 5.992 -6.634 1.00 25.00 C ATOM 0 H ILE A 795 -13.237 6.375 -7.611 1.00 25.00 H new ATOM 0 HA ILE A 795 -13.198 3.503 -7.529 1.00 25.00 H new ATOM 0 HB ILE A 795 -12.225 5.608 -5.602 1.00 25.00 H new ATOM 0 HG12 ILE A 795 -10.335 3.959 -7.208 1.00 25.00 H new ATOM 0 HG13 ILE A 795 -11.254 5.155 -8.100 1.00 25.00 H new ATOM 0 HG21 ILE A 795 -10.824 3.728 -4.676 1.00 25.00 H new ATOM 0 HG22 ILE A 795 -12.563 3.385 -4.510 1.00 25.00 H new ATOM 0 HG23 ILE A 795 -11.620 2.601 -5.800 1.00 25.00 H new ATOM 0 HD11 ILE A 795 -9.096 6.089 -7.347 1.00 25.00 H new ATOM 0 HD12 ILE A 795 -10.447 6.940 -6.562 1.00 25.00 H new ATOM 0 HD13 ILE A 795 -9.515 5.725 -5.656 1.00 25.00 H new ATOM 834 N MET A 796 -15.021 5.383 -5.437 1.00 25.00 N ATOM 835 CA MET A 796 -16.055 5.316 -4.479 1.00 25.00 C ATOM 836 C MET A 796 -17.229 4.438 -4.984 1.00 25.00 C ATOM 837 O MET A 796 -17.959 3.794 -4.263 1.00 25.00 O ATOM 838 CB MET A 796 -16.566 6.736 -4.141 1.00 25.00 C ATOM 839 CG MET A 796 -17.018 6.907 -2.704 1.00 25.00 C ATOM 840 SD MET A 796 -18.787 6.694 -2.524 1.00 25.00 S ATOM 841 CE MET A 796 -18.860 5.444 -1.276 1.00 25.00 C ATOM 0 H MET A 796 -14.766 6.326 -5.730 1.00 25.00 H new ATOM 0 HA MET A 796 -15.648 4.858 -3.578 1.00 25.00 H new ATOM 0 HB2 MET A 796 -15.773 7.455 -4.349 1.00 25.00 H new ATOM 0 HB3 MET A 796 -17.397 6.978 -4.803 1.00 25.00 H new ATOM 0 HG2 MET A 796 -16.500 6.184 -2.073 1.00 25.00 H new ATOM 0 HG3 MET A 796 -16.735 7.899 -2.351 1.00 25.00 H new ATOM 0 HE1 MET A 796 -19.847 4.982 -1.281 1.00 25.00 H new ATOM 0 HE2 MET A 796 -18.103 4.686 -1.476 1.00 25.00 H new ATOM 0 HE3 MET A 796 -18.675 5.893 -0.300 1.00 25.00 H new ATOM 851 N SER A 797 -17.275 4.345 -6.327 1.00 25.00 N ATOM 852 CA SER A 797 -18.258 3.527 -7.035 1.00 25.00 C ATOM 853 C SER A 797 -17.875 2.048 -7.092 1.00 25.00 C ATOM 854 O SER A 797 -18.766 1.216 -7.327 1.00 25.00 O ATOM 855 CB SER A 797 -18.453 4.046 -8.461 1.00 25.00 C ATOM 856 OG SER A 797 -19.574 3.461 -9.105 1.00 25.00 O ATOM 0 H SER A 797 -16.629 4.837 -6.944 1.00 25.00 H new ATOM 0 HA SER A 797 -19.186 3.607 -6.469 1.00 25.00 H new ATOM 0 HB2 SER A 797 -18.577 5.129 -8.436 1.00 25.00 H new ATOM 0 HB3 SER A 797 -17.555 3.841 -9.044 1.00 25.00 H new ATOM 0 HG SER A 797 -19.716 2.556 -8.757 1.00 25.00 H new ATOM 862 N ILE A 798 -16.601 1.639 -6.934 1.00 25.00 N ATOM 863 CA ILE A 798 -16.250 0.212 -7.057 1.00 25.00 C ATOM 864 C ILE A 798 -16.273 -0.403 -5.672 1.00 25.00 C ATOM 865 O ILE A 798 -16.458 -1.578 -5.471 1.00 25.00 O ATOM 866 CB ILE A 798 -14.866 -0.011 -7.760 1.00 25.00 C ATOM 867 CG1 ILE A 798 -13.697 0.310 -6.830 1.00 25.00 C ATOM 868 CG2 ILE A 798 -14.805 0.862 -9.109 1.00 25.00 C ATOM 869 CD1 ILE A 798 -12.353 0.516 -7.518 1.00 25.00 C ATOM 0 H ILE A 798 -15.817 2.258 -6.726 1.00 25.00 H new ATOM 0 HA ILE A 798 -16.984 -0.277 -7.697 1.00 25.00 H new ATOM 0 HB ILE A 798 -14.772 -1.066 -8.017 1.00 25.00 H new ATOM 0 HG12 ILE A 798 -13.940 1.211 -6.267 1.00 25.00 H new ATOM 0 HG13 ILE A 798 -13.596 -0.500 -6.108 1.00 25.00 H new ATOM 0 HG21 ILE A 798 -13.844 0.708 -9.599 1.00 25.00 H new ATOM 0 HG22 ILE A 798 -15.607 0.553 -9.779 1.00 25.00 H new ATOM 0 HG23 ILE A 798 -14.923 1.918 -8.865 1.00 25.00 H new ATOM 0 HD11 ILE A 798 -11.592 0.738 -6.770 1.00 25.00 H new ATOM 0 HD12 ILE A 798 -12.078 -0.390 -8.058 1.00 25.00 H new ATOM 0 HD13 ILE A 798 -12.427 1.347 -8.219 1.00 25.00 H new ATOM 881 N VAL A 799 -16.086 0.533 -4.758 1.00 25.00 N ATOM 882 CA VAL A 799 -15.920 0.289 -3.355 1.00 25.00 C ATOM 883 C VAL A 799 -17.264 0.422 -2.627 1.00 25.00 C ATOM 884 O VAL A 799 -17.367 0.401 -1.417 1.00 25.00 O ATOM 885 CB VAL A 799 -14.709 1.199 -2.997 1.00 25.00 C ATOM 886 CG1 VAL A 799 -15.105 2.495 -2.419 1.00 25.00 C ATOM 887 CG2 VAL A 799 -13.540 0.522 -2.688 1.00 25.00 C ATOM 0 H VAL A 799 -16.046 1.524 -4.995 1.00 25.00 H new ATOM 0 HA VAL A 799 -15.664 -0.718 -3.027 1.00 25.00 H new ATOM 0 HB VAL A 799 -14.244 1.641 -3.878 1.00 25.00 H new ATOM 0 HG11 VAL A 799 -14.214 3.080 -2.192 1.00 25.00 H new ATOM 0 HG12 VAL A 799 -15.724 3.038 -3.133 1.00 25.00 H new ATOM 0 HG13 VAL A 799 -15.671 2.327 -1.503 1.00 25.00 H new ATOM 0 HG21 VAL A 799 -12.755 1.240 -2.453 1.00 25.00 H new ATOM 0 HG22 VAL A 799 -13.710 -0.124 -1.827 1.00 25.00 H new ATOM 0 HG23 VAL A 799 -13.234 -0.084 -3.541 1.00 25.00 H new ATOM 897 N ASP A 800 -18.325 0.410 -3.425 1.00 25.00 N ATOM 898 CA ASP A 800 -19.686 0.389 -2.904 1.00 25.00 C ATOM 899 C ASP A 800 -20.474 -0.689 -3.625 1.00 25.00 C ATOM 900 O ASP A 800 -21.453 -0.435 -4.319 1.00 25.00 O ATOM 901 CB ASP A 800 -20.349 1.768 -3.084 1.00 25.00 C ATOM 902 CG ASP A 800 -21.768 1.760 -2.545 1.00 25.00 C ATOM 903 OD1 ASP A 800 -22.089 0.888 -1.706 1.00 25.00 O ATOM 904 OD2 ASP A 800 -22.578 2.603 -2.965 1.00 25.00 O ATOM 0 H ASP A 800 -18.267 0.415 -4.443 1.00 25.00 H new ATOM 0 HA ASP A 800 -19.668 0.165 -1.837 1.00 25.00 H new ATOM 0 HB2 ASP A 800 -19.763 2.528 -2.567 1.00 25.00 H new ATOM 0 HB3 ASP A 800 -20.358 2.037 -4.140 1.00 25.00 H new ATOM 909 N PRO A 801 -20.044 -1.959 -3.469 1.00 25.00 N ATOM 910 CA PRO A 801 -20.778 -3.032 -4.150 1.00 25.00 C ATOM 911 C PRO A 801 -22.149 -3.344 -3.559 1.00 25.00 C ATOM 912 O PRO A 801 -22.851 -4.204 -4.072 1.00 25.00 O ATOM 913 CB PRO A 801 -19.844 -4.232 -3.968 1.00 25.00 C ATOM 914 CG PRO A 801 -19.184 -3.978 -2.659 1.00 25.00 C ATOM 915 CD PRO A 801 -18.898 -2.513 -2.707 1.00 25.00 C ATOM 0 HA PRO A 801 -21.002 -2.759 -5.181 1.00 25.00 H new ATOM 0 HB2 PRO A 801 -20.397 -5.171 -3.961 1.00 25.00 H new ATOM 0 HB3 PRO A 801 -19.116 -4.297 -4.776 1.00 25.00 H new ATOM 0 HG2 PRO A 801 -19.834 -4.235 -1.823 1.00 25.00 H new ATOM 0 HG3 PRO A 801 -18.272 -4.564 -2.546 1.00 25.00 H new ATOM 0 HD2 PRO A 801 -18.836 -2.084 -1.707 1.00 25.00 H new ATOM 0 HD3 PRO A 801 -17.949 -2.306 -3.202 1.00 25.00 H new ATOM 923 N ASN A 802 -22.534 -2.672 -2.477 1.00 25.00 N ATOM 924 CA ASN A 802 -23.804 -2.966 -1.818 1.00 25.00 C ATOM 925 C ASN A 802 -24.777 -1.818 -2.095 1.00 25.00 C ATOM 926 O ASN A 802 -25.941 -1.868 -1.712 1.00 25.00 O ATOM 927 CB ASN A 802 -23.603 -3.132 -0.303 1.00 25.00 C ATOM 928 CG ASN A 802 -23.097 -4.494 0.093 1.00 25.00 C ATOM 929 OD1 ASN A 802 -22.237 -5.062 -0.689 1.00 25.00 O flip ATOM 930 ND2 ASN A 802 -23.488 -5.019 1.114 1.00 25.00 N flip ATOM 0 H ASN A 802 -21.991 -1.927 -2.041 1.00 25.00 H new ATOM 0 HA ASN A 802 -24.207 -3.900 -2.209 1.00 25.00 H new ATOM 0 HB2 ASN A 802 -22.899 -2.377 0.046 1.00 25.00 H new ATOM 0 HB3 ASN A 802 -24.550 -2.944 0.203 1.00 25.00 H new ATOM 0 HD21 ASN A 802 -24.167 -4.540 1.706 1.00 25.00 H new ATOM 0 HD22 ASN A 802 -23.138 -5.939 1.381 1.00 25.00 H new ATOM 937 N ARG A 803 -24.273 -0.792 -2.775 1.00 25.00 N ATOM 938 CA ARG A 803 -25.050 0.395 -3.176 1.00 25.00 C ATOM 939 C ARG A 803 -25.732 1.081 -2.000 1.00 25.00 C ATOM 940 O ARG A 803 -26.869 1.534 -2.087 1.00 25.00 O ATOM 941 CB ARG A 803 -26.038 0.045 -4.299 1.00 25.00 C ATOM 942 CG ARG A 803 -25.335 -0.540 -5.535 1.00 25.00 C ATOM 943 CD ARG A 803 -24.438 0.499 -6.229 1.00 25.00 C ATOM 944 NE ARG A 803 -23.333 -0.150 -6.952 1.00 25.00 N ATOM 945 CZ ARG A 803 -22.116 0.365 -7.114 1.00 25.00 C ATOM 946 NH1 ARG A 803 -21.772 1.541 -6.649 1.00 25.00 N ATOM 947 NH2 ARG A 803 -21.217 -0.325 -7.757 1.00 25.00 N ATOM 0 H ARG A 803 -23.298 -0.754 -3.072 1.00 25.00 H new ATOM 0 HA ARG A 803 -24.343 1.125 -3.569 1.00 25.00 H new ATOM 0 HB2 ARG A 803 -26.769 -0.673 -3.926 1.00 25.00 H new ATOM 0 HB3 ARG A 803 -26.589 0.940 -4.587 1.00 25.00 H new ATOM 0 HG2 ARG A 803 -24.733 -1.399 -5.238 1.00 25.00 H new ATOM 0 HG3 ARG A 803 -26.083 -0.903 -6.240 1.00 25.00 H new ATOM 0 HD2 ARG A 803 -25.033 1.091 -6.925 1.00 25.00 H new ATOM 0 HD3 ARG A 803 -24.035 1.189 -5.487 1.00 25.00 H new ATOM 0 HE ARG A 803 -23.514 -1.067 -7.361 1.00 25.00 H new ATOM 0 HH11 ARG A 803 -22.450 2.105 -6.137 1.00 25.00 H new ATOM 0 HH12 ARG A 803 -20.826 1.892 -6.799 1.00 25.00 H new ATOM 0 HH21 ARG A 803 -21.450 -1.246 -8.128 1.00 25.00 H new ATOM 0 HH22 ARG A 803 -20.280 0.056 -7.889 1.00 25.00 H new ATOM 961 N LEU A 804 -24.995 1.159 -0.903 1.00 25.00 N ATOM 962 CA LEU A 804 -25.453 1.829 0.313 1.00 25.00 C ATOM 963 C LEU A 804 -24.779 3.193 0.422 1.00 25.00 C ATOM 964 O LEU A 804 -25.104 3.990 1.290 1.00 25.00 O ATOM 965 CB LEU A 804 -25.174 0.977 1.565 1.00 25.00 C ATOM 966 CG LEU A 804 -24.185 -0.194 1.456 1.00 25.00 C ATOM 967 CD1 LEU A 804 -22.741 0.242 1.333 1.00 25.00 C ATOM 968 CD2 LEU A 804 -24.297 -1.138 2.635 1.00 25.00 C ATOM 0 H LEU A 804 -24.059 0.760 -0.827 1.00 25.00 H new ATOM 0 HA LEU A 804 -26.533 1.964 0.252 1.00 25.00 H new ATOM 0 HB2 LEU A 804 -24.810 1.645 2.345 1.00 25.00 H new ATOM 0 HB3 LEU A 804 -26.126 0.574 1.909 1.00 25.00 H new ATOM 0 HG LEU A 804 -24.468 -0.705 0.536 1.00 25.00 H new ATOM 0 HD11 LEU A 804 -22.100 -0.637 1.260 1.00 25.00 H new ATOM 0 HD12 LEU A 804 -22.621 0.854 0.439 1.00 25.00 H new ATOM 0 HD13 LEU A 804 -22.461 0.824 2.211 1.00 25.00 H new ATOM 0 HD21 LEU A 804 -23.581 -1.952 2.519 1.00 25.00 H new ATOM 0 HD22 LEU A 804 -24.084 -0.596 3.557 1.00 25.00 H new ATOM 0 HD23 LEU A 804 -25.307 -1.547 2.679 1.00 25.00 H new ATOM 980 N GLY A 805 -23.843 3.458 -0.477 1.00 25.00 N ATOM 981 CA GLY A 805 -23.178 4.754 -0.505 1.00 25.00 C ATOM 982 C GLY A 805 -22.060 4.872 0.506 1.00 25.00 C ATOM 983 O GLY A 805 -21.635 5.975 0.859 1.00 25.00 O ATOM 0 H GLY A 805 -23.528 2.801 -1.191 1.00 25.00 H new ATOM 0 HA2 GLY A 805 -22.776 4.927 -1.503 1.00 25.00 H new ATOM 0 HA3 GLY A 805 -23.913 5.536 -0.317 1.00 25.00 H new ATOM 987 N VAL A 806 -21.574 3.736 0.977 1.00 25.00 N ATOM 988 CA VAL A 806 -20.513 3.704 1.972 1.00 25.00 C ATOM 989 C VAL A 806 -19.545 2.602 1.554 1.00 25.00 C ATOM 990 O VAL A 806 -19.902 1.666 0.853 1.00 25.00 O ATOM 991 CB VAL A 806 -21.048 3.414 3.401 1.00 25.00 C ATOM 992 CG1 VAL A 806 -20.566 4.475 4.382 1.00 25.00 C ATOM 993 CG2 VAL A 806 -22.586 3.375 3.459 1.00 25.00 C ATOM 0 H VAL A 806 -21.900 2.815 0.684 1.00 25.00 H new ATOM 0 HA VAL A 806 -20.030 4.680 2.014 1.00 25.00 H new ATOM 0 HB VAL A 806 -20.661 2.432 3.674 1.00 25.00 H new ATOM 0 HG11 VAL A 806 -20.952 4.253 5.377 1.00 25.00 H new ATOM 0 HG12 VAL A 806 -19.476 4.478 4.408 1.00 25.00 H new ATOM 0 HG13 VAL A 806 -20.924 5.454 4.064 1.00 25.00 H new ATOM 0 HG21 VAL A 806 -22.906 3.169 4.480 1.00 25.00 H new ATOM 0 HG22 VAL A 806 -22.987 4.337 3.140 1.00 25.00 H new ATOM 0 HG23 VAL A 806 -22.955 2.591 2.798 1.00 25.00 H new ATOM 1003 N VAL A 807 -18.291 2.726 1.969 1.00 25.00 N ATOM 1004 CA VAL A 807 -17.230 1.836 1.557 1.00 25.00 C ATOM 1005 C VAL A 807 -17.056 0.685 2.533 1.00 25.00 C ATOM 1006 O VAL A 807 -16.905 0.896 3.743 1.00 25.00 O ATOM 1007 CB VAL A 807 -15.909 2.578 1.452 1.00 25.00 C ATOM 1008 CG1 VAL A 807 -14.809 1.634 0.972 1.00 25.00 C ATOM 1009 CG2 VAL A 807 -16.081 3.772 0.534 1.00 25.00 C ATOM 0 H VAL A 807 -17.985 3.459 2.609 1.00 25.00 H new ATOM 0 HA VAL A 807 -17.514 1.442 0.581 1.00 25.00 H new ATOM 0 HB VAL A 807 -15.606 2.946 2.432 1.00 25.00 H new ATOM 0 HG11 VAL A 807 -13.867 2.179 0.901 1.00 25.00 H new ATOM 0 HG12 VAL A 807 -14.700 0.812 1.680 1.00 25.00 H new ATOM 0 HG13 VAL A 807 -15.073 1.236 -0.008 1.00 25.00 H new ATOM 0 HG21 VAL A 807 -15.136 4.309 0.455 1.00 25.00 H new ATOM 0 HG22 VAL A 807 -16.388 3.430 -0.454 1.00 25.00 H new ATOM 0 HG23 VAL A 807 -16.843 4.437 0.941 1.00 25.00 H new ATOM 1019 N THR A 808 -17.088 -0.517 2.013 1.00 25.00 N ATOM 1020 CA THR A 808 -16.974 -1.704 2.843 1.00 25.00 C ATOM 1021 C THR A 808 -15.634 -2.374 2.688 1.00 25.00 C ATOM 1022 O THR A 808 -14.881 -2.084 1.795 1.00 25.00 O ATOM 1023 CB THR A 808 -18.064 -2.751 2.497 1.00 25.00 C ATOM 1024 OG1 THR A 808 -17.491 -3.752 1.672 1.00 25.00 O ATOM 1025 CG2 THR A 808 -19.178 -2.150 1.684 1.00 25.00 C ATOM 0 H THR A 808 -17.192 -0.706 1.016 1.00 25.00 H new ATOM 0 HA THR A 808 -17.098 -1.357 3.869 1.00 25.00 H new ATOM 0 HB THR A 808 -18.449 -3.138 3.441 1.00 25.00 H new ATOM 0 HG1 THR A 808 -17.181 -3.348 0.835 1.00 25.00 H new ATOM 0 HG21 THR A 808 -19.921 -2.916 1.463 1.00 25.00 H new ATOM 0 HG22 THR A 808 -19.646 -1.343 2.248 1.00 25.00 H new ATOM 0 HG23 THR A 808 -18.775 -1.755 0.751 1.00 25.00 H new ATOM 1033 N PHE A 809 -15.344 -3.296 3.567 1.00 25.00 N ATOM 1034 CA PHE A 809 -14.093 -4.020 3.558 1.00 25.00 C ATOM 1035 C PHE A 809 -13.765 -4.871 2.386 1.00 25.00 C ATOM 1036 O PHE A 809 -12.620 -5.031 2.074 1.00 25.00 O ATOM 1037 CB PHE A 809 -14.039 -4.873 4.808 1.00 25.00 C ATOM 1038 CG PHE A 809 -15.400 -5.240 5.348 1.00 25.00 C ATOM 1039 CD1 PHE A 809 -16.108 -6.339 4.820 1.00 25.00 C ATOM 1040 CD2 PHE A 809 -15.986 -4.481 6.381 1.00 25.00 C ATOM 1041 CE1 PHE A 809 -17.400 -6.670 5.304 1.00 25.00 C ATOM 1042 CE2 PHE A 809 -17.276 -4.805 6.876 1.00 25.00 C ATOM 1043 CZ PHE A 809 -17.986 -5.896 6.332 1.00 25.00 C ATOM 0 H PHE A 809 -15.975 -3.571 4.320 1.00 25.00 H new ATOM 0 HA PHE A 809 -13.340 -3.234 3.505 1.00 25.00 H new ATOM 0 HB2 PHE A 809 -13.485 -5.786 4.591 1.00 25.00 H new ATOM 0 HB3 PHE A 809 -13.483 -4.339 5.579 1.00 25.00 H new ATOM 0 HD1 PHE A 809 -15.662 -6.936 4.038 1.00 25.00 H new ATOM 0 HD2 PHE A 809 -15.448 -3.644 6.800 1.00 25.00 H new ATOM 0 HE1 PHE A 809 -17.935 -7.511 4.888 1.00 25.00 H new ATOM 0 HE2 PHE A 809 -17.714 -4.217 7.669 1.00 25.00 H new ATOM 0 HZ PHE A 809 -18.972 -6.139 6.699 1.00 25.00 H new ATOM 1053 N GLN A 810 -14.766 -5.408 1.726 1.00 25.00 N ATOM 1054 CA GLN A 810 -14.516 -6.186 0.528 1.00 25.00 C ATOM 1055 C GLN A 810 -14.288 -5.222 -0.606 1.00 25.00 C ATOM 1056 O GLN A 810 -13.796 -5.598 -1.671 1.00 25.00 O ATOM 1057 CB GLN A 810 -15.715 -7.068 0.212 1.00 25.00 C ATOM 1058 CG GLN A 810 -16.944 -6.275 -0.268 1.00 25.00 C ATOM 1059 CD GLN A 810 -18.259 -6.848 0.259 1.00 25.00 C ATOM 1060 OE1 GLN A 810 -18.610 -7.979 -0.025 1.00 25.00 O ATOM 1061 NE2 GLN A 810 -18.977 -6.071 1.032 1.00 25.00 N ATOM 0 H GLN A 810 -15.748 -5.324 1.991 1.00 25.00 H new ATOM 0 HA GLN A 810 -13.647 -6.828 0.673 1.00 25.00 H new ATOM 0 HB2 GLN A 810 -15.434 -7.790 -0.555 1.00 25.00 H new ATOM 0 HB3 GLN A 810 -15.983 -7.637 1.102 1.00 25.00 H new ATOM 0 HG2 GLN A 810 -16.850 -5.238 0.053 1.00 25.00 H new ATOM 0 HG3 GLN A 810 -16.965 -6.271 -1.358 1.00 25.00 H new ATOM 0 HE21 GLN A 810 -18.653 -5.129 1.250 1.00 25.00 H new ATOM 0 HE22 GLN A 810 -19.860 -6.409 1.416 1.00 25.00 H new ATOM 1070 N ALA A 811 -14.663 -3.968 -0.379 1.00 25.00 N ATOM 1071 CA ALA A 811 -14.585 -2.944 -1.410 1.00 25.00 C ATOM 1072 C ALA A 811 -13.211 -2.314 -1.450 1.00 25.00 C ATOM 1073 O ALA A 811 -12.514 -2.416 -2.423 1.00 25.00 O ATOM 1074 CB ALA A 811 -15.634 -1.927 -1.119 1.00 25.00 C ATOM 0 H ALA A 811 -15.026 -3.637 0.515 1.00 25.00 H new ATOM 0 HA ALA A 811 -14.754 -3.387 -2.392 1.00 25.00 H new ATOM 0 HB1 ALA A 811 -15.601 -1.144 -1.876 1.00 25.00 H new ATOM 0 HB2 ALA A 811 -16.615 -2.402 -1.131 1.00 25.00 H new ATOM 0 HB3 ALA A 811 -15.454 -1.490 -0.137 1.00 25.00 H new ATOM 1080 N PHE A 812 -12.838 -1.675 -0.352 1.00 25.00 N ATOM 1081 CA PHE A 812 -11.481 -1.107 -0.144 1.00 25.00 C ATOM 1082 C PHE A 812 -10.322 -1.885 -0.783 1.00 25.00 C ATOM 1083 O PHE A 812 -9.342 -1.310 -1.237 1.00 25.00 O ATOM 1084 CB PHE A 812 -11.103 -1.150 1.355 1.00 25.00 C ATOM 1085 CG PHE A 812 -11.839 -0.221 2.223 1.00 25.00 C ATOM 1086 CD1 PHE A 812 -11.606 1.157 2.235 1.00 25.00 C ATOM 1087 CD2 PHE A 812 -12.758 -0.751 3.090 1.00 25.00 C ATOM 1088 CE1 PHE A 812 -12.359 1.977 3.104 1.00 25.00 C ATOM 1089 CE2 PHE A 812 -13.529 0.036 3.943 1.00 25.00 C ATOM 1090 CZ PHE A 812 -13.350 1.385 3.944 1.00 25.00 C ATOM 0 H PHE A 812 -13.464 -1.525 0.439 1.00 25.00 H new ATOM 0 HA PHE A 812 -11.574 -0.117 -0.590 1.00 25.00 H new ATOM 0 HB2 PHE A 812 -11.261 -2.164 1.722 1.00 25.00 H new ATOM 0 HB3 PHE A 812 -10.038 -0.940 1.449 1.00 25.00 H new ATOM 0 HD1 PHE A 812 -10.858 1.590 1.587 1.00 25.00 H new ATOM 0 HD2 PHE A 812 -12.890 -1.823 3.113 1.00 25.00 H new ATOM 0 HE1 PHE A 812 -12.187 3.043 3.133 1.00 25.00 H new ATOM 0 HE2 PHE A 812 -14.260 -0.419 4.595 1.00 25.00 H new ATOM 0 HZ PHE A 812 -13.959 2.009 4.581 1.00 25.00 H new ATOM 1100 N ILE A 813 -10.426 -3.211 -0.799 1.00 25.00 N ATOM 1101 CA ILE A 813 -9.394 -4.093 -1.354 1.00 25.00 C ATOM 1102 C ILE A 813 -9.136 -3.784 -2.828 1.00 25.00 C ATOM 1103 O ILE A 813 -7.999 -3.882 -3.317 1.00 25.00 O ATOM 1104 CB ILE A 813 -9.838 -5.575 -1.274 1.00 25.00 C ATOM 1105 CG1 ILE A 813 -10.351 -5.888 0.129 1.00 25.00 C ATOM 1106 CG2 ILE A 813 -8.672 -6.533 -1.725 1.00 25.00 C ATOM 1107 CD1 ILE A 813 -9.400 -5.510 1.318 1.00 25.00 C ATOM 0 H ILE A 813 -11.233 -3.711 -0.426 1.00 25.00 H new ATOM 0 HA ILE A 813 -8.491 -3.925 -0.767 1.00 25.00 H new ATOM 0 HB ILE A 813 -10.662 -5.746 -1.967 1.00 25.00 H new ATOM 0 HG12 ILE A 813 -11.299 -5.368 0.270 1.00 25.00 H new ATOM 0 HG13 ILE A 813 -10.562 -6.956 0.186 1.00 25.00 H new ATOM 0 HG21 ILE A 813 -9.006 -7.568 -1.661 1.00 25.00 H new ATOM 0 HG22 ILE A 813 -8.391 -6.305 -2.753 1.00 25.00 H new ATOM 0 HG23 ILE A 813 -7.810 -6.389 -1.073 1.00 25.00 H new ATOM 0 HD11 ILE A 813 -9.873 -5.780 2.262 1.00 25.00 H new ATOM 0 HD12 ILE A 813 -8.458 -6.050 1.217 1.00 25.00 H new ATOM 0 HD13 ILE A 813 -9.207 -4.437 1.303 1.00 25.00 H new ATOM 1119 N ASP A 814 -10.198 -3.382 -3.506 1.00 25.00 N ATOM 1120 CA ASP A 814 -10.164 -3.003 -4.873 1.00 25.00 C ATOM 1121 C ASP A 814 -9.068 -1.938 -5.076 1.00 25.00 C ATOM 1122 O ASP A 814 -8.363 -2.010 -6.060 1.00 25.00 O ATOM 1123 CB ASP A 814 -11.537 -2.466 -5.333 1.00 25.00 C ATOM 1124 CG ASP A 814 -11.800 -2.678 -6.796 1.00 25.00 C ATOM 1125 OD1 ASP A 814 -10.888 -2.483 -7.625 1.00 25.00 O ATOM 1126 OD2 ASP A 814 -12.938 -3.068 -7.136 1.00 25.00 O ATOM 0 H ASP A 814 -11.127 -3.315 -3.090 1.00 25.00 H new ATOM 0 HA ASP A 814 -9.934 -3.879 -5.479 1.00 25.00 H new ATOM 0 HB2 ASP A 814 -12.322 -2.955 -4.756 1.00 25.00 H new ATOM 0 HB3 ASP A 814 -11.595 -1.400 -5.112 1.00 25.00 H new ATOM 1131 N PHE A 815 -8.913 -1.006 -4.157 1.00 25.00 N ATOM 1132 CA PHE A 815 -7.800 -0.031 -4.245 1.00 25.00 C ATOM 1133 C PHE A 815 -6.495 -0.680 -3.808 1.00 25.00 C ATOM 1134 O PHE A 815 -5.482 -0.521 -4.446 1.00 25.00 O ATOM 1135 CB PHE A 815 -8.019 1.205 -3.358 1.00 25.00 C ATOM 1136 CG PHE A 815 -7.182 2.412 -3.746 1.00 25.00 C ATOM 1137 CD1 PHE A 815 -5.744 2.414 -3.683 1.00 25.00 C ATOM 1138 CD2 PHE A 815 -7.828 3.562 -4.193 1.00 25.00 C ATOM 1139 CE1 PHE A 815 -5.021 3.564 -4.083 1.00 25.00 C ATOM 1140 CE2 PHE A 815 -7.103 4.705 -4.590 1.00 25.00 C ATOM 1141 CZ PHE A 815 -5.713 4.697 -4.551 1.00 25.00 C ATOM 0 H PHE A 815 -9.522 -0.888 -3.347 1.00 25.00 H new ATOM 0 HA PHE A 815 -7.760 0.285 -5.287 1.00 25.00 H new ATOM 0 HB2 PHE A 815 -9.073 1.482 -3.395 1.00 25.00 H new ATOM 0 HB3 PHE A 815 -7.795 0.940 -2.325 1.00 25.00 H new ATOM 0 HD1 PHE A 815 -5.217 1.539 -3.331 1.00 25.00 H new ATOM 0 HD2 PHE A 815 -8.907 3.579 -4.237 1.00 25.00 H new ATOM 0 HE1 PHE A 815 -3.942 3.572 -4.029 1.00 25.00 H new ATOM 0 HE2 PHE A 815 -7.628 5.587 -4.925 1.00 25.00 H new ATOM 0 HZ PHE A 815 -5.161 5.565 -4.882 1.00 25.00 H new ATOM 1151 N MET A 816 -6.511 -1.385 -2.692 1.00 25.00 N ATOM 1152 CA MET A 816 -5.294 -1.991 -2.155 1.00 25.00 C ATOM 1153 C MET A 816 -4.523 -2.883 -3.134 1.00 25.00 C ATOM 1154 O MET A 816 -3.323 -2.961 -3.068 1.00 25.00 O ATOM 1155 CB MET A 816 -5.671 -2.832 -0.960 1.00 25.00 C ATOM 1156 CG MET A 816 -4.774 -2.671 0.271 1.00 25.00 C ATOM 1157 SD MET A 816 -3.054 -3.097 0.069 1.00 25.00 S ATOM 1158 CE MET A 816 -2.342 -1.469 0.094 1.00 25.00 C ATOM 0 H MET A 816 -7.349 -1.555 -2.136 1.00 25.00 H new ATOM 0 HA MET A 816 -4.631 -1.161 -1.910 1.00 25.00 H new ATOM 0 HB2 MET A 816 -6.695 -2.589 -0.676 1.00 25.00 H new ATOM 0 HB3 MET A 816 -5.663 -3.880 -1.259 1.00 25.00 H new ATOM 0 HG2 MET A 816 -4.831 -1.634 0.601 1.00 25.00 H new ATOM 0 HG3 MET A 816 -5.184 -3.284 1.074 1.00 25.00 H new ATOM 0 HE1 MET A 816 -1.346 -1.501 -0.347 1.00 25.00 H new ATOM 0 HE2 MET A 816 -2.971 -0.788 -0.479 1.00 25.00 H new ATOM 0 HE3 MET A 816 -2.272 -1.118 1.124 1.00 25.00 H new ATOM 1168 N SER A 817 -5.182 -3.558 -4.060 1.00 25.00 N ATOM 1169 CA SER A 817 -4.430 -4.374 -5.024 1.00 25.00 C ATOM 1170 C SER A 817 -3.737 -3.500 -6.078 1.00 25.00 C ATOM 1171 O SER A 817 -2.791 -3.927 -6.742 1.00 25.00 O ATOM 1172 CB SER A 817 -5.340 -5.405 -5.680 1.00 25.00 C ATOM 1173 OG SER A 817 -4.969 -5.658 -7.031 1.00 25.00 O ATOM 0 H SER A 817 -6.196 -3.566 -4.172 1.00 25.00 H new ATOM 0 HA SER A 817 -3.651 -4.905 -4.477 1.00 25.00 H new ATOM 0 HB2 SER A 817 -5.302 -6.335 -5.113 1.00 25.00 H new ATOM 0 HB3 SER A 817 -6.371 -5.053 -5.647 1.00 25.00 H new ATOM 0 HG SER A 817 -4.430 -6.475 -7.075 1.00 25.00 H new ATOM 1179 N ARG A 818 -4.227 -2.278 -6.216 1.00 25.00 N ATOM 1180 CA ARG A 818 -3.675 -1.282 -7.173 1.00 25.00 C ATOM 1181 C ARG A 818 -2.356 -0.739 -6.664 1.00 25.00 C ATOM 1182 O ARG A 818 -1.585 -0.182 -7.425 1.00 25.00 O ATOM 1183 CB ARG A 818 -4.611 -0.080 -7.401 1.00 25.00 C ATOM 1184 CG ARG A 818 -6.055 -0.432 -7.657 1.00 25.00 C ATOM 1185 CD ARG A 818 -6.278 -1.152 -8.961 1.00 25.00 C ATOM 1186 NE ARG A 818 -7.673 -1.618 -9.032 1.00 25.00 N ATOM 1187 CZ ARG A 818 -8.300 -2.001 -10.135 1.00 25.00 C ATOM 1188 NH1 ARG A 818 -7.715 -1.992 -11.308 1.00 25.00 N ATOM 1189 NH2 ARG A 818 -9.535 -2.397 -10.060 1.00 25.00 N ATOM 0 H ARG A 818 -5.019 -1.931 -5.676 1.00 25.00 H new ATOM 0 HA ARG A 818 -3.553 -1.814 -8.116 1.00 25.00 H new ATOM 0 HB2 ARG A 818 -4.561 0.570 -6.527 1.00 25.00 H new ATOM 0 HB3 ARG A 818 -4.238 0.495 -8.248 1.00 25.00 H new ATOM 0 HG2 ARG A 818 -6.418 -1.056 -6.840 1.00 25.00 H new ATOM 0 HG3 ARG A 818 -6.650 0.481 -7.650 1.00 25.00 H new ATOM 0 HD2 ARG A 818 -6.062 -0.487 -9.797 1.00 25.00 H new ATOM 0 HD3 ARG A 818 -5.596 -1.998 -9.043 1.00 25.00 H new ATOM 0 HE ARG A 818 -8.201 -1.649 -8.160 1.00 25.00 H new ATOM 0 HH11 ARG A 818 -6.747 -1.683 -11.393 1.00 25.00 H new ATOM 0 HH12 ARG A 818 -8.228 -2.294 -12.136 1.00 25.00 H new ATOM 0 HH21 ARG A 818 -10.012 -2.411 -9.159 1.00 25.00 H new ATOM 0 HH22 ARG A 818 -10.027 -2.694 -10.902 1.00 25.00 H new ATOM 1203 N GLU A 819 -2.137 -0.903 -5.367 1.00 25.00 N ATOM 1204 CA GLU A 819 -0.940 -0.413 -4.663 1.00 25.00 C ATOM 1205 C GLU A 819 0.353 -0.816 -5.383 1.00 25.00 C ATOM 1206 O GLU A 819 1.340 -0.102 -5.368 1.00 25.00 O ATOM 1207 CB GLU A 819 -0.942 -1.074 -3.290 1.00 25.00 C ATOM 1208 CG GLU A 819 0.327 -1.047 -2.491 1.00 25.00 C ATOM 1209 CD GLU A 819 0.627 0.292 -1.848 1.00 25.00 C ATOM 1210 OE1 GLU A 819 -0.302 0.882 -1.259 1.00 25.00 O ATOM 1211 OE2 GLU A 819 1.792 0.745 -1.917 1.00 25.00 O ATOM 0 H GLU A 819 -2.793 -1.388 -4.755 1.00 25.00 H new ATOM 0 HA GLU A 819 -0.970 0.675 -4.614 1.00 25.00 H new ATOM 0 HB2 GLU A 819 -1.722 -0.601 -2.693 1.00 25.00 H new ATOM 0 HB3 GLU A 819 -1.231 -2.117 -3.422 1.00 25.00 H new ATOM 0 HG2 GLU A 819 0.269 -1.807 -1.712 1.00 25.00 H new ATOM 0 HG3 GLU A 819 1.158 -1.320 -3.141 1.00 25.00 H new ATOM 1218 N THR A 820 0.308 -1.977 -6.023 1.00 25.00 N ATOM 1219 CA THR A 820 1.452 -2.547 -6.738 1.00 25.00 C ATOM 1220 C THR A 820 1.940 -1.711 -7.947 1.00 25.00 C ATOM 1221 O THR A 820 2.924 -2.068 -8.608 1.00 25.00 O ATOM 1222 CB THR A 820 1.086 -3.963 -7.249 1.00 25.00 C ATOM 1223 OG1 THR A 820 -0.047 -3.884 -8.123 1.00 25.00 O ATOM 1224 CG2 THR A 820 0.702 -4.884 -6.090 1.00 25.00 C ATOM 0 H THR A 820 -0.529 -2.558 -6.063 1.00 25.00 H new ATOM 0 HA THR A 820 2.268 -2.564 -6.015 1.00 25.00 H new ATOM 0 HB THR A 820 1.959 -4.361 -7.767 1.00 25.00 H new ATOM 0 HG1 THR A 820 -0.871 -3.906 -7.593 1.00 25.00 H new ATOM 0 HG21 THR A 820 0.450 -5.871 -6.478 1.00 25.00 H new ATOM 0 HG22 THR A 820 1.541 -4.969 -5.399 1.00 25.00 H new ATOM 0 HG23 THR A 820 -0.159 -4.469 -5.566 1.00 25.00 H new ATOM 1232 N ALA A 821 1.246 -0.615 -8.233 1.00 25.00 N ATOM 1233 CA ALA A 821 1.610 0.306 -9.306 1.00 25.00 C ATOM 1234 C ALA A 821 2.616 1.338 -8.752 1.00 25.00 C ATOM 1235 O ALA A 821 3.437 1.009 -7.912 1.00 25.00 O ATOM 1236 CB ALA A 821 0.343 1.002 -9.851 1.00 25.00 C ATOM 0 H ALA A 821 0.408 -0.338 -7.723 1.00 25.00 H new ATOM 0 HA ALA A 821 2.074 -0.237 -10.129 1.00 25.00 H new ATOM 0 HB1 ALA A 821 0.620 1.688 -10.651 1.00 25.00 H new ATOM 0 HB2 ALA A 821 -0.346 0.252 -10.239 1.00 25.00 H new ATOM 0 HB3 ALA A 821 -0.141 1.558 -9.048 1.00 25.00 H new ATOM 1242 N ASP A 822 2.552 2.574 -9.234 1.00 25.00 N ATOM 1243 CA ASP A 822 3.467 3.630 -8.788 1.00 25.00 C ATOM 1244 C ASP A 822 2.678 4.855 -8.378 1.00 25.00 C ATOM 1245 O ASP A 822 1.742 5.249 -9.082 1.00 25.00 O ATOM 1246 CB ASP A 822 4.418 4.033 -9.919 1.00 25.00 C ATOM 1247 CG ASP A 822 5.648 4.756 -9.407 1.00 25.00 C ATOM 1248 OD1 ASP A 822 6.095 4.425 -8.286 1.00 25.00 O ATOM 1249 OD2 ASP A 822 6.174 5.634 -10.118 1.00 25.00 O ATOM 0 H ASP A 822 1.876 2.875 -9.936 1.00 25.00 H new ATOM 0 HA ASP A 822 4.040 3.245 -7.945 1.00 25.00 H new ATOM 0 HB2 ASP A 822 4.725 3.142 -10.467 1.00 25.00 H new ATOM 0 HB3 ASP A 822 3.889 4.675 -10.624 1.00 25.00 H new ATOM 1254 N THR A 823 3.051 5.461 -7.259 1.00 25.00 N ATOM 1255 CA THR A 823 2.367 6.660 -6.785 1.00 25.00 C ATOM 1256 C THR A 823 3.301 7.658 -6.117 1.00 25.00 C ATOM 1257 O THR A 823 4.273 7.284 -5.484 1.00 25.00 O ATOM 1258 CB THR A 823 1.232 6.325 -5.791 1.00 25.00 C ATOM 1259 OG1 THR A 823 0.781 4.985 -5.997 1.00 25.00 O ATOM 1260 CG2 THR A 823 0.065 7.257 -6.005 1.00 25.00 C ATOM 0 H THR A 823 3.818 5.146 -6.665 1.00 25.00 H new ATOM 0 HA THR A 823 1.953 7.114 -7.685 1.00 25.00 H new ATOM 0 HB THR A 823 1.619 6.438 -4.778 1.00 25.00 H new ATOM 0 HG1 THR A 823 0.063 4.780 -5.362 1.00 25.00 H new ATOM 0 HG21 THR A 823 -0.730 7.013 -5.300 1.00 25.00 H new ATOM 0 HG22 THR A 823 0.387 8.286 -5.846 1.00 25.00 H new ATOM 0 HG23 THR A 823 -0.307 7.146 -7.024 1.00 25.00 H new ATOM 1268 N ASP A 824 2.984 8.937 -6.254 1.00 25.00 N ATOM 1269 CA ASP A 824 3.765 10.009 -5.627 1.00 25.00 C ATOM 1270 C ASP A 824 3.643 9.922 -4.102 1.00 25.00 C ATOM 1271 O ASP A 824 4.591 10.120 -3.352 1.00 25.00 O ATOM 1272 CB ASP A 824 3.227 11.358 -6.116 1.00 25.00 C ATOM 1273 CG ASP A 824 4.066 12.531 -5.646 1.00 25.00 C ATOM 1274 OD1 ASP A 824 5.141 12.772 -6.234 1.00 25.00 O ATOM 1275 OD2 ASP A 824 3.636 13.227 -4.701 1.00 25.00 O ATOM 0 H ASP A 824 2.186 9.266 -6.797 1.00 25.00 H new ATOM 0 HA ASP A 824 4.816 9.908 -5.898 1.00 25.00 H new ATOM 0 HB2 ASP A 824 3.191 11.356 -7.205 1.00 25.00 H new ATOM 0 HB3 ASP A 824 2.203 11.485 -5.764 1.00 25.00 H new ATOM 1280 N THR A 825 2.441 9.593 -3.666 1.00 25.00 N ATOM 1281 CA THR A 825 2.099 9.443 -2.257 1.00 25.00 C ATOM 1282 C THR A 825 2.642 8.146 -1.659 1.00 25.00 C ATOM 1283 O THR A 825 2.618 7.968 -0.441 1.00 25.00 O ATOM 1284 CB THR A 825 0.591 9.417 -2.109 1.00 25.00 C ATOM 1285 OG1 THR A 825 0.082 8.502 -3.072 1.00 25.00 O ATOM 1286 CG2 THR A 825 -0.024 10.763 -2.371 1.00 25.00 C ATOM 0 H THR A 825 1.656 9.418 -4.293 1.00 25.00 H new ATOM 0 HA THR A 825 2.546 10.286 -1.730 1.00 25.00 H new ATOM 0 HB THR A 825 0.345 9.127 -1.087 1.00 25.00 H new ATOM 0 HG1 THR A 825 -0.868 8.687 -3.229 1.00 25.00 H new ATOM 0 HG21 THR A 825 -1.106 10.698 -2.254 1.00 25.00 H new ATOM 0 HG22 THR A 825 0.375 11.489 -1.663 1.00 25.00 H new ATOM 0 HG23 THR A 825 0.212 11.080 -3.387 1.00 25.00 H new ATOM 1294 N ALA A 826 3.098 7.230 -2.504 1.00 25.00 N ATOM 1295 CA ALA A 826 3.581 5.922 -2.054 1.00 25.00 C ATOM 1296 C ALA A 826 4.785 6.037 -1.103 1.00 25.00 C ATOM 1297 O ALA A 826 5.032 5.151 -0.295 1.00 25.00 O ATOM 1298 CB ALA A 826 3.931 5.049 -3.278 1.00 25.00 C ATOM 0 H ALA A 826 3.145 7.367 -3.514 1.00 25.00 H new ATOM 0 HA ALA A 826 2.780 5.448 -1.486 1.00 25.00 H new ATOM 0 HB1 ALA A 826 4.290 4.077 -2.941 1.00 25.00 H new ATOM 0 HB2 ALA A 826 3.042 4.914 -3.895 1.00 25.00 H new ATOM 0 HB3 ALA A 826 4.708 5.539 -3.864 1.00 25.00 H new ATOM 1304 N ASP A 827 5.508 7.141 -1.178 1.00 25.00 N ATOM 1305 CA ASP A 827 6.638 7.380 -0.269 1.00 25.00 C ATOM 1306 C ASP A 827 6.156 7.361 1.186 1.00 25.00 C ATOM 1307 O ASP A 827 6.839 6.886 2.091 1.00 25.00 O ATOM 1308 CB ASP A 827 7.254 8.746 -0.571 1.00 25.00 C ATOM 1309 CG ASP A 827 8.417 9.077 0.348 1.00 25.00 C ATOM 1310 OD1 ASP A 827 9.483 8.441 0.222 1.00 25.00 O ATOM 1311 OD2 ASP A 827 8.263 9.988 1.194 1.00 25.00 O ATOM 0 H ASP A 827 5.342 7.888 -1.852 1.00 25.00 H new ATOM 0 HA ASP A 827 7.381 6.595 -0.414 1.00 25.00 H new ATOM 0 HB2 ASP A 827 7.596 8.766 -1.606 1.00 25.00 H new ATOM 0 HB3 ASP A 827 6.488 9.516 -0.474 1.00 25.00 H new ATOM 1316 N GLN A 828 4.954 7.874 1.400 1.00 25.00 N ATOM 1317 CA GLN A 828 4.391 7.970 2.741 1.00 25.00 C ATOM 1318 C GLN A 828 4.063 6.605 3.324 1.00 25.00 C ATOM 1319 O GLN A 828 4.262 6.369 4.513 1.00 25.00 O ATOM 1320 CB GLN A 828 3.082 8.754 2.715 1.00 25.00 C ATOM 1321 CG GLN A 828 3.125 10.091 1.989 1.00 25.00 C ATOM 1322 CD GLN A 828 1.752 10.721 1.942 1.00 25.00 C ATOM 1323 OE1 GLN A 828 1.550 11.854 2.354 1.00 25.00 O ATOM 1324 NE2 GLN A 828 0.796 9.976 1.452 1.00 25.00 N ATOM 0 H GLN A 828 4.348 8.231 0.662 1.00 25.00 H new ATOM 0 HA GLN A 828 5.147 8.465 3.350 1.00 25.00 H new ATOM 0 HB2 GLN A 828 2.318 8.133 2.248 1.00 25.00 H new ATOM 0 HB3 GLN A 828 2.765 8.930 3.743 1.00 25.00 H new ATOM 0 HG2 GLN A 828 3.821 10.762 2.494 1.00 25.00 H new ATOM 0 HG3 GLN A 828 3.499 9.948 0.975 1.00 25.00 H new ATOM 0 HE21 GLN A 828 1.003 9.035 1.118 1.00 25.00 H new ATOM 0 HE22 GLN A 828 -0.157 10.336 1.404 1.00 25.00 H new ATOM 1333 N VAL A 829 3.535 5.709 2.498 1.00 25.00 N ATOM 1334 CA VAL A 829 3.114 4.403 2.999 1.00 25.00 C ATOM 1335 C VAL A 829 4.358 3.532 3.241 1.00 25.00 C ATOM 1336 O VAL A 829 4.416 2.749 4.201 1.00 25.00 O ATOM 1337 CB VAL A 829 2.031 3.716 2.075 1.00 25.00 C ATOM 1338 CG1 VAL A 829 2.519 3.512 0.662 1.00 25.00 C ATOM 1339 CG2 VAL A 829 1.581 2.388 2.658 1.00 25.00 C ATOM 0 H VAL A 829 3.390 5.856 1.499 1.00 25.00 H new ATOM 0 HA VAL A 829 2.604 4.536 3.953 1.00 25.00 H new ATOM 0 HB VAL A 829 1.183 4.400 2.037 1.00 25.00 H new ATOM 0 HG11 VAL A 829 1.736 3.037 0.072 1.00 25.00 H new ATOM 0 HG12 VAL A 829 2.771 4.477 0.221 1.00 25.00 H new ATOM 0 HG13 VAL A 829 3.403 2.875 0.671 1.00 25.00 H new ATOM 0 HG21 VAL A 829 0.836 1.937 2.003 1.00 25.00 H new ATOM 0 HG22 VAL A 829 2.438 1.721 2.747 1.00 25.00 H new ATOM 0 HG23 VAL A 829 1.145 2.552 3.644 1.00 25.00 H new ATOM 1349 N MET A 830 5.369 3.694 2.395 1.00 25.00 N ATOM 1350 CA MET A 830 6.613 2.931 2.516 1.00 25.00 C ATOM 1351 C MET A 830 7.448 3.333 3.733 1.00 25.00 C ATOM 1352 O MET A 830 8.399 2.640 4.095 1.00 25.00 O ATOM 1353 CB MET A 830 7.456 3.097 1.255 1.00 25.00 C ATOM 1354 CG MET A 830 6.874 2.398 0.040 1.00 25.00 C ATOM 1355 SD MET A 830 8.108 2.263 -1.261 1.00 25.00 S ATOM 1356 CE MET A 830 7.153 1.546 -2.574 1.00 25.00 C ATOM 0 H MET A 830 5.354 4.349 1.613 1.00 25.00 H new ATOM 0 HA MET A 830 6.322 1.889 2.648 1.00 25.00 H new ATOM 0 HB2 MET A 830 7.563 4.160 1.036 1.00 25.00 H new ATOM 0 HB3 MET A 830 8.457 2.708 1.443 1.00 25.00 H new ATOM 0 HG2 MET A 830 6.521 1.405 0.319 1.00 25.00 H new ATOM 0 HG3 MET A 830 6.010 2.952 -0.326 1.00 25.00 H new ATOM 0 HE1 MET A 830 7.787 1.403 -3.449 1.00 25.00 H new ATOM 0 HE2 MET A 830 6.757 0.583 -2.252 1.00 25.00 H new ATOM 0 HE3 MET A 830 6.328 2.211 -2.828 1.00 25.00 H new ATOM 1366 N ALA A 831 7.091 4.431 4.389 1.00 25.00 N ATOM 1367 CA ALA A 831 7.796 4.867 5.595 1.00 25.00 C ATOM 1368 C ALA A 831 7.760 3.772 6.678 1.00 25.00 C ATOM 1369 O ALA A 831 8.633 3.711 7.553 1.00 25.00 O ATOM 1370 CB ALA A 831 7.172 6.162 6.122 1.00 25.00 C ATOM 0 H ALA A 831 6.319 5.037 4.109 1.00 25.00 H new ATOM 0 HA ALA A 831 8.839 5.053 5.340 1.00 25.00 H new ATOM 0 HB1 ALA A 831 7.701 6.482 7.020 1.00 25.00 H new ATOM 0 HB2 ALA A 831 7.247 6.938 5.361 1.00 25.00 H new ATOM 0 HB3 ALA A 831 6.123 5.989 6.361 1.00 25.00 H new ATOM 1376 N SER A 832 6.761 2.900 6.604 1.00 25.00 N ATOM 1377 CA SER A 832 6.618 1.782 7.536 1.00 25.00 C ATOM 1378 C SER A 832 7.823 0.844 7.516 1.00 25.00 C ATOM 1379 O SER A 832 8.124 0.189 8.510 1.00 25.00 O ATOM 1380 CB SER A 832 5.362 0.991 7.183 1.00 25.00 C ATOM 1381 OG SER A 832 4.268 1.875 6.985 1.00 25.00 O ATOM 0 H SER A 832 6.027 2.946 5.898 1.00 25.00 H new ATOM 0 HA SER A 832 6.546 2.201 8.540 1.00 25.00 H new ATOM 0 HB2 SER A 832 5.534 0.405 6.280 1.00 25.00 H new ATOM 0 HB3 SER A 832 5.130 0.286 7.982 1.00 25.00 H new ATOM 0 HG SER A 832 4.236 2.150 6.045 1.00 25.00 H new ATOM 1387 N PHE A 833 8.533 0.789 6.397 1.00 25.00 N ATOM 1388 CA PHE A 833 9.696 -0.087 6.276 1.00 25.00 C ATOM 1389 C PHE A 833 10.814 0.320 7.244 1.00 25.00 C ATOM 1390 O PHE A 833 11.642 -0.503 7.619 1.00 25.00 O ATOM 1391 CB PHE A 833 10.199 -0.094 4.842 1.00 25.00 C ATOM 1392 CG PHE A 833 9.159 -0.521 3.828 1.00 25.00 C ATOM 1393 CD1 PHE A 833 8.106 -1.404 4.171 1.00 25.00 C ATOM 1394 CD2 PHE A 833 9.228 -0.037 2.511 1.00 25.00 C ATOM 1395 CE1 PHE A 833 7.140 -1.781 3.216 1.00 25.00 C ATOM 1396 CE2 PHE A 833 8.270 -0.427 1.545 1.00 25.00 C ATOM 1397 CZ PHE A 833 7.222 -1.294 1.905 1.00 25.00 C ATOM 0 H PHE A 833 8.327 1.337 5.562 1.00 25.00 H new ATOM 0 HA PHE A 833 9.386 -1.097 6.546 1.00 25.00 H new ATOM 0 HB2 PHE A 833 10.552 0.905 4.587 1.00 25.00 H new ATOM 0 HB3 PHE A 833 11.057 -0.763 4.772 1.00 25.00 H new ATOM 0 HD1 PHE A 833 8.042 -1.793 5.176 1.00 25.00 H new ATOM 0 HD2 PHE A 833 10.021 0.641 2.232 1.00 25.00 H new ATOM 0 HE1 PHE A 833 6.336 -2.446 3.495 1.00 25.00 H new ATOM 0 HE2 PHE A 833 8.343 -0.059 0.532 1.00 25.00 H new ATOM 0 HZ PHE A 833 6.483 -1.583 1.173 1.00 25.00 H new ATOM 1407 N LYS A 834 10.835 1.577 7.683 1.00 25.00 N ATOM 1408 CA LYS A 834 11.827 2.003 8.681 1.00 25.00 C ATOM 1409 C LYS A 834 11.499 1.356 10.020 1.00 25.00 C ATOM 1410 O LYS A 834 12.392 0.979 10.767 1.00 25.00 O ATOM 1411 CB LYS A 834 11.843 3.537 8.836 1.00 25.00 C ATOM 1412 CG LYS A 834 12.776 4.072 9.963 1.00 25.00 C ATOM 1413 CD LYS A 834 14.220 3.787 9.747 1.00 25.00 C ATOM 1414 CE LYS A 834 14.880 4.089 11.040 1.00 25.00 C ATOM 1415 NZ LYS A 834 16.336 3.701 11.078 1.00 25.00 N ATOM 0 H LYS A 834 10.194 2.308 7.375 1.00 25.00 H new ATOM 0 HA LYS A 834 12.814 1.688 8.343 1.00 25.00 H new ATOM 0 HB2 LYS A 834 12.150 3.980 7.889 1.00 25.00 H new ATOM 0 HB3 LYS A 834 10.827 3.878 9.033 1.00 25.00 H new ATOM 0 HG2 LYS A 834 12.639 5.150 10.051 1.00 25.00 H new ATOM 0 HG3 LYS A 834 12.469 3.633 10.912 1.00 25.00 H new ATOM 0 HD2 LYS A 834 14.376 2.747 9.460 1.00 25.00 H new ATOM 0 HD3 LYS A 834 14.626 4.404 8.945 1.00 25.00 H new ATOM 0 HE2 LYS A 834 14.791 5.156 11.243 1.00 25.00 H new ATOM 0 HE3 LYS A 834 14.352 3.567 11.839 1.00 25.00 H new ATOM 0 HZ1 LYS A 834 16.713 3.861 12.034 1.00 25.00 H new ATOM 0 HZ2 LYS A 834 16.434 2.696 10.831 1.00 25.00 H new ATOM 0 HZ3 LYS A 834 16.867 4.279 10.396 1.00 25.00 H new ATOM 1429 N ILE A 835 10.217 1.218 10.313 1.00 25.00 N ATOM 1430 CA ILE A 835 9.774 0.631 11.577 1.00 25.00 C ATOM 1431 C ILE A 835 10.125 -0.853 11.528 1.00 25.00 C ATOM 1432 O ILE A 835 10.598 -1.428 12.507 1.00 25.00 O ATOM 1433 CB ILE A 835 8.234 0.833 11.815 1.00 25.00 C ATOM 1434 CG1 ILE A 835 7.927 2.319 12.091 1.00 25.00 C ATOM 1435 CG2 ILE A 835 7.743 0.013 13.026 1.00 25.00 C ATOM 1436 CD1 ILE A 835 7.610 3.148 10.876 1.00 25.00 C ATOM 0 H ILE A 835 9.459 1.504 9.694 1.00 25.00 H new ATOM 0 HA ILE A 835 10.274 1.126 12.410 1.00 25.00 H new ATOM 0 HB ILE A 835 7.721 0.497 10.914 1.00 25.00 H new ATOM 0 HG12 ILE A 835 7.084 2.377 12.780 1.00 25.00 H new ATOM 0 HG13 ILE A 835 8.784 2.762 12.599 1.00 25.00 H new ATOM 0 HG21 ILE A 835 6.674 0.174 13.165 1.00 25.00 H new ATOM 0 HG22 ILE A 835 7.931 -1.046 12.849 1.00 25.00 H new ATOM 0 HG23 ILE A 835 8.277 0.331 13.921 1.00 25.00 H new ATOM 0 HD11 ILE A 835 7.410 4.176 11.179 1.00 25.00 H new ATOM 0 HD12 ILE A 835 8.458 3.130 10.192 1.00 25.00 H new ATOM 0 HD13 ILE A 835 6.732 2.739 10.376 1.00 25.00 H new ATOM 1448 N LEU A 836 9.906 -1.451 10.367 1.00 25.00 N ATOM 1449 CA LEU A 836 10.208 -2.861 10.131 1.00 25.00 C ATOM 1450 C LEU A 836 11.709 -3.140 10.314 1.00 25.00 C ATOM 1451 O LEU A 836 12.103 -4.108 10.962 1.00 25.00 O ATOM 1452 CB LEU A 836 9.783 -3.205 8.700 1.00 25.00 C ATOM 1453 CG LEU A 836 9.225 -4.596 8.373 1.00 25.00 C ATOM 1454 CD1 LEU A 836 9.291 -4.748 6.863 1.00 25.00 C ATOM 1455 CD2 LEU A 836 9.942 -5.759 9.034 1.00 25.00 C ATOM 0 H LEU A 836 9.512 -0.973 9.556 1.00 25.00 H new ATOM 0 HA LEU A 836 9.667 -3.476 10.850 1.00 25.00 H new ATOM 0 HB2 LEU A 836 9.029 -2.476 8.403 1.00 25.00 H new ATOM 0 HB3 LEU A 836 10.650 -3.046 8.059 1.00 25.00 H new ATOM 0 HG LEU A 836 8.211 -4.643 8.771 1.00 25.00 H new ATOM 0 HD11 LEU A 836 8.903 -5.726 6.578 1.00 25.00 H new ATOM 0 HD12 LEU A 836 8.691 -3.969 6.392 1.00 25.00 H new ATOM 0 HD13 LEU A 836 10.326 -4.658 6.533 1.00 25.00 H new ATOM 0 HD21 LEU A 836 9.469 -6.695 8.737 1.00 25.00 H new ATOM 0 HD22 LEU A 836 10.987 -5.766 8.723 1.00 25.00 H new ATOM 0 HD23 LEU A 836 9.886 -5.652 10.117 1.00 25.00 H new ATOM 1467 N ALA A 837 12.540 -2.276 9.744 1.00 25.00 N ATOM 1468 CA ALA A 837 13.993 -2.401 9.846 1.00 25.00 C ATOM 1469 C ALA A 837 14.451 -2.178 11.288 1.00 25.00 C ATOM 1470 O ALA A 837 15.373 -2.828 11.786 1.00 25.00 O ATOM 1471 CB ALA A 837 14.673 -1.354 8.896 1.00 25.00 C ATOM 0 H ALA A 837 12.230 -1.471 9.200 1.00 25.00 H new ATOM 0 HA ALA A 837 14.285 -3.407 9.546 1.00 25.00 H new ATOM 0 HB1 ALA A 837 15.757 -1.445 8.970 1.00 25.00 H new ATOM 0 HB2 ALA A 837 14.363 -1.540 7.868 1.00 25.00 H new ATOM 0 HB3 ALA A 837 14.373 -0.348 9.189 1.00 25.00 H new ATOM 1477 N GLY A 838 13.823 -1.232 11.955 1.00 25.00 N ATOM 1478 CA GLY A 838 14.260 -0.849 13.276 1.00 25.00 C ATOM 1479 C GLY A 838 15.272 0.251 13.059 1.00 25.00 C ATOM 1480 O GLY A 838 14.890 1.357 12.701 1.00 25.00 O ATOM 0 H GLY A 838 13.014 -0.719 11.605 1.00 25.00 H new ATOM 0 HA2 GLY A 838 13.423 -0.500 13.881 1.00 25.00 H new ATOM 0 HA3 GLY A 838 14.704 -1.693 13.803 1.00 25.00 H new ATOM 1484 N ASP A 839 16.558 -0.020 13.257 1.00 25.00 N ATOM 1485 CA ASP A 839 17.576 1.013 13.041 1.00 25.00 C ATOM 1486 C ASP A 839 18.584 0.662 11.957 1.00 25.00 C ATOM 1487 O ASP A 839 19.535 1.396 11.711 1.00 25.00 O ATOM 1488 CB ASP A 839 18.286 1.378 14.341 1.00 25.00 C ATOM 1489 CG ASP A 839 18.728 2.841 14.362 1.00 25.00 C ATOM 1490 OD1 ASP A 839 18.141 3.663 13.603 1.00 25.00 O ATOM 1491 OD2 ASP A 839 19.646 3.172 15.138 1.00 25.00 O ATOM 0 H ASP A 839 16.919 -0.924 13.560 1.00 25.00 H new ATOM 0 HA ASP A 839 17.032 1.886 12.681 1.00 25.00 H new ATOM 0 HB2 ASP A 839 17.620 1.189 15.183 1.00 25.00 H new ATOM 0 HB3 ASP A 839 19.156 0.735 14.472 1.00 25.00 H new ATOM 1496 N LYS A 840 18.397 -0.475 11.307 1.00 25.00 N ATOM 1497 CA LYS A 840 19.370 -0.917 10.311 1.00 25.00 C ATOM 1498 C LYS A 840 19.128 -0.077 9.059 1.00 25.00 C ATOM 1499 O LYS A 840 18.009 0.332 8.813 1.00 25.00 O ATOM 1500 CB LYS A 840 19.264 -2.419 10.065 1.00 25.00 C ATOM 1501 CG LYS A 840 17.886 -2.896 9.770 1.00 25.00 C ATOM 1502 CD LYS A 840 17.766 -4.401 9.820 1.00 25.00 C ATOM 1503 CE LYS A 840 18.385 -5.101 8.613 1.00 25.00 C ATOM 1504 NZ LYS A 840 18.088 -6.560 8.627 1.00 25.00 N ATOM 0 H LYS A 840 17.601 -1.099 11.443 1.00 25.00 H new ATOM 0 HA LYS A 840 20.394 -0.766 10.654 1.00 25.00 H new ATOM 0 HB2 LYS A 840 19.914 -2.685 9.232 1.00 25.00 H new ATOM 0 HB3 LYS A 840 19.638 -2.946 10.943 1.00 25.00 H new ATOM 0 HG2 LYS A 840 17.193 -2.456 10.487 1.00 25.00 H new ATOM 0 HG3 LYS A 840 17.588 -2.545 8.782 1.00 25.00 H new ATOM 0 HD2 LYS A 840 18.246 -4.766 10.728 1.00 25.00 H new ATOM 0 HD3 LYS A 840 16.712 -4.672 9.886 1.00 25.00 H new ATOM 0 HE2 LYS A 840 18.000 -4.657 7.695 1.00 25.00 H new ATOM 0 HE3 LYS A 840 19.464 -4.947 8.613 1.00 25.00 H new ATOM 0 HZ1 LYS A 840 18.630 -7.032 7.875 1.00 25.00 H new ATOM 0 HZ2 LYS A 840 18.355 -6.960 9.549 1.00 25.00 H new ATOM 0 HZ3 LYS A 840 17.071 -6.709 8.466 1.00 25.00 H new ATOM 1518 N ASN A 841 20.173 0.197 8.290 1.00 25.00 N ATOM 1519 CA ASN A 841 20.057 1.072 7.108 1.00 25.00 C ATOM 1520 C ASN A 841 19.399 0.423 5.894 1.00 25.00 C ATOM 1521 O ASN A 841 19.146 1.085 4.906 1.00 25.00 O ATOM 1522 CB ASN A 841 21.443 1.587 6.687 1.00 25.00 C ATOM 1523 CG ASN A 841 22.353 0.508 6.245 1.00 25.00 C ATOM 1524 OD1 ASN A 841 22.143 -0.230 5.313 1.00 25.00 O ATOM 1525 ND2 ASN A 841 23.398 0.421 6.961 1.00 25.00 N ATOM 0 H ASN A 841 21.112 -0.167 8.454 1.00 25.00 H new ATOM 0 HA ASN A 841 19.404 1.885 7.427 1.00 25.00 H new ATOM 0 HB2 ASN A 841 21.326 2.309 5.879 1.00 25.00 H new ATOM 0 HB3 ASN A 841 21.897 2.117 7.524 1.00 25.00 H new ATOM 0 HD21 ASN A 841 24.098 -0.292 6.757 1.00 25.00 H new ATOM 0 HD22 ASN A 841 23.538 1.065 7.740 1.00 25.00 H new ATOM 1532 N TYR A 842 19.139 -0.868 5.972 1.00 25.00 N ATOM 1533 CA TYR A 842 18.584 -1.601 4.842 1.00 25.00 C ATOM 1534 C TYR A 842 17.561 -2.561 5.389 1.00 25.00 C ATOM 1535 O TYR A 842 17.568 -2.834 6.567 1.00 25.00 O ATOM 1536 CB TYR A 842 19.691 -2.370 4.106 1.00 25.00 C ATOM 1537 CG TYR A 842 20.205 -3.587 4.857 1.00 25.00 C ATOM 1538 CD1 TYR A 842 21.266 -3.485 5.780 1.00 25.00 C ATOM 1539 CD2 TYR A 842 19.635 -4.855 4.635 1.00 25.00 C ATOM 1540 CE1 TYR A 842 21.746 -4.637 6.468 1.00 25.00 C ATOM 1541 CE2 TYR A 842 20.111 -6.000 5.310 1.00 25.00 C ATOM 1542 CZ TYR A 842 21.158 -5.883 6.222 1.00 25.00 C ATOM 1543 OH TYR A 842 21.609 -7.000 6.877 1.00 25.00 O ATOM 0 H TYR A 842 19.302 -1.434 6.805 1.00 25.00 H new ATOM 0 HA TYR A 842 18.127 -0.915 4.129 1.00 25.00 H new ATOM 0 HB2 TYR A 842 19.313 -2.689 3.135 1.00 25.00 H new ATOM 0 HB3 TYR A 842 20.525 -1.694 3.917 1.00 25.00 H new ATOM 0 HD1 TYR A 842 21.720 -2.523 5.968 1.00 25.00 H new ATOM 0 HD2 TYR A 842 18.818 -4.954 3.935 1.00 25.00 H new ATOM 0 HE1 TYR A 842 22.558 -4.549 7.175 1.00 25.00 H new ATOM 0 HE2 TYR A 842 19.664 -6.965 5.120 1.00 25.00 H new ATOM 0 HH TYR A 842 21.090 -7.780 6.589 1.00 25.00 H new ATOM 1553 N ILE A 843 16.698 -3.078 4.541 1.00 25.00 N ATOM 1554 CA ILE A 843 15.716 -4.075 4.920 1.00 25.00 C ATOM 1555 C ILE A 843 16.093 -5.315 4.132 1.00 25.00 C ATOM 1556 O ILE A 843 16.631 -5.210 3.027 1.00 25.00 O ATOM 1557 CB ILE A 843 14.269 -3.586 4.577 1.00 25.00 C ATOM 1558 CG1 ILE A 843 13.232 -4.352 5.398 1.00 25.00 C ATOM 1559 CG2 ILE A 843 13.961 -3.659 3.079 1.00 25.00 C ATOM 1560 CD1 ILE A 843 13.069 -3.728 6.727 1.00 25.00 C ATOM 0 H ILE A 843 16.657 -2.815 3.556 1.00 25.00 H new ATOM 0 HA ILE A 843 15.714 -4.271 5.992 1.00 25.00 H new ATOM 0 HB ILE A 843 14.214 -2.532 4.849 1.00 25.00 H new ATOM 0 HG12 ILE A 843 12.277 -4.361 4.873 1.00 25.00 H new ATOM 0 HG13 ILE A 843 13.543 -5.391 5.512 1.00 25.00 H new ATOM 0 HG21 ILE A 843 12.945 -3.308 2.899 1.00 25.00 H new ATOM 0 HG22 ILE A 843 14.664 -3.031 2.532 1.00 25.00 H new ATOM 0 HG23 ILE A 843 14.054 -4.690 2.738 1.00 25.00 H new ATOM 0 HD11 ILE A 843 12.328 -4.283 7.301 1.00 25.00 H new ATOM 0 HD12 ILE A 843 14.022 -3.742 7.255 1.00 25.00 H new ATOM 0 HD13 ILE A 843 12.737 -2.697 6.607 1.00 25.00 H new ATOM 1572 N THR A 844 15.837 -6.491 4.665 1.00 25.00 N ATOM 1573 CA THR A 844 16.088 -7.688 3.887 1.00 25.00 C ATOM 1574 C THR A 844 14.825 -7.910 3.084 1.00 25.00 C ATOM 1575 O THR A 844 13.736 -7.525 3.508 1.00 25.00 O ATOM 1576 CB THR A 844 16.396 -8.944 4.738 1.00 25.00 C ATOM 1577 OG1 THR A 844 15.288 -9.247 5.576 1.00 25.00 O ATOM 1578 CG2 THR A 844 17.609 -8.744 5.609 1.00 25.00 C ATOM 0 H THR A 844 15.467 -6.644 5.603 1.00 25.00 H new ATOM 0 HA THR A 844 16.978 -7.542 3.275 1.00 25.00 H new ATOM 0 HB THR A 844 16.590 -9.763 4.046 1.00 25.00 H new ATOM 0 HG1 THR A 844 15.490 -10.043 6.110 1.00 25.00 H new ATOM 0 HG21 THR A 844 17.792 -9.647 6.191 1.00 25.00 H new ATOM 0 HG22 THR A 844 18.476 -8.534 4.983 1.00 25.00 H new ATOM 0 HG23 THR A 844 17.438 -7.906 6.285 1.00 25.00 H new ATOM 1586 N MET A 845 14.957 -8.547 1.933 1.00 25.00 N ATOM 1587 CA MET A 845 13.796 -8.932 1.144 1.00 25.00 C ATOM 1588 C MET A 845 12.835 -9.740 2.010 1.00 25.00 C ATOM 1589 O MET A 845 11.628 -9.639 1.885 1.00 25.00 O ATOM 1590 CB MET A 845 14.250 -9.797 -0.029 1.00 25.00 C ATOM 1591 CG MET A 845 15.196 -9.090 -0.955 1.00 25.00 C ATOM 1592 SD MET A 845 15.549 -10.035 -2.431 1.00 25.00 S ATOM 1593 CE MET A 845 16.618 -8.870 -3.247 1.00 25.00 C ATOM 0 H MET A 845 15.854 -8.809 1.523 1.00 25.00 H new ATOM 0 HA MET A 845 13.295 -8.036 0.776 1.00 25.00 H new ATOM 0 HB2 MET A 845 14.732 -10.695 0.356 1.00 25.00 H new ATOM 0 HB3 MET A 845 13.375 -10.122 -0.592 1.00 25.00 H new ATOM 0 HG2 MET A 845 14.770 -8.127 -1.238 1.00 25.00 H new ATOM 0 HG3 MET A 845 16.128 -8.884 -0.428 1.00 25.00 H new ATOM 0 HE1 MET A 845 16.154 -8.539 -4.176 1.00 25.00 H new ATOM 0 HE2 MET A 845 16.783 -8.011 -2.597 1.00 25.00 H new ATOM 0 HE3 MET A 845 17.573 -9.346 -3.468 1.00 25.00 H new ATOM 1603 N ASP A 846 13.403 -10.537 2.898 1.00 25.00 N ATOM 1604 CA ASP A 846 12.642 -11.413 3.776 1.00 25.00 C ATOM 1605 C ASP A 846 11.894 -10.674 4.879 1.00 25.00 C ATOM 1606 O ASP A 846 10.846 -11.120 5.325 1.00 25.00 O ATOM 1607 CB ASP A 846 13.590 -12.428 4.386 1.00 25.00 C ATOM 1608 CG ASP A 846 14.106 -13.422 3.353 1.00 25.00 C ATOM 1609 OD1 ASP A 846 13.377 -13.713 2.368 1.00 25.00 O ATOM 1610 OD2 ASP A 846 15.246 -13.901 3.510 1.00 25.00 O ATOM 0 H ASP A 846 14.412 -10.596 3.032 1.00 25.00 H new ATOM 0 HA ASP A 846 11.878 -11.899 3.169 1.00 25.00 H new ATOM 0 HB2 ASP A 846 14.433 -11.908 4.841 1.00 25.00 H new ATOM 0 HB3 ASP A 846 13.079 -12.967 5.184 1.00 25.00 H new ATOM 1615 N GLU A 847 12.418 -9.538 5.310 1.00 25.00 N ATOM 1616 CA GLU A 847 11.735 -8.713 6.310 1.00 25.00 C ATOM 1617 C GLU A 847 10.475 -8.122 5.681 1.00 25.00 C ATOM 1618 O GLU A 847 9.426 -8.064 6.316 1.00 25.00 O ATOM 1619 CB GLU A 847 12.661 -7.610 6.854 1.00 25.00 C ATOM 1620 CG GLU A 847 13.527 -8.113 8.029 1.00 25.00 C ATOM 1621 CD GLU A 847 14.946 -7.538 8.073 1.00 25.00 C ATOM 1622 OE1 GLU A 847 15.242 -6.502 7.443 1.00 25.00 O ATOM 1623 OE2 GLU A 847 15.797 -8.157 8.752 1.00 25.00 O ATOM 0 H GLU A 847 13.310 -9.162 4.989 1.00 25.00 H new ATOM 0 HA GLU A 847 11.456 -9.334 7.161 1.00 25.00 H new ATOM 0 HB2 GLU A 847 13.308 -7.252 6.053 1.00 25.00 H new ATOM 0 HB3 GLU A 847 12.061 -6.761 7.183 1.00 25.00 H new ATOM 0 HG2 GLU A 847 13.022 -7.870 8.964 1.00 25.00 H new ATOM 0 HG3 GLU A 847 13.592 -9.200 7.975 1.00 25.00 H new ATOM 1630 N LEU A 848 10.560 -7.717 4.421 1.00 25.00 N ATOM 1631 CA LEU A 848 9.374 -7.221 3.717 1.00 25.00 C ATOM 1632 C LEU A 848 8.399 -8.377 3.563 1.00 25.00 C ATOM 1633 O LEU A 848 7.204 -8.221 3.717 1.00 25.00 O ATOM 1634 CB LEU A 848 9.741 -6.676 2.337 1.00 25.00 C ATOM 1635 CG LEU A 848 10.611 -5.416 2.342 1.00 25.00 C ATOM 1636 CD1 LEU A 848 11.131 -5.179 0.945 1.00 25.00 C ATOM 1637 CD2 LEU A 848 9.834 -4.194 2.825 1.00 25.00 C ATOM 0 H LEU A 848 11.418 -7.719 3.870 1.00 25.00 H new ATOM 0 HA LEU A 848 8.928 -6.409 4.290 1.00 25.00 H new ATOM 0 HB2 LEU A 848 10.263 -7.456 1.783 1.00 25.00 H new ATOM 0 HB3 LEU A 848 8.821 -6.461 1.793 1.00 25.00 H new ATOM 0 HG LEU A 848 11.439 -5.568 3.034 1.00 25.00 H new ATOM 0 HD11 LEU A 848 11.753 -4.284 0.935 1.00 25.00 H new ATOM 0 HD12 LEU A 848 11.724 -6.036 0.627 1.00 25.00 H new ATOM 0 HD13 LEU A 848 10.292 -5.046 0.262 1.00 25.00 H new ATOM 0 HD21 LEU A 848 10.486 -3.321 2.814 1.00 25.00 H new ATOM 0 HD22 LEU A 848 8.983 -4.020 2.166 1.00 25.00 H new ATOM 0 HD23 LEU A 848 9.477 -4.368 3.840 1.00 25.00 H new ATOM 1649 N ARG A 849 8.935 -9.555 3.289 1.00 25.00 N ATOM 1650 CA ARG A 849 8.141 -10.782 3.120 1.00 25.00 C ATOM 1651 C ARG A 849 7.707 -11.335 4.480 1.00 25.00 C ATOM 1652 O ARG A 849 7.518 -12.543 4.630 1.00 25.00 O ATOM 1653 CB ARG A 849 8.986 -11.859 2.418 1.00 0.00 C ATOM 1654 CG ARG A 849 9.304 -11.612 0.963 1.00 25.00 C ATOM 1655 CD ARG A 849 10.459 -12.523 0.567 1.00 25.00 C ATOM 1656 NE ARG A 849 10.940 -12.273 -0.798 1.00 25.00 N ATOM 1657 CZ ARG A 849 12.144 -12.605 -1.251 1.00 25.00 C ATOM 1658 NH1 ARG A 849 13.050 -13.188 -0.499 1.00 25.00 N ATOM 1659 NH2 ARG A 849 12.450 -12.334 -2.490 1.00 25.00 N ATOM 0 H ARG A 849 9.938 -9.698 3.175 1.00 25.00 H new ATOM 0 HA ARG A 849 7.263 -10.534 2.524 1.00 25.00 H new ATOM 0 HB2 ARG A 849 9.925 -11.966 2.961 1.00 0.00 H new ATOM 0 HB3 ARG A 849 8.462 -12.812 2.497 1.00 0.00 H new ATOM 0 HG2 ARG A 849 8.430 -11.814 0.343 1.00 25.00 H new ATOM 0 HG3 ARG A 849 9.572 -10.567 0.804 1.00 25.00 H new ATOM 0 HD2 ARG A 849 11.282 -12.384 1.268 1.00 25.00 H new ATOM 0 HD3 ARG A 849 10.141 -13.562 0.650 1.00 25.00 H new ATOM 0 HE ARG A 849 10.303 -11.810 -1.446 1.00 25.00 H new ATOM 0 HH11 ARG A 849 12.842 -13.404 0.476 1.00 25.00 H new ATOM 0 HH12 ARG A 849 13.962 -13.425 -0.890 1.00 25.00 H new ATOM 0 HH21 ARG A 849 11.769 -11.874 -3.095 1.00 25.00 H new ATOM 0 HH22 ARG A 849 13.370 -12.582 -2.854 1.00 25.00 H new ATOM 1673 N ARG A 850 7.558 -10.478 5.481 1.00 25.00 N ATOM 1674 CA ARG A 850 7.194 -10.948 6.813 1.00 25.00 C ATOM 1675 C ARG A 850 6.011 -10.160 7.257 1.00 25.00 C ATOM 1676 O ARG A 850 5.125 -10.679 7.928 1.00 25.00 O ATOM 1677 CB ARG A 850 8.360 -10.795 7.793 1.00 25.00 C ATOM 1678 CG ARG A 850 8.055 -11.305 9.198 1.00 25.00 C ATOM 1679 CD ARG A 850 7.726 -12.795 9.204 1.00 25.00 C ATOM 1680 NE ARG A 850 7.206 -13.226 10.510 1.00 25.00 N ATOM 1681 CZ ARG A 850 6.384 -14.251 10.703 1.00 25.00 C ATOM 1682 NH1 ARG A 850 5.946 -14.995 9.714 1.00 25.00 N ATOM 1683 NH2 ARG A 850 5.984 -14.528 11.913 1.00 25.00 N ATOM 0 H ARG A 850 7.681 -9.469 5.400 1.00 25.00 H new ATOM 0 HA ARG A 850 6.952 -12.010 6.785 1.00 25.00 H new ATOM 0 HB2 ARG A 850 9.224 -11.332 7.401 1.00 25.00 H new ATOM 0 HB3 ARG A 850 8.638 -9.743 7.851 1.00 25.00 H new ATOM 0 HG2 ARG A 850 8.912 -11.120 9.845 1.00 25.00 H new ATOM 0 HG3 ARG A 850 7.216 -10.746 9.613 1.00 25.00 H new ATOM 0 HD2 ARG A 850 6.990 -13.009 8.429 1.00 25.00 H new ATOM 0 HD3 ARG A 850 8.621 -13.367 8.960 1.00 25.00 H new ATOM 0 HE ARG A 850 7.499 -12.697 11.331 1.00 25.00 H new ATOM 0 HH11 ARG A 850 6.236 -14.794 8.757 1.00 25.00 H new ATOM 0 HH12 ARG A 850 5.315 -15.774 9.902 1.00 25.00 H new ATOM 0 HH21 ARG A 850 6.303 -13.960 12.698 1.00 25.00 H new ATOM 0 HH22 ARG A 850 5.353 -15.313 12.074 1.00 25.00 H new ATOM 1697 N GLU A 851 5.996 -8.904 6.860 1.00 25.00 N ATOM 1698 CA GLU A 851 4.861 -8.054 7.151 1.00 25.00 C ATOM 1699 C GLU A 851 3.945 -8.058 5.916 1.00 25.00 C ATOM 1700 O GLU A 851 2.753 -7.819 6.024 1.00 25.00 O ATOM 1701 CB GLU A 851 5.326 -6.647 7.546 1.00 25.00 C ATOM 1702 CG GLU A 851 5.852 -5.820 6.401 1.00 25.00 C ATOM 1703 CD GLU A 851 5.983 -4.337 6.753 1.00 25.00 C ATOM 1704 OE1 GLU A 851 5.825 -3.976 7.943 1.00 25.00 O ATOM 1705 OE2 GLU A 851 6.256 -3.535 5.838 1.00 25.00 O ATOM 0 H GLU A 851 6.749 -8.453 6.340 1.00 25.00 H new ATOM 0 HA GLU A 851 4.298 -8.429 8.006 1.00 25.00 H new ATOM 0 HB2 GLU A 851 4.492 -6.118 8.007 1.00 25.00 H new ATOM 0 HB3 GLU A 851 6.105 -6.734 8.303 1.00 25.00 H new ATOM 0 HG2 GLU A 851 6.826 -6.204 6.098 1.00 25.00 H new ATOM 0 HG3 GLU A 851 5.186 -5.928 5.545 1.00 25.00 H new ATOM 1712 N LEU A 852 4.517 -8.355 4.750 1.00 25.00 N ATOM 1713 CA LEU A 852 3.767 -8.409 3.494 1.00 25.00 C ATOM 1714 C LEU A 852 3.784 -9.827 2.909 1.00 25.00 C ATOM 1715 O LEU A 852 4.600 -10.142 2.043 1.00 25.00 O ATOM 1716 CB LEU A 852 4.339 -7.424 2.440 1.00 25.00 C ATOM 1717 CG LEU A 852 4.809 -6.059 2.955 1.00 25.00 C ATOM 1718 CD1 LEU A 852 5.605 -5.291 1.959 1.00 25.00 C ATOM 1719 CD2 LEU A 852 3.663 -5.214 3.500 1.00 25.00 C ATOM 0 H LEU A 852 5.510 -8.564 4.648 1.00 25.00 H new ATOM 0 HA LEU A 852 2.742 -8.119 3.727 1.00 25.00 H new ATOM 0 HB2 LEU A 852 5.180 -7.908 1.944 1.00 25.00 H new ATOM 0 HB3 LEU A 852 3.575 -7.256 1.681 1.00 25.00 H new ATOM 0 HG LEU A 852 5.479 -6.289 3.784 1.00 25.00 H new ATOM 0 HD11 LEU A 852 5.904 -4.336 2.391 1.00 25.00 H new ATOM 0 HD12 LEU A 852 6.494 -5.860 1.686 1.00 25.00 H new ATOM 0 HD13 LEU A 852 5.001 -5.113 1.069 1.00 25.00 H new ATOM 0 HD21 LEU A 852 4.051 -4.258 3.851 1.00 25.00 H new ATOM 0 HD22 LEU A 852 2.931 -5.041 2.711 1.00 25.00 H new ATOM 0 HD23 LEU A 852 3.186 -5.738 4.328 1.00 25.00 H new ATOM 1731 N PRO A 853 2.867 -10.705 3.353 1.00 25.00 N ATOM 1732 CA PRO A 853 2.815 -11.972 2.608 1.00 25.00 C ATOM 1733 C PRO A 853 2.418 -11.891 1.093 1.00 25.00 C ATOM 1734 O PRO A 853 2.770 -12.796 0.336 1.00 25.00 O ATOM 1735 CB PRO A 853 1.811 -12.804 3.419 1.00 25.00 C ATOM 1736 CG PRO A 853 0.941 -11.805 4.097 1.00 25.00 C ATOM 1737 CD PRO A 853 1.855 -10.653 4.429 1.00 25.00 C ATOM 0 HA PRO A 853 3.815 -12.398 2.529 1.00 25.00 H new ATOM 0 HB2 PRO A 853 1.229 -13.460 2.772 1.00 25.00 H new ATOM 0 HB3 PRO A 853 2.320 -13.440 4.143 1.00 25.00 H new ATOM 0 HG2 PRO A 853 0.125 -11.487 3.448 1.00 25.00 H new ATOM 0 HG3 PRO A 853 0.489 -12.222 4.997 1.00 25.00 H new ATOM 0 HD2 PRO A 853 1.320 -9.703 4.434 1.00 25.00 H new ATOM 0 HD3 PRO A 853 2.308 -10.769 5.414 1.00 25.00 H new ATOM 1745 N PRO A 854 1.682 -10.840 0.626 1.00 25.00 N ATOM 1746 CA PRO A 854 1.431 -10.817 -0.823 1.00 25.00 C ATOM 1747 C PRO A 854 2.591 -10.345 -1.706 1.00 25.00 C ATOM 1748 O PRO A 854 3.705 -10.112 -1.245 1.00 25.00 O ATOM 1749 CB PRO A 854 0.323 -9.776 -0.923 1.00 25.00 C ATOM 1750 CG PRO A 854 0.624 -8.867 0.085 1.00 25.00 C ATOM 1751 CD PRO A 854 1.028 -9.663 1.237 1.00 25.00 C ATOM 0 HA PRO A 854 1.224 -11.826 -1.178 1.00 25.00 H new ATOM 0 HB2 PRO A 854 0.312 -9.297 -1.902 1.00 25.00 H new ATOM 0 HB3 PRO A 854 -0.660 -10.224 -0.776 1.00 25.00 H new ATOM 0 HG2 PRO A 854 1.423 -8.193 -0.223 1.00 25.00 H new ATOM 0 HG3 PRO A 854 -0.241 -8.248 0.323 1.00 25.00 H new ATOM 0 HD2 PRO A 854 1.712 -9.114 1.885 1.00 25.00 H new ATOM 0 HD3 PRO A 854 0.172 -9.950 1.847 1.00 25.00 H new ATOM 1759 N ASP A 855 2.277 -10.160 -2.985 1.00 25.00 N ATOM 1760 CA ASP A 855 3.210 -9.631 -3.987 1.00 25.00 C ATOM 1761 C ASP A 855 3.727 -8.262 -3.630 1.00 25.00 C ATOM 1762 O ASP A 855 4.696 -7.804 -4.202 1.00 25.00 O ATOM 1763 CB ASP A 855 2.555 -9.496 -5.356 1.00 25.00 C ATOM 1764 CG ASP A 855 2.317 -10.813 -6.013 1.00 25.00 C ATOM 1765 OD1 ASP A 855 2.556 -11.872 -5.380 1.00 25.00 O ATOM 1766 OD2 ASP A 855 1.861 -10.820 -7.179 1.00 25.00 O ATOM 0 H ASP A 855 1.355 -10.375 -3.365 1.00 25.00 H new ATOM 0 HA ASP A 855 4.027 -10.352 -4.011 1.00 25.00 H new ATOM 0 HB2 ASP A 855 1.606 -8.971 -5.250 1.00 25.00 H new ATOM 0 HB3 ASP A 855 3.188 -8.883 -5.998 1.00 25.00 H new ATOM 1771 N GLN A 856 3.072 -7.598 -2.692 1.00 25.00 N ATOM 1772 CA GLN A 856 3.505 -6.285 -2.249 1.00 25.00 C ATOM 1773 C GLN A 856 4.980 -6.343 -1.871 1.00 25.00 C ATOM 1774 O GLN A 856 5.725 -5.399 -2.103 1.00 25.00 O ATOM 1775 CB GLN A 856 2.676 -5.832 -1.046 1.00 25.00 C ATOM 1776 CG GLN A 856 1.164 -5.769 -1.306 1.00 25.00 C ATOM 1777 CD GLN A 856 0.744 -4.569 -2.088 1.00 25.00 C ATOM 1778 OE1 GLN A 856 1.499 -4.012 -2.854 1.00 25.00 O ATOM 1779 NE2 GLN A 856 -0.469 -4.159 -1.888 1.00 25.00 N ATOM 0 H GLN A 856 2.237 -7.948 -2.222 1.00 25.00 H new ATOM 0 HA GLN A 856 3.363 -5.568 -3.058 1.00 25.00 H new ATOM 0 HB2 GLN A 856 2.862 -6.513 -0.215 1.00 25.00 H new ATOM 0 HB3 GLN A 856 3.020 -4.846 -0.733 1.00 25.00 H new ATOM 0 HG2 GLN A 856 0.858 -6.667 -1.842 1.00 25.00 H new ATOM 0 HG3 GLN A 856 0.639 -5.773 -0.351 1.00 25.00 H new ATOM 0 HE21 GLN A 856 -1.074 -4.656 -1.234 1.00 25.00 H new ATOM 0 HE22 GLN A 856 -0.819 -3.339 -2.384 1.00 25.00 H new ATOM 1788 N ALA A 857 5.404 -7.471 -1.315 1.00 25.00 N ATOM 1789 CA ALA A 857 6.797 -7.661 -0.969 1.00 25.00 C ATOM 1790 C ALA A 857 7.685 -7.579 -2.213 1.00 25.00 C ATOM 1791 O ALA A 857 8.621 -6.805 -2.245 1.00 25.00 O ATOM 1792 CB ALA A 857 6.979 -9.008 -0.282 1.00 25.00 C ATOM 0 H ALA A 857 4.800 -8.264 -1.096 1.00 25.00 H new ATOM 0 HA ALA A 857 7.095 -6.866 -0.286 1.00 25.00 H new ATOM 0 HB1 ALA A 857 8.029 -9.146 -0.024 1.00 25.00 H new ATOM 0 HB2 ALA A 857 6.375 -9.038 0.625 1.00 25.00 H new ATOM 0 HB3 ALA A 857 6.663 -9.805 -0.955 1.00 25.00 H new ATOM 1798 N GLU A 858 7.399 -8.381 -3.231 1.00 25.00 N ATOM 1799 CA GLU A 858 8.256 -8.432 -4.423 1.00 25.00 C ATOM 1800 C GLU A 858 8.186 -7.164 -5.241 1.00 25.00 C ATOM 1801 O GLU A 858 9.173 -6.736 -5.823 1.00 25.00 O ATOM 1802 CB GLU A 858 7.944 -9.647 -5.291 1.00 25.00 C ATOM 1803 CG GLU A 858 6.482 -9.898 -5.633 1.00 25.00 C ATOM 1804 CD GLU A 858 6.259 -11.232 -6.374 1.00 25.00 C ATOM 1805 OE1 GLU A 858 7.001 -12.201 -6.090 1.00 25.00 O ATOM 1806 OE2 GLU A 858 5.339 -11.322 -7.224 1.00 25.00 O ATOM 0 H GLU A 858 6.590 -9.002 -3.262 1.00 25.00 H new ATOM 0 HA GLU A 858 9.278 -8.527 -4.057 1.00 25.00 H new ATOM 0 HB2 GLU A 858 8.497 -9.547 -6.225 1.00 25.00 H new ATOM 0 HB3 GLU A 858 8.330 -10.532 -4.785 1.00 25.00 H new ATOM 0 HG2 GLU A 858 5.894 -9.895 -4.715 1.00 25.00 H new ATOM 0 HG3 GLU A 858 6.113 -9.079 -6.251 1.00 25.00 H new ATOM 1813 N TYR A 859 7.017 -6.563 -5.253 1.00 25.00 N ATOM 1814 CA TYR A 859 6.812 -5.262 -5.904 1.00 25.00 C ATOM 1815 C TYR A 859 7.778 -4.258 -5.288 1.00 25.00 C ATOM 1816 O TYR A 859 8.537 -3.591 -5.996 1.00 25.00 O ATOM 1817 CB TYR A 859 5.349 -4.799 -5.737 1.00 25.00 C ATOM 1818 CG TYR A 859 5.148 -3.341 -5.305 1.00 25.00 C ATOM 1819 CD1 TYR A 859 5.638 -2.267 -6.079 1.00 25.00 C ATOM 1820 CD2 TYR A 859 4.460 -3.033 -4.112 1.00 25.00 C ATOM 1821 CE1 TYR A 859 5.432 -0.920 -5.669 1.00 25.00 C ATOM 1822 CE2 TYR A 859 4.223 -1.690 -3.723 1.00 25.00 C ATOM 1823 CZ TYR A 859 4.704 -0.647 -4.506 1.00 25.00 C ATOM 1824 OH TYR A 859 4.466 0.645 -4.118 1.00 25.00 O ATOM 0 H TYR A 859 6.179 -6.949 -4.818 1.00 25.00 H new ATOM 0 HA TYR A 859 7.007 -5.344 -6.973 1.00 25.00 H new ATOM 0 HB2 TYR A 859 4.831 -4.951 -6.684 1.00 25.00 H new ATOM 0 HB3 TYR A 859 4.867 -5.444 -5.003 1.00 25.00 H new ATOM 0 HD1 TYR A 859 6.176 -2.470 -6.993 1.00 25.00 H new ATOM 0 HD2 TYR A 859 4.107 -3.836 -3.482 1.00 25.00 H new ATOM 0 HE1 TYR A 859 5.838 -0.109 -6.255 1.00 25.00 H new ATOM 0 HE2 TYR A 859 3.670 -1.478 -2.820 1.00 25.00 H new ATOM 0 HH TYR A 859 3.945 0.647 -3.288 1.00 25.00 H new ATOM 1834 N CYS A 860 7.762 -4.165 -3.970 1.00 25.00 N ATOM 1835 CA CYS A 860 8.622 -3.232 -3.267 1.00 25.00 C ATOM 1836 C CYS A 860 10.084 -3.602 -3.470 1.00 25.00 C ATOM 1837 O CYS A 860 10.910 -2.738 -3.694 1.00 25.00 O ATOM 1838 CB CYS A 860 8.287 -3.229 -1.779 1.00 25.00 C ATOM 1839 SG CYS A 860 6.668 -2.535 -1.405 1.00 25.00 S ATOM 0 H CYS A 860 7.162 -4.725 -3.365 1.00 25.00 H new ATOM 0 HA CYS A 860 8.455 -2.233 -3.671 1.00 25.00 H new ATOM 0 HB2 CYS A 860 8.330 -4.251 -1.404 1.00 25.00 H new ATOM 0 HB3 CYS A 860 9.049 -2.661 -1.245 1.00 25.00 H new ATOM 0 HG CYS A 860 5.930 -2.555 -2.475 1.00 25.00 H new ATOM 1845 N ILE A 861 10.390 -4.891 -3.404 1.00 25.00 N ATOM 1846 CA ILE A 861 11.760 -5.396 -3.551 1.00 25.00 C ATOM 1847 C ILE A 861 12.339 -4.980 -4.894 1.00 25.00 C ATOM 1848 O ILE A 861 13.494 -4.574 -4.989 1.00 25.00 O ATOM 1849 CB ILE A 861 11.769 -6.964 -3.434 1.00 25.00 C ATOM 1850 CG1 ILE A 861 11.685 -7.370 -1.954 1.00 25.00 C ATOM 1851 CG2 ILE A 861 13.004 -7.604 -4.132 1.00 25.00 C ATOM 1852 CD1 ILE A 861 11.204 -8.810 -1.711 1.00 25.00 C ATOM 0 H ILE A 861 9.697 -5.623 -3.247 1.00 25.00 H new ATOM 0 HA ILE A 861 12.373 -4.971 -2.757 1.00 25.00 H new ATOM 0 HB ILE A 861 10.894 -7.348 -3.959 1.00 25.00 H new ATOM 0 HG12 ILE A 861 12.669 -7.248 -1.501 1.00 25.00 H new ATOM 0 HG13 ILE A 861 11.011 -6.684 -1.441 1.00 25.00 H new ATOM 0 HG21 ILE A 861 12.963 -8.688 -4.022 1.00 25.00 H new ATOM 0 HG22 ILE A 861 12.998 -7.346 -5.191 1.00 25.00 H new ATOM 0 HG23 ILE A 861 13.918 -7.227 -3.672 1.00 25.00 H new ATOM 0 HD11 ILE A 861 11.176 -9.008 -0.640 1.00 25.00 H new ATOM 0 HD12 ILE A 861 10.206 -8.936 -2.130 1.00 25.00 H new ATOM 0 HD13 ILE A 861 11.889 -9.508 -2.191 1.00 25.00 H new ATOM 1864 N ALA A 862 11.523 -5.080 -5.929 1.00 25.00 N ATOM 1865 CA ALA A 862 11.949 -4.769 -7.286 1.00 25.00 C ATOM 1866 C ALA A 862 12.304 -3.287 -7.476 1.00 25.00 C ATOM 1867 O ALA A 862 13.157 -2.945 -8.285 1.00 25.00 O ATOM 1868 CB ALA A 862 10.839 -5.168 -8.238 1.00 25.00 C ATOM 0 H ALA A 862 10.550 -5.378 -5.855 1.00 25.00 H new ATOM 0 HA ALA A 862 12.861 -5.330 -7.493 1.00 25.00 H new ATOM 0 HB1 ALA A 862 11.139 -4.943 -9.261 1.00 25.00 H new ATOM 0 HB2 ALA A 862 10.645 -6.236 -8.143 1.00 25.00 H new ATOM 0 HB3 ALA A 862 9.934 -4.612 -7.995 1.00 25.00 H new ATOM 1874 N ARG A 863 11.632 -2.421 -6.737 1.00 25.00 N ATOM 1875 CA ARG A 863 11.844 -0.973 -6.828 1.00 25.00 C ATOM 1876 C ARG A 863 12.831 -0.444 -5.778 1.00 25.00 C ATOM 1877 O ARG A 863 13.257 0.706 -5.815 1.00 25.00 O ATOM 1878 CB ARG A 863 10.488 -0.282 -6.674 1.00 25.00 C ATOM 1879 CG ARG A 863 9.708 -0.244 -7.952 1.00 25.00 C ATOM 1880 CD ARG A 863 8.371 -0.886 -7.724 1.00 25.00 C ATOM 1881 NE ARG A 863 7.340 -0.392 -8.638 1.00 25.00 N ATOM 1882 CZ ARG A 863 6.774 0.809 -8.585 1.00 25.00 C ATOM 1883 NH1 ARG A 863 7.105 1.730 -7.714 1.00 25.00 N ATOM 1884 NH2 ARG A 863 5.853 1.078 -9.444 1.00 25.00 N ATOM 0 H ARG A 863 10.924 -2.694 -6.056 1.00 25.00 H new ATOM 0 HA ARG A 863 12.289 -0.754 -7.799 1.00 25.00 H new ATOM 0 HB2 ARG A 863 9.905 -0.801 -5.913 1.00 25.00 H new ATOM 0 HB3 ARG A 863 10.643 0.736 -6.318 1.00 25.00 H new ATOM 0 HG2 ARG A 863 9.580 0.786 -8.285 1.00 25.00 H new ATOM 0 HG3 ARG A 863 10.249 -0.769 -8.740 1.00 25.00 H new ATOM 0 HD2 ARG A 863 8.467 -1.965 -7.841 1.00 25.00 H new ATOM 0 HD3 ARG A 863 8.056 -0.704 -6.696 1.00 25.00 H new ATOM 0 HE ARG A 863 7.030 -1.022 -9.378 1.00 25.00 H new ATOM 0 HH11 ARG A 863 7.835 1.543 -7.026 1.00 25.00 H new ATOM 0 HH12 ARG A 863 6.633 2.634 -7.724 1.00 25.00 H new ATOM 0 HH21 ARG A 863 5.580 0.379 -10.135 1.00 25.00 H new ATOM 0 HH22 ARG A 863 5.396 1.990 -9.433 1.00 25.00 H new ATOM 1898 N MET A 864 13.192 -1.280 -4.826 1.00 25.00 N ATOM 1899 CA MET A 864 14.066 -0.854 -3.743 1.00 25.00 C ATOM 1900 C MET A 864 15.535 -0.754 -4.157 1.00 25.00 C ATOM 1901 O MET A 864 15.951 -1.341 -5.152 1.00 25.00 O ATOM 1902 CB MET A 864 13.917 -1.810 -2.591 1.00 25.00 C ATOM 1903 CG MET A 864 13.876 -1.140 -1.243 1.00 25.00 C ATOM 1904 SD MET A 864 13.141 -2.185 0.016 1.00 25.00 S ATOM 1905 CE MET A 864 11.557 -1.327 0.378 1.00 25.00 C ATOM 0 H MET A 864 12.897 -2.255 -4.777 1.00 25.00 H new ATOM 0 HA MET A 864 13.762 0.152 -3.453 1.00 25.00 H new ATOM 0 HB2 MET A 864 13.002 -2.387 -2.727 1.00 25.00 H new ATOM 0 HB3 MET A 864 14.746 -2.517 -2.609 1.00 25.00 H new ATOM 0 HG2 MET A 864 14.889 -0.871 -0.943 1.00 25.00 H new ATOM 0 HG3 MET A 864 13.309 -0.212 -1.318 1.00 25.00 H new ATOM 0 HE1 MET A 864 10.759 -2.063 0.476 1.00 25.00 H new ATOM 0 HE2 MET A 864 11.651 -0.767 1.308 1.00 25.00 H new ATOM 0 HE3 MET A 864 11.320 -0.642 -0.436 1.00 25.00 H new ATOM 1915 N ALA A 865 16.325 0.004 -3.402 1.00 25.00 N ATOM 1916 CA ALA A 865 17.718 0.227 -3.773 1.00 25.00 C ATOM 1917 C ALA A 865 18.547 -1.055 -3.604 1.00 25.00 C ATOM 1918 O ALA A 865 18.490 -1.694 -2.562 1.00 25.00 O ATOM 1919 CB ALA A 865 18.315 1.341 -2.951 1.00 25.00 C ATOM 0 H ALA A 865 16.030 0.468 -2.543 1.00 25.00 H new ATOM 0 HA ALA A 865 17.740 0.514 -4.824 1.00 25.00 H new ATOM 0 HB1 ALA A 865 19.354 1.492 -3.243 1.00 25.00 H new ATOM 0 HB2 ALA A 865 17.753 2.260 -3.121 1.00 25.00 H new ATOM 0 HB3 ALA A 865 18.269 1.078 -1.894 1.00 25.00 H new ATOM 1925 N PRO A 866 19.331 -1.433 -4.621 1.00 25.00 N ATOM 1926 CA PRO A 866 20.116 -2.671 -4.635 1.00 25.00 C ATOM 1927 C PRO A 866 21.359 -2.674 -3.740 1.00 25.00 C ATOM 1928 O PRO A 866 22.466 -2.343 -4.172 1.00 25.00 O ATOM 1929 CB PRO A 866 20.496 -2.793 -6.109 1.00 25.00 C ATOM 1930 CG PRO A 866 20.618 -1.388 -6.569 1.00 25.00 C ATOM 1931 CD PRO A 866 19.499 -0.681 -5.875 1.00 25.00 C ATOM 0 HA PRO A 866 19.542 -3.504 -4.229 1.00 25.00 H new ATOM 0 HB2 PRO A 866 21.432 -3.337 -6.236 1.00 25.00 H new ATOM 0 HB3 PRO A 866 19.735 -3.333 -6.673 1.00 25.00 H new ATOM 0 HG2 PRO A 866 21.585 -0.963 -6.301 1.00 25.00 H new ATOM 0 HG3 PRO A 866 20.526 -1.313 -7.653 1.00 25.00 H new ATOM 0 HD2 PRO A 866 19.743 0.364 -5.685 1.00 25.00 H new ATOM 0 HD3 PRO A 866 18.588 -0.692 -6.473 1.00 25.00 H new ATOM 1939 N TYR A 867 21.192 -3.061 -2.487 1.00 25.00 N ATOM 1940 CA TYR A 867 22.334 -3.133 -1.578 1.00 25.00 C ATOM 1941 C TYR A 867 22.922 -4.539 -1.653 1.00 25.00 C ATOM 1942 O TYR A 867 22.388 -5.491 -1.102 1.00 25.00 O ATOM 1943 CB TYR A 867 21.881 -2.801 -0.156 1.00 25.00 C ATOM 1944 CG TYR A 867 21.963 -1.320 0.169 1.00 25.00 C ATOM 1945 CD1 TYR A 867 21.864 -0.333 -0.851 1.00 25.00 C ATOM 1946 CD2 TYR A 867 22.154 -0.890 1.501 1.00 25.00 C ATOM 1947 CE1 TYR A 867 21.985 1.035 -0.539 1.00 25.00 C ATOM 1948 CE2 TYR A 867 22.252 0.492 1.815 1.00 25.00 C ATOM 1949 CZ TYR A 867 22.172 1.439 0.786 1.00 25.00 C ATOM 1950 OH TYR A 867 22.263 2.773 1.067 1.00 25.00 O ATOM 0 H TYR A 867 20.297 -3.327 -2.077 1.00 25.00 H new ATOM 0 HA TYR A 867 23.098 -2.410 -1.864 1.00 25.00 H new ATOM 0 HB2 TYR A 867 20.854 -3.139 -0.021 1.00 25.00 H new ATOM 0 HB3 TYR A 867 22.495 -3.356 0.553 1.00 25.00 H new ATOM 0 HD1 TYR A 867 21.695 -0.636 -1.874 1.00 25.00 H new ATOM 0 HD2 TYR A 867 22.227 -1.622 2.292 1.00 25.00 H new ATOM 0 HE1 TYR A 867 21.933 1.774 -1.325 1.00 25.00 H new ATOM 0 HE2 TYR A 867 22.387 0.810 2.838 1.00 25.00 H new ATOM 0 HH TYR A 867 21.405 3.093 1.416 1.00 25.00 H new ATOM 2048 N GLY A 875 20.146 -10.425 -0.398 1.00 25.00 N ATOM 2049 CA GLY A 875 18.782 -9.947 -0.329 1.00 25.00 C ATOM 2050 C GLY A 875 18.642 -8.739 0.575 1.00 25.00 C ATOM 2051 O GLY A 875 17.762 -8.723 1.418 1.00 25.00 O ATOM 0 HA2 GLY A 875 18.438 -9.690 -1.331 1.00 25.00 H new ATOM 0 HA3 GLY A 875 18.137 -10.747 0.034 1.00 25.00 H new ATOM 2055 N ALA A 876 19.508 -7.746 0.414 1.00 25.00 N ATOM 2056 CA ALA A 876 19.486 -6.528 1.223 1.00 25.00 C ATOM 2057 C ALA A 876 19.103 -5.366 0.316 1.00 25.00 C ATOM 2058 O ALA A 876 19.615 -5.257 -0.793 1.00 25.00 O ATOM 2059 CB ALA A 876 20.867 -6.284 1.838 1.00 25.00 C ATOM 0 H ALA A 876 20.251 -7.761 -0.285 1.00 25.00 H new ATOM 0 HA ALA A 876 18.764 -6.625 2.034 1.00 25.00 H new ATOM 0 HB1 ALA A 876 20.842 -5.375 2.439 1.00 25.00 H new ATOM 0 HB2 ALA A 876 21.138 -7.130 2.470 1.00 25.00 H new ATOM 0 HB3 ALA A 876 21.605 -6.173 1.043 1.00 25.00 H new ATOM 2065 N LEU A 877 18.202 -4.511 0.768 1.00 25.00 N ATOM 2066 CA LEU A 877 17.798 -3.347 -0.015 1.00 25.00 C ATOM 2067 C LEU A 877 17.569 -2.125 0.851 1.00 25.00 C ATOM 2068 O LEU A 877 17.108 -2.252 1.969 1.00 25.00 O ATOM 2069 CB LEU A 877 16.506 -3.657 -0.752 1.00 25.00 C ATOM 2070 CG LEU A 877 16.446 -4.911 -1.638 1.00 25.00 C ATOM 2071 CD1 LEU A 877 15.033 -5.413 -1.653 1.00 25.00 C ATOM 2072 CD2 LEU A 877 16.942 -4.638 -3.060 1.00 25.00 C ATOM 0 H LEU A 877 17.735 -4.597 1.671 1.00 25.00 H new ATOM 0 HA LEU A 877 18.608 -3.129 -0.711 1.00 25.00 H new ATOM 0 HB2 LEU A 877 15.713 -3.739 -0.009 1.00 25.00 H new ATOM 0 HB3 LEU A 877 16.268 -2.797 -1.379 1.00 25.00 H new ATOM 0 HG LEU A 877 17.111 -5.668 -1.222 1.00 25.00 H new ATOM 0 HD11 LEU A 877 14.970 -6.304 -2.278 1.00 25.00 H new ATOM 0 HD12 LEU A 877 14.724 -5.659 -0.637 1.00 25.00 H new ATOM 0 HD13 LEU A 877 14.377 -4.641 -2.055 1.00 25.00 H new ATOM 0 HD21 LEU A 877 16.881 -5.553 -3.649 1.00 25.00 H new ATOM 0 HD22 LEU A 877 16.322 -3.869 -3.520 1.00 25.00 H new ATOM 0 HD23 LEU A 877 17.977 -4.297 -3.025 1.00 25.00 H new ATOM 2084 N ASP A 878 17.868 -0.940 0.351 1.00 25.00 N ATOM 2085 CA ASP A 878 17.625 0.272 1.136 1.00 25.00 C ATOM 2086 C ASP A 878 16.182 0.697 1.017 1.00 25.00 C ATOM 2087 O ASP A 878 15.728 1.111 -0.046 1.00 25.00 O ATOM 2088 CB ASP A 878 18.525 1.405 0.714 1.00 25.00 C ATOM 2089 CG ASP A 878 18.638 2.472 1.795 1.00 25.00 C ATOM 2090 OD1 ASP A 878 17.585 2.827 2.366 1.00 25.00 O ATOM 2091 OD2 ASP A 878 19.751 2.965 2.071 1.00 25.00 O ATOM 0 H ASP A 878 18.271 -0.784 -0.573 1.00 25.00 H new ATOM 0 HA ASP A 878 17.849 0.033 2.176 1.00 25.00 H new ATOM 0 HB2 ASP A 878 19.516 1.015 0.484 1.00 25.00 H new ATOM 0 HB3 ASP A 878 18.139 1.854 -0.201 1.00 25.00 H new ATOM 2096 N TYR A 879 15.466 0.579 2.121 1.00 25.00 N ATOM 2097 CA TYR A 879 14.046 0.871 2.156 1.00 25.00 C ATOM 2098 C TYR A 879 13.755 2.361 1.968 1.00 25.00 C ATOM 2099 O TYR A 879 12.758 2.721 1.369 1.00 25.00 O ATOM 2100 CB TYR A 879 13.453 0.379 3.473 1.00 25.00 C ATOM 2101 CG TYR A 879 14.194 0.864 4.695 1.00 25.00 C ATOM 2102 CD1 TYR A 879 13.886 2.101 5.291 1.00 25.00 C ATOM 2103 CD2 TYR A 879 15.222 0.089 5.259 1.00 25.00 C ATOM 2104 CE1 TYR A 879 14.612 2.564 6.411 1.00 25.00 C ATOM 2105 CE2 TYR A 879 15.938 0.540 6.382 1.00 25.00 C ATOM 2106 CZ TYR A 879 15.636 1.780 6.943 1.00 25.00 C ATOM 2107 OH TYR A 879 16.349 2.215 8.027 1.00 25.00 O ATOM 0 H TYR A 879 15.852 0.279 3.016 1.00 25.00 H new ATOM 0 HA TYR A 879 13.580 0.347 1.322 1.00 25.00 H new ATOM 0 HB2 TYR A 879 12.415 0.704 3.537 1.00 25.00 H new ATOM 0 HB3 TYR A 879 13.446 -0.711 3.473 1.00 25.00 H new ATOM 0 HD1 TYR A 879 13.085 2.703 4.888 1.00 25.00 H new ATOM 0 HD2 TYR A 879 15.466 -0.868 4.823 1.00 25.00 H new ATOM 0 HE1 TYR A 879 14.375 3.520 6.853 1.00 25.00 H new ATOM 0 HE2 TYR A 879 16.719 -0.072 6.808 1.00 25.00 H new ATOM 0 HH TYR A 879 16.782 1.451 8.462 1.00 25.00 H new ATOM 2117 N MET A 880 14.618 3.219 2.503 1.00 25.00 N ATOM 2118 CA MET A 880 14.418 4.671 2.435 1.00 25.00 C ATOM 2119 C MET A 880 15.124 5.338 1.252 1.00 25.00 C ATOM 2120 O MET A 880 14.704 6.389 0.795 1.00 25.00 O ATOM 2121 CB MET A 880 14.812 5.321 3.765 1.00 25.00 C ATOM 2122 CG MET A 880 16.229 5.045 4.207 1.00 25.00 C ATOM 2123 SD MET A 880 16.562 5.689 5.858 1.00 25.00 S ATOM 2124 CE MET A 880 18.132 4.881 6.180 1.00 25.00 C ATOM 0 H MET A 880 15.468 2.937 2.992 1.00 25.00 H new ATOM 0 HA MET A 880 13.354 4.832 2.259 1.00 25.00 H new ATOM 0 HB2 MET A 880 14.675 6.399 3.681 1.00 25.00 H new ATOM 0 HB3 MET A 880 14.130 4.973 4.540 1.00 25.00 H new ATOM 0 HG2 MET A 880 16.409 3.970 4.194 1.00 25.00 H new ATOM 0 HG3 MET A 880 16.924 5.493 3.497 1.00 25.00 H new ATOM 0 HE1 MET A 880 18.492 5.167 7.168 1.00 25.00 H new ATOM 0 HE2 MET A 880 18.000 3.800 6.141 1.00 25.00 H new ATOM 0 HE3 MET A 880 18.859 5.185 5.427 1.00 25.00 H new ATOM 2134 N SER A 881 16.187 4.723 0.750 1.00 25.00 N ATOM 2135 CA SER A 881 16.909 5.251 -0.418 1.00 25.00 C ATOM 2136 C SER A 881 16.445 4.519 -1.674 1.00 25.00 C ATOM 2137 O SER A 881 17.098 4.566 -2.723 1.00 25.00 O ATOM 2138 CB SER A 881 18.423 5.111 -0.245 1.00 25.00 C ATOM 2139 OG SER A 881 19.114 5.810 -1.268 1.00 25.00 O ATOM 0 H SER A 881 16.574 3.858 1.128 1.00 25.00 H new ATOM 0 HA SER A 881 16.687 6.314 -0.514 1.00 25.00 H new ATOM 0 HB2 SER A 881 18.719 5.498 0.730 1.00 25.00 H new ATOM 0 HB3 SER A 881 18.700 4.057 -0.267 1.00 25.00 H new ATOM 0 HG SER A 881 18.619 5.731 -2.110 1.00 25.00 H new ATOM 2145 N PHE A 882 15.316 3.838 -1.540 1.00 25.00 N ATOM 2146 CA PHE A 882 14.658 3.131 -2.639 1.00 25.00 C ATOM 2147 C PHE A 882 14.324 4.048 -3.824 1.00 25.00 C ATOM 2148 O PHE A 882 14.467 5.267 -3.742 1.00 25.00 O ATOM 2149 CB PHE A 882 13.332 2.546 -2.121 1.00 25.00 C ATOM 2150 CG PHE A 882 12.183 3.533 -2.127 1.00 25.00 C ATOM 2151 CD1 PHE A 882 12.101 4.563 -1.170 1.00 25.00 C ATOM 2152 CD2 PHE A 882 11.169 3.430 -3.105 1.00 25.00 C ATOM 2153 CE1 PHE A 882 11.027 5.490 -1.192 1.00 25.00 C ATOM 2154 CE2 PHE A 882 10.095 4.350 -3.136 1.00 25.00 C ATOM 2155 CZ PHE A 882 10.025 5.382 -2.177 1.00 25.00 C ATOM 0 H PHE A 882 14.820 3.757 -0.652 1.00 25.00 H new ATOM 0 HA PHE A 882 15.349 2.362 -2.986 1.00 25.00 H new ATOM 0 HB2 PHE A 882 13.062 1.685 -2.733 1.00 25.00 H new ATOM 0 HB3 PHE A 882 13.479 2.181 -1.105 1.00 25.00 H new ATOM 0 HD1 PHE A 882 12.864 4.648 -0.411 1.00 25.00 H new ATOM 0 HD2 PHE A 882 11.214 2.639 -3.839 1.00 25.00 H new ATOM 0 HE1 PHE A 882 10.977 6.278 -0.455 1.00 25.00 H new ATOM 0 HE2 PHE A 882 9.330 4.262 -3.893 1.00 25.00 H new ATOM 0 HZ PHE A 882 9.207 6.087 -2.198 1.00 25.00 H new