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+ -178:sc= 0.425 (180deg=0.417) USER MOD Set 1.2: A 879 TYR OH : rot 156:sc= 1.25 USER MOD Set 1.3: A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 808 THR OG1 : rot -166:sc= 1.01 USER MOD Set 2.2: A 810 GLN :FLIP amide:sc= 0.527 F(o=-0.64,f=1.5) USER MOD Set 3.1: A 772 LYS NZ :NH3+ -135:sc= 1.03 (180deg=0.0723) USER MOD Set 3.2: A 784 ASN : amide:sc= 0.479 K(o=1.5,f=0.86) USER MOD Set 4.1: A 763 SER OG : rot -115:sc= 1.28 USER MOD Set 4.2: A 765 THR OG1 : rot 44:sc= 0.0384 USER MOD Single : A 742 SER OG : rot -26:sc= 0.0758 USER MOD Single : A 744 SER OG : rot 180:sc= 0.1 USER MOD Single : A 745 GLN :FLIP amide:sc= 0 F(o=-0.61,f=0) USER MOD Single : A 747 GLN : amide:sc= -0.0751 K(o=-0.075,f=-1.8) USER MOD Single : A 748 MET CE :methyl 140:sc= -2.16! (180deg=-4.19!) USER MOD Single : A 749 ASN : amide:sc= 0.00936 X(o=0.0094,f=0) USER MOD Single : A 754 SER OG : rot -87:sc= 0.941 USER MOD Single : A 756 ASN : amide:sc= 0.368 K(o=0.37,f=-1.2) USER MOD Single : A 757 HIS : no HD1:sc= -0.44 X(o=-0.44,f=-0.034) USER MOD Single : A 762 HIS : no HD1:sc= -0.552 X(o=-0.55,f=-0.073) USER MOD Single : A 774 CYS SG : rot 180:sc= 0.773 USER MOD Single : A 777 SER OG : rot -38:sc= 0.311 USER MOD Single : A 780 TYR OH : rot 180:sc= -0.119 USER MOD Single : A 787 GLN : amide:sc= -0.388 X(o=-0.39,f=-0.11) USER MOD Single : A 796 MET CE :methyl -160:sc= 0 (180deg=-0.238) USER MOD Single : A 797 SER OG : rot 180:sc= 0 USER MOD Single : A 802 ASN :FLIP amide:sc= 0 F(o=-0.94,f=0) USER MOD Single : A 816 MET CE :methyl 179:sc= -0.13 (180deg=-0.13) USER MOD Single : A 817 SER OG : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot -89:sc= 0.94 USER MOD Single : A 823 THR OG1 : rot 171:sc= 0.159 USER MOD Single : A 825 THR OG1 : rot -145:sc= 0.548 USER MOD Single : A 828 GLN : amide:sc= -0.213 X(o=-0.21,f=0) USER MOD Single : A 830 MET CE :methyl -171:sc= 0 (180deg=-0.0908) USER MOD Single : A 832 SER OG : rot -85:sc= 1.25 USER MOD Single : A 840 LYS NZ :NH3+ 158:sc= 0.52 (180deg=-0.192!) USER MOD Single : A 841 ASN : amide:sc= 0.0333 K(o=0.033,f=-2.2!) USER MOD Single : A 842 TYR OH : rot 180:sc= 0 USER MOD Single : A 844 THR OG1 : rot -71:sc= 0.571 USER MOD Single : A 845 MET CE :methyl 126:sc= -0.258 (180deg=-1.11) USER MOD Single : A 856 GLN : amide:sc= -2.08 K(o=-2.1,f=-4.8!) USER MOD Single : A 859 TYR OH : rot -68:sc= 0.016 USER MOD Single : A 860 CYS SG : rot 13:sc= 0.876 USER MOD Single : A 864 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 867 TYR OH : rot 82:sc= 0.496 USER MOD Single : A 881 SER OG : rot -44:sc= 0.493 USER MOD ----------------------------------------------------------------- ATOM 21 N SER A 742 -1.250 -10.901 -7.317 1.00 25.00 N ATOM 22 CA SER A 742 -1.977 -9.706 -6.835 1.00 25.00 C ATOM 23 C SER A 742 -1.997 -9.728 -5.294 1.00 25.00 C ATOM 24 O SER A 742 -1.131 -10.337 -4.665 1.00 25.00 O ATOM 25 CB SER A 742 -3.424 -9.678 -7.367 1.00 25.00 C ATOM 26 OG SER A 742 -4.122 -10.857 -7.011 1.00 25.00 O ATOM 0 HA SER A 742 -1.467 -8.815 -7.200 1.00 25.00 H new ATOM 0 HB2 SER A 742 -3.945 -8.808 -6.966 1.00 25.00 H new ATOM 0 HB3 SER A 742 -3.414 -9.572 -8.452 1.00 25.00 H new ATOM 0 HG SER A 742 -3.484 -11.592 -6.892 1.00 25.00 H new ATOM 32 N ILE A 743 -3.005 -9.097 -4.702 1.00 25.00 N ATOM 33 CA ILE A 743 -3.204 -9.095 -3.253 1.00 25.00 C ATOM 34 C ILE A 743 -3.403 -10.525 -2.699 1.00 25.00 C ATOM 35 O ILE A 743 -3.878 -11.429 -3.391 1.00 25.00 O ATOM 36 CB ILE A 743 -4.412 -8.193 -2.885 1.00 25.00 C ATOM 37 CG1 ILE A 743 -4.038 -7.378 -1.645 1.00 25.00 C ATOM 38 CG2 ILE A 743 -5.729 -9.015 -2.728 1.00 25.00 C ATOM 39 CD1 ILE A 743 -5.196 -6.904 -0.808 1.00 25.00 C ATOM 0 H ILE A 743 -3.712 -8.569 -5.214 1.00 25.00 H new ATOM 0 HA ILE A 743 -2.303 -8.692 -2.791 1.00 25.00 H new ATOM 0 HB ILE A 743 -4.628 -7.499 -3.697 1.00 25.00 H new ATOM 0 HG12 ILE A 743 -3.383 -7.983 -1.018 1.00 25.00 H new ATOM 0 HG13 ILE A 743 -3.462 -6.509 -1.963 1.00 25.00 H new ATOM 0 HG21 ILE A 743 -6.548 -8.344 -2.470 1.00 25.00 H new ATOM 0 HG22 ILE A 743 -5.956 -9.521 -3.666 1.00 25.00 H new ATOM 0 HG23 ILE A 743 -5.604 -9.755 -1.938 1.00 25.00 H new ATOM 0 HD11 ILE A 743 -4.821 -6.337 0.044 1.00 25.00 H new ATOM 0 HD12 ILE A 743 -5.844 -6.267 -1.410 1.00 25.00 H new ATOM 0 HD13 ILE A 743 -5.763 -7.764 -0.451 1.00 25.00 H new ATOM 51 N SER A 744 -3.020 -10.715 -1.447 1.00 25.00 N ATOM 52 CA SER A 744 -3.127 -12.005 -0.777 1.00 25.00 C ATOM 53 C SER A 744 -4.392 -12.044 0.061 1.00 25.00 C ATOM 54 O SER A 744 -4.909 -11.004 0.481 1.00 25.00 O ATOM 55 CB SER A 744 -1.900 -12.228 0.123 1.00 25.00 C ATOM 56 OG SER A 744 -2.028 -13.407 0.904 1.00 25.00 O ATOM 0 H SER A 744 -2.625 -9.978 -0.863 1.00 25.00 H new ATOM 0 HA SER A 744 -3.169 -12.795 -1.527 1.00 25.00 H new ATOM 0 HB2 SER A 744 -1.004 -12.296 -0.494 1.00 25.00 H new ATOM 0 HB3 SER A 744 -1.770 -11.368 0.781 1.00 25.00 H new ATOM 0 HG SER A 744 -1.230 -13.518 1.462 1.00 25.00 H new ATOM 62 N GLN A 745 -4.845 -13.250 0.370 1.00 25.00 N ATOM 63 CA GLN A 745 -5.980 -13.443 1.264 1.00 25.00 C ATOM 64 C GLN A 745 -5.644 -12.906 2.650 1.00 25.00 C ATOM 65 O GLN A 745 -6.521 -12.463 3.376 1.00 25.00 O ATOM 66 CB GLN A 745 -6.328 -14.930 1.372 1.00 25.00 C ATOM 67 CG GLN A 745 -7.057 -15.492 0.153 1.00 25.00 C ATOM 68 CD GLN A 745 -8.569 -15.530 0.333 1.00 25.00 C ATOM 69 OE1 GLN A 745 -9.157 -14.413 0.686 1.00 25.00 O flip ATOM 70 NE2 GLN A 745 -9.192 -16.560 0.153 1.00 25.00 N flip ATOM 0 H GLN A 745 -4.441 -14.116 0.013 1.00 25.00 H new ATOM 0 HA GLN A 745 -6.836 -12.904 0.857 1.00 25.00 H new ATOM 0 HB2 GLN A 745 -5.409 -15.497 1.525 1.00 25.00 H new ATOM 0 HB3 GLN A 745 -6.948 -15.083 2.255 1.00 25.00 H new ATOM 0 HG2 GLN A 745 -6.815 -14.886 -0.720 1.00 25.00 H new ATOM 0 HG3 GLN A 745 -6.695 -16.500 -0.048 1.00 25.00 H new ATOM 0 HE21 GLN A 745 -8.702 -17.411 -0.121 1.00 25.00 H new ATOM 0 HE22 GLN A 745 -10.204 -16.572 0.276 1.00 25.00 H new ATOM 79 N GLU A 746 -4.372 -12.926 3.011 1.00 25.00 N ATOM 80 CA GLU A 746 -3.962 -12.448 4.326 1.00 25.00 C ATOM 81 C GLU A 746 -3.848 -10.938 4.321 1.00 25.00 C ATOM 82 O GLU A 746 -4.260 -10.284 5.273 1.00 25.00 O ATOM 83 CB GLU A 746 -2.651 -13.101 4.738 1.00 25.00 C ATOM 84 CG GLU A 746 -2.840 -14.581 5.001 1.00 25.00 C ATOM 85 CD GLU A 746 -1.562 -15.267 5.433 1.00 25.00 C ATOM 86 OE1 GLU A 746 -1.233 -15.221 6.636 1.00 25.00 O ATOM 87 OE2 GLU A 746 -0.907 -15.887 4.569 1.00 25.00 O ATOM 0 H GLU A 746 -3.611 -13.263 2.422 1.00 25.00 H new ATOM 0 HA GLU A 746 -4.720 -12.725 5.059 1.00 25.00 H new ATOM 0 HB2 GLU A 746 -1.908 -12.960 3.953 1.00 25.00 H new ATOM 0 HB3 GLU A 746 -2.265 -12.615 5.634 1.00 25.00 H new ATOM 0 HG2 GLU A 746 -3.598 -14.714 5.773 1.00 25.00 H new ATOM 0 HG3 GLU A 746 -3.217 -15.061 4.098 1.00 25.00 H new ATOM 94 N GLN A 747 -3.391 -10.378 3.208 1.00 25.00 N ATOM 95 CA GLN A 747 -3.308 -8.928 3.082 1.00 25.00 C ATOM 96 C GLN A 747 -4.684 -8.297 3.181 1.00 25.00 C ATOM 97 O GLN A 747 -4.855 -7.276 3.827 1.00 25.00 O ATOM 98 CB GLN A 747 -2.674 -8.515 1.752 1.00 25.00 C ATOM 99 CG GLN A 747 -2.408 -7.006 1.659 1.00 25.00 C ATOM 100 CD GLN A 747 -1.379 -6.540 2.658 1.00 25.00 C ATOM 101 OE1 GLN A 747 -0.196 -6.723 2.459 1.00 25.00 O ATOM 102 NE2 GLN A 747 -1.828 -5.958 3.735 1.00 25.00 N ATOM 0 H GLN A 747 -3.076 -10.898 2.389 1.00 25.00 H new ATOM 0 HA GLN A 747 -2.681 -8.576 3.901 1.00 25.00 H new ATOM 0 HB2 GLN A 747 -1.735 -9.053 1.621 1.00 25.00 H new ATOM 0 HB3 GLN A 747 -3.330 -8.814 0.934 1.00 25.00 H new ATOM 0 HG2 GLN A 747 -2.070 -6.761 0.652 1.00 25.00 H new ATOM 0 HG3 GLN A 747 -3.340 -6.465 1.823 1.00 25.00 H new ATOM 0 HE21 GLN A 747 -2.831 -5.824 3.862 1.00 25.00 H new ATOM 0 HE22 GLN A 747 -1.176 -5.637 4.451 1.00 25.00 H new ATOM 111 N MET A 748 -5.684 -8.902 2.558 1.00 25.00 N ATOM 112 CA MET A 748 -7.018 -8.331 2.597 1.00 25.00 C ATOM 113 C MET A 748 -7.600 -8.533 3.979 1.00 25.00 C ATOM 114 O MET A 748 -8.512 -7.830 4.381 1.00 25.00 O ATOM 115 CB MET A 748 -7.936 -8.949 1.542 1.00 25.00 C ATOM 116 CG MET A 748 -8.217 -10.409 1.714 1.00 25.00 C ATOM 117 SD MET A 748 -9.723 -10.948 0.864 1.00 25.00 S ATOM 118 CE MET A 748 -9.545 -10.190 -0.761 1.00 25.00 C ATOM 0 H MET A 748 -5.600 -9.771 2.030 1.00 25.00 H new ATOM 0 HA MET A 748 -6.943 -7.267 2.372 1.00 25.00 H new ATOM 0 HB2 MET A 748 -8.884 -8.410 1.548 1.00 25.00 H new ATOM 0 HB3 MET A 748 -7.489 -8.795 0.560 1.00 25.00 H new ATOM 0 HG2 MET A 748 -7.370 -10.983 1.338 1.00 25.00 H new ATOM 0 HG3 MET A 748 -8.307 -10.633 2.777 1.00 25.00 H new ATOM 0 HE1 MET A 748 -9.881 -10.889 -1.527 1.00 25.00 H new ATOM 0 HE2 MET A 748 -10.147 -9.283 -0.807 1.00 25.00 H new ATOM 0 HE3 MET A 748 -8.498 -9.939 -0.933 1.00 25.00 H new ATOM 128 N ASN A 749 -7.071 -9.502 4.710 1.00 25.00 N ATOM 129 CA ASN A 749 -7.597 -9.813 6.023 1.00 25.00 C ATOM 130 C ASN A 749 -7.102 -8.808 7.048 1.00 25.00 C ATOM 131 O ASN A 749 -7.867 -8.343 7.880 1.00 25.00 O ATOM 132 CB ASN A 749 -7.236 -11.244 6.423 1.00 25.00 C ATOM 133 CG ASN A 749 -6.795 -11.356 7.863 1.00 25.00 C ATOM 134 OD1 ASN A 749 -7.610 -11.432 8.769 1.00 25.00 O ATOM 135 ND2 ASN A 749 -5.505 -11.387 8.074 1.00 25.00 N ATOM 0 H ASN A 749 -6.284 -10.081 4.416 1.00 25.00 H new ATOM 0 HA ASN A 749 -8.684 -9.743 5.988 1.00 25.00 H new ATOM 0 HB2 ASN A 749 -8.099 -11.890 6.261 1.00 25.00 H new ATOM 0 HB3 ASN A 749 -6.439 -11.608 5.774 1.00 25.00 H new ATOM 0 HD21 ASN A 749 -5.146 -11.478 9.024 1.00 25.00 H new ATOM 0 HD22 ASN A 749 -4.858 -11.321 7.288 1.00 25.00 H new ATOM 142 N GLU A 750 -5.840 -8.427 6.971 1.00 25.00 N ATOM 143 CA GLU A 750 -5.329 -7.416 7.886 1.00 25.00 C ATOM 144 C GLU A 750 -5.780 -6.027 7.429 1.00 25.00 C ATOM 145 O GLU A 750 -6.129 -5.183 8.244 1.00 25.00 O ATOM 146 CB GLU A 750 -3.806 -7.507 8.002 1.00 25.00 C ATOM 147 CG GLU A 750 -3.056 -7.236 6.718 1.00 25.00 C ATOM 148 CD GLU A 750 -1.601 -7.588 6.839 1.00 25.00 C ATOM 149 OE1 GLU A 750 -1.256 -8.764 6.600 1.00 25.00 O ATOM 150 OE2 GLU A 750 -0.812 -6.701 7.210 1.00 25.00 O ATOM 0 H GLU A 750 -5.161 -8.791 6.302 1.00 25.00 H new ATOM 0 HA GLU A 750 -5.738 -7.596 8.880 1.00 25.00 H new ATOM 0 HB2 GLU A 750 -3.470 -6.798 8.759 1.00 25.00 H new ATOM 0 HB3 GLU A 750 -3.541 -8.503 8.358 1.00 25.00 H new ATOM 0 HG2 GLU A 750 -3.503 -7.811 5.907 1.00 25.00 H new ATOM 0 HG3 GLU A 750 -3.155 -6.183 6.454 1.00 25.00 H new ATOM 157 N PHE A 751 -5.843 -5.799 6.125 1.00 25.00 N ATOM 158 CA PHE A 751 -6.236 -4.492 5.608 1.00 25.00 C ATOM 159 C PHE A 751 -7.721 -4.204 5.779 1.00 25.00 C ATOM 160 O PHE A 751 -8.124 -3.045 5.857 1.00 25.00 O ATOM 161 CB PHE A 751 -5.858 -4.366 4.144 1.00 25.00 C ATOM 162 CG PHE A 751 -6.216 -3.042 3.555 1.00 25.00 C ATOM 163 CD1 PHE A 751 -5.576 -1.867 3.981 1.00 25.00 C ATOM 164 CD2 PHE A 751 -7.207 -2.955 2.572 1.00 25.00 C ATOM 165 CE1 PHE A 751 -5.930 -0.620 3.421 1.00 25.00 C ATOM 166 CE2 PHE A 751 -7.538 -1.724 1.995 1.00 25.00 C ATOM 167 CZ PHE A 751 -6.909 -0.555 2.420 1.00 25.00 C ATOM 0 H PHE A 751 -5.630 -6.494 5.409 1.00 25.00 H new ATOM 0 HA PHE A 751 -5.694 -3.753 6.199 1.00 25.00 H new ATOM 0 HB2 PHE A 751 -4.785 -4.525 4.038 1.00 25.00 H new ATOM 0 HB3 PHE A 751 -6.355 -5.154 3.578 1.00 25.00 H new ATOM 0 HD1 PHE A 751 -4.810 -1.917 4.740 1.00 25.00 H new ATOM 0 HD2 PHE A 751 -7.723 -3.849 2.254 1.00 25.00 H new ATOM 0 HE1 PHE A 751 -5.447 0.283 3.764 1.00 25.00 H new ATOM 0 HE2 PHE A 751 -8.285 -1.679 1.216 1.00 25.00 H new ATOM 0 HZ PHE A 751 -7.174 0.395 1.981 1.00 25.00 H new ATOM 177 N ARG A 752 -8.546 -5.231 5.938 1.00 25.00 N ATOM 178 CA ARG A 752 -9.957 -5.006 6.231 1.00 25.00 C ATOM 179 C ARG A 752 -10.079 -4.292 7.565 1.00 25.00 C ATOM 180 O ARG A 752 -11.084 -3.682 7.806 1.00 25.00 O ATOM 181 CB ARG A 752 -10.766 -6.319 6.241 1.00 25.00 C ATOM 182 CG ARG A 752 -10.651 -7.158 7.502 1.00 25.00 C ATOM 183 CD ARG A 752 -11.838 -6.977 8.434 1.00 25.00 C ATOM 184 NE ARG A 752 -11.685 -7.823 9.626 1.00 25.00 N ATOM 185 CZ ARG A 752 -12.517 -7.851 10.659 1.00 25.00 C ATOM 186 NH1 ARG A 752 -13.585 -7.093 10.721 1.00 25.00 N ATOM 187 NH2 ARG A 752 -12.267 -8.660 11.650 1.00 25.00 N ATOM 0 H ARG A 752 -8.271 -6.211 5.871 1.00 25.00 H new ATOM 0 HA ARG A 752 -10.377 -4.386 5.439 1.00 25.00 H new ATOM 0 HB2 ARG A 752 -11.817 -6.077 6.083 1.00 25.00 H new ATOM 0 HB3 ARG A 752 -10.448 -6.926 5.393 1.00 25.00 H new ATOM 0 HG2 ARG A 752 -10.566 -8.210 7.228 1.00 25.00 H new ATOM 0 HG3 ARG A 752 -9.735 -6.891 8.030 1.00 25.00 H new ATOM 0 HD2 ARG A 752 -11.920 -5.931 8.730 1.00 25.00 H new ATOM 0 HD3 ARG A 752 -12.760 -7.234 7.913 1.00 25.00 H new ATOM 0 HE ARG A 752 -10.873 -8.439 9.662 1.00 25.00 H new ATOM 0 HH11 ARG A 752 -13.801 -6.452 9.957 1.00 25.00 H new ATOM 0 HH12 ARG A 752 -14.200 -7.144 11.533 1.00 25.00 H new ATOM 0 HH21 ARG A 752 -11.442 -9.259 11.624 1.00 25.00 H new ATOM 0 HH22 ARG A 752 -12.896 -8.694 12.452 1.00 25.00 H new ATOM 201 N ALA A 753 -9.054 -4.334 8.415 1.00 25.00 N ATOM 202 CA ALA A 753 -9.080 -3.626 9.697 1.00 25.00 C ATOM 203 C ALA A 753 -9.019 -2.111 9.483 1.00 25.00 C ATOM 204 O ALA A 753 -9.467 -1.341 10.329 1.00 25.00 O ATOM 205 CB ALA A 753 -7.921 -4.072 10.567 1.00 25.00 C ATOM 0 H ALA A 753 -8.193 -4.852 8.240 1.00 25.00 H new ATOM 0 HA ALA A 753 -10.017 -3.867 10.200 1.00 25.00 H new ATOM 0 HB1 ALA A 753 -7.952 -3.538 11.517 1.00 25.00 H new ATOM 0 HB2 ALA A 753 -7.995 -5.144 10.751 1.00 25.00 H new ATOM 0 HB3 ALA A 753 -6.981 -3.855 10.060 1.00 25.00 H new ATOM 211 N SER A 754 -8.543 -1.679 8.324 1.00 25.00 N ATOM 212 CA SER A 754 -8.525 -0.259 8.000 1.00 25.00 C ATOM 213 C SER A 754 -9.955 0.296 7.898 1.00 25.00 C ATOM 214 O SER A 754 -10.166 1.503 7.991 1.00 25.00 O ATOM 215 CB SER A 754 -7.714 0.022 6.728 1.00 25.00 C ATOM 216 OG SER A 754 -7.376 1.396 6.651 1.00 25.00 O ATOM 0 H SER A 754 -8.166 -2.286 7.596 1.00 25.00 H new ATOM 0 HA SER A 754 -8.023 0.263 8.815 1.00 25.00 H new ATOM 0 HB2 SER A 754 -6.807 -0.583 6.726 1.00 25.00 H new ATOM 0 HB3 SER A 754 -8.291 -0.267 5.850 1.00 25.00 H new ATOM 0 HG SER A 754 -8.104 1.888 6.218 1.00 25.00 H new ATOM 222 N PHE A 755 -10.939 -0.600 7.842 1.00 25.00 N ATOM 223 CA PHE A 755 -12.361 -0.209 7.929 1.00 25.00 C ATOM 224 C PHE A 755 -12.724 0.539 9.207 1.00 25.00 C ATOM 225 O PHE A 755 -13.730 1.225 9.246 1.00 25.00 O ATOM 226 CB PHE A 755 -13.276 -1.440 7.785 1.00 25.00 C ATOM 227 CG PHE A 755 -13.598 -2.174 9.103 1.00 25.00 C ATOM 228 CD1 PHE A 755 -12.593 -2.636 9.974 1.00 25.00 C ATOM 229 CD2 PHE A 755 -14.929 -2.434 9.444 1.00 25.00 C ATOM 230 CE1 PHE A 755 -12.914 -3.353 11.156 1.00 25.00 C ATOM 231 CE2 PHE A 755 -15.267 -3.134 10.629 1.00 25.00 C ATOM 232 CZ PHE A 755 -14.255 -3.594 11.482 1.00 25.00 C ATOM 0 H PHE A 755 -10.787 -1.603 7.737 1.00 25.00 H new ATOM 0 HA PHE A 755 -12.518 0.483 7.101 1.00 25.00 H new ATOM 0 HB2 PHE A 755 -14.212 -1.125 7.324 1.00 25.00 H new ATOM 0 HB3 PHE A 755 -12.805 -2.145 7.100 1.00 25.00 H new ATOM 0 HD1 PHE A 755 -11.557 -2.441 9.738 1.00 25.00 H new ATOM 0 HD2 PHE A 755 -15.718 -2.094 8.789 1.00 25.00 H new ATOM 0 HE1 PHE A 755 -12.127 -3.712 11.802 1.00 25.00 H new ATOM 0 HE2 PHE A 755 -16.303 -3.313 10.874 1.00 25.00 H new ATOM 0 HZ PHE A 755 -14.507 -4.131 12.385 1.00 25.00 H new ATOM 242 N ASN A 756 -11.939 0.358 10.261 1.00 25.00 N ATOM 243 CA ASN A 756 -12.188 1.055 11.530 1.00 25.00 C ATOM 244 C ASN A 756 -11.089 2.079 11.835 1.00 25.00 C ATOM 245 O ASN A 756 -11.226 2.889 12.742 1.00 25.00 O ATOM 246 CB ASN A 756 -12.337 0.042 12.681 1.00 25.00 C ATOM 247 CG ASN A 756 -11.008 -0.459 13.223 1.00 25.00 C ATOM 248 OD1 ASN A 756 -10.283 0.247 13.894 1.00 25.00 O ATOM 249 ND2 ASN A 756 -10.719 -1.700 12.974 1.00 25.00 N ATOM 0 H ASN A 756 -11.128 -0.260 10.270 1.00 25.00 H new ATOM 0 HA ASN A 756 -13.124 1.605 11.432 1.00 25.00 H new ATOM 0 HB2 ASN A 756 -12.900 0.505 13.492 1.00 25.00 H new ATOM 0 HB3 ASN A 756 -12.922 -0.809 12.332 1.00 25.00 H new ATOM 0 HD21 ASN A 756 -9.861 -2.108 13.346 1.00 25.00 H new ATOM 0 HD22 ASN A 756 -11.349 -2.267 12.407 1.00 25.00 H new ATOM 256 N HIS A 757 -10.011 2.031 11.059 1.00 25.00 N ATOM 257 CA HIS A 757 -8.821 2.861 11.301 1.00 25.00 C ATOM 258 C HIS A 757 -9.115 4.350 11.163 1.00 25.00 C ATOM 259 O HIS A 757 -8.900 5.122 12.086 1.00 25.00 O ATOM 260 CB HIS A 757 -7.721 2.457 10.305 1.00 25.00 C ATOM 261 CG HIS A 757 -6.450 3.241 10.433 1.00 25.00 C ATOM 262 ND1 HIS A 757 -5.472 3.281 9.469 1.00 25.00 N ATOM 263 CD2 HIS A 757 -5.984 4.035 11.440 1.00 25.00 C ATOM 264 CE1 HIS A 757 -4.491 4.067 9.901 1.00 25.00 C ATOM 265 NE2 HIS A 757 -4.749 4.554 11.099 1.00 25.00 N ATOM 0 H HIS A 757 -9.931 1.420 10.246 1.00 25.00 H new ATOM 0 HA HIS A 757 -8.495 2.690 12.327 1.00 25.00 H new ATOM 0 HB2 HIS A 757 -7.496 1.399 10.441 1.00 25.00 H new ATOM 0 HB3 HIS A 757 -8.105 2.574 9.292 1.00 25.00 H new ATOM 0 HD2 HIS A 757 -6.503 4.229 12.367 1.00 25.00 H new ATOM 0 HE1 HIS A 757 -3.593 4.280 9.340 1.00 25.00 H new ATOM 0 HE2 HIS A 757 -4.164 5.179 11.654 1.00 25.00 H new ATOM 273 N PHE A 758 -9.597 4.748 9.995 1.00 25.00 N ATOM 274 CA PHE A 758 -9.885 6.156 9.729 1.00 25.00 C ATOM 275 C PHE A 758 -11.368 6.413 9.782 1.00 25.00 C ATOM 276 O PHE A 758 -11.826 7.500 9.438 1.00 25.00 O ATOM 277 CB PHE A 758 -9.354 6.556 8.362 1.00 25.00 C ATOM 278 CG PHE A 758 -8.041 7.284 8.417 1.00 25.00 C ATOM 279 CD1 PHE A 758 -6.833 6.570 8.474 1.00 25.00 C ATOM 280 CD2 PHE A 758 -8.004 8.691 8.386 1.00 25.00 C ATOM 281 CE1 PHE A 758 -5.590 7.249 8.502 1.00 25.00 C ATOM 282 CE2 PHE A 758 -6.764 9.385 8.409 1.00 25.00 C ATOM 283 CZ PHE A 758 -5.555 8.658 8.467 1.00 25.00 C ATOM 0 H PHE A 758 -9.798 4.121 9.216 1.00 25.00 H new ATOM 0 HA PHE A 758 -9.392 6.752 10.497 1.00 25.00 H new ATOM 0 HB2 PHE A 758 -9.239 5.661 7.750 1.00 25.00 H new ATOM 0 HB3 PHE A 758 -10.090 7.189 7.866 1.00 25.00 H new ATOM 0 HD1 PHE A 758 -6.852 5.490 8.497 1.00 25.00 H new ATOM 0 HD2 PHE A 758 -8.928 9.249 8.344 1.00 25.00 H new ATOM 0 HE1 PHE A 758 -4.669 6.687 8.550 1.00 25.00 H new ATOM 0 HE2 PHE A 758 -6.747 10.465 8.382 1.00 25.00 H new ATOM 0 HZ PHE A 758 -4.609 9.178 8.484 1.00 25.00 H new ATOM 293 N ASP A 759 -12.137 5.408 10.170 1.00 25.00 N ATOM 294 CA ASP A 759 -13.587 5.570 10.252 1.00 25.00 C ATOM 295 C ASP A 759 -13.962 6.656 11.208 1.00 25.00 C ATOM 296 O ASP A 759 -13.865 6.515 12.422 1.00 25.00 O ATOM 297 CB ASP A 759 -14.316 4.284 10.564 1.00 25.00 C ATOM 298 CG ASP A 759 -15.808 4.399 10.292 1.00 25.00 C ATOM 299 OD1 ASP A 759 -16.373 5.510 10.442 1.00 75.00 O ATOM 300 OD2 ASP A 759 -16.422 3.426 9.857 1.00 75.00 O ATOM 0 H ASP A 759 -11.792 4.484 10.430 1.00 25.00 H new ATOM 0 HA ASP A 759 -13.914 5.867 9.255 1.00 25.00 H new ATOM 0 HB2 ASP A 759 -13.899 3.475 9.964 1.00 25.00 H new ATOM 0 HB3 ASP A 759 -14.157 4.021 11.610 1.00 25.00 H new ATOM 305 N ARG A 760 -14.349 7.766 10.602 1.00 25.00 N ATOM 306 CA ARG A 760 -14.637 8.985 11.353 1.00 25.00 C ATOM 307 C ARG A 760 -15.659 8.800 12.437 1.00 25.00 C ATOM 308 O ARG A 760 -15.606 9.462 13.463 1.00 25.00 O ATOM 309 CB ARG A 760 -15.142 10.067 10.421 1.00 25.00 C ATOM 310 CG ARG A 760 -14.084 10.936 9.967 1.00 25.00 C ATOM 311 CD ARG A 760 -14.680 11.786 8.919 1.00 25.00 C ATOM 312 NE ARG A 760 -13.661 12.485 8.123 1.00 25.00 N ATOM 313 CZ ARG A 760 -13.915 13.385 7.179 1.00 25.00 C ATOM 314 NH1 ARG A 760 -15.129 13.766 6.888 1.00 25.00 N ATOM 315 NH2 ARG A 760 -12.933 13.917 6.515 1.00 25.00 N ATOM 0 H ARG A 760 -14.472 7.852 9.593 1.00 25.00 H new ATOM 0 HA ARG A 760 -13.695 9.266 11.823 1.00 25.00 H new ATOM 0 HB2 ARG A 760 -15.625 9.605 9.560 1.00 25.00 H new ATOM 0 HB3 ARG A 760 -15.901 10.659 10.932 1.00 25.00 H new ATOM 0 HG2 ARG A 760 -13.697 11.541 10.787 1.00 25.00 H new ATOM 0 HG3 ARG A 760 -13.247 10.359 9.573 1.00 25.00 H new ATOM 0 HD2 ARG A 760 -15.294 11.171 8.261 1.00 25.00 H new ATOM 0 HD3 ARG A 760 -15.343 12.518 9.381 1.00 25.00 H new ATOM 0 HE ARG A 760 -12.683 12.262 8.310 1.00 25.00 H new ATOM 0 HH11 ARG A 760 -15.922 13.370 7.392 1.00 25.00 H new ATOM 0 HH12 ARG A 760 -15.284 14.460 6.156 1.00 25.00 H new ATOM 0 HH21 ARG A 760 -11.972 13.643 6.719 1.00 25.00 H new ATOM 0 HH22 ARG A 760 -13.123 14.608 5.789 1.00 25.00 H new ATOM 329 N ASP A 761 -16.623 7.942 12.171 1.00 25.00 N ATOM 330 CA ASP A 761 -17.706 7.715 13.107 1.00 25.00 C ATOM 331 C ASP A 761 -17.692 6.271 13.616 1.00 25.00 C ATOM 332 O ASP A 761 -18.572 5.858 14.364 1.00 25.00 O ATOM 333 CB ASP A 761 -19.045 8.092 12.462 1.00 25.00 C ATOM 334 CG ASP A 761 -19.106 7.720 11.006 1.00 25.00 C ATOM 335 OD1 ASP A 761 -18.700 8.514 10.140 1.00 50.00 O ATOM 336 OD2 ASP A 761 -19.448 6.568 10.711 1.00 50.00 O ATOM 0 H ASP A 761 -16.679 7.390 11.315 1.00 25.00 H new ATOM 0 HA ASP A 761 -17.567 8.356 13.978 1.00 25.00 H new ATOM 0 HB2 ASP A 761 -19.855 7.594 12.995 1.00 25.00 H new ATOM 0 HB3 ASP A 761 -19.206 9.165 12.567 1.00 25.00 H new ATOM 341 N HIS A 762 -16.684 5.513 13.190 1.00 25.00 N ATOM 342 CA HIS A 762 -16.479 4.117 13.617 1.00 25.00 C ATOM 343 C HIS A 762 -17.660 3.163 13.331 1.00 25.00 C ATOM 344 O HIS A 762 -17.898 2.205 14.058 1.00 25.00 O ATOM 345 CB HIS A 762 -16.079 4.077 15.098 1.00 25.00 C ATOM 346 CG HIS A 762 -15.108 2.985 15.428 1.00 25.00 C ATOM 347 ND1 HIS A 762 -13.747 3.085 15.270 1.00 25.00 N ATOM 348 CD2 HIS A 762 -15.315 1.733 15.923 1.00 25.00 C ATOM 349 CE1 HIS A 762 -13.196 1.945 15.675 1.00 25.00 C ATOM 350 NE2 HIS A 762 -14.105 1.079 16.079 1.00 25.00 N ATOM 0 H HIS A 762 -15.977 5.846 12.534 1.00 25.00 H new ATOM 0 HA HIS A 762 -15.668 3.734 12.998 1.00 25.00 H new ATOM 0 HB2 HIS A 762 -15.641 5.036 15.373 1.00 25.00 H new ATOM 0 HB3 HIS A 762 -16.976 3.950 15.705 1.00 25.00 H new ATOM 0 HD2 HIS A 762 -16.281 1.312 16.159 1.00 25.00 H new ATOM 0 HE1 HIS A 762 -12.133 1.752 15.673 1.00 25.00 H new ATOM 0 HE2 HIS A 762 -13.950 0.134 16.430 1.00 25.00 H new ATOM 358 N SER A 763 -18.364 3.404 12.231 1.00 25.00 N ATOM 359 CA SER A 763 -19.485 2.550 11.811 1.00 25.00 C ATOM 360 C SER A 763 -19.033 1.212 11.230 1.00 25.00 C ATOM 361 O SER A 763 -19.827 0.285 11.087 1.00 25.00 O ATOM 362 CB SER A 763 -20.310 3.263 10.745 1.00 25.00 C ATOM 363 OG SER A 763 -19.508 4.185 10.024 1.00 25.00 O ATOM 0 H SER A 763 -18.182 4.188 11.605 1.00 25.00 H new ATOM 0 HA SER A 763 -20.070 2.355 12.710 1.00 25.00 H new ATOM 0 HB2 SER A 763 -20.738 2.532 10.059 1.00 25.00 H new ATOM 0 HB3 SER A 763 -21.144 3.787 11.213 1.00 25.00 H new ATOM 0 HG SER A 763 -19.824 5.097 10.195 1.00 25.00 H new ATOM 369 N GLY A 764 -17.772 1.133 10.835 1.00 25.00 N ATOM 370 CA GLY A 764 -17.255 -0.078 10.217 1.00 25.00 C ATOM 371 C GLY A 764 -17.408 0.009 8.714 1.00 25.00 C ATOM 372 O GLY A 764 -17.360 -0.981 7.984 1.00 25.00 O ATOM 0 H GLY A 764 -17.092 1.887 10.930 1.00 25.00 H new ATOM 0 HA2 GLY A 764 -16.205 -0.211 10.478 1.00 25.00 H new ATOM 0 HA3 GLY A 764 -17.790 -0.948 10.597 1.00 25.00 H new ATOM 376 N THR A 765 -17.596 1.228 8.254 1.00 25.00 N ATOM 377 CA THR A 765 -17.676 1.537 6.835 1.00 25.00 C ATOM 378 C THR A 765 -17.258 2.991 6.663 1.00 25.00 C ATOM 379 O THR A 765 -17.710 3.880 7.403 1.00 25.00 O ATOM 380 CB THR A 765 -19.110 1.410 6.295 1.00 25.00 C ATOM 381 OG1 THR A 765 -20.028 1.912 7.269 1.00 25.00 O ATOM 382 CG2 THR A 765 -19.501 -0.025 5.977 1.00 25.00 C ATOM 0 H THR A 765 -17.699 2.043 8.858 1.00 25.00 H new ATOM 0 HA THR A 765 -17.038 0.839 6.294 1.00 25.00 H new ATOM 0 HB THR A 765 -19.148 1.983 5.369 1.00 25.00 H new ATOM 0 HG1 THR A 765 -19.685 2.752 7.639 1.00 25.00 H new ATOM 0 HG21 THR A 765 -20.524 -0.049 5.600 1.00 25.00 H new ATOM 0 HG22 THR A 765 -18.826 -0.427 5.221 1.00 25.00 H new ATOM 0 HG23 THR A 765 -19.434 -0.629 6.882 1.00 25.00 H new ATOM 390 N LEU A 766 -16.435 3.274 5.673 1.00 25.00 N ATOM 391 CA LEU A 766 -15.973 4.643 5.457 1.00 25.00 C ATOM 392 C LEU A 766 -16.852 5.274 4.385 1.00 25.00 C ATOM 393 O LEU A 766 -17.033 4.709 3.341 1.00 25.00 O ATOM 394 CB LEU A 766 -14.491 4.669 5.030 1.00 25.00 C ATOM 395 CG LEU A 766 -13.369 4.661 6.100 1.00 25.00 C ATOM 396 CD1 LEU A 766 -13.465 5.880 6.870 1.00 25.00 C ATOM 397 CD2 LEU A 766 -13.374 3.483 7.041 1.00 25.00 C ATOM 0 H LEU A 766 -16.073 2.589 5.010 1.00 25.00 H new ATOM 0 HA LEU A 766 -16.048 5.208 6.386 1.00 25.00 H new ATOM 0 HB2 LEU A 766 -14.326 3.807 4.383 1.00 25.00 H new ATOM 0 HB3 LEU A 766 -14.347 5.559 4.418 1.00 25.00 H new ATOM 0 HG LEU A 766 -12.432 4.581 5.549 1.00 25.00 H new ATOM 0 HD11 LEU A 766 -12.683 5.893 7.629 1.00 25.00 H new ATOM 0 HD12 LEU A 766 -13.344 6.738 6.209 1.00 25.00 H new ATOM 0 HD13 LEU A 766 -14.441 5.929 7.353 1.00 25.00 H new ATOM 0 HD21 LEU A 766 -12.549 3.578 7.747 1.00 25.00 H new ATOM 0 HD22 LEU A 766 -14.317 3.457 7.587 1.00 25.00 H new ATOM 0 HD23 LEU A 766 -13.259 2.561 6.471 1.00 25.00 H new ATOM 409 N GLY A 767 -17.433 6.429 4.659 1.00 25.00 N ATOM 410 CA GLY A 767 -18.297 7.090 3.696 1.00 25.00 C ATOM 411 C GLY A 767 -17.447 7.794 2.674 1.00 25.00 C ATOM 412 O GLY A 767 -16.268 7.613 2.698 1.00 25.00 O ATOM 0 H GLY A 767 -17.322 6.929 5.541 1.00 25.00 H new ATOM 0 HA2 GLY A 767 -18.944 6.361 3.209 1.00 25.00 H new ATOM 0 HA3 GLY A 767 -18.946 7.805 4.202 1.00 25.00 H new ATOM 416 N PRO A 768 -17.987 8.631 1.797 1.00 25.00 N ATOM 417 CA PRO A 768 -17.153 9.282 0.777 1.00 25.00 C ATOM 418 C PRO A 768 -16.046 10.171 1.361 1.00 25.00 C ATOM 419 O PRO A 768 -14.864 9.939 1.136 1.00 25.00 O ATOM 420 CB PRO A 768 -18.176 10.105 -0.015 1.00 25.00 C ATOM 421 CG PRO A 768 -19.306 10.317 0.959 1.00 25.00 C ATOM 422 CD PRO A 768 -19.393 9.036 1.705 1.00 25.00 C ATOM 0 HA PRO A 768 -16.601 8.559 0.177 1.00 25.00 H new ATOM 0 HB2 PRO A 768 -17.753 11.053 -0.349 1.00 25.00 H new ATOM 0 HB3 PRO A 768 -18.511 9.574 -0.906 1.00 25.00 H new ATOM 0 HG2 PRO A 768 -19.103 11.154 1.628 1.00 25.00 H new ATOM 0 HG3 PRO A 768 -20.239 10.541 0.443 1.00 25.00 H new ATOM 0 HD2 PRO A 768 -19.843 9.168 2.689 1.00 25.00 H new ATOM 0 HD3 PRO A 768 -19.995 8.297 1.176 1.00 25.00 H new ATOM 430 N GLU A 769 -16.439 11.160 2.149 1.00 25.00 N ATOM 431 CA GLU A 769 -15.506 12.107 2.758 1.00 25.00 C ATOM 432 C GLU A 769 -14.640 11.423 3.813 1.00 25.00 C ATOM 433 O GLU A 769 -13.601 11.930 4.213 1.00 25.00 O ATOM 434 CB GLU A 769 -16.304 13.252 3.386 1.00 25.00 C ATOM 435 CG GLU A 769 -15.940 14.628 2.843 1.00 25.00 C ATOM 436 CD GLU A 769 -14.626 15.144 3.403 1.00 25.00 C ATOM 437 OE1 GLU A 769 -14.550 15.365 4.633 1.00 25.00 O ATOM 438 OE2 GLU A 769 -13.664 15.319 2.629 1.00 25.00 O ATOM 0 H GLU A 769 -17.416 11.332 2.387 1.00 25.00 H new ATOM 0 HA GLU A 769 -14.840 12.498 1.988 1.00 25.00 H new ATOM 0 HB2 GLU A 769 -17.367 13.076 3.219 1.00 25.00 H new ATOM 0 HB3 GLU A 769 -16.145 13.244 4.464 1.00 25.00 H new ATOM 0 HG2 GLU A 769 -15.875 14.581 1.756 1.00 25.00 H new ATOM 0 HG3 GLU A 769 -16.736 15.333 3.084 1.00 25.00 H new ATOM 445 N GLU A 770 -15.068 10.254 4.255 1.00 25.00 N ATOM 446 CA GLU A 770 -14.263 9.481 5.203 1.00 25.00 C ATOM 447 C GLU A 770 -13.255 8.576 4.458 1.00 25.00 C ATOM 448 O GLU A 770 -12.095 8.482 4.836 1.00 25.00 O ATOM 449 CB GLU A 770 -15.128 8.603 6.103 1.00 25.00 C ATOM 450 CG GLU A 770 -16.438 9.125 6.625 1.00 25.00 C ATOM 451 CD GLU A 770 -17.110 8.028 7.475 1.00 25.00 C ATOM 452 OE1 GLU A 770 -16.427 7.417 8.312 1.00 50.00 O ATOM 453 OE2 GLU A 770 -18.215 7.577 7.136 1.00 50.00 O ATOM 0 H GLU A 770 -15.950 9.820 3.983 1.00 25.00 H new ATOM 0 HA GLU A 770 -13.731 10.205 5.820 1.00 25.00 H new ATOM 0 HB2 GLU A 770 -15.340 7.685 5.554 1.00 25.00 H new ATOM 0 HB3 GLU A 770 -14.522 8.326 6.966 1.00 25.00 H new ATOM 0 HG2 GLU A 770 -16.275 10.020 7.225 1.00 25.00 H new ATOM 0 HG3 GLU A 770 -17.087 9.411 5.797 1.00 25.00 H new ATOM 460 N PHE A 771 -13.712 7.904 3.409 1.00 25.00 N ATOM 461 CA PHE A 771 -12.892 6.978 2.612 1.00 25.00 C ATOM 462 C PHE A 771 -11.704 7.687 2.014 1.00 25.00 C ATOM 463 O PHE A 771 -10.592 7.164 2.015 1.00 25.00 O ATOM 464 CB PHE A 771 -13.756 6.377 1.489 1.00 25.00 C ATOM 465 CG PHE A 771 -12.997 5.514 0.497 1.00 25.00 C ATOM 466 CD1 PHE A 771 -12.225 4.422 0.934 1.00 25.00 C ATOM 467 CD2 PHE A 771 -13.103 5.760 -0.893 1.00 25.00 C ATOM 468 CE1 PHE A 771 -11.573 3.562 0.002 1.00 25.00 C ATOM 469 CE2 PHE A 771 -12.452 4.914 -1.841 1.00 25.00 C ATOM 470 CZ PHE A 771 -11.694 3.807 -1.385 1.00 25.00 C ATOM 0 H PHE A 771 -14.673 7.982 3.077 1.00 25.00 H new ATOM 0 HA PHE A 771 -12.523 6.187 3.265 1.00 25.00 H new ATOM 0 HB2 PHE A 771 -14.548 5.778 1.939 1.00 25.00 H new ATOM 0 HB3 PHE A 771 -14.240 7.190 0.947 1.00 25.00 H new ATOM 0 HD1 PHE A 771 -12.125 4.232 1.992 1.00 25.00 H new ATOM 0 HD2 PHE A 771 -13.685 6.600 -1.242 1.00 25.00 H new ATOM 0 HE1 PHE A 771 -10.988 2.725 0.355 1.00 25.00 H new ATOM 0 HE2 PHE A 771 -12.537 5.116 -2.898 1.00 25.00 H new ATOM 0 HZ PHE A 771 -11.210 3.152 -2.095 1.00 25.00 H new ATOM 480 N LYS A 772 -11.921 8.913 1.566 1.00 25.00 N ATOM 481 CA LYS A 772 -10.856 9.706 0.989 1.00 25.00 C ATOM 482 C LYS A 772 -9.802 10.042 2.040 1.00 25.00 C ATOM 483 O LYS A 772 -8.688 10.367 1.688 1.00 25.00 O ATOM 484 CB LYS A 772 -11.431 10.957 0.308 1.00 25.00 C ATOM 485 CG LYS A 772 -12.200 11.903 1.222 1.00 25.00 C ATOM 486 CD LYS A 772 -11.341 13.010 1.789 1.00 25.00 C ATOM 487 CE LYS A 772 -10.857 13.988 0.701 1.00 25.00 C ATOM 488 NZ LYS A 772 -11.422 15.385 0.829 1.00 25.00 N ATOM 0 H LYS A 772 -12.828 9.378 1.592 1.00 25.00 H new ATOM 0 HA LYS A 772 -10.354 9.123 0.217 1.00 25.00 H new ATOM 0 HB2 LYS A 772 -10.611 11.509 -0.151 1.00 25.00 H new ATOM 0 HB3 LYS A 772 -12.093 10.640 -0.498 1.00 25.00 H new ATOM 0 HG2 LYS A 772 -13.028 12.343 0.666 1.00 25.00 H new ATOM 0 HG3 LYS A 772 -12.635 11.332 2.043 1.00 25.00 H new ATOM 0 HD2 LYS A 772 -11.908 13.558 2.541 1.00 25.00 H new ATOM 0 HD3 LYS A 772 -10.478 12.575 2.294 1.00 25.00 H new ATOM 0 HE2 LYS A 772 -9.769 14.043 0.736 1.00 25.00 H new ATOM 0 HE3 LYS A 772 -11.125 13.588 -0.277 1.00 25.00 H new ATOM 0 HZ1 LYS A 772 -11.733 15.720 -0.105 1.00 25.00 H new ATOM 0 HZ2 LYS A 772 -12.232 15.373 1.481 1.00 25.00 H new ATOM 0 HZ3 LYS A 772 -10.689 16.023 1.199 1.00 25.00 H new ATOM 502 N ALA A 773 -10.160 10.004 3.322 1.00 25.00 N ATOM 503 CA ALA A 773 -9.200 10.313 4.379 1.00 25.00 C ATOM 504 C ALA A 773 -8.417 9.042 4.731 1.00 25.00 C ATOM 505 O ALA A 773 -7.231 9.091 5.019 1.00 25.00 O ATOM 506 CB ALA A 773 -9.925 10.867 5.618 1.00 25.00 C ATOM 0 H ALA A 773 -11.096 9.765 3.651 1.00 25.00 H new ATOM 0 HA ALA A 773 -8.506 11.077 4.029 1.00 25.00 H new ATOM 0 HB1 ALA A 773 -9.196 11.092 6.396 1.00 25.00 H new ATOM 0 HB2 ALA A 773 -10.461 11.777 5.349 1.00 25.00 H new ATOM 0 HB3 ALA A 773 -10.632 10.125 5.988 1.00 25.00 H new ATOM 512 N CYS A 774 -9.098 7.905 4.685 1.00 25.00 N ATOM 513 CA CYS A 774 -8.471 6.614 4.969 1.00 25.00 C ATOM 514 C CYS A 774 -7.380 6.333 3.958 1.00 25.00 C ATOM 515 O CYS A 774 -6.276 5.919 4.294 1.00 25.00 O ATOM 516 CB CYS A 774 -9.529 5.506 4.898 1.00 25.00 C ATOM 517 SG CYS A 774 -8.925 3.889 5.436 1.00 25.00 S ATOM 0 H CYS A 774 -10.090 7.847 4.453 1.00 25.00 H new ATOM 0 HA CYS A 774 -8.034 6.642 5.967 1.00 25.00 H new ATOM 0 HB2 CYS A 774 -10.381 5.790 5.516 1.00 25.00 H new ATOM 0 HB3 CYS A 774 -9.891 5.426 3.873 1.00 25.00 H new ATOM 0 HG CYS A 774 -9.884 3.016 5.345 1.00 25.00 H new ATOM 523 N LEU A 775 -7.714 6.591 2.710 1.00 25.00 N ATOM 524 CA LEU A 775 -6.819 6.368 1.582 1.00 25.00 C ATOM 525 C LEU A 775 -5.512 7.182 1.591 1.00 25.00 C ATOM 526 O LEU A 775 -4.554 6.823 0.919 1.00 25.00 O ATOM 527 CB LEU A 775 -7.587 6.687 0.312 1.00 25.00 C ATOM 528 CG LEU A 775 -8.510 5.611 -0.273 1.00 25.00 C ATOM 529 CD1 LEU A 775 -9.199 6.236 -1.489 1.00 25.00 C ATOM 530 CD2 LEU A 775 -7.737 4.371 -0.702 1.00 25.00 C ATOM 0 H LEU A 775 -8.624 6.966 2.443 1.00 25.00 H new ATOM 0 HA LEU A 775 -6.502 5.327 1.648 1.00 25.00 H new ATOM 0 HB2 LEU A 775 -8.191 7.574 0.503 1.00 25.00 H new ATOM 0 HB3 LEU A 775 -6.861 6.955 -0.456 1.00 25.00 H new ATOM 0 HG LEU A 775 -9.227 5.290 0.482 1.00 25.00 H new ATOM 0 HD11 LEU A 775 -9.870 5.506 -1.942 1.00 25.00 H new ATOM 0 HD12 LEU A 775 -9.772 7.108 -1.174 1.00 25.00 H new ATOM 0 HD13 LEU A 775 -8.447 6.539 -2.217 1.00 25.00 H new ATOM 0 HD21 LEU A 775 -8.429 3.634 -1.110 1.00 25.00 H new ATOM 0 HD22 LEU A 775 -7.006 4.643 -1.463 1.00 25.00 H new ATOM 0 HD23 LEU A 775 -7.222 3.947 0.160 1.00 25.00 H new ATOM 542 N ILE A 776 -5.464 8.257 2.362 1.00 25.00 N ATOM 543 CA ILE A 776 -4.263 9.093 2.474 1.00 25.00 C ATOM 544 C ILE A 776 -3.129 8.254 3.054 1.00 25.00 C ATOM 545 O ILE A 776 -1.977 8.374 2.650 1.00 25.00 O ATOM 546 CB ILE A 776 -4.515 10.318 3.412 1.00 25.00 C ATOM 547 CG1 ILE A 776 -5.706 11.130 2.885 1.00 25.00 C ATOM 548 CG2 ILE A 776 -3.266 11.221 3.498 1.00 25.00 C ATOM 549 CD1 ILE A 776 -6.115 12.326 3.746 1.00 25.00 C ATOM 0 H ILE A 776 -6.249 8.580 2.928 1.00 25.00 H new ATOM 0 HA ILE A 776 -4.004 9.462 1.482 1.00 25.00 H new ATOM 0 HB ILE A 776 -4.734 9.945 4.413 1.00 25.00 H new ATOM 0 HG12 ILE A 776 -5.465 11.489 1.884 1.00 25.00 H new ATOM 0 HG13 ILE A 776 -6.563 10.464 2.787 1.00 25.00 H new ATOM 0 HG21 ILE A 776 -3.471 12.064 4.157 1.00 25.00 H new ATOM 0 HG22 ILE A 776 -2.428 10.647 3.894 1.00 25.00 H new ATOM 0 HG23 ILE A 776 -3.015 11.590 2.504 1.00 25.00 H new ATOM 0 HD11 ILE A 776 -6.964 12.832 3.287 1.00 25.00 H new ATOM 0 HD12 ILE A 776 -6.394 11.980 4.741 1.00 25.00 H new ATOM 0 HD13 ILE A 776 -5.279 13.021 3.825 1.00 25.00 H new ATOM 561 N SER A 777 -3.480 7.374 3.980 1.00 25.00 N ATOM 562 CA SER A 777 -2.504 6.515 4.648 1.00 25.00 C ATOM 563 C SER A 777 -1.996 5.401 3.736 1.00 25.00 C ATOM 564 O SER A 777 -1.079 4.675 4.104 1.00 25.00 O ATOM 565 CB SER A 777 -3.141 5.892 5.894 1.00 25.00 C ATOM 566 OG SER A 777 -2.193 5.154 6.646 1.00 25.00 O ATOM 0 H SER A 777 -4.441 7.233 4.290 1.00 25.00 H new ATOM 0 HA SER A 777 -1.652 7.138 4.921 1.00 25.00 H new ATOM 0 HB2 SER A 777 -3.570 6.677 6.517 1.00 25.00 H new ATOM 0 HB3 SER A 777 -3.961 5.238 5.597 1.00 25.00 H new ATOM 0 HG SER A 777 -1.585 4.685 6.037 1.00 25.00 H new ATOM 572 N LEU A 778 -2.620 5.247 2.574 1.00 25.00 N ATOM 573 CA LEU A 778 -2.254 4.195 1.628 1.00 25.00 C ATOM 574 C LEU A 778 -1.568 4.774 0.394 1.00 25.00 C ATOM 575 O LEU A 778 -1.012 4.041 -0.398 1.00 25.00 O ATOM 576 CB LEU A 778 -3.496 3.386 1.197 1.00 25.00 C ATOM 577 CG LEU A 778 -4.077 2.334 2.164 1.00 25.00 C ATOM 578 CD1 LEU A 778 -3.016 1.319 2.595 1.00 25.00 C ATOM 579 CD2 LEU A 778 -4.721 2.991 3.404 1.00 25.00 C ATOM 0 H LEU A 778 -3.388 5.841 2.261 1.00 25.00 H new ATOM 0 HA LEU A 778 -1.555 3.531 2.137 1.00 25.00 H new ATOM 0 HB2 LEU A 778 -4.290 4.098 0.970 1.00 25.00 H new ATOM 0 HB3 LEU A 778 -3.249 2.876 0.266 1.00 25.00 H new ATOM 0 HG LEU A 778 -4.857 1.804 1.617 1.00 25.00 H new ATOM 0 HD11 LEU A 778 -3.462 0.594 3.276 1.00 25.00 H new ATOM 0 HD12 LEU A 778 -2.629 0.802 1.717 1.00 25.00 H new ATOM 0 HD13 LEU A 778 -2.201 1.837 3.100 1.00 25.00 H new ATOM 0 HD21 LEU A 778 -5.119 2.217 4.061 1.00 25.00 H new ATOM 0 HD22 LEU A 778 -3.970 3.571 3.940 1.00 25.00 H new ATOM 0 HD23 LEU A 778 -5.530 3.649 3.088 1.00 25.00 H new ATOM 591 N GLY A 779 -1.583 6.090 0.232 1.00 25.00 N ATOM 592 CA GLY A 779 -0.904 6.663 -0.918 1.00 25.00 C ATOM 593 C GLY A 779 -1.754 6.584 -2.173 1.00 25.00 C ATOM 594 O GLY A 779 -1.353 6.053 -3.206 1.00 25.00 O ATOM 0 H GLY A 779 -2.038 6.757 0.855 1.00 25.00 H new ATOM 0 HA2 GLY A 779 -0.656 7.704 -0.712 1.00 25.00 H new ATOM 0 HA3 GLY A 779 0.037 6.138 -1.083 1.00 25.00 H new ATOM 598 N TYR A 780 -2.958 7.118 -2.062 1.00 25.00 N ATOM 599 CA TYR A 780 -3.920 7.128 -3.163 1.00 25.00 C ATOM 600 C TYR A 780 -3.544 7.941 -4.412 1.00 25.00 C ATOM 601 O TYR A 780 -2.718 8.843 -4.368 1.00 25.00 O ATOM 602 CB TYR A 780 -5.292 7.567 -2.650 1.00 25.00 C ATOM 603 CG TYR A 780 -5.384 8.942 -1.994 1.00 25.00 C ATOM 604 CD1 TYR A 780 -4.254 9.765 -1.809 1.00 25.00 C ATOM 605 CD2 TYR A 780 -6.629 9.421 -1.546 1.00 25.00 C ATOM 606 CE1 TYR A 780 -4.368 11.031 -1.200 1.00 25.00 C ATOM 607 CE2 TYR A 780 -6.748 10.685 -0.949 1.00 25.00 C ATOM 608 CZ TYR A 780 -5.617 11.487 -0.785 1.00 25.00 C ATOM 609 OH TYR A 780 -5.745 12.728 -0.213 1.00 25.00 O ATOM 0 H TYR A 780 -3.301 7.558 -1.208 1.00 25.00 H new ATOM 0 HA TYR A 780 -3.927 6.096 -3.515 1.00 25.00 H new ATOM 0 HB2 TYR A 780 -5.989 7.545 -3.488 1.00 25.00 H new ATOM 0 HB3 TYR A 780 -5.637 6.825 -1.929 1.00 25.00 H new ATOM 0 HD1 TYR A 780 -3.285 9.420 -2.139 1.00 25.00 H new ATOM 0 HD2 TYR A 780 -7.508 8.805 -1.664 1.00 25.00 H new ATOM 0 HE1 TYR A 780 -3.491 11.645 -1.056 1.00 25.00 H new ATOM 0 HE2 TYR A 780 -7.713 11.037 -0.617 1.00 25.00 H new ATOM 0 HH TYR A 780 -6.684 12.887 0.016 1.00 25.00 H new ATOM 619 N ASP A 781 -4.191 7.605 -5.524 1.00 25.00 N ATOM 620 CA ASP A 781 -3.905 8.192 -6.842 1.00 25.00 C ATOM 621 C ASP A 781 -4.840 9.352 -7.144 1.00 25.00 C ATOM 622 O ASP A 781 -5.035 9.749 -8.293 1.00 25.00 O ATOM 623 CB ASP A 781 -3.989 7.115 -7.947 1.00 25.00 C ATOM 624 CG ASP A 781 -5.410 6.564 -8.163 1.00 25.00 C ATOM 625 OD1 ASP A 781 -6.213 6.512 -7.204 1.00 25.00 O ATOM 626 OD2 ASP A 781 -5.673 6.043 -9.275 1.00 25.00 O ATOM 0 H ASP A 781 -4.938 6.911 -5.542 1.00 25.00 H new ATOM 0 HA ASP A 781 -2.888 8.584 -6.821 1.00 25.00 H new ATOM 0 HB2 ASP A 781 -3.626 7.538 -8.884 1.00 25.00 H new ATOM 0 HB3 ASP A 781 -3.324 6.291 -7.691 1.00 25.00 H new ATOM 631 N ILE A 782 -5.401 9.902 -6.081 1.00 25.00 N ATOM 632 CA ILE A 782 -6.279 11.052 -6.151 1.00 25.00 C ATOM 633 C ILE A 782 -5.891 12.048 -5.074 1.00 25.00 C ATOM 634 O ILE A 782 -5.181 11.719 -4.139 1.00 25.00 O ATOM 635 CB ILE A 782 -7.754 10.658 -5.970 1.00 25.00 C ATOM 636 CG1 ILE A 782 -7.933 9.785 -4.706 1.00 25.00 C ATOM 637 CG2 ILE A 782 -8.244 10.025 -7.264 1.00 25.00 C ATOM 638 CD1 ILE A 782 -8.226 8.312 -4.950 1.00 25.00 C ATOM 0 H ILE A 782 -5.256 9.556 -5.133 1.00 25.00 H new ATOM 0 HA ILE A 782 -6.169 11.497 -7.140 1.00 25.00 H new ATOM 0 HB ILE A 782 -8.382 11.530 -5.788 1.00 25.00 H new ATOM 0 HG12 ILE A 782 -7.027 9.860 -4.105 1.00 25.00 H new ATOM 0 HG13 ILE A 782 -8.745 10.203 -4.112 1.00 25.00 H new ATOM 0 HG21 ILE A 782 -9.290 9.738 -7.155 1.00 25.00 H new ATOM 0 HG22 ILE A 782 -8.147 10.742 -8.079 1.00 25.00 H new ATOM 0 HG23 ILE A 782 -7.646 9.141 -7.486 1.00 25.00 H new ATOM 0 HD11 ILE A 782 -8.332 7.799 -3.994 1.00 25.00 H new ATOM 0 HD12 ILE A 782 -9.151 8.214 -5.519 1.00 25.00 H new ATOM 0 HD13 ILE A 782 -7.405 7.866 -5.512 1.00 25.00 H new ATOM 650 N GLY A 783 -6.396 13.258 -5.204 1.00 25.00 N ATOM 651 CA GLY A 783 -6.153 14.295 -4.227 1.00 25.00 C ATOM 652 C GLY A 783 -7.359 15.194 -4.277 1.00 25.00 C ATOM 653 O GLY A 783 -8.330 14.857 -4.950 1.00 25.00 O ATOM 0 H GLY A 783 -6.983 13.547 -5.986 1.00 25.00 H new ATOM 0 HA2 GLY A 783 -6.022 13.871 -3.231 1.00 25.00 H new ATOM 0 HA3 GLY A 783 -5.243 14.848 -4.461 1.00 25.00 H new ATOM 657 N ASN A 784 -7.305 16.339 -3.612 1.00 25.00 N ATOM 658 CA ASN A 784 -8.439 17.270 -3.603 1.00 25.00 C ATOM 659 C ASN A 784 -8.450 18.129 -4.877 1.00 25.00 C ATOM 660 O ASN A 784 -9.217 19.086 -5.002 1.00 25.00 O ATOM 661 CB ASN A 784 -8.399 18.148 -2.349 1.00 25.00 C ATOM 662 CG ASN A 784 -9.768 18.324 -1.728 1.00 25.00 C ATOM 663 OD1 ASN A 784 -9.996 17.934 -0.585 1.00 25.00 O ATOM 664 ND2 ASN A 784 -10.679 18.892 -2.466 1.00 25.00 N ATOM 0 H ASN A 784 -6.497 16.650 -3.073 1.00 25.00 H new ATOM 0 HA ASN A 784 -9.362 16.690 -3.584 1.00 25.00 H new ATOM 0 HB2 ASN A 784 -7.725 17.702 -1.617 1.00 25.00 H new ATOM 0 HB3 ASN A 784 -7.990 19.125 -2.605 1.00 25.00 H new ATOM 0 HD21 ASN A 784 -11.621 19.027 -2.099 1.00 25.00 H new ATOM 0 HD22 ASN A 784 -10.450 19.202 -3.410 1.00 25.00 H new ATOM 671 N ASP A 785 -7.588 17.765 -5.813 1.00 25.00 N ATOM 672 CA ASP A 785 -7.504 18.400 -7.122 1.00 25.00 C ATOM 673 C ASP A 785 -8.828 18.213 -7.859 1.00 25.00 C ATOM 674 O ASP A 785 -9.533 17.232 -7.628 1.00 25.00 O ATOM 675 CB ASP A 785 -6.379 17.741 -7.921 1.00 25.00 C ATOM 676 CG ASP A 785 -5.029 17.944 -7.280 1.00 25.00 C ATOM 677 OD1 ASP A 785 -4.739 17.248 -6.283 1.00 25.00 O ATOM 678 OD2 ASP A 785 -4.288 18.837 -7.733 1.00 25.00 O ATOM 0 H ASP A 785 -6.916 17.009 -5.684 1.00 25.00 H new ATOM 0 HA ASP A 785 -7.300 19.465 -7.007 1.00 25.00 H new ATOM 0 HB2 ASP A 785 -6.579 16.673 -8.013 1.00 25.00 H new ATOM 0 HB3 ASP A 785 -6.365 18.151 -8.931 1.00 25.00 H new ATOM 683 N PRO A 786 -9.168 19.114 -8.797 1.00 25.00 N ATOM 684 CA PRO A 786 -10.487 18.963 -9.426 1.00 25.00 C ATOM 685 C PRO A 786 -10.618 17.702 -10.272 1.00 25.00 C ATOM 686 O PRO A 786 -11.713 17.175 -10.443 1.00 25.00 O ATOM 687 CB PRO A 786 -10.607 20.232 -10.278 1.00 25.00 C ATOM 688 CG PRO A 786 -9.197 20.597 -10.597 1.00 25.00 C ATOM 689 CD PRO A 786 -8.444 20.283 -9.328 1.00 25.00 C ATOM 0 HA PRO A 786 -11.281 18.851 -8.687 1.00 25.00 H new ATOM 0 HB2 PRO A 786 -11.185 20.050 -11.184 1.00 25.00 H new ATOM 0 HB3 PRO A 786 -11.111 21.030 -9.733 1.00 25.00 H new ATOM 0 HG2 PRO A 786 -8.816 20.021 -11.440 1.00 25.00 H new ATOM 0 HG3 PRO A 786 -9.108 21.650 -10.864 1.00 25.00 H new ATOM 0 HD2 PRO A 786 -7.397 20.054 -9.526 1.00 25.00 H new ATOM 0 HD3 PRO A 786 -8.461 21.120 -8.630 1.00 25.00 H new ATOM 697 N GLN A 787 -9.502 17.191 -10.768 1.00 25.00 N ATOM 698 CA GLN A 787 -9.529 15.948 -11.521 1.00 25.00 C ATOM 699 C GLN A 787 -9.602 14.767 -10.559 1.00 25.00 C ATOM 700 O GLN A 787 -10.365 13.837 -10.773 1.00 25.00 O ATOM 701 CB GLN A 787 -8.282 15.817 -12.403 1.00 25.00 C ATOM 702 CG GLN A 787 -8.131 16.904 -13.429 1.00 25.00 C ATOM 703 CD GLN A 787 -9.251 16.903 -14.354 1.00 25.00 C ATOM 704 OE1 GLN A 787 -10.039 17.818 -14.502 1.00 25.00 O ATOM 705 NE2 GLN A 787 -9.295 15.833 -15.020 1.00 25.00 N ATOM 0 H GLN A 787 -8.578 17.611 -10.665 1.00 25.00 H new ATOM 0 HA GLN A 787 -10.409 15.953 -12.164 1.00 25.00 H new ATOM 0 HB2 GLN A 787 -7.399 15.812 -11.764 1.00 25.00 H new ATOM 0 HB3 GLN A 787 -8.312 14.854 -12.913 1.00 25.00 H new ATOM 0 HG2 GLN A 787 -8.065 17.872 -12.932 1.00 25.00 H new ATOM 0 HG3 GLN A 787 -7.200 16.764 -13.979 1.00 25.00 H new ATOM 0 HE21 GLN A 787 -8.607 15.099 -14.852 1.00 25.00 H new ATOM 0 HE22 GLN A 787 -10.019 15.701 -15.726 1.00 25.00 H new ATOM 714 N GLY A 788 -8.812 14.804 -9.495 1.00 25.00 N ATOM 715 CA GLY A 788 -8.772 13.688 -8.574 1.00 25.00 C ATOM 716 C GLY A 788 -10.029 13.525 -7.756 1.00 25.00 C ATOM 717 O GLY A 788 -10.404 12.416 -7.450 1.00 25.00 O ATOM 0 H GLY A 788 -8.201 15.584 -9.254 1.00 25.00 H new ATOM 0 HA2 GLY A 788 -8.595 12.771 -9.137 1.00 25.00 H new ATOM 0 HA3 GLY A 788 -7.925 13.816 -7.900 1.00 25.00 H new ATOM 721 N GLU A 789 -10.726 14.606 -7.460 1.00 25.00 N ATOM 722 CA GLU A 789 -11.994 14.508 -6.729 1.00 25.00 C ATOM 723 C GLU A 789 -13.028 13.756 -7.577 1.00 25.00 C ATOM 724 O GLU A 789 -13.909 13.077 -7.047 1.00 25.00 O ATOM 725 CB GLU A 789 -12.530 15.906 -6.390 1.00 25.00 C ATOM 726 CG GLU A 789 -11.771 16.615 -5.263 1.00 25.00 C ATOM 727 CD GLU A 789 -12.355 16.342 -3.874 1.00 25.00 C ATOM 728 OE1 GLU A 789 -13.447 16.877 -3.576 1.00 25.00 O ATOM 729 OE2 GLU A 789 -11.701 15.647 -3.057 1.00 25.00 O ATOM 0 H GLU A 789 -10.448 15.556 -7.707 1.00 25.00 H new ATOM 0 HA GLU A 789 -11.817 13.964 -5.801 1.00 25.00 H new ATOM 0 HB2 GLU A 789 -12.489 16.525 -7.286 1.00 25.00 H new ATOM 0 HB3 GLU A 789 -13.580 15.822 -6.109 1.00 25.00 H new ATOM 0 HG2 GLU A 789 -10.729 16.297 -5.280 1.00 25.00 H new ATOM 0 HG3 GLU A 789 -11.779 17.689 -5.448 1.00 25.00 H new ATOM 736 N ALA A 790 -12.903 13.844 -8.897 1.00 25.00 N ATOM 737 CA ALA A 790 -13.845 13.176 -9.785 1.00 25.00 C ATOM 738 C ALA A 790 -13.512 11.688 -9.821 1.00 25.00 C ATOM 739 O ALA A 790 -14.395 10.836 -9.843 1.00 25.00 O ATOM 740 CB ALA A 790 -13.768 13.784 -11.193 1.00 25.00 C ATOM 0 H ALA A 790 -12.166 14.366 -9.371 1.00 25.00 H new ATOM 0 HA ALA A 790 -14.862 13.311 -9.417 1.00 25.00 H new ATOM 0 HB1 ALA A 790 -14.477 13.277 -11.848 1.00 25.00 H new ATOM 0 HB2 ALA A 790 -14.014 14.845 -11.145 1.00 25.00 H new ATOM 0 HB3 ALA A 790 -12.759 13.663 -11.587 1.00 25.00 H new ATOM 746 N GLU A 791 -12.226 11.386 -9.816 1.00 25.00 N ATOM 747 CA GLU A 791 -11.766 10.003 -9.871 1.00 25.00 C ATOM 748 C GLU A 791 -11.965 9.316 -8.536 1.00 25.00 C ATOM 749 O GLU A 791 -12.283 8.136 -8.473 1.00 25.00 O ATOM 750 CB GLU A 791 -10.297 9.959 -10.267 1.00 25.00 C ATOM 751 CG GLU A 791 -10.006 10.600 -11.605 1.00 25.00 C ATOM 752 CD GLU A 791 -10.435 9.723 -12.797 1.00 25.00 C ATOM 753 OE1 GLU A 791 -11.569 9.180 -12.808 1.00 25.00 O ATOM 754 OE2 GLU A 791 -9.584 9.470 -13.671 1.00 25.00 O ATOM 0 H GLU A 791 -11.478 12.078 -9.774 1.00 25.00 H new ATOM 0 HA GLU A 791 -12.355 9.474 -10.620 1.00 25.00 H new ATOM 0 HB2 GLU A 791 -9.708 10.460 -9.499 1.00 25.00 H new ATOM 0 HB3 GLU A 791 -9.968 8.920 -10.293 1.00 25.00 H new ATOM 0 HG2 GLU A 791 -10.521 11.559 -11.662 1.00 25.00 H new ATOM 0 HG3 GLU A 791 -8.938 10.807 -11.678 1.00 25.00 H new ATOM 761 N PHE A 792 -11.855 10.080 -7.464 1.00 25.00 N ATOM 762 CA PHE A 792 -12.151 9.573 -6.133 1.00 25.00 C ATOM 763 C PHE A 792 -13.607 9.133 -6.132 1.00 25.00 C ATOM 764 O PHE A 792 -13.926 8.041 -5.677 1.00 25.00 O ATOM 765 CB PHE A 792 -11.911 10.650 -5.067 1.00 25.00 C ATOM 766 CG PHE A 792 -12.939 10.653 -3.973 1.00 25.00 C ATOM 767 CD1 PHE A 792 -13.007 9.596 -3.043 1.00 25.00 C ATOM 768 CD2 PHE A 792 -13.868 11.708 -3.880 1.00 25.00 C ATOM 769 CE1 PHE A 792 -14.004 9.588 -2.041 1.00 25.00 C ATOM 770 CE2 PHE A 792 -14.860 11.707 -2.882 1.00 25.00 C ATOM 771 CZ PHE A 792 -14.931 10.646 -1.969 1.00 25.00 C ATOM 0 H PHE A 792 -11.562 11.057 -7.488 1.00 25.00 H new ATOM 0 HA PHE A 792 -11.495 8.737 -5.892 1.00 25.00 H new ATOM 0 HB2 PHE A 792 -10.925 10.500 -4.627 1.00 25.00 H new ATOM 0 HB3 PHE A 792 -11.901 11.629 -5.547 1.00 25.00 H new ATOM 0 HD1 PHE A 792 -12.293 8.787 -3.096 1.00 25.00 H new ATOM 0 HD2 PHE A 792 -13.818 12.527 -4.583 1.00 25.00 H new ATOM 0 HE1 PHE A 792 -14.055 8.774 -1.333 1.00 25.00 H new ATOM 0 HE2 PHE A 792 -15.565 12.522 -2.820 1.00 25.00 H new ATOM 0 HZ PHE A 792 -15.698 10.640 -1.209 1.00 25.00 H new ATOM 781 N ALA A 793 -14.485 9.950 -6.700 1.00 25.00 N ATOM 782 CA ALA A 793 -15.899 9.603 -6.760 1.00 25.00 C ATOM 783 C ALA A 793 -16.159 8.429 -7.715 1.00 25.00 C ATOM 784 O ALA A 793 -17.031 7.596 -7.465 1.00 25.00 O ATOM 785 CB ALA A 793 -16.720 10.829 -7.168 1.00 25.00 C ATOM 0 H ALA A 793 -14.247 10.848 -7.121 1.00 25.00 H new ATOM 0 HA ALA A 793 -16.210 9.281 -5.766 1.00 25.00 H new ATOM 0 HB1 ALA A 793 -17.776 10.562 -7.211 1.00 25.00 H new ATOM 0 HB2 ALA A 793 -16.576 11.623 -6.436 1.00 25.00 H new ATOM 0 HB3 ALA A 793 -16.393 11.176 -8.148 1.00 25.00 H new ATOM 791 N ARG A 794 -15.366 8.334 -8.773 1.00 25.00 N ATOM 792 CA ARG A 794 -15.437 7.201 -9.703 1.00 25.00 C ATOM 793 C ARG A 794 -15.140 5.913 -8.942 1.00 25.00 C ATOM 794 O ARG A 794 -15.814 4.909 -9.137 1.00 25.00 O ATOM 795 CB ARG A 794 -14.447 7.412 -10.857 1.00 25.00 C ATOM 796 CG ARG A 794 -14.387 6.276 -11.858 1.00 25.00 C ATOM 797 CD ARG A 794 -13.064 5.535 -11.752 1.00 25.00 C ATOM 798 NE ARG A 794 -11.915 6.327 -12.239 1.00 25.00 N ATOM 799 CZ ARG A 794 -10.650 5.917 -12.248 1.00 25.00 C ATOM 800 NH1 ARG A 794 -10.295 4.737 -11.800 1.00 25.00 N ATOM 801 NH2 ARG A 794 -9.723 6.701 -12.713 1.00 25.00 N ATOM 0 H ARG A 794 -14.660 9.029 -9.015 1.00 25.00 H new ATOM 0 HA ARG A 794 -16.436 7.128 -10.132 1.00 25.00 H new ATOM 0 HB2 ARG A 794 -14.714 8.328 -11.384 1.00 25.00 H new ATOM 0 HB3 ARG A 794 -13.451 7.563 -10.440 1.00 25.00 H new ATOM 0 HG2 ARG A 794 -15.211 5.585 -11.681 1.00 25.00 H new ATOM 0 HG3 ARG A 794 -14.510 6.668 -12.868 1.00 25.00 H new ATOM 0 HD2 ARG A 794 -12.892 5.258 -10.712 1.00 25.00 H new ATOM 0 HD3 ARG A 794 -13.127 4.608 -12.322 1.00 25.00 H new ATOM 0 HE ARG A 794 -12.108 7.263 -12.597 1.00 25.00 H new ATOM 0 HH11 ARG A 794 -10.999 4.099 -11.429 1.00 25.00 H new ATOM 0 HH12 ARG A 794 -9.315 4.457 -11.823 1.00 25.00 H new ATOM 0 HH21 ARG A 794 -9.968 7.625 -13.068 1.00 25.00 H new ATOM 0 HH22 ARG A 794 -8.751 6.392 -12.722 1.00 25.00 H new ATOM 815 N ILE A 795 -14.171 5.949 -8.042 1.00 25.00 N ATOM 816 CA ILE A 795 -13.849 4.778 -7.239 1.00 25.00 C ATOM 817 C ILE A 795 -14.931 4.574 -6.201 1.00 25.00 C ATOM 818 O ILE A 795 -15.361 3.466 -5.990 1.00 25.00 O ATOM 819 CB ILE A 795 -12.505 4.892 -6.486 1.00 25.00 C ATOM 820 CG1 ILE A 795 -11.349 5.121 -7.461 1.00 25.00 C ATOM 821 CG2 ILE A 795 -12.239 3.597 -5.682 1.00 25.00 C ATOM 822 CD1 ILE A 795 -10.285 6.000 -6.882 1.00 25.00 C ATOM 0 H ILE A 795 -13.597 6.769 -7.849 1.00 25.00 H new ATOM 0 HA ILE A 795 -13.775 3.944 -7.937 1.00 25.00 H new ATOM 0 HB ILE A 795 -12.570 5.744 -5.809 1.00 25.00 H new ATOM 0 HG12 ILE A 795 -10.914 4.161 -7.737 1.00 25.00 H new ATOM 0 HG13 ILE A 795 -11.732 5.572 -8.376 1.00 25.00 H new ATOM 0 HG21 ILE A 795 -11.290 3.685 -5.154 1.00 25.00 H new ATOM 0 HG22 ILE A 795 -13.042 3.445 -4.961 1.00 25.00 H new ATOM 0 HG23 ILE A 795 -12.197 2.748 -6.364 1.00 25.00 H new ATOM 0 HD11 ILE A 795 -9.486 6.133 -7.612 1.00 25.00 H new ATOM 0 HD12 ILE A 795 -10.712 6.971 -6.630 1.00 25.00 H new ATOM 0 HD13 ILE A 795 -9.881 5.537 -5.982 1.00 25.00 H new ATOM 834 N MET A 796 -15.392 5.647 -5.572 1.00 25.00 N ATOM 835 CA MET A 796 -16.423 5.564 -4.528 1.00 25.00 C ATOM 836 C MET A 796 -17.674 4.843 -5.042 1.00 25.00 C ATOM 837 O MET A 796 -18.386 4.196 -4.287 1.00 25.00 O ATOM 838 CB MET A 796 -16.768 6.970 -4.022 1.00 25.00 C ATOM 839 CG MET A 796 -17.111 7.030 -2.539 1.00 25.00 C ATOM 840 SD MET A 796 -18.882 6.928 -2.230 1.00 25.00 S ATOM 841 CE MET A 796 -18.967 5.529 -1.119 1.00 25.00 C ATOM 0 H MET A 796 -15.069 6.595 -5.764 1.00 25.00 H new ATOM 0 HA MET A 796 -16.028 4.980 -3.697 1.00 25.00 H new ATOM 0 HB2 MET A 796 -15.924 7.632 -4.216 1.00 25.00 H new ATOM 0 HB3 MET A 796 -17.612 7.354 -4.595 1.00 25.00 H new ATOM 0 HG2 MET A 796 -16.608 6.213 -2.021 1.00 25.00 H new ATOM 0 HG3 MET A 796 -16.726 7.959 -2.119 1.00 25.00 H new ATOM 0 HE1 MET A 796 -19.979 5.125 -1.120 1.00 25.00 H new ATOM 0 HE2 MET A 796 -18.269 4.760 -1.449 1.00 25.00 H new ATOM 0 HE3 MET A 796 -18.705 5.849 -0.110 1.00 25.00 H new ATOM 851 N SER A 797 -17.878 4.902 -6.348 1.00 25.00 N ATOM 852 CA SER A 797 -18.990 4.224 -7.004 1.00 25.00 C ATOM 853 C SER A 797 -18.730 2.721 -7.162 1.00 25.00 C ATOM 854 O SER A 797 -19.662 1.920 -7.118 1.00 25.00 O ATOM 855 CB SER A 797 -19.214 4.851 -8.384 1.00 25.00 C ATOM 856 OG SER A 797 -20.374 4.336 -9.013 1.00 25.00 O ATOM 0 H SER A 797 -17.277 5.422 -6.987 1.00 25.00 H new ATOM 0 HA SER A 797 -19.876 4.343 -6.380 1.00 25.00 H new ATOM 0 HB2 SER A 797 -19.306 5.932 -8.282 1.00 25.00 H new ATOM 0 HB3 SER A 797 -18.345 4.663 -9.014 1.00 25.00 H new ATOM 0 HG SER A 797 -20.486 4.759 -9.890 1.00 25.00 H new ATOM 862 N ILE A 798 -17.472 2.326 -7.338 1.00 25.00 N ATOM 863 CA ILE A 798 -17.149 0.904 -7.523 1.00 25.00 C ATOM 864 C ILE A 798 -16.888 0.207 -6.189 1.00 25.00 C ATOM 865 O ILE A 798 -17.108 -0.994 -6.059 1.00 25.00 O ATOM 866 CB ILE A 798 -16.005 0.667 -8.567 1.00 25.00 C ATOM 867 CG1 ILE A 798 -14.626 1.049 -8.004 1.00 25.00 C ATOM 868 CG2 ILE A 798 -16.328 1.467 -9.861 1.00 25.00 C ATOM 869 CD1 ILE A 798 -13.449 0.776 -8.941 1.00 25.00 C ATOM 0 H ILE A 798 -16.668 2.954 -7.357 1.00 25.00 H new ATOM 0 HA ILE A 798 -18.034 0.437 -7.955 1.00 25.00 H new ATOM 0 HB ILE A 798 -15.957 -0.397 -8.800 1.00 25.00 H new ATOM 0 HG12 ILE A 798 -14.633 2.110 -7.753 1.00 25.00 H new ATOM 0 HG13 ILE A 798 -14.466 0.503 -7.074 1.00 25.00 H new ATOM 0 HG21 ILE A 798 -15.537 1.308 -10.594 1.00 25.00 H new ATOM 0 HG22 ILE A 798 -17.278 1.125 -10.272 1.00 25.00 H new ATOM 0 HG23 ILE A 798 -16.396 2.529 -9.625 1.00 25.00 H new ATOM 0 HD11 ILE A 798 -12.521 1.078 -8.456 1.00 25.00 H new ATOM 0 HD12 ILE A 798 -13.408 -0.288 -9.173 1.00 25.00 H new ATOM 0 HD13 ILE A 798 -13.578 1.344 -9.863 1.00 25.00 H new ATOM 881 N VAL A 799 -16.511 0.976 -5.175 1.00 25.00 N ATOM 882 CA VAL A 799 -16.295 0.435 -3.833 1.00 25.00 C ATOM 883 C VAL A 799 -17.578 0.553 -3.012 1.00 25.00 C ATOM 884 O VAL A 799 -17.581 0.428 -1.787 1.00 25.00 O ATOM 885 CB VAL A 799 -15.079 1.087 -3.117 1.00 25.00 C ATOM 886 CG1 VAL A 799 -13.818 0.863 -3.942 1.00 25.00 C ATOM 887 CG2 VAL A 799 -15.290 2.573 -2.870 1.00 25.00 C ATOM 0 H VAL A 799 -16.347 1.980 -5.254 1.00 25.00 H new ATOM 0 HA VAL A 799 -16.045 -0.621 -3.931 1.00 25.00 H new ATOM 0 HB VAL A 799 -14.971 0.611 -2.143 1.00 25.00 H new ATOM 0 HG11 VAL A 799 -12.967 1.321 -3.438 1.00 25.00 H new ATOM 0 HG12 VAL A 799 -13.641 -0.207 -4.053 1.00 25.00 H new ATOM 0 HG13 VAL A 799 -13.942 1.314 -4.926 1.00 25.00 H new ATOM 0 HG21 VAL A 799 -14.415 2.986 -2.368 1.00 25.00 H new ATOM 0 HG22 VAL A 799 -15.436 3.083 -3.822 1.00 25.00 H new ATOM 0 HG23 VAL A 799 -16.170 2.716 -2.243 1.00 25.00 H new ATOM 897 N ASP A 800 -18.688 0.665 -3.724 1.00 25.00 N ATOM 898 CA ASP A 800 -20.014 0.533 -3.132 1.00 25.00 C ATOM 899 C ASP A 800 -20.787 -0.597 -3.840 1.00 25.00 C ATOM 900 O ASP A 800 -21.855 -0.384 -4.428 1.00 25.00 O ATOM 901 CB ASP A 800 -20.786 1.845 -3.215 1.00 25.00 C ATOM 902 CG ASP A 800 -22.120 1.760 -2.513 1.00 25.00 C ATOM 903 OD1 ASP A 800 -22.306 0.837 -1.683 1.00 25.00 O ATOM 904 OD2 ASP A 800 -23.004 2.589 -2.786 1.00 25.00 O ATOM 0 H ASP A 800 -18.698 0.850 -4.727 1.00 25.00 H new ATOM 0 HA ASP A 800 -19.901 0.283 -2.077 1.00 25.00 H new ATOM 0 HB2 ASP A 800 -20.192 2.644 -2.771 1.00 25.00 H new ATOM 0 HB3 ASP A 800 -20.943 2.108 -4.261 1.00 25.00 H new ATOM 909 N PRO A 801 -20.265 -1.838 -3.782 1.00 25.00 N ATOM 910 CA PRO A 801 -20.981 -2.918 -4.469 1.00 25.00 C ATOM 911 C PRO A 801 -22.306 -3.314 -3.816 1.00 25.00 C ATOM 912 O PRO A 801 -23.023 -4.155 -4.346 1.00 25.00 O ATOM 913 CB PRO A 801 -19.981 -4.079 -4.394 1.00 25.00 C ATOM 914 CG PRO A 801 -19.227 -3.827 -3.144 1.00 25.00 C ATOM 915 CD PRO A 801 -19.032 -2.346 -3.148 1.00 25.00 C ATOM 0 HA PRO A 801 -21.273 -2.620 -5.476 1.00 25.00 H new ATOM 0 HB2 PRO A 801 -20.490 -5.042 -4.365 1.00 25.00 H new ATOM 0 HB3 PRO A 801 -19.321 -4.093 -5.261 1.00 25.00 H new ATOM 0 HG2 PRO A 801 -19.783 -4.156 -2.266 1.00 25.00 H new ATOM 0 HG3 PRO A 801 -18.275 -4.357 -3.136 1.00 25.00 H new ATOM 0 HD2 PRO A 801 -18.909 -1.955 -2.138 1.00 25.00 H new ATOM 0 HD3 PRO A 801 -18.144 -2.060 -3.711 1.00 25.00 H new ATOM 923 N ASN A 802 -22.627 -2.740 -2.659 1.00 25.00 N ATOM 924 CA ASN A 802 -23.844 -3.114 -1.945 1.00 25.00 C ATOM 925 C ASN A 802 -24.868 -1.985 -2.059 1.00 25.00 C ATOM 926 O ASN A 802 -25.988 -2.112 -1.578 1.00 25.00 O ATOM 927 CB ASN A 802 -23.526 -3.411 -0.476 1.00 25.00 C ATOM 928 CG ASN A 802 -23.003 -4.810 -0.253 1.00 25.00 C ATOM 929 OD1 ASN A 802 -21.932 -5.153 -0.908 1.00 25.00 O flip ATOM 930 ND2 ASN A 802 -23.550 -5.561 0.529 1.00 25.00 N flip ATOM 0 H ASN A 802 -22.067 -2.021 -2.200 1.00 25.00 H new ATOM 0 HA ASN A 802 -24.262 -4.017 -2.390 1.00 25.00 H new ATOM 0 HB2 ASN A 802 -22.788 -2.693 -0.118 1.00 25.00 H new ATOM 0 HB3 ASN A 802 -24.427 -3.267 0.121 1.00 25.00 H new ATOM 0 HD21 ASN A 802 -24.388 -5.258 1.025 1.00 25.00 H new ATOM 0 HD22 ASN A 802 -23.171 -6.494 0.690 1.00 25.00 H new ATOM 937 N ARG A 803 -24.466 -0.901 -2.721 1.00 25.00 N ATOM 938 CA ARG A 803 -25.322 0.271 -2.979 1.00 25.00 C ATOM 939 C ARG A 803 -25.896 0.871 -1.698 1.00 25.00 C ATOM 940 O ARG A 803 -27.054 1.274 -1.641 1.00 25.00 O ATOM 941 CB ARG A 803 -26.412 -0.082 -3.994 1.00 25.00 C ATOM 942 CG ARG A 803 -25.815 -0.456 -5.345 1.00 25.00 C ATOM 943 CD ARG A 803 -26.558 -1.598 -5.984 1.00 25.00 C ATOM 944 NE ARG A 803 -25.877 -2.027 -7.216 1.00 25.00 N ATOM 945 CZ ARG A 803 -26.262 -3.026 -8.000 1.00 25.00 C ATOM 946 NH1 ARG A 803 -27.330 -3.743 -7.745 1.00 25.00 N ATOM 947 NH2 ARG A 803 -25.557 -3.308 -9.059 1.00 25.00 N ATOM 0 H ARG A 803 -23.524 -0.804 -3.101 1.00 25.00 H new ATOM 0 HA ARG A 803 -24.696 1.051 -3.412 1.00 25.00 H new ATOM 0 HB2 ARG A 803 -27.008 -0.912 -3.616 1.00 25.00 H new ATOM 0 HB3 ARG A 803 -27.087 0.766 -4.115 1.00 25.00 H new ATOM 0 HG2 ARG A 803 -25.840 0.410 -6.006 1.00 25.00 H new ATOM 0 HG3 ARG A 803 -24.768 -0.729 -5.217 1.00 25.00 H new ATOM 0 HD2 ARG A 803 -26.623 -2.433 -5.287 1.00 25.00 H new ATOM 0 HD3 ARG A 803 -27.579 -1.293 -6.213 1.00 25.00 H new ATOM 0 HE ARG A 803 -25.039 -1.514 -7.490 1.00 25.00 H new ATOM 0 HH11 ARG A 803 -27.896 -3.540 -6.921 1.00 25.00 H new ATOM 0 HH12 ARG A 803 -27.595 -4.504 -8.371 1.00 25.00 H new ATOM 0 HH21 ARG A 803 -24.722 -2.764 -9.276 1.00 25.00 H new ATOM 0 HH22 ARG A 803 -25.840 -4.073 -9.671 1.00 25.00 H new ATOM 961 N LEU A 804 -25.046 0.939 -0.683 1.00 25.00 N ATOM 962 CA LEU A 804 -25.395 1.529 0.609 1.00 25.00 C ATOM 963 C LEU A 804 -24.739 2.899 0.768 1.00 25.00 C ATOM 964 O LEU A 804 -25.041 3.635 1.700 1.00 25.00 O ATOM 965 CB LEU A 804 -25.001 0.603 1.773 1.00 25.00 C ATOM 966 CG LEU A 804 -23.978 -0.516 1.526 1.00 25.00 C ATOM 967 CD1 LEU A 804 -22.571 -0.001 1.376 1.00 25.00 C ATOM 968 CD2 LEU A 804 -24.002 -1.527 2.651 1.00 25.00 C ATOM 0 H LEU A 804 -24.090 0.586 -0.729 1.00 25.00 H new ATOM 0 HA LEU A 804 -26.477 1.656 0.636 1.00 25.00 H new ATOM 0 HB2 LEU A 804 -24.613 1.231 2.575 1.00 25.00 H new ATOM 0 HB3 LEU A 804 -25.913 0.137 2.145 1.00 25.00 H new ATOM 0 HG LEU A 804 -24.273 -0.985 0.587 1.00 25.00 H new ATOM 0 HD11 LEU A 804 -21.894 -0.838 1.204 1.00 25.00 H new ATOM 0 HD12 LEU A 804 -22.523 0.685 0.530 1.00 25.00 H new ATOM 0 HD13 LEU A 804 -22.276 0.523 2.285 1.00 25.00 H new ATOM 0 HD21 LEU A 804 -23.269 -2.309 2.453 1.00 25.00 H new ATOM 0 HD22 LEU A 804 -23.759 -1.031 3.591 1.00 25.00 H new ATOM 0 HD23 LEU A 804 -24.995 -1.970 2.721 1.00 25.00 H new ATOM 980 N GLY A 805 -23.863 3.245 -0.163 1.00 25.00 N ATOM 981 CA GLY A 805 -23.231 4.558 -0.155 1.00 25.00 C ATOM 982 C GLY A 805 -22.060 4.662 0.799 1.00 25.00 C ATOM 983 O GLY A 805 -21.672 5.758 1.211 1.00 25.00 O ATOM 0 H GLY A 805 -23.574 2.639 -0.931 1.00 25.00 H new ATOM 0 HA2 GLY A 805 -22.890 4.794 -1.163 1.00 25.00 H new ATOM 0 HA3 GLY A 805 -23.975 5.308 0.113 1.00 25.00 H new ATOM 987 N VAL A 806 -21.496 3.521 1.169 1.00 25.00 N ATOM 988 CA VAL A 806 -20.380 3.479 2.111 1.00 25.00 C ATOM 989 C VAL A 806 -19.381 2.407 1.674 1.00 25.00 C ATOM 990 O VAL A 806 -19.748 1.448 1.003 1.00 25.00 O ATOM 991 CB VAL A 806 -20.851 3.158 3.562 1.00 25.00 C ATOM 992 CG1 VAL A 806 -20.397 4.248 4.525 1.00 25.00 C ATOM 993 CG2 VAL A 806 -22.385 3.015 3.675 1.00 25.00 C ATOM 0 H VAL A 806 -21.793 2.606 0.831 1.00 25.00 H new ATOM 0 HA VAL A 806 -19.916 4.466 2.111 1.00 25.00 H new ATOM 0 HB VAL A 806 -20.398 2.202 3.822 1.00 25.00 H new ATOM 0 HG11 VAL A 806 -20.735 4.007 5.533 1.00 25.00 H new ATOM 0 HG12 VAL A 806 -19.309 4.314 4.513 1.00 25.00 H new ATOM 0 HG13 VAL A 806 -20.822 5.204 4.219 1.00 25.00 H new ATOM 0 HG21 VAL A 806 -22.655 2.792 4.707 1.00 25.00 H new ATOM 0 HG22 VAL A 806 -22.861 3.947 3.369 1.00 25.00 H new ATOM 0 HG23 VAL A 806 -22.724 2.205 3.028 1.00 25.00 H new ATOM 1003 N VAL A 807 -18.122 2.577 2.044 1.00 25.00 N ATOM 1004 CA VAL A 807 -17.058 1.666 1.636 1.00 25.00 C ATOM 1005 C VAL A 807 -16.876 0.616 2.707 1.00 25.00 C ATOM 1006 O VAL A 807 -16.677 0.936 3.877 1.00 25.00 O ATOM 1007 CB VAL A 807 -15.736 2.441 1.443 1.00 25.00 C ATOM 1008 CG1 VAL A 807 -14.616 1.527 0.965 1.00 25.00 C ATOM 1009 CG2 VAL A 807 -15.955 3.580 0.448 1.00 25.00 C ATOM 0 H VAL A 807 -17.807 3.347 2.634 1.00 25.00 H new ATOM 0 HA VAL A 807 -17.328 1.194 0.691 1.00 25.00 H new ATOM 0 HB VAL A 807 -15.434 2.850 2.407 1.00 25.00 H new ATOM 0 HG11 VAL A 807 -13.701 2.107 0.840 1.00 25.00 H new ATOM 0 HG12 VAL A 807 -14.449 0.740 1.701 1.00 25.00 H new ATOM 0 HG13 VAL A 807 -14.894 1.079 0.011 1.00 25.00 H new ATOM 0 HG21 VAL A 807 -15.023 4.128 0.311 1.00 25.00 H new ATOM 0 HG22 VAL A 807 -16.279 3.170 -0.509 1.00 25.00 H new ATOM 0 HG23 VAL A 807 -16.720 4.256 0.831 1.00 25.00 H new ATOM 1019 N THR A 808 -16.974 -0.643 2.316 1.00 25.00 N ATOM 1020 CA THR A 808 -16.887 -1.754 3.260 1.00 25.00 C ATOM 1021 C THR A 808 -15.580 -2.493 3.125 1.00 25.00 C ATOM 1022 O THR A 808 -14.859 -2.309 2.178 1.00 25.00 O ATOM 1023 CB THR A 808 -18.046 -2.774 3.067 1.00 25.00 C ATOM 1024 OG1 THR A 808 -17.552 -3.925 2.386 1.00 25.00 O ATOM 1025 CG2 THR A 808 -19.184 -2.198 2.236 1.00 25.00 C ATOM 0 H THR A 808 -17.115 -0.927 1.346 1.00 25.00 H new ATOM 0 HA THR A 808 -16.959 -1.310 4.253 1.00 25.00 H new ATOM 0 HB THR A 808 -18.425 -3.024 4.058 1.00 25.00 H new ATOM 0 HG1 THR A 808 -18.305 -4.463 2.063 1.00 25.00 H new ATOM 0 HG21 THR A 808 -19.970 -2.945 2.128 1.00 25.00 H new ATOM 0 HG22 THR A 808 -19.588 -1.316 2.734 1.00 25.00 H new ATOM 0 HG23 THR A 808 -18.810 -1.919 1.251 1.00 25.00 H new ATOM 1033 N PHE A 809 -15.300 -3.359 4.080 1.00 25.00 N ATOM 1034 CA PHE A 809 -14.095 -4.183 4.102 1.00 25.00 C ATOM 1035 C PHE A 809 -13.808 -4.910 2.803 1.00 25.00 C ATOM 1036 O PHE A 809 -12.677 -4.932 2.363 1.00 25.00 O ATOM 1037 CB PHE A 809 -14.231 -5.200 5.234 1.00 25.00 C ATOM 1038 CG PHE A 809 -15.663 -5.490 5.612 1.00 25.00 C ATOM 1039 CD1 PHE A 809 -16.408 -6.460 4.910 1.00 25.00 C ATOM 1040 CD2 PHE A 809 -16.281 -4.782 6.665 1.00 25.00 C ATOM 1041 CE1 PHE A 809 -17.760 -6.714 5.244 1.00 25.00 C ATOM 1042 CE2 PHE A 809 -17.631 -5.028 7.006 1.00 25.00 C ATOM 1043 CZ PHE A 809 -18.374 -5.992 6.290 1.00 25.00 C ATOM 0 H PHE A 809 -15.912 -3.516 4.880 1.00 25.00 H new ATOM 0 HA PHE A 809 -13.253 -3.508 4.254 1.00 25.00 H new ATOM 0 HB2 PHE A 809 -13.746 -6.130 4.937 1.00 25.00 H new ATOM 0 HB3 PHE A 809 -13.700 -4.830 6.111 1.00 25.00 H new ATOM 0 HD1 PHE A 809 -15.942 -7.015 4.109 1.00 25.00 H new ATOM 0 HD2 PHE A 809 -15.717 -4.044 7.216 1.00 25.00 H new ATOM 0 HE1 PHE A 809 -18.321 -7.459 4.699 1.00 25.00 H new ATOM 0 HE2 PHE A 809 -18.093 -4.479 7.813 1.00 25.00 H new ATOM 0 HZ PHE A 809 -19.408 -6.176 6.542 1.00 25.00 H new ATOM 1053 N GLN A 810 -14.827 -5.472 2.174 1.00 25.00 N ATOM 1054 CA GLN A 810 -14.632 -6.200 0.922 1.00 25.00 C ATOM 1055 C GLN A 810 -14.425 -5.229 -0.238 1.00 25.00 C ATOM 1056 O GLN A 810 -13.993 -5.612 -1.313 1.00 25.00 O ATOM 1057 CB GLN A 810 -15.834 -7.123 0.665 1.00 25.00 C ATOM 1058 CG GLN A 810 -17.124 -6.396 0.245 1.00 25.00 C ATOM 1059 CD GLN A 810 -18.344 -6.805 1.063 1.00 25.00 C ATOM 1060 OE1 GLN A 810 -19.226 -5.864 1.319 1.00 25.00 O flip ATOM 1061 NE2 GLN A 810 -18.477 -7.940 1.478 1.00 25.00 N flip ATOM 0 H GLN A 810 -15.792 -5.441 2.503 1.00 25.00 H new ATOM 0 HA GLN A 810 -13.735 -6.814 1.003 1.00 25.00 H new ATOM 0 HB2 GLN A 810 -15.566 -7.838 -0.113 1.00 25.00 H new ATOM 0 HB3 GLN A 810 -16.034 -7.697 1.570 1.00 25.00 H new ATOM 0 HG2 GLN A 810 -16.974 -5.321 0.343 1.00 25.00 H new ATOM 0 HG3 GLN A 810 -17.319 -6.596 -0.809 1.00 25.00 H new ATOM 0 HE21 GLN A 810 -17.775 -8.648 1.262 1.00 25.00 H new ATOM 0 HE22 GLN A 810 -19.291 -8.185 2.042 1.00 25.00 H new ATOM 1070 N ALA A 811 -14.774 -3.973 -0.004 1.00 25.00 N ATOM 1071 CA ALA A 811 -14.674 -2.928 -1.010 1.00 25.00 C ATOM 1072 C ALA A 811 -13.308 -2.257 -0.975 1.00 25.00 C ATOM 1073 O ALA A 811 -12.770 -1.876 -1.993 1.00 25.00 O ATOM 1074 CB ALA A 811 -15.746 -1.912 -0.775 1.00 25.00 C ATOM 0 H ALA A 811 -15.136 -3.649 0.893 1.00 25.00 H new ATOM 0 HA ALA A 811 -14.800 -3.381 -1.993 1.00 25.00 H new ATOM 0 HB1 ALA A 811 -15.674 -1.127 -1.527 1.00 25.00 H new ATOM 0 HB2 ALA A 811 -16.723 -2.391 -0.843 1.00 25.00 H new ATOM 0 HB3 ALA A 811 -15.623 -1.477 0.217 1.00 25.00 H new ATOM 1080 N PHE A 812 -12.762 -2.101 0.220 1.00 25.00 N ATOM 1081 CA PHE A 812 -11.460 -1.444 0.385 1.00 25.00 C ATOM 1082 C PHE A 812 -10.365 -2.191 -0.380 1.00 25.00 C ATOM 1083 O PHE A 812 -9.394 -1.595 -0.842 1.00 25.00 O ATOM 1084 CB PHE A 812 -11.041 -1.385 1.849 1.00 25.00 C ATOM 1085 CG PHE A 812 -11.813 -0.429 2.670 1.00 25.00 C ATOM 1086 CD1 PHE A 812 -11.574 0.954 2.623 1.00 25.00 C ATOM 1087 CD2 PHE A 812 -12.767 -0.920 3.537 1.00 25.00 C ATOM 1088 CE1 PHE A 812 -12.340 1.825 3.428 1.00 25.00 C ATOM 1089 CE2 PHE A 812 -13.540 -0.084 4.326 1.00 25.00 C ATOM 1090 CZ PHE A 812 -13.350 1.283 4.267 1.00 25.00 C ATOM 0 H PHE A 812 -13.191 -2.416 1.090 1.00 25.00 H new ATOM 0 HA PHE A 812 -11.576 -0.434 -0.007 1.00 25.00 H new ATOM 0 HB2 PHE A 812 -11.141 -2.380 2.283 1.00 25.00 H new ATOM 0 HB3 PHE A 812 -9.985 -1.119 1.901 1.00 25.00 H new ATOM 0 HD1 PHE A 812 -10.807 1.350 1.974 1.00 25.00 H new ATOM 0 HD2 PHE A 812 -12.916 -1.988 3.603 1.00 25.00 H new ATOM 0 HE1 PHE A 812 -12.160 2.890 3.406 1.00 25.00 H new ATOM 0 HE2 PHE A 812 -14.288 -0.499 4.985 1.00 25.00 H new ATOM 0 HZ PHE A 812 -13.970 1.940 4.859 1.00 25.00 H new ATOM 1100 N ILE A 813 -10.527 -3.503 -0.491 1.00 25.00 N ATOM 1101 CA ILE A 813 -9.525 -4.373 -1.117 1.00 25.00 C ATOM 1102 C ILE A 813 -9.321 -3.995 -2.571 1.00 25.00 C ATOM 1103 O ILE A 813 -8.224 -4.090 -3.112 1.00 25.00 O ATOM 1104 CB ILE A 813 -9.963 -5.854 -1.058 1.00 25.00 C ATOM 1105 CG1 ILE A 813 -10.379 -6.241 0.378 1.00 25.00 C ATOM 1106 CG2 ILE A 813 -8.840 -6.781 -1.590 1.00 25.00 C ATOM 1107 CD1 ILE A 813 -9.437 -5.739 1.536 1.00 25.00 C ATOM 0 H ILE A 813 -11.352 -3.998 -0.153 1.00 25.00 H new ATOM 0 HA ILE A 813 -8.595 -4.243 -0.564 1.00 25.00 H new ATOM 0 HB ILE A 813 -10.832 -5.983 -1.703 1.00 25.00 H new ATOM 0 HG12 ILE A 813 -11.381 -5.854 0.560 1.00 25.00 H new ATOM 0 HG13 ILE A 813 -10.442 -7.328 0.435 1.00 25.00 H new ATOM 0 HG21 ILE A 813 -9.170 -7.819 -1.539 1.00 25.00 H new ATOM 0 HG22 ILE A 813 -8.614 -6.522 -2.625 1.00 25.00 H new ATOM 0 HG23 ILE A 813 -7.945 -6.655 -0.981 1.00 25.00 H new ATOM 0 HD11 ILE A 813 -9.831 -6.072 2.496 1.00 25.00 H new ATOM 0 HD12 ILE A 813 -8.436 -6.147 1.394 1.00 25.00 H new ATOM 0 HD13 ILE A 813 -9.390 -4.650 1.521 1.00 25.00 H new ATOM 1119 N ASP A 814 -10.390 -3.516 -3.172 1.00 25.00 N ATOM 1120 CA ASP A 814 -10.360 -3.018 -4.549 1.00 25.00 C ATOM 1121 C ASP A 814 -9.185 -2.049 -4.751 1.00 25.00 C ATOM 1122 O ASP A 814 -8.375 -2.223 -5.660 1.00 25.00 O ATOM 1123 CB ASP A 814 -11.678 -2.313 -4.860 1.00 25.00 C ATOM 1124 CG ASP A 814 -11.967 -2.244 -6.350 1.00 25.00 C ATOM 1125 OD1 ASP A 814 -11.387 -1.370 -7.033 1.00 25.00 O ATOM 1126 OD2 ASP A 814 -12.788 -3.050 -6.835 1.00 25.00 O ATOM 0 H ASP A 814 -11.307 -3.457 -2.729 1.00 25.00 H new ATOM 0 HA ASP A 814 -10.227 -3.861 -5.227 1.00 25.00 H new ATOM 0 HB2 ASP A 814 -12.493 -2.837 -4.360 1.00 25.00 H new ATOM 0 HB3 ASP A 814 -11.650 -1.303 -4.452 1.00 25.00 H new ATOM 1131 N PHE A 815 -9.036 -1.089 -3.843 1.00 25.00 N ATOM 1132 CA PHE A 815 -7.899 -0.163 -3.909 1.00 25.00 C ATOM 1133 C PHE A 815 -6.603 -0.840 -3.461 1.00 25.00 C ATOM 1134 O PHE A 815 -5.561 -0.638 -4.044 1.00 25.00 O ATOM 1135 CB PHE A 815 -8.143 1.080 -3.050 1.00 25.00 C ATOM 1136 CG PHE A 815 -7.423 2.306 -3.550 1.00 25.00 C ATOM 1137 CD1 PHE A 815 -6.007 2.390 -3.553 1.00 25.00 C ATOM 1138 CD2 PHE A 815 -8.166 3.405 -4.029 1.00 25.00 C ATOM 1139 CE1 PHE A 815 -5.362 3.539 -4.048 1.00 25.00 C ATOM 1140 CE2 PHE A 815 -7.527 4.548 -4.508 1.00 25.00 C ATOM 1141 CZ PHE A 815 -6.126 4.614 -4.532 1.00 25.00 C ATOM 0 H PHE A 815 -9.674 -0.929 -3.063 1.00 25.00 H new ATOM 0 HA PHE A 815 -7.799 0.140 -4.951 1.00 25.00 H new ATOM 0 HB2 PHE A 815 -9.213 1.285 -3.017 1.00 25.00 H new ATOM 0 HB3 PHE A 815 -7.826 0.874 -2.028 1.00 25.00 H new ATOM 0 HD1 PHE A 815 -5.420 1.567 -3.173 1.00 25.00 H new ATOM 0 HD2 PHE A 815 -9.245 3.361 -4.025 1.00 25.00 H new ATOM 0 HE1 PHE A 815 -4.283 3.594 -4.056 1.00 25.00 H new ATOM 0 HE2 PHE A 815 -8.112 5.384 -4.861 1.00 25.00 H new ATOM 0 HZ PHE A 815 -5.634 5.492 -4.923 1.00 25.00 H new ATOM 1151 N MET A 816 -6.669 -1.671 -2.438 1.00 25.00 N ATOM 1152 CA MET A 816 -5.479 -2.377 -1.948 1.00 25.00 C ATOM 1153 C MET A 816 -4.757 -3.206 -3.021 1.00 25.00 C ATOM 1154 O MET A 816 -3.557 -3.349 -2.985 1.00 25.00 O ATOM 1155 CB MET A 816 -5.887 -3.333 -0.853 1.00 25.00 C ATOM 1156 CG MET A 816 -4.982 -3.369 0.367 1.00 25.00 C ATOM 1157 SD MET A 816 -3.289 -3.819 0.106 1.00 25.00 S ATOM 1158 CE MET A 816 -2.562 -2.265 0.398 1.00 25.00 C ATOM 0 H MET A 816 -7.526 -1.880 -1.926 1.00 25.00 H new ATOM 0 HA MET A 816 -4.794 -1.602 -1.604 1.00 25.00 H new ATOM 0 HB2 MET A 816 -6.894 -3.073 -0.527 1.00 25.00 H new ATOM 0 HB3 MET A 816 -5.937 -4.337 -1.274 1.00 25.00 H new ATOM 0 HG2 MET A 816 -5.002 -2.383 0.831 1.00 25.00 H new ATOM 0 HG3 MET A 816 -5.411 -4.068 1.085 1.00 25.00 H new ATOM 0 HE1 MET A 816 -1.480 -2.345 0.298 1.00 25.00 H new ATOM 0 HE2 MET A 816 -2.941 -1.544 -0.326 1.00 25.00 H new ATOM 0 HE3 MET A 816 -2.809 -1.931 1.406 1.00 25.00 H new ATOM 1168 N SER A 817 -5.467 -3.777 -3.978 1.00 25.00 N ATOM 1169 CA SER A 817 -4.780 -4.535 -5.028 1.00 25.00 C ATOM 1170 C SER A 817 -4.187 -3.584 -6.074 1.00 25.00 C ATOM 1171 O SER A 817 -3.264 -3.946 -6.799 1.00 25.00 O ATOM 1172 CB SER A 817 -5.699 -5.565 -5.668 1.00 25.00 C ATOM 1173 OG SER A 817 -5.008 -6.316 -6.656 1.00 25.00 O ATOM 0 H SER A 817 -6.483 -3.739 -4.057 1.00 25.00 H new ATOM 0 HA SER A 817 -3.960 -5.085 -4.566 1.00 25.00 H new ATOM 0 HB2 SER A 817 -6.089 -6.236 -4.902 1.00 25.00 H new ATOM 0 HB3 SER A 817 -6.555 -5.064 -6.119 1.00 25.00 H new ATOM 0 HG SER A 817 -5.617 -6.973 -7.053 1.00 25.00 H new ATOM 1179 N ARG A 818 -4.695 -2.359 -6.123 1.00 25.00 N ATOM 1180 CA ARG A 818 -4.142 -1.305 -6.994 1.00 25.00 C ATOM 1181 C ARG A 818 -2.817 -0.773 -6.463 1.00 25.00 C ATOM 1182 O ARG A 818 -2.062 -0.164 -7.200 1.00 25.00 O ATOM 1183 CB ARG A 818 -5.113 -0.136 -7.135 1.00 25.00 C ATOM 1184 CG ARG A 818 -6.453 -0.534 -7.704 1.00 25.00 C ATOM 1185 CD ARG A 818 -6.664 0.098 -9.044 1.00 25.00 C ATOM 1186 NE ARG A 818 -7.225 1.457 -8.913 1.00 25.00 N ATOM 1187 CZ ARG A 818 -6.555 2.602 -9.039 1.00 25.00 C ATOM 1188 NH1 ARG A 818 -5.279 2.666 -9.323 1.00 25.00 N ATOM 1189 NH2 ARG A 818 -7.199 3.717 -8.869 1.00 25.00 N ATOM 0 H ARG A 818 -5.497 -2.060 -5.568 1.00 25.00 H new ATOM 0 HA ARG A 818 -3.979 -1.766 -7.968 1.00 25.00 H new ATOM 0 HB2 ARG A 818 -5.263 0.321 -6.157 1.00 25.00 H new ATOM 0 HB3 ARG A 818 -4.665 0.623 -7.777 1.00 25.00 H new ATOM 0 HG2 ARG A 818 -6.508 -1.619 -7.795 1.00 25.00 H new ATOM 0 HG3 ARG A 818 -7.248 -0.230 -7.023 1.00 25.00 H new ATOM 0 HD2 ARG A 818 -5.716 0.144 -9.580 1.00 25.00 H new ATOM 0 HD3 ARG A 818 -7.337 -0.520 -9.638 1.00 25.00 H new ATOM 0 HE ARG A 818 -8.221 1.526 -8.706 1.00 25.00 H new ATOM 0 HH11 ARG A 818 -4.744 1.809 -9.461 1.00 25.00 H new ATOM 0 HH12 ARG A 818 -4.820 3.573 -9.407 1.00 25.00 H new ATOM 0 HH21 ARG A 818 -8.194 3.702 -8.645 1.00 25.00 H new ATOM 0 HH22 ARG A 818 -6.710 4.607 -8.960 1.00 25.00 H new ATOM 1203 N GLU A 819 -2.565 -1.022 -5.184 1.00 25.00 N ATOM 1204 CA GLU A 819 -1.326 -0.634 -4.480 1.00 25.00 C ATOM 1205 C GLU A 819 -0.064 -1.162 -5.197 1.00 25.00 C ATOM 1206 O GLU A 819 1.044 -0.707 -4.975 1.00 25.00 O ATOM 1207 CB GLU A 819 -1.391 -1.273 -3.092 1.00 25.00 C ATOM 1208 CG GLU A 819 -0.337 -0.895 -2.071 1.00 25.00 C ATOM 1209 CD GLU A 819 -0.775 0.221 -1.111 1.00 25.00 C ATOM 1210 OE1 GLU A 819 -1.971 0.606 -1.114 1.00 25.00 O ATOM 1211 OE2 GLU A 819 0.058 0.617 -0.272 1.00 25.00 O ATOM 0 H GLU A 819 -3.227 -1.512 -4.582 1.00 25.00 H new ATOM 0 HA GLU A 819 -1.258 0.453 -4.445 1.00 25.00 H new ATOM 0 HB2 GLU A 819 -2.366 -1.038 -2.664 1.00 25.00 H new ATOM 0 HB3 GLU A 819 -1.353 -2.354 -3.223 1.00 25.00 H new ATOM 0 HG2 GLU A 819 -0.074 -1.779 -1.490 1.00 25.00 H new ATOM 0 HG3 GLU A 819 0.565 -0.578 -2.594 1.00 25.00 H new ATOM 1218 N THR A 820 -0.262 -2.139 -6.069 1.00 25.00 N ATOM 1219 CA THR A 820 0.815 -2.749 -6.848 1.00 25.00 C ATOM 1220 C THR A 820 1.332 -1.843 -7.983 1.00 25.00 C ATOM 1221 O THR A 820 2.136 -2.275 -8.815 1.00 25.00 O ATOM 1222 CB THR A 820 0.312 -4.078 -7.456 1.00 25.00 C ATOM 1223 OG1 THR A 820 -0.838 -3.827 -8.272 1.00 25.00 O ATOM 1224 CG2 THR A 820 -0.110 -5.050 -6.351 1.00 25.00 C ATOM 0 H THR A 820 -1.181 -2.537 -6.260 1.00 25.00 H new ATOM 0 HA THR A 820 1.647 -2.915 -6.164 1.00 25.00 H new ATOM 0 HB THR A 820 1.123 -4.509 -8.043 1.00 25.00 H new ATOM 0 HG1 THR A 820 -1.647 -3.880 -7.722 1.00 25.00 H new ATOM 0 HG21 THR A 820 -0.461 -5.980 -6.799 1.00 25.00 H new ATOM 0 HG22 THR A 820 0.742 -5.258 -5.704 1.00 25.00 H new ATOM 0 HG23 THR A 820 -0.912 -4.605 -5.762 1.00 25.00 H new ATOM 1232 N ALA A 821 0.883 -0.594 -8.000 1.00 25.00 N ATOM 1233 CA ALA A 821 1.320 0.403 -8.980 1.00 25.00 C ATOM 1234 C ALA A 821 1.784 1.679 -8.256 1.00 25.00 C ATOM 1235 O ALA A 821 1.336 1.972 -7.158 1.00 25.00 O ATOM 1236 CB ALA A 821 0.173 0.719 -9.949 1.00 25.00 C ATOM 0 H ALA A 821 0.200 -0.238 -7.331 1.00 25.00 H new ATOM 0 HA ALA A 821 2.158 0.004 -9.552 1.00 25.00 H new ATOM 0 HB1 ALA A 821 0.504 1.461 -10.675 1.00 25.00 H new ATOM 0 HB2 ALA A 821 -0.124 -0.191 -10.470 1.00 25.00 H new ATOM 0 HB3 ALA A 821 -0.677 1.112 -9.391 1.00 25.00 H new ATOM 1242 N ASP A 822 2.702 2.405 -8.881 1.00 25.00 N ATOM 1243 CA ASP A 822 3.312 3.601 -8.285 1.00 25.00 C ATOM 1244 C ASP A 822 2.371 4.800 -8.140 1.00 25.00 C ATOM 1245 O ASP A 822 1.497 5.028 -8.984 1.00 25.00 O ATOM 1246 CB ASP A 822 4.480 4.060 -9.164 1.00 25.00 C ATOM 1247 CG ASP A 822 5.562 3.017 -9.284 1.00 25.00 C ATOM 1248 OD1 ASP A 822 5.472 2.152 -10.188 1.00 25.00 O ATOM 1249 OD2 ASP A 822 6.521 3.058 -8.495 1.00 25.00 O ATOM 0 H ASP A 822 3.049 2.187 -9.815 1.00 25.00 H new ATOM 0 HA ASP A 822 3.615 3.297 -7.283 1.00 25.00 H new ATOM 0 HB2 ASP A 822 4.107 4.306 -10.158 1.00 25.00 H new ATOM 0 HB3 ASP A 822 4.906 4.973 -8.748 1.00 25.00 H new ATOM 1254 N THR A 823 2.645 5.628 -7.136 1.00 25.00 N ATOM 1255 CA THR A 823 1.945 6.899 -6.944 1.00 25.00 C ATOM 1256 C THR A 823 2.908 7.973 -6.461 1.00 25.00 C ATOM 1257 O THR A 823 4.034 7.675 -6.087 1.00 25.00 O ATOM 1258 CB THR A 823 0.840 6.807 -5.884 1.00 25.00 C ATOM 1259 OG1 THR A 823 0.528 5.440 -5.612 1.00 25.00 O ATOM 1260 CG2 THR A 823 -0.388 7.492 -6.364 1.00 25.00 C ATOM 0 H THR A 823 3.358 5.439 -6.432 1.00 25.00 H new ATOM 0 HA THR A 823 1.513 7.145 -7.914 1.00 25.00 H new ATOM 0 HB THR A 823 1.199 7.289 -4.974 1.00 25.00 H new ATOM 0 HG1 THR A 823 -0.071 5.389 -4.838 1.00 25.00 H new ATOM 0 HG21 THR A 823 -1.166 7.420 -5.603 1.00 25.00 H new ATOM 0 HG22 THR A 823 -0.167 8.541 -6.559 1.00 25.00 H new ATOM 0 HG23 THR A 823 -0.734 7.018 -7.282 1.00 25.00 H new ATOM 1268 N ASP A 824 2.447 9.215 -6.415 1.00 25.00 N ATOM 1269 CA ASP A 824 3.243 10.315 -5.882 1.00 25.00 C ATOM 1270 C ASP A 824 3.173 10.325 -4.353 1.00 25.00 C ATOM 1271 O ASP A 824 4.173 10.495 -3.661 1.00 25.00 O ATOM 1272 CB ASP A 824 2.741 11.654 -6.442 1.00 25.00 C ATOM 1273 CG ASP A 824 1.334 12.009 -5.964 1.00 25.00 C ATOM 1274 OD1 ASP A 824 0.426 11.151 -6.087 1.00 25.00 O ATOM 1275 OD2 ASP A 824 1.144 13.125 -5.450 1.00 25.00 O ATOM 0 H ASP A 824 1.520 9.488 -6.742 1.00 25.00 H new ATOM 0 HA ASP A 824 4.280 10.175 -6.186 1.00 25.00 H new ATOM 0 HB2 ASP A 824 3.430 12.446 -6.148 1.00 25.00 H new ATOM 0 HB3 ASP A 824 2.749 11.612 -7.531 1.00 25.00 H new ATOM 1280 N THR A 825 1.984 10.062 -3.840 1.00 25.00 N ATOM 1281 CA THR A 825 1.731 9.964 -2.409 1.00 25.00 C ATOM 1282 C THR A 825 2.408 8.729 -1.826 1.00 25.00 C ATOM 1283 O THR A 825 2.590 8.624 -0.609 1.00 25.00 O ATOM 1284 CB THR A 825 0.236 9.839 -2.169 1.00 25.00 C ATOM 1285 OG1 THR A 825 -0.281 8.900 -3.106 1.00 25.00 O ATOM 1286 CG2 THR A 825 -0.481 11.142 -2.374 1.00 25.00 C ATOM 0 H THR A 825 1.154 9.908 -4.412 1.00 25.00 H new ATOM 0 HA THR A 825 2.128 10.859 -1.930 1.00 25.00 H new ATOM 0 HB THR A 825 0.081 9.524 -1.137 1.00 25.00 H new ATOM 0 HG1 THR A 825 -1.182 9.173 -3.380 1.00 25.00 H new ATOM 0 HG21 THR A 825 -1.547 11.004 -2.191 1.00 25.00 H new ATOM 0 HG22 THR A 825 -0.088 11.886 -1.682 1.00 25.00 H new ATOM 0 HG23 THR A 825 -0.330 11.483 -3.398 1.00 25.00 H new ATOM 1294 N ALA A 826 2.743 7.778 -2.691 1.00 25.00 N ATOM 1295 CA ALA A 826 3.370 6.524 -2.279 1.00 25.00 C ATOM 1296 C ALA A 826 4.717 6.748 -1.574 1.00 25.00 C ATOM 1297 O ALA A 826 5.153 5.921 -0.779 1.00 25.00 O ATOM 1298 CB ALA A 826 3.551 5.609 -3.492 1.00 25.00 C ATOM 0 H ALA A 826 2.589 7.853 -3.696 1.00 25.00 H new ATOM 0 HA ALA A 826 2.707 6.048 -1.557 1.00 25.00 H new ATOM 0 HB1 ALA A 826 4.019 4.676 -3.177 1.00 25.00 H new ATOM 0 HB2 ALA A 826 2.578 5.396 -3.935 1.00 25.00 H new ATOM 0 HB3 ALA A 826 4.185 6.103 -4.229 1.00 25.00 H new ATOM 1304 N ASP A 827 5.344 7.889 -1.821 1.00 25.00 N ATOM 1305 CA ASP A 827 6.610 8.232 -1.163 1.00 25.00 C ATOM 1306 C ASP A 827 6.433 8.251 0.356 1.00 25.00 C ATOM 1307 O ASP A 827 7.311 7.847 1.115 1.00 25.00 O ATOM 1308 CB ASP A 827 7.071 9.612 -1.637 1.00 25.00 C ATOM 1309 CG ASP A 827 8.429 9.996 -1.077 1.00 25.00 C ATOM 1310 OD1 ASP A 827 9.446 9.424 -1.525 1.00 25.00 O ATOM 1311 OD2 ASP A 827 8.483 10.912 -0.225 1.00 25.00 O ATOM 0 H ASP A 827 5.002 8.597 -2.471 1.00 25.00 H new ATOM 0 HA ASP A 827 7.357 7.482 -1.422 1.00 25.00 H new ATOM 0 HB2 ASP A 827 7.115 9.623 -2.726 1.00 25.00 H new ATOM 0 HB3 ASP A 827 6.335 10.359 -1.340 1.00 25.00 H new ATOM 1316 N GLN A 828 5.259 8.683 0.794 1.00 25.00 N ATOM 1317 CA GLN A 828 4.970 8.786 2.218 1.00 25.00 C ATOM 1318 C GLN A 828 4.802 7.423 2.872 1.00 25.00 C ATOM 1319 O GLN A 828 5.233 7.213 4.002 1.00 25.00 O ATOM 1320 CB GLN A 828 3.662 9.540 2.441 1.00 25.00 C ATOM 1321 CG GLN A 828 3.529 10.853 1.684 1.00 25.00 C ATOM 1322 CD GLN A 828 2.159 11.458 1.882 1.00 25.00 C ATOM 1323 OE1 GLN A 828 2.015 12.581 2.342 1.00 25.00 O ATOM 1324 NE2 GLN A 828 1.141 10.700 1.559 1.00 25.00 N ATOM 0 H GLN A 828 4.492 8.968 0.185 1.00 25.00 H new ATOM 0 HA GLN A 828 5.818 9.308 2.661 1.00 25.00 H new ATOM 0 HB2 GLN A 828 2.835 8.890 2.156 1.00 25.00 H new ATOM 0 HB3 GLN A 828 3.556 9.742 3.507 1.00 25.00 H new ATOM 0 HG2 GLN A 828 4.292 11.552 2.026 1.00 25.00 H new ATOM 0 HG3 GLN A 828 3.705 10.684 0.622 1.00 25.00 H new ATOM 0 HE21 GLN A 828 1.300 9.768 1.177 1.00 25.00 H new ATOM 0 HE22 GLN A 828 0.189 11.042 1.689 1.00 25.00 H new ATOM 1333 N VAL A 829 4.103 6.519 2.199 1.00 25.00 N ATOM 1334 CA VAL A 829 3.780 5.231 2.808 1.00 25.00 C ATOM 1335 C VAL A 829 5.023 4.336 2.832 1.00 25.00 C ATOM 1336 O VAL A 829 5.219 3.563 3.768 1.00 25.00 O ATOM 1337 CB VAL A 829 2.547 4.527 2.122 1.00 25.00 C ATOM 1338 CG1 VAL A 829 2.796 4.240 0.660 1.00 25.00 C ATOM 1339 CG2 VAL A 829 2.190 3.235 2.843 1.00 25.00 C ATOM 0 H VAL A 829 3.753 6.647 1.249 1.00 25.00 H new ATOM 0 HA VAL A 829 3.472 5.414 3.837 1.00 25.00 H new ATOM 0 HB VAL A 829 1.711 5.223 2.191 1.00 25.00 H new ATOM 0 HG11 VAL A 829 1.920 3.755 0.230 1.00 25.00 H new ATOM 0 HG12 VAL A 829 2.988 5.175 0.133 1.00 25.00 H new ATOM 0 HG13 VAL A 829 3.660 3.583 0.560 1.00 25.00 H new ATOM 0 HG21 VAL A 829 1.337 2.768 2.351 1.00 25.00 H new ATOM 0 HG22 VAL A 829 3.042 2.555 2.815 1.00 25.00 H new ATOM 0 HG23 VAL A 829 1.936 3.455 3.880 1.00 25.00 H new ATOM 1349 N MET A 830 5.915 4.505 1.863 1.00 25.00 N ATOM 1350 CA MET A 830 7.160 3.729 1.822 1.00 25.00 C ATOM 1351 C MET A 830 8.110 4.074 2.974 1.00 25.00 C ATOM 1352 O MET A 830 9.031 3.319 3.279 1.00 25.00 O ATOM 1353 CB MET A 830 7.873 3.952 0.493 1.00 25.00 C ATOM 1354 CG MET A 830 7.213 3.239 -0.681 1.00 25.00 C ATOM 1355 SD MET A 830 8.251 3.270 -2.166 1.00 25.00 S ATOM 1356 CE MET A 830 8.149 4.999 -2.662 1.00 25.00 C ATOM 0 H MET A 830 5.805 5.168 1.096 1.00 25.00 H new ATOM 0 HA MET A 830 6.881 2.681 1.929 1.00 25.00 H new ATOM 0 HB2 MET A 830 7.909 5.021 0.284 1.00 25.00 H new ATOM 0 HB3 MET A 830 8.904 3.610 0.582 1.00 25.00 H new ATOM 0 HG2 MET A 830 7.005 2.205 -0.406 1.00 25.00 H new ATOM 0 HG3 MET A 830 6.255 3.710 -0.899 1.00 25.00 H new ATOM 0 HE1 MET A 830 8.607 5.124 -3.643 1.00 25.00 H new ATOM 0 HE2 MET A 830 7.103 5.303 -2.708 1.00 25.00 H new ATOM 0 HE3 MET A 830 8.675 5.618 -1.935 1.00 25.00 H new ATOM 1366 N ALA A 831 7.843 5.166 3.679 1.00 25.00 N ATOM 1367 CA ALA A 831 8.627 5.515 4.864 1.00 25.00 C ATOM 1368 C ALA A 831 8.500 4.420 5.944 1.00 25.00 C ATOM 1369 O ALA A 831 9.354 4.303 6.829 1.00 25.00 O ATOM 1370 CB ALA A 831 8.163 6.870 5.413 1.00 25.00 C ATOM 0 H ALA A 831 7.096 5.823 3.456 1.00 25.00 H new ATOM 0 HA ALA A 831 9.677 5.589 4.581 1.00 25.00 H new ATOM 0 HB1 ALA A 831 8.750 7.125 6.295 1.00 25.00 H new ATOM 0 HB2 ALA A 831 8.300 7.637 4.651 1.00 25.00 H new ATOM 0 HB3 ALA A 831 7.109 6.811 5.683 1.00 25.00 H new ATOM 1376 N SER A 832 7.459 3.601 5.838 1.00 25.00 N ATOM 1377 CA SER A 832 7.222 2.489 6.760 1.00 25.00 C ATOM 1378 C SER A 832 8.379 1.500 6.828 1.00 25.00 C ATOM 1379 O SER A 832 8.591 0.882 7.869 1.00 25.00 O ATOM 1380 CB SER A 832 5.968 1.732 6.332 1.00 25.00 C ATOM 1381 OG SER A 832 6.098 1.293 4.994 1.00 25.00 O ATOM 0 H SER A 832 6.752 3.688 5.108 1.00 25.00 H new ATOM 0 HA SER A 832 7.108 2.930 7.750 1.00 25.00 H new ATOM 0 HB2 SER A 832 5.808 0.877 6.989 1.00 25.00 H new ATOM 0 HB3 SER A 832 5.094 2.376 6.428 1.00 25.00 H new ATOM 0 HG SER A 832 5.829 2.013 4.386 1.00 25.00 H new ATOM 1387 N PHE A 833 9.164 1.374 5.766 1.00 25.00 N ATOM 1388 CA PHE A 833 10.285 0.432 5.769 1.00 25.00 C ATOM 1389 C PHE A 833 11.314 0.781 6.853 1.00 25.00 C ATOM 1390 O PHE A 833 11.987 -0.100 7.386 1.00 25.00 O ATOM 1391 CB PHE A 833 10.976 0.402 4.410 1.00 25.00 C ATOM 1392 CG PHE A 833 10.045 0.164 3.247 1.00 25.00 C ATOM 1393 CD1 PHE A 833 8.961 -0.737 3.340 1.00 25.00 C ATOM 1394 CD2 PHE A 833 10.257 0.848 2.033 1.00 25.00 C ATOM 1395 CE1 PHE A 833 8.091 -0.931 2.243 1.00 25.00 C ATOM 1396 CE2 PHE A 833 9.394 0.656 0.933 1.00 25.00 C ATOM 1397 CZ PHE A 833 8.307 -0.227 1.040 1.00 25.00 C ATOM 0 H PHE A 833 9.051 1.902 4.901 1.00 25.00 H new ATOM 0 HA PHE A 833 9.871 -0.553 5.985 1.00 25.00 H new ATOM 0 HB2 PHE A 833 11.494 1.349 4.258 1.00 25.00 H new ATOM 0 HB3 PHE A 833 11.736 -0.380 4.419 1.00 25.00 H new ATOM 0 HD1 PHE A 833 8.796 -1.282 4.257 1.00 25.00 H new ATOM 0 HD2 PHE A 833 11.091 1.528 1.943 1.00 25.00 H new ATOM 0 HE1 PHE A 833 7.262 -1.618 2.326 1.00 25.00 H new ATOM 0 HE2 PHE A 833 9.569 1.188 0.009 1.00 25.00 H new ATOM 0 HZ PHE A 833 7.638 -0.367 0.203 1.00 25.00 H new ATOM 1407 N LYS A 834 11.408 2.057 7.222 1.00 25.00 N ATOM 1408 CA LYS A 834 12.316 2.469 8.303 1.00 25.00 C ATOM 1409 C LYS A 834 11.809 1.926 9.630 1.00 25.00 C ATOM 1410 O LYS A 834 12.588 1.528 10.483 1.00 25.00 O ATOM 1411 CB LYS A 834 12.421 4.008 8.383 1.00 25.00 C ATOM 1412 CG LYS A 834 13.290 4.543 9.554 1.00 25.00 C ATOM 1413 CD LYS A 834 14.731 4.166 9.462 1.00 25.00 C ATOM 1414 CE LYS A 834 15.285 4.339 10.831 1.00 25.00 C ATOM 1415 NZ LYS A 834 16.682 3.794 10.972 1.00 25.00 N ATOM 0 H LYS A 834 10.877 2.818 6.798 1.00 25.00 H new ATOM 0 HA LYS A 834 13.306 2.066 8.091 1.00 25.00 H new ATOM 0 HB2 LYS A 834 12.833 4.379 7.445 1.00 25.00 H new ATOM 0 HB3 LYS A 834 11.417 4.422 8.476 1.00 25.00 H new ATOM 0 HG2 LYS A 834 13.211 5.630 9.585 1.00 25.00 H new ATOM 0 HG3 LYS A 834 12.886 4.167 10.494 1.00 25.00 H new ATOM 0 HD2 LYS A 834 14.845 3.137 9.122 1.00 25.00 H new ATOM 0 HD3 LYS A 834 15.255 4.798 8.746 1.00 25.00 H new ATOM 0 HE2 LYS A 834 15.287 5.399 11.085 1.00 25.00 H new ATOM 0 HE3 LYS A 834 14.632 3.840 11.547 1.00 25.00 H new ATOM 0 HZ1 LYS A 834 17.003 3.912 11.954 1.00 25.00 H new ATOM 0 HZ2 LYS A 834 16.687 2.784 10.725 1.00 25.00 H new ATOM 0 HZ3 LYS A 834 17.322 4.310 10.335 1.00 25.00 H new ATOM 1429 N ILE A 835 10.498 1.915 9.794 1.00 25.00 N ATOM 1430 CA ILE A 835 9.878 1.468 11.040 1.00 25.00 C ATOM 1431 C ILE A 835 10.016 -0.050 11.116 1.00 25.00 C ATOM 1432 O ILE A 835 10.309 -0.605 12.172 1.00 25.00 O ATOM 1433 CB ILE A 835 8.368 1.898 11.121 1.00 25.00 C ATOM 1434 CG1 ILE A 835 8.259 3.426 11.306 1.00 25.00 C ATOM 1435 CG2 ILE A 835 7.664 1.219 12.316 1.00 25.00 C ATOM 1436 CD1 ILE A 835 8.183 4.234 10.026 1.00 25.00 C ATOM 0 H ILE A 835 9.834 2.211 9.078 1.00 25.00 H new ATOM 0 HA ILE A 835 10.381 1.936 11.886 1.00 25.00 H new ATOM 0 HB ILE A 835 7.889 1.592 10.191 1.00 25.00 H new ATOM 0 HG12 ILE A 835 7.373 3.640 11.903 1.00 25.00 H new ATOM 0 HG13 ILE A 835 9.120 3.767 11.880 1.00 25.00 H new ATOM 0 HG21 ILE A 835 6.621 1.533 12.350 1.00 25.00 H new ATOM 0 HG22 ILE A 835 7.714 0.136 12.200 1.00 25.00 H new ATOM 0 HG23 ILE A 835 8.160 1.508 13.243 1.00 25.00 H new ATOM 0 HD11 ILE A 835 8.109 5.294 10.269 1.00 25.00 H new ATOM 0 HD12 ILE A 835 9.080 4.060 9.432 1.00 25.00 H new ATOM 0 HD13 ILE A 835 7.305 3.930 9.456 1.00 25.00 H new ATOM 1448 N LEU A 836 9.859 -0.702 9.973 1.00 25.00 N ATOM 1449 CA LEU A 836 10.004 -2.153 9.866 1.00 25.00 C ATOM 1450 C LEU A 836 11.427 -2.584 10.246 1.00 25.00 C ATOM 1451 O LEU A 836 11.622 -3.534 11.004 1.00 25.00 O ATOM 1452 CB LEU A 836 9.708 -2.563 8.420 1.00 25.00 C ATOM 1453 CG LEU A 836 9.047 -3.917 8.115 1.00 25.00 C ATOM 1454 CD1 LEU A 836 9.411 -4.268 6.688 1.00 25.00 C ATOM 1455 CD2 LEU A 836 9.433 -5.072 9.037 1.00 25.00 C ATOM 0 H LEU A 836 9.628 -0.243 9.092 1.00 25.00 H new ATOM 0 HA LEU A 836 9.308 -2.640 10.549 1.00 25.00 H new ATOM 0 HB2 LEU A 836 9.072 -1.790 7.990 1.00 25.00 H new ATOM 0 HB3 LEU A 836 10.653 -2.536 7.878 1.00 25.00 H new ATOM 0 HG LEU A 836 7.976 -3.793 8.278 1.00 25.00 H new ATOM 0 HD11 LEU A 836 8.963 -5.226 6.423 1.00 25.00 H new ATOM 0 HD12 LEU A 836 9.038 -3.495 6.017 1.00 25.00 H new ATOM 0 HD13 LEU A 836 10.495 -4.337 6.595 1.00 25.00 H new ATOM 0 HD21 LEU A 836 8.907 -5.975 8.728 1.00 25.00 H new ATOM 0 HD22 LEU A 836 10.508 -5.240 8.979 1.00 25.00 H new ATOM 0 HD23 LEU A 836 9.159 -4.826 10.063 1.00 25.00 H new ATOM 1467 N ALA A 837 12.414 -1.856 9.736 1.00 25.00 N ATOM 1468 CA ALA A 837 13.819 -2.118 10.044 1.00 25.00 C ATOM 1469 C ALA A 837 14.082 -1.822 11.532 1.00 25.00 C ATOM 1470 O ALA A 837 14.923 -2.444 12.184 1.00 25.00 O ATOM 1471 CB ALA A 837 14.725 -1.210 9.141 1.00 25.00 C ATOM 0 H ALA A 837 12.267 -1.072 9.101 1.00 25.00 H new ATOM 0 HA ALA A 837 14.053 -3.164 9.846 1.00 25.00 H new ATOM 0 HB1 ALA A 837 15.774 -1.402 9.368 1.00 25.00 H new ATOM 0 HB2 ALA A 837 14.534 -1.434 8.092 1.00 25.00 H new ATOM 0 HB3 ALA A 837 14.498 -0.162 9.335 1.00 25.00 H new ATOM 1477 N GLY A 838 13.409 -0.814 12.052 1.00 25.00 N ATOM 1478 CA GLY A 838 13.710 -0.334 13.383 1.00 25.00 C ATOM 1479 C GLY A 838 14.837 0.661 13.226 1.00 25.00 C ATOM 1480 O GLY A 838 14.599 1.783 12.801 1.00 25.00 O ATOM 0 H GLY A 838 12.656 -0.316 11.576 1.00 25.00 H new ATOM 0 HA2 GLY A 838 12.836 0.135 13.835 1.00 25.00 H new ATOM 0 HA3 GLY A 838 14.004 -1.156 14.036 1.00 25.00 H new ATOM 1484 N ASP A 839 16.066 0.271 13.543 1.00 25.00 N ATOM 1485 CA ASP A 839 17.208 1.165 13.322 1.00 25.00 C ATOM 1486 C ASP A 839 18.315 0.586 12.445 1.00 25.00 C ATOM 1487 O ASP A 839 19.366 1.192 12.270 1.00 25.00 O ATOM 1488 CB ASP A 839 17.785 1.655 14.645 1.00 25.00 C ATOM 1489 CG ASP A 839 18.366 3.060 14.534 1.00 25.00 C ATOM 1490 OD1 ASP A 839 17.969 3.807 13.598 1.00 25.00 O ATOM 1491 OD2 ASP A 839 19.174 3.438 15.404 1.00 25.00 O ATOM 0 H ASP A 839 16.300 -0.637 13.945 1.00 25.00 H new ATOM 0 HA ASP A 839 16.798 2.006 12.762 1.00 25.00 H new ATOM 0 HB2 ASP A 839 17.004 1.645 15.406 1.00 25.00 H new ATOM 0 HB3 ASP A 839 18.563 0.967 14.977 1.00 25.00 H new ATOM 1496 N LYS A 840 18.116 -0.623 11.936 1.00 25.00 N ATOM 1497 CA LYS A 840 19.169 -1.286 11.159 1.00 25.00 C ATOM 1498 C LYS A 840 19.308 -0.570 9.824 1.00 25.00 C ATOM 1499 O LYS A 840 18.370 0.055 9.355 1.00 25.00 O ATOM 1500 CB LYS A 840 18.879 -2.780 10.984 1.00 25.00 C ATOM 1501 CG LYS A 840 17.520 -3.079 10.443 1.00 25.00 C ATOM 1502 CD LYS A 840 17.099 -4.524 10.645 1.00 25.00 C ATOM 1503 CE LYS A 840 17.684 -5.473 9.610 1.00 25.00 C ATOM 1504 NZ LYS A 840 17.129 -6.842 9.810 1.00 25.00 N ATOM 0 H LYS A 840 17.255 -1.160 12.041 1.00 25.00 H new ATOM 0 HA LYS A 840 20.116 -1.225 11.695 1.00 25.00 H new ATOM 0 HB2 LYS A 840 19.626 -3.208 10.316 1.00 25.00 H new ATOM 0 HB3 LYS A 840 18.992 -3.276 11.948 1.00 25.00 H new ATOM 0 HG2 LYS A 840 16.793 -2.425 10.924 1.00 25.00 H new ATOM 0 HG3 LYS A 840 17.501 -2.848 9.378 1.00 25.00 H new ATOM 0 HD2 LYS A 840 17.406 -4.849 11.639 1.00 25.00 H new ATOM 0 HD3 LYS A 840 16.011 -4.586 10.611 1.00 25.00 H new ATOM 0 HE2 LYS A 840 17.451 -5.119 8.606 1.00 25.00 H new ATOM 0 HE3 LYS A 840 18.770 -5.495 9.696 1.00 25.00 H new ATOM 0 HZ1 LYS A 840 17.216 -7.384 8.927 1.00 25.00 H new ATOM 0 HZ2 LYS A 840 17.657 -7.324 10.566 1.00 25.00 H new ATOM 0 HZ3 LYS A 840 16.126 -6.774 10.077 1.00 25.00 H new ATOM 1518 N ASN A 841 20.493 -0.626 9.238 1.00 25.00 N ATOM 1519 CA ASN A 841 20.790 0.127 8.013 1.00 25.00 C ATOM 1520 C ASN A 841 20.299 -0.520 6.720 1.00 25.00 C ATOM 1521 O ASN A 841 20.543 0.010 5.648 1.00 25.00 O ATOM 1522 CB ASN A 841 22.303 0.324 7.885 1.00 25.00 C ATOM 1523 CG ASN A 841 23.012 -0.934 7.618 1.00 25.00 C ATOM 1524 OD1 ASN A 841 23.037 -1.865 8.409 1.00 25.00 O ATOM 1525 ND2 ASN A 841 23.590 -0.976 6.477 1.00 25.00 N ATOM 0 H ASN A 841 21.272 -1.185 9.586 1.00 25.00 H new ATOM 0 HA ASN A 841 20.250 1.067 8.125 1.00 25.00 H new ATOM 0 HB2 ASN A 841 22.508 1.031 7.081 1.00 25.00 H new ATOM 0 HB3 ASN A 841 22.688 0.767 8.804 1.00 25.00 H new ATOM 0 HD21 ASN A 841 24.100 -1.813 6.194 1.00 25.00 H new ATOM 0 HD22 ASN A 841 23.541 -0.173 5.851 1.00 25.00 H new ATOM 1532 N TYR A 842 19.644 -1.665 6.807 1.00 25.00 N ATOM 1533 CA TYR A 842 19.160 -2.358 5.618 1.00 25.00 C ATOM 1534 C TYR A 842 17.946 -3.156 6.058 1.00 25.00 C ATOM 1535 O TYR A 842 17.806 -3.410 7.235 1.00 25.00 O ATOM 1536 CB TYR A 842 20.243 -3.297 5.065 1.00 25.00 C ATOM 1537 CG TYR A 842 20.447 -4.549 5.898 1.00 25.00 C ATOM 1538 CD1 TYR A 842 21.347 -4.568 6.982 1.00 25.00 C ATOM 1539 CD2 TYR A 842 19.738 -5.730 5.600 1.00 25.00 C ATOM 1540 CE1 TYR A 842 21.531 -5.747 7.755 1.00 25.00 C ATOM 1541 CE2 TYR A 842 19.928 -6.906 6.356 1.00 25.00 C ATOM 1542 CZ TYR A 842 20.818 -6.906 7.430 1.00 25.00 C ATOM 1543 OH TYR A 842 20.992 -8.049 8.167 1.00 25.00 O ATOM 0 H TYR A 842 19.434 -2.137 7.686 1.00 25.00 H new ATOM 0 HA TYR A 842 18.908 -1.654 4.825 1.00 25.00 H new ATOM 0 HB2 TYR A 842 19.976 -3.587 4.049 1.00 25.00 H new ATOM 0 HB3 TYR A 842 21.186 -2.754 5.004 1.00 25.00 H new ATOM 0 HD1 TYR A 842 21.904 -3.676 7.229 1.00 25.00 H new ATOM 0 HD2 TYR A 842 19.037 -5.735 4.779 1.00 25.00 H new ATOM 0 HE1 TYR A 842 22.218 -5.748 8.589 1.00 25.00 H new ATOM 0 HE2 TYR A 842 19.385 -7.805 6.103 1.00 25.00 H new ATOM 0 HH TYR A 842 20.421 -8.760 7.808 1.00 25.00 H new ATOM 1553 N ILE A 843 17.095 -3.564 5.138 1.00 25.00 N ATOM 1554 CA ILE A 843 15.957 -4.422 5.444 1.00 25.00 C ATOM 1555 C ILE A 843 16.242 -5.765 4.799 1.00 25.00 C ATOM 1556 O ILE A 843 16.914 -5.837 3.774 1.00 25.00 O ATOM 1557 CB ILE A 843 14.623 -3.808 4.895 1.00 25.00 C ATOM 1558 CG1 ILE A 843 13.410 -4.357 5.655 1.00 25.00 C ATOM 1559 CG2 ILE A 843 14.454 -4.014 3.394 1.00 25.00 C ATOM 1560 CD1 ILE A 843 13.194 -3.585 6.894 1.00 25.00 C ATOM 0 H ILE A 843 17.169 -3.312 4.153 1.00 25.00 H new ATOM 0 HA ILE A 843 15.828 -4.526 6.521 1.00 25.00 H new ATOM 0 HB ILE A 843 14.685 -2.733 5.064 1.00 25.00 H new ATOM 0 HG12 ILE A 843 12.522 -4.304 5.025 1.00 25.00 H new ATOM 0 HG13 ILE A 843 13.568 -5.408 5.896 1.00 25.00 H new ATOM 0 HG21 ILE A 843 13.514 -3.569 3.069 1.00 25.00 H new ATOM 0 HG22 ILE A 843 15.281 -3.540 2.866 1.00 25.00 H new ATOM 0 HG23 ILE A 843 14.446 -5.081 3.172 1.00 25.00 H new ATOM 0 HD11 ILE A 843 12.330 -3.984 7.425 1.00 25.00 H new ATOM 0 HD12 ILE A 843 14.077 -3.661 7.529 1.00 25.00 H new ATOM 0 HD13 ILE A 843 13.015 -2.539 6.645 1.00 25.00 H new ATOM 1572 N THR A 844 15.757 -6.839 5.382 1.00 25.00 N ATOM 1573 CA THR A 844 15.876 -8.130 4.726 1.00 25.00 C ATOM 1574 C THR A 844 14.662 -8.272 3.829 1.00 25.00 C ATOM 1575 O THR A 844 13.597 -7.736 4.130 1.00 25.00 O ATOM 1576 CB THR A 844 15.923 -9.317 5.710 1.00 25.00 C ATOM 1577 OG1 THR A 844 14.755 -9.317 6.524 1.00 25.00 O ATOM 1578 CG2 THR A 844 17.130 -9.247 6.617 1.00 25.00 C ATOM 0 H THR A 844 15.287 -6.851 6.287 1.00 25.00 H new ATOM 0 HA THR A 844 16.817 -8.158 4.176 1.00 25.00 H new ATOM 0 HB THR A 844 15.981 -10.228 5.114 1.00 25.00 H new ATOM 0 HG1 THR A 844 14.794 -8.566 7.152 1.00 25.00 H new ATOM 0 HG21 THR A 844 17.126 -10.101 7.295 1.00 25.00 H new ATOM 0 HG22 THR A 844 18.039 -9.265 6.015 1.00 25.00 H new ATOM 0 HG23 THR A 844 17.097 -8.324 7.196 1.00 25.00 H new ATOM 1586 N MET A 845 14.800 -9.034 2.756 1.00 25.00 N ATOM 1587 CA MET A 845 13.668 -9.340 1.887 1.00 25.00 C ATOM 1588 C MET A 845 12.556 -9.979 2.701 1.00 25.00 C ATOM 1589 O MET A 845 11.384 -9.765 2.446 1.00 25.00 O ATOM 1590 CB MET A 845 14.101 -10.320 0.797 1.00 25.00 C ATOM 1591 CG MET A 845 15.154 -9.757 -0.108 1.00 25.00 C ATOM 1592 SD MET A 845 15.586 -10.846 -1.450 1.00 25.00 S ATOM 1593 CE MET A 845 16.819 -9.828 -2.238 1.00 25.00 C ATOM 0 H MET A 845 15.683 -9.453 2.463 1.00 25.00 H new ATOM 0 HA MET A 845 13.313 -8.415 1.433 1.00 25.00 H new ATOM 0 HB2 MET A 845 14.478 -11.230 1.263 1.00 25.00 H new ATOM 0 HB3 MET A 845 13.232 -10.602 0.203 1.00 25.00 H new ATOM 0 HG2 MET A 845 14.803 -8.809 -0.517 1.00 25.00 H new ATOM 0 HG3 MET A 845 16.048 -9.540 0.477 1.00 25.00 H new ATOM 0 HE1 MET A 845 17.744 -10.395 -2.346 1.00 25.00 H new ATOM 0 HE2 MET A 845 16.464 -9.522 -3.222 1.00 25.00 H new ATOM 0 HE3 MET A 845 17.005 -8.944 -1.628 1.00 25.00 H new ATOM 1603 N ASP A 846 12.942 -10.761 3.695 1.00 25.00 N ATOM 1604 CA ASP A 846 11.980 -11.470 4.528 1.00 25.00 C ATOM 1605 C ASP A 846 11.216 -10.551 5.474 1.00 25.00 C ATOM 1606 O ASP A 846 10.093 -10.850 5.841 1.00 25.00 O ATOM 1607 CB ASP A 846 12.682 -12.562 5.318 1.00 25.00 C ATOM 1608 CG ASP A 846 12.937 -13.801 4.475 1.00 25.00 C ATOM 1609 OD1 ASP A 846 11.988 -14.283 3.803 1.00 25.00 O ATOM 1610 OD2 ASP A 846 14.094 -14.261 4.433 1.00 25.00 O ATOM 0 H ASP A 846 13.917 -10.922 3.947 1.00 25.00 H new ATOM 0 HA ASP A 846 11.244 -11.910 3.854 1.00 25.00 H new ATOM 0 HB2 ASP A 846 13.630 -12.182 5.699 1.00 25.00 H new ATOM 0 HB3 ASP A 846 12.075 -12.831 6.183 1.00 25.00 H new ATOM 1615 N GLU A 847 11.794 -9.416 5.833 1.00 25.00 N ATOM 1616 CA GLU A 847 11.077 -8.435 6.654 1.00 25.00 C ATOM 1617 C GLU A 847 9.982 -7.781 5.814 1.00 25.00 C ATOM 1618 O GLU A 847 8.874 -7.569 6.294 1.00 25.00 O ATOM 1619 CB GLU A 847 12.034 -7.387 7.249 1.00 25.00 C ATOM 1620 CG GLU A 847 12.701 -7.902 8.539 1.00 25.00 C ATOM 1621 CD GLU A 847 13.996 -7.182 8.899 1.00 25.00 C ATOM 1622 OE1 GLU A 847 14.820 -6.933 7.993 1.00 25.00 O ATOM 1623 OE2 GLU A 847 14.278 -7.019 10.102 1.00 25.00 O ATOM 0 H GLU A 847 12.744 -9.147 5.577 1.00 25.00 H new ATOM 0 HA GLU A 847 10.617 -8.949 7.498 1.00 25.00 H new ATOM 0 HB2 GLU A 847 12.801 -7.135 6.517 1.00 25.00 H new ATOM 0 HB3 GLU A 847 11.484 -6.470 7.463 1.00 25.00 H new ATOM 0 HG2 GLU A 847 11.998 -7.798 9.365 1.00 25.00 H new ATOM 0 HG3 GLU A 847 12.908 -8.966 8.429 1.00 25.00 H new ATOM 1630 N LEU A 848 10.256 -7.540 4.539 1.00 25.00 N ATOM 1631 CA LEU A 848 9.228 -7.009 3.637 1.00 25.00 C ATOM 1632 C LEU A 848 8.163 -8.076 3.418 1.00 25.00 C ATOM 1633 O LEU A 848 6.979 -7.799 3.438 1.00 25.00 O ATOM 1634 CB LEU A 848 9.841 -6.609 2.293 1.00 25.00 C ATOM 1635 CG LEU A 848 10.872 -5.475 2.356 1.00 25.00 C ATOM 1636 CD1 LEU A 848 11.631 -5.429 1.045 1.00 25.00 C ATOM 1637 CD2 LEU A 848 10.211 -4.124 2.629 1.00 25.00 C ATOM 0 H LEU A 848 11.165 -7.699 4.105 1.00 25.00 H new ATOM 0 HA LEU A 848 8.783 -6.122 4.088 1.00 25.00 H new ATOM 0 HB2 LEU A 848 10.316 -7.486 1.853 1.00 25.00 H new ATOM 0 HB3 LEU A 848 9.037 -6.311 1.620 1.00 25.00 H new ATOM 0 HG LEU A 848 11.556 -5.673 3.181 1.00 25.00 H new ATOM 0 HD11 LEU A 848 12.367 -4.626 1.079 1.00 25.00 H new ATOM 0 HD12 LEU A 848 12.139 -6.380 0.885 1.00 25.00 H new ATOM 0 HD13 LEU A 848 10.934 -5.248 0.227 1.00 25.00 H new ATOM 0 HD21 LEU A 848 10.974 -3.347 2.666 1.00 25.00 H new ATOM 0 HD22 LEU A 848 9.502 -3.898 1.833 1.00 25.00 H new ATOM 0 HD23 LEU A 848 9.685 -4.162 3.583 1.00 25.00 H new ATOM 1649 N ARG A 849 8.598 -9.321 3.292 1.00 25.00 N ATOM 1650 CA ARG A 849 7.697 -10.475 3.121 1.00 25.00 C ATOM 1651 C ARG A 849 7.002 -10.875 4.427 1.00 25.00 C ATOM 1652 O ARG A 849 6.382 -11.933 4.508 1.00 25.00 O ATOM 1653 CB ARG A 849 8.505 -11.665 2.590 1.00 25.00 C ATOM 1654 CG ARG A 849 8.915 -11.522 1.121 1.00 25.00 C ATOM 1655 CD ARG A 849 10.174 -12.331 0.756 1.00 25.00 C ATOM 1656 NE ARG A 849 10.339 -13.566 1.540 1.00 25.00 N ATOM 1657 CZ ARG A 849 9.761 -14.731 1.287 1.00 25.00 C ATOM 1658 NH1 ARG A 849 8.933 -14.913 0.286 1.00 25.00 N ATOM 1659 NH2 ARG A 849 10.036 -15.732 2.071 1.00 25.00 N ATOM 0 H ARG A 849 9.587 -9.571 3.304 1.00 25.00 H new ATOM 0 HA ARG A 849 6.919 -10.186 2.414 1.00 25.00 H new ATOM 0 HB2 ARG A 849 9.401 -11.785 3.199 1.00 25.00 H new ATOM 0 HB3 ARG A 849 7.916 -12.575 2.707 1.00 25.00 H new ATOM 0 HG2 ARG A 849 8.089 -11.845 0.488 1.00 25.00 H new ATOM 0 HG3 ARG A 849 9.092 -10.469 0.902 1.00 25.00 H new ATOM 0 HD2 ARG A 849 10.135 -12.587 -0.303 1.00 25.00 H new ATOM 0 HD3 ARG A 849 11.052 -11.702 0.899 1.00 25.00 H new ATOM 0 HE ARG A 849 10.954 -13.521 2.352 1.00 25.00 H new ATOM 0 HH11 ARG A 849 8.709 -14.138 -0.338 1.00 25.00 H new ATOM 0 HH12 ARG A 849 8.513 -15.830 0.132 1.00 25.00 H new ATOM 0 HH21 ARG A 849 10.679 -15.606 2.852 1.00 25.00 H new ATOM 0 HH22 ARG A 849 9.608 -16.643 1.904 1.00 25.00 H new ATOM 1673 N ARG A 850 7.102 -10.028 5.442 1.00 25.00 N ATOM 1674 CA ARG A 850 6.469 -10.279 6.740 1.00 25.00 C ATOM 1675 C ARG A 850 5.338 -9.289 6.914 1.00 25.00 C ATOM 1676 O ARG A 850 4.274 -9.647 7.397 1.00 25.00 O ATOM 1677 CB ARG A 850 7.501 -10.123 7.861 1.00 25.00 C ATOM 1678 CG ARG A 850 6.955 -10.210 9.270 1.00 25.00 C ATOM 1679 CD ARG A 850 7.931 -9.533 10.210 1.00 25.00 C ATOM 1680 NE ARG A 850 7.340 -9.311 11.538 1.00 25.00 N ATOM 1681 CZ ARG A 850 7.823 -8.482 12.456 1.00 25.00 C ATOM 1682 NH1 ARG A 850 8.909 -7.772 12.258 1.00 25.00 N ATOM 1683 NH2 ARG A 850 7.198 -8.361 13.594 1.00 25.00 N ATOM 0 H ARG A 850 7.620 -9.151 5.395 1.00 25.00 H new ATOM 0 HA ARG A 850 6.077 -11.295 6.782 1.00 25.00 H new ATOM 0 HB2 ARG A 850 8.263 -10.892 7.738 1.00 25.00 H new ATOM 0 HB3 ARG A 850 7.998 -9.160 7.742 1.00 25.00 H new ATOM 0 HG2 ARG A 850 5.979 -9.729 9.328 1.00 25.00 H new ATOM 0 HG3 ARG A 850 6.814 -11.252 9.557 1.00 25.00 H new ATOM 0 HD2 ARG A 850 8.827 -10.146 10.308 1.00 25.00 H new ATOM 0 HD3 ARG A 850 8.243 -8.578 9.786 1.00 25.00 H new ATOM 0 HE ARG A 850 6.495 -9.833 11.772 1.00 25.00 H new ATOM 0 HH11 ARG A 850 9.413 -7.846 11.374 1.00 25.00 H new ATOM 0 HH12 ARG A 850 9.249 -7.146 12.988 1.00 25.00 H new ATOM 0 HH21 ARG A 850 6.350 -8.899 13.770 1.00 25.00 H new ATOM 0 HH22 ARG A 850 7.557 -7.728 14.308 1.00 25.00 H new ATOM 1697 N GLU A 851 5.570 -8.047 6.520 1.00 25.00 N ATOM 1698 CA GLU A 851 4.522 -7.031 6.581 1.00 25.00 C ATOM 1699 C GLU A 851 3.634 -7.144 5.341 1.00 25.00 C ATOM 1700 O GLU A 851 2.463 -6.803 5.382 1.00 25.00 O ATOM 1701 CB GLU A 851 5.124 -5.623 6.688 1.00 25.00 C ATOM 1702 CG GLU A 851 6.028 -5.233 5.528 1.00 25.00 C ATOM 1703 CD GLU A 851 6.405 -3.755 5.543 1.00 25.00 C ATOM 1704 OE1 GLU A 851 6.104 -3.059 6.541 1.00 25.00 O ATOM 1705 OE2 GLU A 851 7.058 -3.306 4.578 1.00 25.00 O ATOM 0 H GLU A 851 6.464 -7.717 6.157 1.00 25.00 H new ATOM 0 HA GLU A 851 3.919 -7.200 7.473 1.00 25.00 H new ATOM 0 HB2 GLU A 851 4.312 -4.899 6.759 1.00 25.00 H new ATOM 0 HB3 GLU A 851 5.694 -5.555 7.615 1.00 25.00 H new ATOM 0 HG2 GLU A 851 6.936 -5.835 5.563 1.00 25.00 H new ATOM 0 HG3 GLU A 851 5.527 -5.466 4.589 1.00 25.00 H new ATOM 1712 N LEU A 852 4.201 -7.650 4.252 1.00 25.00 N ATOM 1713 CA LEU A 852 3.469 -7.828 3.002 1.00 25.00 C ATOM 1714 C LEU A 852 3.463 -9.303 2.585 1.00 25.00 C ATOM 1715 O LEU A 852 4.305 -9.737 1.803 1.00 25.00 O ATOM 1716 CB LEU A 852 4.103 -7.017 1.849 1.00 25.00 C ATOM 1717 CG LEU A 852 4.004 -5.484 1.721 1.00 25.00 C ATOM 1718 CD1 LEU A 852 3.256 -4.775 2.809 1.00 25.00 C ATOM 1719 CD2 LEU A 852 5.406 -4.893 1.591 1.00 25.00 C ATOM 0 H LEU A 852 5.176 -7.947 4.209 1.00 25.00 H new ATOM 0 HA LEU A 852 2.454 -7.475 3.183 1.00 25.00 H new ATOM 0 HB2 LEU A 852 5.167 -7.254 1.858 1.00 25.00 H new ATOM 0 HB3 LEU A 852 3.693 -7.427 0.926 1.00 25.00 H new ATOM 0 HG LEU A 852 3.406 -5.318 0.825 1.00 25.00 H new ATOM 0 HD11 LEU A 852 3.254 -3.703 2.610 1.00 25.00 H new ATOM 0 HD12 LEU A 852 2.229 -5.140 2.842 1.00 25.00 H new ATOM 0 HD13 LEU A 852 3.740 -4.965 3.767 1.00 25.00 H new ATOM 0 HD21 LEU A 852 5.337 -3.809 1.500 1.00 25.00 H new ATOM 0 HD22 LEU A 852 5.991 -5.147 2.475 1.00 25.00 H new ATOM 0 HD23 LEU A 852 5.892 -5.301 0.705 1.00 25.00 H new ATOM 1731 N PRO A 853 2.448 -10.071 3.011 1.00 25.00 N ATOM 1732 CA PRO A 853 2.272 -11.372 2.339 1.00 25.00 C ATOM 1733 C PRO A 853 2.136 -11.381 0.768 1.00 25.00 C ATOM 1734 O PRO A 853 2.518 -12.370 0.140 1.00 25.00 O ATOM 1735 CB PRO A 853 0.977 -11.907 2.976 1.00 25.00 C ATOM 1736 CG PRO A 853 0.864 -11.182 4.282 1.00 25.00 C ATOM 1737 CD PRO A 853 1.375 -9.813 3.994 1.00 25.00 C ATOM 0 HA PRO A 853 3.176 -11.964 2.481 1.00 25.00 H new ATOM 0 HB2 PRO A 853 0.114 -11.712 2.340 1.00 25.00 H new ATOM 0 HB3 PRO A 853 1.026 -12.986 3.125 1.00 25.00 H new ATOM 0 HG2 PRO A 853 -0.168 -11.155 4.633 1.00 25.00 H new ATOM 0 HG3 PRO A 853 1.452 -11.670 5.059 1.00 25.00 H new ATOM 0 HD2 PRO A 853 0.597 -9.167 3.586 1.00 25.00 H new ATOM 0 HD3 PRO A 853 1.756 -9.325 4.891 1.00 25.00 H new ATOM 1745 N PRO A 854 1.527 -10.342 0.128 1.00 25.00 N ATOM 1746 CA PRO A 854 1.304 -10.390 -1.325 1.00 25.00 C ATOM 1747 C PRO A 854 2.447 -9.900 -2.218 1.00 25.00 C ATOM 1748 O PRO A 854 3.558 -9.644 -1.764 1.00 25.00 O ATOM 1749 CB PRO A 854 0.135 -9.423 -1.475 1.00 25.00 C ATOM 1750 CG PRO A 854 0.423 -8.412 -0.545 1.00 25.00 C ATOM 1751 CD PRO A 854 0.909 -9.113 0.657 1.00 25.00 C ATOM 0 HA PRO A 854 1.167 -11.423 -1.645 1.00 25.00 H new ATOM 0 HB2 PRO A 854 0.068 -9.028 -2.489 1.00 25.00 H new ATOM 0 HB3 PRO A 854 -0.817 -9.908 -1.259 1.00 25.00 H new ATOM 0 HG2 PRO A 854 1.177 -7.726 -0.931 1.00 25.00 H new ATOM 0 HG3 PRO A 854 -0.464 -7.819 -0.322 1.00 25.00 H new ATOM 0 HD2 PRO A 854 1.630 -8.509 1.207 1.00 25.00 H new ATOM 0 HD3 PRO A 854 0.094 -9.340 1.344 1.00 25.00 H new ATOM 1759 N ASP A 855 2.107 -9.680 -3.485 1.00 25.00 N ATOM 1760 CA ASP A 855 3.006 -9.121 -4.499 1.00 25.00 C ATOM 1761 C ASP A 855 3.658 -7.801 -4.109 1.00 25.00 C ATOM 1762 O ASP A 855 4.702 -7.444 -4.640 1.00 25.00 O ATOM 1763 CB ASP A 855 2.225 -8.859 -5.786 1.00 25.00 C ATOM 1764 CG ASP A 855 2.015 -10.102 -6.601 1.00 25.00 C ATOM 1765 OD1 ASP A 855 1.572 -11.137 -6.054 1.00 25.00 O ATOM 1766 OD2 ASP A 855 2.266 -10.054 -7.819 1.00 25.00 O ATOM 0 H ASP A 855 1.177 -9.889 -3.847 1.00 25.00 H new ATOM 0 HA ASP A 855 3.794 -9.864 -4.618 1.00 25.00 H new ATOM 0 HB2 ASP A 855 1.257 -8.426 -5.536 1.00 25.00 H new ATOM 0 HB3 ASP A 855 2.759 -8.122 -6.386 1.00 25.00 H new ATOM 1771 N GLN A 856 3.069 -7.069 -3.180 1.00 25.00 N ATOM 1772 CA GLN A 856 3.664 -5.821 -2.739 1.00 25.00 C ATOM 1773 C GLN A 856 5.058 -6.072 -2.135 1.00 25.00 C ATOM 1774 O GLN A 856 5.940 -5.238 -2.273 1.00 25.00 O ATOM 1775 CB GLN A 856 2.732 -5.086 -1.777 1.00 25.00 C ATOM 1776 CG GLN A 856 1.593 -4.342 -2.485 1.00 25.00 C ATOM 1777 CD GLN A 856 0.277 -5.106 -2.494 1.00 25.00 C ATOM 1778 OE1 GLN A 856 0.228 -6.288 -2.813 1.00 25.00 O ATOM 1779 NE2 GLN A 856 -0.791 -4.433 -2.165 1.00 25.00 N ATOM 0 H GLN A 856 2.191 -7.313 -2.722 1.00 25.00 H new ATOM 0 HA GLN A 856 3.802 -5.170 -3.602 1.00 25.00 H new ATOM 0 HB2 GLN A 856 2.307 -5.803 -1.075 1.00 25.00 H new ATOM 0 HB3 GLN A 856 3.314 -4.374 -1.192 1.00 25.00 H new ATOM 0 HG2 GLN A 856 1.441 -3.379 -1.997 1.00 25.00 H new ATOM 0 HG3 GLN A 856 1.890 -4.135 -3.513 1.00 25.00 H new ATOM 0 HE21 GLN A 856 -0.714 -3.450 -1.904 1.00 25.00 H new ATOM 0 HE22 GLN A 856 -1.703 -4.890 -2.168 1.00 25.00 H new ATOM 1788 N ALA A 857 5.302 -7.250 -1.573 1.00 25.00 N ATOM 1789 CA ALA A 857 6.643 -7.575 -1.086 1.00 25.00 C ATOM 1790 C ALA A 857 7.665 -7.634 -2.221 1.00 25.00 C ATOM 1791 O ALA A 857 8.744 -7.069 -2.112 1.00 25.00 O ATOM 1792 CB ALA A 857 6.632 -8.896 -0.345 1.00 25.00 C ATOM 0 H ALA A 857 4.607 -7.985 -1.443 1.00 25.00 H new ATOM 0 HA ALA A 857 6.939 -6.776 -0.406 1.00 25.00 H new ATOM 0 HB1 ALA A 857 7.637 -9.122 0.010 1.00 25.00 H new ATOM 0 HB2 ALA A 857 5.953 -8.831 0.505 1.00 25.00 H new ATOM 0 HB3 ALA A 857 6.298 -9.687 -1.016 1.00 25.00 H new ATOM 1798 N GLU A 858 7.349 -8.345 -3.295 1.00 25.00 N ATOM 1799 CA GLU A 858 8.309 -8.498 -4.391 1.00 25.00 C ATOM 1800 C GLU A 858 8.481 -7.199 -5.142 1.00 25.00 C ATOM 1801 O GLU A 858 9.575 -6.864 -5.566 1.00 25.00 O ATOM 1802 CB GLU A 858 7.919 -9.620 -5.348 1.00 25.00 C ATOM 1803 CG GLU A 858 6.508 -9.610 -5.872 1.00 25.00 C ATOM 1804 CD GLU A 858 6.205 -10.824 -6.734 1.00 25.00 C ATOM 1805 OE1 GLU A 858 6.612 -10.856 -7.914 1.00 25.00 O ATOM 1806 OE2 GLU A 858 5.502 -11.739 -6.249 1.00 25.00 O ATOM 0 H GLU A 858 6.456 -8.818 -3.435 1.00 25.00 H new ATOM 0 HA GLU A 858 9.263 -8.772 -3.940 1.00 25.00 H new ATOM 0 HB2 GLU A 858 8.597 -9.589 -6.201 1.00 25.00 H new ATOM 0 HB3 GLU A 858 8.086 -10.571 -4.842 1.00 25.00 H new ATOM 0 HG2 GLU A 858 5.812 -9.579 -5.034 1.00 25.00 H new ATOM 0 HG3 GLU A 858 6.346 -8.703 -6.455 1.00 25.00 H new ATOM 1813 N TYR A 859 7.407 -6.438 -5.224 1.00 25.00 N ATOM 1814 CA TYR A 859 7.463 -5.083 -5.791 1.00 25.00 C ATOM 1815 C TYR A 859 8.493 -4.263 -5.016 1.00 25.00 C ATOM 1816 O TYR A 859 9.394 -3.675 -5.607 1.00 25.00 O ATOM 1817 CB TYR A 859 6.080 -4.397 -5.759 1.00 25.00 C ATOM 1818 CG TYR A 859 6.066 -2.966 -5.200 1.00 25.00 C ATOM 1819 CD1 TYR A 859 6.742 -1.911 -5.854 1.00 25.00 C ATOM 1820 CD2 TYR A 859 5.379 -2.666 -4.003 1.00 25.00 C ATOM 1821 CE1 TYR A 859 6.726 -0.593 -5.316 1.00 25.00 C ATOM 1822 CE2 TYR A 859 5.353 -1.348 -3.479 1.00 25.00 C ATOM 1823 CZ TYR A 859 6.027 -0.328 -4.142 1.00 25.00 C ATOM 1824 OH TYR A 859 6.011 0.947 -3.643 1.00 25.00 O ATOM 0 H TYR A 859 6.480 -6.725 -4.908 1.00 25.00 H new ATOM 0 HA TYR A 859 7.760 -5.151 -6.837 1.00 25.00 H new ATOM 0 HB2 TYR A 859 5.680 -4.377 -6.773 1.00 25.00 H new ATOM 0 HB3 TYR A 859 5.404 -5.009 -5.162 1.00 25.00 H new ATOM 0 HD1 TYR A 859 7.276 -2.107 -6.772 1.00 25.00 H new ATOM 0 HD2 TYR A 859 4.863 -3.455 -3.476 1.00 25.00 H new ATOM 0 HE1 TYR A 859 7.257 0.202 -5.819 1.00 25.00 H new ATOM 0 HE2 TYR A 859 4.812 -1.137 -2.568 1.00 25.00 H new ATOM 0 HH TYR A 859 6.907 1.185 -3.324 1.00 25.00 H new ATOM 1834 N CYS A 860 8.391 -4.261 -3.696 1.00 25.00 N ATOM 1835 CA CYS A 860 9.318 -3.502 -2.874 1.00 25.00 C ATOM 1836 C CYS A 860 10.744 -4.006 -3.058 1.00 25.00 C ATOM 1837 O CYS A 860 11.660 -3.216 -3.226 1.00 25.00 O ATOM 1838 CB CYS A 860 8.922 -3.605 -1.403 1.00 25.00 C ATOM 1839 SG CYS A 860 7.353 -2.812 -1.013 1.00 25.00 S ATOM 0 H CYS A 860 7.680 -4.773 -3.174 1.00 25.00 H new ATOM 0 HA CYS A 860 9.274 -2.459 -3.188 1.00 25.00 H new ATOM 0 HB2 CYS A 860 8.865 -4.657 -1.125 1.00 25.00 H new ATOM 0 HB3 CYS A 860 9.706 -3.156 -0.793 1.00 25.00 H new ATOM 0 HG CYS A 860 6.718 -2.541 -2.115 1.00 25.00 H new ATOM 1845 N ILE A 861 10.918 -5.320 -3.064 1.00 25.00 N ATOM 1846 CA ILE A 861 12.240 -5.939 -3.208 1.00 25.00 C ATOM 1847 C ILE A 861 12.883 -5.546 -4.535 1.00 25.00 C ATOM 1848 O ILE A 861 14.077 -5.261 -4.600 1.00 25.00 O ATOM 1849 CB ILE A 861 12.116 -7.503 -3.124 1.00 25.00 C ATOM 1850 CG1 ILE A 861 11.858 -7.916 -1.663 1.00 25.00 C ATOM 1851 CG2 ILE A 861 13.378 -8.220 -3.691 1.00 25.00 C ATOM 1852 CD1 ILE A 861 11.332 -9.338 -1.486 1.00 25.00 C ATOM 0 H ILE A 861 10.154 -5.990 -2.970 1.00 25.00 H new ATOM 0 HA ILE A 861 12.872 -5.581 -2.395 1.00 25.00 H new ATOM 0 HB ILE A 861 11.275 -7.814 -3.744 1.00 25.00 H new ATOM 0 HG12 ILE A 861 12.787 -7.814 -1.101 1.00 25.00 H new ATOM 0 HG13 ILE A 861 11.142 -7.221 -1.224 1.00 25.00 H new ATOM 0 HG21 ILE A 861 13.249 -9.300 -3.613 1.00 25.00 H new ATOM 0 HG22 ILE A 861 13.513 -7.945 -4.737 1.00 25.00 H new ATOM 0 HG23 ILE A 861 14.256 -7.917 -3.120 1.00 25.00 H new ATOM 0 HD11 ILE A 861 11.180 -9.540 -0.426 1.00 25.00 H new ATOM 0 HD12 ILE A 861 10.385 -9.444 -2.015 1.00 25.00 H new ATOM 0 HD13 ILE A 861 12.055 -10.046 -1.890 1.00 25.00 H new ATOM 1864 N ALA A 862 12.083 -5.524 -5.588 1.00 25.00 N ATOM 1865 CA ALA A 862 12.575 -5.283 -6.940 1.00 25.00 C ATOM 1866 C ALA A 862 13.140 -3.875 -7.151 1.00 25.00 C ATOM 1867 O ALA A 862 13.970 -3.658 -8.025 1.00 25.00 O ATOM 1868 CB ALA A 862 11.444 -5.537 -7.920 1.00 25.00 C ATOM 0 H ALA A 862 11.075 -5.672 -5.533 1.00 25.00 H new ATOM 0 HA ALA A 862 13.407 -5.967 -7.107 1.00 25.00 H new ATOM 0 HB1 ALA A 862 11.797 -5.361 -8.936 1.00 25.00 H new ATOM 0 HB2 ALA A 862 11.107 -6.569 -7.827 1.00 25.00 H new ATOM 0 HB3 ALA A 862 10.615 -4.864 -7.702 1.00 25.00 H new ATOM 1874 N ARG A 863 12.658 -2.916 -6.377 1.00 25.00 N ATOM 1875 CA ARG A 863 13.103 -1.528 -6.502 1.00 25.00 C ATOM 1876 C ARG A 863 14.044 -1.125 -5.365 1.00 25.00 C ATOM 1877 O ARG A 863 14.590 -0.031 -5.362 1.00 25.00 O ATOM 1878 CB ARG A 863 11.879 -0.608 -6.543 1.00 25.00 C ATOM 1879 CG ARG A 863 11.100 -0.669 -7.855 1.00 25.00 C ATOM 1880 CD ARG A 863 9.817 -1.458 -7.669 1.00 25.00 C ATOM 1881 NE ARG A 863 8.812 -1.224 -8.722 1.00 25.00 N ATOM 1882 CZ ARG A 863 8.044 -0.142 -8.822 1.00 25.00 C ATOM 1883 NH1 ARG A 863 8.166 0.880 -8.021 1.00 25.00 N ATOM 1884 NH2 ARG A 863 7.136 -0.095 -9.750 1.00 25.00 N ATOM 0 H ARG A 863 11.957 -3.069 -5.652 1.00 25.00 H new ATOM 0 HA ARG A 863 13.668 -1.430 -7.429 1.00 25.00 H new ATOM 0 HB2 ARG A 863 11.211 -0.872 -5.723 1.00 25.00 H new ATOM 0 HB3 ARG A 863 12.203 0.419 -6.372 1.00 25.00 H new ATOM 0 HG2 ARG A 863 10.868 0.340 -8.196 1.00 25.00 H new ATOM 0 HG3 ARG A 863 11.712 -1.134 -8.628 1.00 25.00 H new ATOM 0 HD2 ARG A 863 10.057 -2.521 -7.640 1.00 25.00 H new ATOM 0 HD3 ARG A 863 9.382 -1.203 -6.703 1.00 25.00 H new ATOM 0 HE ARG A 863 8.696 -1.949 -9.430 1.00 25.00 H new ATOM 0 HH11 ARG A 863 8.871 0.869 -7.284 1.00 25.00 H new ATOM 0 HH12 ARG A 863 7.557 1.690 -8.132 1.00 25.00 H new ATOM 0 HH21 ARG A 863 7.019 -0.881 -10.390 1.00 25.00 H new ATOM 0 HH22 ARG A 863 6.540 0.728 -9.839 1.00 25.00 H new ATOM 1898 N MET A 864 14.248 -2.002 -4.399 1.00 25.00 N ATOM 1899 CA MET A 864 15.122 -1.685 -3.275 1.00 25.00 C ATOM 1900 C MET A 864 16.596 -1.858 -3.650 1.00 25.00 C ATOM 1901 O MET A 864 16.920 -2.588 -4.580 1.00 25.00 O ATOM 1902 CB MET A 864 14.754 -2.542 -2.086 1.00 25.00 C ATOM 1903 CG MET A 864 14.855 -1.797 -0.786 1.00 25.00 C ATOM 1904 SD MET A 864 13.747 -2.427 0.462 1.00 25.00 S ATOM 1905 CE MET A 864 12.209 -1.532 0.105 1.00 25.00 C ATOM 0 H MET A 864 13.827 -2.931 -4.366 1.00 25.00 H new ATOM 0 HA MET A 864 14.982 -0.638 -3.008 1.00 25.00 H new ATOM 0 HB2 MET A 864 13.736 -2.912 -2.210 1.00 25.00 H new ATOM 0 HB3 MET A 864 15.409 -3.413 -2.054 1.00 25.00 H new ATOM 0 HG2 MET A 864 15.879 -1.855 -0.418 1.00 25.00 H new ATOM 0 HG3 MET A 864 14.638 -0.743 -0.959 1.00 25.00 H new ATOM 0 HE1 MET A 864 11.439 -1.835 0.814 1.00 25.00 H new ATOM 0 HE2 MET A 864 12.383 -0.460 0.195 1.00 25.00 H new ATOM 0 HE3 MET A 864 11.881 -1.763 -0.908 1.00 25.00 H new ATOM 1915 N ALA A 865 17.492 -1.147 -2.971 1.00 25.00 N ATOM 1916 CA ALA A 865 18.901 -1.170 -3.363 1.00 25.00 C ATOM 1917 C ALA A 865 19.541 -2.524 -3.014 1.00 25.00 C ATOM 1918 O ALA A 865 19.326 -3.044 -1.931 1.00 25.00 O ATOM 1919 CB ALA A 865 19.675 -0.021 -2.703 1.00 25.00 C ATOM 0 H ALA A 865 17.277 -0.560 -2.165 1.00 25.00 H new ATOM 0 HA ALA A 865 18.951 -1.034 -4.443 1.00 25.00 H new ATOM 0 HB1 ALA A 865 20.720 -0.062 -3.011 1.00 25.00 H new ATOM 0 HB2 ALA A 865 19.243 0.932 -3.009 1.00 25.00 H new ATOM 0 HB3 ALA A 865 19.613 -0.116 -1.619 1.00 25.00 H new ATOM 1925 N PRO A 866 20.343 -3.093 -3.926 1.00 25.00 N ATOM 1926 CA PRO A 866 20.956 -4.416 -3.774 1.00 25.00 C ATOM 1927 C PRO A 866 22.134 -4.457 -2.801 1.00 25.00 C ATOM 1928 O PRO A 866 23.288 -4.228 -3.168 1.00 25.00 O ATOM 1929 CB PRO A 866 21.392 -4.741 -5.200 1.00 25.00 C ATOM 1930 CG PRO A 866 21.718 -3.422 -5.792 1.00 25.00 C ATOM 1931 CD PRO A 866 20.695 -2.487 -5.220 1.00 25.00 C ATOM 0 HA PRO A 866 20.263 -5.136 -3.338 1.00 25.00 H new ATOM 0 HB2 PRO A 866 22.255 -5.406 -5.210 1.00 25.00 H new ATOM 0 HB3 PRO A 866 20.598 -5.241 -5.755 1.00 25.00 H new ATOM 0 HG2 PRO A 866 22.729 -3.110 -5.532 1.00 25.00 H new ATOM 0 HG3 PRO A 866 21.663 -3.452 -6.880 1.00 25.00 H new ATOM 0 HD2 PRO A 866 21.099 -1.482 -5.094 1.00 25.00 H new ATOM 0 HD3 PRO A 866 19.825 -2.401 -5.871 1.00 25.00 H new ATOM 1939 N TYR A 867 21.842 -4.761 -1.551 1.00 25.00 N ATOM 1940 CA TYR A 867 22.880 -4.820 -0.525 1.00 25.00 C ATOM 1941 C TYR A 867 23.429 -6.233 -0.339 1.00 25.00 C ATOM 1942 O TYR A 867 22.779 -7.104 0.218 1.00 25.00 O ATOM 1943 CB TYR A 867 22.326 -4.284 0.790 1.00 25.00 C ATOM 1944 CG TYR A 867 22.730 -2.856 1.051 1.00 25.00 C ATOM 1945 CD1 TYR A 867 22.782 -1.899 0.001 1.00 25.00 C ATOM 1946 CD2 TYR A 867 23.084 -2.446 2.353 1.00 25.00 C ATOM 1947 CE1 TYR A 867 23.204 -0.567 0.265 1.00 25.00 C ATOM 1948 CE2 TYR A 867 23.496 -1.120 2.610 1.00 25.00 C ATOM 1949 CZ TYR A 867 23.559 -0.196 1.569 1.00 25.00 C ATOM 1950 OH TYR A 867 23.957 1.084 1.849 1.00 25.00 O ATOM 0 H TYR A 867 20.901 -4.971 -1.217 1.00 25.00 H new ATOM 0 HA TYR A 867 23.713 -4.199 -0.854 1.00 25.00 H new ATOM 0 HB2 TYR A 867 21.238 -4.353 0.777 1.00 25.00 H new ATOM 0 HB3 TYR A 867 22.675 -4.912 1.610 1.00 25.00 H new ATOM 0 HD1 TYR A 867 22.500 -2.185 -1.002 1.00 25.00 H new ATOM 0 HD2 TYR A 867 23.039 -3.156 3.165 1.00 25.00 H new ATOM 0 HE1 TYR A 867 23.251 0.156 -0.536 1.00 25.00 H new ATOM 0 HE2 TYR A 867 23.762 -0.822 3.613 1.00 25.00 H new ATOM 0 HH TYR A 867 23.168 1.655 1.960 1.00 25.00 H new ATOM 2048 N GLY A 875 19.806 -11.710 0.771 1.00 25.00 N ATOM 2049 CA GLY A 875 18.467 -11.156 0.865 1.00 25.00 C ATOM 2050 C GLY A 875 18.437 -9.882 1.687 1.00 25.00 C ATOM 2051 O GLY A 875 17.537 -9.708 2.496 1.00 25.00 O ATOM 0 HA2 GLY A 875 18.088 -10.951 -0.136 1.00 25.00 H new ATOM 0 HA3 GLY A 875 17.800 -11.893 1.313 1.00 25.00 H new ATOM 2055 N ALA A 876 19.437 -9.027 1.524 1.00 25.00 N ATOM 2056 CA ALA A 876 19.517 -7.749 2.231 1.00 25.00 C ATOM 2057 C ALA A 876 19.363 -6.626 1.209 1.00 25.00 C ATOM 2058 O ALA A 876 19.911 -6.703 0.114 1.00 25.00 O ATOM 2059 CB ALA A 876 20.859 -7.629 2.964 1.00 25.00 C ATOM 0 H ALA A 876 20.222 -9.198 0.895 1.00 25.00 H new ATOM 0 HA ALA A 876 18.724 -7.683 2.976 1.00 25.00 H new ATOM 0 HB1 ALA A 876 20.904 -6.673 3.486 1.00 25.00 H new ATOM 0 HB2 ALA A 876 20.954 -8.441 3.685 1.00 25.00 H new ATOM 0 HB3 ALA A 876 21.674 -7.688 2.243 1.00 25.00 H new ATOM 2065 N LEU A 877 18.606 -5.599 1.556 1.00 25.00 N ATOM 2066 CA LEU A 877 18.387 -4.472 0.661 1.00 25.00 C ATOM 2067 C LEU A 877 18.353 -3.154 1.418 1.00 25.00 C ATOM 2068 O LEU A 877 17.940 -3.111 2.564 1.00 25.00 O ATOM 2069 CB LEU A 877 17.062 -4.639 -0.069 1.00 25.00 C ATOM 2070 CG LEU A 877 16.827 -5.925 -0.874 1.00 25.00 C ATOM 2071 CD1 LEU A 877 15.350 -6.212 -0.919 1.00 25.00 C ATOM 2072 CD2 LEU A 877 17.400 -5.817 -2.287 1.00 25.00 C ATOM 0 H LEU A 877 18.130 -5.521 2.455 1.00 25.00 H new ATOM 0 HA LEU A 877 19.216 -4.453 -0.046 1.00 25.00 H new ATOM 0 HB2 LEU A 877 16.264 -4.560 0.669 1.00 25.00 H new ATOM 0 HB3 LEU A 877 16.950 -3.796 -0.751 1.00 25.00 H new ATOM 0 HG LEU A 877 17.346 -6.747 -0.381 1.00 25.00 H new ATOM 0 HD11 LEU A 877 15.174 -7.124 -1.489 1.00 25.00 H new ATOM 0 HD12 LEU A 877 14.973 -6.340 0.096 1.00 25.00 H new ATOM 0 HD13 LEU A 877 14.832 -5.380 -1.396 1.00 25.00 H new ATOM 0 HD21 LEU A 877 17.215 -6.746 -2.827 1.00 25.00 H new ATOM 0 HD22 LEU A 877 16.921 -4.991 -2.812 1.00 25.00 H new ATOM 0 HD23 LEU A 877 18.474 -5.638 -2.231 1.00 25.00 H new ATOM 2084 N ASP A 878 18.749 -2.069 0.777 1.00 25.00 N ATOM 2085 CA ASP A 878 18.687 -0.752 1.417 1.00 25.00 C ATOM 2086 C ASP A 878 17.350 -0.095 1.172 1.00 25.00 C ATOM 2087 O ASP A 878 17.037 0.332 0.062 1.00 25.00 O ATOM 2088 CB ASP A 878 19.819 0.137 0.959 1.00 25.00 C ATOM 2089 CG ASP A 878 20.029 1.317 1.882 1.00 25.00 C ATOM 2090 OD1 ASP A 878 19.034 1.765 2.490 1.00 25.00 O ATOM 2091 OD2 ASP A 878 21.158 1.827 1.972 1.00 25.00 O ATOM 0 H ASP A 878 19.114 -2.065 -0.175 1.00 25.00 H new ATOM 0 HA ASP A 878 18.799 -0.901 2.491 1.00 25.00 H new ATOM 0 HB2 ASP A 878 20.738 -0.447 0.904 1.00 25.00 H new ATOM 0 HB3 ASP A 878 19.610 0.498 -0.048 1.00 25.00 H new ATOM 2096 N TYR A 879 16.557 -0.050 2.232 1.00 25.00 N ATOM 2097 CA TYR A 879 15.213 0.491 2.179 1.00 25.00 C ATOM 2098 C TYR A 879 15.213 2.011 1.980 1.00 25.00 C ATOM 2099 O TYR A 879 14.302 2.558 1.377 1.00 25.00 O ATOM 2100 CB TYR A 879 14.462 0.119 3.456 1.00 25.00 C ATOM 2101 CG TYR A 879 15.105 0.612 4.737 1.00 25.00 C ATOM 2102 CD1 TYR A 879 14.829 1.899 5.238 1.00 25.00 C ATOM 2103 CD2 TYR A 879 15.993 -0.208 5.459 1.00 25.00 C ATOM 2104 CE1 TYR A 879 15.445 2.365 6.422 1.00 25.00 C ATOM 2105 CE2 TYR A 879 16.600 0.246 6.655 1.00 25.00 C ATOM 2106 CZ TYR A 879 16.323 1.535 7.121 1.00 25.00 C ATOM 2107 OH TYR A 879 16.913 1.980 8.276 1.00 25.00 O ATOM 0 H TYR A 879 16.831 -0.389 3.154 1.00 25.00 H new ATOM 0 HA TYR A 879 14.708 0.056 1.317 1.00 25.00 H new ATOM 0 HB2 TYR A 879 13.450 0.520 3.396 1.00 25.00 H new ATOM 0 HB3 TYR A 879 14.372 -0.966 3.505 1.00 25.00 H new ATOM 0 HD1 TYR A 879 14.137 2.539 4.710 1.00 25.00 H new ATOM 0 HD2 TYR A 879 16.215 -1.200 5.094 1.00 25.00 H new ATOM 0 HE1 TYR A 879 15.237 3.361 6.785 1.00 25.00 H new ATOM 0 HE2 TYR A 879 17.272 -0.398 7.203 1.00 25.00 H new ATOM 0 HH TYR A 879 17.168 1.213 8.830 1.00 25.00 H new ATOM 2117 N MET A 880 16.209 2.691 2.535 1.00 25.00 N ATOM 2118 CA MET A 880 16.278 4.156 2.482 1.00 25.00 C ATOM 2119 C MET A 880 17.085 4.686 1.296 1.00 25.00 C ATOM 2120 O MET A 880 16.871 5.808 0.856 1.00 25.00 O ATOM 2121 CB MET A 880 16.795 4.717 3.812 1.00 25.00 C ATOM 2122 CG MET A 880 18.082 4.098 4.299 1.00 25.00 C ATOM 2123 SD MET A 880 18.560 4.687 5.932 1.00 25.00 S ATOM 2124 CE MET A 880 19.925 3.571 6.263 1.00 25.00 C ATOM 0 H MET A 880 16.986 2.254 3.030 1.00 25.00 H new ATOM 0 HA MET A 880 15.260 4.512 2.323 1.00 25.00 H new ATOM 0 HB2 MET A 880 16.942 5.792 3.705 1.00 25.00 H new ATOM 0 HB3 MET A 880 16.028 4.575 4.573 1.00 25.00 H new ATOM 0 HG2 MET A 880 17.972 3.014 4.326 1.00 25.00 H new ATOM 0 HG3 MET A 880 18.879 4.320 3.589 1.00 25.00 H new ATOM 0 HE1 MET A 880 20.347 3.793 7.243 1.00 25.00 H new ATOM 0 HE2 MET A 880 19.566 2.542 6.247 1.00 25.00 H new ATOM 0 HE3 MET A 880 20.693 3.699 5.500 1.00 25.00 H new ATOM 2134 N SER A 881 17.989 3.872 0.763 1.00 25.00 N ATOM 2135 CA SER A 881 18.782 4.256 -0.415 1.00 25.00 C ATOM 2136 C SER A 881 18.309 3.477 -1.638 1.00 25.00 C ATOM 2137 O SER A 881 19.044 3.316 -2.616 1.00 25.00 O ATOM 2138 CB SER A 881 20.275 4.022 -0.181 1.00 25.00 C ATOM 2139 OG SER A 881 21.049 4.617 -1.211 1.00 25.00 O ATOM 0 H SER A 881 18.196 2.940 1.123 1.00 25.00 H new ATOM 0 HA SER A 881 18.636 5.322 -0.590 1.00 25.00 H new ATOM 0 HB2 SER A 881 20.565 4.438 0.784 1.00 25.00 H new ATOM 0 HB3 SER A 881 20.477 2.952 -0.141 1.00 25.00 H new ATOM 0 HG SER A 881 20.640 4.424 -2.080 1.00 25.00 H new ATOM 2145 N PHE A 882 17.079 2.987 -1.554 1.00 25.00 N ATOM 2146 CA PHE A 882 16.423 2.274 -2.654 1.00 25.00 C ATOM 2147 C PHE A 882 16.490 2.993 -4.007 1.00 25.00 C ATOM 2148 O PHE A 882 16.680 4.210 -4.094 1.00 25.00 O ATOM 2149 CB PHE A 882 14.948 2.032 -2.296 1.00 25.00 C ATOM 2150 CG PHE A 882 14.055 3.220 -2.552 1.00 25.00 C ATOM 2151 CD1 PHE A 882 13.985 4.288 -1.637 1.00 25.00 C ATOM 2152 CD2 PHE A 882 13.263 3.267 -3.718 1.00 25.00 C ATOM 2153 CE1 PHE A 882 13.141 5.402 -1.889 1.00 25.00 C ATOM 2154 CE2 PHE A 882 12.418 4.372 -3.980 1.00 25.00 C ATOM 2155 CZ PHE A 882 12.357 5.442 -3.063 1.00 25.00 C ATOM 0 H PHE A 882 16.501 3.071 -0.718 1.00 25.00 H new ATOM 0 HA PHE A 882 16.972 1.340 -2.772 1.00 25.00 H new ATOM 0 HB2 PHE A 882 14.579 1.182 -2.870 1.00 25.00 H new ATOM 0 HB3 PHE A 882 14.880 1.759 -1.243 1.00 25.00 H new ATOM 0 HD1 PHE A 882 14.579 4.260 -0.735 1.00 25.00 H new ATOM 0 HD2 PHE A 882 13.302 2.448 -4.421 1.00 25.00 H new ATOM 0 HE1 PHE A 882 13.099 6.218 -1.183 1.00 25.00 H new ATOM 0 HE2 PHE A 882 11.821 4.396 -4.880 1.00 25.00 H new ATOM 0 HZ PHE A 882 11.714 6.288 -3.258 1.00 25.00 H new