USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 996 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 834 LYS NZ :NH3+ 165:sc= 0.131 (180deg=0) USER MOD Set 1.2: A 879 TYR OH : rot -179:sc= 1.45 USER MOD Set 2.1: A 742 SER OG : rot 34:sc= 0.119 USER MOD Set 2.2: A 817 SER OG : rot 180:sc= 0 USER MOD Set 2.3: A 820 THR OG1 : rot -85:sc= 0.27 USER MOD Set 3.1: A 808 THR OG1 : rot -101:sc= -0.0228 USER MOD Set 3.2: A 810 GLN : amide:sc= 0.603 X(o=0.58,f=0.65) USER MOD Set 4.1: A 763 SER OG : rot 95:sc= 0.907 USER MOD Set 4.2: A 765 THR OG1 : rot 180:sc= 0.831 USER MOD Set 5.1: A 756 ASN :FLIP amide:sc= 0.572 X(o=0.77,f=1.1) USER MOD Set 5.2: A 762 HIS :FLIP no HE2:sc= 0.5 F(o=0.35,f=1.1) USER MOD Single : A 744 SER OG : rot 180:sc= 0.645 USER MOD Single : A 745 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 747 GLN : amide:sc= -0.021 K(o=-0.021,f=-1.3) USER MOD Single : A 748 MET CE :methyl -106:sc= -1.95 (180deg=-3.8!) USER MOD Single : A 749 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 754 SER OG : rot -95:sc= 0.0192 USER MOD Single : A 757 HIS : no HD1:sc= -0.247 X(o=-0.25,f=-0.017) USER MOD Single : A 772 LYS NZ :NH3+ -163:sc= 1.73 (180deg=1.33) USER MOD Single : A 774 CYS SG : rot 180:sc= -0.0878 USER MOD Single : A 777 SER OG : rot -34:sc= 0.396 USER MOD Single : A 780 TYR OH : rot 180:sc= -0.0225 USER MOD Single : A 784 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 787 GLN : amide:sc= -0.277 X(o=-0.28,f=-0.0021) USER MOD Single : A 796 MET CE :methyl -145:sc= -0.221 (180deg=-0.578) USER MOD Single : A 797 SER OG : rot -23:sc= 0.195 USER MOD Single : A 802 ASN :FLIP amide:sc= 0 F(o=-2.3!,f=0) USER MOD Single : A 816 MET CE :methyl 172:sc= -0.436 (180deg=-0.532) USER MOD Single : A 823 THR OG1 : rot 180:sc= -0.0226 USER MOD Single : A 825 THR OG1 : rot -119:sc= 1.19 USER MOD Single : A 828 GLN : amide:sc= -0.369 X(o=-0.37,f=0) USER MOD Single : A 830 MET CE :methyl 176:sc= 0 (180deg=-0.0163) USER MOD Single : A 832 SER OG : rot 87:sc= 0.733 USER MOD Single : A 840 LYS NZ :NH3+ -131:sc= -0.175 (180deg=-1.22!) USER MOD Single : A 841 ASN : amide:sc= 0.0358 K(o=0.036,f=-2.4!) USER MOD Single : A 842 TYR OH : rot 180:sc= 0 USER MOD Single : A 844 THR OG1 : rot 180:sc= 0.191 USER MOD Single : A 845 MET CE :methyl 148:sc= -0.351 (180deg=-1.51) USER MOD Single : A 856 GLN :FLIP amide:sc= -1.18 F(o=-3!,f=-1.2) USER MOD Single : A 859 TYR OH : rot 180:sc= 0 USER MOD Single : A 860 CYS SG : rot 20:sc= 1.48 USER MOD Single : A 864 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 867 TYR OH : rot 117:sc= 0.944 USER MOD Single : A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 881 SER OG : rot -50:sc= 0.369 USER MOD ----------------------------------------------------------------- ATOM 21 N SER A 742 -1.461 -9.176 -6.275 1.00 25.00 N ATOM 22 CA SER A 742 -1.333 -7.987 -5.414 1.00 25.00 C ATOM 23 C SER A 742 -1.602 -8.248 -3.927 1.00 25.00 C ATOM 24 O SER A 742 -0.763 -7.957 -3.079 1.00 25.00 O ATOM 25 CB SER A 742 -2.220 -6.841 -5.912 1.00 25.00 C ATOM 26 OG SER A 742 -1.974 -6.569 -7.282 1.00 25.00 O ATOM 0 HA SER A 742 -0.284 -7.701 -5.489 1.00 25.00 H new ATOM 0 HB2 SER A 742 -3.269 -7.101 -5.771 1.00 25.00 H new ATOM 0 HB3 SER A 742 -2.031 -5.946 -5.320 1.00 25.00 H new ATOM 0 HG SER A 742 -1.759 -7.404 -7.748 1.00 25.00 H new ATOM 32 N ILE A 743 -2.770 -8.781 -3.606 1.00 25.00 N ATOM 33 CA ILE A 743 -3.165 -9.013 -2.241 1.00 25.00 C ATOM 34 C ILE A 743 -3.372 -10.477 -1.796 1.00 25.00 C ATOM 35 O ILE A 743 -3.822 -11.346 -2.559 1.00 25.00 O ATOM 36 CB ILE A 743 -4.420 -8.186 -1.991 1.00 25.00 C ATOM 37 CG1 ILE A 743 -4.098 -7.312 -0.811 1.00 25.00 C ATOM 38 CG2 ILE A 743 -5.709 -9.028 -1.877 1.00 25.00 C ATOM 39 CD1 ILE A 743 -5.262 -6.647 -0.174 1.00 25.00 C ATOM 0 H ILE A 743 -3.468 -9.063 -4.294 1.00 25.00 H new ATOM 0 HA ILE A 743 -2.317 -8.710 -1.626 1.00 25.00 H new ATOM 0 HB ILE A 743 -4.670 -7.561 -2.848 1.00 25.00 H new ATOM 0 HG12 ILE A 743 -3.591 -7.918 -0.060 1.00 25.00 H new ATOM 0 HG13 ILE A 743 -3.393 -6.545 -1.131 1.00 25.00 H new ATOM 0 HG21 ILE A 743 -6.559 -8.369 -1.699 1.00 25.00 H new ATOM 0 HG22 ILE A 743 -5.866 -9.581 -2.803 1.00 25.00 H new ATOM 0 HG23 ILE A 743 -5.614 -9.729 -1.048 1.00 25.00 H new ATOM 0 HD11 ILE A 743 -4.921 -6.041 0.666 1.00 25.00 H new ATOM 0 HD12 ILE A 743 -5.760 -6.008 -0.903 1.00 25.00 H new ATOM 0 HD13 ILE A 743 -5.961 -7.402 0.184 1.00 25.00 H new ATOM 51 N SER A 744 -3.047 -10.740 -0.535 1.00 25.00 N ATOM 52 CA SER A 744 -3.240 -12.063 0.065 1.00 25.00 C ATOM 53 C SER A 744 -4.538 -12.089 0.851 1.00 25.00 C ATOM 54 O SER A 744 -5.141 -11.049 1.120 1.00 25.00 O ATOM 55 CB SER A 744 -2.087 -12.421 1.007 1.00 25.00 C ATOM 56 OG SER A 744 -2.104 -11.612 2.167 1.00 25.00 O ATOM 0 H SER A 744 -2.645 -10.050 0.100 1.00 25.00 H new ATOM 0 HA SER A 744 -3.273 -12.792 -0.744 1.00 25.00 H new ATOM 0 HB2 SER A 744 -2.159 -13.471 1.292 1.00 25.00 H new ATOM 0 HB3 SER A 744 -1.137 -12.296 0.487 1.00 25.00 H new ATOM 0 HG SER A 744 -1.359 -11.863 2.752 1.00 25.00 H new ATOM 62 N GLN A 745 -4.964 -13.282 1.241 1.00 25.00 N ATOM 63 CA GLN A 745 -6.185 -13.433 2.023 1.00 25.00 C ATOM 64 C GLN A 745 -5.998 -12.852 3.420 1.00 25.00 C ATOM 65 O GLN A 745 -6.948 -12.406 4.038 1.00 25.00 O ATOM 66 CB GLN A 745 -6.578 -14.911 2.126 1.00 25.00 C ATOM 67 CG GLN A 745 -7.037 -15.529 0.795 1.00 25.00 C ATOM 68 CD GLN A 745 -8.548 -15.451 0.564 1.00 25.00 C ATOM 69 OE1 GLN A 745 -9.176 -14.387 0.999 1.00 25.00 O flip ATOM 70 NE2 GLN A 745 -9.126 -16.350 -0.016 1.00 25.00 N flip ATOM 0 H GLN A 745 -4.485 -14.157 1.030 1.00 25.00 H new ATOM 0 HA GLN A 745 -6.983 -12.890 1.516 1.00 25.00 H new ATOM 0 HB2 GLN A 745 -5.727 -15.477 2.504 1.00 25.00 H new ATOM 0 HB3 GLN A 745 -7.379 -15.013 2.858 1.00 25.00 H new ATOM 0 HG2 GLN A 745 -6.527 -15.022 -0.025 1.00 25.00 H new ATOM 0 HG3 GLN A 745 -6.728 -16.574 0.765 1.00 25.00 H new ATOM 0 HE21 GLN A 745 -8.605 -17.165 -0.341 1.00 25.00 H new ATOM 0 HE22 GLN A 745 -10.131 -16.289 -0.177 1.00 25.00 H new ATOM 79 N GLU A 746 -4.770 -12.849 3.910 1.00 25.00 N ATOM 80 CA GLU A 746 -4.490 -12.329 5.244 1.00 25.00 C ATOM 81 C GLU A 746 -4.394 -10.819 5.204 1.00 25.00 C ATOM 82 O GLU A 746 -4.896 -10.150 6.098 1.00 25.00 O ATOM 83 CB GLU A 746 -3.215 -12.958 5.785 1.00 25.00 C ATOM 84 CG GLU A 746 -3.425 -14.435 6.084 1.00 25.00 C ATOM 85 CD GLU A 746 -2.140 -15.145 6.439 1.00 25.00 C ATOM 86 OE1 GLU A 746 -1.404 -15.523 5.502 1.00 25.00 O ATOM 87 OE2 GLU A 746 -1.870 -15.338 7.640 1.00 25.00 O ATOM 0 H GLU A 746 -3.953 -13.198 3.410 1.00 25.00 H new ATOM 0 HA GLU A 746 -5.306 -12.591 5.917 1.00 25.00 H new ATOM 0 HB2 GLU A 746 -2.410 -12.840 5.060 1.00 25.00 H new ATOM 0 HB3 GLU A 746 -2.905 -12.439 6.692 1.00 25.00 H new ATOM 0 HG2 GLU A 746 -4.132 -14.538 6.907 1.00 25.00 H new ATOM 0 HG3 GLU A 746 -3.874 -14.917 5.216 1.00 25.00 H new ATOM 94 N GLN A 747 -3.790 -10.281 4.154 1.00 25.00 N ATOM 95 CA GLN A 747 -3.689 -8.832 4.000 1.00 25.00 C ATOM 96 C GLN A 747 -5.069 -8.196 3.940 1.00 25.00 C ATOM 97 O GLN A 747 -5.300 -7.138 4.502 1.00 25.00 O ATOM 98 CB GLN A 747 -2.928 -8.481 2.729 1.00 25.00 C ATOM 99 CG GLN A 747 -2.681 -6.985 2.544 1.00 25.00 C ATOM 100 CD GLN A 747 -1.775 -6.415 3.599 1.00 25.00 C ATOM 101 OE1 GLN A 747 -0.566 -6.543 3.520 1.00 25.00 O ATOM 102 NE2 GLN A 747 -2.350 -5.782 4.594 1.00 25.00 N ATOM 0 H GLN A 747 -3.364 -10.819 3.399 1.00 25.00 H new ATOM 0 HA GLN A 747 -3.152 -8.445 4.866 1.00 25.00 H new ATOM 0 HB2 GLN A 747 -1.969 -8.999 2.738 1.00 25.00 H new ATOM 0 HB3 GLN A 747 -3.484 -8.856 1.870 1.00 25.00 H new ATOM 0 HG2 GLN A 747 -2.243 -6.812 1.561 1.00 25.00 H new ATOM 0 HG3 GLN A 747 -3.635 -6.457 2.565 1.00 25.00 H new ATOM 0 HE21 GLN A 747 -3.366 -5.696 4.625 1.00 25.00 H new ATOM 0 HE22 GLN A 747 -1.781 -5.376 5.337 1.00 25.00 H new ATOM 111 N MET A 748 -6.007 -8.844 3.265 1.00 25.00 N ATOM 112 CA MET A 748 -7.347 -8.290 3.158 1.00 25.00 C ATOM 113 C MET A 748 -8.065 -8.488 4.480 1.00 25.00 C ATOM 114 O MET A 748 -9.030 -7.809 4.771 1.00 25.00 O ATOM 115 CB MET A 748 -8.142 -8.908 2.005 1.00 25.00 C ATOM 116 CG MET A 748 -8.400 -10.376 2.115 1.00 25.00 C ATOM 117 SD MET A 748 -9.871 -10.897 1.188 1.00 25.00 S ATOM 118 CE MET A 748 -9.619 -10.101 -0.420 1.00 25.00 C ATOM 0 H MET A 748 -5.869 -9.737 2.792 1.00 25.00 H new ATOM 0 HA MET A 748 -7.265 -7.226 2.935 1.00 25.00 H new ATOM 0 HB2 MET A 748 -9.100 -8.393 1.930 1.00 25.00 H new ATOM 0 HB3 MET A 748 -7.606 -8.720 1.075 1.00 25.00 H new ATOM 0 HG2 MET A 748 -7.531 -10.922 1.748 1.00 25.00 H new ATOM 0 HG3 MET A 748 -8.524 -10.642 3.165 1.00 25.00 H new ATOM 0 HE1 MET A 748 -10.296 -9.253 -0.516 1.00 25.00 H new ATOM 0 HE2 MET A 748 -8.589 -9.753 -0.496 1.00 25.00 H new ATOM 0 HE3 MET A 748 -9.820 -10.818 -1.216 1.00 25.00 H new ATOM 128 N ASN A 749 -7.598 -9.434 5.280 1.00 25.00 N ATOM 129 CA ASN A 749 -8.256 -9.736 6.543 1.00 25.00 C ATOM 130 C ASN A 749 -7.828 -8.748 7.622 1.00 25.00 C ATOM 131 O ASN A 749 -8.611 -8.392 8.489 1.00 25.00 O ATOM 132 CB ASN A 749 -7.968 -11.174 6.978 1.00 25.00 C ATOM 133 CG ASN A 749 -7.704 -11.302 8.458 1.00 25.00 C ATOM 134 OD1 ASN A 749 -8.624 -11.421 9.257 1.00 25.00 O ATOM 135 ND2 ASN A 749 -6.450 -11.286 8.828 1.00 25.00 N ATOM 0 H ASN A 749 -6.774 -10.001 5.081 1.00 25.00 H new ATOM 0 HA ASN A 749 -9.332 -9.637 6.397 1.00 25.00 H new ATOM 0 HB2 ASN A 749 -8.815 -11.805 6.710 1.00 25.00 H new ATOM 0 HB3 ASN A 749 -7.105 -11.548 6.427 1.00 25.00 H new ATOM 0 HD21 ASN A 749 -6.208 -11.375 9.815 1.00 25.00 H new ATOM 0 HD22 ASN A 749 -5.713 -11.185 8.130 1.00 25.00 H new ATOM 142 N GLU A 750 -6.591 -8.286 7.562 1.00 25.00 N ATOM 143 CA GLU A 750 -6.143 -7.249 8.494 1.00 25.00 C ATOM 144 C GLU A 750 -6.614 -5.895 7.966 1.00 25.00 C ATOM 145 O GLU A 750 -7.033 -5.032 8.735 1.00 25.00 O ATOM 146 CB GLU A 750 -4.633 -7.313 8.719 1.00 25.00 C ATOM 147 CG GLU A 750 -3.792 -7.121 7.473 1.00 25.00 C ATOM 148 CD GLU A 750 -2.370 -7.590 7.677 1.00 25.00 C ATOM 149 OE1 GLU A 750 -1.683 -7.034 8.552 1.00 25.00 O ATOM 150 OE2 GLU A 750 -1.948 -8.529 6.965 1.00 25.00 O ATOM 0 H GLU A 750 -5.887 -8.600 6.895 1.00 25.00 H new ATOM 0 HA GLU A 750 -6.584 -7.410 9.478 1.00 25.00 H new ATOM 0 HB2 GLU A 750 -4.356 -6.550 9.447 1.00 25.00 H new ATOM 0 HB3 GLU A 750 -4.387 -8.279 9.160 1.00 25.00 H new ATOM 0 HG2 GLU A 750 -4.240 -7.669 6.644 1.00 25.00 H new ATOM 0 HG3 GLU A 750 -3.791 -6.067 7.194 1.00 25.00 H new ATOM 157 N PHE A 751 -6.572 -5.694 6.656 1.00 25.00 N ATOM 158 CA PHE A 751 -6.983 -4.417 6.080 1.00 25.00 C ATOM 159 C PHE A 751 -8.517 -4.195 6.100 1.00 25.00 C ATOM 160 O PHE A 751 -8.986 -3.089 6.039 1.00 25.00 O ATOM 161 CB PHE A 751 -6.480 -4.251 4.670 1.00 25.00 C ATOM 162 CG PHE A 751 -6.833 -2.940 4.044 1.00 25.00 C ATOM 163 CD1 PHE A 751 -6.401 -1.741 4.630 1.00 25.00 C ATOM 164 CD2 PHE A 751 -7.601 -2.887 2.893 1.00 25.00 C ATOM 165 CE1 PHE A 751 -6.760 -0.498 4.065 1.00 25.00 C ATOM 166 CE2 PHE A 751 -7.930 -1.665 2.307 1.00 25.00 C ATOM 167 CZ PHE A 751 -7.518 -0.466 2.889 1.00 25.00 C ATOM 0 H PHE A 751 -6.262 -6.389 5.977 1.00 25.00 H new ATOM 0 HA PHE A 751 -6.529 -3.662 6.722 1.00 25.00 H new ATOM 0 HB2 PHE A 751 -5.396 -4.362 4.668 1.00 25.00 H new ATOM 0 HB3 PHE A 751 -6.884 -5.055 4.055 1.00 25.00 H new ATOM 0 HD1 PHE A 751 -5.789 -1.769 5.520 1.00 25.00 H new ATOM 0 HD2 PHE A 751 -7.950 -3.805 2.443 1.00 25.00 H new ATOM 0 HE1 PHE A 751 -6.451 0.423 4.538 1.00 25.00 H new ATOM 0 HE2 PHE A 751 -8.508 -1.647 1.395 1.00 25.00 H new ATOM 0 HZ PHE A 751 -7.782 0.478 2.436 1.00 25.00 H new ATOM 177 N ARG A 752 -9.307 -5.263 6.201 1.00 25.00 N ATOM 178 CA ARG A 752 -10.756 -5.097 6.326 1.00 25.00 C ATOM 179 C ARG A 752 -11.009 -4.369 7.628 1.00 25.00 C ATOM 180 O ARG A 752 -12.046 -3.786 7.775 1.00 25.00 O ATOM 181 CB ARG A 752 -11.516 -6.428 6.285 1.00 25.00 C ATOM 182 CG ARG A 752 -11.312 -7.305 7.489 1.00 25.00 C ATOM 183 CD ARG A 752 -12.455 -7.217 8.480 1.00 25.00 C ATOM 184 NE ARG A 752 -12.125 -7.977 9.690 1.00 25.00 N ATOM 185 CZ ARG A 752 -12.848 -7.994 10.804 1.00 25.00 C ATOM 186 NH1 ARG A 752 -13.956 -7.302 10.937 1.00 25.00 N ATOM 187 NH2 ARG A 752 -12.438 -8.718 11.809 1.00 25.00 N ATOM 0 H ARG A 752 -8.980 -6.229 6.199 1.00 25.00 H new ATOM 0 HA ARG A 752 -11.128 -4.528 5.474 1.00 25.00 H new ATOM 0 HB2 ARG A 752 -12.581 -6.220 6.180 1.00 25.00 H new ATOM 0 HB3 ARG A 752 -11.210 -6.978 5.395 1.00 25.00 H new ATOM 0 HG2 ARG A 752 -11.198 -8.339 7.164 1.00 25.00 H new ATOM 0 HG3 ARG A 752 -10.384 -7.022 7.986 1.00 25.00 H new ATOM 0 HD2 ARG A 752 -12.647 -6.175 8.735 1.00 25.00 H new ATOM 0 HD3 ARG A 752 -13.368 -7.609 8.031 1.00 25.00 H new ATOM 0 HE ARG A 752 -11.273 -8.537 9.675 1.00 25.00 H new ATOM 0 HH11 ARG A 752 -14.291 -6.723 10.167 1.00 25.00 H new ATOM 0 HH12 ARG A 752 -14.481 -7.343 11.810 1.00 25.00 H new ATOM 0 HH21 ARG A 752 -11.576 -9.258 11.731 1.00 25.00 H new ATOM 0 HH22 ARG A 752 -12.979 -8.744 12.673 1.00 25.00 H new ATOM 201 N ALA A 753 -10.065 -4.371 8.566 1.00 25.00 N ATOM 202 CA ALA A 753 -10.226 -3.616 9.824 1.00 25.00 C ATOM 203 C ALA A 753 -10.302 -2.145 9.608 1.00 25.00 C ATOM 204 O ALA A 753 -10.897 -1.408 10.376 1.00 25.00 O ATOM 205 CB ALA A 753 -9.107 -3.984 10.800 1.00 25.00 C ATOM 0 H ALA A 753 -9.184 -4.880 8.488 1.00 25.00 H new ATOM 0 HA ALA A 753 -11.183 -3.902 10.260 1.00 25.00 H new ATOM 0 HB1 ALA A 753 -9.233 -3.423 11.726 1.00 25.00 H new ATOM 0 HB2 ALA A 753 -9.148 -5.052 11.015 1.00 25.00 H new ATOM 0 HB3 ALA A 753 -8.142 -3.740 10.356 1.00 25.00 H new ATOM 211 N SER A 754 -9.726 -1.677 8.532 1.00 25.00 N ATOM 212 CA SER A 754 -9.739 -0.251 8.150 1.00 25.00 C ATOM 213 C SER A 754 -11.189 0.240 7.998 1.00 25.00 C ATOM 214 O SER A 754 -11.450 1.432 8.120 1.00 25.00 O ATOM 215 CB SER A 754 -8.991 -0.129 6.825 1.00 25.00 C ATOM 216 OG SER A 754 -9.862 -0.154 5.721 1.00 25.00 O ATOM 0 H SER A 754 -9.221 -2.269 7.872 1.00 25.00 H new ATOM 0 HA SER A 754 -9.260 0.361 8.914 1.00 25.00 H new ATOM 0 HB2 SER A 754 -8.421 0.800 6.815 1.00 25.00 H new ATOM 0 HB3 SER A 754 -8.273 -0.945 6.738 1.00 25.00 H new ATOM 0 HG SER A 754 -9.922 -1.068 5.372 1.00 25.00 H new ATOM 222 N PHE A 755 -12.097 -0.699 7.762 1.00 25.00 N ATOM 223 CA PHE A 755 -13.514 -0.389 7.684 1.00 25.00 C ATOM 224 C PHE A 755 -14.079 0.325 8.906 1.00 25.00 C ATOM 225 O PHE A 755 -15.094 0.981 8.809 1.00 25.00 O ATOM 226 CB PHE A 755 -14.333 -1.678 7.424 1.00 25.00 C ATOM 227 CG PHE A 755 -14.833 -2.385 8.676 1.00 25.00 C ATOM 228 CD1 PHE A 755 -13.940 -2.834 9.687 1.00 25.00 C ATOM 229 CD2 PHE A 755 -16.202 -2.615 8.853 1.00 25.00 C ATOM 230 CE1 PHE A 755 -14.421 -3.525 10.832 1.00 25.00 C ATOM 231 CE2 PHE A 755 -16.687 -3.296 9.989 1.00 25.00 C ATOM 232 CZ PHE A 755 -15.802 -3.746 10.972 1.00 25.00 C ATOM 0 H PHE A 755 -11.873 -1.684 7.621 1.00 25.00 H new ATOM 0 HA PHE A 755 -13.606 0.309 6.852 1.00 25.00 H new ATOM 0 HB2 PHE A 755 -15.191 -1.426 6.800 1.00 25.00 H new ATOM 0 HB3 PHE A 755 -13.717 -2.373 6.854 1.00 25.00 H new ATOM 0 HD1 PHE A 755 -12.881 -2.647 9.583 1.00 25.00 H new ATOM 0 HD2 PHE A 755 -16.900 -2.265 8.107 1.00 25.00 H new ATOM 0 HE1 PHE A 755 -13.733 -3.877 11.586 1.00 25.00 H new ATOM 0 HE2 PHE A 755 -17.747 -3.470 10.099 1.00 25.00 H new ATOM 0 HZ PHE A 755 -16.180 -4.265 11.841 1.00 25.00 H new ATOM 242 N ASN A 756 -13.431 0.172 10.040 1.00 25.00 N ATOM 243 CA ASN A 756 -13.853 0.837 11.273 1.00 25.00 C ATOM 244 C ASN A 756 -12.782 1.779 11.834 1.00 25.00 C ATOM 245 O ASN A 756 -12.988 2.441 12.826 1.00 25.00 O ATOM 246 CB ASN A 756 -14.297 -0.193 12.338 1.00 25.00 C ATOM 247 CG ASN A 756 -13.223 -0.503 13.362 1.00 25.00 C ATOM 248 OD1 ASN A 756 -12.124 -1.057 12.925 1.00 25.00 O flip ATOM 249 ND2 ASN A 756 -13.395 -0.250 14.534 1.00 25.00 N flip ATOM 0 H ASN A 756 -12.601 -0.411 10.143 1.00 25.00 H new ATOM 0 HA ASN A 756 -14.711 1.457 11.013 1.00 25.00 H new ATOM 0 HB2 ASN A 756 -15.180 0.186 12.852 1.00 25.00 H new ATOM 0 HB3 ASN A 756 -14.590 -1.117 11.839 1.00 25.00 H new ATOM 0 HD21 ASN A 756 -14.266 0.183 14.840 1.00 25.00 H new ATOM 0 HD22 ASN A 756 -12.668 -0.470 15.215 1.00 25.00 H new ATOM 256 N HIS A 757 -11.641 1.821 11.167 1.00 25.00 N ATOM 257 CA HIS A 757 -10.507 2.629 11.607 1.00 25.00 C ATOM 258 C HIS A 757 -10.826 4.119 11.474 1.00 25.00 C ATOM 259 O HIS A 757 -10.760 4.870 12.437 1.00 25.00 O ATOM 260 CB HIS A 757 -9.263 2.291 10.769 1.00 25.00 C ATOM 261 CG HIS A 757 -8.051 3.097 11.137 1.00 25.00 C ATOM 262 ND1 HIS A 757 -6.957 3.259 10.316 1.00 25.00 N ATOM 263 CD2 HIS A 757 -7.748 3.792 12.270 1.00 25.00 C ATOM 264 CE1 HIS A 757 -6.068 4.014 10.954 1.00 25.00 C ATOM 265 NE2 HIS A 757 -6.495 4.366 12.149 1.00 25.00 N ATOM 0 H HIS A 757 -11.471 1.299 10.307 1.00 25.00 H new ATOM 0 HA HIS A 757 -10.309 2.403 12.655 1.00 25.00 H new ATOM 0 HB2 HIS A 757 -9.034 1.232 10.886 1.00 25.00 H new ATOM 0 HB3 HIS A 757 -9.490 2.453 9.715 1.00 25.00 H new ATOM 0 HD2 HIS A 757 -8.390 3.881 13.134 1.00 25.00 H new ATOM 0 HE1 HIS A 757 -5.112 4.303 10.543 1.00 25.00 H new ATOM 0 HE2 HIS A 757 -6.007 4.939 12.837 1.00 25.00 H new ATOM 273 N PHE A 758 -11.162 4.533 10.262 1.00 25.00 N ATOM 274 CA PHE A 758 -11.461 5.940 9.985 1.00 25.00 C ATOM 275 C PHE A 758 -12.952 6.177 9.838 1.00 25.00 C ATOM 276 O PHE A 758 -13.370 7.274 9.477 1.00 25.00 O ATOM 277 CB PHE A 758 -10.755 6.355 8.702 1.00 25.00 C ATOM 278 CG PHE A 758 -9.496 7.138 8.929 1.00 25.00 C ATOM 279 CD1 PHE A 758 -8.271 6.477 9.131 1.00 25.00 C ATOM 280 CD2 PHE A 758 -9.523 8.544 8.930 1.00 25.00 C ATOM 281 CE1 PHE A 758 -7.076 7.210 9.321 1.00 25.00 C ATOM 282 CE2 PHE A 758 -8.334 9.292 9.118 1.00 25.00 C ATOM 283 CZ PHE A 758 -7.108 8.621 9.311 1.00 25.00 C ATOM 0 H PHE A 758 -11.236 3.919 9.451 1.00 25.00 H new ATOM 0 HA PHE A 758 -11.108 6.536 10.827 1.00 25.00 H new ATOM 0 HB2 PHE A 758 -10.517 5.462 8.124 1.00 25.00 H new ATOM 0 HB3 PHE A 758 -11.439 6.952 8.099 1.00 25.00 H new ATOM 0 HD1 PHE A 758 -8.242 5.397 9.141 1.00 25.00 H new ATOM 0 HD2 PHE A 758 -10.461 9.060 8.786 1.00 25.00 H new ATOM 0 HE1 PHE A 758 -6.141 6.691 9.473 1.00 25.00 H new ATOM 0 HE2 PHE A 758 -8.366 10.372 9.114 1.00 25.00 H new ATOM 0 HZ PHE A 758 -6.198 9.185 9.451 1.00 25.00 H new ATOM 293 N ASP A 759 -13.752 5.145 10.093 1.00 25.00 N ATOM 294 CA ASP A 759 -15.209 5.254 9.967 1.00 25.00 C ATOM 295 C ASP A 759 -15.778 6.349 10.827 1.00 25.00 C ATOM 296 O ASP A 759 -15.915 6.228 12.038 1.00 25.00 O ATOM 297 CB ASP A 759 -15.904 3.938 10.232 1.00 25.00 C ATOM 298 CG ASP A 759 -17.313 3.897 9.638 1.00 25.00 C ATOM 299 OD1 ASP A 759 -17.951 4.961 9.432 1.00 50.00 O ATOM 300 OD2 ASP A 759 -17.806 2.800 9.379 1.00 50.00 O ATOM 0 H ASP A 759 -13.421 4.226 10.387 1.00 25.00 H new ATOM 0 HA ASP A 759 -15.403 5.524 8.929 1.00 25.00 H new ATOM 0 HB2 ASP A 759 -15.311 3.125 9.812 1.00 25.00 H new ATOM 0 HB3 ASP A 759 -15.960 3.769 11.307 1.00 25.00 H new ATOM 305 N ARG A 760 -16.106 7.428 10.139 1.00 25.00 N ATOM 306 CA ARG A 760 -16.588 8.659 10.754 1.00 25.00 C ATOM 307 C ARG A 760 -17.778 8.451 11.667 1.00 25.00 C ATOM 308 O ARG A 760 -17.901 9.107 12.691 1.00 25.00 O ATOM 309 CB ARG A 760 -16.990 9.600 9.633 1.00 25.00 C ATOM 310 CG ARG A 760 -17.241 10.997 10.001 1.00 25.00 C ATOM 311 CD ARG A 760 -17.539 11.622 8.694 1.00 25.00 C ATOM 312 NE ARG A 760 -18.959 11.465 8.337 1.00 25.00 N ATOM 313 CZ ARG A 760 -19.555 12.041 7.302 1.00 25.00 C ATOM 314 NH1 ARG A 760 -18.918 12.848 6.485 1.00 25.00 N ATOM 315 NH2 ARG A 760 -20.815 11.795 7.089 1.00 25.00 N ATOM 0 H ARG A 760 -16.045 7.478 9.122 1.00 25.00 H new ATOM 0 HA ARG A 760 -15.787 9.061 11.374 1.00 25.00 H new ATOM 0 HB2 ARG A 760 -16.205 9.584 8.877 1.00 25.00 H new ATOM 0 HB3 ARG A 760 -17.891 9.205 9.164 1.00 25.00 H new ATOM 0 HG2 ARG A 760 -18.076 11.090 10.696 1.00 25.00 H new ATOM 0 HG3 ARG A 760 -16.375 11.452 10.481 1.00 25.00 H new ATOM 0 HD2 ARG A 760 -17.286 12.682 8.729 1.00 25.00 H new ATOM 0 HD3 ARG A 760 -16.916 11.171 7.922 1.00 25.00 H new ATOM 0 HE ARG A 760 -19.529 10.866 8.933 1.00 25.00 H new ATOM 0 HH11 ARG A 760 -17.930 13.051 6.636 1.00 25.00 H new ATOM 0 HH12 ARG A 760 -19.411 13.272 5.699 1.00 25.00 H new ATOM 0 HH21 ARG A 760 -21.325 11.169 7.713 1.00 25.00 H new ATOM 0 HH22 ARG A 760 -21.293 12.228 6.298 1.00 25.00 H new ATOM 329 N ASP A 761 -18.666 7.554 11.270 1.00 25.00 N ATOM 330 CA ASP A 761 -19.873 7.280 12.043 1.00 25.00 C ATOM 331 C ASP A 761 -19.914 5.824 12.489 1.00 25.00 C ATOM 332 O ASP A 761 -20.900 5.384 13.063 1.00 25.00 O ATOM 333 CB ASP A 761 -21.127 7.696 11.261 1.00 25.00 C ATOM 334 CG ASP A 761 -20.955 7.548 9.775 1.00 25.00 C ATOM 335 OD1 ASP A 761 -21.146 6.425 9.269 1.00 50.00 O ATOM 336 OD2 ASP A 761 -20.608 8.537 9.085 1.00 50.00 O ATOM 0 H ASP A 761 -18.576 7.002 10.417 1.00 25.00 H new ATOM 0 HA ASP A 761 -19.853 7.884 12.950 1.00 25.00 H new ATOM 0 HB2 ASP A 761 -21.972 7.090 11.588 1.00 25.00 H new ATOM 0 HB3 ASP A 761 -21.369 8.733 11.494 1.00 25.00 H new ATOM 341 N HIS A 762 -18.841 5.081 12.210 1.00 25.00 N ATOM 342 CA HIS A 762 -18.729 3.672 12.637 1.00 25.00 C ATOM 343 C HIS A 762 -19.893 2.805 12.122 1.00 25.00 C ATOM 344 O HIS A 762 -20.353 1.875 12.774 1.00 25.00 O ATOM 345 CB HIS A 762 -18.592 3.578 14.164 1.00 25.00 C ATOM 346 CG HIS A 762 -17.833 2.371 14.626 1.00 25.00 C ATOM 347 ND1 HIS A 762 -18.265 1.115 14.932 1.00 25.00 N flip ATOM 348 CD2 HIS A 762 -16.478 2.342 14.840 1.00 25.00 C flip ATOM 349 CE1 HIS A 762 -17.199 0.331 15.327 1.00 25.00 C flip ATOM 350 NE2 HIS A 762 -16.149 1.125 15.261 1.00 25.00 N flip ATOM 0 H HIS A 762 -18.034 5.426 11.691 1.00 25.00 H new ATOM 0 HA HIS A 762 -17.823 3.269 12.185 1.00 25.00 H new ATOM 0 HB2 HIS A 762 -18.091 4.474 14.531 1.00 25.00 H new ATOM 0 HB3 HIS A 762 -19.587 3.564 14.609 1.00 25.00 H new ATOM 0 HD1 HIS A 762 -19.234 0.800 14.877 1.00 25.00 H new ATOM 0 HD2 HIS A 762 -15.796 3.166 14.692 1.00 25.00 H new ATOM 0 HE1 HIS A 762 -17.221 -0.707 15.625 1.00 25.00 H new ATOM 358 N SER A 763 -20.355 3.123 10.921 1.00 25.00 N ATOM 359 CA SER A 763 -21.437 2.395 10.276 1.00 25.00 C ATOM 360 C SER A 763 -20.961 1.045 9.728 1.00 25.00 C ATOM 361 O SER A 763 -21.752 0.244 9.238 1.00 25.00 O ATOM 362 CB SER A 763 -21.988 3.261 9.145 1.00 25.00 C ATOM 363 OG SER A 763 -20.966 3.625 8.215 1.00 25.00 O ATOM 0 H SER A 763 -19.988 3.896 10.365 1.00 25.00 H new ATOM 0 HA SER A 763 -22.215 2.186 11.010 1.00 25.00 H new ATOM 0 HB2 SER A 763 -22.779 2.721 8.624 1.00 25.00 H new ATOM 0 HB3 SER A 763 -22.439 4.162 9.562 1.00 25.00 H new ATOM 0 HG SER A 763 -20.963 2.991 7.468 1.00 25.00 H new ATOM 369 N GLY A 764 -19.658 0.812 9.799 1.00 25.00 N ATOM 370 CA GLY A 764 -19.070 -0.439 9.337 1.00 25.00 C ATOM 371 C GLY A 764 -18.815 -0.318 7.856 1.00 25.00 C ATOM 372 O GLY A 764 -18.597 -1.288 7.133 1.00 25.00 O ATOM 0 H GLY A 764 -18.983 1.478 10.175 1.00 25.00 H new ATOM 0 HA2 GLY A 764 -18.140 -0.641 9.868 1.00 25.00 H new ATOM 0 HA3 GLY A 764 -19.741 -1.273 9.541 1.00 25.00 H new ATOM 376 N THR A 765 -18.880 0.922 7.408 1.00 25.00 N ATOM 377 CA THR A 765 -18.717 1.280 6.015 1.00 25.00 C ATOM 378 C THR A 765 -18.225 2.722 5.921 1.00 25.00 C ATOM 379 O THR A 765 -18.744 3.607 6.614 1.00 25.00 O ATOM 380 CB THR A 765 -20.063 1.218 5.289 1.00 25.00 C ATOM 381 OG1 THR A 765 -21.097 1.659 6.175 1.00 25.00 O ATOM 382 CG2 THR A 765 -20.408 -0.188 4.824 1.00 25.00 C ATOM 0 H THR A 765 -19.051 1.723 8.016 1.00 25.00 H new ATOM 0 HA THR A 765 -18.009 0.585 5.564 1.00 25.00 H new ATOM 0 HB THR A 765 -19.985 1.860 4.411 1.00 25.00 H new ATOM 0 HG1 THR A 765 -21.961 1.623 5.714 1.00 25.00 H new ATOM 0 HG21 THR A 765 -21.372 -0.177 4.315 1.00 25.00 H new ATOM 0 HG22 THR A 765 -19.639 -0.543 4.137 1.00 25.00 H new ATOM 0 HG23 THR A 765 -20.460 -0.854 5.686 1.00 25.00 H new ATOM 390 N LEU A 766 -17.260 3.004 5.069 1.00 25.00 N ATOM 391 CA LEU A 766 -16.782 4.379 4.927 1.00 25.00 C ATOM 392 C LEU A 766 -17.557 5.024 3.775 1.00 25.00 C ATOM 393 O LEU A 766 -17.642 4.462 2.715 1.00 25.00 O ATOM 394 CB LEU A 766 -15.263 4.418 4.663 1.00 25.00 C ATOM 395 CG LEU A 766 -14.276 4.446 5.867 1.00 25.00 C ATOM 396 CD1 LEU A 766 -14.512 5.646 6.633 1.00 25.00 C ATOM 397 CD2 LEU A 766 -14.354 3.259 6.784 1.00 25.00 C ATOM 0 H LEU A 766 -16.794 2.320 4.472 1.00 25.00 H new ATOM 0 HA LEU A 766 -16.952 4.931 5.851 1.00 25.00 H new ATOM 0 HB2 LEU A 766 -15.014 3.547 4.057 1.00 25.00 H new ATOM 0 HB3 LEU A 766 -15.060 5.299 4.054 1.00 25.00 H new ATOM 0 HG LEU A 766 -13.276 4.419 5.434 1.00 25.00 H new ATOM 0 HD11 LEU A 766 -13.827 5.678 7.480 1.00 25.00 H new ATOM 0 HD12 LEU A 766 -14.349 6.519 6.001 1.00 25.00 H new ATOM 0 HD13 LEU A 766 -15.539 5.649 6.997 1.00 25.00 H new ATOM 0 HD21 LEU A 766 -13.628 3.373 7.589 1.00 25.00 H new ATOM 0 HD22 LEU A 766 -15.357 3.191 7.206 1.00 25.00 H new ATOM 0 HD23 LEU A 766 -14.134 2.351 6.223 1.00 25.00 H new ATOM 409 N GLY A 767 -18.137 6.196 3.985 1.00 25.00 N ATOM 410 CA GLY A 767 -18.890 6.868 2.936 1.00 25.00 C ATOM 411 C GLY A 767 -17.929 7.633 2.070 1.00 25.00 C ATOM 412 O GLY A 767 -16.762 7.410 2.194 1.00 25.00 O ATOM 0 H GLY A 767 -18.101 6.701 4.870 1.00 25.00 H new ATOM 0 HA2 GLY A 767 -19.440 6.140 2.339 1.00 25.00 H new ATOM 0 HA3 GLY A 767 -19.626 7.543 3.372 1.00 25.00 H new ATOM 416 N PRO A 768 -18.365 8.542 1.201 1.00 25.00 N ATOM 417 CA PRO A 768 -17.410 9.226 0.321 1.00 25.00 C ATOM 418 C PRO A 768 -16.330 10.017 1.058 1.00 25.00 C ATOM 419 O PRO A 768 -15.151 9.699 0.969 1.00 25.00 O ATOM 420 CB PRO A 768 -18.311 10.150 -0.512 1.00 25.00 C ATOM 421 CG PRO A 768 -19.554 10.301 0.312 1.00 25.00 C ATOM 422 CD PRO A 768 -19.743 8.987 0.975 1.00 25.00 C ATOM 0 HA PRO A 768 -16.832 8.514 -0.267 1.00 25.00 H new ATOM 0 HB2 PRO A 768 -17.834 11.113 -0.692 1.00 25.00 H new ATOM 0 HB3 PRO A 768 -18.531 9.716 -1.487 1.00 25.00 H new ATOM 0 HG2 PRO A 768 -19.446 11.100 1.045 1.00 25.00 H new ATOM 0 HG3 PRO A 768 -20.411 10.555 -0.311 1.00 25.00 H new ATOM 0 HD2 PRO A 768 -20.297 9.080 1.909 1.00 25.00 H new ATOM 0 HD3 PRO A 768 -20.296 8.291 0.344 1.00 25.00 H new ATOM 430 N GLU A 769 -16.739 11.038 1.795 1.00 25.00 N ATOM 431 CA GLU A 769 -15.800 11.916 2.500 1.00 25.00 C ATOM 432 C GLU A 769 -15.102 11.165 3.607 1.00 25.00 C ATOM 433 O GLU A 769 -14.086 11.590 4.134 1.00 25.00 O ATOM 434 CB GLU A 769 -16.538 13.121 3.088 1.00 25.00 C ATOM 435 CG GLU A 769 -16.658 14.264 2.110 1.00 25.00 C ATOM 436 CD GLU A 769 -15.290 14.750 1.660 1.00 25.00 C ATOM 437 OE1 GLU A 769 -14.526 15.267 2.500 1.00 25.00 O ATOM 438 OE2 GLU A 769 -14.970 14.594 0.471 1.00 25.00 O ATOM 0 H GLU A 769 -17.720 11.285 1.925 1.00 25.00 H new ATOM 0 HA GLU A 769 -15.057 12.264 1.783 1.00 25.00 H new ATOM 0 HB2 GLU A 769 -17.534 12.813 3.404 1.00 25.00 H new ATOM 0 HB3 GLU A 769 -16.013 13.464 3.979 1.00 25.00 H new ATOM 0 HG2 GLU A 769 -17.236 13.945 1.243 1.00 25.00 H new ATOM 0 HG3 GLU A 769 -17.204 15.086 2.573 1.00 25.00 H new ATOM 445 N GLU A 770 -15.664 10.033 3.973 1.00 25.00 N ATOM 446 CA GLU A 770 -15.048 9.237 5.012 1.00 25.00 C ATOM 447 C GLU A 770 -13.964 8.331 4.378 1.00 25.00 C ATOM 448 O GLU A 770 -12.854 8.215 4.888 1.00 25.00 O ATOM 449 CB GLU A 770 -16.067 8.362 5.729 1.00 25.00 C ATOM 450 CG GLU A 770 -17.428 8.907 6.070 1.00 25.00 C ATOM 451 CD GLU A 770 -18.240 7.777 6.730 1.00 25.00 C ATOM 452 OE1 GLU A 770 -17.739 7.171 7.678 1.00 50.00 O ATOM 453 OE2 GLU A 770 -19.350 7.430 6.287 1.00 50.00 O ATOM 0 H GLU A 770 -16.524 9.651 3.579 1.00 25.00 H new ATOM 0 HA GLU A 770 -14.608 9.915 5.743 1.00 25.00 H new ATOM 0 HB2 GLU A 770 -16.219 7.474 5.115 1.00 25.00 H new ATOM 0 HB3 GLU A 770 -15.609 8.030 6.661 1.00 25.00 H new ATOM 0 HG2 GLU A 770 -17.340 9.758 6.746 1.00 25.00 H new ATOM 0 HG3 GLU A 770 -17.932 9.264 5.172 1.00 25.00 H new ATOM 460 N PHE A 771 -14.305 7.687 3.266 1.00 25.00 N ATOM 461 CA PHE A 771 -13.398 6.769 2.548 1.00 25.00 C ATOM 462 C PHE A 771 -12.145 7.474 2.119 1.00 25.00 C ATOM 463 O PHE A 771 -11.047 6.939 2.255 1.00 25.00 O ATOM 464 CB PHE A 771 -14.123 6.199 1.315 1.00 25.00 C ATOM 465 CG PHE A 771 -13.262 5.336 0.416 1.00 25.00 C ATOM 466 CD1 PHE A 771 -12.515 4.266 0.937 1.00 25.00 C ATOM 467 CD2 PHE A 771 -13.225 5.582 -0.975 1.00 25.00 C ATOM 468 CE1 PHE A 771 -11.755 3.417 0.083 1.00 25.00 C ATOM 469 CE2 PHE A 771 -12.467 4.749 -1.843 1.00 25.00 C ATOM 470 CZ PHE A 771 -11.739 3.657 -1.311 1.00 25.00 C ATOM 0 H PHE A 771 -15.221 7.781 2.827 1.00 25.00 H new ATOM 0 HA PHE A 771 -13.118 5.960 3.222 1.00 25.00 H new ATOM 0 HB2 PHE A 771 -14.976 5.610 1.652 1.00 25.00 H new ATOM 0 HB3 PHE A 771 -14.520 7.028 0.729 1.00 25.00 H new ATOM 0 HD1 PHE A 771 -12.517 4.085 2.002 1.00 25.00 H new ATOM 0 HD2 PHE A 771 -13.780 6.413 -1.384 1.00 25.00 H new ATOM 0 HE1 PHE A 771 -11.193 2.593 0.498 1.00 25.00 H new ATOM 0 HE2 PHE A 771 -12.447 4.948 -2.904 1.00 25.00 H new ATOM 0 HZ PHE A 771 -11.174 3.011 -1.966 1.00 25.00 H new ATOM 480 N LYS A 772 -12.299 8.688 1.622 1.00 25.00 N ATOM 481 CA LYS A 772 -11.164 9.459 1.173 1.00 25.00 C ATOM 482 C LYS A 772 -10.236 9.788 2.331 1.00 25.00 C ATOM 483 O LYS A 772 -9.069 10.034 2.106 1.00 25.00 O ATOM 484 CB LYS A 772 -11.615 10.716 0.416 1.00 25.00 C ATOM 485 CG LYS A 772 -12.552 11.644 1.172 1.00 25.00 C ATOM 486 CD LYS A 772 -11.851 12.785 1.841 1.00 25.00 C ATOM 487 CE LYS A 772 -11.244 13.746 0.825 1.00 25.00 C ATOM 488 NZ LYS A 772 -12.084 14.965 0.533 1.00 25.00 N ATOM 0 H LYS A 772 -13.199 9.157 1.521 1.00 25.00 H new ATOM 0 HA LYS A 772 -10.595 8.851 0.470 1.00 25.00 H new ATOM 0 HB2 LYS A 772 -10.729 11.281 0.128 1.00 25.00 H new ATOM 0 HB3 LYS A 772 -12.108 10.405 -0.505 1.00 25.00 H new ATOM 0 HG2 LYS A 772 -13.295 12.040 0.480 1.00 25.00 H new ATOM 0 HG3 LYS A 772 -13.092 11.069 1.924 1.00 25.00 H new ATOM 0 HD2 LYS A 772 -12.555 13.323 2.476 1.00 25.00 H new ATOM 0 HD3 LYS A 772 -11.066 12.399 2.491 1.00 25.00 H new ATOM 0 HE2 LYS A 772 -10.270 14.071 1.189 1.00 25.00 H new ATOM 0 HE3 LYS A 772 -11.072 13.208 -0.107 1.00 25.00 H new ATOM 0 HZ1 LYS A 772 -11.759 15.407 -0.350 1.00 25.00 H new ATOM 0 HZ2 LYS A 772 -13.080 14.684 0.433 1.00 25.00 H new ATOM 0 HZ3 LYS A 772 -11.992 15.645 1.315 1.00 25.00 H new ATOM 502 N ALA A 773 -10.741 9.799 3.565 1.00 25.00 N ATOM 503 CA ALA A 773 -9.904 10.166 4.702 1.00 25.00 C ATOM 504 C ALA A 773 -9.160 8.913 5.178 1.00 25.00 C ATOM 505 O ALA A 773 -8.013 8.982 5.600 1.00 25.00 O ATOM 506 CB ALA A 773 -10.765 10.740 5.833 1.00 25.00 C ATOM 0 H ALA A 773 -11.706 9.563 3.798 1.00 25.00 H new ATOM 0 HA ALA A 773 -9.187 10.932 4.406 1.00 25.00 H new ATOM 0 HB1 ALA A 773 -10.127 11.009 6.675 1.00 25.00 H new ATOM 0 HB2 ALA A 773 -11.290 11.627 5.477 1.00 25.00 H new ATOM 0 HB3 ALA A 773 -11.491 9.993 6.153 1.00 25.00 H new ATOM 512 N CYS A 774 -9.823 7.768 5.086 1.00 25.00 N ATOM 513 CA CYS A 774 -9.208 6.496 5.457 1.00 25.00 C ATOM 514 C CYS A 774 -8.016 6.243 4.551 1.00 25.00 C ATOM 515 O CYS A 774 -6.941 5.862 4.995 1.00 25.00 O ATOM 516 CB CYS A 774 -10.229 5.361 5.305 1.00 25.00 C ATOM 517 SG CYS A 774 -9.654 3.767 5.965 1.00 25.00 S ATOM 0 H CYS A 774 -10.786 7.692 4.758 1.00 25.00 H new ATOM 0 HA CYS A 774 -8.878 6.535 6.495 1.00 25.00 H new ATOM 0 HB2 CYS A 774 -11.151 5.643 5.813 1.00 25.00 H new ATOM 0 HB3 CYS A 774 -10.471 5.241 4.249 1.00 25.00 H new ATOM 0 HG CYS A 774 -10.578 2.869 5.796 1.00 25.00 H new ATOM 523 N LEU A 775 -8.235 6.482 3.271 1.00 25.00 N ATOM 524 CA LEU A 775 -7.232 6.270 2.233 1.00 25.00 C ATOM 525 C LEU A 775 -5.937 7.085 2.370 1.00 25.00 C ATOM 526 O LEU A 775 -4.905 6.710 1.820 1.00 25.00 O ATOM 527 CB LEU A 775 -7.873 6.612 0.896 1.00 25.00 C ATOM 528 CG LEU A 775 -8.719 5.538 0.206 1.00 25.00 C ATOM 529 CD1 LEU A 775 -9.321 6.176 -1.044 1.00 25.00 C ATOM 530 CD2 LEU A 775 -7.883 4.331 -0.187 1.00 25.00 C ATOM 0 H LEU A 775 -9.124 6.833 2.914 1.00 25.00 H new ATOM 0 HA LEU A 775 -6.925 5.228 2.323 1.00 25.00 H new ATOM 0 HB2 LEU A 775 -8.503 7.489 1.043 1.00 25.00 H new ATOM 0 HB3 LEU A 775 -7.078 6.902 0.209 1.00 25.00 H new ATOM 0 HG LEU A 775 -9.491 5.184 0.889 1.00 25.00 H new ATOM 0 HD11 LEU A 775 -9.934 5.442 -1.568 1.00 25.00 H new ATOM 0 HD12 LEU A 775 -9.939 7.026 -0.757 1.00 25.00 H new ATOM 0 HD13 LEU A 775 -8.520 6.515 -1.701 1.00 25.00 H new ATOM 0 HD21 LEU A 775 -8.519 3.591 -0.674 1.00 25.00 H new ATOM 0 HD22 LEU A 775 -7.096 4.642 -0.874 1.00 25.00 H new ATOM 0 HD23 LEU A 775 -7.434 3.893 0.705 1.00 25.00 H new ATOM 542 N ILE A 776 -5.978 8.182 3.107 1.00 25.00 N ATOM 543 CA ILE A 776 -4.792 9.020 3.309 1.00 25.00 C ATOM 544 C ILE A 776 -3.752 8.198 4.063 1.00 25.00 C ATOM 545 O ILE A 776 -2.556 8.294 3.815 1.00 25.00 O ATOM 546 CB ILE A 776 -5.101 10.293 4.143 1.00 25.00 C ATOM 547 CG1 ILE A 776 -6.335 11.013 3.577 1.00 25.00 C ATOM 548 CG2 ILE A 776 -3.892 11.255 4.113 1.00 25.00 C ATOM 549 CD1 ILE A 776 -6.789 12.221 4.369 1.00 25.00 C ATOM 0 H ILE A 776 -6.817 8.519 3.579 1.00 25.00 H new ATOM 0 HA ILE A 776 -4.435 9.339 2.330 1.00 25.00 H new ATOM 0 HB ILE A 776 -5.299 9.991 5.171 1.00 25.00 H new ATOM 0 HG12 ILE A 776 -6.118 11.327 2.556 1.00 25.00 H new ATOM 0 HG13 ILE A 776 -7.159 10.302 3.523 1.00 25.00 H new ATOM 0 HG21 ILE A 776 -4.120 12.144 4.701 1.00 25.00 H new ATOM 0 HG22 ILE A 776 -3.019 10.756 4.534 1.00 25.00 H new ATOM 0 HG23 ILE A 776 -3.683 11.545 3.083 1.00 25.00 H new ATOM 0 HD11 ILE A 776 -7.665 12.661 3.892 1.00 25.00 H new ATOM 0 HD12 ILE A 776 -7.044 11.916 5.384 1.00 25.00 H new ATOM 0 HD13 ILE A 776 -5.986 12.957 4.402 1.00 25.00 H new ATOM 561 N SER A 777 -4.238 7.375 4.983 1.00 25.00 N ATOM 562 CA SER A 777 -3.378 6.544 5.821 1.00 25.00 C ATOM 563 C SER A 777 -2.768 5.382 5.046 1.00 25.00 C ATOM 564 O SER A 777 -1.957 4.637 5.591 1.00 25.00 O ATOM 565 CB SER A 777 -4.195 5.986 6.991 1.00 25.00 C ATOM 566 OG SER A 777 -3.366 5.335 7.937 1.00 25.00 O ATOM 0 H SER A 777 -5.234 7.264 5.170 1.00 25.00 H new ATOM 0 HA SER A 777 -2.564 7.173 6.181 1.00 25.00 H new ATOM 0 HB2 SER A 777 -4.737 6.797 7.477 1.00 25.00 H new ATOM 0 HB3 SER A 777 -4.940 5.285 6.615 1.00 25.00 H new ATOM 0 HG SER A 777 -2.619 4.902 7.474 1.00 25.00 H new ATOM 572 N LEU A 778 -3.171 5.219 3.790 1.00 25.00 N ATOM 573 CA LEU A 778 -2.671 4.132 2.951 1.00 25.00 C ATOM 574 C LEU A 778 -1.741 4.651 1.859 1.00 25.00 C ATOM 575 O LEU A 778 -0.933 3.905 1.351 1.00 25.00 O ATOM 576 CB LEU A 778 -3.834 3.348 2.302 1.00 25.00 C ATOM 577 CG LEU A 778 -4.603 2.326 3.166 1.00 25.00 C ATOM 578 CD1 LEU A 778 -3.663 1.249 3.709 1.00 25.00 C ATOM 579 CD2 LEU A 778 -5.370 3.008 4.319 1.00 25.00 C ATOM 0 H LEU A 778 -3.846 5.828 3.328 1.00 25.00 H new ATOM 0 HA LEU A 778 -2.109 3.463 3.602 1.00 25.00 H new ATOM 0 HB2 LEU A 778 -4.555 4.074 1.926 1.00 25.00 H new ATOM 0 HB3 LEU A 778 -3.435 2.818 1.437 1.00 25.00 H new ATOM 0 HG LEU A 778 -5.339 1.849 2.519 1.00 25.00 H new ATOM 0 HD11 LEU A 778 -4.231 0.542 4.314 1.00 25.00 H new ATOM 0 HD12 LEU A 778 -3.195 0.721 2.878 1.00 25.00 H new ATOM 0 HD13 LEU A 778 -2.892 1.715 4.323 1.00 25.00 H new ATOM 0 HD21 LEU A 778 -5.897 2.253 4.902 1.00 25.00 H new ATOM 0 HD22 LEU A 778 -4.666 3.537 4.962 1.00 25.00 H new ATOM 0 HD23 LEU A 778 -6.089 3.717 3.908 1.00 25.00 H new ATOM 591 N GLY A 779 -1.841 5.926 1.501 1.00 25.00 N ATOM 592 CA GLY A 779 -0.985 6.442 0.436 1.00 25.00 C ATOM 593 C GLY A 779 -1.692 6.363 -0.902 1.00 25.00 C ATOM 594 O GLY A 779 -1.194 5.833 -1.889 1.00 25.00 O ATOM 0 H GLY A 779 -2.482 6.603 1.915 1.00 25.00 H new ATOM 0 HA2 GLY A 779 -0.713 7.476 0.649 1.00 25.00 H new ATOM 0 HA3 GLY A 779 -0.058 5.870 0.398 1.00 25.00 H new ATOM 598 N TYR A 780 -2.895 6.907 -0.908 1.00 25.00 N ATOM 599 CA TYR A 780 -3.750 6.950 -2.092 1.00 25.00 C ATOM 600 C TYR A 780 -3.220 7.711 -3.322 1.00 25.00 C ATOM 601 O TYR A 780 -2.272 8.480 -3.243 1.00 25.00 O ATOM 602 CB TYR A 780 -5.121 7.502 -1.694 1.00 25.00 C ATOM 603 CG TYR A 780 -5.148 8.888 -1.061 1.00 25.00 C ATOM 604 CD1 TYR A 780 -3.968 9.621 -0.812 1.00 25.00 C ATOM 605 CD2 TYR A 780 -6.375 9.470 -0.702 1.00 25.00 C ATOM 606 CE1 TYR A 780 -4.008 10.893 -0.224 1.00 25.00 C ATOM 607 CE2 TYR A 780 -6.428 10.749 -0.129 1.00 25.00 C ATOM 608 CZ TYR A 780 -5.240 11.461 0.104 1.00 25.00 C ATOM 609 OH TYR A 780 -5.295 12.716 0.657 1.00 25.00 O ATOM 0 H TYR A 780 -3.315 7.338 -0.085 1.00 25.00 H new ATOM 0 HA TYR A 780 -3.792 5.916 -2.433 1.00 25.00 H new ATOM 0 HB2 TYR A 780 -5.750 7.523 -2.584 1.00 25.00 H new ATOM 0 HB3 TYR A 780 -5.580 6.801 -0.996 1.00 25.00 H new ATOM 0 HD1 TYR A 780 -3.014 9.193 -1.080 1.00 25.00 H new ATOM 0 HD2 TYR A 780 -7.292 8.924 -0.870 1.00 25.00 H new ATOM 0 HE1 TYR A 780 -3.092 11.430 -0.026 1.00 25.00 H new ATOM 0 HE2 TYR A 780 -7.381 11.186 0.133 1.00 25.00 H new ATOM 0 HH TYR A 780 -6.230 12.960 0.823 1.00 25.00 H new ATOM 619 N ASP A 781 -3.867 7.479 -4.460 1.00 25.00 N ATOM 620 CA ASP A 781 -3.467 8.036 -5.759 1.00 25.00 C ATOM 621 C ASP A 781 -4.302 9.259 -6.108 1.00 25.00 C ATOM 622 O ASP A 781 -4.323 9.726 -7.246 1.00 25.00 O ATOM 623 CB ASP A 781 -3.570 6.961 -6.869 1.00 25.00 C ATOM 624 CG ASP A 781 -5.010 6.476 -7.124 1.00 25.00 C ATOM 625 OD1 ASP A 781 -5.877 6.610 -6.238 1.00 25.00 O ATOM 626 OD2 ASP A 781 -5.261 5.925 -8.226 1.00 25.00 O ATOM 0 H ASP A 781 -4.698 6.890 -4.512 1.00 25.00 H new ATOM 0 HA ASP A 781 -2.426 8.352 -5.687 1.00 25.00 H new ATOM 0 HB2 ASP A 781 -3.162 7.366 -7.795 1.00 25.00 H new ATOM 0 HB3 ASP A 781 -2.951 6.107 -6.595 1.00 25.00 H new ATOM 631 N ILE A 782 -4.980 9.777 -5.098 1.00 25.00 N ATOM 632 CA ILE A 782 -5.795 10.972 -5.218 1.00 25.00 C ATOM 633 C ILE A 782 -5.424 11.899 -4.076 1.00 25.00 C ATOM 634 O ILE A 782 -4.687 11.521 -3.182 1.00 25.00 O ATOM 635 CB ILE A 782 -7.304 10.663 -5.178 1.00 25.00 C ATOM 636 CG1 ILE A 782 -7.660 9.832 -3.927 1.00 25.00 C ATOM 637 CG2 ILE A 782 -7.715 10.046 -6.520 1.00 25.00 C ATOM 638 CD1 ILE A 782 -7.928 8.365 -4.160 1.00 25.00 C ATOM 0 H ILE A 782 -4.979 9.374 -4.161 1.00 25.00 H new ATOM 0 HA ILE A 782 -5.600 11.435 -6.185 1.00 25.00 H new ATOM 0 HB ILE A 782 -7.894 11.572 -5.066 1.00 25.00 H new ATOM 0 HG12 ILE A 782 -6.843 9.922 -3.211 1.00 25.00 H new ATOM 0 HG13 ILE A 782 -8.542 10.272 -3.462 1.00 25.00 H new ATOM 0 HG21 ILE A 782 -8.782 9.822 -6.506 1.00 25.00 H new ATOM 0 HG22 ILE A 782 -7.503 10.750 -7.324 1.00 25.00 H new ATOM 0 HG23 ILE A 782 -7.153 9.127 -6.685 1.00 25.00 H new ATOM 0 HD11 ILE A 782 -8.167 7.884 -3.212 1.00 25.00 H new ATOM 0 HD12 ILE A 782 -8.768 8.253 -4.846 1.00 25.00 H new ATOM 0 HD13 ILE A 782 -7.043 7.897 -4.591 1.00 25.00 H new ATOM 650 N GLY A 783 -5.947 13.110 -4.108 1.00 25.00 N ATOM 651 CA GLY A 783 -5.662 14.081 -3.076 1.00 25.00 C ATOM 652 C GLY A 783 -6.764 15.107 -3.109 1.00 25.00 C ATOM 653 O GLY A 783 -7.797 14.864 -3.729 1.00 25.00 O ATOM 0 H GLY A 783 -6.573 13.443 -4.841 1.00 25.00 H new ATOM 0 HA2 GLY A 783 -5.614 13.600 -2.099 1.00 25.00 H new ATOM 0 HA3 GLY A 783 -4.694 14.551 -3.248 1.00 25.00 H new ATOM 657 N ASN A 784 -6.552 16.252 -2.475 1.00 25.00 N ATOM 658 CA ASN A 784 -7.559 17.325 -2.429 1.00 25.00 C ATOM 659 C ASN A 784 -7.453 18.172 -3.706 1.00 25.00 C ATOM 660 O ASN A 784 -7.827 19.344 -3.741 1.00 25.00 O ATOM 661 CB ASN A 784 -7.331 18.218 -1.199 1.00 25.00 C ATOM 662 CG ASN A 784 -7.343 17.443 0.097 1.00 25.00 C ATOM 663 OD1 ASN A 784 -8.382 17.062 0.605 1.00 25.00 O ATOM 664 ND2 ASN A 784 -6.176 17.216 0.647 1.00 25.00 N ATOM 0 H ASN A 784 -5.688 16.471 -1.979 1.00 25.00 H new ATOM 0 HA ASN A 784 -8.552 16.880 -2.360 1.00 25.00 H new ATOM 0 HB2 ASN A 784 -6.375 18.732 -1.301 1.00 25.00 H new ATOM 0 HB3 ASN A 784 -8.104 18.986 -1.165 1.00 25.00 H new ATOM 0 HD21 ASN A 784 -6.118 16.706 1.528 1.00 25.00 H new ATOM 0 HD22 ASN A 784 -5.325 17.550 0.194 1.00 25.00 H new ATOM 671 N ASP A 785 -6.905 17.561 -4.739 1.00 25.00 N ATOM 672 CA ASP A 785 -6.650 18.204 -6.016 1.00 25.00 C ATOM 673 C ASP A 785 -7.913 18.257 -6.859 1.00 25.00 C ATOM 674 O ASP A 785 -8.800 17.415 -6.709 1.00 25.00 O ATOM 675 CB ASP A 785 -5.592 17.394 -6.762 1.00 25.00 C ATOM 676 CG ASP A 785 -4.296 17.320 -6.002 1.00 25.00 C ATOM 677 OD1 ASP A 785 -4.163 16.417 -5.149 1.00 25.00 O ATOM 678 OD2 ASP A 785 -3.420 18.169 -6.248 1.00 25.00 O ATOM 0 H ASP A 785 -6.618 16.582 -4.714 1.00 25.00 H new ATOM 0 HA ASP A 785 -6.309 19.224 -5.838 1.00 25.00 H new ATOM 0 HB2 ASP A 785 -5.966 16.386 -6.939 1.00 25.00 H new ATOM 0 HB3 ASP A 785 -5.414 17.844 -7.739 1.00 25.00 H new ATOM 683 N PRO A 786 -8.009 19.229 -7.787 1.00 25.00 N ATOM 684 CA PRO A 786 -9.244 19.283 -8.580 1.00 25.00 C ATOM 685 C PRO A 786 -9.444 18.060 -9.473 1.00 25.00 C ATOM 686 O PRO A 786 -10.566 17.741 -9.846 1.00 25.00 O ATOM 687 CB PRO A 786 -9.066 20.563 -9.405 1.00 25.00 C ATOM 688 CG PRO A 786 -7.588 20.721 -9.527 1.00 25.00 C ATOM 689 CD PRO A 786 -7.073 20.303 -8.176 1.00 25.00 C ATOM 0 HA PRO A 786 -10.135 19.286 -7.952 1.00 25.00 H new ATOM 0 HB2 PRO A 786 -9.539 20.475 -10.383 1.00 25.00 H new ATOM 0 HB3 PRO A 786 -9.518 21.422 -8.909 1.00 25.00 H new ATOM 0 HG2 PRO A 786 -7.182 20.095 -10.322 1.00 25.00 H new ATOM 0 HG3 PRO A 786 -7.313 21.750 -9.760 1.00 25.00 H new ATOM 0 HD2 PRO A 786 -6.045 19.944 -8.228 1.00 25.00 H new ATOM 0 HD3 PRO A 786 -7.087 21.129 -7.465 1.00 25.00 H new ATOM 697 N GLN A 787 -8.363 17.366 -9.806 1.00 25.00 N ATOM 698 CA GLN A 787 -8.479 16.137 -10.584 1.00 25.00 C ATOM 699 C GLN A 787 -8.704 14.952 -9.648 1.00 25.00 C ATOM 700 O GLN A 787 -9.550 14.110 -9.903 1.00 25.00 O ATOM 701 CB GLN A 787 -7.226 15.884 -11.428 1.00 25.00 C ATOM 702 CG GLN A 787 -6.922 16.956 -12.415 1.00 25.00 C ATOM 703 CD GLN A 787 -5.818 16.560 -13.251 1.00 25.00 C ATOM 704 OE1 GLN A 787 -5.862 16.369 -14.452 1.00 25.00 O ATOM 705 NE2 GLN A 787 -4.774 16.444 -12.569 1.00 25.00 N ATOM 0 H GLN A 787 -7.409 17.627 -9.555 1.00 25.00 H new ATOM 0 HA GLN A 787 -9.328 16.249 -11.258 1.00 25.00 H new ATOM 0 HB2 GLN A 787 -6.371 15.768 -10.762 1.00 25.00 H new ATOM 0 HB3 GLN A 787 -7.346 14.940 -11.960 1.00 25.00 H new ATOM 0 HG2 GLN A 787 -7.800 17.155 -13.029 1.00 25.00 H new ATOM 0 HG3 GLN A 787 -6.680 17.883 -11.894 1.00 25.00 H new ATOM 0 HE21 GLN A 787 -4.799 16.618 -11.564 1.00 25.00 H new ATOM 0 HE22 GLN A 787 -3.898 16.176 -13.018 1.00 25.00 H new ATOM 714 N GLY A 788 -7.936 14.884 -8.569 1.00 25.00 N ATOM 715 CA GLY A 788 -8.019 13.748 -7.673 1.00 25.00 C ATOM 716 C GLY A 788 -9.344 13.586 -6.976 1.00 25.00 C ATOM 717 O GLY A 788 -9.772 12.477 -6.765 1.00 25.00 O ATOM 0 H GLY A 788 -7.257 15.595 -8.298 1.00 25.00 H new ATOM 0 HA2 GLY A 788 -7.810 12.841 -8.240 1.00 25.00 H new ATOM 0 HA3 GLY A 788 -7.237 13.840 -6.919 1.00 25.00 H new ATOM 721 N GLU A 789 -10.011 14.668 -6.635 1.00 25.00 N ATOM 722 CA GLU A 789 -11.325 14.559 -5.990 1.00 25.00 C ATOM 723 C GLU A 789 -12.347 13.933 -6.953 1.00 25.00 C ATOM 724 O GLU A 789 -13.314 13.296 -6.533 1.00 25.00 O ATOM 725 CB GLU A 789 -11.818 15.935 -5.523 1.00 25.00 C ATOM 726 CG GLU A 789 -11.110 16.467 -4.255 1.00 25.00 C ATOM 727 CD GLU A 789 -11.520 15.732 -2.964 1.00 25.00 C ATOM 728 OE1 GLU A 789 -12.437 14.885 -3.001 1.00 25.00 O ATOM 729 OE2 GLU A 789 -10.923 16.019 -1.899 1.00 25.00 O ATOM 0 H GLU A 789 -9.682 15.622 -6.785 1.00 25.00 H new ATOM 0 HA GLU A 789 -11.221 13.913 -5.118 1.00 25.00 H new ATOM 0 HB2 GLU A 789 -11.677 16.652 -6.332 1.00 25.00 H new ATOM 0 HB3 GLU A 789 -12.889 15.878 -5.330 1.00 25.00 H new ATOM 0 HG2 GLU A 789 -10.032 16.378 -4.387 1.00 25.00 H new ATOM 0 HG3 GLU A 789 -11.331 17.529 -4.144 1.00 25.00 H new ATOM 736 N ALA A 790 -12.131 14.092 -8.254 1.00 25.00 N ATOM 737 CA ALA A 790 -13.057 13.540 -9.235 1.00 25.00 C ATOM 738 C ALA A 790 -12.790 12.043 -9.358 1.00 25.00 C ATOM 739 O ALA A 790 -13.712 11.231 -9.433 1.00 25.00 O ATOM 740 CB ALA A 790 -12.877 14.240 -10.590 1.00 25.00 C ATOM 0 H ALA A 790 -11.334 14.591 -8.650 1.00 25.00 H new ATOM 0 HA ALA A 790 -14.086 13.703 -8.913 1.00 25.00 H new ATOM 0 HB1 ALA A 790 -13.575 13.818 -11.313 1.00 25.00 H new ATOM 0 HB2 ALA A 790 -13.072 15.306 -10.477 1.00 25.00 H new ATOM 0 HB3 ALA A 790 -11.856 14.093 -10.943 1.00 25.00 H new ATOM 746 N GLU A 791 -11.517 11.686 -9.365 1.00 25.00 N ATOM 747 CA GLU A 791 -11.109 10.290 -9.474 1.00 25.00 C ATOM 748 C GLU A 791 -11.442 9.548 -8.193 1.00 25.00 C ATOM 749 O GLU A 791 -11.804 8.382 -8.217 1.00 25.00 O ATOM 750 CB GLU A 791 -9.616 10.202 -9.755 1.00 25.00 C ATOM 751 CG GLU A 791 -9.190 10.922 -11.018 1.00 25.00 C ATOM 752 CD GLU A 791 -9.689 10.232 -12.302 1.00 25.00 C ATOM 753 OE1 GLU A 791 -10.903 10.299 -12.612 1.00 25.00 O ATOM 754 OE2 GLU A 791 -8.868 9.609 -13.003 1.00 25.00 O ATOM 0 H GLU A 791 -10.742 12.346 -9.296 1.00 25.00 H new ATOM 0 HA GLU A 791 -11.651 9.829 -10.300 1.00 25.00 H new ATOM 0 HB2 GLU A 791 -9.071 10.619 -8.908 1.00 25.00 H new ATOM 0 HB3 GLU A 791 -9.331 9.153 -9.832 1.00 25.00 H new ATOM 0 HG2 GLU A 791 -9.567 11.944 -10.992 1.00 25.00 H new ATOM 0 HG3 GLU A 791 -8.102 10.984 -11.045 1.00 25.00 H new ATOM 761 N PHE A 792 -11.346 10.237 -7.072 1.00 25.00 N ATOM 762 CA PHE A 792 -11.741 9.661 -5.792 1.00 25.00 C ATOM 763 C PHE A 792 -13.195 9.226 -5.906 1.00 25.00 C ATOM 764 O PHE A 792 -13.537 8.094 -5.567 1.00 25.00 O ATOM 765 CB PHE A 792 -11.561 10.667 -4.644 1.00 25.00 C ATOM 766 CG PHE A 792 -12.710 10.686 -3.678 1.00 25.00 C ATOM 767 CD1 PHE A 792 -13.005 9.559 -2.886 1.00 25.00 C ATOM 768 CD2 PHE A 792 -13.520 11.831 -3.566 1.00 25.00 C ATOM 769 CE1 PHE A 792 -14.112 9.571 -2.015 1.00 25.00 C ATOM 770 CE2 PHE A 792 -14.622 11.848 -2.695 1.00 25.00 C ATOM 771 CZ PHE A 792 -14.919 10.726 -1.932 1.00 25.00 C ATOM 0 H PHE A 792 -10.999 11.195 -7.017 1.00 25.00 H new ATOM 0 HA PHE A 792 -11.106 8.806 -5.562 1.00 25.00 H new ATOM 0 HB2 PHE A 792 -10.646 10.428 -4.103 1.00 25.00 H new ATOM 0 HB3 PHE A 792 -11.432 11.665 -5.063 1.00 25.00 H new ATOM 0 HD1 PHE A 792 -12.379 8.681 -2.947 1.00 25.00 H new ATOM 0 HD2 PHE A 792 -13.292 12.706 -4.156 1.00 25.00 H new ATOM 0 HE1 PHE A 792 -14.342 8.703 -1.415 1.00 25.00 H new ATOM 0 HE2 PHE A 792 -15.237 12.732 -2.619 1.00 25.00 H new ATOM 0 HZ PHE A 792 -15.773 10.737 -1.271 1.00 25.00 H new ATOM 781 N ALA A 793 -14.055 10.107 -6.399 1.00 25.00 N ATOM 782 CA ALA A 793 -15.468 9.781 -6.526 1.00 25.00 C ATOM 783 C ALA A 793 -15.702 8.677 -7.564 1.00 25.00 C ATOM 784 O ALA A 793 -16.627 7.874 -7.441 1.00 25.00 O ATOM 785 CB ALA A 793 -16.262 11.040 -6.882 1.00 25.00 C ATOM 0 H ALA A 793 -13.802 11.043 -6.714 1.00 25.00 H new ATOM 0 HA ALA A 793 -15.817 9.400 -5.566 1.00 25.00 H new ATOM 0 HB1 ALA A 793 -17.319 10.789 -6.976 1.00 25.00 H new ATOM 0 HB2 ALA A 793 -16.134 11.785 -6.097 1.00 25.00 H new ATOM 0 HB3 ALA A 793 -15.900 11.443 -7.828 1.00 25.00 H new ATOM 791 N ARG A 794 -14.850 8.631 -8.575 1.00 25.00 N ATOM 792 CA ARG A 794 -14.909 7.595 -9.607 1.00 25.00 C ATOM 793 C ARG A 794 -14.653 6.230 -8.971 1.00 25.00 C ATOM 794 O ARG A 794 -15.313 5.254 -9.309 1.00 25.00 O ATOM 795 CB ARG A 794 -13.855 7.920 -10.669 1.00 25.00 C ATOM 796 CG ARG A 794 -13.839 7.076 -11.911 1.00 25.00 C ATOM 797 CD ARG A 794 -12.719 7.640 -12.778 1.00 25.00 C ATOM 798 NE ARG A 794 -12.573 6.986 -14.086 1.00 25.00 N ATOM 799 CZ ARG A 794 -11.678 7.338 -15.004 1.00 25.00 C ATOM 800 NH1 ARG A 794 -10.837 8.326 -14.828 1.00 25.00 N ATOM 801 NH2 ARG A 794 -11.630 6.680 -16.130 1.00 25.00 N ATOM 0 H ARG A 794 -14.098 9.307 -8.708 1.00 25.00 H new ATOM 0 HA ARG A 794 -15.892 7.566 -10.076 1.00 25.00 H new ATOM 0 HB2 ARG A 794 -13.990 8.959 -10.970 1.00 25.00 H new ATOM 0 HB3 ARG A 794 -12.873 7.849 -10.201 1.00 25.00 H new ATOM 0 HG2 ARG A 794 -13.658 6.028 -11.670 1.00 25.00 H new ATOM 0 HG3 ARG A 794 -14.797 7.123 -12.429 1.00 25.00 H new ATOM 0 HD2 ARG A 794 -12.899 8.703 -12.936 1.00 25.00 H new ATOM 0 HD3 ARG A 794 -11.778 7.553 -12.235 1.00 25.00 H new ATOM 0 HE ARG A 794 -13.199 6.211 -14.304 1.00 25.00 H new ATOM 0 HH11 ARG A 794 -10.852 8.860 -13.959 1.00 25.00 H new ATOM 0 HH12 ARG A 794 -10.167 8.562 -15.560 1.00 25.00 H new ATOM 0 HH21 ARG A 794 -12.274 5.907 -16.297 1.00 25.00 H new ATOM 0 HH22 ARG A 794 -10.949 6.939 -16.843 1.00 25.00 H new ATOM 815 N ILE A 795 -13.714 6.167 -8.038 1.00 25.00 N ATOM 816 CA ILE A 795 -13.418 4.930 -7.325 1.00 25.00 C ATOM 817 C ILE A 795 -14.555 4.663 -6.370 1.00 25.00 C ATOM 818 O ILE A 795 -15.002 3.547 -6.248 1.00 25.00 O ATOM 819 CB ILE A 795 -12.126 4.993 -6.468 1.00 25.00 C ATOM 820 CG1 ILE A 795 -10.899 5.315 -7.328 1.00 25.00 C ATOM 821 CG2 ILE A 795 -11.906 3.637 -5.746 1.00 25.00 C ATOM 822 CD1 ILE A 795 -9.879 6.144 -6.577 1.00 25.00 C ATOM 0 H ILE A 795 -13.141 6.962 -7.755 1.00 25.00 H new ATOM 0 HA ILE A 795 -13.283 4.157 -8.081 1.00 25.00 H new ATOM 0 HB ILE A 795 -12.250 5.790 -5.735 1.00 25.00 H new ATOM 0 HG12 ILE A 795 -10.436 4.386 -7.661 1.00 25.00 H new ATOM 0 HG13 ILE A 795 -11.215 5.852 -8.222 1.00 25.00 H new ATOM 0 HG21 ILE A 795 -10.997 3.687 -5.146 1.00 25.00 H new ATOM 0 HG22 ILE A 795 -12.757 3.427 -5.098 1.00 25.00 H new ATOM 0 HG23 ILE A 795 -11.809 2.842 -6.486 1.00 25.00 H new ATOM 0 HD11 ILE A 795 -9.027 6.348 -7.226 1.00 25.00 H new ATOM 0 HD12 ILE A 795 -10.332 7.085 -6.267 1.00 25.00 H new ATOM 0 HD13 ILE A 795 -9.542 5.596 -5.697 1.00 25.00 H new ATOM 834 N MET A 796 -15.036 5.697 -5.697 1.00 25.00 N ATOM 835 CA MET A 796 -16.131 5.564 -4.731 1.00 25.00 C ATOM 836 C MET A 796 -17.358 4.905 -5.369 1.00 25.00 C ATOM 837 O MET A 796 -18.159 4.267 -4.697 1.00 25.00 O ATOM 838 CB MET A 796 -16.482 6.941 -4.164 1.00 25.00 C ATOM 839 CG MET A 796 -16.899 6.920 -2.714 1.00 25.00 C ATOM 840 SD MET A 796 -18.683 6.931 -2.522 1.00 25.00 S ATOM 841 CE MET A 796 -18.906 5.536 -1.479 1.00 25.00 C ATOM 0 H MET A 796 -14.685 6.649 -5.799 1.00 25.00 H new ATOM 0 HA MET A 796 -15.804 4.917 -3.917 1.00 25.00 H new ATOM 0 HB2 MET A 796 -15.619 7.598 -4.274 1.00 25.00 H new ATOM 0 HB3 MET A 796 -17.289 7.372 -4.757 1.00 25.00 H new ATOM 0 HG2 MET A 796 -16.489 6.032 -2.233 1.00 25.00 H new ATOM 0 HG3 MET A 796 -16.475 7.784 -2.203 1.00 25.00 H new ATOM 0 HE1 MET A 796 -19.837 5.032 -1.740 1.00 25.00 H new ATOM 0 HE2 MET A 796 -18.071 4.847 -1.609 1.00 25.00 H new ATOM 0 HE3 MET A 796 -18.948 5.862 -0.440 1.00 25.00 H new ATOM 851 N SER A 797 -17.465 5.052 -6.682 1.00 25.00 N ATOM 852 CA SER A 797 -18.554 4.473 -7.463 1.00 25.00 C ATOM 853 C SER A 797 -18.299 3.009 -7.825 1.00 25.00 C ATOM 854 O SER A 797 -19.239 2.292 -8.184 1.00 25.00 O ATOM 855 CB SER A 797 -18.756 5.274 -8.751 1.00 25.00 C ATOM 856 OG SER A 797 -19.865 4.774 -9.483 1.00 25.00 O ATOM 0 H SER A 797 -16.795 5.580 -7.241 1.00 25.00 H new ATOM 0 HA SER A 797 -19.448 4.515 -6.841 1.00 25.00 H new ATOM 0 HB2 SER A 797 -18.916 6.325 -8.510 1.00 25.00 H new ATOM 0 HB3 SER A 797 -17.856 5.221 -9.363 1.00 25.00 H new ATOM 0 HG SER A 797 -20.029 3.841 -9.232 1.00 25.00 H new ATOM 862 N ILE A 798 -17.048 2.557 -7.749 1.00 25.00 N ATOM 863 CA ILE A 798 -16.731 1.145 -7.997 1.00 25.00 C ATOM 864 C ILE A 798 -16.569 0.348 -6.695 1.00 25.00 C ATOM 865 O ILE A 798 -16.749 -0.869 -6.684 1.00 25.00 O ATOM 866 CB ILE A 798 -15.528 0.949 -8.978 1.00 25.00 C ATOM 867 CG1 ILE A 798 -14.175 1.256 -8.315 1.00 25.00 C ATOM 868 CG2 ILE A 798 -15.748 1.821 -10.247 1.00 25.00 C ATOM 869 CD1 ILE A 798 -12.951 0.943 -9.185 1.00 25.00 C ATOM 0 H ILE A 798 -16.242 3.139 -7.520 1.00 25.00 H new ATOM 0 HA ILE A 798 -17.597 0.728 -8.510 1.00 25.00 H new ATOM 0 HB ILE A 798 -15.492 -0.102 -9.265 1.00 25.00 H new ATOM 0 HG12 ILE A 798 -14.150 2.311 -8.042 1.00 25.00 H new ATOM 0 HG13 ILE A 798 -14.101 0.686 -7.389 1.00 25.00 H new ATOM 0 HG21 ILE A 798 -14.911 1.685 -10.931 1.00 25.00 H new ATOM 0 HG22 ILE A 798 -16.672 1.519 -10.740 1.00 25.00 H new ATOM 0 HG23 ILE A 798 -15.816 2.870 -9.960 1.00 25.00 H new ATOM 0 HD11 ILE A 798 -12.042 1.191 -8.637 1.00 25.00 H new ATOM 0 HD12 ILE A 798 -12.945 -0.117 -9.437 1.00 25.00 H new ATOM 0 HD13 ILE A 798 -12.995 1.533 -10.100 1.00 25.00 H new ATOM 881 N VAL A 799 -16.250 1.026 -5.598 1.00 25.00 N ATOM 882 CA VAL A 799 -16.024 0.369 -4.312 1.00 25.00 C ATOM 883 C VAL A 799 -17.304 0.315 -3.489 1.00 25.00 C ATOM 884 O VAL A 799 -17.284 0.180 -2.268 1.00 25.00 O ATOM 885 CB VAL A 799 -14.852 0.992 -3.505 1.00 25.00 C ATOM 886 CG1 VAL A 799 -13.541 0.794 -4.255 1.00 25.00 C ATOM 887 CG2 VAL A 799 -15.087 2.463 -3.214 1.00 25.00 C ATOM 0 H VAL A 799 -16.141 2.040 -5.573 1.00 25.00 H new ATOM 0 HA VAL A 799 -15.722 -0.654 -4.538 1.00 25.00 H new ATOM 0 HB VAL A 799 -14.795 0.479 -2.545 1.00 25.00 H new ATOM 0 HG11 VAL A 799 -12.724 1.234 -3.682 1.00 25.00 H new ATOM 0 HG12 VAL A 799 -13.357 -0.272 -4.390 1.00 25.00 H new ATOM 0 HG13 VAL A 799 -13.603 1.278 -5.230 1.00 25.00 H new ATOM 0 HG21 VAL A 799 -14.245 2.861 -2.648 1.00 25.00 H new ATOM 0 HG22 VAL A 799 -15.184 3.009 -4.153 1.00 25.00 H new ATOM 0 HG23 VAL A 799 -16.001 2.577 -2.632 1.00 25.00 H new ATOM 897 N ASP A 800 -18.436 0.378 -4.166 1.00 25.00 N ATOM 898 CA ASP A 800 -19.701 0.064 -3.521 1.00 25.00 C ATOM 899 C ASP A 800 -20.405 -1.068 -4.321 1.00 25.00 C ATOM 900 O ASP A 800 -21.476 -0.894 -4.880 1.00 25.00 O ATOM 901 CB ASP A 800 -20.565 1.317 -3.245 1.00 25.00 C ATOM 902 CG ASP A 800 -21.342 1.803 -4.445 1.00 25.00 C ATOM 903 OD1 ASP A 800 -20.751 2.093 -5.497 1.00 25.00 O ATOM 904 OD2 ASP A 800 -22.588 1.901 -4.308 1.00 25.00 O ATOM 0 H ASP A 800 -18.508 0.640 -5.149 1.00 25.00 H new ATOM 0 HA ASP A 800 -19.519 -0.319 -2.517 1.00 25.00 H new ATOM 0 HB2 ASP A 800 -21.264 1.094 -2.439 1.00 25.00 H new ATOM 0 HB3 ASP A 800 -19.919 2.121 -2.893 1.00 25.00 H new ATOM 909 N PRO A 801 -19.793 -2.279 -4.370 1.00 25.00 N ATOM 910 CA PRO A 801 -20.342 -3.416 -5.136 1.00 25.00 C ATOM 911 C PRO A 801 -21.672 -3.987 -4.630 1.00 25.00 C ATOM 912 O PRO A 801 -22.150 -4.996 -5.120 1.00 25.00 O ATOM 913 CB PRO A 801 -19.238 -4.475 -4.994 1.00 25.00 C ATOM 914 CG PRO A 801 -18.600 -4.161 -3.700 1.00 25.00 C ATOM 915 CD PRO A 801 -18.527 -2.671 -3.721 1.00 25.00 C ATOM 0 HA PRO A 801 -20.583 -3.101 -6.151 1.00 25.00 H new ATOM 0 HB2 PRO A 801 -19.651 -5.484 -5.000 1.00 25.00 H new ATOM 0 HB3 PRO A 801 -18.523 -4.418 -5.815 1.00 25.00 H new ATOM 0 HG2 PRO A 801 -19.190 -4.525 -2.859 1.00 25.00 H new ATOM 0 HG3 PRO A 801 -17.612 -4.613 -3.616 1.00 25.00 H new ATOM 0 HD2 PRO A 801 -18.445 -2.258 -2.716 1.00 25.00 H new ATOM 0 HD3 PRO A 801 -17.661 -2.318 -4.282 1.00 25.00 H new ATOM 923 N ASN A 802 -22.263 -3.341 -3.637 1.00 25.00 N ATOM 924 CA ASN A 802 -23.535 -3.769 -3.053 1.00 25.00 C ATOM 925 C ASN A 802 -24.552 -2.675 -3.400 1.00 25.00 C ATOM 926 O ASN A 802 -25.718 -2.761 -3.044 1.00 25.00 O ATOM 927 CB ASN A 802 -23.417 -3.901 -1.527 1.00 25.00 C ATOM 928 CG ASN A 802 -22.751 -5.182 -1.071 1.00 25.00 C ATOM 929 OD1 ASN A 802 -21.838 -5.689 -1.835 1.00 25.00 O flip ATOM 930 ND2 ASN A 802 -23.062 -5.693 -0.013 1.00 25.00 N flip ATOM 0 H ASN A 802 -21.876 -2.500 -3.208 1.00 25.00 H new ATOM 0 HA ASN A 802 -23.834 -4.742 -3.442 1.00 25.00 H new ATOM 0 HB2 ASN A 802 -22.852 -3.052 -1.141 1.00 25.00 H new ATOM 0 HB3 ASN A 802 -24.414 -3.846 -1.089 1.00 25.00 H new ATOM 0 HD21 ASN A 802 -23.786 -5.267 0.566 1.00 25.00 H new ATOM 0 HD22 ASN A 802 -22.599 -6.547 0.296 1.00 25.00 H new ATOM 937 N ARG A 803 -24.062 -1.647 -4.095 1.00 25.00 N ATOM 938 CA ARG A 803 -24.847 -0.497 -4.571 1.00 25.00 C ATOM 939 C ARG A 803 -25.590 0.246 -3.468 1.00 25.00 C ATOM 940 O ARG A 803 -26.723 0.680 -3.637 1.00 25.00 O ATOM 941 CB ARG A 803 -25.789 -0.930 -5.698 1.00 25.00 C ATOM 942 CG ARG A 803 -25.084 -1.733 -6.815 1.00 25.00 C ATOM 943 CD ARG A 803 -23.862 -1.020 -7.428 1.00 25.00 C ATOM 944 NE ARG A 803 -24.072 0.411 -7.713 1.00 25.00 N ATOM 945 CZ ARG A 803 -23.093 1.293 -7.905 1.00 25.00 C ATOM 946 NH1 ARG A 803 -21.836 0.940 -7.885 1.00 25.00 N ATOM 947 NH2 ARG A 803 -23.383 2.547 -8.110 1.00 25.00 N ATOM 0 H ARG A 803 -23.077 -1.586 -4.352 1.00 25.00 H new ATOM 0 HA ARG A 803 -24.132 0.227 -4.962 1.00 25.00 H new ATOM 0 HB2 ARG A 803 -26.592 -1.535 -5.277 1.00 25.00 H new ATOM 0 HB3 ARG A 803 -26.252 -0.045 -6.134 1.00 25.00 H new ATOM 0 HG2 ARG A 803 -24.766 -2.694 -6.411 1.00 25.00 H new ATOM 0 HG3 ARG A 803 -25.804 -1.943 -7.606 1.00 25.00 H new ATOM 0 HD2 ARG A 803 -23.017 -1.122 -6.747 1.00 25.00 H new ATOM 0 HD3 ARG A 803 -23.588 -1.526 -8.354 1.00 25.00 H new ATOM 0 HE ARG A 803 -25.033 0.749 -7.767 1.00 25.00 H new ATOM 0 HH11 ARG A 803 -21.582 -0.034 -7.719 1.00 25.00 H new ATOM 0 HH12 ARG A 803 -21.108 1.638 -8.035 1.00 25.00 H new ATOM 0 HH21 ARG A 803 -24.357 2.850 -8.123 1.00 25.00 H new ATOM 0 HH22 ARG A 803 -22.636 3.226 -8.257 1.00 25.00 H new ATOM 961 N LEU A 804 -24.912 0.387 -2.341 1.00 25.00 N ATOM 962 CA LEU A 804 -25.451 1.069 -1.161 1.00 25.00 C ATOM 963 C LEU A 804 -24.858 2.466 -0.978 1.00 25.00 C ATOM 964 O LEU A 804 -25.290 3.218 -0.114 1.00 25.00 O ATOM 965 CB LEU A 804 -25.219 0.232 0.112 1.00 25.00 C ATOM 966 CG LEU A 804 -24.179 -0.900 0.065 1.00 25.00 C ATOM 967 CD1 LEU A 804 -22.742 -0.397 -0.092 1.00 25.00 C ATOM 968 CD2 LEU A 804 -24.255 -1.780 1.310 1.00 25.00 C ATOM 0 H LEU A 804 -23.965 0.031 -2.212 1.00 25.00 H new ATOM 0 HA LEU A 804 -26.522 1.181 -1.327 1.00 25.00 H new ATOM 0 HB2 LEU A 804 -24.930 0.915 0.910 1.00 25.00 H new ATOM 0 HB3 LEU A 804 -26.174 -0.207 0.399 1.00 25.00 H new ATOM 0 HG LEU A 804 -24.433 -1.482 -0.821 1.00 25.00 H new ATOM 0 HD11 LEU A 804 -22.060 -1.247 -0.118 1.00 25.00 H new ATOM 0 HD12 LEU A 804 -22.654 0.168 -1.020 1.00 25.00 H new ATOM 0 HD13 LEU A 804 -22.488 0.247 0.750 1.00 25.00 H new ATOM 0 HD21 LEU A 804 -23.506 -2.570 1.244 1.00 25.00 H new ATOM 0 HD22 LEU A 804 -24.066 -1.174 2.196 1.00 25.00 H new ATOM 0 HD23 LEU A 804 -25.247 -2.226 1.381 1.00 25.00 H new ATOM 980 N GLY A 805 -23.878 2.810 -1.800 1.00 25.00 N ATOM 981 CA GLY A 805 -23.270 4.134 -1.729 1.00 25.00 C ATOM 982 C GLY A 805 -22.297 4.301 -0.576 1.00 25.00 C ATOM 983 O GLY A 805 -22.075 5.410 -0.092 1.00 25.00 O ATOM 0 H GLY A 805 -23.488 2.199 -2.518 1.00 25.00 H new ATOM 0 HA2 GLY A 805 -22.748 4.334 -2.665 1.00 25.00 H new ATOM 0 HA3 GLY A 805 -24.058 4.881 -1.638 1.00 25.00 H new ATOM 987 N VAL A 806 -21.719 3.196 -0.125 1.00 25.00 N ATOM 988 CA VAL A 806 -20.753 3.214 0.974 1.00 25.00 C ATOM 989 C VAL A 806 -19.686 2.147 0.709 1.00 25.00 C ATOM 990 O VAL A 806 -19.958 1.160 0.029 1.00 25.00 O ATOM 991 CB VAL A 806 -21.410 2.921 2.354 1.00 25.00 C ATOM 992 CG1 VAL A 806 -21.141 4.060 3.332 1.00 25.00 C ATOM 993 CG2 VAL A 806 -22.930 2.712 2.258 1.00 25.00 C ATOM 0 H VAL A 806 -21.902 2.267 -0.504 1.00 25.00 H new ATOM 0 HA VAL A 806 -20.323 4.215 1.016 1.00 25.00 H new ATOM 0 HB VAL A 806 -20.958 1.995 2.711 1.00 25.00 H new ATOM 0 HG11 VAL A 806 -21.609 3.835 4.290 1.00 25.00 H new ATOM 0 HG12 VAL A 806 -20.066 4.174 3.471 1.00 25.00 H new ATOM 0 HG13 VAL A 806 -21.556 4.986 2.934 1.00 25.00 H new ATOM 0 HG21 VAL A 806 -23.333 2.511 3.251 1.00 25.00 H new ATOM 0 HG22 VAL A 806 -23.396 3.610 1.852 1.00 25.00 H new ATOM 0 HG23 VAL A 806 -23.140 1.866 1.603 1.00 25.00 H new ATOM 1003 N VAL A 807 -18.482 2.342 1.228 1.00 25.00 N ATOM 1004 CA VAL A 807 -17.371 1.438 0.968 1.00 25.00 C ATOM 1005 C VAL A 807 -17.334 0.356 2.023 1.00 25.00 C ATOM 1006 O VAL A 807 -17.320 0.637 3.219 1.00 25.00 O ATOM 1007 CB VAL A 807 -16.043 2.221 0.967 1.00 25.00 C ATOM 1008 CG1 VAL A 807 -14.867 1.326 0.608 1.00 25.00 C ATOM 1009 CG2 VAL A 807 -16.146 3.385 -0.021 1.00 25.00 C ATOM 0 H VAL A 807 -18.249 3.126 1.837 1.00 25.00 H new ATOM 0 HA VAL A 807 -17.508 0.977 -0.010 1.00 25.00 H new ATOM 0 HB VAL A 807 -15.866 2.604 1.972 1.00 25.00 H new ATOM 0 HG11 VAL A 807 -13.948 1.912 0.617 1.00 25.00 H new ATOM 0 HG12 VAL A 807 -14.790 0.518 1.335 1.00 25.00 H new ATOM 0 HG13 VAL A 807 -15.020 0.906 -0.386 1.00 25.00 H new ATOM 0 HG21 VAL A 807 -15.209 3.942 -0.026 1.00 25.00 H new ATOM 0 HG22 VAL A 807 -16.343 2.997 -1.021 1.00 25.00 H new ATOM 0 HG23 VAL A 807 -16.960 4.046 0.279 1.00 25.00 H new ATOM 1019 N THR A 808 -17.332 -0.886 1.572 1.00 25.00 N ATOM 1020 CA THR A 808 -17.364 -2.037 2.470 1.00 25.00 C ATOM 1021 C THR A 808 -16.031 -2.728 2.561 1.00 25.00 C ATOM 1022 O THR A 808 -15.174 -2.510 1.749 1.00 25.00 O ATOM 1023 CB THR A 808 -18.375 -3.098 1.984 1.00 25.00 C ATOM 1024 OG1 THR A 808 -17.705 -4.009 1.120 1.00 25.00 O ATOM 1025 CG2 THR A 808 -19.491 -2.493 1.172 1.00 25.00 C ATOM 0 H THR A 808 -17.308 -1.129 0.582 1.00 25.00 H new ATOM 0 HA THR A 808 -17.648 -1.636 3.443 1.00 25.00 H new ATOM 0 HB THR A 808 -18.786 -3.577 2.872 1.00 25.00 H new ATOM 0 HG1 THR A 808 -17.909 -3.786 0.188 1.00 25.00 H new ATOM 0 HG21 THR A 808 -20.176 -3.279 0.853 1.00 25.00 H new ATOM 0 HG22 THR A 808 -20.030 -1.766 1.779 1.00 25.00 H new ATOM 0 HG23 THR A 808 -19.075 -1.996 0.295 1.00 25.00 H new ATOM 1033 N PHE A 809 -15.876 -3.585 3.552 1.00 25.00 N ATOM 1034 CA PHE A 809 -14.659 -4.365 3.763 1.00 25.00 C ATOM 1035 C PHE A 809 -14.176 -5.099 2.531 1.00 25.00 C ATOM 1036 O PHE A 809 -12.993 -5.104 2.263 1.00 25.00 O ATOM 1037 CB PHE A 809 -14.898 -5.361 4.894 1.00 25.00 C ATOM 1038 CG PHE A 809 -16.355 -5.639 5.149 1.00 25.00 C ATOM 1039 CD1 PHE A 809 -17.031 -6.645 4.430 1.00 25.00 C ATOM 1040 CD2 PHE A 809 -17.068 -4.888 6.107 1.00 25.00 C ATOM 1041 CE1 PHE A 809 -18.408 -6.891 4.650 1.00 25.00 C ATOM 1042 CE2 PHE A 809 -18.443 -5.123 6.335 1.00 25.00 C ATOM 1043 CZ PHE A 809 -19.116 -6.123 5.601 1.00 25.00 C ATOM 0 H PHE A 809 -16.600 -3.766 4.247 1.00 25.00 H new ATOM 0 HA PHE A 809 -13.872 -3.656 4.018 1.00 25.00 H new ATOM 0 HB2 PHE A 809 -14.394 -6.297 4.656 1.00 25.00 H new ATOM 0 HB3 PHE A 809 -14.444 -4.978 5.808 1.00 25.00 H new ATOM 0 HD1 PHE A 809 -16.493 -7.235 3.703 1.00 25.00 H new ATOM 0 HD2 PHE A 809 -16.557 -4.124 6.673 1.00 25.00 H new ATOM 0 HE1 PHE A 809 -18.916 -7.664 4.092 1.00 25.00 H new ATOM 0 HE2 PHE A 809 -18.977 -4.539 7.069 1.00 25.00 H new ATOM 0 HZ PHE A 809 -20.169 -6.300 5.766 1.00 25.00 H new ATOM 1053 N GLN A 810 -15.078 -5.704 1.773 1.00 25.00 N ATOM 1054 CA GLN A 810 -14.674 -6.412 0.560 1.00 25.00 C ATOM 1055 C GLN A 810 -14.326 -5.415 -0.544 1.00 25.00 C ATOM 1056 O GLN A 810 -13.680 -5.755 -1.521 1.00 25.00 O ATOM 1057 CB GLN A 810 -15.793 -7.364 0.109 1.00 25.00 C ATOM 1058 CG GLN A 810 -16.958 -6.675 -0.594 1.00 25.00 C ATOM 1059 CD GLN A 810 -18.307 -7.245 -0.192 1.00 25.00 C ATOM 1060 OE1 GLN A 810 -18.565 -8.420 -0.355 1.00 25.00 O ATOM 1061 NE2 GLN A 810 -19.165 -6.410 0.344 1.00 25.00 N ATOM 0 H GLN A 810 -16.079 -5.722 1.968 1.00 25.00 H new ATOM 0 HA GLN A 810 -13.784 -7.005 0.773 1.00 25.00 H new ATOM 0 HB2 GLN A 810 -15.370 -8.111 -0.562 1.00 25.00 H new ATOM 0 HB3 GLN A 810 -16.174 -7.897 0.980 1.00 25.00 H new ATOM 0 HG2 GLN A 810 -16.936 -5.610 -0.365 1.00 25.00 H new ATOM 0 HG3 GLN A 810 -16.834 -6.772 -1.673 1.00 25.00 H new ATOM 0 HE21 GLN A 810 -18.914 -5.429 0.466 1.00 25.00 H new ATOM 0 HE22 GLN A 810 -20.083 -6.742 0.639 1.00 25.00 H new ATOM 1070 N ALA A 811 -14.787 -4.183 -0.375 1.00 25.00 N ATOM 1071 CA ALA A 811 -14.587 -3.135 -1.364 1.00 25.00 C ATOM 1072 C ALA A 811 -13.265 -2.413 -1.173 1.00 25.00 C ATOM 1073 O ALA A 811 -12.619 -2.025 -2.121 1.00 25.00 O ATOM 1074 CB ALA A 811 -15.700 -2.162 -1.287 1.00 25.00 C ATOM 0 H ALA A 811 -15.308 -3.884 0.449 1.00 25.00 H new ATOM 0 HA ALA A 811 -14.566 -3.607 -2.346 1.00 25.00 H new ATOM 0 HB1 ALA A 811 -15.549 -1.377 -2.028 1.00 25.00 H new ATOM 0 HB2 ALA A 811 -16.643 -2.672 -1.485 1.00 25.00 H new ATOM 0 HB3 ALA A 811 -15.728 -1.720 -0.291 1.00 25.00 H new ATOM 1080 N PHE A 812 -12.881 -2.229 0.081 1.00 25.00 N ATOM 1081 CA PHE A 812 -11.631 -1.533 0.403 1.00 25.00 C ATOM 1082 C PHE A 812 -10.440 -2.216 -0.258 1.00 25.00 C ATOM 1083 O PHE A 812 -9.463 -1.577 -0.637 1.00 25.00 O ATOM 1084 CB PHE A 812 -11.387 -1.509 1.906 1.00 25.00 C ATOM 1085 CG PHE A 812 -12.259 -0.581 2.642 1.00 25.00 C ATOM 1086 CD1 PHE A 812 -12.032 0.805 2.653 1.00 25.00 C ATOM 1087 CD2 PHE A 812 -13.322 -1.096 3.346 1.00 25.00 C ATOM 1088 CE1 PHE A 812 -12.918 1.649 3.351 1.00 25.00 C ATOM 1089 CE2 PHE A 812 -14.210 -0.287 4.030 1.00 25.00 C ATOM 1090 CZ PHE A 812 -14.030 1.075 4.027 1.00 25.00 C ATOM 0 H PHE A 812 -13.409 -2.548 0.893 1.00 25.00 H new ATOM 0 HA PHE A 812 -11.731 -0.514 0.028 1.00 25.00 H new ATOM 0 HB2 PHE A 812 -11.528 -2.515 2.302 1.00 25.00 H new ATOM 0 HB3 PHE A 812 -10.348 -1.237 2.090 1.00 25.00 H new ATOM 0 HD1 PHE A 812 -11.184 1.221 2.130 1.00 25.00 H new ATOM 0 HD2 PHE A 812 -13.468 -2.166 3.365 1.00 25.00 H new ATOM 0 HE1 PHE A 812 -12.755 2.716 3.373 1.00 25.00 H new ATOM 0 HE2 PHE A 812 -15.041 -0.723 4.564 1.00 25.00 H new ATOM 0 HZ PHE A 812 -14.735 1.712 4.540 1.00 25.00 H new ATOM 1100 N ILE A 813 -10.540 -3.529 -0.378 1.00 25.00 N ATOM 1101 CA ILE A 813 -9.468 -4.369 -0.909 1.00 25.00 C ATOM 1102 C ILE A 813 -9.115 -3.968 -2.323 1.00 25.00 C ATOM 1103 O ILE A 813 -7.969 -4.048 -2.738 1.00 25.00 O ATOM 1104 CB ILE A 813 -9.906 -5.846 -0.912 1.00 25.00 C ATOM 1105 CG1 ILE A 813 -10.485 -6.239 0.467 1.00 25.00 C ATOM 1106 CG2 ILE A 813 -8.737 -6.758 -1.329 1.00 25.00 C ATOM 1107 CD1 ILE A 813 -9.689 -5.747 1.730 1.00 25.00 C ATOM 0 H ILE A 813 -11.374 -4.051 -0.108 1.00 25.00 H new ATOM 0 HA ILE A 813 -8.595 -4.237 -0.270 1.00 25.00 H new ATOM 0 HB ILE A 813 -10.698 -5.979 -1.649 1.00 25.00 H new ATOM 0 HG12 ILE A 813 -11.502 -5.852 0.533 1.00 25.00 H new ATOM 0 HG13 ILE A 813 -10.555 -7.326 0.510 1.00 25.00 H new ATOM 0 HG21 ILE A 813 -9.067 -7.797 -1.325 1.00 25.00 H new ATOM 0 HG22 ILE A 813 -8.404 -6.487 -2.331 1.00 25.00 H new ATOM 0 HG23 ILE A 813 -7.912 -6.636 -0.627 1.00 25.00 H new ATOM 0 HD11 ILE A 813 -10.195 -6.086 2.634 1.00 25.00 H new ATOM 0 HD12 ILE A 813 -8.679 -6.155 1.705 1.00 25.00 H new ATOM 0 HD13 ILE A 813 -9.640 -4.658 1.728 1.00 25.00 H new ATOM 1119 N ASP A 814 -10.116 -3.516 -3.044 1.00 25.00 N ATOM 1120 CA ASP A 814 -9.928 -3.035 -4.412 1.00 25.00 C ATOM 1121 C ASP A 814 -8.778 -2.015 -4.467 1.00 25.00 C ATOM 1122 O ASP A 814 -7.885 -2.109 -5.308 1.00 25.00 O ATOM 1123 CB ASP A 814 -11.227 -2.397 -4.904 1.00 25.00 C ATOM 1124 CG ASP A 814 -11.392 -2.486 -6.412 1.00 25.00 C ATOM 1125 OD1 ASP A 814 -10.905 -3.463 -7.020 1.00 25.00 O ATOM 1126 OD2 ASP A 814 -12.022 -1.576 -6.989 1.00 25.00 O ATOM 0 H ASP A 814 -11.079 -3.468 -2.711 1.00 25.00 H new ATOM 0 HA ASP A 814 -9.670 -3.875 -5.058 1.00 25.00 H new ATOM 0 HB2 ASP A 814 -12.073 -2.887 -4.421 1.00 25.00 H new ATOM 0 HB3 ASP A 814 -11.250 -1.350 -4.602 1.00 25.00 H new ATOM 1131 N PHE A 815 -8.778 -1.059 -3.542 1.00 25.00 N ATOM 1132 CA PHE A 815 -7.704 -0.064 -3.481 1.00 25.00 C ATOM 1133 C PHE A 815 -6.436 -0.676 -2.897 1.00 25.00 C ATOM 1134 O PHE A 815 -5.339 -0.399 -3.319 1.00 25.00 O ATOM 1135 CB PHE A 815 -8.111 1.134 -2.630 1.00 25.00 C ATOM 1136 CG PHE A 815 -7.350 2.381 -2.966 1.00 25.00 C ATOM 1137 CD1 PHE A 815 -5.963 2.492 -2.702 1.00 25.00 C ATOM 1138 CD2 PHE A 815 -8.015 3.466 -3.567 1.00 25.00 C ATOM 1139 CE1 PHE A 815 -5.265 3.650 -3.058 1.00 25.00 C ATOM 1140 CE2 PHE A 815 -7.322 4.617 -3.907 1.00 25.00 C ATOM 1141 CZ PHE A 815 -5.949 4.709 -3.668 1.00 25.00 C ATOM 0 H PHE A 815 -9.500 -0.950 -2.830 1.00 25.00 H new ATOM 0 HA PHE A 815 -7.514 0.270 -4.501 1.00 25.00 H new ATOM 0 HB2 PHE A 815 -9.177 1.320 -2.761 1.00 25.00 H new ATOM 0 HB3 PHE A 815 -7.957 0.894 -1.578 1.00 25.00 H new ATOM 0 HD1 PHE A 815 -5.441 1.677 -2.223 1.00 25.00 H new ATOM 0 HD2 PHE A 815 -9.075 3.401 -3.765 1.00 25.00 H new ATOM 0 HE1 PHE A 815 -4.205 3.727 -2.864 1.00 25.00 H new ATOM 0 HE2 PHE A 815 -7.846 5.446 -4.359 1.00 25.00 H new ATOM 0 HZ PHE A 815 -5.412 5.601 -3.955 1.00 25.00 H new ATOM 1151 N MET A 816 -6.587 -1.533 -1.917 1.00 25.00 N ATOM 1152 CA MET A 816 -5.427 -2.198 -1.331 1.00 25.00 C ATOM 1153 C MET A 816 -4.631 -3.019 -2.367 1.00 25.00 C ATOM 1154 O MET A 816 -3.449 -3.229 -2.223 1.00 25.00 O ATOM 1155 CB MET A 816 -5.905 -3.149 -0.278 1.00 25.00 C ATOM 1156 CG MET A 816 -5.084 -3.183 1.018 1.00 25.00 C ATOM 1157 SD MET A 816 -3.355 -3.581 0.899 1.00 25.00 S ATOM 1158 CE MET A 816 -2.683 -1.959 1.080 1.00 25.00 C ATOM 0 H MET A 816 -7.484 -1.790 -1.506 1.00 25.00 H new ATOM 0 HA MET A 816 -4.775 -1.422 -0.928 1.00 25.00 H new ATOM 0 HB2 MET A 816 -6.935 -2.894 -0.026 1.00 25.00 H new ATOM 0 HB3 MET A 816 -5.920 -4.153 -0.702 1.00 25.00 H new ATOM 0 HG2 MET A 816 -5.170 -2.206 1.494 1.00 25.00 H new ATOM 0 HG3 MET A 816 -5.548 -3.906 1.689 1.00 25.00 H new ATOM 0 HE1 MET A 816 -1.599 -2.023 1.173 1.00 25.00 H new ATOM 0 HE2 MET A 816 -2.937 -1.360 0.205 1.00 25.00 H new ATOM 0 HE3 MET A 816 -3.097 -1.491 1.973 1.00 25.00 H new ATOM 1168 N SER A 817 -5.280 -3.500 -3.416 1.00 25.00 N ATOM 1169 CA SER A 817 -4.571 -4.219 -4.471 1.00 25.00 C ATOM 1170 C SER A 817 -3.959 -3.223 -5.474 1.00 25.00 C ATOM 1171 O SER A 817 -2.986 -3.525 -6.174 1.00 25.00 O ATOM 1172 CB SER A 817 -5.538 -5.197 -5.140 1.00 25.00 C ATOM 1173 OG SER A 817 -5.290 -5.349 -6.526 1.00 25.00 O ATOM 0 H SER A 817 -6.285 -3.409 -3.562 1.00 25.00 H new ATOM 0 HA SER A 817 -3.744 -4.792 -4.051 1.00 25.00 H new ATOM 0 HB2 SER A 817 -5.460 -6.169 -4.653 1.00 25.00 H new ATOM 0 HB3 SER A 817 -6.560 -4.848 -4.994 1.00 25.00 H new ATOM 0 HG SER A 817 -5.933 -5.984 -6.906 1.00 25.00 H new ATOM 1179 N ARG A 818 -4.524 -2.023 -5.512 1.00 25.00 N ATOM 1180 CA ARG A 818 -4.014 -0.917 -6.369 1.00 25.00 C ATOM 1181 C ARG A 818 -2.681 -0.409 -5.849 1.00 25.00 C ATOM 1182 O ARG A 818 -1.899 0.183 -6.585 1.00 25.00 O ATOM 1183 CB ARG A 818 -4.972 0.283 -6.368 1.00 25.00 C ATOM 1184 CG ARG A 818 -6.181 0.131 -7.244 1.00 25.00 C ATOM 1185 CD ARG A 818 -5.831 0.473 -8.683 1.00 25.00 C ATOM 1186 NE ARG A 818 -5.413 1.893 -8.823 1.00 25.00 N ATOM 1187 CZ ARG A 818 -4.168 2.322 -9.042 1.00 25.00 C ATOM 1188 NH1 ARG A 818 -3.157 1.505 -9.193 1.00 25.00 N ATOM 1189 NH2 ARG A 818 -3.928 3.600 -9.101 1.00 25.00 N ATOM 0 H ARG A 818 -5.344 -1.772 -4.960 1.00 25.00 H new ATOM 0 HA ARG A 818 -3.917 -1.326 -7.375 1.00 25.00 H new ATOM 0 HB2 ARG A 818 -5.303 0.463 -5.345 1.00 25.00 H new ATOM 0 HB3 ARG A 818 -4.421 1.169 -6.685 1.00 25.00 H new ATOM 0 HG2 ARG A 818 -6.555 -0.891 -7.186 1.00 25.00 H new ATOM 0 HG3 ARG A 818 -6.980 0.784 -6.891 1.00 25.00 H new ATOM 0 HD2 ARG A 818 -5.028 -0.179 -9.027 1.00 25.00 H new ATOM 0 HD3 ARG A 818 -6.693 0.282 -9.323 1.00 25.00 H new ATOM 0 HE ARG A 818 -6.142 2.602 -8.745 1.00 25.00 H new ATOM 0 HH11 ARG A 818 -3.304 0.497 -9.145 1.00 25.00 H new ATOM 0 HH12 ARG A 818 -2.222 1.876 -9.359 1.00 25.00 H new ATOM 0 HH21 ARG A 818 -4.689 4.268 -8.980 1.00 25.00 H new ATOM 0 HH22 ARG A 818 -2.979 3.933 -9.268 1.00 25.00 H new ATOM 1203 N GLU A 819 -2.460 -0.669 -4.576 1.00 25.00 N ATOM 1204 CA GLU A 819 -1.272 -0.278 -3.819 1.00 25.00 C ATOM 1205 C GLU A 819 0.062 -0.628 -4.494 1.00 25.00 C ATOM 1206 O GLU A 819 1.063 0.045 -4.313 1.00 25.00 O ATOM 1207 CB GLU A 819 -1.369 -1.076 -2.530 1.00 25.00 C ATOM 1208 CG GLU A 819 -0.400 -0.779 -1.438 1.00 25.00 C ATOM 1209 CD GLU A 819 -0.868 0.340 -0.504 1.00 25.00 C ATOM 1210 OE1 GLU A 819 -1.997 0.865 -0.686 1.00 25.00 O ATOM 1211 OE2 GLU A 819 -0.112 0.672 0.427 1.00 25.00 O ATOM 0 H GLU A 819 -3.133 -1.183 -4.007 1.00 25.00 H new ATOM 0 HA GLU A 819 -1.264 0.806 -3.703 1.00 25.00 H new ATOM 0 HB2 GLU A 819 -2.373 -0.938 -2.129 1.00 25.00 H new ATOM 0 HB3 GLU A 819 -1.269 -2.131 -2.784 1.00 25.00 H new ATOM 0 HG2 GLU A 819 -0.232 -1.684 -0.854 1.00 25.00 H new ATOM 0 HG3 GLU A 819 0.558 -0.500 -1.877 1.00 25.00 H new ATOM 1218 N THR A 820 0.050 -1.702 -5.268 1.00 25.00 N ATOM 1219 CA THR A 820 1.249 -2.236 -5.923 1.00 25.00 C ATOM 1220 C THR A 820 1.814 -1.378 -7.069 1.00 25.00 C ATOM 1221 O THR A 820 2.777 -1.769 -7.744 1.00 25.00 O ATOM 1222 CB THR A 820 0.929 -3.626 -6.495 1.00 25.00 C ATOM 1223 OG1 THR A 820 -0.161 -3.526 -7.421 1.00 25.00 O ATOM 1224 CG2 THR A 820 0.502 -4.565 -5.390 1.00 25.00 C ATOM 0 H THR A 820 -0.796 -2.237 -5.465 1.00 25.00 H new ATOM 0 HA THR A 820 2.013 -2.256 -5.146 1.00 25.00 H new ATOM 0 HB THR A 820 1.825 -4.005 -6.986 1.00 25.00 H new ATOM 0 HG1 THR A 820 -1.010 -3.568 -6.933 1.00 25.00 H new ATOM 0 HG21 THR A 820 0.279 -5.545 -5.811 1.00 25.00 H new ATOM 0 HG22 THR A 820 1.307 -4.658 -4.661 1.00 25.00 H new ATOM 0 HG23 THR A 820 -0.388 -4.170 -4.900 1.00 25.00 H new ATOM 1232 N ALA A 821 1.212 -0.221 -7.294 1.00 25.00 N ATOM 1233 CA ALA A 821 1.645 0.700 -8.341 1.00 25.00 C ATOM 1234 C ALA A 821 2.694 1.687 -7.789 1.00 25.00 C ATOM 1235 O ALA A 821 3.430 1.383 -6.860 1.00 25.00 O ATOM 1236 CB ALA A 821 0.419 1.456 -8.895 1.00 25.00 C ATOM 0 H ALA A 821 0.409 0.109 -6.758 1.00 25.00 H new ATOM 0 HA ALA A 821 2.109 0.136 -9.150 1.00 25.00 H new ATOM 0 HB1 ALA A 821 0.739 2.145 -9.677 1.00 25.00 H new ATOM 0 HB2 ALA A 821 -0.292 0.742 -9.309 1.00 25.00 H new ATOM 0 HB3 ALA A 821 -0.057 2.017 -8.090 1.00 25.00 H new ATOM 1242 N ASP A 822 2.753 2.866 -8.384 1.00 25.00 N ATOM 1243 CA ASP A 822 3.646 3.937 -7.953 1.00 25.00 C ATOM 1244 C ASP A 822 2.742 5.133 -7.689 1.00 25.00 C ATOM 1245 O ASP A 822 1.689 5.265 -8.320 1.00 25.00 O ATOM 1246 CB ASP A 822 4.709 4.255 -9.020 1.00 25.00 C ATOM 1247 CG ASP A 822 4.145 4.254 -10.439 1.00 25.00 C ATOM 1248 OD1 ASP A 822 3.936 3.142 -10.991 1.00 25.00 O ATOM 1249 OD2 ASP A 822 3.926 5.340 -11.006 1.00 25.00 O ATOM 0 H ASP A 822 2.177 3.113 -9.189 1.00 25.00 H new ATOM 0 HA ASP A 822 4.208 3.655 -7.063 1.00 25.00 H new ATOM 0 HB2 ASP A 822 5.148 5.230 -8.809 1.00 25.00 H new ATOM 0 HB3 ASP A 822 5.514 3.523 -8.954 1.00 25.00 H new ATOM 1254 N THR A 823 3.132 5.978 -6.742 1.00 25.00 N ATOM 1255 CA THR A 823 2.296 7.099 -6.320 1.00 25.00 C ATOM 1256 C THR A 823 3.110 8.298 -5.854 1.00 25.00 C ATOM 1257 O THR A 823 4.282 8.167 -5.542 1.00 25.00 O ATOM 1258 CB THR A 823 1.399 6.681 -5.130 1.00 25.00 C ATOM 1259 OG1 THR A 823 1.282 5.258 -5.084 1.00 25.00 O ATOM 1260 CG2 THR A 823 0.037 7.261 -5.271 1.00 25.00 C ATOM 0 H THR A 823 4.023 5.909 -6.250 1.00 25.00 H new ATOM 0 HA THR A 823 1.709 7.377 -7.195 1.00 25.00 H new ATOM 0 HB THR A 823 1.860 7.051 -4.214 1.00 25.00 H new ATOM 0 HG1 THR A 823 0.714 5.001 -4.328 1.00 25.00 H new ATOM 0 HG21 THR A 823 -0.578 6.955 -4.425 1.00 25.00 H new ATOM 0 HG22 THR A 823 0.105 8.349 -5.296 1.00 25.00 H new ATOM 0 HG23 THR A 823 -0.416 6.905 -6.196 1.00 25.00 H new ATOM 1268 N ASP A 824 2.475 9.461 -5.782 1.00 25.00 N ATOM 1269 CA ASP A 824 3.124 10.670 -5.263 1.00 25.00 C ATOM 1270 C ASP A 824 3.208 10.590 -3.732 1.00 25.00 C ATOM 1271 O ASP A 824 4.216 10.904 -3.110 1.00 25.00 O ATOM 1272 CB ASP A 824 2.313 11.900 -5.679 1.00 25.00 C ATOM 1273 CG ASP A 824 3.033 13.201 -5.383 1.00 25.00 C ATOM 1274 OD1 ASP A 824 4.134 13.413 -5.931 1.00 25.00 O ATOM 1275 OD2 ASP A 824 2.487 14.019 -4.613 1.00 25.00 O ATOM 0 H ASP A 824 1.508 9.598 -6.076 1.00 25.00 H new ATOM 0 HA ASP A 824 4.132 10.750 -5.671 1.00 25.00 H new ATOM 0 HB2 ASP A 824 2.096 11.844 -6.746 1.00 25.00 H new ATOM 0 HB3 ASP A 824 1.356 11.892 -5.158 1.00 25.00 H new ATOM 1280 N THR A 825 2.121 10.118 -3.142 1.00 25.00 N ATOM 1281 CA THR A 825 1.999 9.901 -1.697 1.00 25.00 C ATOM 1282 C THR A 825 2.934 8.784 -1.233 1.00 25.00 C ATOM 1283 O THR A 825 3.186 8.634 -0.036 1.00 25.00 O ATOM 1284 CB THR A 825 0.563 9.520 -1.352 1.00 25.00 C ATOM 1285 OG1 THR A 825 0.196 8.404 -2.156 1.00 25.00 O ATOM 1286 CG2 THR A 825 -0.385 10.658 -1.650 1.00 25.00 C ATOM 0 H THR A 825 1.278 9.868 -3.659 1.00 25.00 H new ATOM 0 HA THR A 825 2.273 10.826 -1.190 1.00 25.00 H new ATOM 0 HB THR A 825 0.503 9.284 -0.289 1.00 25.00 H new ATOM 0 HG1 THR A 825 -0.568 8.645 -2.721 1.00 25.00 H new ATOM 0 HG21 THR A 825 -1.402 10.360 -1.395 1.00 25.00 H new ATOM 0 HG22 THR A 825 -0.103 11.530 -1.060 1.00 25.00 H new ATOM 0 HG23 THR A 825 -0.334 10.906 -2.710 1.00 25.00 H new ATOM 1294 N ALA A 826 3.425 7.987 -2.178 1.00 25.00 N ATOM 1295 CA ALA A 826 4.290 6.849 -1.878 1.00 25.00 C ATOM 1296 C ALA A 826 5.561 7.241 -1.108 1.00 25.00 C ATOM 1297 O ALA A 826 6.136 6.423 -0.393 1.00 25.00 O ATOM 1298 CB ALA A 826 4.661 6.111 -3.169 1.00 25.00 C ATOM 0 H ALA A 826 3.235 8.111 -3.172 1.00 25.00 H new ATOM 0 HA ALA A 826 3.720 6.188 -1.225 1.00 25.00 H new ATOM 0 HB1 ALA A 826 5.306 5.265 -2.932 1.00 25.00 H new ATOM 0 HB2 ALA A 826 3.755 5.751 -3.656 1.00 25.00 H new ATOM 0 HB3 ALA A 826 5.187 6.791 -3.839 1.00 25.00 H new ATOM 1304 N ASP A 827 5.984 8.489 -1.239 1.00 25.00 N ATOM 1305 CA ASP A 827 7.160 8.991 -0.513 1.00 25.00 C ATOM 1306 C ASP A 827 6.943 8.873 0.999 1.00 25.00 C ATOM 1307 O ASP A 827 7.865 8.615 1.769 1.00 25.00 O ATOM 1308 CB ASP A 827 7.397 10.461 -0.874 1.00 25.00 C ATOM 1309 CG ASP A 827 8.650 11.028 -0.221 1.00 25.00 C ATOM 1310 OD1 ASP A 827 9.764 10.736 -0.707 1.00 25.00 O ATOM 1311 OD2 ASP A 827 8.517 11.778 0.774 1.00 25.00 O ATOM 0 H ASP A 827 5.535 9.180 -1.840 1.00 25.00 H new ATOM 0 HA ASP A 827 8.027 8.395 -0.797 1.00 25.00 H new ATOM 0 HB2 ASP A 827 7.481 10.557 -1.957 1.00 25.00 H new ATOM 0 HB3 ASP A 827 6.533 11.051 -0.567 1.00 25.00 H new ATOM 1316 N GLN A 828 5.702 9.047 1.424 1.00 25.00 N ATOM 1317 CA GLN A 828 5.375 8.992 2.842 1.00 25.00 C ATOM 1318 C GLN A 828 5.427 7.573 3.378 1.00 25.00 C ATOM 1319 O GLN A 828 5.839 7.344 4.511 1.00 25.00 O ATOM 1320 CB GLN A 828 3.958 9.507 3.090 1.00 25.00 C ATOM 1321 CG GLN A 828 3.638 10.846 2.419 1.00 25.00 C ATOM 1322 CD GLN A 828 2.187 11.269 2.593 1.00 25.00 C ATOM 1323 OE1 GLN A 828 1.902 12.411 2.920 1.00 25.00 O ATOM 1324 NE2 GLN A 828 1.265 10.360 2.366 1.00 25.00 N ATOM 0 H GLN A 828 4.907 9.227 0.811 1.00 25.00 H new ATOM 0 HA GLN A 828 6.115 9.612 3.349 1.00 25.00 H new ATOM 0 HB2 GLN A 828 3.247 8.760 2.737 1.00 25.00 H new ATOM 0 HB3 GLN A 828 3.806 9.609 4.164 1.00 25.00 H new ATOM 0 HG2 GLN A 828 4.287 11.617 2.833 1.00 25.00 H new ATOM 0 HG3 GLN A 828 3.865 10.776 1.355 1.00 25.00 H new ATOM 0 HE21 GLN A 828 1.536 9.415 2.094 1.00 25.00 H new ATOM 0 HE22 GLN A 828 0.278 10.600 2.461 1.00 25.00 H new ATOM 1333 N VAL A 829 4.981 6.617 2.576 1.00 25.00 N ATOM 1334 CA VAL A 829 4.904 5.240 3.049 1.00 25.00 C ATOM 1335 C VAL A 829 6.266 4.540 2.961 1.00 25.00 C ATOM 1336 O VAL A 829 6.611 3.746 3.837 1.00 25.00 O ATOM 1337 CB VAL A 829 3.773 4.419 2.329 1.00 25.00 C ATOM 1338 CG1 VAL A 829 4.007 4.302 0.842 1.00 25.00 C ATOM 1339 CG2 VAL A 829 3.643 3.033 2.940 1.00 25.00 C ATOM 0 H VAL A 829 4.673 6.762 1.615 1.00 25.00 H new ATOM 0 HA VAL A 829 4.626 5.283 4.102 1.00 25.00 H new ATOM 0 HB VAL A 829 2.844 4.969 2.476 1.00 25.00 H new ATOM 0 HG11 VAL A 829 3.199 3.726 0.391 1.00 25.00 H new ATOM 0 HG12 VAL A 829 4.035 5.297 0.399 1.00 25.00 H new ATOM 0 HG13 VAL A 829 4.956 3.798 0.662 1.00 25.00 H new ATOM 0 HG21 VAL A 829 2.855 2.482 2.427 1.00 25.00 H new ATOM 0 HG22 VAL A 829 4.587 2.499 2.834 1.00 25.00 H new ATOM 0 HG23 VAL A 829 3.394 3.123 3.997 1.00 25.00 H new ATOM 1349 N MET A 830 7.060 4.840 1.937 1.00 25.00 N ATOM 1350 CA MET A 830 8.372 4.197 1.776 1.00 25.00 C ATOM 1351 C MET A 830 9.320 4.606 2.903 1.00 25.00 C ATOM 1352 O MET A 830 10.318 3.931 3.173 1.00 25.00 O ATOM 1353 CB MET A 830 8.979 4.524 0.404 1.00 25.00 C ATOM 1354 CG MET A 830 9.359 5.977 0.217 1.00 25.00 C ATOM 1355 SD MET A 830 11.015 6.397 0.849 1.00 25.00 S ATOM 1356 CE MET A 830 12.096 5.684 -0.420 1.00 25.00 C ATOM 0 H MET A 830 6.826 5.516 1.210 1.00 25.00 H new ATOM 0 HA MET A 830 8.227 3.118 1.831 1.00 25.00 H new ATOM 0 HB2 MET A 830 9.866 3.908 0.257 1.00 25.00 H new ATOM 0 HB3 MET A 830 8.265 4.245 -0.371 1.00 25.00 H new ATOM 0 HG2 MET A 830 9.314 6.220 -0.845 1.00 25.00 H new ATOM 0 HG3 MET A 830 8.621 6.602 0.719 1.00 25.00 H new ATOM 0 HE1 MET A 830 13.134 5.930 -0.194 1.00 25.00 H new ATOM 0 HE2 MET A 830 11.975 4.601 -0.434 1.00 25.00 H new ATOM 0 HE3 MET A 830 11.830 6.092 -1.395 1.00 25.00 H new ATOM 1366 N ALA A 831 8.987 5.695 3.586 1.00 25.00 N ATOM 1367 CA ALA A 831 9.753 6.158 4.734 1.00 25.00 C ATOM 1368 C ALA A 831 9.825 5.043 5.793 1.00 25.00 C ATOM 1369 O ALA A 831 10.792 4.946 6.558 1.00 25.00 O ATOM 1370 CB ALA A 831 9.087 7.426 5.313 1.00 25.00 C ATOM 0 H ALA A 831 8.182 6.279 3.360 1.00 25.00 H new ATOM 0 HA ALA A 831 10.770 6.405 4.428 1.00 25.00 H new ATOM 0 HB1 ALA A 831 9.658 7.776 6.173 1.00 25.00 H new ATOM 0 HB2 ALA A 831 9.064 8.205 4.551 1.00 25.00 H new ATOM 0 HB3 ALA A 831 8.069 7.193 5.624 1.00 25.00 H new ATOM 1376 N SER A 832 8.804 4.194 5.823 1.00 25.00 N ATOM 1377 CA SER A 832 8.726 3.094 6.779 1.00 25.00 C ATOM 1378 C SER A 832 9.834 2.062 6.608 1.00 25.00 C ATOM 1379 O SER A 832 10.176 1.367 7.561 1.00 25.00 O ATOM 1380 CB SER A 832 7.380 2.393 6.656 1.00 25.00 C ATOM 1381 OG SER A 832 6.330 3.344 6.635 1.00 25.00 O ATOM 0 H SER A 832 8.008 4.248 5.187 1.00 25.00 H new ATOM 0 HA SER A 832 8.846 3.541 7.766 1.00 25.00 H new ATOM 0 HB2 SER A 832 7.356 1.795 5.745 1.00 25.00 H new ATOM 0 HB3 SER A 832 7.242 1.707 7.492 1.00 25.00 H new ATOM 0 HG SER A 832 6.184 3.649 5.715 1.00 25.00 H new ATOM 1387 N PHE A 833 10.416 1.954 5.420 1.00 25.00 N ATOM 1388 CA PHE A 833 11.477 0.971 5.196 1.00 25.00 C ATOM 1389 C PHE A 833 12.699 1.270 6.070 1.00 25.00 C ATOM 1390 O PHE A 833 13.455 0.368 6.429 1.00 25.00 O ATOM 1391 CB PHE A 833 11.899 0.932 3.731 1.00 25.00 C ATOM 1392 CG PHE A 833 10.786 0.571 2.776 1.00 25.00 C ATOM 1393 CD1 PHE A 833 9.865 -0.459 3.078 1.00 25.00 C ATOM 1394 CD2 PHE A 833 10.659 1.254 1.552 1.00 25.00 C ATOM 1395 CE1 PHE A 833 8.827 -0.788 2.174 1.00 25.00 C ATOM 1396 CE2 PHE A 833 9.628 0.921 0.637 1.00 25.00 C ATOM 1397 CZ PHE A 833 8.709 -0.097 0.954 1.00 25.00 C ATOM 0 H PHE A 833 10.179 2.523 4.607 1.00 25.00 H new ATOM 0 HA PHE A 833 11.072 -0.003 5.470 1.00 25.00 H new ATOM 0 HB2 PHE A 833 12.299 1.907 3.454 1.00 25.00 H new ATOM 0 HB3 PHE A 833 12.709 0.211 3.617 1.00 25.00 H new ATOM 0 HD1 PHE A 833 9.955 -1.000 4.008 1.00 25.00 H new ATOM 0 HD2 PHE A 833 11.356 2.042 1.306 1.00 25.00 H new ATOM 0 HE1 PHE A 833 8.125 -1.570 2.421 1.00 25.00 H new ATOM 0 HE2 PHE A 833 9.548 1.448 -0.302 1.00 25.00 H new ATOM 0 HZ PHE A 833 7.917 -0.347 0.264 1.00 25.00 H new ATOM 1407 N LYS A 834 12.890 2.534 6.439 1.00 25.00 N ATOM 1408 CA LYS A 834 14.006 2.901 7.319 1.00 25.00 C ATOM 1409 C LYS A 834 13.742 2.350 8.717 1.00 25.00 C ATOM 1410 O LYS A 834 14.665 1.993 9.432 1.00 25.00 O ATOM 1411 CB LYS A 834 14.170 4.434 7.366 1.00 25.00 C ATOM 1412 CG LYS A 834 15.318 4.971 8.272 1.00 25.00 C ATOM 1413 CD LYS A 834 16.709 4.621 7.798 1.00 25.00 C ATOM 1414 CE LYS A 834 17.236 3.591 8.755 1.00 25.00 C ATOM 1415 NZ LYS A 834 18.731 3.463 8.814 1.00 25.00 N ATOM 0 H LYS A 834 12.299 3.314 6.150 1.00 25.00 H new ATOM 0 HA LYS A 834 14.930 2.473 6.931 1.00 25.00 H new ATOM 0 HB2 LYS A 834 14.338 4.793 6.350 1.00 25.00 H new ATOM 0 HB3 LYS A 834 13.231 4.870 7.707 1.00 25.00 H new ATOM 0 HG2 LYS A 834 15.233 6.056 8.339 1.00 25.00 H new ATOM 0 HG3 LYS A 834 15.182 4.578 9.280 1.00 25.00 H new ATOM 0 HD2 LYS A 834 16.686 4.230 6.781 1.00 25.00 H new ATOM 0 HD3 LYS A 834 17.349 5.503 7.786 1.00 25.00 H new ATOM 0 HE2 LYS A 834 16.870 3.829 9.754 1.00 25.00 H new ATOM 0 HE3 LYS A 834 16.817 2.622 8.484 1.00 25.00 H new ATOM 0 HZ1 LYS A 834 19.000 2.926 9.663 1.00 25.00 H new ATOM 0 HZ2 LYS A 834 19.070 2.964 7.967 1.00 25.00 H new ATOM 0 HZ3 LYS A 834 19.159 4.410 8.853 1.00 25.00 H new ATOM 1429 N ILE A 835 12.481 2.269 9.103 1.00 25.00 N ATOM 1430 CA ILE A 835 12.115 1.780 10.434 1.00 25.00 C ATOM 1431 C ILE A 835 12.247 0.263 10.405 1.00 25.00 C ATOM 1432 O ILE A 835 12.724 -0.355 11.356 1.00 25.00 O ATOM 1433 CB ILE A 835 10.658 2.203 10.841 1.00 25.00 C ATOM 1434 CG1 ILE A 835 10.597 3.721 11.103 1.00 25.00 C ATOM 1435 CG2 ILE A 835 10.206 1.474 12.126 1.00 25.00 C ATOM 1436 CD1 ILE A 835 10.268 4.563 9.886 1.00 25.00 C ATOM 0 H ILE A 835 11.688 2.534 8.518 1.00 25.00 H new ATOM 0 HA ILE A 835 12.776 2.219 11.182 1.00 25.00 H new ATOM 0 HB ILE A 835 9.997 1.933 10.017 1.00 25.00 H new ATOM 0 HG12 ILE A 835 9.850 3.913 11.873 1.00 25.00 H new ATOM 0 HG13 ILE A 835 11.558 4.045 11.503 1.00 25.00 H new ATOM 0 HG21 ILE A 835 9.194 1.786 12.384 1.00 25.00 H new ATOM 0 HG22 ILE A 835 10.222 0.397 11.958 1.00 25.00 H new ATOM 0 HG23 ILE A 835 10.883 1.724 12.943 1.00 25.00 H new ATOM 0 HD11 ILE A 835 10.247 5.616 10.167 1.00 25.00 H new ATOM 0 HD12 ILE A 835 11.027 4.407 9.120 1.00 25.00 H new ATOM 0 HD13 ILE A 835 9.293 4.272 9.495 1.00 25.00 H new ATOM 1448 N LEU A 836 11.837 -0.323 9.290 1.00 25.00 N ATOM 1449 CA LEU A 836 11.919 -1.764 9.078 1.00 25.00 C ATOM 1450 C LEU A 836 13.377 -2.241 9.196 1.00 25.00 C ATOM 1451 O LEU A 836 13.670 -3.227 9.883 1.00 25.00 O ATOM 1452 CB LEU A 836 11.360 -2.086 7.684 1.00 25.00 C ATOM 1453 CG LEU A 836 10.585 -3.393 7.461 1.00 25.00 C ATOM 1454 CD1 LEU A 836 10.576 -3.696 5.981 1.00 25.00 C ATOM 1455 CD2 LEU A 836 11.146 -4.574 8.209 1.00 25.00 C ATOM 0 H LEU A 836 11.436 0.187 8.503 1.00 25.00 H new ATOM 0 HA LEU A 836 11.334 -2.283 9.838 1.00 25.00 H new ATOM 0 HB2 LEU A 836 10.703 -1.264 7.398 1.00 25.00 H new ATOM 0 HB3 LEU A 836 12.198 -2.081 6.987 1.00 25.00 H new ATOM 0 HG LEU A 836 9.579 -3.239 7.851 1.00 25.00 H new ATOM 0 HD11 LEU A 836 10.029 -4.622 5.803 1.00 25.00 H new ATOM 0 HD12 LEU A 836 10.091 -2.880 5.445 1.00 25.00 H new ATOM 0 HD13 LEU A 836 11.601 -3.805 5.626 1.00 25.00 H new ATOM 0 HD21 LEU A 836 10.543 -5.457 7.999 1.00 25.00 H new ATOM 0 HD22 LEU A 836 12.173 -4.752 7.891 1.00 25.00 H new ATOM 0 HD23 LEU A 836 11.128 -4.369 9.279 1.00 25.00 H new ATOM 1467 N ALA A 837 14.282 -1.527 8.533 1.00 25.00 N ATOM 1468 CA ALA A 837 15.715 -1.830 8.577 1.00 25.00 C ATOM 1469 C ALA A 837 16.278 -1.496 9.967 1.00 25.00 C ATOM 1470 O ALA A 837 17.097 -2.223 10.533 1.00 25.00 O ATOM 1471 CB ALA A 837 16.456 -0.985 7.494 1.00 25.00 C ATOM 0 H ALA A 837 14.047 -0.723 7.951 1.00 25.00 H new ATOM 0 HA ALA A 837 15.865 -2.891 8.378 1.00 25.00 H new ATOM 0 HB1 ALA A 837 17.522 -1.209 7.525 1.00 25.00 H new ATOM 0 HB2 ALA A 837 16.062 -1.231 6.508 1.00 25.00 H new ATOM 0 HB3 ALA A 837 16.302 0.076 7.692 1.00 25.00 H new ATOM 1477 N GLY A 838 15.847 -0.367 10.501 1.00 25.00 N ATOM 1478 CA GLY A 838 16.350 0.107 11.774 1.00 25.00 C ATOM 1479 C GLY A 838 17.668 0.833 11.590 1.00 25.00 C ATOM 1480 O GLY A 838 17.697 2.051 11.443 1.00 25.00 O ATOM 0 H GLY A 838 15.148 0.238 10.070 1.00 25.00 H new ATOM 0 HA2 GLY A 838 15.621 0.775 12.233 1.00 25.00 H new ATOM 0 HA3 GLY A 838 16.484 -0.734 12.454 1.00 25.00 H new ATOM 1484 N ASP A 839 18.766 0.091 11.603 1.00 25.00 N ATOM 1485 CA ASP A 839 20.105 0.688 11.502 1.00 25.00 C ATOM 1486 C ASP A 839 20.846 0.293 10.225 1.00 25.00 C ATOM 1487 O ASP A 839 21.741 0.991 9.764 1.00 25.00 O ATOM 1488 CB ASP A 839 20.940 0.260 12.710 1.00 25.00 C ATOM 1489 CG ASP A 839 22.181 1.119 12.895 1.00 25.00 C ATOM 1490 OD1 ASP A 839 22.082 2.356 12.748 1.00 25.00 O ATOM 1491 OD2 ASP A 839 23.252 0.553 13.200 1.00 25.00 O ATOM 0 H ASP A 839 18.764 -0.926 11.682 1.00 25.00 H new ATOM 0 HA ASP A 839 19.968 1.769 11.476 1.00 25.00 H new ATOM 0 HB2 ASP A 839 20.327 0.315 13.609 1.00 25.00 H new ATOM 0 HB3 ASP A 839 21.238 -0.782 12.591 1.00 25.00 H new ATOM 1496 N LYS A 840 20.476 -0.845 9.654 1.00 25.00 N ATOM 1497 CA LYS A 840 21.205 -1.399 8.519 1.00 25.00 C ATOM 1498 C LYS A 840 20.999 -0.548 7.272 1.00 25.00 C ATOM 1499 O LYS A 840 19.969 0.101 7.105 1.00 25.00 O ATOM 1500 CB LYS A 840 20.788 -2.853 8.297 1.00 25.00 C ATOM 1501 CG LYS A 840 19.294 -3.057 8.243 1.00 25.00 C ATOM 1502 CD LYS A 840 18.895 -4.485 8.477 1.00 25.00 C ATOM 1503 CE LYS A 840 19.276 -5.418 7.343 1.00 25.00 C ATOM 1504 NZ LYS A 840 18.794 -6.785 7.665 1.00 25.00 N ATOM 0 H LYS A 840 19.677 -1.402 9.957 1.00 25.00 H new ATOM 0 HA LYS A 840 22.273 -1.384 8.737 1.00 25.00 H new ATOM 0 HB2 LYS A 840 21.228 -3.209 7.365 1.00 25.00 H new ATOM 0 HB3 LYS A 840 21.200 -3.466 9.099 1.00 25.00 H new ATOM 0 HG2 LYS A 840 18.818 -2.424 8.992 1.00 25.00 H new ATOM 0 HG3 LYS A 840 18.922 -2.735 7.270 1.00 25.00 H new ATOM 0 HD2 LYS A 840 19.361 -4.837 9.397 1.00 25.00 H new ATOM 0 HD3 LYS A 840 17.816 -4.532 8.627 1.00 25.00 H new ATOM 0 HE2 LYS A 840 18.836 -5.074 6.407 1.00 25.00 H new ATOM 0 HE3 LYS A 840 20.357 -5.422 7.205 1.00 25.00 H new ATOM 0 HZ1 LYS A 840 19.565 -7.468 7.522 1.00 25.00 H new ATOM 0 HZ2 LYS A 840 18.482 -6.818 8.656 1.00 25.00 H new ATOM 0 HZ3 LYS A 840 17.997 -7.028 7.043 1.00 25.00 H new ATOM 1518 N ASN A 841 21.999 -0.551 6.404 1.00 25.00 N ATOM 1519 CA ASN A 841 21.987 0.258 5.183 1.00 25.00 C ATOM 1520 C ASN A 841 21.249 -0.399 4.022 1.00 25.00 C ATOM 1521 O ASN A 841 21.211 0.152 2.938 1.00 25.00 O ATOM 1522 CB ASN A 841 23.426 0.513 4.725 1.00 25.00 C ATOM 1523 CG ASN A 841 24.089 -0.704 4.256 1.00 25.00 C ATOM 1524 OD1 ASN A 841 24.323 -1.664 4.978 1.00 25.00 O ATOM 1525 ND2 ASN A 841 24.390 -0.675 3.019 1.00 25.00 N ATOM 0 H ASN A 841 22.843 -1.112 6.521 1.00 25.00 H new ATOM 0 HA ASN A 841 21.464 1.179 5.439 1.00 25.00 H new ATOM 0 HB2 ASN A 841 23.423 1.253 3.925 1.00 25.00 H new ATOM 0 HB3 ASN A 841 23.997 0.939 5.551 1.00 25.00 H new ATOM 0 HD21 ASN A 841 24.848 -1.477 2.587 1.00 25.00 H new ATOM 0 HD22 ASN A 841 24.173 0.150 2.461 1.00 25.00 H new ATOM 1532 N TYR A 842 20.679 -1.570 4.240 1.00 25.00 N ATOM 1533 CA TYR A 842 19.969 -2.279 3.180 1.00 25.00 C ATOM 1534 C TYR A 842 18.885 -3.064 3.885 1.00 25.00 C ATOM 1535 O TYR A 842 18.992 -3.278 5.073 1.00 25.00 O ATOM 1536 CB TYR A 842 20.915 -3.221 2.416 1.00 25.00 C ATOM 1537 CG TYR A 842 21.307 -4.456 3.200 1.00 25.00 C ATOM 1538 CD1 TYR A 842 20.535 -5.633 3.120 1.00 25.00 C ATOM 1539 CD2 TYR A 842 22.448 -4.462 4.023 1.00 25.00 C ATOM 1540 CE1 TYR A 842 20.888 -6.791 3.847 1.00 25.00 C ATOM 1541 CE2 TYR A 842 22.802 -5.622 4.769 1.00 25.00 C ATOM 1542 CZ TYR A 842 22.016 -6.774 4.672 1.00 25.00 C ATOM 1543 OH TYR A 842 22.349 -7.897 5.386 1.00 25.00 O ATOM 0 H TYR A 842 20.691 -2.053 5.138 1.00 25.00 H new ATOM 0 HA TYR A 842 19.559 -1.592 2.440 1.00 25.00 H new ATOM 0 HB2 TYR A 842 20.435 -3.528 1.487 1.00 25.00 H new ATOM 0 HB3 TYR A 842 21.817 -2.673 2.143 1.00 25.00 H new ATOM 0 HD1 TYR A 842 19.657 -5.649 2.491 1.00 25.00 H new ATOM 0 HD2 TYR A 842 23.063 -3.576 4.090 1.00 25.00 H new ATOM 0 HE1 TYR A 842 20.289 -7.686 3.766 1.00 25.00 H new ATOM 0 HE2 TYR A 842 23.674 -5.612 5.407 1.00 25.00 H new ATOM 0 HH TYR A 842 23.159 -7.723 5.910 1.00 25.00 H new ATOM 1553 N ILE A 843 17.863 -3.496 3.172 1.00 25.00 N ATOM 1554 CA ILE A 843 16.790 -4.304 3.735 1.00 25.00 C ATOM 1555 C ILE A 843 16.910 -5.672 3.093 1.00 25.00 C ATOM 1556 O ILE A 843 17.385 -5.791 1.967 1.00 25.00 O ATOM 1557 CB ILE A 843 15.392 -3.662 3.435 1.00 25.00 C ATOM 1558 CG1 ILE A 843 14.348 -4.118 4.453 1.00 25.00 C ATOM 1559 CG2 ILE A 843 14.911 -3.929 2.016 1.00 25.00 C ATOM 1560 CD1 ILE A 843 14.433 -3.288 5.678 1.00 25.00 C ATOM 0 H ILE A 843 17.750 -3.297 2.178 1.00 25.00 H new ATOM 0 HA ILE A 843 16.872 -4.371 4.820 1.00 25.00 H new ATOM 0 HB ILE A 843 15.523 -2.584 3.526 1.00 25.00 H new ATOM 0 HG12 ILE A 843 13.350 -4.041 4.021 1.00 25.00 H new ATOM 0 HG13 ILE A 843 14.507 -5.167 4.703 1.00 25.00 H new ATOM 0 HG21 ILE A 843 13.938 -3.460 1.867 1.00 25.00 H new ATOM 0 HG22 ILE A 843 15.626 -3.515 1.305 1.00 25.00 H new ATOM 0 HG23 ILE A 843 14.824 -5.004 1.858 1.00 25.00 H new ATOM 0 HD11 ILE A 843 13.684 -3.622 6.396 1.00 25.00 H new ATOM 0 HD12 ILE A 843 15.426 -3.387 6.116 1.00 25.00 H new ATOM 0 HD13 ILE A 843 14.251 -2.244 5.423 1.00 25.00 H new ATOM 1572 N THR A 844 16.502 -6.717 3.780 1.00 25.00 N ATOM 1573 CA THR A 844 16.511 -8.027 3.150 1.00 25.00 C ATOM 1574 C THR A 844 15.146 -8.211 2.513 1.00 25.00 C ATOM 1575 O THR A 844 14.162 -7.625 2.956 1.00 25.00 O ATOM 1576 CB THR A 844 16.777 -9.186 4.140 1.00 25.00 C ATOM 1577 OG1 THR A 844 15.777 -9.195 5.153 1.00 25.00 O ATOM 1578 CG2 THR A 844 18.127 -9.054 4.804 1.00 25.00 C ATOM 0 H THR A 844 16.169 -6.694 4.744 1.00 25.00 H new ATOM 0 HA THR A 844 17.325 -8.061 2.425 1.00 25.00 H new ATOM 0 HB THR A 844 16.755 -10.114 3.568 1.00 25.00 H new ATOM 0 HG1 THR A 844 15.949 -9.932 5.776 1.00 25.00 H new ATOM 0 HG21 THR A 844 18.277 -9.886 5.492 1.00 25.00 H new ATOM 0 HG22 THR A 844 18.909 -9.065 4.044 1.00 25.00 H new ATOM 0 HG23 THR A 844 18.171 -8.115 5.356 1.00 25.00 H new ATOM 1586 N MET A 845 15.076 -9.042 1.487 1.00 25.00 N ATOM 1587 CA MET A 845 13.793 -9.400 0.886 1.00 25.00 C ATOM 1588 C MET A 845 12.897 -10.006 1.958 1.00 25.00 C ATOM 1589 O MET A 845 11.694 -9.823 1.956 1.00 25.00 O ATOM 1590 CB MET A 845 14.005 -10.423 -0.226 1.00 25.00 C ATOM 1591 CG MET A 845 14.839 -9.887 -1.350 1.00 25.00 C ATOM 1592 SD MET A 845 14.982 -11.019 -2.719 1.00 25.00 S ATOM 1593 CE MET A 845 16.048 -10.047 -3.754 1.00 25.00 C ATOM 0 H MET A 845 15.886 -9.482 1.051 1.00 25.00 H new ATOM 0 HA MET A 845 13.328 -8.507 0.467 1.00 25.00 H new ATOM 0 HB2 MET A 845 14.486 -11.310 0.188 1.00 25.00 H new ATOM 0 HB3 MET A 845 13.037 -10.738 -0.615 1.00 25.00 H new ATOM 0 HG2 MET A 845 14.403 -8.952 -1.704 1.00 25.00 H new ATOM 0 HG3 MET A 845 15.835 -9.653 -0.975 1.00 25.00 H new ATOM 0 HE1 MET A 845 16.694 -10.707 -4.333 1.00 25.00 H new ATOM 0 HE2 MET A 845 15.445 -9.443 -4.432 1.00 25.00 H new ATOM 0 HE3 MET A 845 16.660 -9.393 -3.133 1.00 25.00 H new ATOM 1603 N ASP A 846 13.521 -10.721 2.879 1.00 25.00 N ATOM 1604 CA ASP A 846 12.834 -11.359 3.994 1.00 25.00 C ATOM 1605 C ASP A 846 12.202 -10.335 4.937 1.00 25.00 C ATOM 1606 O ASP A 846 11.157 -10.583 5.507 1.00 25.00 O ATOM 1607 CB ASP A 846 13.838 -12.210 4.768 1.00 25.00 C ATOM 1608 CG ASP A 846 13.169 -13.165 5.731 1.00 25.00 C ATOM 1609 OD1 ASP A 846 12.310 -13.954 5.283 1.00 25.00 O ATOM 1610 OD2 ASP A 846 13.517 -13.138 6.929 1.00 25.00 O ATOM 0 H ASP A 846 14.529 -10.878 2.875 1.00 25.00 H new ATOM 0 HA ASP A 846 12.031 -11.977 3.592 1.00 25.00 H new ATOM 0 HB2 ASP A 846 14.447 -12.777 4.064 1.00 25.00 H new ATOM 0 HB3 ASP A 846 14.513 -11.557 5.320 1.00 25.00 H new ATOM 1615 N GLU A 847 12.829 -9.175 5.091 1.00 25.00 N ATOM 1616 CA GLU A 847 12.294 -8.133 5.967 1.00 25.00 C ATOM 1617 C GLU A 847 11.051 -7.506 5.353 1.00 25.00 C ATOM 1618 O GLU A 847 10.094 -7.199 6.060 1.00 25.00 O ATOM 1619 CB GLU A 847 13.363 -7.078 6.281 1.00 25.00 C ATOM 1620 CG GLU A 847 14.251 -7.543 7.435 1.00 25.00 C ATOM 1621 CD GLU A 847 15.578 -6.810 7.553 1.00 25.00 C ATOM 1622 OE1 GLU A 847 16.125 -6.326 6.541 1.00 25.00 O ATOM 1623 OE2 GLU A 847 16.108 -6.746 8.684 1.00 25.00 O ATOM 0 H GLU A 847 13.703 -8.930 4.625 1.00 25.00 H new ATOM 0 HA GLU A 847 12.003 -8.592 6.912 1.00 25.00 H new ATOM 0 HB2 GLU A 847 13.973 -6.895 5.396 1.00 25.00 H new ATOM 0 HB3 GLU A 847 12.885 -6.133 6.540 1.00 25.00 H new ATOM 0 HG2 GLU A 847 13.702 -7.424 8.369 1.00 25.00 H new ATOM 0 HG3 GLU A 847 14.449 -8.608 7.316 1.00 25.00 H new ATOM 1630 N LEU A 848 11.042 -7.347 4.039 1.00 25.00 N ATOM 1631 CA LEU A 848 9.850 -6.839 3.359 1.00 25.00 C ATOM 1632 C LEU A 848 8.765 -7.901 3.473 1.00 25.00 C ATOM 1633 O LEU A 848 7.607 -7.606 3.694 1.00 25.00 O ATOM 1634 CB LEU A 848 10.150 -6.539 1.891 1.00 25.00 C ATOM 1635 CG LEU A 848 11.125 -5.370 1.676 1.00 25.00 C ATOM 1636 CD1 LEU A 848 11.623 -5.396 0.250 1.00 25.00 C ATOM 1637 CD2 LEU A 848 10.468 -4.023 1.973 1.00 25.00 C ATOM 0 H LEU A 848 11.830 -7.557 3.426 1.00 25.00 H new ATOM 0 HA LEU A 848 9.523 -5.908 3.821 1.00 25.00 H new ATOM 0 HB2 LEU A 848 10.564 -7.434 1.426 1.00 25.00 H new ATOM 0 HB3 LEU A 848 9.214 -6.317 1.378 1.00 25.00 H new ATOM 0 HG LEU A 848 11.959 -5.488 2.368 1.00 25.00 H new ATOM 0 HD11 LEU A 848 12.315 -4.569 0.091 1.00 25.00 H new ATOM 0 HD12 LEU A 848 12.135 -6.339 0.061 1.00 25.00 H new ATOM 0 HD13 LEU A 848 10.778 -5.298 -0.432 1.00 25.00 H new ATOM 0 HD21 LEU A 848 11.189 -3.222 1.809 1.00 25.00 H new ATOM 0 HD22 LEU A 848 9.613 -3.882 1.312 1.00 25.00 H new ATOM 0 HD23 LEU A 848 10.132 -4.003 3.010 1.00 25.00 H new ATOM 1649 N ARG A 849 9.162 -9.160 3.354 1.00 25.00 N ATOM 1650 CA ARG A 849 8.243 -10.297 3.484 1.00 25.00 C ATOM 1651 C ARG A 849 7.844 -10.575 4.938 1.00 25.00 C ATOM 1652 O ARG A 849 7.181 -11.569 5.224 1.00 25.00 O ATOM 1653 CB ARG A 849 8.914 -11.538 2.896 1.00 25.00 C ATOM 1654 CG ARG A 849 9.005 -11.498 1.382 1.00 25.00 C ATOM 1655 CD ARG A 849 9.813 -12.662 0.853 1.00 25.00 C ATOM 1656 NE ARG A 849 9.130 -13.939 1.122 1.00 25.00 N ATOM 1657 CZ ARG A 849 8.167 -14.469 0.372 1.00 25.00 C ATOM 1658 NH1 ARG A 849 7.722 -13.892 -0.720 1.00 25.00 N ATOM 1659 NH2 ARG A 849 7.631 -15.599 0.739 1.00 25.00 N ATOM 0 H ARG A 849 10.128 -9.429 3.165 1.00 25.00 H new ATOM 0 HA ARG A 849 7.329 -10.049 2.945 1.00 25.00 H new ATOM 0 HB2 ARG A 849 9.916 -11.635 3.313 1.00 25.00 H new ATOM 0 HB3 ARG A 849 8.356 -12.424 3.198 1.00 25.00 H new ATOM 0 HG2 ARG A 849 8.003 -11.523 0.954 1.00 25.00 H new ATOM 0 HG3 ARG A 849 9.463 -10.560 1.067 1.00 25.00 H new ATOM 0 HD2 ARG A 849 9.967 -12.546 -0.220 1.00 25.00 H new ATOM 0 HD3 ARG A 849 10.799 -12.667 1.318 1.00 25.00 H new ATOM 0 HE ARG A 849 9.419 -14.459 1.950 1.00 25.00 H new ATOM 0 HH11 ARG A 849 8.116 -13.002 -1.023 1.00 25.00 H new ATOM 0 HH12 ARG A 849 6.982 -14.334 -1.265 1.00 25.00 H new ATOM 0 HH21 ARG A 849 7.951 -16.063 1.589 1.00 25.00 H new ATOM 0 HH22 ARG A 849 6.892 -16.019 0.176 1.00 25.00 H new ATOM 1673 N ARG A 850 8.241 -9.694 5.846 1.00 25.00 N ATOM 1674 CA ARG A 850 7.952 -9.851 7.279 1.00 25.00 C ATOM 1675 C ARG A 850 6.844 -8.892 7.639 1.00 25.00 C ATOM 1676 O ARG A 850 6.018 -9.171 8.498 1.00 25.00 O ATOM 1677 CB ARG A 850 9.232 -9.595 8.096 1.00 25.00 C ATOM 1678 CG ARG A 850 9.154 -8.522 9.199 1.00 25.00 C ATOM 1679 CD ARG A 850 10.546 -8.184 9.728 1.00 25.00 C ATOM 1680 NE ARG A 850 10.503 -7.033 10.649 1.00 25.00 N ATOM 1681 CZ ARG A 850 11.554 -6.306 11.024 1.00 25.00 C ATOM 1682 NH1 ARG A 850 12.770 -6.558 10.613 1.00 25.00 N ATOM 1683 NH2 ARG A 850 11.374 -5.292 11.823 1.00 25.00 N ATOM 0 H ARG A 850 8.770 -8.852 5.620 1.00 25.00 H new ATOM 0 HA ARG A 850 7.624 -10.865 7.508 1.00 25.00 H new ATOM 0 HB2 ARG A 850 9.533 -10.535 8.558 1.00 25.00 H new ATOM 0 HB3 ARG A 850 10.025 -9.312 7.404 1.00 25.00 H new ATOM 0 HG2 ARG A 850 8.682 -7.622 8.804 1.00 25.00 H new ATOM 0 HG3 ARG A 850 8.527 -8.879 10.016 1.00 25.00 H new ATOM 0 HD2 ARG A 850 10.962 -9.050 10.243 1.00 25.00 H new ATOM 0 HD3 ARG A 850 11.210 -7.960 8.893 1.00 25.00 H new ATOM 0 HE ARG A 850 9.594 -6.772 11.030 1.00 25.00 H new ATOM 0 HH11 ARG A 850 12.943 -7.338 9.979 1.00 25.00 H new ATOM 0 HH12 ARG A 850 13.545 -5.974 10.926 1.00 25.00 H new ATOM 0 HH21 ARG A 850 10.437 -5.063 12.154 1.00 25.00 H new ATOM 0 HH22 ARG A 850 12.171 -4.727 12.118 1.00 25.00 H new ATOM 1697 N GLU A 851 6.834 -7.759 6.959 1.00 25.00 N ATOM 1698 CA GLU A 851 5.793 -6.758 7.157 1.00 25.00 C ATOM 1699 C GLU A 851 4.663 -6.960 6.144 1.00 25.00 C ATOM 1700 O GLU A 851 3.515 -6.631 6.417 1.00 25.00 O ATOM 1701 CB GLU A 851 6.383 -5.343 7.043 1.00 25.00 C ATOM 1702 CG GLU A 851 7.042 -5.032 5.705 1.00 25.00 C ATOM 1703 CD GLU A 851 7.360 -3.551 5.543 1.00 25.00 C ATOM 1704 OE1 GLU A 851 7.263 -2.794 6.537 1.00 25.00 O ATOM 1705 OE2 GLU A 851 7.723 -3.146 4.418 1.00 25.00 O ATOM 0 H GLU A 851 7.535 -7.506 6.263 1.00 25.00 H new ATOM 0 HA GLU A 851 5.379 -6.875 8.159 1.00 25.00 H new ATOM 0 HB2 GLU A 851 5.588 -4.618 7.218 1.00 25.00 H new ATOM 0 HB3 GLU A 851 7.119 -5.206 7.835 1.00 25.00 H new ATOM 0 HG2 GLU A 851 7.961 -5.610 5.613 1.00 25.00 H new ATOM 0 HG3 GLU A 851 6.384 -5.350 4.897 1.00 25.00 H new ATOM 1712 N LEU A 852 4.998 -7.514 4.985 1.00 25.00 N ATOM 1713 CA LEU A 852 4.034 -7.744 3.911 1.00 25.00 C ATOM 1714 C LEU A 852 3.944 -9.231 3.553 1.00 25.00 C ATOM 1715 O LEU A 852 4.672 -9.707 2.683 1.00 25.00 O ATOM 1716 CB LEU A 852 4.460 -6.984 2.637 1.00 25.00 C ATOM 1717 CG LEU A 852 4.212 -5.477 2.419 1.00 25.00 C ATOM 1718 CD1 LEU A 852 3.817 -4.683 3.599 1.00 25.00 C ATOM 1719 CD2 LEU A 852 5.453 -4.862 1.783 1.00 25.00 C ATOM 0 H LEU A 852 5.946 -7.817 4.761 1.00 25.00 H new ATOM 0 HA LEU A 852 3.067 -7.390 4.269 1.00 25.00 H new ATOM 0 HB2 LEU A 852 5.535 -7.136 2.535 1.00 25.00 H new ATOM 0 HB3 LEU A 852 3.985 -7.497 1.801 1.00 25.00 H new ATOM 0 HG LEU A 852 3.336 -5.433 1.771 1.00 25.00 H new ATOM 0 HD11 LEU A 852 3.675 -3.643 3.307 1.00 25.00 H new ATOM 0 HD12 LEU A 852 2.886 -5.076 4.007 1.00 25.00 H new ATOM 0 HD13 LEU A 852 4.599 -4.743 4.356 1.00 25.00 H new ATOM 0 HD21 LEU A 852 5.290 -3.796 1.624 1.00 25.00 H new ATOM 0 HD22 LEU A 852 6.308 -5.004 2.443 1.00 25.00 H new ATOM 0 HD23 LEU A 852 5.649 -5.346 0.826 1.00 25.00 H new ATOM 1731 N PRO A 853 3.033 -9.986 4.192 1.00 25.00 N ATOM 1732 CA PRO A 853 2.873 -11.344 3.649 1.00 25.00 C ATOM 1733 C PRO A 853 2.359 -11.466 2.171 1.00 25.00 C ATOM 1734 O PRO A 853 2.686 -12.452 1.505 1.00 25.00 O ATOM 1735 CB PRO A 853 1.913 -12.004 4.650 1.00 25.00 C ATOM 1736 CG PRO A 853 1.143 -10.879 5.257 1.00 25.00 C ATOM 1737 CD PRO A 853 2.117 -9.725 5.324 1.00 25.00 C ATOM 0 HA PRO A 853 3.847 -11.824 3.558 1.00 25.00 H new ATOM 0 HB2 PRO A 853 1.250 -12.711 4.151 1.00 25.00 H new ATOM 0 HB3 PRO A 853 2.460 -12.562 5.410 1.00 25.00 H new ATOM 0 HG2 PRO A 853 0.273 -10.625 4.652 1.00 25.00 H new ATOM 0 HG3 PRO A 853 0.776 -11.143 6.249 1.00 25.00 H new ATOM 0 HD2 PRO A 853 1.611 -8.765 5.219 1.00 25.00 H new ATOM 0 HD3 PRO A 853 2.649 -9.703 6.275 1.00 25.00 H new ATOM 1745 N PRO A 854 1.556 -10.501 1.636 1.00 25.00 N ATOM 1746 CA PRO A 854 1.184 -10.663 0.223 1.00 25.00 C ATOM 1747 C PRO A 854 2.256 -10.305 -0.817 1.00 25.00 C ATOM 1748 O PRO A 854 3.400 -9.995 -0.498 1.00 25.00 O ATOM 1749 CB PRO A 854 0.054 -9.639 0.088 1.00 25.00 C ATOM 1750 CG PRO A 854 0.453 -8.610 0.934 1.00 25.00 C ATOM 1751 CD PRO A 854 0.909 -9.276 2.150 1.00 25.00 C ATOM 0 HA PRO A 854 0.964 -11.711 0.020 1.00 25.00 H new ATOM 0 HB2 PRO A 854 -0.056 -9.295 -0.940 1.00 25.00 H new ATOM 0 HB3 PRO A 854 -0.906 -10.058 0.389 1.00 25.00 H new ATOM 0 HG2 PRO A 854 1.251 -8.017 0.486 1.00 25.00 H new ATOM 0 HG3 PRO A 854 -0.372 -7.929 1.143 1.00 25.00 H new ATOM 0 HD2 PRO A 854 1.608 -8.656 2.712 1.00 25.00 H new ATOM 0 HD3 PRO A 854 0.080 -9.508 2.818 1.00 25.00 H new ATOM 1759 N ASP A 855 1.817 -10.316 -2.072 1.00 25.00 N ATOM 1760 CA ASP A 855 2.594 -9.926 -3.259 1.00 25.00 C ATOM 1761 C ASP A 855 3.181 -8.512 -3.117 1.00 25.00 C ATOM 1762 O ASP A 855 4.076 -8.122 -3.851 1.00 25.00 O ATOM 1763 CB ASP A 855 1.715 -9.912 -4.530 1.00 25.00 C ATOM 1764 CG ASP A 855 0.928 -11.219 -4.777 1.00 25.00 C ATOM 1765 OD1 ASP A 855 0.629 -11.995 -3.831 1.00 25.00 O ATOM 1766 OD2 ASP A 855 0.578 -11.437 -5.960 1.00 25.00 O ATOM 0 H ASP A 855 0.869 -10.609 -2.307 1.00 25.00 H new ATOM 0 HA ASP A 855 3.391 -10.665 -3.344 1.00 25.00 H new ATOM 0 HB2 ASP A 855 1.009 -9.085 -4.459 1.00 25.00 H new ATOM 0 HB3 ASP A 855 2.350 -9.716 -5.394 1.00 25.00 H new ATOM 1771 N GLN A 856 2.663 -7.739 -2.173 1.00 25.00 N ATOM 1772 CA GLN A 856 3.166 -6.399 -1.892 1.00 25.00 C ATOM 1773 C GLN A 856 4.666 -6.470 -1.617 1.00 25.00 C ATOM 1774 O GLN A 856 5.416 -5.570 -1.977 1.00 25.00 O ATOM 1775 CB GLN A 856 2.450 -5.831 -0.681 1.00 25.00 C ATOM 1776 CG GLN A 856 0.938 -5.718 -0.817 1.00 25.00 C ATOM 1777 CD GLN A 856 0.490 -4.451 -1.452 1.00 25.00 C ATOM 1778 OE1 GLN A 856 -0.733 -4.104 -1.206 1.00 25.00 O flip ATOM 1779 NE2 GLN A 856 1.233 -3.780 -2.144 1.00 25.00 N flip ATOM 0 H GLN A 856 1.883 -8.022 -1.580 1.00 25.00 H new ATOM 0 HA GLN A 856 2.985 -5.753 -2.751 1.00 25.00 H new ATOM 0 HB2 GLN A 856 2.675 -6.458 0.182 1.00 25.00 H new ATOM 0 HB3 GLN A 856 2.855 -4.841 -0.470 1.00 25.00 H new ATOM 0 HG2 GLN A 856 0.571 -6.559 -1.405 1.00 25.00 H new ATOM 0 HG3 GLN A 856 0.486 -5.799 0.171 1.00 25.00 H new ATOM 0 HE21 GLN A 856 2.190 -4.089 -2.313 1.00 25.00 H new ATOM 0 HE22 GLN A 856 0.899 -2.908 -2.555 1.00 25.00 H new ATOM 1788 N ALA A 857 5.110 -7.553 -0.996 1.00 25.00 N ATOM 1789 CA ALA A 857 6.521 -7.715 -0.705 1.00 25.00 C ATOM 1790 C ALA A 857 7.335 -7.791 -1.993 1.00 25.00 C ATOM 1791 O ALA A 857 8.351 -7.134 -2.111 1.00 25.00 O ATOM 1792 CB ALA A 857 6.743 -8.956 0.135 1.00 25.00 C ATOM 0 H ALA A 857 4.518 -8.324 -0.688 1.00 25.00 H new ATOM 0 HA ALA A 857 6.858 -6.845 -0.141 1.00 25.00 H new ATOM 0 HB1 ALA A 857 7.806 -9.067 0.347 1.00 25.00 H new ATOM 0 HB2 ALA A 857 6.194 -8.864 1.072 1.00 25.00 H new ATOM 0 HB3 ALA A 857 6.388 -9.832 -0.409 1.00 25.00 H new ATOM 1798 N GLU A 858 6.904 -8.594 -2.955 1.00 25.00 N ATOM 1799 CA GLU A 858 7.678 -8.755 -4.190 1.00 25.00 C ATOM 1800 C GLU A 858 7.607 -7.534 -5.074 1.00 25.00 C ATOM 1801 O GLU A 858 8.565 -7.190 -5.748 1.00 25.00 O ATOM 1802 CB GLU A 858 7.274 -9.997 -4.959 1.00 25.00 C ATOM 1803 CG GLU A 858 5.820 -10.205 -5.232 1.00 25.00 C ATOM 1804 CD GLU A 858 5.574 -11.540 -5.920 1.00 25.00 C ATOM 1805 OE1 GLU A 858 5.771 -12.589 -5.256 1.00 25.00 O ATOM 1806 OE2 GLU A 858 5.199 -11.554 -7.111 1.00 25.00 O ATOM 0 H GLU A 858 6.041 -9.137 -2.913 1.00 25.00 H new ATOM 0 HA GLU A 858 8.716 -8.878 -3.880 1.00 25.00 H new ATOM 0 HB2 GLU A 858 7.796 -9.983 -5.916 1.00 25.00 H new ATOM 0 HB3 GLU A 858 7.639 -10.865 -4.410 1.00 25.00 H new ATOM 0 HG2 GLU A 858 5.263 -10.167 -4.296 1.00 25.00 H new ATOM 0 HG3 GLU A 858 5.446 -9.396 -5.859 1.00 25.00 H new ATOM 1813 N TYR A 859 6.476 -6.868 -5.034 1.00 25.00 N ATOM 1814 CA TYR A 859 6.313 -5.572 -5.714 1.00 25.00 C ATOM 1815 C TYR A 859 7.400 -4.620 -5.210 1.00 25.00 C ATOM 1816 O TYR A 859 8.131 -4.008 -5.998 1.00 25.00 O ATOM 1817 CB TYR A 859 4.909 -4.987 -5.459 1.00 25.00 C ATOM 1818 CG TYR A 859 4.864 -3.526 -4.983 1.00 25.00 C ATOM 1819 CD1 TYR A 859 5.366 -2.467 -5.778 1.00 25.00 C ATOM 1820 CD2 TYR A 859 4.316 -3.198 -3.724 1.00 25.00 C ATOM 1821 CE1 TYR A 859 5.296 -1.125 -5.322 1.00 25.00 C ATOM 1822 CE2 TYR A 859 4.233 -1.854 -3.285 1.00 25.00 C ATOM 1823 CZ TYR A 859 4.721 -0.833 -4.090 1.00 25.00 C ATOM 1824 OH TYR A 859 4.650 0.469 -3.671 1.00 25.00 O ATOM 0 H TYR A 859 5.644 -7.191 -4.540 1.00 25.00 H new ATOM 0 HA TYR A 859 6.414 -5.709 -6.791 1.00 25.00 H new ATOM 0 HB2 TYR A 859 4.331 -5.066 -6.380 1.00 25.00 H new ATOM 0 HB3 TYR A 859 4.409 -5.606 -4.715 1.00 25.00 H new ATOM 0 HD1 TYR A 859 5.806 -2.683 -6.740 1.00 25.00 H new ATOM 0 HD2 TYR A 859 3.953 -3.988 -3.083 1.00 25.00 H new ATOM 0 HE1 TYR A 859 5.691 -0.328 -5.934 1.00 25.00 H new ATOM 0 HE2 TYR A 859 3.791 -1.624 -2.327 1.00 25.00 H new ATOM 0 HH TYR A 859 4.220 0.506 -2.791 1.00 25.00 H new ATOM 1834 N CYS A 860 7.514 -4.515 -3.897 1.00 25.00 N ATOM 1835 CA CYS A 860 8.506 -3.654 -3.281 1.00 25.00 C ATOM 1836 C CYS A 860 9.915 -4.132 -3.625 1.00 25.00 C ATOM 1837 O CYS A 860 10.774 -3.328 -3.944 1.00 25.00 O ATOM 1838 CB CYS A 860 8.310 -3.633 -1.764 1.00 25.00 C ATOM 1839 SG CYS A 860 6.780 -2.847 -1.227 1.00 25.00 S ATOM 0 H CYS A 860 6.926 -5.020 -3.234 1.00 25.00 H new ATOM 0 HA CYS A 860 8.381 -2.643 -3.668 1.00 25.00 H new ATOM 0 HB2 CYS A 860 8.329 -4.658 -1.392 1.00 25.00 H new ATOM 0 HB3 CYS A 860 9.152 -3.113 -1.307 1.00 25.00 H new ATOM 0 HG CYS A 860 5.940 -2.809 -2.219 1.00 25.00 H new ATOM 1845 N ILE A 861 10.136 -5.442 -3.576 1.00 25.00 N ATOM 1846 CA ILE A 861 11.445 -6.042 -3.875 1.00 25.00 C ATOM 1847 C ILE A 861 11.879 -5.681 -5.293 1.00 25.00 C ATOM 1848 O ILE A 861 13.038 -5.368 -5.539 1.00 25.00 O ATOM 1849 CB ILE A 861 11.380 -7.612 -3.731 1.00 25.00 C ATOM 1850 CG1 ILE A 861 11.384 -7.995 -2.238 1.00 25.00 C ATOM 1851 CG2 ILE A 861 12.535 -8.320 -4.501 1.00 25.00 C ATOM 1852 CD1 ILE A 861 10.872 -9.405 -1.926 1.00 25.00 C ATOM 0 H ILE A 861 9.418 -6.123 -3.329 1.00 25.00 H new ATOM 0 HA ILE A 861 12.171 -5.649 -3.163 1.00 25.00 H new ATOM 0 HB ILE A 861 10.451 -7.958 -4.185 1.00 25.00 H new ATOM 0 HG12 ILE A 861 12.402 -7.903 -1.858 1.00 25.00 H new ATOM 0 HG13 ILE A 861 10.774 -7.275 -1.693 1.00 25.00 H new ATOM 0 HG21 ILE A 861 12.450 -9.399 -4.373 1.00 25.00 H new ATOM 0 HG22 ILE A 861 12.470 -8.074 -5.561 1.00 25.00 H new ATOM 0 HG23 ILE A 861 13.494 -7.983 -4.108 1.00 25.00 H new ATOM 0 HD11 ILE A 861 10.915 -9.578 -0.851 1.00 25.00 H new ATOM 0 HD12 ILE A 861 9.842 -9.502 -2.269 1.00 25.00 H new ATOM 0 HD13 ILE A 861 11.495 -10.140 -2.437 1.00 25.00 H new ATOM 1864 N ALA A 862 10.932 -5.719 -6.215 1.00 25.00 N ATOM 1865 CA ALA A 862 11.201 -5.455 -7.621 1.00 25.00 C ATOM 1866 C ALA A 862 11.648 -4.017 -7.873 1.00 25.00 C ATOM 1867 O ALA A 862 12.484 -3.759 -8.728 1.00 25.00 O ATOM 1868 CB ALA A 862 9.942 -5.750 -8.419 1.00 25.00 C ATOM 0 H ALA A 862 9.956 -5.933 -6.012 1.00 25.00 H new ATOM 0 HA ALA A 862 12.022 -6.100 -7.935 1.00 25.00 H new ATOM 0 HB1 ALA A 862 10.127 -5.557 -9.476 1.00 25.00 H new ATOM 0 HB2 ALA A 862 9.663 -6.795 -8.285 1.00 25.00 H new ATOM 0 HB3 ALA A 862 9.132 -5.110 -8.070 1.00 25.00 H new ATOM 1874 N ARG A 863 11.073 -3.083 -7.133 1.00 25.00 N ATOM 1875 CA ARG A 863 11.414 -1.670 -7.290 1.00 25.00 C ATOM 1876 C ARG A 863 12.627 -1.282 -6.447 1.00 25.00 C ATOM 1877 O ARG A 863 13.178 -0.206 -6.612 1.00 25.00 O ATOM 1878 CB ARG A 863 10.209 -0.799 -6.915 1.00 25.00 C ATOM 1879 CG ARG A 863 9.236 -0.584 -8.042 1.00 25.00 C ATOM 1880 CD ARG A 863 7.939 -1.298 -7.811 1.00 25.00 C ATOM 1881 NE ARG A 863 6.872 -0.865 -8.741 1.00 25.00 N ATOM 1882 CZ ARG A 863 6.178 0.271 -8.661 1.00 25.00 C ATOM 1883 NH1 ARG A 863 6.389 1.166 -7.730 1.00 25.00 N ATOM 1884 NH2 ARG A 863 5.256 0.513 -9.551 1.00 25.00 N ATOM 0 H ARG A 863 10.370 -3.272 -6.419 1.00 25.00 H new ATOM 0 HA ARG A 863 11.674 -1.503 -8.335 1.00 25.00 H new ATOM 0 HB2 ARG A 863 9.685 -1.262 -6.079 1.00 25.00 H new ATOM 0 HB3 ARG A 863 10.568 0.170 -6.568 1.00 25.00 H new ATOM 0 HG2 ARG A 863 9.046 0.483 -8.158 1.00 25.00 H new ATOM 0 HG3 ARG A 863 9.680 -0.932 -8.975 1.00 25.00 H new ATOM 0 HD2 ARG A 863 8.096 -2.371 -7.920 1.00 25.00 H new ATOM 0 HD3 ARG A 863 7.613 -1.126 -6.785 1.00 25.00 H new ATOM 0 HE ARG A 863 6.647 -1.492 -9.513 1.00 25.00 H new ATOM 0 HH11 ARG A 863 7.110 1.009 -7.026 1.00 25.00 H new ATOM 0 HH12 ARG A 863 5.833 2.021 -7.709 1.00 25.00 H new ATOM 0 HH21 ARG A 863 5.075 -0.162 -10.294 1.00 25.00 H new ATOM 0 HH22 ARG A 863 4.716 1.377 -9.504 1.00 25.00 H new ATOM 1898 N MET A 864 13.036 -2.149 -5.538 1.00 25.00 N ATOM 1899 CA MET A 864 14.162 -1.855 -4.660 1.00 25.00 C ATOM 1900 C MET A 864 15.497 -2.116 -5.364 1.00 25.00 C ATOM 1901 O MET A 864 15.565 -2.925 -6.283 1.00 25.00 O ATOM 1902 CB MET A 864 14.029 -2.657 -3.383 1.00 25.00 C ATOM 1903 CG MET A 864 14.443 -1.877 -2.170 1.00 25.00 C ATOM 1904 SD MET A 864 13.581 -2.393 -0.695 1.00 25.00 S ATOM 1905 CE MET A 864 12.090 -1.356 -0.715 1.00 25.00 C ATOM 0 H MET A 864 12.608 -3.062 -5.386 1.00 25.00 H new ATOM 0 HA MET A 864 14.149 -0.796 -4.404 1.00 25.00 H new ATOM 0 HB2 MET A 864 12.995 -2.981 -3.267 1.00 25.00 H new ATOM 0 HB3 MET A 864 14.639 -3.557 -3.458 1.00 25.00 H new ATOM 0 HG2 MET A 864 15.516 -1.991 -2.018 1.00 25.00 H new ATOM 0 HG3 MET A 864 14.257 -0.817 -2.343 1.00 25.00 H new ATOM 0 HE1 MET A 864 11.475 -1.587 0.155 1.00 25.00 H new ATOM 0 HE2 MET A 864 12.377 -0.305 -0.688 1.00 25.00 H new ATOM 0 HE3 MET A 864 11.522 -1.553 -1.624 1.00 25.00 H new ATOM 1915 N ALA A 865 16.556 -1.423 -4.958 1.00 25.00 N ATOM 1916 CA ALA A 865 17.831 -1.541 -5.661 1.00 25.00 C ATOM 1917 C ALA A 865 18.457 -2.914 -5.401 1.00 25.00 C ATOM 1918 O ALA A 865 18.505 -3.368 -4.264 1.00 25.00 O ATOM 1919 CB ALA A 865 18.780 -0.433 -5.244 1.00 25.00 C ATOM 0 H ALA A 865 16.560 -0.785 -4.162 1.00 25.00 H new ATOM 0 HA ALA A 865 17.645 -1.442 -6.730 1.00 25.00 H new ATOM 0 HB1 ALA A 865 19.723 -0.541 -5.780 1.00 25.00 H new ATOM 0 HB2 ALA A 865 18.337 0.534 -5.481 1.00 25.00 H new ATOM 0 HB3 ALA A 865 18.963 -0.495 -4.171 1.00 25.00 H new ATOM 1925 N PRO A 866 18.933 -3.592 -6.455 1.00 25.00 N ATOM 1926 CA PRO A 866 19.456 -4.959 -6.370 1.00 25.00 C ATOM 1927 C PRO A 866 20.847 -5.088 -5.748 1.00 25.00 C ATOM 1928 O PRO A 866 21.865 -5.073 -6.443 1.00 25.00 O ATOM 1929 CB PRO A 866 19.459 -5.393 -7.835 1.00 25.00 C ATOM 1930 CG PRO A 866 19.744 -4.138 -8.582 1.00 25.00 C ATOM 1931 CD PRO A 866 18.975 -3.089 -7.841 1.00 25.00 C ATOM 0 HA PRO A 866 18.851 -5.574 -5.704 1.00 25.00 H new ATOM 0 HB2 PRO A 866 20.218 -6.152 -8.025 1.00 25.00 H new ATOM 0 HB3 PRO A 866 18.500 -5.822 -8.126 1.00 25.00 H new ATOM 0 HG2 PRO A 866 20.811 -3.915 -8.595 1.00 25.00 H new ATOM 0 HG3 PRO A 866 19.421 -4.210 -9.620 1.00 25.00 H new ATOM 0 HD2 PRO A 866 19.467 -2.118 -7.899 1.00 25.00 H new ATOM 0 HD3 PRO A 866 17.973 -2.964 -8.251 1.00 25.00 H new ATOM 1939 N TYR A 867 20.912 -5.231 -4.435 1.00 25.00 N ATOM 1940 CA TYR A 867 22.208 -5.384 -3.785 1.00 25.00 C ATOM 1941 C TYR A 867 22.541 -6.869 -3.727 1.00 25.00 C ATOM 1942 O TYR A 867 22.104 -7.602 -2.849 1.00 25.00 O ATOM 1943 CB TYR A 867 22.156 -4.772 -2.383 1.00 25.00 C ATOM 1944 CG TYR A 867 22.480 -3.287 -2.360 1.00 25.00 C ATOM 1945 CD1 TYR A 867 22.368 -2.481 -3.531 1.00 25.00 C ATOM 1946 CD2 TYR A 867 22.917 -2.671 -1.163 1.00 25.00 C ATOM 1947 CE1 TYR A 867 22.720 -1.116 -3.502 1.00 25.00 C ATOM 1948 CE2 TYR A 867 23.254 -1.292 -1.140 1.00 25.00 C ATOM 1949 CZ TYR A 867 23.157 -0.534 -2.313 1.00 25.00 C ATOM 1950 OH TYR A 867 23.476 0.795 -2.294 1.00 25.00 O ATOM 0 H TYR A 867 20.107 -5.245 -3.809 1.00 25.00 H new ATOM 0 HA TYR A 867 22.985 -4.865 -4.346 1.00 25.00 H new ATOM 0 HB2 TYR A 867 21.162 -4.926 -1.964 1.00 25.00 H new ATOM 0 HB3 TYR A 867 22.859 -5.300 -1.738 1.00 25.00 H new ATOM 0 HD1 TYR A 867 22.010 -2.921 -4.450 1.00 25.00 H new ATOM 0 HD2 TYR A 867 22.995 -3.256 -0.258 1.00 25.00 H new ATOM 0 HE1 TYR A 867 22.651 -0.521 -4.401 1.00 25.00 H new ATOM 0 HE2 TYR A 867 23.584 -0.830 -0.221 1.00 25.00 H new ATOM 0 HH TYR A 867 22.872 1.268 -1.684 1.00 25.00 H new ATOM 2048 N GLY A 875 19.422 -11.997 -1.287 1.00 25.00 N ATOM 2049 CA GLY A 875 18.200 -11.287 -0.964 1.00 25.00 C ATOM 2050 C GLY A 875 18.409 -9.992 -0.206 1.00 25.00 C ATOM 2051 O GLY A 875 17.725 -9.764 0.781 1.00 25.00 O ATOM 0 HA2 GLY A 875 17.665 -11.070 -1.889 1.00 25.00 H new ATOM 0 HA3 GLY A 875 17.560 -11.941 -0.372 1.00 25.00 H new ATOM 2055 N ALA A 876 19.341 -9.157 -0.646 1.00 25.00 N ATOM 2056 CA ALA A 876 19.591 -7.855 -0.031 1.00 25.00 C ATOM 2057 C ALA A 876 19.185 -6.785 -1.044 1.00 25.00 C ATOM 2058 O ALA A 876 19.435 -6.934 -2.236 1.00 25.00 O ATOM 2059 CB ALA A 876 21.071 -7.715 0.350 1.00 25.00 C ATOM 0 H ALA A 876 19.947 -9.361 -1.440 1.00 25.00 H new ATOM 0 HA ALA A 876 19.012 -7.746 0.886 1.00 25.00 H new ATOM 0 HB1 ALA A 876 21.238 -6.739 0.806 1.00 25.00 H new ATOM 0 HB2 ALA A 876 21.340 -8.498 1.059 1.00 25.00 H new ATOM 0 HB3 ALA A 876 21.687 -7.808 -0.544 1.00 25.00 H new ATOM 2065 N LEU A 877 18.554 -5.725 -0.576 1.00 25.00 N ATOM 2066 CA LEU A 877 18.151 -4.620 -1.441 1.00 25.00 C ATOM 2067 C LEU A 877 18.326 -3.285 -0.749 1.00 25.00 C ATOM 2068 O LEU A 877 18.188 -3.204 0.461 1.00 25.00 O ATOM 2069 CB LEU A 877 16.680 -4.756 -1.809 1.00 25.00 C ATOM 2070 CG LEU A 877 16.203 -6.067 -2.443 1.00 25.00 C ATOM 2071 CD1 LEU A 877 14.765 -6.265 -2.076 1.00 25.00 C ATOM 2072 CD2 LEU A 877 16.385 -6.061 -3.959 1.00 25.00 C ATOM 0 H LEU A 877 18.305 -5.601 0.405 1.00 25.00 H new ATOM 0 HA LEU A 877 18.782 -4.659 -2.329 1.00 25.00 H new ATOM 0 HB2 LEU A 877 16.095 -4.594 -0.903 1.00 25.00 H new ATOM 0 HB3 LEU A 877 16.434 -3.947 -2.496 1.00 25.00 H new ATOM 0 HG LEU A 877 16.805 -6.893 -2.064 1.00 25.00 H new ATOM 0 HD11 LEU A 877 14.402 -7.193 -2.516 1.00 25.00 H new ATOM 0 HD12 LEU A 877 14.670 -6.316 -0.991 1.00 25.00 H new ATOM 0 HD13 LEU A 877 14.175 -5.430 -2.453 1.00 25.00 H new ATOM 0 HD21 LEU A 877 16.035 -7.008 -4.371 1.00 25.00 H new ATOM 0 HD22 LEU A 877 15.810 -5.242 -4.391 1.00 25.00 H new ATOM 0 HD23 LEU A 877 17.440 -5.929 -4.198 1.00 25.00 H new ATOM 2084 N ASP A 878 18.597 -2.228 -1.491 1.00 25.00 N ATOM 2085 CA ASP A 878 18.694 -0.906 -0.874 1.00 25.00 C ATOM 2086 C ASP A 878 17.352 -0.218 -0.883 1.00 25.00 C ATOM 2087 O ASP A 878 16.836 0.170 -1.929 1.00 25.00 O ATOM 2088 CB ASP A 878 19.750 -0.046 -1.520 1.00 25.00 C ATOM 2089 CG ASP A 878 20.237 1.041 -0.580 1.00 25.00 C ATOM 2090 OD1 ASP A 878 19.363 1.640 0.080 1.00 25.00 O ATOM 2091 OD2 ASP A 878 21.453 1.300 -0.479 1.00 25.00 O ATOM 0 H ASP A 878 18.752 -2.249 -2.499 1.00 25.00 H new ATOM 0 HA ASP A 878 19.003 -1.054 0.161 1.00 25.00 H new ATOM 0 HB2 ASP A 878 20.591 -0.669 -1.824 1.00 25.00 H new ATOM 0 HB3 ASP A 878 19.347 0.409 -2.425 1.00 25.00 H new ATOM 2096 N TYR A 879 16.789 -0.092 0.306 1.00 25.00 N ATOM 2097 CA TYR A 879 15.473 0.489 0.486 1.00 25.00 C ATOM 2098 C TYR A 879 15.471 1.997 0.213 1.00 25.00 C ATOM 2099 O TYR A 879 14.508 2.535 -0.316 1.00 25.00 O ATOM 2100 CB TYR A 879 14.966 0.188 1.893 1.00 25.00 C ATOM 2101 CG TYR A 879 15.857 0.690 3.011 1.00 25.00 C ATOM 2102 CD1 TYR A 879 15.716 1.993 3.524 1.00 25.00 C ATOM 2103 CD2 TYR A 879 16.844 -0.143 3.569 1.00 25.00 C ATOM 2104 CE1 TYR A 879 16.561 2.458 4.559 1.00 25.00 C ATOM 2105 CE2 TYR A 879 17.676 0.309 4.614 1.00 25.00 C ATOM 2106 CZ TYR A 879 17.533 1.608 5.097 1.00 25.00 C ATOM 2107 OH TYR A 879 18.355 2.030 6.110 1.00 25.00 O ATOM 0 H TYR A 879 17.233 -0.391 1.174 1.00 25.00 H new ATOM 0 HA TYR A 879 14.799 0.036 -0.241 1.00 25.00 H new ATOM 0 HB2 TYR A 879 13.977 0.630 2.010 1.00 25.00 H new ATOM 0 HB3 TYR A 879 14.848 -0.890 1.998 1.00 25.00 H new ATOM 0 HD1 TYR A 879 14.954 2.645 3.123 1.00 25.00 H new ATOM 0 HD2 TYR A 879 16.967 -1.147 3.190 1.00 25.00 H new ATOM 0 HE1 TYR A 879 16.456 3.466 4.932 1.00 25.00 H new ATOM 0 HE2 TYR A 879 18.420 -0.349 5.038 1.00 25.00 H new ATOM 0 HH TYR A 879 18.978 1.311 6.347 1.00 25.00 H new ATOM 2117 N MET A 880 16.550 2.673 0.588 1.00 25.00 N ATOM 2118 CA MET A 880 16.654 4.124 0.420 1.00 25.00 C ATOM 2119 C MET A 880 17.241 4.527 -0.932 1.00 25.00 C ATOM 2120 O MET A 880 16.967 5.612 -1.423 1.00 25.00 O ATOM 2121 CB MET A 880 17.446 4.738 1.583 1.00 25.00 C ATOM 2122 CG MET A 880 18.807 4.118 1.817 1.00 25.00 C ATOM 2123 SD MET A 880 19.655 4.764 3.267 1.00 25.00 S ATOM 2124 CE MET A 880 21.139 3.750 3.213 1.00 25.00 C ATOM 0 H MET A 880 17.371 2.241 1.013 1.00 25.00 H new ATOM 0 HA MET A 880 15.640 4.524 0.435 1.00 25.00 H new ATOM 0 HB2 MET A 880 17.575 5.804 1.395 1.00 25.00 H new ATOM 0 HB3 MET A 880 16.857 4.644 2.495 1.00 25.00 H new ATOM 0 HG2 MET A 880 18.692 3.039 1.925 1.00 25.00 H new ATOM 0 HG3 MET A 880 19.429 4.286 0.938 1.00 25.00 H new ATOM 0 HE1 MET A 880 21.790 4.014 4.046 1.00 25.00 H new ATOM 0 HE2 MET A 880 20.864 2.698 3.287 1.00 25.00 H new ATOM 0 HE3 MET A 880 21.664 3.923 2.273 1.00 25.00 H new ATOM 2134 N SER A 881 18.040 3.652 -1.530 1.00 25.00 N ATOM 2135 CA SER A 881 18.647 3.921 -2.842 1.00 25.00 C ATOM 2136 C SER A 881 17.935 3.143 -3.943 1.00 25.00 C ATOM 2137 O SER A 881 18.493 2.922 -5.015 1.00 25.00 O ATOM 2138 CB SER A 881 20.134 3.561 -2.835 1.00 25.00 C ATOM 2139 OG SER A 881 20.795 4.120 -3.958 1.00 25.00 O ATOM 0 H SER A 881 18.287 2.746 -1.132 1.00 25.00 H new ATOM 0 HA SER A 881 18.541 4.987 -3.043 1.00 25.00 H new ATOM 0 HB2 SER A 881 20.596 3.925 -1.917 1.00 25.00 H new ATOM 0 HB3 SER A 881 20.250 2.477 -2.842 1.00 25.00 H new ATOM 0 HG SER A 881 20.293 3.907 -4.772 1.00 25.00 H new ATOM 2145 N PHE A 882 16.709 2.728 -3.651 1.00 25.00 N ATOM 2146 CA PHE A 882 15.847 2.002 -4.599 1.00 25.00 C ATOM 2147 C PHE A 882 15.795 2.548 -6.041 1.00 25.00 C ATOM 2148 O PHE A 882 16.021 3.730 -6.302 1.00 25.00 O ATOM 2149 CB PHE A 882 14.421 1.930 -4.030 1.00 25.00 C ATOM 2150 CG PHE A 882 13.574 3.133 -4.346 1.00 25.00 C ATOM 2151 CD1 PHE A 882 13.813 4.371 -3.717 1.00 25.00 C ATOM 2152 CD2 PHE A 882 12.523 3.030 -5.283 1.00 25.00 C ATOM 2153 CE1 PHE A 882 13.020 5.504 -4.028 1.00 25.00 C ATOM 2154 CE2 PHE A 882 11.726 4.157 -5.602 1.00 25.00 C ATOM 2155 CZ PHE A 882 11.977 5.396 -4.972 1.00 25.00 C ATOM 0 H PHE A 882 16.273 2.883 -2.742 1.00 25.00 H new ATOM 0 HA PHE A 882 16.309 1.020 -4.696 1.00 25.00 H new ATOM 0 HB2 PHE A 882 13.929 1.039 -4.421 1.00 25.00 H new ATOM 0 HB3 PHE A 882 14.478 1.813 -2.948 1.00 25.00 H new ATOM 0 HD1 PHE A 882 14.608 4.457 -2.991 1.00 25.00 H new ATOM 0 HD2 PHE A 882 12.325 2.082 -5.762 1.00 25.00 H new ATOM 0 HE1 PHE A 882 13.214 6.449 -3.543 1.00 25.00 H new ATOM 0 HE2 PHE A 882 10.929 4.069 -6.325 1.00 25.00 H new ATOM 0 HZ PHE A 882 11.372 6.258 -5.212 1.00 25.00 H new