USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1180 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 68 MET CE :methyl -151:sc= -0.143 (180deg=-0.52) USER MOD Set 1.2: B 9 HIS : no HD1:sc= -0.0682 K(o=-0.21,f=-1.2) USER MOD Set 2.1: A 105 MET CE :methyl 180:sc=-0.00245 (180deg=0) USER MOD Set 2.2: A 120 MET CE :methyl 153:sc= -0.261 (180deg=-0.35) USER MOD Set 3.1: A 56 ASN : amide:sc= -0.413! C(o=0.011!,f=-6.7!) USER MOD Set 3.2: A 58 THR OG1 : rot 92:sc= 0.425 USER MOD Single : A 4 GLN : amide:sc= -0.266 X(o=-0.27,f=-0.21) USER MOD Single : A 9 LYS NZ :NH3+ -170:sc= 1.23 (180deg=1.18) USER MOD Single : A 13 SER OG : rot 72:sc= 0.285 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot -66:sc= 0.937 USER MOD Single : A 24 THR OG1 : rot -75:sc= 0.771 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.103 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.663 USER MOD Single : A 32 MET CE :methyl -122:sc= 0 (180deg=-0.218) USER MOD Single : A 34 SER OG : rot 94:sc= 0.28 USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 38 ASN : amide:sc= -0.0292 X(o=-0.029,f=0) USER MOD Single : A 40 THR OG1 : rot -72:sc= 0.562 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 MET CE :methyl -138:sc= -0.166 (180deg=-1.22) USER MOD Single : A 49 ASN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 66 THR OG1 : rot 85:sc= 1.26 USER MOD Single : A 67 MET CE :methyl -147:sc= -0.492 (180deg=-1.17) USER MOD Single : A 71 LYS NZ :NH3+ 171:sc= -0.0705 (180deg=-0.316) USER MOD Single : A 72 MET CE :methyl -167:sc= -0.915 (180deg=-1.23) USER MOD Single : A 73 LYS NZ :NH3+ -147:sc= 1.24 (180deg=1.04) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 61:sc= 0.904 USER MOD Single : A 90 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.137) USER MOD Single : A 93 ASN : amide:sc= -0.535 K(o=-0.53,f=-6.9!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -79:sc= 1.23 USER MOD Single : A 103 HIS : no HE2:sc= 0.263 K(o=0.26,f=-0.91) USER MOD Single : A 106 THR OG1 : rot 85:sc= 1.22 USER MOD Single : A 107 ASN : amide:sc= -0.0399 K(o=-0.04,f=-0.59) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.351 USER MOD Single : A 131 GLN : amide:sc=-0.00935 X(o=-0.0094,f=-0.46) USER MOD Single : A 133 ASN : amide:sc= 0.454 K(o=0.45,f=-10!) USER MOD Single : A 134 TYR OH : rot 180:sc= -0.018 USER MOD Single : A 139 GLN :FLIP amide:sc= 0 F(o=-0.53,f=0) USER MOD Single : A 140 MET CE :methyl 149:sc= -0.178 (180deg=-2.04) USER MOD Single : A 141 MET CE :methyl 158:sc= -0.53 (180deg=-1.58) USER MOD Single : A 142 THR OG1 : rot 49:sc= 0.439 USER MOD Single : B 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ -152:sc= 1.27 (180deg=1.21) USER MOD Single : B 5 GLN : amide:sc= 0.437 K(o=0.44,f=-1.5) USER MOD Single : B 6 LYS NZ :NH3+ -148:sc= 1.24 (180deg=0.704) USER MOD Single : B 7 THR OG1 : rot 81:sc= 0.172 USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 3.439 2.801 17.318 1.00 0.00 N ATOM 30 CA GLU A 3 2.309 2.462 16.509 1.00 0.00 C ATOM 31 C GLU A 3 2.633 2.183 15.082 1.00 0.00 C ATOM 32 O GLU A 3 2.169 1.249 14.430 1.00 0.00 O ATOM 33 CB GLU A 3 1.292 3.616 16.543 1.00 0.00 C ATOM 34 CG GLU A 3 -0.073 3.277 15.942 1.00 0.00 C ATOM 35 CD GLU A 3 -0.946 4.510 16.125 1.00 0.00 C ATOM 36 OE1 GLU A 3 -0.969 5.491 15.334 1.00 0.00 O ATOM 37 OE2 GLU A 3 -1.713 4.454 17.123 1.00 0.00 O ATOM 0 HA GLU A 3 1.910 1.541 16.935 1.00 0.00 H new ATOM 0 HB2 GLU A 3 1.152 3.929 17.578 1.00 0.00 H new ATOM 0 HB3 GLU A 3 1.710 4.468 16.006 1.00 0.00 H new ATOM 0 HG2 GLU A 3 0.021 3.022 14.886 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -0.513 2.413 16.441 1.00 0.00 H new ATOM 44 N GLN A 4 3.494 3.020 14.476 1.00 0.00 N ATOM 45 CA GLN A 4 3.990 2.875 13.142 1.00 0.00 C ATOM 46 C GLN A 4 4.891 1.709 12.923 1.00 0.00 C ATOM 47 O GLN A 4 4.631 1.014 11.942 1.00 0.00 O ATOM 48 CB GLN A 4 4.731 4.161 12.738 1.00 0.00 C ATOM 49 CG GLN A 4 3.812 5.373 12.576 1.00 0.00 C ATOM 50 CD GLN A 4 2.439 5.107 11.976 1.00 0.00 C ATOM 51 OE1 GLN A 4 2.124 4.840 10.818 1.00 0.00 O ATOM 52 NE2 GLN A 4 1.471 5.155 12.930 1.00 0.00 N ATOM 0 H GLN A 4 3.865 3.846 14.945 1.00 0.00 H new ATOM 0 HA GLN A 4 3.113 2.692 12.522 1.00 0.00 H new ATOM 0 HB2 GLN A 4 5.486 4.387 13.491 1.00 0.00 H new ATOM 0 HB3 GLN A 4 5.258 3.987 11.800 1.00 0.00 H new ATOM 0 HG2 GLN A 4 3.674 5.830 13.556 1.00 0.00 H new ATOM 0 HG3 GLN A 4 4.321 6.107 11.951 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.717 5.375 13.895 1.00 0.00 H new ATOM 0 HE22 GLN A 4 0.499 4.971 12.680 1.00 0.00 H new ATOM 61 N ILE A 5 5.877 1.456 13.802 1.00 0.00 N ATOM 62 CA ILE A 5 6.776 0.345 13.762 1.00 0.00 C ATOM 63 C ILE A 5 6.046 -0.953 13.791 1.00 0.00 C ATOM 64 O ILE A 5 6.460 -1.911 13.138 1.00 0.00 O ATOM 65 CB ILE A 5 7.812 0.456 14.841 1.00 0.00 C ATOM 66 CG1 ILE A 5 8.704 1.709 14.829 1.00 0.00 C ATOM 67 CG2 ILE A 5 8.687 -0.808 14.895 1.00 0.00 C ATOM 68 CD1 ILE A 5 9.638 1.911 13.637 1.00 0.00 C ATOM 0 H ILE A 5 6.058 2.071 14.595 1.00 0.00 H new ATOM 0 HA ILE A 5 7.307 0.370 12.811 1.00 0.00 H new ATOM 0 HB ILE A 5 7.213 0.562 15.746 1.00 0.00 H new ATOM 0 HG12 ILE A 5 8.055 2.582 14.897 1.00 0.00 H new ATOM 0 HG13 ILE A 5 9.314 1.694 15.733 1.00 0.00 H new ATOM 0 HG21 ILE A 5 9.430 -0.703 15.685 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.060 -1.676 15.100 1.00 0.00 H new ATOM 0 HG23 ILE A 5 9.191 -0.942 13.938 1.00 0.00 H new ATOM 0 HD11 ILE A 5 10.202 2.834 13.769 1.00 0.00 H new ATOM 0 HD12 ILE A 5 10.329 1.071 13.570 1.00 0.00 H new ATOM 0 HD13 ILE A 5 9.051 1.972 12.721 1.00 0.00 H new ATOM 80 N ALA A 6 4.916 -1.070 14.511 1.00 0.00 N ATOM 81 CA ALA A 6 4.081 -2.222 14.660 1.00 0.00 C ATOM 82 C ALA A 6 3.255 -2.343 13.425 1.00 0.00 C ATOM 83 O ALA A 6 3.003 -3.423 12.892 1.00 0.00 O ATOM 84 CB ALA A 6 3.220 -2.070 15.925 1.00 0.00 C ATOM 0 H ALA A 6 4.553 -0.277 15.041 1.00 0.00 H new ATOM 0 HA ALA A 6 4.668 -3.132 14.782 1.00 0.00 H new ATOM 0 HB1 ALA A 6 2.583 -2.947 16.039 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.868 -1.975 16.797 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.598 -1.179 15.837 1.00 0.00 H new ATOM 90 N GLU A 7 2.908 -1.242 12.735 1.00 0.00 N ATOM 91 CA GLU A 7 2.192 -1.378 11.504 1.00 0.00 C ATOM 92 C GLU A 7 3.020 -1.959 10.411 1.00 0.00 C ATOM 93 O GLU A 7 2.690 -2.925 9.724 1.00 0.00 O ATOM 94 CB GLU A 7 1.676 0.023 11.135 1.00 0.00 C ATOM 95 CG GLU A 7 0.555 0.060 10.094 1.00 0.00 C ATOM 96 CD GLU A 7 -0.845 -0.346 10.530 1.00 0.00 C ATOM 97 OE1 GLU A 7 -1.299 -0.257 11.702 1.00 0.00 O ATOM 98 OE2 GLU A 7 -1.438 -0.939 9.589 1.00 0.00 O ATOM 0 H GLU A 7 3.115 -0.284 13.018 1.00 0.00 H new ATOM 0 HA GLU A 7 1.369 -2.081 11.633 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.321 0.511 12.043 1.00 0.00 H new ATOM 0 HB3 GLU A 7 2.513 0.613 10.762 1.00 0.00 H new ATOM 0 HG2 GLU A 7 0.500 1.075 9.700 1.00 0.00 H new ATOM 0 HG3 GLU A 7 0.847 -0.587 9.267 1.00 0.00 H new ATOM 105 N PHE A 8 4.240 -1.398 10.326 1.00 0.00 N ATOM 106 CA PHE A 8 5.312 -1.781 9.461 1.00 0.00 C ATOM 107 C PHE A 8 5.739 -3.191 9.683 1.00 0.00 C ATOM 108 O PHE A 8 6.045 -3.924 8.744 1.00 0.00 O ATOM 109 CB PHE A 8 6.582 -0.917 9.526 1.00 0.00 C ATOM 110 CG PHE A 8 6.264 0.395 8.895 1.00 0.00 C ATOM 111 CD1 PHE A 8 5.822 0.415 7.593 1.00 0.00 C ATOM 112 CD2 PHE A 8 6.426 1.559 9.608 1.00 0.00 C ATOM 113 CE1 PHE A 8 5.517 1.617 7.000 1.00 0.00 C ATOM 114 CE2 PHE A 8 6.028 2.758 9.066 1.00 0.00 C ATOM 115 CZ PHE A 8 5.626 2.764 7.751 1.00 0.00 C ATOM 0 H PHE A 8 4.496 -0.606 10.916 1.00 0.00 H new ATOM 0 HA PHE A 8 4.864 -1.637 8.478 1.00 0.00 H new ATOM 0 HB2 PHE A 8 6.899 -0.778 10.560 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.405 -1.405 9.003 1.00 0.00 H new ATOM 0 HD1 PHE A 8 5.715 -0.507 7.040 1.00 0.00 H new ATOM 0 HD2 PHE A 8 6.866 1.532 10.594 1.00 0.00 H new ATOM 0 HE1 PHE A 8 5.199 1.660 5.969 1.00 0.00 H new ATOM 0 HE2 PHE A 8 6.031 3.664 9.653 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.386 3.710 7.288 1.00 0.00 H new ATOM 125 N LYS A 9 5.758 -3.587 10.969 1.00 0.00 N ATOM 126 CA LYS A 9 6.033 -4.922 11.404 1.00 0.00 C ATOM 127 C LYS A 9 5.033 -5.924 10.940 1.00 0.00 C ATOM 128 O LYS A 9 5.387 -6.992 10.443 1.00 0.00 O ATOM 129 CB LYS A 9 6.076 -4.934 12.941 1.00 0.00 C ATOM 130 CG LYS A 9 6.466 -6.249 13.619 1.00 0.00 C ATOM 131 CD LYS A 9 5.280 -7.064 14.138 1.00 0.00 C ATOM 132 CE LYS A 9 4.309 -6.431 15.137 1.00 0.00 C ATOM 133 NZ LYS A 9 3.202 -7.396 15.315 1.00 0.00 N ATOM 0 H LYS A 9 5.573 -2.947 11.741 1.00 0.00 H new ATOM 0 HA LYS A 9 6.988 -5.211 10.965 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.778 -4.166 13.265 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.092 -4.643 13.309 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.028 -6.857 12.910 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.135 -6.031 14.452 1.00 0.00 H new ATOM 0 HD2 LYS A 9 4.698 -7.380 13.273 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.681 -7.966 14.600 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.805 -6.230 16.087 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.936 -5.477 14.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.433 -6.947 15.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.847 -7.693 14.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 3.547 -8.228 15.836 1.00 0.00 H new ATOM 147 N GLU A 10 3.732 -5.640 11.131 1.00 0.00 N ATOM 148 CA GLU A 10 2.694 -6.478 10.616 1.00 0.00 C ATOM 149 C GLU A 10 2.593 -6.662 9.141 1.00 0.00 C ATOM 150 O GLU A 10 2.278 -7.714 8.587 1.00 0.00 O ATOM 151 CB GLU A 10 1.294 -5.940 10.956 1.00 0.00 C ATOM 152 CG GLU A 10 1.054 -6.078 12.460 1.00 0.00 C ATOM 153 CD GLU A 10 0.778 -7.521 12.859 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.434 -7.859 12.801 1.00 0.00 O ATOM 155 OE2 GLU A 10 1.732 -8.263 13.218 1.00 0.00 O ATOM 0 H GLU A 10 3.398 -4.825 11.645 1.00 0.00 H new ATOM 0 HA GLU A 10 2.985 -7.416 11.088 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.210 -4.895 10.657 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.535 -6.492 10.402 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.926 -5.711 13.002 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.211 -5.452 12.752 1.00 0.00 H new ATOM 162 N ALA A 11 3.023 -5.628 8.395 1.00 0.00 N ATOM 163 CA ALA A 11 3.267 -5.649 6.986 1.00 0.00 C ATOM 164 C ALA A 11 4.406 -6.509 6.559 1.00 0.00 C ATOM 165 O ALA A 11 4.299 -7.295 5.620 1.00 0.00 O ATOM 166 CB ALA A 11 3.580 -4.220 6.511 1.00 0.00 C ATOM 0 H ALA A 11 3.213 -4.714 8.806 1.00 0.00 H new ATOM 0 HA ALA A 11 2.362 -6.065 6.544 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.768 -4.226 5.437 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.732 -3.571 6.727 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.463 -3.849 7.031 1.00 0.00 H new ATOM 172 N PHE A 12 5.596 -6.328 7.159 1.00 0.00 N ATOM 173 CA PHE A 12 6.821 -6.985 6.820 1.00 0.00 C ATOM 174 C PHE A 12 6.697 -8.454 7.038 1.00 0.00 C ATOM 175 O PHE A 12 7.325 -9.217 6.306 1.00 0.00 O ATOM 176 CB PHE A 12 7.915 -6.319 7.671 1.00 0.00 C ATOM 177 CG PHE A 12 9.300 -6.481 7.145 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.958 -7.582 7.641 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.926 -5.481 6.439 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.317 -7.631 7.440 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.297 -5.504 6.340 1.00 0.00 C ATOM 182 CZ PHE A 12 11.956 -6.650 6.719 1.00 0.00 C ATOM 0 H PHE A 12 5.709 -5.677 7.936 1.00 0.00 H new ATOM 0 HA PHE A 12 7.078 -6.880 5.766 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.695 -5.255 7.753 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.873 -6.732 8.679 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.433 -8.369 8.162 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.353 -4.694 5.972 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.889 -8.449 7.853 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.841 -4.646 5.975 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.993 -6.782 6.446 1.00 0.00 H new ATOM 192 N SER A 13 5.975 -8.921 8.072 1.00 0.00 N ATOM 193 CA SER A 13 5.536 -10.268 8.269 1.00 0.00 C ATOM 194 C SER A 13 4.974 -11.035 7.122 1.00 0.00 C ATOM 195 O SER A 13 5.154 -12.252 7.114 1.00 0.00 O ATOM 196 CB SER A 13 4.480 -10.376 9.382 1.00 0.00 C ATOM 197 OG SER A 13 5.048 -10.047 10.641 1.00 0.00 O ATOM 0 H SER A 13 5.675 -8.307 8.829 1.00 0.00 H new ATOM 0 HA SER A 13 6.499 -10.722 8.503 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.647 -9.707 9.167 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.077 -11.388 9.412 1.00 0.00 H new ATOM 0 HG SER A 13 5.217 -9.083 10.682 1.00 0.00 H new ATOM 203 N LEU A 14 4.296 -10.358 6.178 1.00 0.00 N ATOM 204 CA LEU A 14 3.678 -10.968 5.042 1.00 0.00 C ATOM 205 C LEU A 14 4.672 -11.370 4.007 1.00 0.00 C ATOM 206 O LEU A 14 4.599 -12.459 3.438 1.00 0.00 O ATOM 207 CB LEU A 14 2.506 -10.126 4.510 1.00 0.00 C ATOM 208 CG LEU A 14 1.226 -9.985 5.351 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.233 -9.126 4.550 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.615 -11.369 5.628 1.00 0.00 C ATOM 0 H LEU A 14 4.174 -9.346 6.207 1.00 0.00 H new ATOM 0 HA LEU A 14 3.229 -11.906 5.369 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.885 -9.121 4.323 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.217 -10.542 3.545 1.00 0.00 H new ATOM 0 HG LEU A 14 1.453 -9.518 6.309 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.688 -9.007 5.121 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.671 -8.146 4.359 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.011 -9.615 3.602 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.290 -11.254 6.224 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.368 -11.854 4.683 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.333 -11.981 6.173 1.00 0.00 H new ATOM 222 N PHE A 15 5.642 -10.481 3.727 1.00 0.00 N ATOM 223 CA PHE A 15 6.818 -10.697 2.943 1.00 0.00 C ATOM 224 C PHE A 15 7.802 -11.628 3.565 1.00 0.00 C ATOM 225 O PHE A 15 8.230 -12.564 2.891 1.00 0.00 O ATOM 226 CB PHE A 15 7.593 -9.407 2.625 1.00 0.00 C ATOM 227 CG PHE A 15 6.895 -8.390 1.789 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.713 -8.681 0.457 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.379 -7.234 2.325 1.00 0.00 C ATOM 230 CE1 PHE A 15 6.139 -7.765 -0.393 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.778 -6.320 1.493 1.00 0.00 C ATOM 232 CZ PHE A 15 5.629 -6.613 0.158 1.00 0.00 C ATOM 0 H PHE A 15 5.597 -9.526 4.082 1.00 0.00 H new ATOM 0 HA PHE A 15 6.408 -11.135 2.033 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.872 -8.937 3.568 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.519 -9.683 2.121 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.025 -9.641 0.074 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.445 -7.046 3.387 1.00 0.00 H new ATOM 0 HE1 PHE A 15 6.090 -7.944 -1.457 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.425 -5.378 1.885 1.00 0.00 H new ATOM 0 HZ PHE A 15 5.097 -5.919 -0.476 1.00 0.00 H new ATOM 242 N ASP A 16 8.289 -11.417 4.800 1.00 0.00 N ATOM 243 CA ASP A 16 9.196 -12.247 5.531 1.00 0.00 C ATOM 244 C ASP A 16 8.649 -13.541 6.027 1.00 0.00 C ATOM 245 O ASP A 16 7.932 -13.577 7.026 1.00 0.00 O ATOM 246 CB ASP A 16 9.843 -11.350 6.599 1.00 0.00 C ATOM 247 CG ASP A 16 10.955 -12.026 7.389 1.00 0.00 C ATOM 248 OD1 ASP A 16 11.278 -13.184 7.010 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.629 -11.389 8.241 1.00 0.00 O ATOM 0 H ASP A 16 8.023 -10.590 5.334 1.00 0.00 H new ATOM 0 HA ASP A 16 9.957 -12.634 4.854 1.00 0.00 H new ATOM 0 HB2 ASP A 16 10.245 -10.460 6.115 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.072 -11.015 7.292 1.00 0.00 H new ATOM 254 N LYS A 17 8.996 -14.640 5.333 1.00 0.00 N ATOM 255 CA LYS A 17 8.363 -15.915 5.468 1.00 0.00 C ATOM 256 C LYS A 17 8.849 -16.646 6.672 1.00 0.00 C ATOM 257 O LYS A 17 8.406 -17.726 7.059 1.00 0.00 O ATOM 258 CB LYS A 17 8.421 -16.671 4.130 1.00 0.00 C ATOM 259 CG LYS A 17 7.192 -17.574 4.014 1.00 0.00 C ATOM 260 CD LYS A 17 7.023 -18.211 2.633 1.00 0.00 C ATOM 261 CE LYS A 17 5.723 -19.012 2.533 1.00 0.00 C ATOM 262 NZ LYS A 17 5.494 -19.613 1.201 1.00 0.00 N ATOM 0 H LYS A 17 9.751 -14.639 4.648 1.00 0.00 H new ATOM 0 HA LYS A 17 7.299 -15.796 5.674 1.00 0.00 H new ATOM 0 HB2 LYS A 17 8.449 -15.965 3.300 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.332 -17.266 4.073 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.261 -18.364 4.762 1.00 0.00 H new ATOM 0 HG3 LYS A 17 6.301 -16.991 4.247 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.030 -17.433 1.870 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.870 -18.866 2.428 1.00 0.00 H new ATOM 0 HE2 LYS A 17 5.737 -19.804 3.281 1.00 0.00 H new ATOM 0 HE3 LYS A 17 4.885 -18.359 2.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.597 -20.139 1.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.449 -18.861 0.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 6.275 -20.262 0.974 1.00 0.00 H new ATOM 276 N ASP A 18 9.923 -16.145 7.308 1.00 0.00 N ATOM 277 CA ASP A 18 10.691 -16.698 8.381 1.00 0.00 C ATOM 278 C ASP A 18 10.273 -15.938 9.592 1.00 0.00 C ATOM 279 O ASP A 18 9.841 -16.483 10.607 1.00 0.00 O ATOM 280 CB ASP A 18 12.179 -16.397 8.134 1.00 0.00 C ATOM 281 CG ASP A 18 12.633 -16.683 6.710 1.00 0.00 C ATOM 282 OD1 ASP A 18 12.393 -17.817 6.216 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.185 -15.739 6.085 1.00 0.00 O ATOM 0 H ASP A 18 10.297 -15.237 7.032 1.00 0.00 H new ATOM 0 HA ASP A 18 10.543 -17.774 8.477 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.372 -15.349 8.364 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.780 -16.990 8.823 1.00 0.00 H new ATOM 288 N GLY A 19 10.243 -14.599 9.468 1.00 0.00 N ATOM 289 CA GLY A 19 10.109 -13.612 10.495 1.00 0.00 C ATOM 290 C GLY A 19 11.440 -13.333 11.104 1.00 0.00 C ATOM 291 O GLY A 19 11.501 -13.234 12.328 1.00 0.00 O ATOM 0 H GLY A 19 10.321 -14.164 8.549 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.690 -12.696 10.079 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.415 -13.961 11.260 1.00 0.00 H new ATOM 295 N ASP A 20 12.536 -13.187 10.338 1.00 0.00 N ATOM 296 CA ASP A 20 13.890 -12.982 10.749 1.00 0.00 C ATOM 297 C ASP A 20 14.078 -11.512 10.906 1.00 0.00 C ATOM 298 O ASP A 20 14.783 -11.085 11.819 1.00 0.00 O ATOM 299 CB ASP A 20 14.924 -13.752 9.910 1.00 0.00 C ATOM 300 CG ASP A 20 15.177 -13.039 8.589 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.269 -12.955 7.719 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.341 -12.586 8.425 1.00 0.00 O ATOM 0 H ASP A 20 12.462 -13.216 9.321 1.00 0.00 H new ATOM 0 HA ASP A 20 14.088 -13.438 11.719 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.857 -13.842 10.466 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.566 -14.764 9.721 1.00 0.00 H new ATOM 307 N GLY A 21 13.623 -10.633 9.996 1.00 0.00 N ATOM 308 CA GLY A 21 13.801 -9.215 10.061 1.00 0.00 C ATOM 309 C GLY A 21 14.425 -8.713 8.805 1.00 0.00 C ATOM 310 O GLY A 21 14.639 -7.508 8.681 1.00 0.00 O ATOM 0 H GLY A 21 13.103 -10.928 9.170 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.838 -8.728 10.217 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.429 -8.959 10.914 1.00 0.00 H new ATOM 314 N THR A 22 14.561 -9.515 7.734 1.00 0.00 N ATOM 315 CA THR A 22 15.020 -9.099 6.445 1.00 0.00 C ATOM 316 C THR A 22 14.139 -9.652 5.378 1.00 0.00 C ATOM 317 O THR A 22 13.687 -10.769 5.624 1.00 0.00 O ATOM 318 CB THR A 22 16.422 -9.559 6.175 1.00 0.00 C ATOM 319 OG1 THR A 22 16.638 -10.963 6.166 1.00 0.00 O ATOM 320 CG2 THR A 22 17.292 -8.881 7.247 1.00 0.00 C ATOM 0 H THR A 22 14.338 -10.510 7.770 1.00 0.00 H new ATOM 0 HA THR A 22 14.995 -8.009 6.439 1.00 0.00 H new ATOM 0 HB THR A 22 16.677 -9.276 5.154 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.494 -11.322 7.066 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.333 -9.174 7.109 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.204 -7.798 7.155 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.956 -9.190 8.237 1.00 0.00 H new ATOM 328 N ILE A 23 13.963 -8.961 4.238 1.00 0.00 N ATOM 329 CA ILE A 23 13.291 -9.426 3.064 1.00 0.00 C ATOM 330 C ILE A 23 14.306 -9.645 1.996 1.00 0.00 C ATOM 331 O ILE A 23 15.116 -8.798 1.622 1.00 0.00 O ATOM 332 CB ILE A 23 12.141 -8.541 2.684 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.004 -8.525 3.719 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.631 -8.915 1.282 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.144 -7.269 3.578 1.00 0.00 C ATOM 0 H ILE A 23 14.316 -8.010 4.130 1.00 0.00 H new ATOM 0 HA ILE A 23 12.810 -10.386 3.251 1.00 0.00 H new ATOM 0 HB ILE A 23 12.519 -7.519 2.665 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.382 -9.411 3.593 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.423 -8.571 4.724 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.796 -8.268 1.014 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.435 -8.789 0.557 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.300 -9.954 1.280 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.349 -7.287 4.323 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.763 -6.385 3.729 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.706 -7.238 2.581 1.00 0.00 H new ATOM 347 N THR A 24 14.275 -10.860 1.420 1.00 0.00 N ATOM 348 CA THR A 24 15.246 -11.271 0.454 1.00 0.00 C ATOM 349 C THR A 24 14.641 -11.179 -0.904 1.00 0.00 C ATOM 350 O THR A 24 13.464 -10.859 -1.062 1.00 0.00 O ATOM 351 CB THR A 24 15.700 -12.668 0.758 1.00 0.00 C ATOM 352 OG1 THR A 24 14.612 -13.570 0.900 1.00 0.00 O ATOM 353 CG2 THR A 24 16.545 -12.816 2.034 1.00 0.00 C ATOM 0 H THR A 24 13.568 -11.566 1.627 1.00 0.00 H new ATOM 0 HA THR A 24 16.120 -10.621 0.491 1.00 0.00 H new ATOM 0 HB THR A 24 16.318 -12.906 -0.108 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.171 -13.418 1.762 1.00 0.00 H new ATOM 0 HG21 THR A 24 16.824 -13.861 2.167 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.446 -12.208 1.946 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.965 -12.483 2.895 1.00 0.00 H new ATOM 361 N THR A 25 15.365 -11.552 -1.975 1.00 0.00 N ATOM 362 CA THR A 25 14.971 -11.461 -3.346 1.00 0.00 C ATOM 363 C THR A 25 13.800 -12.348 -3.598 1.00 0.00 C ATOM 364 O THR A 25 12.768 -11.949 -4.134 1.00 0.00 O ATOM 365 CB THR A 25 16.111 -11.802 -4.258 1.00 0.00 C ATOM 366 OG1 THR A 25 17.063 -12.667 -3.655 1.00 0.00 O ATOM 367 CG2 THR A 25 16.783 -10.512 -4.756 1.00 0.00 C ATOM 0 H THR A 25 16.299 -11.948 -1.872 1.00 0.00 H new ATOM 0 HA THR A 25 14.680 -10.432 -3.557 1.00 0.00 H new ATOM 0 HB THR A 25 15.697 -12.349 -5.105 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.782 -12.858 -4.293 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.611 -10.765 -5.418 1.00 0.00 H new ATOM 0 HG22 THR A 25 16.055 -9.909 -5.299 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.160 -9.946 -3.904 1.00 0.00 H new ATOM 375 N LYS A 26 13.937 -13.576 -3.068 1.00 0.00 N ATOM 376 CA LYS A 26 13.005 -14.658 -3.140 1.00 0.00 C ATOM 377 C LYS A 26 11.689 -14.307 -2.535 1.00 0.00 C ATOM 378 O LYS A 26 10.644 -14.442 -3.170 1.00 0.00 O ATOM 379 CB LYS A 26 13.642 -15.806 -2.339 1.00 0.00 C ATOM 380 CG LYS A 26 14.864 -16.473 -2.973 1.00 0.00 C ATOM 381 CD LYS A 26 15.406 -17.625 -2.124 1.00 0.00 C ATOM 382 CE LYS A 26 16.526 -18.444 -2.768 1.00 0.00 C ATOM 383 NZ LYS A 26 16.829 -19.761 -2.165 1.00 0.00 N ATOM 0 H LYS A 26 14.774 -13.832 -2.544 1.00 0.00 H new ATOM 0 HA LYS A 26 12.810 -14.920 -4.180 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.930 -15.423 -1.360 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.883 -16.570 -2.171 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.598 -16.848 -3.961 1.00 0.00 H new ATOM 0 HG3 LYS A 26 15.648 -15.729 -3.114 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.772 -17.218 -1.181 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.581 -18.296 -1.883 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.270 -18.602 -3.816 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.437 -17.845 -2.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.604 -20.214 -2.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.113 -19.631 -1.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 15.983 -20.365 -2.207 1.00 0.00 H new ATOM 397 N GLU A 27 11.731 -13.785 -1.297 1.00 0.00 N ATOM 398 CA GLU A 27 10.554 -13.364 -0.602 1.00 0.00 C ATOM 399 C GLU A 27 9.744 -12.283 -1.231 1.00 0.00 C ATOM 400 O GLU A 27 8.614 -12.117 -0.773 1.00 0.00 O ATOM 401 CB GLU A 27 10.924 -13.017 0.850 1.00 0.00 C ATOM 402 CG GLU A 27 11.406 -14.221 1.662 1.00 0.00 C ATOM 403 CD GLU A 27 12.057 -13.811 2.976 1.00 0.00 C ATOM 404 OE1 GLU A 27 12.999 -12.990 3.133 1.00 0.00 O ATOM 405 OE2 GLU A 27 11.574 -14.344 4.010 1.00 0.00 O ATOM 0 H GLU A 27 12.594 -13.653 -0.770 1.00 0.00 H new ATOM 0 HA GLU A 27 9.878 -14.218 -0.649 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.704 -12.256 0.846 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.056 -12.580 1.343 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.562 -14.879 1.868 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.119 -14.794 1.069 1.00 0.00 H new ATOM 412 N LEU A 28 10.338 -11.461 -2.114 1.00 0.00 N ATOM 413 CA LEU A 28 9.666 -10.529 -2.965 1.00 0.00 C ATOM 414 C LEU A 28 9.075 -11.149 -4.185 1.00 0.00 C ATOM 415 O LEU A 28 7.935 -10.994 -4.620 1.00 0.00 O ATOM 416 CB LEU A 28 10.554 -9.357 -3.415 1.00 0.00 C ATOM 417 CG LEU A 28 10.882 -8.405 -2.252 1.00 0.00 C ATOM 418 CD1 LEU A 28 11.823 -7.266 -2.679 1.00 0.00 C ATOM 419 CD2 LEU A 28 9.657 -7.757 -1.583 1.00 0.00 C ATOM 0 H LEU A 28 11.350 -11.447 -2.241 1.00 0.00 H new ATOM 0 HA LEU A 28 8.864 -10.153 -2.330 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.480 -9.745 -3.838 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.050 -8.803 -4.206 1.00 0.00 H new ATOM 0 HG LEU A 28 11.363 -9.062 -1.527 1.00 0.00 H new ATOM 0 HD11 LEU A 28 12.025 -6.621 -1.824 1.00 0.00 H new ATOM 0 HD12 LEU A 28 12.760 -7.686 -3.046 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.352 -6.683 -3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.987 -7.103 -0.776 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.106 -7.173 -2.320 1.00 0.00 H new ATOM 0 HD23 LEU A 28 9.009 -8.535 -1.179 1.00 0.00 H new ATOM 431 N GLY A 29 9.867 -12.017 -4.839 1.00 0.00 N ATOM 432 CA GLY A 29 9.461 -12.629 -6.066 1.00 0.00 C ATOM 433 C GLY A 29 8.312 -13.573 -5.971 1.00 0.00 C ATOM 434 O GLY A 29 7.459 -13.564 -6.857 1.00 0.00 O ATOM 0 H GLY A 29 10.793 -12.296 -4.516 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.203 -11.842 -6.774 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.314 -13.165 -6.482 1.00 0.00 H new ATOM 438 N THR A 30 8.258 -14.388 -4.902 1.00 0.00 N ATOM 439 CA THR A 30 7.096 -15.118 -4.501 1.00 0.00 C ATOM 440 C THR A 30 5.864 -14.295 -4.344 1.00 0.00 C ATOM 441 O THR A 30 4.735 -14.687 -4.632 1.00 0.00 O ATOM 442 CB THR A 30 7.288 -16.129 -3.409 1.00 0.00 C ATOM 443 OG1 THR A 30 6.169 -16.991 -3.260 1.00 0.00 O ATOM 444 CG2 THR A 30 7.489 -15.297 -2.131 1.00 0.00 C ATOM 0 H THR A 30 9.059 -14.545 -4.291 1.00 0.00 H new ATOM 0 HA THR A 30 6.915 -15.737 -5.380 1.00 0.00 H new ATOM 0 HB THR A 30 8.132 -16.782 -3.632 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.343 -17.631 -2.539 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.637 -15.964 -1.282 1.00 0.00 H new ATOM 0 HG22 THR A 30 8.364 -14.658 -2.247 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.608 -14.678 -1.957 1.00 0.00 H new ATOM 452 N VAL A 31 5.931 -13.081 -3.769 1.00 0.00 N ATOM 453 CA VAL A 31 4.880 -12.130 -3.581 1.00 0.00 C ATOM 454 C VAL A 31 4.379 -11.506 -4.839 1.00 0.00 C ATOM 455 O VAL A 31 3.181 -11.465 -5.115 1.00 0.00 O ATOM 456 CB VAL A 31 5.140 -11.258 -2.389 1.00 0.00 C ATOM 457 CG1 VAL A 31 4.085 -10.150 -2.224 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.178 -12.128 -1.121 1.00 0.00 C ATOM 0 H VAL A 31 6.815 -12.732 -3.398 1.00 0.00 H new ATOM 0 HA VAL A 31 3.972 -12.661 -3.295 1.00 0.00 H new ATOM 0 HB VAL A 31 6.100 -10.767 -2.546 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.322 -9.549 -1.346 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.084 -9.514 -3.109 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.100 -10.601 -2.100 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.367 -11.497 -0.252 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.221 -12.636 -0.999 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.973 -12.868 -1.211 1.00 0.00 H new ATOM 468 N MET A 32 5.236 -11.136 -5.807 1.00 0.00 N ATOM 469 CA MET A 32 4.920 -10.704 -7.134 1.00 0.00 C ATOM 470 C MET A 32 4.241 -11.804 -7.875 1.00 0.00 C ATOM 471 O MET A 32 3.219 -11.638 -8.540 1.00 0.00 O ATOM 472 CB MET A 32 6.144 -10.354 -7.996 1.00 0.00 C ATOM 473 CG MET A 32 6.642 -8.974 -7.560 1.00 0.00 C ATOM 474 SD MET A 32 8.185 -8.595 -8.443 1.00 0.00 S ATOM 475 CE MET A 32 7.492 -8.174 -10.068 1.00 0.00 C ATOM 0 H MET A 32 6.243 -11.140 -5.644 1.00 0.00 H new ATOM 0 HA MET A 32 4.306 -9.815 -6.991 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.928 -11.101 -7.869 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.878 -10.348 -9.053 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.889 -8.216 -7.776 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.811 -8.958 -6.483 1.00 0.00 H new ATOM 0 HE1 MET A 32 7.920 -8.829 -10.827 1.00 0.00 H new ATOM 0 HE2 MET A 32 6.410 -8.302 -10.046 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.730 -7.138 -10.307 1.00 0.00 H new ATOM 485 N ARG A 33 4.754 -13.046 -7.810 1.00 0.00 N ATOM 486 CA ARG A 33 4.151 -14.192 -8.417 1.00 0.00 C ATOM 487 C ARG A 33 2.828 -14.551 -7.832 1.00 0.00 C ATOM 488 O ARG A 33 1.925 -14.734 -8.646 1.00 0.00 O ATOM 489 CB ARG A 33 5.138 -15.359 -8.244 1.00 0.00 C ATOM 490 CG ARG A 33 4.708 -16.677 -8.893 1.00 0.00 C ATOM 491 CD ARG A 33 5.536 -17.907 -8.519 1.00 0.00 C ATOM 492 NE ARG A 33 5.438 -18.089 -7.043 1.00 0.00 N ATOM 493 CZ ARG A 33 4.257 -18.318 -6.399 1.00 0.00 C ATOM 494 NH1 ARG A 33 3.133 -18.777 -7.024 1.00 0.00 N ATOM 495 NH2 ARG A 33 4.117 -18.055 -5.067 1.00 0.00 N ATOM 0 H ARG A 33 5.621 -13.260 -7.317 1.00 0.00 H new ATOM 0 HA ARG A 33 3.953 -13.968 -9.465 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.101 -15.064 -8.661 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.291 -15.530 -7.178 1.00 0.00 H new ATOM 0 HG2 ARG A 33 3.668 -16.868 -8.627 1.00 0.00 H new ATOM 0 HG3 ARG A 33 4.743 -16.555 -9.976 1.00 0.00 H new ATOM 0 HD2 ARG A 33 5.164 -18.790 -9.039 1.00 0.00 H new ATOM 0 HD3 ARG A 33 6.575 -17.774 -8.820 1.00 0.00 H new ATOM 0 HE ARG A 33 6.293 -18.040 -6.489 1.00 0.00 H new ATOM 0 HH11 ARG A 33 3.148 -18.968 -8.026 1.00 0.00 H new ATOM 0 HH12 ARG A 33 2.278 -18.929 -6.489 1.00 0.00 H new ATOM 0 HH21 ARG A 33 4.903 -17.681 -4.536 1.00 0.00 H new ATOM 0 HH22 ARG A 33 3.226 -18.233 -4.603 1.00 0.00 H new ATOM 509 N SER A 34 2.711 -14.721 -6.503 1.00 0.00 N ATOM 510 CA SER A 34 1.458 -15.000 -5.873 1.00 0.00 C ATOM 511 C SER A 34 0.310 -14.084 -6.124 1.00 0.00 C ATOM 512 O SER A 34 -0.850 -14.486 -6.045 1.00 0.00 O ATOM 513 CB SER A 34 1.644 -14.950 -4.347 1.00 0.00 C ATOM 514 OG SER A 34 2.326 -16.139 -3.978 1.00 0.00 O ATOM 0 H SER A 34 3.498 -14.664 -5.856 1.00 0.00 H new ATOM 0 HA SER A 34 1.199 -15.964 -6.311 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.217 -14.070 -4.056 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.680 -14.884 -3.842 1.00 0.00 H new ATOM 0 HG SER A 34 3.290 -15.967 -3.947 1.00 0.00 H new ATOM 520 N LEU A 35 0.516 -12.789 -6.423 1.00 0.00 N ATOM 521 CA LEU A 35 -0.390 -11.870 -7.039 1.00 0.00 C ATOM 522 C LEU A 35 -0.508 -12.063 -8.512 1.00 0.00 C ATOM 523 O LEU A 35 -1.524 -12.541 -9.015 1.00 0.00 O ATOM 524 CB LEU A 35 -0.054 -10.419 -6.657 1.00 0.00 C ATOM 525 CG LEU A 35 -0.135 -10.145 -5.146 1.00 0.00 C ATOM 526 CD1 LEU A 35 0.147 -8.647 -4.947 1.00 0.00 C ATOM 527 CD2 LEU A 35 -1.332 -10.647 -4.320 1.00 0.00 C ATOM 0 H LEU A 35 1.408 -12.343 -6.211 1.00 0.00 H new ATOM 0 HA LEU A 35 -1.381 -12.090 -6.642 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.951 -10.184 -7.007 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.738 -9.748 -7.177 1.00 0.00 H new ATOM 0 HG LEU A 35 0.618 -10.798 -4.706 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.100 -8.406 -3.885 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.140 -8.410 -5.329 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.598 -8.062 -5.485 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.204 -10.354 -3.278 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -2.252 -10.210 -4.709 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.390 -11.733 -4.387 1.00 0.00 H new ATOM 539 N GLY A 36 0.531 -11.735 -9.300 1.00 0.00 N ATOM 540 CA GLY A 36 0.363 -12.065 -10.682 1.00 0.00 C ATOM 541 C GLY A 36 1.459 -11.514 -11.528 1.00 0.00 C ATOM 542 O GLY A 36 1.153 -10.645 -12.342 1.00 0.00 O ATOM 0 H GLY A 36 1.404 -11.287 -9.022 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.329 -13.149 -10.794 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.594 -11.679 -11.033 1.00 0.00 H new ATOM 546 N GLN A 37 2.725 -11.953 -11.405 1.00 0.00 N ATOM 547 CA GLN A 37 3.705 -11.429 -12.305 1.00 0.00 C ATOM 548 C GLN A 37 4.945 -12.232 -12.113 1.00 0.00 C ATOM 549 O GLN A 37 5.319 -12.681 -11.031 1.00 0.00 O ATOM 550 CB GLN A 37 4.185 -10.002 -11.991 1.00 0.00 C ATOM 551 CG GLN A 37 5.234 -9.376 -12.913 1.00 0.00 C ATOM 552 CD GLN A 37 4.628 -8.741 -14.157 1.00 0.00 C ATOM 553 OE1 GLN A 37 3.466 -8.968 -14.489 1.00 0.00 O ATOM 554 NE2 GLN A 37 5.429 -7.897 -14.863 1.00 0.00 N ATOM 0 H GLN A 37 3.058 -12.633 -10.722 1.00 0.00 H new ATOM 0 HA GLN A 37 3.236 -11.452 -13.289 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.312 -9.350 -11.988 1.00 0.00 H new ATOM 0 HB3 GLN A 37 4.588 -10.001 -10.978 1.00 0.00 H new ATOM 0 HG2 GLN A 37 5.791 -8.620 -12.360 1.00 0.00 H new ATOM 0 HG3 GLN A 37 5.949 -10.142 -13.214 1.00 0.00 H new ATOM 0 HE21 GLN A 37 6.389 -7.731 -14.559 1.00 0.00 H new ATOM 0 HE22 GLN A 37 5.070 -7.430 -15.696 1.00 0.00 H new ATOM 563 N ASN A 38 5.556 -12.666 -13.229 1.00 0.00 N ATOM 564 CA ASN A 38 6.678 -13.544 -13.098 1.00 0.00 C ATOM 565 C ASN A 38 8.022 -12.950 -13.349 1.00 0.00 C ATOM 566 O ASN A 38 8.376 -12.806 -14.518 1.00 0.00 O ATOM 567 CB ASN A 38 6.438 -14.747 -14.024 1.00 0.00 C ATOM 568 CG ASN A 38 5.154 -15.520 -13.757 1.00 0.00 C ATOM 569 OD1 ASN A 38 4.203 -15.453 -14.535 1.00 0.00 O ATOM 570 ND2 ASN A 38 5.070 -16.236 -12.604 1.00 0.00 N ATOM 0 H ASN A 38 5.290 -12.423 -14.183 1.00 0.00 H new ATOM 0 HA ASN A 38 6.725 -13.824 -12.046 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.424 -14.395 -15.055 1.00 0.00 H new ATOM 0 HB3 ASN A 38 7.282 -15.431 -13.932 1.00 0.00 H new ATOM 0 HD21 ASN A 38 4.208 -16.729 -12.372 1.00 0.00 H new ATOM 0 HD22 ASN A 38 5.869 -16.280 -11.972 1.00 0.00 H new ATOM 577 N PRO A 39 8.854 -12.499 -12.459 1.00 0.00 N ATOM 578 CA PRO A 39 10.073 -11.785 -12.708 1.00 0.00 C ATOM 579 C PRO A 39 11.238 -12.690 -12.917 1.00 0.00 C ATOM 580 O PRO A 39 11.065 -13.894 -12.734 1.00 0.00 O ATOM 581 CB PRO A 39 10.336 -10.957 -11.452 1.00 0.00 C ATOM 582 CG PRO A 39 9.559 -11.602 -10.293 1.00 0.00 C ATOM 583 CD PRO A 39 8.534 -12.471 -11.040 1.00 0.00 C ATOM 0 HA PRO A 39 9.963 -11.189 -13.614 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.403 -10.930 -11.229 1.00 0.00 H new ATOM 0 HB3 PRO A 39 10.015 -9.926 -11.600 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.206 -12.197 -9.649 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.078 -10.857 -9.660 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.539 -13.484 -10.637 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.530 -12.074 -10.892 1.00 0.00 H new ATOM 591 N THR A 40 12.402 -12.192 -13.372 1.00 0.00 N ATOM 592 CA THR A 40 13.579 -13.003 -13.383 1.00 0.00 C ATOM 593 C THR A 40 14.298 -12.623 -12.134 1.00 0.00 C ATOM 594 O THR A 40 13.821 -11.866 -11.291 1.00 0.00 O ATOM 595 CB THR A 40 14.491 -12.599 -14.504 1.00 0.00 C ATOM 596 OG1 THR A 40 14.805 -11.214 -14.498 1.00 0.00 O ATOM 597 CG2 THR A 40 13.856 -12.872 -15.878 1.00 0.00 C ATOM 0 H THR A 40 12.528 -11.244 -13.727 1.00 0.00 H new ATOM 0 HA THR A 40 13.321 -14.058 -13.478 1.00 0.00 H new ATOM 0 HB THR A 40 15.390 -13.194 -14.344 1.00 0.00 H new ATOM 0 HG1 THR A 40 14.020 -10.699 -14.780 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.546 -12.567 -16.665 1.00 0.00 H new ATOM 0 HG22 THR A 40 13.643 -13.937 -15.975 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.929 -12.307 -15.969 1.00 0.00 H new ATOM 605 N GLU A 41 15.495 -13.190 -11.899 1.00 0.00 N ATOM 606 CA GLU A 41 16.228 -12.899 -10.705 1.00 0.00 C ATOM 607 C GLU A 41 16.930 -11.603 -10.927 1.00 0.00 C ATOM 608 O GLU A 41 17.114 -10.811 -10.004 1.00 0.00 O ATOM 609 CB GLU A 41 17.254 -14.005 -10.409 1.00 0.00 C ATOM 610 CG GLU A 41 16.595 -15.303 -9.936 1.00 0.00 C ATOM 611 CD GLU A 41 17.570 -16.430 -10.243 1.00 0.00 C ATOM 612 OE1 GLU A 41 17.705 -16.906 -11.402 1.00 0.00 O ATOM 613 OE2 GLU A 41 18.107 -16.923 -9.215 1.00 0.00 O ATOM 0 H GLU A 41 15.953 -13.846 -12.531 1.00 0.00 H new ATOM 0 HA GLU A 41 15.552 -12.841 -9.852 1.00 0.00 H new ATOM 0 HB2 GLU A 41 17.838 -14.204 -11.307 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.950 -13.656 -9.647 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.378 -15.260 -8.869 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.646 -15.463 -10.448 1.00 0.00 H new ATOM 620 N ALA A 42 17.360 -11.280 -12.160 1.00 0.00 N ATOM 621 CA ALA A 42 17.967 -10.021 -12.460 1.00 0.00 C ATOM 622 C ALA A 42 17.212 -8.775 -12.148 1.00 0.00 C ATOM 623 O ALA A 42 17.797 -7.888 -11.527 1.00 0.00 O ATOM 624 CB ALA A 42 18.474 -9.951 -13.910 1.00 0.00 C ATOM 0 H ALA A 42 17.285 -11.905 -12.963 1.00 0.00 H new ATOM 0 HA ALA A 42 18.789 -10.022 -11.744 1.00 0.00 H new ATOM 0 HB1 ALA A 42 18.927 -8.976 -14.090 1.00 0.00 H new ATOM 0 HB2 ALA A 42 19.217 -10.732 -14.074 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.638 -10.095 -14.595 1.00 0.00 H new ATOM 630 N GLU A 43 15.890 -8.806 -12.390 1.00 0.00 N ATOM 631 CA GLU A 43 15.020 -7.785 -11.892 1.00 0.00 C ATOM 632 C GLU A 43 14.853 -7.752 -10.412 1.00 0.00 C ATOM 633 O GLU A 43 14.760 -6.669 -9.838 1.00 0.00 O ATOM 634 CB GLU A 43 13.782 -7.728 -12.804 1.00 0.00 C ATOM 635 CG GLU A 43 12.994 -9.028 -12.978 1.00 0.00 C ATOM 636 CD GLU A 43 12.171 -9.104 -14.256 1.00 0.00 C ATOM 637 OE1 GLU A 43 11.284 -8.219 -14.387 1.00 0.00 O ATOM 638 OE2 GLU A 43 12.469 -9.972 -15.120 1.00 0.00 O ATOM 0 H GLU A 43 15.424 -9.536 -12.929 1.00 0.00 H new ATOM 0 HA GLU A 43 15.484 -6.802 -11.971 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.105 -6.970 -12.411 1.00 0.00 H new ATOM 0 HB3 GLU A 43 14.101 -7.390 -13.790 1.00 0.00 H new ATOM 0 HG2 GLU A 43 13.692 -9.865 -12.960 1.00 0.00 H new ATOM 0 HG3 GLU A 43 12.327 -9.150 -12.124 1.00 0.00 H new ATOM 645 N LEU A 44 14.826 -8.876 -9.673 1.00 0.00 N ATOM 646 CA LEU A 44 14.782 -8.838 -8.245 1.00 0.00 C ATOM 647 C LEU A 44 15.977 -8.231 -7.593 1.00 0.00 C ATOM 648 O LEU A 44 15.939 -7.505 -6.600 1.00 0.00 O ATOM 649 CB LEU A 44 14.435 -10.183 -7.585 1.00 0.00 C ATOM 650 CG LEU A 44 13.093 -10.778 -8.044 1.00 0.00 C ATOM 651 CD1 LEU A 44 12.903 -12.287 -7.817 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.931 -10.061 -7.337 1.00 0.00 C ATOM 0 H LEU A 44 14.835 -9.816 -10.068 1.00 0.00 H new ATOM 0 HA LEU A 44 13.948 -8.160 -8.063 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.230 -10.897 -7.800 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.411 -10.050 -6.503 1.00 0.00 H new ATOM 0 HG LEU A 44 13.101 -10.625 -9.123 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.921 -12.589 -8.180 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.674 -12.836 -8.357 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.979 -12.507 -6.752 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.984 -10.489 -7.668 1.00 0.00 H new ATOM 0 HD22 LEU A 44 12.028 -10.186 -6.259 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.955 -8.999 -7.583 1.00 0.00 H new ATOM 664 N GLN A 45 17.173 -8.480 -8.155 1.00 0.00 N ATOM 665 CA GLN A 45 18.432 -7.989 -7.686 1.00 0.00 C ATOM 666 C GLN A 45 18.544 -6.526 -7.941 1.00 0.00 C ATOM 667 O GLN A 45 19.050 -5.781 -7.103 1.00 0.00 O ATOM 668 CB GLN A 45 19.622 -8.593 -8.451 1.00 0.00 C ATOM 669 CG GLN A 45 19.751 -10.081 -8.121 1.00 0.00 C ATOM 670 CD GLN A 45 20.812 -10.782 -8.957 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.652 -11.621 -9.842 1.00 0.00 O ATOM 672 NE2 GLN A 45 22.076 -10.342 -8.715 1.00 0.00 N ATOM 0 H GLN A 45 17.266 -9.060 -8.989 1.00 0.00 H new ATOM 0 HA GLN A 45 18.465 -8.251 -6.628 1.00 0.00 H new ATOM 0 HB2 GLN A 45 19.481 -8.460 -9.524 1.00 0.00 H new ATOM 0 HB3 GLN A 45 20.541 -8.071 -8.183 1.00 0.00 H new ATOM 0 HG2 GLN A 45 19.994 -10.194 -7.065 1.00 0.00 H new ATOM 0 HG3 GLN A 45 18.789 -10.568 -8.280 1.00 0.00 H new ATOM 0 HE21 GLN A 45 22.243 -9.646 -7.988 1.00 0.00 H new ATOM 0 HE22 GLN A 45 22.856 -10.708 -9.261 1.00 0.00 H new ATOM 681 N ASP A 46 17.876 -5.986 -8.976 1.00 0.00 N ATOM 682 CA ASP A 46 17.809 -4.573 -9.186 1.00 0.00 C ATOM 683 C ASP A 46 16.896 -3.958 -8.182 1.00 0.00 C ATOM 684 O ASP A 46 17.216 -2.864 -7.720 1.00 0.00 O ATOM 685 CB ASP A 46 17.316 -4.421 -10.635 1.00 0.00 C ATOM 686 CG ASP A 46 17.472 -2.998 -11.152 1.00 0.00 C ATOM 687 OD1 ASP A 46 18.572 -2.657 -11.663 1.00 0.00 O ATOM 688 OD2 ASP A 46 16.477 -2.225 -11.163 1.00 0.00 O ATOM 0 H ASP A 46 17.377 -6.536 -9.675 1.00 0.00 H new ATOM 0 HA ASP A 46 18.762 -4.061 -9.056 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.872 -5.102 -11.279 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.267 -4.713 -10.692 1.00 0.00 H new ATOM 693 N MET A 47 15.812 -4.649 -7.786 1.00 0.00 N ATOM 694 CA MET A 47 14.828 -4.206 -6.848 1.00 0.00 C ATOM 695 C MET A 47 15.403 -4.109 -5.477 1.00 0.00 C ATOM 696 O MET A 47 15.070 -3.186 -4.735 1.00 0.00 O ATOM 697 CB MET A 47 13.666 -5.210 -6.940 1.00 0.00 C ATOM 698 CG MET A 47 12.516 -4.741 -6.047 1.00 0.00 C ATOM 699 SD MET A 47 11.209 -6.000 -5.932 1.00 0.00 S ATOM 700 CE MET A 47 10.652 -5.695 -7.634 1.00 0.00 C ATOM 0 H MET A 47 15.610 -5.581 -8.147 1.00 0.00 H new ATOM 0 HA MET A 47 14.471 -3.202 -7.077 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.327 -5.297 -7.972 1.00 0.00 H new ATOM 0 HB3 MET A 47 14.001 -6.200 -6.630 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.896 -4.516 -5.050 1.00 0.00 H new ATOM 0 HG3 MET A 47 12.098 -3.816 -6.445 1.00 0.00 H new ATOM 0 HE1 MET A 47 9.562 -5.692 -7.665 1.00 0.00 H new ATOM 0 HE2 MET A 47 11.027 -4.729 -7.972 1.00 0.00 H new ATOM 0 HE3 MET A 47 11.031 -6.481 -8.287 1.00 0.00 H new ATOM 710 N ILE A 48 16.335 -5.030 -5.173 1.00 0.00 N ATOM 711 CA ILE A 48 17.089 -4.922 -3.963 1.00 0.00 C ATOM 712 C ILE A 48 17.901 -3.673 -3.986 1.00 0.00 C ATOM 713 O ILE A 48 17.895 -2.888 -3.039 1.00 0.00 O ATOM 714 CB ILE A 48 17.929 -6.148 -3.752 1.00 0.00 C ATOM 715 CG1 ILE A 48 17.068 -7.360 -3.358 1.00 0.00 C ATOM 716 CG2 ILE A 48 19.006 -5.878 -2.688 1.00 0.00 C ATOM 717 CD1 ILE A 48 16.039 -7.243 -2.234 1.00 0.00 C ATOM 0 H ILE A 48 16.564 -5.837 -5.754 1.00 0.00 H new ATOM 0 HA ILE A 48 16.409 -4.858 -3.113 1.00 0.00 H new ATOM 0 HB ILE A 48 18.419 -6.387 -4.696 1.00 0.00 H new ATOM 0 HG12 ILE A 48 16.534 -7.680 -4.252 1.00 0.00 H new ATOM 0 HG13 ILE A 48 17.750 -8.166 -3.088 1.00 0.00 H new ATOM 0 HG21 ILE A 48 19.608 -6.775 -2.544 1.00 0.00 H new ATOM 0 HG22 ILE A 48 19.646 -5.060 -3.018 1.00 0.00 H new ATOM 0 HG23 ILE A 48 18.528 -5.608 -1.747 1.00 0.00 H new ATOM 0 HD11 ILE A 48 15.532 -8.199 -2.104 1.00 0.00 H new ATOM 0 HD12 ILE A 48 16.543 -6.970 -1.307 1.00 0.00 H new ATOM 0 HD13 ILE A 48 15.307 -6.476 -2.489 1.00 0.00 H new ATOM 729 N ASN A 49 18.641 -3.388 -5.073 1.00 0.00 N ATOM 730 CA ASN A 49 19.665 -2.390 -5.111 1.00 0.00 C ATOM 731 C ASN A 49 19.280 -0.954 -5.007 1.00 0.00 C ATOM 732 O ASN A 49 19.893 -0.067 -4.416 1.00 0.00 O ATOM 733 CB ASN A 49 20.549 -2.451 -6.368 1.00 0.00 C ATOM 734 CG ASN A 49 21.524 -3.618 -6.319 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.661 -4.375 -5.359 1.00 0.00 O ATOM 736 ND2 ASN A 49 22.252 -3.850 -7.444 1.00 0.00 N ATOM 0 H ASN A 49 18.521 -3.873 -5.962 1.00 0.00 H new ATOM 0 HA ASN A 49 20.174 -2.678 -4.192 1.00 0.00 H new ATOM 0 HB2 ASN A 49 19.918 -2.542 -7.252 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.104 -1.518 -6.467 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.897 -4.640 -7.481 1.00 0.00 H new ATOM 0 HD22 ASN A 49 22.153 -3.234 -8.251 1.00 0.00 H new ATOM 743 N GLU A 50 18.033 -0.731 -5.458 1.00 0.00 N ATOM 744 CA GLU A 50 17.148 0.369 -5.228 1.00 0.00 C ATOM 745 C GLU A 50 17.004 0.667 -3.775 1.00 0.00 C ATOM 746 O GLU A 50 17.136 1.826 -3.385 1.00 0.00 O ATOM 747 CB GLU A 50 15.852 0.084 -6.005 1.00 0.00 C ATOM 748 CG GLU A 50 14.661 1.029 -5.832 1.00 0.00 C ATOM 749 CD GLU A 50 14.987 2.414 -6.374 1.00 0.00 C ATOM 750 OE1 GLU A 50 15.747 2.663 -7.347 1.00 0.00 O ATOM 751 OE2 GLU A 50 14.323 3.345 -5.845 1.00 0.00 O ATOM 0 H GLU A 50 17.590 -1.419 -6.067 1.00 0.00 H new ATOM 0 HA GLU A 50 17.547 1.308 -5.612 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.102 0.061 -7.066 1.00 0.00 H new ATOM 0 HB3 GLU A 50 15.519 -0.918 -5.734 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.792 0.625 -6.352 1.00 0.00 H new ATOM 0 HG3 GLU A 50 14.397 1.099 -4.777 1.00 0.00 H new ATOM 758 N VAL A 51 16.525 -0.233 -2.897 1.00 0.00 N ATOM 759 CA VAL A 51 16.167 -0.064 -1.523 1.00 0.00 C ATOM 760 C VAL A 51 17.332 -0.295 -0.623 1.00 0.00 C ATOM 761 O VAL A 51 17.442 0.380 0.399 1.00 0.00 O ATOM 762 CB VAL A 51 15.010 -0.829 -0.952 1.00 0.00 C ATOM 763 CG1 VAL A 51 13.758 -0.254 -1.636 1.00 0.00 C ATOM 764 CG2 VAL A 51 15.292 -2.314 -1.235 1.00 0.00 C ATOM 0 H VAL A 51 16.371 -1.197 -3.192 1.00 0.00 H new ATOM 0 HA VAL A 51 15.823 0.970 -1.554 1.00 0.00 H new ATOM 0 HB VAL A 51 14.860 -0.742 0.124 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.872 -0.769 -1.265 1.00 0.00 H new ATOM 0 HG12 VAL A 51 13.679 0.810 -1.415 1.00 0.00 H new ATOM 0 HG13 VAL A 51 13.835 -0.396 -2.714 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.478 -2.921 -0.839 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.371 -2.471 -2.311 1.00 0.00 H new ATOM 0 HG23 VAL A 51 16.227 -2.604 -0.756 1.00 0.00 H new ATOM 774 N ASP A 52 18.273 -1.198 -0.951 1.00 0.00 N ATOM 775 CA ASP A 52 19.420 -1.592 -0.193 1.00 0.00 C ATOM 776 C ASP A 52 20.528 -0.603 -0.312 1.00 0.00 C ATOM 777 O ASP A 52 21.137 -0.444 -1.369 1.00 0.00 O ATOM 778 CB ASP A 52 19.806 -2.993 -0.697 1.00 0.00 C ATOM 779 CG ASP A 52 21.038 -3.611 -0.052 1.00 0.00 C ATOM 780 OD1 ASP A 52 21.381 -3.413 1.144 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.666 -4.394 -0.814 1.00 0.00 O ATOM 0 H ASP A 52 18.223 -1.701 -1.837 1.00 0.00 H new ATOM 0 HA ASP A 52 19.201 -1.624 0.874 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.961 -3.662 -0.537 1.00 0.00 H new ATOM 0 HB3 ASP A 52 19.970 -2.939 -1.773 1.00 0.00 H new ATOM 786 N ALA A 53 20.788 0.112 0.797 1.00 0.00 N ATOM 787 CA ALA A 53 21.815 1.085 1.006 1.00 0.00 C ATOM 788 C ALA A 53 23.111 0.380 1.218 1.00 0.00 C ATOM 789 O ALA A 53 24.074 0.694 0.520 1.00 0.00 O ATOM 790 CB ALA A 53 21.411 2.022 2.156 1.00 0.00 C ATOM 0 H ALA A 53 20.217 -0.006 1.634 1.00 0.00 H new ATOM 0 HA ALA A 53 21.946 1.724 0.132 1.00 0.00 H new ATOM 0 HB1 ALA A 53 22.195 2.763 2.314 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.479 2.528 1.903 1.00 0.00 H new ATOM 0 HB3 ALA A 53 21.272 1.441 3.067 1.00 0.00 H new ATOM 796 N ASP A 54 23.206 -0.487 2.241 1.00 0.00 N ATOM 797 CA ASP A 54 24.431 -1.066 2.699 1.00 0.00 C ATOM 798 C ASP A 54 25.049 -2.081 1.801 1.00 0.00 C ATOM 799 O ASP A 54 26.264 -2.054 1.612 1.00 0.00 O ATOM 800 CB ASP A 54 24.130 -1.586 4.115 1.00 0.00 C ATOM 801 CG ASP A 54 22.879 -2.453 4.158 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.882 -3.571 3.577 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.838 -1.995 4.699 1.00 0.00 O ATOM 0 H ASP A 54 22.393 -0.798 2.773 1.00 0.00 H new ATOM 0 HA ASP A 54 25.216 -0.309 2.702 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.982 -2.162 4.477 1.00 0.00 H new ATOM 0 HB3 ASP A 54 24.007 -0.740 4.792 1.00 0.00 H new ATOM 808 N GLY A 55 24.272 -3.013 1.220 1.00 0.00 N ATOM 809 CA GLY A 55 24.855 -3.895 0.257 1.00 0.00 C ATOM 810 C GLY A 55 24.857 -5.316 0.704 1.00 0.00 C ATOM 811 O GLY A 55 25.549 -6.138 0.104 1.00 0.00 O ATOM 0 H GLY A 55 23.279 -3.154 1.406 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.307 -3.815 -0.682 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.879 -3.581 0.056 1.00 0.00 H new ATOM 815 N ASN A 56 24.156 -5.592 1.818 1.00 0.00 N ATOM 816 CA ASN A 56 23.888 -6.914 2.293 1.00 0.00 C ATOM 817 C ASN A 56 22.943 -7.726 1.476 1.00 0.00 C ATOM 818 O ASN A 56 22.803 -8.922 1.723 1.00 0.00 O ATOM 819 CB ASN A 56 23.515 -7.069 3.777 1.00 0.00 C ATOM 820 CG ASN A 56 22.135 -6.474 4.014 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.441 -6.092 3.073 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.686 -6.456 5.298 1.00 0.00 N ATOM 0 H ASN A 56 23.760 -4.864 2.412 1.00 0.00 H new ATOM 0 HA ASN A 56 24.892 -7.320 2.170 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.522 -8.122 4.057 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.252 -6.567 4.403 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.746 -6.118 5.505 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.289 -6.781 6.054 1.00 0.00 H new ATOM 829 N GLY A 57 22.360 -7.212 0.378 1.00 0.00 N ATOM 830 CA GLY A 57 21.484 -7.925 -0.499 1.00 0.00 C ATOM 831 C GLY A 57 20.074 -8.039 -0.033 1.00 0.00 C ATOM 832 O GLY A 57 19.298 -8.814 -0.589 1.00 0.00 O ATOM 0 H GLY A 57 22.508 -6.246 0.087 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.490 -7.432 -1.471 1.00 0.00 H new ATOM 0 HA3 GLY A 57 21.883 -8.928 -0.648 1.00 0.00 H new ATOM 836 N THR A 58 19.693 -7.432 1.105 1.00 0.00 N ATOM 837 CA THR A 58 18.360 -7.524 1.615 1.00 0.00 C ATOM 838 C THR A 58 17.803 -6.171 1.898 1.00 0.00 C ATOM 839 O THR A 58 18.477 -5.257 2.371 1.00 0.00 O ATOM 840 CB THR A 58 18.192 -8.278 2.901 1.00 0.00 C ATOM 841 OG1 THR A 58 19.077 -7.969 3.968 1.00 0.00 O ATOM 842 CG2 THR A 58 18.559 -9.754 2.675 1.00 0.00 C ATOM 0 H THR A 58 20.320 -6.869 1.680 1.00 0.00 H new ATOM 0 HA THR A 58 17.846 -8.065 0.820 1.00 0.00 H new ATOM 0 HB THR A 58 17.166 -8.025 3.168 1.00 0.00 H new ATOM 0 HG1 THR A 58 18.680 -7.272 4.531 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.438 -10.306 3.607 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.904 -10.179 1.914 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.595 -9.825 2.343 1.00 0.00 H new ATOM 850 N ILE A 59 16.464 -6.056 1.855 1.00 0.00 N ATOM 851 CA ILE A 59 15.845 -4.920 2.465 1.00 0.00 C ATOM 852 C ILE A 59 15.615 -5.361 3.870 1.00 0.00 C ATOM 853 O ILE A 59 14.868 -6.270 4.226 1.00 0.00 O ATOM 854 CB ILE A 59 14.689 -4.434 1.642 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.609 -3.681 2.437 1.00 0.00 C ATOM 856 CG2 ILE A 59 14.195 -5.473 0.622 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.714 -2.792 1.574 1.00 0.00 C ATOM 0 H ILE A 59 15.829 -6.722 1.415 1.00 0.00 H new ATOM 0 HA ILE A 59 16.434 -4.004 2.504 1.00 0.00 H new ATOM 0 HB ILE A 59 15.084 -3.636 1.013 1.00 0.00 H new ATOM 0 HG12 ILE A 59 12.987 -4.405 2.963 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.093 -3.066 3.196 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.358 -5.060 0.059 1.00 0.00 H new ATOM 0 HG22 ILE A 59 15.005 -5.724 -0.063 1.00 0.00 H new ATOM 0 HG23 ILE A 59 13.871 -6.372 1.146 1.00 0.00 H new ATOM 0 HD11 ILE A 59 11.978 -2.294 2.205 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.324 -2.043 1.068 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.201 -3.403 0.832 1.00 0.00 H new ATOM 869 N ASP A 60 16.445 -4.672 4.673 1.00 0.00 N ATOM 870 CA ASP A 60 16.405 -4.703 6.102 1.00 0.00 C ATOM 871 C ASP A 60 15.250 -3.925 6.632 1.00 0.00 C ATOM 872 O ASP A 60 14.462 -3.292 5.931 1.00 0.00 O ATOM 873 CB ASP A 60 17.720 -4.149 6.676 1.00 0.00 C ATOM 874 CG ASP A 60 18.895 -4.910 6.079 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.900 -6.161 6.224 1.00 0.00 O ATOM 876 OD2 ASP A 60 19.787 -4.314 5.418 1.00 0.00 O ATOM 0 H ASP A 60 17.179 -4.065 4.308 1.00 0.00 H new ATOM 0 HA ASP A 60 16.281 -5.741 6.412 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.809 -3.086 6.450 1.00 0.00 H new ATOM 0 HB3 ASP A 60 17.724 -4.245 7.762 1.00 0.00 H new ATOM 881 N PHE A 61 15.107 -3.836 7.966 1.00 0.00 N ATOM 882 CA PHE A 61 14.026 -3.131 8.583 1.00 0.00 C ATOM 883 C PHE A 61 14.004 -1.671 8.290 1.00 0.00 C ATOM 884 O PHE A 61 12.974 -1.235 7.778 1.00 0.00 O ATOM 885 CB PHE A 61 13.939 -3.400 10.095 1.00 0.00 C ATOM 886 CG PHE A 61 12.521 -3.266 10.533 1.00 0.00 C ATOM 887 CD1 PHE A 61 11.574 -4.091 9.973 1.00 0.00 C ATOM 888 CD2 PHE A 61 12.223 -2.343 11.507 1.00 0.00 C ATOM 889 CE1 PHE A 61 10.244 -3.936 10.283 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.907 -2.314 11.904 1.00 0.00 C ATOM 891 CZ PHE A 61 9.921 -2.958 11.194 1.00 0.00 C ATOM 0 H PHE A 61 15.754 -4.262 8.629 1.00 0.00 H new ATOM 0 HA PHE A 61 13.129 -3.541 8.118 1.00 0.00 H new ATOM 0 HB2 PHE A 61 14.310 -4.400 10.321 1.00 0.00 H new ATOM 0 HB3 PHE A 61 14.569 -2.696 10.639 1.00 0.00 H new ATOM 0 HD1 PHE A 61 11.877 -4.866 9.285 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.969 -1.687 11.930 1.00 0.00 H new ATOM 0 HE1 PHE A 61 9.485 -4.556 9.830 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.640 -1.770 12.798 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.886 -2.694 11.353 1.00 0.00 H new ATOM 901 N PRO A 62 14.949 -0.867 8.678 1.00 0.00 N ATOM 902 CA PRO A 62 14.844 0.539 8.416 1.00 0.00 C ATOM 903 C PRO A 62 14.889 0.934 6.980 1.00 0.00 C ATOM 904 O PRO A 62 14.790 2.122 6.677 1.00 0.00 O ATOM 905 CB PRO A 62 15.934 1.136 9.303 1.00 0.00 C ATOM 906 CG PRO A 62 17.020 0.062 9.471 1.00 0.00 C ATOM 907 CD PRO A 62 16.291 -1.239 9.101 1.00 0.00 C ATOM 0 HA PRO A 62 13.856 0.931 8.658 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.349 2.036 8.849 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.526 1.426 10.271 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.872 0.246 8.817 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.402 0.033 10.491 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.816 -1.762 8.302 1.00 0.00 H new ATOM 0 HD3 PRO A 62 16.253 -1.916 9.954 1.00 0.00 H new ATOM 915 N GLU A 63 15.022 -0.039 6.060 1.00 0.00 N ATOM 916 CA GLU A 63 15.071 0.155 4.644 1.00 0.00 C ATOM 917 C GLU A 63 13.669 0.126 4.141 1.00 0.00 C ATOM 918 O GLU A 63 13.334 1.090 3.455 1.00 0.00 O ATOM 919 CB GLU A 63 16.041 -0.758 3.875 1.00 0.00 C ATOM 920 CG GLU A 63 17.497 -0.673 4.337 1.00 0.00 C ATOM 921 CD GLU A 63 18.411 -1.619 3.571 1.00 0.00 C ATOM 922 OE1 GLU A 63 18.193 -2.857 3.657 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.513 -1.187 3.141 1.00 0.00 O ATOM 0 H GLU A 63 15.100 -1.022 6.322 1.00 0.00 H new ATOM 0 HA GLU A 63 15.519 1.129 4.446 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.702 -1.790 3.972 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.994 -0.505 2.816 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.854 0.350 4.214 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.551 -0.904 5.401 1.00 0.00 H new ATOM 930 N PHE A 64 12.782 -0.806 4.533 1.00 0.00 N ATOM 931 CA PHE A 64 11.360 -0.695 4.439 1.00 0.00 C ATOM 932 C PHE A 64 10.815 0.554 5.042 1.00 0.00 C ATOM 933 O PHE A 64 10.032 1.227 4.374 1.00 0.00 O ATOM 934 CB PHE A 64 10.694 -1.917 5.093 1.00 0.00 C ATOM 935 CG PHE A 64 9.312 -2.213 4.622 1.00 0.00 C ATOM 936 CD1 PHE A 64 9.261 -2.742 3.353 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.235 -1.877 5.407 1.00 0.00 C ATOM 938 CE1 PHE A 64 8.011 -3.024 2.857 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.015 -2.186 4.852 1.00 0.00 C ATOM 940 CZ PHE A 64 6.888 -2.711 3.587 1.00 0.00 C ATOM 0 H PHE A 64 13.078 -1.693 4.941 1.00 0.00 H new ATOM 0 HA PHE A 64 11.127 -0.654 3.375 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.318 -2.792 4.911 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.668 -1.763 6.172 1.00 0.00 H new ATOM 0 HD1 PHE A 64 10.156 -2.926 2.777 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.338 -1.411 6.376 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.910 -3.493 1.890 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.121 -2.009 5.432 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.907 -2.877 3.167 1.00 0.00 H new ATOM 950 N LEU A 65 11.311 0.982 6.217 1.00 0.00 N ATOM 951 CA LEU A 65 10.836 2.201 6.794 1.00 0.00 C ATOM 952 C LEU A 65 11.192 3.438 6.045 1.00 0.00 C ATOM 953 O LEU A 65 10.355 4.323 5.874 1.00 0.00 O ATOM 954 CB LEU A 65 11.491 2.395 8.172 1.00 0.00 C ATOM 955 CG LEU A 65 11.212 1.302 9.217 1.00 0.00 C ATOM 956 CD1 LEU A 65 11.750 1.716 10.597 1.00 0.00 C ATOM 957 CD2 LEU A 65 9.704 1.037 9.356 1.00 0.00 C ATOM 0 H LEU A 65 12.026 0.496 6.758 1.00 0.00 H new ATOM 0 HA LEU A 65 9.752 2.088 6.805 1.00 0.00 H new ATOM 0 HB2 LEU A 65 12.569 2.467 8.031 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.158 3.350 8.578 1.00 0.00 H new ATOM 0 HG LEU A 65 11.715 0.399 8.872 1.00 0.00 H new ATOM 0 HD11 LEU A 65 11.541 0.928 11.320 1.00 0.00 H new ATOM 0 HD12 LEU A 65 12.826 1.876 10.535 1.00 0.00 H new ATOM 0 HD13 LEU A 65 11.264 2.638 10.915 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.538 0.260 10.102 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.201 1.952 9.668 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.302 0.711 8.397 1.00 0.00 H new ATOM 969 N THR A 66 12.404 3.518 5.467 1.00 0.00 N ATOM 970 CA THR A 66 12.815 4.536 4.551 1.00 0.00 C ATOM 971 C THR A 66 11.946 4.666 3.348 1.00 0.00 C ATOM 972 O THR A 66 11.421 5.733 3.032 1.00 0.00 O ATOM 973 CB THR A 66 14.262 4.324 4.216 1.00 0.00 C ATOM 974 OG1 THR A 66 15.128 4.389 5.339 1.00 0.00 O ATOM 975 CG2 THR A 66 14.903 5.387 3.308 1.00 0.00 C ATOM 0 H THR A 66 13.138 2.833 5.650 1.00 0.00 H new ATOM 0 HA THR A 66 12.697 5.502 5.043 1.00 0.00 H new ATOM 0 HB THR A 66 14.192 3.344 3.743 1.00 0.00 H new ATOM 0 HG1 THR A 66 15.159 3.514 5.779 1.00 0.00 H new ATOM 0 HG21 THR A 66 15.948 5.133 3.132 1.00 0.00 H new ATOM 0 HG22 THR A 66 14.373 5.420 2.356 1.00 0.00 H new ATOM 0 HG23 THR A 66 14.843 6.362 3.791 1.00 0.00 H new ATOM 983 N MET A 67 11.528 3.549 2.725 1.00 0.00 N ATOM 984 CA MET A 67 10.731 3.657 1.543 1.00 0.00 C ATOM 985 C MET A 67 9.325 4.115 1.728 1.00 0.00 C ATOM 986 O MET A 67 8.768 5.055 1.164 1.00 0.00 O ATOM 987 CB MET A 67 10.677 2.179 1.119 1.00 0.00 C ATOM 988 CG MET A 67 9.613 1.767 0.100 1.00 0.00 C ATOM 989 SD MET A 67 10.013 0.182 -0.696 1.00 0.00 S ATOM 990 CE MET A 67 9.552 -0.983 0.618 1.00 0.00 C ATOM 0 H MET A 67 11.734 2.597 3.028 1.00 0.00 H new ATOM 0 HA MET A 67 11.156 4.393 0.861 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.652 1.912 0.712 1.00 0.00 H new ATOM 0 HB3 MET A 67 10.531 1.578 2.017 1.00 0.00 H new ATOM 0 HG2 MET A 67 8.646 1.690 0.596 1.00 0.00 H new ATOM 0 HG3 MET A 67 9.520 2.542 -0.661 1.00 0.00 H new ATOM 0 HE1 MET A 67 10.214 -1.849 0.585 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.643 -0.493 1.587 1.00 0.00 H new ATOM 0 HE3 MET A 67 8.522 -1.308 0.471 1.00 0.00 H new ATOM 1000 N MET A 68 8.592 3.444 2.633 1.00 0.00 N ATOM 1001 CA MET A 68 7.179 3.504 2.847 1.00 0.00 C ATOM 1002 C MET A 68 6.684 4.718 3.555 1.00 0.00 C ATOM 1003 O MET A 68 5.580 5.182 3.276 1.00 0.00 O ATOM 1004 CB MET A 68 6.821 2.327 3.771 1.00 0.00 C ATOM 1005 CG MET A 68 6.967 0.949 3.123 1.00 0.00 C ATOM 1006 SD MET A 68 6.206 0.657 1.498 1.00 0.00 S ATOM 1007 CE MET A 68 4.561 1.265 1.968 1.00 0.00 C ATOM 0 H MET A 68 9.037 2.793 3.280 1.00 0.00 H new ATOM 0 HA MET A 68 6.726 3.496 1.856 1.00 0.00 H new ATOM 0 HB2 MET A 68 7.457 2.369 4.655 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.793 2.448 4.112 1.00 0.00 H new ATOM 0 HG2 MET A 68 8.033 0.740 3.030 1.00 0.00 H new ATOM 0 HG3 MET A 68 6.557 0.214 3.816 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.801 0.754 1.376 1.00 0.00 H new ATOM 0 HE2 MET A 68 4.389 1.069 3.026 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.503 2.338 1.784 1.00 0.00 H new ATOM 1017 N ALA A 69 7.470 5.295 4.482 1.00 0.00 N ATOM 1018 CA ALA A 69 7.050 6.472 5.177 1.00 0.00 C ATOM 1019 C ALA A 69 7.239 7.713 4.373 1.00 0.00 C ATOM 1020 O ALA A 69 7.004 8.826 4.840 1.00 0.00 O ATOM 1021 CB ALA A 69 7.776 6.582 6.528 1.00 0.00 C ATOM 0 H ALA A 69 8.391 4.949 4.749 1.00 0.00 H new ATOM 0 HA ALA A 69 5.979 6.375 5.353 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.446 7.483 7.046 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.545 5.708 7.137 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.852 6.633 6.360 1.00 0.00 H new ATOM 1027 N ARG A 70 7.719 7.635 3.119 1.00 0.00 N ATOM 1028 CA ARG A 70 7.824 8.726 2.200 1.00 0.00 C ATOM 1029 C ARG A 70 6.472 9.101 1.697 1.00 0.00 C ATOM 1030 O ARG A 70 5.692 8.285 1.208 1.00 0.00 O ATOM 1031 CB ARG A 70 8.697 8.305 1.006 1.00 0.00 C ATOM 1032 CG ARG A 70 8.803 9.475 0.026 1.00 0.00 C ATOM 1033 CD ARG A 70 9.807 9.281 -1.113 1.00 0.00 C ATOM 1034 NE ARG A 70 9.570 10.219 -2.246 1.00 0.00 N ATOM 1035 CZ ARG A 70 10.248 10.137 -3.428 1.00 0.00 C ATOM 1036 NH1 ARG A 70 11.053 9.056 -3.638 1.00 0.00 N ATOM 1037 NH2 ARG A 70 10.184 11.125 -4.368 1.00 0.00 N ATOM 0 H ARG A 70 8.054 6.757 2.723 1.00 0.00 H new ATOM 0 HA ARG A 70 8.272 9.578 2.712 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.689 8.012 1.350 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.262 7.437 0.510 1.00 0.00 H new ATOM 0 HG2 ARG A 70 7.819 9.657 -0.406 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.078 10.371 0.583 1.00 0.00 H new ATOM 0 HD2 ARG A 70 10.818 9.425 -0.731 1.00 0.00 H new ATOM 0 HD3 ARG A 70 9.747 8.255 -1.476 1.00 0.00 H new ATOM 0 HE ARG A 70 8.871 10.954 -2.134 1.00 0.00 H new ATOM 0 HH11 ARG A 70 11.136 8.335 -2.921 1.00 0.00 H new ATOM 0 HH12 ARG A 70 11.572 8.968 -4.512 1.00 0.00 H new ATOM 0 HH21 ARG A 70 9.617 11.956 -4.197 1.00 0.00 H new ATOM 0 HH22 ARG A 70 10.703 11.033 -5.241 1.00 0.00 H new ATOM 1051 N LYS A 71 6.071 10.350 1.990 1.00 0.00 N ATOM 1052 CA LYS A 71 4.781 10.854 1.635 1.00 0.00 C ATOM 1053 C LYS A 71 4.933 11.298 0.221 1.00 0.00 C ATOM 1054 O LYS A 71 5.664 12.252 -0.040 1.00 0.00 O ATOM 1055 CB LYS A 71 4.507 12.109 2.482 1.00 0.00 C ATOM 1056 CG LYS A 71 3.032 12.506 2.566 1.00 0.00 C ATOM 1057 CD LYS A 71 2.113 11.774 3.546 1.00 0.00 C ATOM 1058 CE LYS A 71 0.696 12.352 3.545 1.00 0.00 C ATOM 1059 NZ LYS A 71 0.135 12.492 2.183 1.00 0.00 N ATOM 0 H LYS A 71 6.655 11.025 2.484 1.00 0.00 H new ATOM 0 HA LYS A 71 3.986 10.122 1.780 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.883 11.941 3.491 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.072 12.943 2.066 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.992 13.567 2.810 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.605 12.392 1.570 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.073 10.717 3.285 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.530 11.838 4.551 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.045 11.708 4.137 1.00 0.00 H new ATOM 0 HE3 LYS A 71 0.706 13.328 4.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -0.873 12.741 2.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 0.645 13.241 1.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.237 11.592 1.671 1.00 0.00 H new ATOM 1073 N MET A 72 4.352 10.604 -0.774 1.00 0.00 N ATOM 1074 CA MET A 72 4.523 10.804 -2.179 1.00 0.00 C ATOM 1075 C MET A 72 3.861 12.078 -2.581 1.00 0.00 C ATOM 1076 O MET A 72 3.065 12.628 -1.823 1.00 0.00 O ATOM 1077 CB MET A 72 3.913 9.661 -3.008 1.00 0.00 C ATOM 1078 CG MET A 72 4.681 8.337 -3.021 1.00 0.00 C ATOM 1079 SD MET A 72 3.447 7.034 -3.310 1.00 0.00 S ATOM 1080 CE MET A 72 4.713 5.946 -4.024 1.00 0.00 C ATOM 0 H MET A 72 3.708 9.838 -0.576 1.00 0.00 H new ATOM 0 HA MET A 72 5.595 10.836 -2.374 1.00 0.00 H new ATOM 0 HB2 MET A 72 2.908 9.468 -2.634 1.00 0.00 H new ATOM 0 HB3 MET A 72 3.809 10.005 -4.037 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.439 8.335 -3.804 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.199 8.179 -2.075 1.00 0.00 H new ATOM 0 HE1 MET A 72 4.231 5.109 -4.529 1.00 0.00 H new ATOM 0 HE2 MET A 72 5.311 6.507 -4.742 1.00 0.00 H new ATOM 0 HE3 MET A 72 5.358 5.569 -3.230 1.00 0.00 H new ATOM 1090 N LYS A 73 4.170 12.554 -3.801 1.00 0.00 N ATOM 1091 CA LYS A 73 3.333 13.501 -4.470 1.00 0.00 C ATOM 1092 C LYS A 73 2.170 12.799 -5.082 1.00 0.00 C ATOM 1093 O LYS A 73 2.106 11.571 -5.098 1.00 0.00 O ATOM 1094 CB LYS A 73 4.082 14.260 -5.579 1.00 0.00 C ATOM 1095 CG LYS A 73 4.299 13.527 -6.904 1.00 0.00 C ATOM 1096 CD LYS A 73 5.126 14.287 -7.942 1.00 0.00 C ATOM 1097 CE LYS A 73 5.334 13.648 -9.317 1.00 0.00 C ATOM 1098 NZ LYS A 73 6.268 12.517 -9.112 1.00 0.00 N ATOM 0 H LYS A 73 5.002 12.282 -4.325 1.00 0.00 H new ATOM 0 HA LYS A 73 3.004 14.222 -3.722 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.535 15.180 -5.787 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.058 14.550 -5.190 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.790 12.576 -6.698 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.326 13.297 -7.337 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.655 15.258 -8.095 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.109 14.474 -7.511 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.388 13.301 -9.732 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.746 14.369 -10.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.866 12.403 -9.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.869 12.708 -8.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 5.726 11.644 -8.951 1.00 0.00 H new ATOM 1112 N ASP A 74 1.245 13.553 -5.701 1.00 0.00 N ATOM 1113 CA ASP A 74 -0.115 13.223 -5.996 1.00 0.00 C ATOM 1114 C ASP A 74 -0.360 12.075 -6.914 1.00 0.00 C ATOM 1115 O ASP A 74 -1.220 11.255 -6.598 1.00 0.00 O ATOM 1116 CB ASP A 74 -0.726 14.511 -6.573 1.00 0.00 C ATOM 1117 CG ASP A 74 -0.641 15.665 -5.584 1.00 0.00 C ATOM 1118 OD1 ASP A 74 0.503 16.191 -5.539 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -1.633 16.099 -4.940 1.00 0.00 O ATOM 0 H ASP A 74 1.476 14.491 -6.028 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.573 12.872 -5.071 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.206 14.780 -7.492 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.769 14.333 -6.836 1.00 0.00 H new ATOM 1124 N THR A 75 0.289 12.080 -8.092 1.00 0.00 N ATOM 1125 CA THR A 75 0.091 11.117 -9.130 1.00 0.00 C ATOM 1126 C THR A 75 0.615 9.790 -8.701 1.00 0.00 C ATOM 1127 O THR A 75 0.058 8.738 -9.010 1.00 0.00 O ATOM 1128 CB THR A 75 0.752 11.395 -10.447 1.00 0.00 C ATOM 1129 OG1 THR A 75 2.108 11.793 -10.304 1.00 0.00 O ATOM 1130 CG2 THR A 75 -0.120 12.481 -11.098 1.00 0.00 C ATOM 0 H THR A 75 0.983 12.788 -8.331 1.00 0.00 H new ATOM 0 HA THR A 75 -0.987 11.154 -9.287 1.00 0.00 H new ATOM 0 HB THR A 75 0.812 10.501 -11.067 1.00 0.00 H new ATOM 0 HG1 THR A 75 2.495 11.961 -11.189 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.294 12.745 -12.071 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.135 12.105 -11.226 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.138 13.364 -10.459 1.00 0.00 H new ATOM 1138 N ASP A 76 1.717 9.776 -7.930 1.00 0.00 N ATOM 1139 CA ASP A 76 2.329 8.654 -7.289 1.00 0.00 C ATOM 1140 C ASP A 76 1.465 8.114 -6.202 1.00 0.00 C ATOM 1141 O ASP A 76 1.196 6.924 -6.044 1.00 0.00 O ATOM 1142 CB ASP A 76 3.752 8.932 -6.774 1.00 0.00 C ATOM 1143 CG ASP A 76 4.702 9.258 -7.917 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.867 8.398 -8.822 1.00 0.00 O ATOM 1145 OD2 ASP A 76 5.194 10.413 -8.027 1.00 0.00 O ATOM 0 H ASP A 76 2.228 10.638 -7.738 1.00 0.00 H new ATOM 0 HA ASP A 76 2.434 7.895 -8.064 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.730 9.763 -6.069 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.120 8.062 -6.230 1.00 0.00 H new ATOM 1150 N SER A 77 0.789 8.981 -5.427 1.00 0.00 N ATOM 1151 CA SER A 77 -0.085 8.603 -4.361 1.00 0.00 C ATOM 1152 C SER A 77 -1.360 8.018 -4.862 1.00 0.00 C ATOM 1153 O SER A 77 -1.893 7.068 -4.289 1.00 0.00 O ATOM 1154 CB SER A 77 -0.517 9.764 -3.449 1.00 0.00 C ATOM 1155 OG SER A 77 0.616 10.457 -2.947 1.00 0.00 O ATOM 0 H SER A 77 0.855 9.991 -5.550 1.00 0.00 H new ATOM 0 HA SER A 77 0.516 7.886 -3.801 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.153 10.452 -4.005 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.111 9.380 -2.620 1.00 0.00 H new ATOM 0 HG SER A 77 1.125 10.836 -3.694 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.831 8.483 -6.032 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.969 7.943 -6.709 1.00 0.00 C ATOM 1163 C GLU A 78 -2.780 6.584 -7.291 1.00 0.00 C ATOM 1164 O GLU A 78 -3.605 5.676 -7.208 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.431 8.962 -7.764 1.00 0.00 C ATOM 1166 CG GLU A 78 -4.566 8.430 -8.643 1.00 0.00 C ATOM 1167 CD GLU A 78 -5.388 9.370 -9.512 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -5.317 10.612 -9.310 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -6.171 8.898 -10.380 1.00 0.00 O ATOM 0 H GLU A 78 -1.403 9.266 -6.526 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.743 7.783 -5.959 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.761 9.872 -7.264 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.585 9.234 -8.395 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.133 7.680 -9.305 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.263 7.911 -7.985 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.593 6.385 -7.891 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.029 5.174 -8.402 1.00 0.00 C ATOM 1178 C GLU A 79 -1.009 4.063 -7.411 1.00 0.00 C ATOM 1179 O GLU A 79 -1.236 2.907 -7.765 1.00 0.00 O ATOM 1180 CB GLU A 79 0.270 5.600 -9.108 1.00 0.00 C ATOM 1181 CG GLU A 79 0.850 4.423 -9.895 1.00 0.00 C ATOM 1182 CD GLU A 79 2.048 4.717 -10.786 1.00 0.00 C ATOM 1183 OE1 GLU A 79 3.084 5.231 -10.285 1.00 0.00 O ATOM 1184 OE2 GLU A 79 2.031 4.215 -11.941 1.00 0.00 O ATOM 0 H GLU A 79 -0.956 7.169 -8.033 1.00 0.00 H new ATOM 0 HA GLU A 79 -1.644 4.673 -9.150 1.00 0.00 H new ATOM 0 HB2 GLU A 79 0.071 6.435 -9.780 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.995 5.949 -8.373 1.00 0.00 H new ATOM 0 HG2 GLU A 79 1.137 3.648 -9.184 1.00 0.00 H new ATOM 0 HG3 GLU A 79 0.058 4.007 -10.517 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.654 4.317 -6.138 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.578 3.400 -5.043 1.00 0.00 C ATOM 1193 C GLU A 80 -1.884 2.717 -4.821 1.00 0.00 C ATOM 1194 O GLU A 80 -1.902 1.503 -4.626 1.00 0.00 O ATOM 1195 CB GLU A 80 -0.042 4.229 -3.864 1.00 0.00 C ATOM 1196 CG GLU A 80 0.027 3.450 -2.549 1.00 0.00 C ATOM 1197 CD GLU A 80 0.799 4.152 -1.441 1.00 0.00 C ATOM 1198 OE1 GLU A 80 0.670 5.396 -1.291 1.00 0.00 O ATOM 1199 OE2 GLU A 80 1.491 3.483 -0.628 1.00 0.00 O ATOM 0 H GLU A 80 -0.395 5.260 -5.850 1.00 0.00 H new ATOM 0 HA GLU A 80 0.096 2.562 -5.217 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.954 4.596 -4.112 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.679 5.103 -3.726 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.988 3.257 -2.202 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.489 2.481 -2.739 1.00 0.00 H new ATOM 1206 N ILE A 81 -3.006 3.458 -4.856 1.00 0.00 N ATOM 1207 CA ILE A 81 -4.327 2.937 -4.686 1.00 0.00 C ATOM 1208 C ILE A 81 -4.748 2.266 -5.949 1.00 0.00 C ATOM 1209 O ILE A 81 -5.242 1.152 -5.787 1.00 0.00 O ATOM 1210 CB ILE A 81 -5.195 4.072 -4.231 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -4.597 4.584 -2.909 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -6.632 3.560 -4.037 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -4.380 3.584 -1.774 1.00 0.00 C ATOM 0 H ILE A 81 -2.991 4.466 -5.010 1.00 0.00 H new ATOM 0 HA ILE A 81 -4.399 2.163 -3.922 1.00 0.00 H new ATOM 0 HB ILE A 81 -5.230 4.881 -4.960 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.635 5.043 -3.136 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -5.247 5.375 -2.535 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.269 4.380 -3.706 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -7.009 3.166 -4.981 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.638 2.770 -3.286 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -3.953 4.098 -0.913 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.335 3.138 -1.494 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -3.697 2.801 -2.104 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.567 2.861 -7.142 1.00 0.00 N ATOM 1226 CA ARG A 82 -4.972 2.444 -8.448 1.00 0.00 C ATOM 1227 C ARG A 82 -4.444 1.073 -8.700 1.00 0.00 C ATOM 1228 O ARG A 82 -5.143 0.120 -9.041 1.00 0.00 O ATOM 1229 CB ARG A 82 -4.476 3.331 -9.602 1.00 0.00 C ATOM 1230 CG ARG A 82 -5.189 4.665 -9.830 1.00 0.00 C ATOM 1231 CD ARG A 82 -6.567 4.459 -10.463 1.00 0.00 C ATOM 1232 NE ARG A 82 -7.094 5.798 -10.852 1.00 0.00 N ATOM 1233 CZ ARG A 82 -8.340 6.256 -10.538 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -9.345 5.350 -10.361 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -8.606 7.578 -10.751 1.00 0.00 N ATOM 0 H ARG A 82 -4.071 3.751 -7.191 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.060 2.502 -8.441 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.419 3.540 -9.434 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.544 2.752 -10.523 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.298 5.189 -8.880 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.581 5.299 -10.476 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.494 3.809 -11.335 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.242 3.973 -9.759 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.482 6.413 -11.389 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -9.157 4.353 -10.464 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.285 5.670 -10.126 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -7.884 8.188 -11.133 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -9.527 7.955 -10.528 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.118 0.931 -8.531 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.475 -0.331 -8.732 1.00 0.00 C ATOM 1251 C GLU A 83 -2.803 -1.348 -7.694 1.00 0.00 C ATOM 1252 O GLU A 83 -2.831 -2.516 -8.078 1.00 0.00 O ATOM 1253 CB GLU A 83 -0.951 -0.126 -8.771 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.549 0.788 -9.930 1.00 0.00 C ATOM 1255 CD GLU A 83 -1.010 0.208 -11.260 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -0.814 -1.010 -11.512 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -1.709 0.966 -11.985 1.00 0.00 O ATOM 0 H GLU A 83 -2.492 1.688 -8.256 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.850 -0.719 -9.679 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.615 0.307 -7.829 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.454 -1.090 -8.875 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.986 1.776 -9.788 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.533 0.916 -9.940 1.00 0.00 H new ATOM 1264 N ALA A 84 -3.166 -1.026 -6.439 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.573 -2.022 -5.497 1.00 0.00 C ATOM 1266 C ALA A 84 -4.877 -2.605 -5.922 1.00 0.00 C ATOM 1267 O ALA A 84 -5.032 -3.824 -5.884 1.00 0.00 O ATOM 1268 CB ALA A 84 -3.695 -1.437 -4.080 1.00 0.00 C ATOM 0 H ALA A 84 -3.177 -0.073 -6.076 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.812 -2.802 -5.471 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -4.006 -2.220 -3.389 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.730 -1.038 -3.767 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.436 -0.637 -4.079 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.777 -1.716 -6.379 1.00 0.00 N ATOM 1275 CA PHE A 85 -7.104 -2.122 -6.725 1.00 0.00 C ATOM 1276 C PHE A 85 -7.121 -3.094 -7.854 1.00 0.00 C ATOM 1277 O PHE A 85 -7.875 -4.064 -7.908 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.931 -0.872 -7.067 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.402 -1.082 -6.964 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -10.069 -1.026 -5.763 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -10.120 -1.267 -8.122 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.401 -1.358 -5.680 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.465 -1.539 -8.044 1.00 0.00 C ATOM 1284 CZ PHE A 85 -12.086 -1.686 -6.826 1.00 0.00 C ATOM 0 H PHE A 85 -5.588 -0.722 -6.508 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.542 -2.637 -5.870 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.641 -0.061 -6.399 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.688 -0.552 -8.080 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.540 -0.717 -4.873 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -9.632 -1.199 -9.083 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.904 -1.361 -4.724 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.042 -1.639 -8.952 1.00 0.00 H new ATOM 0 HZ PHE A 85 -13.100 -2.055 -6.770 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.165 -2.855 -8.770 1.00 0.00 N ATOM 1295 CA ARG A 86 -5.925 -3.571 -9.984 1.00 0.00 C ATOM 1296 C ARG A 86 -5.491 -4.984 -9.796 1.00 0.00 C ATOM 1297 O ARG A 86 -5.835 -5.842 -10.607 1.00 0.00 O ATOM 1298 CB ARG A 86 -4.895 -2.788 -10.816 1.00 0.00 C ATOM 1299 CG ARG A 86 -4.994 -3.054 -12.319 1.00 0.00 C ATOM 1300 CD ARG A 86 -3.756 -2.532 -13.051 1.00 0.00 C ATOM 1301 NE ARG A 86 -3.568 -1.068 -12.852 1.00 0.00 N ATOM 1302 CZ ARG A 86 -4.339 -0.167 -13.528 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -5.523 -0.504 -14.118 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -3.875 1.102 -13.720 1.00 0.00 N ATOM 0 H ARG A 86 -5.501 -2.091 -8.647 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.879 -3.645 -10.506 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.029 -1.722 -10.634 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.893 -3.046 -10.475 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -5.101 -4.124 -12.496 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -5.887 -2.574 -12.719 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -2.873 -3.063 -12.695 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -3.848 -2.745 -14.116 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.855 -0.735 -12.203 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -5.865 -1.463 -14.064 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -6.066 0.204 -14.613 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.959 1.370 -13.360 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -4.444 1.782 -14.224 1.00 0.00 H new ATOM 1318 N VAL A 87 -4.710 -5.244 -8.732 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.457 -6.557 -8.226 1.00 0.00 C ATOM 1320 C VAL A 87 -5.675 -7.233 -7.698 1.00 0.00 C ATOM 1321 O VAL A 87 -5.983 -8.368 -8.060 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.412 -6.570 -7.149 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -3.160 -7.897 -6.414 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -2.062 -6.330 -7.845 1.00 0.00 C ATOM 0 H VAL A 87 -4.237 -4.511 -8.204 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.096 -7.108 -9.094 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.773 -5.840 -6.425 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.381 -7.756 -5.665 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.078 -8.222 -5.925 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.842 -8.655 -7.130 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.264 -6.330 -7.102 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.881 -7.122 -8.572 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.082 -5.367 -8.356 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.332 -6.585 -6.721 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.397 -7.094 -5.913 1.00 0.00 C ATOM 1336 C PHE A 88 -8.568 -7.556 -6.710 1.00 0.00 C ATOM 1337 O PHE A 88 -9.153 -8.593 -6.402 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.843 -6.098 -4.830 1.00 0.00 C ATOM 1339 CG PHE A 88 -6.928 -5.987 -3.659 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -6.660 -7.128 -2.940 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.397 -4.798 -3.218 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -5.904 -7.071 -1.793 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -5.637 -4.691 -2.077 1.00 0.00 C ATOM 1344 CZ PHE A 88 -5.439 -5.850 -1.364 1.00 0.00 C ATOM 0 H PHE A 88 -6.097 -5.623 -6.476 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.979 -7.969 -5.414 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.947 -5.113 -5.285 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.831 -6.391 -4.473 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.047 -8.078 -3.279 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.586 -3.905 -3.795 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -5.679 -7.970 -1.238 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.218 -3.748 -1.758 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.897 -5.799 -0.431 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.933 -6.756 -7.728 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.891 -6.975 -8.767 1.00 0.00 C ATOM 1356 C ASP A 89 -9.275 -7.850 -9.804 1.00 0.00 C ATOM 1357 O ASP A 89 -8.314 -7.455 -10.462 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.299 -5.608 -9.341 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.574 -5.662 -10.171 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.150 -6.776 -10.287 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.926 -4.648 -10.831 1.00 0.00 O ATOM 0 H ASP A 89 -8.498 -5.839 -7.831 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.786 -7.472 -8.392 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.437 -4.903 -8.521 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.487 -5.224 -9.959 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.842 -9.060 -9.961 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.286 -10.001 -10.883 1.00 0.00 C ATOM 1368 C LYS A 90 -9.732 -9.748 -12.282 1.00 0.00 C ATOM 1369 O LYS A 90 -9.011 -9.566 -13.262 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.824 -11.382 -10.472 1.00 0.00 C ATOM 1371 CG LYS A 90 -9.288 -12.479 -11.393 1.00 0.00 C ATOM 1372 CD LYS A 90 -7.761 -12.558 -11.343 1.00 0.00 C ATOM 1373 CE LYS A 90 -7.256 -13.843 -12.004 1.00 0.00 C ATOM 1374 NZ LYS A 90 -7.889 -14.150 -13.305 1.00 0.00 N ATOM 0 H LYS A 90 -10.670 -9.383 -9.460 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.199 -9.928 -10.855 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.537 -11.595 -9.442 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.913 -11.376 -10.505 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.713 -13.440 -11.101 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.610 -12.286 -12.416 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.332 -11.692 -11.848 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.425 -12.522 -10.307 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -6.178 -13.764 -12.148 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.427 -14.678 -11.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -7.411 -14.965 -13.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -8.893 -14.376 -13.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -7.808 -13.325 -13.934 1.00 0.00 H new ATOM 1388 N ASP A 91 -11.057 -9.753 -12.517 1.00 0.00 N ATOM 1389 CA ASP A 91 -11.753 -9.554 -13.750 1.00 0.00 C ATOM 1390 C ASP A 91 -11.487 -8.196 -14.301 1.00 0.00 C ATOM 1391 O ASP A 91 -11.265 -8.106 -15.507 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.268 -9.817 -13.705 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.953 -9.119 -12.539 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.920 -7.863 -12.449 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.478 -9.805 -11.622 1.00 0.00 O ATOM 0 H ASP A 91 -11.712 -9.916 -11.752 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.347 -10.318 -14.413 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.718 -9.481 -14.639 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.444 -10.890 -13.634 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.471 -7.130 -13.480 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.084 -5.783 -13.764 1.00 0.00 C ATOM 1402 C GLY A 92 -12.282 -5.061 -14.278 1.00 0.00 C ATOM 1403 O GLY A 92 -12.156 -4.120 -15.059 1.00 0.00 O ATOM 0 H GLY A 92 -11.763 -7.228 -12.508 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.703 -5.298 -12.865 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -10.282 -5.764 -14.501 1.00 0.00 H new ATOM 1407 N ASN A 93 -13.448 -5.452 -13.733 1.00 0.00 N ATOM 1408 CA ASN A 93 -14.698 -4.783 -13.924 1.00 0.00 C ATOM 1409 C ASN A 93 -14.850 -3.515 -13.156 1.00 0.00 C ATOM 1410 O ASN A 93 -15.524 -2.616 -13.658 1.00 0.00 O ATOM 1411 CB ASN A 93 -15.875 -5.751 -13.716 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.152 -6.209 -12.292 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.509 -5.843 -11.309 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.163 -7.106 -12.136 1.00 0.00 N ATOM 0 H ASN A 93 -13.523 -6.272 -13.131 1.00 0.00 H new ATOM 0 HA ASN A 93 -14.707 -4.457 -14.964 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -16.777 -5.274 -14.099 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.698 -6.636 -14.327 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.383 -7.470 -11.209 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.701 -7.414 -12.946 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.157 -3.348 -12.015 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.282 -2.187 -11.190 1.00 0.00 C ATOM 1423 C GLY A 94 -14.608 -2.440 -9.758 1.00 0.00 C ATOM 1424 O GLY A 94 -14.506 -1.479 -8.997 1.00 0.00 O ATOM 0 H GLY A 94 -13.494 -4.036 -11.658 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.347 -1.629 -11.237 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.057 -1.547 -11.612 1.00 0.00 H new ATOM 1428 N TYR A 95 -14.999 -3.664 -9.361 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.344 -4.037 -8.024 1.00 0.00 C ATOM 1430 C TYR A 95 -14.603 -5.253 -7.584 1.00 0.00 C ATOM 1431 O TYR A 95 -14.454 -6.213 -8.337 1.00 0.00 O ATOM 1432 CB TYR A 95 -16.839 -4.360 -7.861 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.571 -3.218 -8.478 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -17.557 -1.956 -7.933 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.375 -3.395 -9.579 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -18.240 -0.882 -8.454 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.055 -2.355 -10.168 1.00 0.00 C ATOM 1438 CZ TYR A 95 -18.950 -1.102 -9.611 1.00 0.00 C ATOM 1439 OH TYR A 95 -19.582 0.012 -10.203 1.00 0.00 O ATOM 0 H TYR A 95 -15.079 -4.442 -10.016 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.079 -3.170 -7.419 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.092 -5.299 -8.354 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.103 -4.471 -6.809 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -16.972 -1.798 -7.039 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.476 -4.386 -9.996 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -18.220 0.087 -7.978 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.658 -2.519 -11.049 1.00 0.00 H new ATOM 0 HH TYR A 95 -20.051 -0.271 -11.015 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.185 -5.274 -6.306 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.613 -6.462 -5.754 1.00 0.00 C ATOM 1451 C ILE A 96 -14.655 -7.249 -5.035 1.00 0.00 C ATOM 1452 O ILE A 96 -15.104 -6.864 -3.956 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.470 -6.243 -4.808 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.434 -5.265 -5.387 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.921 -7.622 -4.404 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -10.862 -4.457 -4.223 1.00 0.00 C ATOM 0 H ILE A 96 -14.241 -4.483 -5.664 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.213 -6.995 -6.617 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.799 -5.745 -3.896 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.642 -5.807 -5.903 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -11.898 -4.605 -6.120 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -11.087 -7.494 -3.715 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.708 -8.199 -3.918 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.579 -8.152 -5.293 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.121 -3.751 -4.599 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.666 -3.911 -3.729 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.390 -5.132 -3.509 1.00 0.00 H new ATOM 1468 N SER A 97 -15.086 -8.418 -5.542 1.00 0.00 N ATOM 1469 CA SER A 97 -16.022 -9.321 -4.948 1.00 0.00 C ATOM 1470 C SER A 97 -15.445 -10.388 -4.083 1.00 0.00 C ATOM 1471 O SER A 97 -14.242 -10.557 -3.889 1.00 0.00 O ATOM 1472 CB SER A 97 -16.865 -10.035 -6.018 1.00 0.00 C ATOM 1473 OG SER A 97 -16.148 -11.038 -6.722 1.00 0.00 O ATOM 0 H SER A 97 -14.750 -8.758 -6.443 1.00 0.00 H new ATOM 0 HA SER A 97 -16.614 -8.663 -4.312 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.736 -10.487 -5.543 1.00 0.00 H new ATOM 0 HB3 SER A 97 -17.237 -9.297 -6.729 1.00 0.00 H new ATOM 0 HG SER A 97 -15.577 -10.618 -7.399 1.00 0.00 H new ATOM 1479 N ALA A 98 -16.272 -11.141 -3.336 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.905 -11.985 -2.241 1.00 0.00 C ATOM 1481 C ALA A 98 -15.084 -13.187 -2.557 1.00 0.00 C ATOM 1482 O ALA A 98 -14.143 -13.635 -1.904 1.00 0.00 O ATOM 1483 CB ALA A 98 -17.212 -12.249 -1.473 1.00 0.00 C ATOM 0 H ALA A 98 -17.276 -11.160 -3.513 1.00 0.00 H new ATOM 0 HA ALA A 98 -15.176 -11.474 -1.612 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -17.007 -12.892 -0.617 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.627 -11.303 -1.126 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.928 -12.740 -2.132 1.00 0.00 H new ATOM 1489 N ALA A 99 -15.306 -13.746 -3.760 1.00 0.00 N ATOM 1490 CA ALA A 99 -14.637 -14.687 -4.604 1.00 0.00 C ATOM 1491 C ALA A 99 -13.220 -14.242 -4.731 1.00 0.00 C ATOM 1492 O ALA A 99 -12.294 -14.917 -4.286 1.00 0.00 O ATOM 1493 CB ALA A 99 -15.379 -14.598 -5.949 1.00 0.00 C ATOM 0 H ALA A 99 -16.159 -13.460 -4.240 1.00 0.00 H new ATOM 0 HA ALA A 99 -14.638 -15.711 -4.231 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.929 -15.291 -6.660 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -16.428 -14.858 -5.804 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.307 -13.582 -6.338 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.975 -13.022 -5.241 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.702 -12.515 -5.652 1.00 0.00 C ATOM 1501 C GLU A 100 -10.937 -12.233 -4.405 1.00 0.00 C ATOM 1502 O GLU A 100 -9.712 -12.322 -4.338 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.912 -11.191 -6.405 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.664 -11.275 -7.735 1.00 0.00 C ATOM 1505 CD GLU A 100 -13.237 -10.002 -8.341 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -14.304 -9.502 -7.895 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.550 -9.481 -9.259 1.00 0.00 O ATOM 0 H GLU A 100 -13.722 -12.341 -5.376 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.181 -13.222 -6.297 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.452 -10.508 -5.750 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.935 -10.746 -6.593 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.987 -11.713 -8.469 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.488 -11.976 -7.603 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.590 -11.855 -3.292 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.963 -11.784 -2.008 1.00 0.00 C ATOM 1516 C LEU A 101 -10.653 -13.125 -1.436 1.00 0.00 C ATOM 1517 O LEU A 101 -9.622 -13.115 -0.764 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.840 -10.887 -1.118 1.00 0.00 C ATOM 1519 CG LEU A 101 -11.232 -10.361 0.193 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.017 -9.468 -0.113 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -12.178 -9.533 1.079 1.00 0.00 C ATOM 0 H LEU A 101 -12.576 -11.593 -3.283 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.974 -11.332 -2.088 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -12.150 -10.027 -1.712 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.743 -11.444 -0.868 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.975 -11.265 0.746 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.592 -9.099 0.821 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.266 -10.047 -0.650 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.331 -8.624 -0.727 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.649 -9.212 1.976 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.520 -8.657 0.527 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -13.037 -10.142 1.362 1.00 0.00 H new ATOM 1533 N ARG A 102 -11.368 -14.239 -1.672 1.00 0.00 N ATOM 1534 CA ARG A 102 -10.943 -15.579 -1.413 1.00 0.00 C ATOM 1535 C ARG A 102 -9.699 -15.985 -2.126 1.00 0.00 C ATOM 1536 O ARG A 102 -8.757 -16.531 -1.553 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.949 -16.719 -1.649 1.00 0.00 C ATOM 1538 CG ARG A 102 -13.027 -16.840 -0.570 1.00 0.00 C ATOM 1539 CD ARG A 102 -14.237 -17.707 -0.923 1.00 0.00 C ATOM 1540 NE ARG A 102 -14.961 -17.890 0.367 1.00 0.00 N ATOM 1541 CZ ARG A 102 -15.764 -16.972 0.980 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -15.950 -15.689 0.553 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -16.582 -17.372 1.997 1.00 0.00 N ATOM 0 H ARG A 102 -12.306 -14.200 -2.071 1.00 0.00 H new ATOM 0 HA ARG A 102 -10.789 -15.479 -0.339 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -12.433 -16.567 -2.614 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.405 -17.661 -1.710 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -12.566 -17.244 0.332 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -13.382 -15.839 -0.325 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -14.869 -17.221 -1.666 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -13.929 -18.664 -1.343 1.00 0.00 H new ATOM 0 HE ARG A 102 -14.845 -18.788 0.837 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -15.470 -15.355 -0.283 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -16.569 -15.064 1.070 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -16.589 -18.348 2.292 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -17.186 -16.694 2.462 1.00 0.00 H new ATOM 1557 N HIS A 103 -9.564 -15.645 -3.420 1.00 0.00 N ATOM 1558 CA HIS A 103 -8.527 -15.982 -4.345 1.00 0.00 C ATOM 1559 C HIS A 103 -7.297 -15.195 -4.047 1.00 0.00 C ATOM 1560 O HIS A 103 -6.234 -15.810 -3.977 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.943 -15.843 -5.819 1.00 0.00 C ATOM 1562 CG HIS A 103 -9.897 -16.898 -6.295 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -11.122 -17.272 -5.782 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -9.548 -17.859 -7.192 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -11.438 -18.427 -6.426 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -10.527 -18.827 -7.293 1.00 0.00 N ATOM 0 H HIS A 103 -10.271 -15.062 -3.869 1.00 0.00 H new ATOM 0 HA HIS A 103 -8.315 -17.042 -4.206 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.400 -14.864 -5.964 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.048 -15.872 -6.441 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -11.672 -16.787 -5.073 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -8.625 -17.864 -7.752 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -12.354 -18.969 -6.244 1.00 0.00 H new ATOM 1574 N VAL A 104 -7.426 -13.884 -3.776 1.00 0.00 N ATOM 1575 CA VAL A 104 -6.269 -13.155 -3.358 1.00 0.00 C ATOM 1576 C VAL A 104 -5.679 -13.645 -2.080 1.00 0.00 C ATOM 1577 O VAL A 104 -4.459 -13.801 -2.045 1.00 0.00 O ATOM 1578 CB VAL A 104 -6.449 -11.668 -3.282 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -6.963 -11.056 -1.968 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -5.113 -11.000 -3.646 1.00 0.00 C ATOM 0 H VAL A 104 -8.291 -13.347 -3.842 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.568 -13.356 -4.168 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.259 -11.471 -3.984 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.038 -9.974 -2.076 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.946 -11.467 -1.735 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.270 -11.293 -1.161 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.223 -9.917 -3.597 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.343 -11.319 -2.943 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.825 -11.290 -4.656 1.00 0.00 H new ATOM 1590 N MET A 105 -6.491 -13.923 -1.044 1.00 0.00 N ATOM 1591 CA MET A 105 -6.075 -14.449 0.219 1.00 0.00 C ATOM 1592 C MET A 105 -5.515 -15.829 0.196 1.00 0.00 C ATOM 1593 O MET A 105 -4.511 -16.073 0.862 1.00 0.00 O ATOM 1594 CB MET A 105 -7.186 -14.380 1.280 1.00 0.00 C ATOM 1595 CG MET A 105 -7.631 -12.977 1.698 1.00 0.00 C ATOM 1596 SD MET A 105 -6.320 -12.037 2.536 1.00 0.00 S ATOM 1597 CE MET A 105 -7.371 -10.557 2.606 1.00 0.00 C ATOM 0 H MET A 105 -7.498 -13.771 -1.092 1.00 0.00 H new ATOM 0 HA MET A 105 -5.253 -13.786 0.488 1.00 0.00 H new ATOM 0 HB2 MET A 105 -8.056 -14.917 0.902 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.845 -14.911 2.169 1.00 0.00 H new ATOM 0 HG2 MET A 105 -7.957 -12.427 0.815 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.493 -13.057 2.360 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.827 -9.747 3.093 1.00 0.00 H new ATOM 0 HE2 MET A 105 -7.642 -10.255 1.594 1.00 0.00 H new ATOM 0 HE3 MET A 105 -8.275 -10.779 3.173 1.00 0.00 H new ATOM 1607 N THR A 106 -6.091 -16.728 -0.622 1.00 0.00 N ATOM 1608 CA THR A 106 -5.560 -18.014 -0.952 1.00 0.00 C ATOM 1609 C THR A 106 -4.189 -18.007 -1.536 1.00 0.00 C ATOM 1610 O THR A 106 -3.301 -18.732 -1.090 1.00 0.00 O ATOM 1611 CB THR A 106 -6.389 -18.888 -1.846 1.00 0.00 C ATOM 1612 OG1 THR A 106 -7.710 -19.003 -1.337 1.00 0.00 O ATOM 1613 CG2 THR A 106 -5.765 -20.262 -2.145 1.00 0.00 C ATOM 0 H THR A 106 -6.983 -16.545 -1.081 1.00 0.00 H new ATOM 0 HA THR A 106 -5.555 -18.440 0.051 1.00 0.00 H new ATOM 0 HB THR A 106 -6.425 -18.389 -2.814 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.248 -18.246 -1.650 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.429 -20.829 -2.797 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.802 -20.125 -2.638 1.00 0.00 H new ATOM 0 HG23 THR A 106 -5.621 -20.807 -1.212 1.00 0.00 H new ATOM 1621 N ASN A 107 -4.010 -17.301 -2.667 1.00 0.00 N ATOM 1622 CA ASN A 107 -2.717 -17.287 -3.277 1.00 0.00 C ATOM 1623 C ASN A 107 -1.710 -16.532 -2.480 1.00 0.00 C ATOM 1624 O ASN A 107 -0.559 -16.961 -2.420 1.00 0.00 O ATOM 1625 CB ASN A 107 -2.586 -16.710 -4.697 1.00 0.00 C ATOM 1626 CG ASN A 107 -3.451 -17.540 -5.635 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -3.192 -18.742 -5.652 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -4.395 -16.909 -6.383 1.00 0.00 N ATOM 0 H ASN A 107 -4.730 -16.759 -3.144 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.541 -18.362 -3.325 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.902 -15.667 -4.713 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.546 -16.733 -5.021 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.969 -17.443 -7.036 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.529 -15.902 -6.291 1.00 0.00 H new ATOM 1635 N LEU A 108 -2.048 -15.375 -1.882 1.00 0.00 N ATOM 1636 CA LEU A 108 -1.166 -14.592 -1.074 1.00 0.00 C ATOM 1637 C LEU A 108 -0.825 -15.179 0.253 1.00 0.00 C ATOM 1638 O LEU A 108 0.310 -15.034 0.705 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.651 -13.132 -1.067 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.700 -12.054 -0.519 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -0.753 -11.831 1.002 1.00 0.00 C ATOM 1642 CD2 LEU A 108 0.746 -12.173 -1.029 1.00 0.00 C ATOM 0 H LEU A 108 -2.979 -14.967 -1.966 1.00 0.00 H new ATOM 0 HA LEU A 108 -0.179 -14.603 -1.537 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.907 -12.861 -2.091 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.572 -13.090 -0.486 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.114 -11.143 -0.952 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.044 -11.051 1.280 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -1.759 -11.526 1.290 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.493 -12.757 1.515 1.00 0.00 H new ATOM 0 HD21 LEU A 108 1.351 -11.377 -0.596 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.156 -13.140 -0.738 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.757 -12.087 -2.116 1.00 0.00 H new ATOM 1654 N GLY A 109 -1.705 -16.064 0.754 1.00 0.00 N ATOM 1655 CA GLY A 109 -1.314 -17.025 1.739 1.00 0.00 C ATOM 1656 C GLY A 109 -1.525 -16.486 3.112 1.00 0.00 C ATOM 1657 O GLY A 109 -0.663 -16.563 3.985 1.00 0.00 O ATOM 0 H GLY A 109 -2.686 -16.115 0.478 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.890 -17.941 1.610 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.265 -17.287 1.603 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.661 -15.790 3.298 1.00 0.00 N ATOM 1662 CA GLU A 110 -3.084 -15.295 4.571 1.00 0.00 C ATOM 1663 C GLU A 110 -3.848 -16.347 5.298 1.00 0.00 C ATOM 1664 O GLU A 110 -4.755 -16.935 4.711 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.828 -13.970 4.330 1.00 0.00 C ATOM 1666 CG GLU A 110 -3.510 -12.734 5.173 1.00 0.00 C ATOM 1667 CD GLU A 110 -3.412 -12.991 6.670 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -4.428 -13.379 7.306 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -2.397 -12.658 7.338 1.00 0.00 O ATOM 0 H GLU A 110 -3.305 -15.565 2.539 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.251 -15.068 5.236 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.668 -13.697 3.287 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.892 -14.173 4.447 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.567 -12.310 4.829 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.280 -11.983 4.997 1.00 0.00 H new ATOM 1676 N LYS A 111 -3.510 -16.585 6.578 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.037 -17.573 7.466 1.00 0.00 C ATOM 1678 C LYS A 111 -5.269 -17.125 8.174 1.00 0.00 C ATOM 1679 O LYS A 111 -5.233 -16.585 9.279 1.00 0.00 O ATOM 1680 CB LYS A 111 -3.065 -17.969 8.590 1.00 0.00 C ATOM 1681 CG LYS A 111 -3.394 -19.419 8.953 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.580 -19.749 10.205 1.00 0.00 C ATOM 1683 CE LYS A 111 -1.071 -19.836 9.972 1.00 0.00 C ATOM 1684 NZ LYS A 111 -0.349 -20.270 11.189 1.00 0.00 N ATOM 0 H LYS A 111 -2.791 -16.024 7.036 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.236 -18.412 6.798 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -2.030 -17.876 8.260 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -3.183 -17.316 9.454 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -4.461 -19.539 9.141 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -3.137 -20.092 8.135 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.775 -18.989 10.962 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.928 -20.699 10.610 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -0.869 -20.535 9.161 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.696 -18.863 9.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.671 -20.316 10.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.521 -19.589 11.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -0.688 -21.210 11.477 1.00 0.00 H new ATOM 1698 N LEU A 112 -6.435 -17.347 7.542 1.00 0.00 N ATOM 1699 CA LEU A 112 -7.712 -16.764 7.816 1.00 0.00 C ATOM 1700 C LEU A 112 -8.721 -17.739 7.313 1.00 0.00 C ATOM 1701 O LEU A 112 -8.392 -18.540 6.440 1.00 0.00 O ATOM 1702 CB LEU A 112 -7.814 -15.286 7.403 1.00 0.00 C ATOM 1703 CG LEU A 112 -7.785 -14.844 5.930 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -9.045 -15.310 5.180 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -7.557 -13.332 5.764 1.00 0.00 C ATOM 0 H LEU A 112 -6.486 -18.001 6.761 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.911 -16.630 8.879 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.744 -14.906 7.826 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.999 -14.764 7.903 1.00 0.00 H new ATOM 0 HG LEU A 112 -6.923 -15.335 5.477 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.993 -14.981 4.142 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.107 -16.398 5.214 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.929 -14.881 5.652 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.546 -13.080 4.704 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.361 -12.786 6.259 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.602 -13.057 6.212 1.00 0.00 H new ATOM 1717 N THR A 113 -9.924 -17.740 7.914 1.00 0.00 N ATOM 1718 CA THR A 113 -10.963 -18.659 7.566 1.00 0.00 C ATOM 1719 C THR A 113 -11.844 -18.144 6.481 1.00 0.00 C ATOM 1720 O THR A 113 -11.695 -17.045 5.949 1.00 0.00 O ATOM 1721 CB THR A 113 -11.827 -19.139 8.694 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.723 -18.186 9.247 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.842 -19.530 9.809 1.00 0.00 C ATOM 0 H THR A 113 -10.180 -17.089 8.657 1.00 0.00 H new ATOM 0 HA THR A 113 -10.393 -19.522 7.221 1.00 0.00 H new ATOM 0 HB THR A 113 -12.460 -19.936 8.303 1.00 0.00 H new ATOM 0 HG1 THR A 113 -13.237 -18.602 9.971 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.397 -19.893 10.674 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.177 -20.315 9.449 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.253 -18.659 10.096 1.00 0.00 H new ATOM 1731 N ASP A 114 -12.870 -18.938 6.124 1.00 0.00 N ATOM 1732 CA ASP A 114 -13.891 -18.699 5.152 1.00 0.00 C ATOM 1733 C ASP A 114 -14.820 -17.567 5.425 1.00 0.00 C ATOM 1734 O ASP A 114 -15.126 -16.675 4.634 1.00 0.00 O ATOM 1735 CB ASP A 114 -14.585 -20.029 4.811 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.296 -19.964 3.467 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -14.630 -19.647 2.446 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -16.549 -20.093 3.429 1.00 0.00 O ATOM 0 H ASP A 114 -12.994 -19.848 6.568 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.390 -18.321 4.261 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -13.847 -20.831 4.794 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -15.305 -20.275 5.592 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.274 -17.573 6.691 1.00 0.00 N ATOM 1744 CA GLU A 115 -16.054 -16.692 7.504 1.00 0.00 C ATOM 1745 C GLU A 115 -15.406 -15.351 7.553 1.00 0.00 C ATOM 1746 O GLU A 115 -16.091 -14.332 7.484 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.171 -17.247 8.933 1.00 0.00 C ATOM 1748 CG GLU A 115 -17.158 -18.410 9.046 1.00 0.00 C ATOM 1749 CD GLU A 115 -16.918 -19.239 10.300 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -16.546 -18.676 11.363 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -17.242 -20.457 10.283 1.00 0.00 O ATOM 0 H GLU A 115 -15.031 -18.384 7.259 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.050 -16.607 7.070 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.188 -17.578 9.269 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.484 -16.446 9.603 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -18.177 -18.022 9.057 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -17.069 -19.048 8.167 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.070 -15.302 7.701 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.290 -14.105 7.763 1.00 0.00 C ATOM 1760 C GLU A 116 -13.267 -13.342 6.484 1.00 0.00 C ATOM 1761 O GLU A 116 -13.211 -12.113 6.510 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.832 -14.431 8.127 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.734 -14.908 9.578 1.00 0.00 C ATOM 1764 CD GLU A 116 -10.339 -14.920 10.188 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.708 -13.835 10.299 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.850 -16.011 10.587 1.00 0.00 O ATOM 0 H GLU A 116 -13.503 -16.146 7.782 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.769 -13.490 8.525 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.448 -15.201 7.458 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.210 -13.547 7.986 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.371 -14.271 10.192 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -12.142 -15.917 9.635 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.372 -13.969 5.299 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.391 -13.213 4.085 1.00 0.00 C ATOM 1775 C VAL A 117 -14.654 -12.449 3.885 1.00 0.00 C ATOM 1776 O VAL A 117 -14.727 -11.284 3.497 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.174 -14.181 2.960 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -13.012 -13.299 1.711 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -11.974 -15.143 2.988 1.00 0.00 C ATOM 0 H VAL A 117 -13.443 -14.980 5.181 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.604 -12.459 4.125 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.024 -14.862 3.011 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -12.848 -13.931 0.838 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -13.914 -12.705 1.565 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -12.158 -12.635 1.843 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -11.984 -15.764 2.092 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.048 -14.569 3.021 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.038 -15.779 3.871 1.00 0.00 H new ATOM 1789 N ASP A 118 -15.784 -13.077 4.256 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.073 -12.458 4.264 1.00 0.00 C ATOM 1791 C ASP A 118 -17.281 -11.311 5.192 1.00 0.00 C ATOM 1792 O ASP A 118 -17.942 -10.336 4.835 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.094 -13.587 4.483 1.00 0.00 C ATOM 1794 CG ASP A 118 -18.093 -14.627 3.372 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -17.590 -14.288 2.268 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -18.677 -15.734 3.521 1.00 0.00 O ATOM 0 H ASP A 118 -15.801 -14.050 4.561 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.197 -11.956 3.304 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -17.882 -14.080 5.432 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -19.091 -13.154 4.565 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.565 -11.356 6.330 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.588 -10.278 7.269 1.00 0.00 C ATOM 1803 C GLU A 119 -15.780 -9.071 6.933 1.00 0.00 C ATOM 1804 O GLU A 119 -16.014 -7.928 7.322 1.00 0.00 O ATOM 1805 CB GLU A 119 -16.072 -10.851 8.599 1.00 0.00 C ATOM 1806 CG GLU A 119 -16.548 -9.924 9.720 1.00 0.00 C ATOM 1807 CD GLU A 119 -16.096 -10.476 11.064 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -16.724 -11.467 11.524 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -15.197 -9.892 11.727 1.00 0.00 O ATOM 0 H GLU A 119 -15.970 -12.139 6.600 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.615 -9.914 7.289 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.450 -11.862 8.752 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.984 -10.915 8.592 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -16.145 -8.922 9.573 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -17.634 -9.837 9.698 1.00 0.00 H new ATOM 1816 N MET A 120 -14.727 -9.345 6.143 1.00 0.00 N ATOM 1817 CA MET A 120 -14.085 -8.310 5.394 1.00 0.00 C ATOM 1818 C MET A 120 -14.834 -7.634 4.297 1.00 0.00 C ATOM 1819 O MET A 120 -14.486 -6.464 4.140 1.00 0.00 O ATOM 1820 CB MET A 120 -12.724 -8.846 4.919 1.00 0.00 C ATOM 1821 CG MET A 120 -11.549 -8.765 5.895 1.00 0.00 C ATOM 1822 SD MET A 120 -10.179 -9.827 5.344 1.00 0.00 S ATOM 1823 CE MET A 120 -9.131 -8.477 4.731 1.00 0.00 C ATOM 0 H MET A 120 -14.323 -10.274 6.023 1.00 0.00 H new ATOM 0 HA MET A 120 -13.996 -7.479 6.094 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.855 -9.891 4.637 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.447 -8.304 4.015 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.206 -7.733 5.974 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.875 -9.070 6.890 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.084 -8.777 4.782 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.394 -8.253 3.697 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.284 -7.590 5.345 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.747 -8.280 3.551 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.689 -7.656 2.675 1.00 0.00 C ATOM 1835 C ILE A 121 -17.695 -6.798 3.362 1.00 0.00 C ATOM 1836 O ILE A 121 -17.955 -5.630 3.078 1.00 0.00 O ATOM 1837 CB ILE A 121 -17.221 -8.689 1.726 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.145 -9.386 0.876 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.181 -8.016 0.731 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.300 -8.490 -0.027 1.00 0.00 C ATOM 0 H ILE A 121 -15.832 -9.296 3.560 1.00 0.00 H new ATOM 0 HA ILE A 121 -16.181 -6.904 2.071 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.699 -9.438 2.357 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.474 -9.922 1.548 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.635 -10.133 0.252 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.570 -8.763 0.039 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -19.008 -7.560 1.275 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.646 -7.248 0.172 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.580 -9.099 -0.573 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.948 -7.972 -0.735 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.769 -7.758 0.581 1.00 0.00 H new ATOM 1852 N ARG A 122 -18.115 -7.296 4.539 1.00 0.00 N ATOM 1853 CA ARG A 122 -19.051 -6.706 5.445 1.00 0.00 C ATOM 1854 C ARG A 122 -18.549 -5.373 5.882 1.00 0.00 C ATOM 1855 O ARG A 122 -19.236 -4.358 5.780 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.273 -7.671 6.621 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.369 -7.111 7.530 1.00 0.00 C ATOM 1858 CD ARG A 122 -20.506 -8.077 8.708 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.010 -9.402 8.252 1.00 0.00 N ATOM 1860 CZ ARG A 122 -20.769 -10.586 8.888 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -20.380 -10.620 10.196 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -20.900 -11.737 8.167 1.00 0.00 N ATOM 0 H ARG A 122 -17.768 -8.190 4.885 1.00 0.00 H new ATOM 0 HA ARG A 122 -20.014 -6.540 4.962 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.559 -8.655 6.250 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.348 -7.798 7.183 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.108 -6.112 7.878 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.312 -7.024 6.990 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -19.540 -8.200 9.197 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.188 -7.659 9.449 1.00 0.00 H new ATOM 0 HE ARG A 122 -21.576 -9.427 7.404 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -20.264 -9.750 10.716 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -20.205 -11.515 10.653 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -21.170 -11.695 7.184 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -20.728 -12.639 8.611 1.00 0.00 H new ATOM 1876 N GLU A 123 -17.270 -5.258 6.282 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.533 -4.097 6.675 1.00 0.00 C ATOM 1878 C GLU A 123 -16.293 -3.097 5.597 1.00 0.00 C ATOM 1879 O GLU A 123 -16.667 -1.937 5.769 1.00 0.00 O ATOM 1880 CB GLU A 123 -15.205 -4.540 7.312 1.00 0.00 C ATOM 1881 CG GLU A 123 -14.439 -3.391 7.971 1.00 0.00 C ATOM 1882 CD GLU A 123 -13.256 -3.984 8.722 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.309 -4.327 7.966 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -13.122 -3.999 9.975 1.00 0.00 O ATOM 0 H GLU A 123 -16.681 -6.089 6.335 1.00 0.00 H new ATOM 0 HA GLU A 123 -17.160 -3.569 7.394 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -15.406 -5.309 8.058 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -14.576 -4.995 6.547 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.096 -2.681 7.219 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.088 -2.843 8.654 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.790 -3.544 4.433 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.528 -2.672 3.330 1.00 0.00 C ATOM 1893 C ALA A 124 -16.718 -1.988 2.752 1.00 0.00 C ATOM 1894 O ALA A 124 -16.837 -0.777 2.567 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.910 -3.587 2.260 1.00 0.00 C ATOM 0 H ALA A 124 -15.562 -4.522 4.254 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.892 -1.855 3.673 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.675 -3.001 1.372 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.997 -4.037 2.650 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.619 -4.372 1.999 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.778 -2.790 2.546 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.995 -2.529 1.842 1.00 0.00 C ATOM 1903 C ASP A 125 -19.861 -1.557 2.567 1.00 0.00 C ATOM 1904 O ASP A 125 -20.345 -1.794 3.672 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.751 -3.824 1.504 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.990 -3.575 0.656 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.798 -2.877 -0.375 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -22.086 -4.084 1.013 1.00 0.00 O ATOM 0 H ASP A 125 -17.777 -3.738 2.922 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.718 -2.064 0.896 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -19.083 -4.502 0.974 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.042 -4.322 2.429 1.00 0.00 H new ATOM 1913 N ILE A 126 -20.198 -0.399 1.970 1.00 0.00 N ATOM 1914 CA ILE A 126 -21.003 0.652 2.511 1.00 0.00 C ATOM 1915 C ILE A 126 -22.385 0.478 1.981 1.00 0.00 C ATOM 1916 O ILE A 126 -23.306 0.166 2.734 1.00 0.00 O ATOM 1917 CB ILE A 126 -20.493 2.044 2.282 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -19.088 2.321 2.842 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -21.456 3.009 2.994 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -18.495 3.603 2.259 1.00 0.00 C ATOM 0 H ILE A 126 -19.878 -0.181 1.026 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.973 0.559 3.597 1.00 0.00 H new ATOM 0 HB ILE A 126 -20.435 2.177 1.202 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -19.138 2.403 3.928 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -18.433 1.480 2.615 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -21.116 4.035 2.849 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -22.457 2.896 2.578 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -21.478 2.781 4.060 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -17.502 3.767 2.677 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -18.422 3.510 1.175 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -19.138 4.447 2.508 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.544 0.570 0.648 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.735 0.655 -0.138 1.00 0.00 C ATOM 1934 C ASP A 127 -24.601 -0.540 0.069 1.00 0.00 C ATOM 1935 O ASP A 127 -25.574 -0.425 0.812 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.456 0.912 -1.629 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.286 0.123 -2.200 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -22.525 -1.101 -2.378 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.180 0.602 -2.567 1.00 0.00 O ATOM 0 H ASP A 127 -21.721 0.587 0.045 1.00 0.00 H new ATOM 0 HA ASP A 127 -24.281 1.530 0.215 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -24.353 0.671 -2.200 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -23.264 1.975 -1.771 1.00 0.00 H new ATOM 1944 N GLY A 128 -24.317 -1.717 -0.517 1.00 0.00 N ATOM 1945 CA GLY A 128 -25.028 -2.950 -0.371 1.00 0.00 C ATOM 1946 C GLY A 128 -24.969 -3.945 -1.478 1.00 0.00 C ATOM 1947 O GLY A 128 -25.714 -4.921 -1.552 1.00 0.00 O ATOM 0 H GLY A 128 -23.521 -1.812 -1.147 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -24.661 -3.438 0.532 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -26.077 -2.708 -0.199 1.00 0.00 H new ATOM 1951 N ASP A 129 -24.059 -3.736 -2.446 1.00 0.00 N ATOM 1952 CA ASP A 129 -23.808 -4.695 -3.477 1.00 0.00 C ATOM 1953 C ASP A 129 -23.051 -5.890 -3.010 1.00 0.00 C ATOM 1954 O ASP A 129 -23.240 -7.002 -3.501 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.226 -4.144 -4.790 1.00 0.00 C ATOM 1956 CG ASP A 129 -21.840 -3.516 -4.739 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.234 -3.412 -3.640 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -21.467 -2.927 -5.789 1.00 0.00 O ATOM 0 H ASP A 129 -23.491 -2.892 -2.514 1.00 0.00 H new ATOM 0 HA ASP A 129 -24.817 -5.017 -3.734 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.199 -4.959 -5.513 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -23.919 -3.397 -5.177 1.00 0.00 H new ATOM 1963 N GLY A 130 -22.186 -5.699 -1.998 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.400 -6.719 -1.376 1.00 0.00 C ATOM 1965 C GLY A 130 -20.122 -6.979 -2.097 1.00 0.00 C ATOM 1966 O GLY A 130 -19.570 -8.078 -2.146 1.00 0.00 O ATOM 0 H GLY A 130 -22.026 -4.778 -1.590 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -21.180 -6.427 -0.349 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.980 -7.641 -1.329 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.687 -5.974 -2.877 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.406 -5.892 -3.507 1.00 0.00 C ATOM 1972 C GLN A 131 -17.775 -4.574 -3.219 1.00 0.00 C ATOM 1973 O GLN A 131 -18.450 -3.596 -2.900 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.725 -5.944 -5.010 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.416 -7.253 -5.396 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.469 -7.377 -6.912 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -18.548 -7.280 -7.721 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -20.705 -7.600 -7.434 1.00 0.00 N ATOM 0 H GLN A 131 -20.271 -5.163 -3.081 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.733 -6.678 -3.166 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.365 -5.102 -5.276 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.803 -5.837 -5.582 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.877 -8.099 -4.971 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.425 -7.278 -4.984 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.511 -7.690 -6.816 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -20.826 -7.677 -8.444 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.444 -4.491 -3.392 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.775 -3.314 -2.931 1.00 0.00 C ATOM 1989 C VAL A 132 -15.391 -2.429 -4.066 1.00 0.00 C ATOM 1990 O VAL A 132 -14.529 -2.796 -4.864 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.580 -3.782 -2.155 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.897 -2.645 -1.375 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -14.927 -4.902 -1.160 1.00 0.00 C ATOM 0 H VAL A 132 -15.854 -5.200 -3.828 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.428 -2.712 -2.300 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.894 -4.165 -2.910 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.039 -3.041 -0.832 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.563 -1.876 -2.071 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.605 -2.212 -0.669 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -14.027 -5.204 -0.624 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -15.669 -4.539 -0.448 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -15.332 -5.757 -1.701 1.00 0.00 H new ATOM 2003 N ASN A 133 -16.029 -1.265 -4.283 1.00 0.00 N ATOM 2004 CA ASN A 133 -15.539 -0.216 -5.121 1.00 0.00 C ATOM 2005 C ASN A 133 -14.260 0.383 -4.647 1.00 0.00 C ATOM 2006 O ASN A 133 -13.621 0.033 -3.656 1.00 0.00 O ATOM 2007 CB ASN A 133 -16.696 0.732 -5.480 1.00 0.00 C ATOM 2008 CG ASN A 133 -17.068 1.568 -4.264 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.270 2.332 -3.723 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -18.392 1.704 -3.985 1.00 0.00 N ATOM 0 H ASN A 133 -16.928 -1.046 -3.854 1.00 0.00 H new ATOM 0 HA ASN A 133 -15.203 -0.621 -6.076 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -16.404 1.382 -6.305 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.559 0.157 -5.817 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.705 2.428 -3.339 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.072 1.082 -4.422 1.00 0.00 H new ATOM 2017 N TYR A 134 -13.877 1.416 -5.419 1.00 0.00 N ATOM 2018 CA TYR A 134 -12.692 2.202 -5.265 1.00 0.00 C ATOM 2019 C TYR A 134 -12.611 2.985 -4.000 1.00 0.00 C ATOM 2020 O TYR A 134 -11.588 3.025 -3.318 1.00 0.00 O ATOM 2021 CB TYR A 134 -12.618 3.175 -6.454 1.00 0.00 C ATOM 2022 CG TYR A 134 -11.243 3.738 -6.562 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -10.319 2.907 -7.150 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -10.844 4.933 -6.012 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -9.000 3.286 -7.239 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -9.523 5.307 -6.089 1.00 0.00 C ATOM 2027 CZ TYR A 134 -8.605 4.487 -6.700 1.00 0.00 C ATOM 2028 OH TYR A 134 -7.244 4.814 -6.880 1.00 0.00 O ATOM 0 H TYR A 134 -14.440 1.724 -6.212 1.00 0.00 H new ATOM 0 HA TYR A 134 -11.857 1.502 -5.229 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -12.882 2.657 -7.376 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.341 3.980 -6.322 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -10.631 1.951 -7.544 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -11.563 5.574 -5.523 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -8.281 2.646 -7.728 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -9.206 6.249 -5.667 1.00 0.00 H new ATOM 0 HH TYR A 134 -7.059 5.682 -6.465 1.00 0.00 H new ATOM 2038 N GLU A 135 -13.713 3.674 -3.653 1.00 0.00 N ATOM 2039 CA GLU A 135 -13.813 4.574 -2.547 1.00 0.00 C ATOM 2040 C GLU A 135 -13.902 3.761 -1.301 1.00 0.00 C ATOM 2041 O GLU A 135 -13.393 4.117 -0.239 1.00 0.00 O ATOM 2042 CB GLU A 135 -15.165 5.296 -2.681 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.181 6.449 -3.686 1.00 0.00 C ATOM 2044 CD GLU A 135 -16.571 6.919 -4.091 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -17.098 6.180 -4.966 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -17.142 7.948 -3.642 1.00 0.00 O ATOM 0 H GLU A 135 -14.585 3.597 -4.176 1.00 0.00 H new ATOM 0 HA GLU A 135 -12.967 5.261 -2.523 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -15.922 4.568 -2.973 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -15.453 5.681 -1.703 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -14.637 7.292 -3.260 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.641 6.140 -4.581 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.627 2.632 -1.391 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.709 1.745 -0.272 1.00 0.00 C ATOM 2055 C GLU A 136 -13.394 1.215 0.186 1.00 0.00 C ATOM 2056 O GLU A 136 -13.209 1.037 1.389 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.720 0.615 -0.531 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.173 1.092 -0.582 1.00 0.00 C ATOM 2059 CD GLU A 136 -18.171 0.047 -1.061 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.968 -0.625 -2.107 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.329 -0.038 -0.571 1.00 0.00 O ATOM 0 H GLU A 136 -15.146 2.337 -2.218 1.00 0.00 H new ATOM 0 HA GLU A 136 -15.073 2.351 0.557 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -15.473 0.127 -1.474 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.620 -0.137 0.252 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -17.467 1.425 0.413 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -17.233 1.960 -1.239 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.468 0.981 -0.761 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.095 0.653 -0.527 1.00 0.00 C ATOM 2070 C PHE A 137 -10.248 1.799 -0.093 1.00 0.00 C ATOM 2071 O PHE A 137 -9.568 1.842 0.931 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.549 0.073 -1.843 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.155 -0.448 -1.768 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -8.799 -1.609 -1.123 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.125 0.341 -2.224 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.484 -1.906 -0.849 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -6.794 0.012 -2.123 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.499 -1.105 -1.378 1.00 0.00 C ATOM 0 H PHE A 137 -12.693 1.024 -1.755 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.054 -0.054 0.301 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.206 -0.734 -2.168 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.591 0.847 -2.610 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -9.570 -2.304 -0.824 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.378 1.281 -2.692 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.230 -2.753 -0.229 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.024 0.598 -2.602 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.464 -1.361 -1.203 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.212 2.957 -0.776 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.435 4.075 -0.338 1.00 0.00 C ATOM 2090 C VAL A 138 -9.873 4.691 0.946 1.00 0.00 C ATOM 2091 O VAL A 138 -9.033 5.028 1.779 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.063 5.034 -1.430 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -10.182 5.948 -1.957 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -7.828 5.848 -1.008 1.00 0.00 C ATOM 0 H VAL A 138 -10.727 3.120 -1.641 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.478 3.635 -0.058 1.00 0.00 H new ATOM 0 HB VAL A 138 -8.838 4.403 -2.290 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.786 6.593 -2.742 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -10.990 5.338 -2.361 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -10.564 6.562 -1.142 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -7.561 6.543 -1.804 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.053 6.406 -0.099 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -6.993 5.172 -0.821 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.178 4.853 1.228 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.526 5.320 2.534 1.00 0.00 C ATOM 2106 C GLN A 139 -11.221 4.401 3.667 1.00 0.00 C ATOM 2107 O GLN A 139 -10.971 4.820 4.796 1.00 0.00 O ATOM 2108 CB GLN A 139 -12.924 5.945 2.676 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.253 6.921 1.544 1.00 0.00 C ATOM 2110 CD GLN A 139 -14.756 7.157 1.552 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -15.543 6.367 0.774 1.00 0.00 O flip ATOM 2112 NE2 GLN A 139 -15.249 8.054 2.235 1.00 0.00 N flip ATOM 0 H GLN A 139 -11.955 4.673 0.592 1.00 0.00 H new ATOM 0 HA GLN A 139 -10.818 6.144 2.627 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -13.672 5.152 2.695 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -12.989 6.467 3.631 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -12.719 7.861 1.683 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -12.936 6.513 0.584 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -14.650 8.641 2.815 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -16.257 8.210 2.221 1.00 0.00 H new ATOM 2121 N MET A 140 -11.236 3.080 3.417 1.00 0.00 N ATOM 2122 CA MET A 140 -10.759 2.047 4.283 1.00 0.00 C ATOM 2123 C MET A 140 -9.284 1.976 4.487 1.00 0.00 C ATOM 2124 O MET A 140 -8.790 1.794 5.599 1.00 0.00 O ATOM 2125 CB MET A 140 -11.390 0.713 3.849 1.00 0.00 C ATOM 2126 CG MET A 140 -11.003 -0.529 4.653 1.00 0.00 C ATOM 2127 SD MET A 140 -12.113 -1.921 4.286 1.00 0.00 S ATOM 2128 CE MET A 140 -11.807 -2.006 2.498 1.00 0.00 C ATOM 0 H MET A 140 -11.610 2.707 2.544 1.00 0.00 H new ATOM 0 HA MET A 140 -11.088 2.305 5.290 1.00 0.00 H new ATOM 0 HB2 MET A 140 -12.474 0.821 3.892 1.00 0.00 H new ATOM 0 HB3 MET A 140 -11.128 0.537 2.806 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.975 -0.809 4.422 1.00 0.00 H new ATOM 0 HG3 MET A 140 -11.040 -0.302 5.718 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.910 -3.037 2.160 1.00 0.00 H new ATOM 0 HE2 MET A 140 -12.529 -1.378 1.975 1.00 0.00 H new ATOM 0 HE3 MET A 140 -10.798 -1.654 2.284 1.00 0.00 H new ATOM 2138 N MET A 141 -8.499 2.245 3.429 1.00 0.00 N ATOM 2139 CA MET A 141 -7.109 2.552 3.566 1.00 0.00 C ATOM 2140 C MET A 141 -6.601 3.699 4.370 1.00 0.00 C ATOM 2141 O MET A 141 -5.741 3.553 5.237 1.00 0.00 O ATOM 2142 CB MET A 141 -6.407 2.564 2.198 1.00 0.00 C ATOM 2143 CG MET A 141 -6.364 1.194 1.518 1.00 0.00 C ATOM 2144 SD MET A 141 -5.217 0.011 2.287 1.00 0.00 S ATOM 2145 CE MET A 141 -6.534 -1.029 2.982 1.00 0.00 C ATOM 0 H MET A 141 -8.833 2.250 2.465 1.00 0.00 H new ATOM 0 HA MET A 141 -6.852 1.722 4.224 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.919 3.269 1.543 1.00 0.00 H new ATOM 0 HB3 MET A 141 -5.388 2.929 2.325 1.00 0.00 H new ATOM 0 HG2 MET A 141 -7.367 0.767 1.525 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.082 1.329 0.474 1.00 0.00 H new ATOM 0 HE1 MET A 141 -6.144 -2.028 3.176 1.00 0.00 H new ATOM 0 HE2 MET A 141 -6.889 -0.591 3.915 1.00 0.00 H new ATOM 0 HE3 MET A 141 -7.360 -1.093 2.273 1.00 0.00 H new ATOM 2155 N THR A 142 -7.057 4.883 3.923 1.00 0.00 N ATOM 2156 CA THR A 142 -6.702 6.181 4.406 1.00 0.00 C ATOM 2157 C THR A 142 -7.005 6.376 5.884 1.00 0.00 C ATOM 2158 O THR A 142 -8.168 6.633 6.296 1.00 0.00 O ATOM 2159 CB THR A 142 -7.415 7.312 3.725 1.00 0.00 C ATOM 2160 OG1 THR A 142 -8.828 7.180 3.692 1.00 0.00 O ATOM 2161 CG2 THR A 142 -6.981 7.436 2.255 1.00 0.00 C ATOM 0 H THR A 142 -7.731 4.934 3.159 1.00 0.00 H new ATOM 0 HA THR A 142 -5.633 6.211 4.198 1.00 0.00 H new ATOM 0 HB THR A 142 -7.145 8.183 4.322 1.00 0.00 H new ATOM 0 HG1 THR A 142 -9.156 6.952 4.587 1.00 0.00 H new ATOM 0 HG21 THR A 142 -7.514 8.264 1.787 1.00 0.00 H new ATOM 0 HG22 THR A 142 -5.908 7.622 2.207 1.00 0.00 H new ATOM 0 HG23 THR A 142 -7.213 6.511 1.728 1.00 0.00 H new ATOM 2170 N ARG B 1 -8.691 -1.082 12.946 1.00 0.00 N ATOM 2171 CA ARG B 1 -7.864 -1.380 11.755 1.00 0.00 C ATOM 2172 C ARG B 1 -6.864 -2.441 12.061 1.00 0.00 C ATOM 2173 O ARG B 1 -5.975 -2.358 12.907 1.00 0.00 O ATOM 2174 CB ARG B 1 -7.113 -0.104 11.338 1.00 0.00 C ATOM 2175 CG ARG B 1 -7.934 1.036 10.732 1.00 0.00 C ATOM 2176 CD ARG B 1 -7.114 2.163 10.100 1.00 0.00 C ATOM 2177 NE ARG B 1 -8.183 2.842 9.316 1.00 0.00 N ATOM 2178 CZ ARG B 1 -7.886 3.934 8.553 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -6.639 4.476 8.431 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -8.825 4.328 7.644 1.00 0.00 N ATOM 0 H1 ARG B 1 -9.382 -0.340 12.712 1.00 0.00 H new ATOM 0 H2 ARG B 1 -9.194 -1.942 13.243 1.00 0.00 H new ATOM 0 H3 ARG B 1 -8.079 -0.754 13.720 1.00 0.00 H new ATOM 0 HA ARG B 1 -8.516 -1.726 10.953 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -6.597 0.284 12.216 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -6.346 -0.386 10.616 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -8.598 0.621 9.973 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -8.567 1.461 11.511 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -6.661 2.818 10.844 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -6.307 1.790 9.470 1.00 0.00 H new ATOM 0 HE ARG B 1 -9.140 2.490 9.349 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -5.852 4.062 8.930 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -6.494 5.295 7.840 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -9.701 3.812 7.559 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -8.651 5.138 7.050 1.00 0.00 H new ATOM 2193 N ARG B 2 -6.906 -3.485 11.214 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.806 -4.390 11.090 1.00 0.00 C ATOM 2195 C ARG B 2 -5.870 -5.069 9.765 1.00 0.00 C ATOM 2196 O ARG B 2 -5.027 -4.796 8.912 1.00 0.00 O ATOM 2197 CB ARG B 2 -5.639 -5.401 12.237 1.00 0.00 C ATOM 2198 CG ARG B 2 -4.504 -6.415 12.085 1.00 0.00 C ATOM 2199 CD ARG B 2 -3.102 -5.890 11.772 1.00 0.00 C ATOM 2200 NE ARG B 2 -2.807 -4.701 12.620 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.345 -3.478 12.226 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -2.354 -3.147 10.902 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -1.763 -2.593 13.087 1.00 0.00 N ATOM 0 H ARG B 2 -7.702 -3.702 10.615 1.00 0.00 H new ATOM 0 HA ARG B 2 -4.908 -3.777 11.162 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -5.481 -4.846 13.162 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -6.575 -5.949 12.350 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -4.445 -6.990 13.009 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -4.783 -7.111 11.294 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -2.363 -6.670 11.954 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -3.031 -5.623 10.718 1.00 0.00 H new ATOM 0 HE ARG B 2 -2.971 -4.815 13.620 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -2.705 -3.812 10.212 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -2.010 -2.235 10.602 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -1.658 -2.834 14.072 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.433 -1.690 12.745 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.872 -5.940 9.548 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.818 -6.846 8.443 1.00 0.00 C ATOM 2219 C LYS B 3 -6.635 -6.362 7.046 1.00 0.00 C ATOM 2220 O LYS B 3 -5.631 -6.639 6.393 1.00 0.00 O ATOM 2221 CB LYS B 3 -8.065 -7.746 8.411 1.00 0.00 C ATOM 2222 CG LYS B 3 -8.286 -8.625 9.644 1.00 0.00 C ATOM 2223 CD LYS B 3 -9.300 -9.762 9.506 1.00 0.00 C ATOM 2224 CE LYS B 3 -9.838 -10.339 10.816 1.00 0.00 C ATOM 2225 NZ LYS B 3 -10.821 -11.427 10.614 1.00 0.00 N ATOM 0 H LYS B 3 -7.708 -6.017 10.128 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.873 -7.332 8.685 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -8.943 -7.113 8.278 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -8.001 -8.392 7.535 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -7.327 -9.057 9.930 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -8.604 -7.984 10.466 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -10.143 -9.402 8.917 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -8.837 -10.569 8.939 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -9.005 -10.717 11.409 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -10.303 -9.540 11.393 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -11.478 -11.456 11.420 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -11.355 -11.254 9.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -10.322 -12.337 10.541 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.512 -5.453 6.581 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.506 -4.936 5.248 1.00 0.00 C ATOM 2241 C TRP B 4 -6.298 -4.104 4.990 1.00 0.00 C ATOM 2242 O TRP B 4 -5.514 -4.360 4.077 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.718 -4.042 4.937 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.904 -4.733 4.308 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -11.056 -5.253 4.825 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.859 -5.217 2.952 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.867 -5.769 3.849 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.060 -5.904 2.744 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -8.921 -5.192 1.956 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.450 -6.361 1.515 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.423 -5.373 0.689 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -10.647 -5.960 0.474 1.00 0.00 C ATOM 0 H TRP B 4 -8.256 -5.062 7.159 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.527 -5.822 4.614 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -9.046 -3.572 5.864 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.393 -3.242 4.272 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -11.299 -5.257 5.877 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.857 -6.003 3.926 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -7.869 -5.042 2.150 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.319 -6.987 1.374 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -8.840 -5.045 -0.159 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -10.987 -6.110 -0.540 1.00 0.00 H new ATOM 2263 N GLN B 5 -6.032 -3.262 6.005 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.892 -2.402 6.069 1.00 0.00 C ATOM 2265 C GLN B 5 -3.581 -3.104 5.984 1.00 0.00 C ATOM 2266 O GLN B 5 -2.670 -2.561 5.360 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.862 -1.430 7.261 1.00 0.00 C ATOM 2268 CG GLN B 5 -6.075 -0.503 7.164 1.00 0.00 C ATOM 2269 CD GLN B 5 -7.364 -1.035 7.773 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -7.446 -1.942 8.600 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -8.490 -0.527 7.205 1.00 0.00 N ATOM 0 H GLN B 5 -6.641 -3.177 6.819 1.00 0.00 H new ATOM 0 HA GLN B 5 -5.029 -1.809 5.165 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -4.882 -1.982 8.200 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.940 -0.849 7.252 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -5.828 0.441 7.650 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -6.256 -0.281 6.112 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -8.421 0.225 6.519 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -9.404 -0.898 7.464 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.404 -4.252 6.661 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.152 -4.940 6.600 1.00 0.00 C ATOM 2282 C LYS B 6 -1.849 -5.524 5.263 1.00 0.00 C ATOM 2283 O LYS B 6 -0.749 -5.429 4.721 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.287 -6.173 7.510 1.00 0.00 C ATOM 2285 CG LYS B 6 -0.982 -6.955 7.678 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.090 -8.227 8.521 1.00 0.00 C ATOM 2287 CE LYS B 6 -1.980 -9.329 7.942 1.00 0.00 C ATOM 2288 NZ LYS B 6 -2.032 -10.433 8.926 1.00 0.00 N ATOM 0 H LYS B 6 -4.114 -4.698 7.241 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.381 -4.217 6.867 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.639 -5.854 8.491 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.048 -6.836 7.099 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -0.608 -7.224 6.690 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.240 -6.299 8.132 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.088 -8.632 8.666 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -1.470 -7.957 9.506 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -2.981 -8.947 7.744 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -1.580 -9.683 6.992 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.127 -11.340 8.426 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.157 -10.438 9.489 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.848 -10.298 9.556 1.00 0.00 H new ATOM 2302 N THR B 7 -2.883 -6.151 4.673 1.00 0.00 N ATOM 2303 CA THR B 7 -2.898 -6.868 3.436 1.00 0.00 C ATOM 2304 C THR B 7 -2.710 -5.956 2.273 1.00 0.00 C ATOM 2305 O THR B 7 -1.976 -6.319 1.355 1.00 0.00 O ATOM 2306 CB THR B 7 -4.022 -7.859 3.375 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.063 -8.636 4.563 1.00 0.00 O ATOM 2308 CG2 THR B 7 -3.896 -8.727 2.111 1.00 0.00 C ATOM 0 H THR B 7 -3.804 -6.154 5.112 1.00 0.00 H new ATOM 0 HA THR B 7 -2.023 -7.515 3.373 1.00 0.00 H new ATOM 0 HB THR B 7 -4.971 -7.326 3.309 1.00 0.00 H new ATOM 0 HG1 THR B 7 -4.521 -8.132 5.268 1.00 0.00 H new ATOM 0 HG21 THR B 7 -4.717 -9.443 2.078 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.933 -8.090 1.227 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.948 -9.264 2.131 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.406 -4.805 2.285 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.330 -3.672 1.416 1.00 0.00 C ATOM 2318 C GLY B 8 -1.959 -3.099 1.302 1.00 0.00 C ATOM 2319 O GLY B 8 -1.586 -2.603 0.240 1.00 0.00 O ATOM 0 H GLY B 8 -4.115 -4.654 3.002 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.678 -3.961 0.424 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -4.008 -2.900 1.779 1.00 0.00 H new ATOM 2323 N HIS B 9 -1.180 -3.208 2.392 1.00 0.00 N ATOM 2324 CA HIS B 9 0.128 -2.660 2.584 1.00 0.00 C ATOM 2325 C HIS B 9 1.071 -3.527 1.822 1.00 0.00 C ATOM 2326 O HIS B 9 1.997 -3.012 1.198 1.00 0.00 O ATOM 2327 CB HIS B 9 0.648 -2.708 4.030 1.00 0.00 C ATOM 2328 CG HIS B 9 1.762 -1.767 4.382 1.00 0.00 C ATOM 2329 ND1 HIS B 9 1.690 -0.683 5.233 1.00 0.00 N ATOM 2330 CD2 HIS B 9 3.076 -1.903 4.060 1.00 0.00 C ATOM 2331 CE1 HIS B 9 2.943 -0.177 5.380 1.00 0.00 C ATOM 2332 NE2 HIS B 9 3.800 -0.921 4.705 1.00 0.00 N ATOM 0 H HIS B 9 -1.495 -3.726 3.212 1.00 0.00 H new ATOM 0 HA HIS B 9 0.068 -1.616 2.275 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -0.189 -2.508 4.698 1.00 0.00 H new ATOM 0 HB3 HIS B 9 0.984 -3.724 4.236 1.00 0.00 H new ATOM 0 HD2 HIS B 9 3.487 -2.657 3.405 1.00 0.00 H new ATOM 0 HE1 HIS B 9 3.198 0.698 5.959 1.00 0.00 H new ATOM 0 HE2 HIS B 9 4.811 -0.793 4.667 1.00 0.00 H new ATOM 2340 N ALA B 10 0.860 -4.855 1.867 1.00 0.00 N ATOM 2341 CA ALA B 10 1.620 -5.767 1.069 1.00 0.00 C ATOM 2342 C ALA B 10 1.493 -5.543 -0.398 1.00 0.00 C ATOM 2343 O ALA B 10 2.486 -5.699 -1.107 1.00 0.00 O ATOM 2344 CB ALA B 10 1.296 -7.166 1.618 1.00 0.00 C ATOM 0 H ALA B 10 0.159 -5.299 2.460 1.00 0.00 H new ATOM 0 HA ALA B 10 2.695 -5.609 1.160 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.847 -7.916 1.050 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.585 -7.221 2.668 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.226 -7.354 1.526 1.00 0.00 H new ATOM 2350 N VAL B 11 0.272 -5.284 -0.901 1.00 0.00 N ATOM 2351 CA VAL B 11 0.025 -4.929 -2.264 1.00 0.00 C ATOM 2352 C VAL B 11 0.600 -3.618 -2.676 1.00 0.00 C ATOM 2353 O VAL B 11 1.213 -3.535 -3.739 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.432 -4.913 -2.620 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -1.746 -4.657 -4.103 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.036 -6.291 -2.298 1.00 0.00 C ATOM 0 H VAL B 11 -0.576 -5.324 -0.336 1.00 0.00 H new ATOM 0 HA VAL B 11 0.536 -5.724 -2.808 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.850 -4.088 -2.042 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -2.826 -4.666 -4.253 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -1.346 -3.687 -4.397 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -1.289 -5.437 -4.712 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.096 -6.292 -2.553 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.523 -7.058 -2.878 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.918 -6.501 -1.235 1.00 0.00 H new ATOM 2366 N ARG B 12 0.372 -2.592 -1.836 1.00 0.00 N ATOM 2367 CA ARG B 12 0.953 -1.288 -1.924 1.00 0.00 C ATOM 2368 C ARG B 12 2.441 -1.268 -2.007 1.00 0.00 C ATOM 2369 O ARG B 12 3.072 -0.632 -2.850 1.00 0.00 O ATOM 2370 CB ARG B 12 0.547 -0.434 -0.711 1.00 0.00 C ATOM 2371 CG ARG B 12 -0.845 0.171 -0.903 1.00 0.00 C ATOM 2372 CD ARG B 12 -1.450 0.851 0.326 1.00 0.00 C ATOM 2373 NE ARG B 12 -0.554 1.950 0.785 1.00 0.00 N ATOM 2374 CZ ARG B 12 0.164 2.013 1.944 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -0.267 1.451 3.111 1.00 0.00 N ATOM 2376 NH2 ARG B 12 1.240 2.853 1.935 1.00 0.00 N ATOM 0 H ARG B 12 -0.262 -2.681 -1.042 1.00 0.00 H new ATOM 0 HA ARG B 12 0.567 -0.884 -2.860 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.559 -1.048 0.190 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.276 0.363 -0.563 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -0.795 0.901 -1.711 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -1.522 -0.619 -1.228 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -2.436 1.249 0.085 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -1.587 0.123 1.126 1.00 0.00 H new ATOM 0 HE ARG B 12 -0.467 2.750 0.158 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -1.160 0.959 3.141 1.00 0.00 H new ATOM 0 HH12 ARG B 12 0.304 1.523 3.953 1.00 0.00 H new ATOM 0 HH21 ARG B 12 1.464 3.386 1.095 1.00 0.00 H new ATOM 0 HH22 ARG B 12 1.820 2.948 2.769 1.00 0.00 H new ATOM 2390 N ALA B 13 3.107 -2.005 -1.101 1.00 0.00 N ATOM 2391 CA ALA B 13 4.522 -1.994 -0.894 1.00 0.00 C ATOM 2392 C ALA B 13 5.152 -2.767 -2.002 1.00 0.00 C ATOM 2393 O ALA B 13 6.184 -2.301 -2.482 1.00 0.00 O ATOM 2394 CB ALA B 13 4.872 -2.553 0.495 1.00 0.00 C ATOM 0 H ALA B 13 2.626 -2.649 -0.473 1.00 0.00 H new ATOM 0 HA ALA B 13 4.910 -0.976 -0.912 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.953 -2.536 0.632 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.399 -1.941 1.263 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.512 -3.579 0.576 1.00 0.00 H new ATOM 2400 N ILE B 14 4.590 -3.905 -2.446 1.00 0.00 N ATOM 2401 CA ILE B 14 5.108 -4.630 -3.564 1.00 0.00 C ATOM 2402 C ILE B 14 4.908 -3.916 -4.857 1.00 0.00 C ATOM 2403 O ILE B 14 5.611 -3.947 -5.866 1.00 0.00 O ATOM 2404 CB ILE B 14 4.582 -6.035 -3.593 1.00 0.00 C ATOM 2405 CG1 ILE B 14 5.441 -6.993 -4.436 1.00 0.00 C ATOM 2406 CG2 ILE B 14 3.099 -6.197 -3.966 1.00 0.00 C ATOM 2407 CD1 ILE B 14 6.964 -6.872 -4.390 1.00 0.00 C ATOM 0 H ILE B 14 3.764 -4.328 -2.023 1.00 0.00 H new ATOM 0 HA ILE B 14 6.188 -4.693 -3.430 1.00 0.00 H new ATOM 0 HB ILE B 14 4.657 -6.318 -2.543 1.00 0.00 H new ATOM 0 HG12 ILE B 14 5.184 -8.010 -4.139 1.00 0.00 H new ATOM 0 HG13 ILE B 14 5.135 -6.878 -5.476 1.00 0.00 H new ATOM 0 HG21 ILE B 14 2.834 -7.254 -3.954 1.00 0.00 H new ATOM 0 HG22 ILE B 14 2.482 -5.660 -3.246 1.00 0.00 H new ATOM 0 HG23 ILE B 14 2.928 -5.792 -4.963 1.00 0.00 H new ATOM 0 HD11 ILE B 14 7.409 -7.623 -5.043 1.00 0.00 H new ATOM 0 HD12 ILE B 14 7.260 -5.878 -4.726 1.00 0.00 H new ATOM 0 HD13 ILE B 14 7.311 -7.028 -3.368 1.00 0.00 H new ATOM 2419 N GLY B 15 3.875 -3.073 -5.031 1.00 0.00 N ATOM 2420 CA GLY B 15 3.690 -2.010 -5.969 1.00 0.00 C ATOM 2421 C GLY B 15 4.708 -0.922 -6.007 1.00 0.00 C ATOM 2422 O GLY B 15 5.071 -0.518 -7.110 1.00 0.00 O ATOM 0 H GLY B 15 3.058 -3.153 -4.426 1.00 0.00 H new ATOM 0 HA2 GLY B 15 3.635 -2.450 -6.965 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.721 -1.553 -5.768 1.00 0.00 H new ATOM 2426 N ARG B 16 5.187 -0.398 -4.865 1.00 0.00 N ATOM 2427 CA ARG B 16 6.142 0.659 -4.739 1.00 0.00 C ATOM 2428 C ARG B 16 7.543 0.175 -4.885 1.00 0.00 C ATOM 2429 O ARG B 16 8.411 0.973 -5.235 1.00 0.00 O ATOM 2430 CB ARG B 16 5.903 1.363 -3.393 1.00 0.00 C ATOM 2431 CG ARG B 16 4.758 2.378 -3.427 1.00 0.00 C ATOM 2432 CD ARG B 16 4.314 2.845 -2.039 1.00 0.00 C ATOM 2433 NE ARG B 16 5.290 3.762 -1.385 1.00 0.00 N ATOM 2434 CZ ARG B 16 4.925 4.714 -0.477 1.00 0.00 C ATOM 2435 NH1 ARG B 16 3.655 4.802 0.014 1.00 0.00 N ATOM 2436 NH2 ARG B 16 5.899 5.577 -0.064 1.00 0.00 N ATOM 0 H ARG B 16 4.880 -0.743 -3.956 1.00 0.00 H new ATOM 0 HA ARG B 16 6.004 1.373 -5.551 1.00 0.00 H new ATOM 0 HB2 ARG B 16 5.689 0.612 -2.633 1.00 0.00 H new ATOM 0 HB3 ARG B 16 6.819 1.871 -3.091 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.068 3.244 -4.011 1.00 0.00 H new ATOM 0 HG3 ARG B 16 3.906 1.935 -3.942 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.352 3.350 -2.124 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.161 1.974 -1.402 1.00 0.00 H new ATOM 0 HE ARG B 16 6.277 3.674 -1.627 1.00 0.00 H new ATOM 0 HH11 ARG B 16 2.941 4.143 -0.297 1.00 0.00 H new ATOM 0 HH12 ARG B 16 3.419 5.527 0.692 1.00 0.00 H new ATOM 0 HH21 ARG B 16 6.846 5.491 -0.433 1.00 0.00 H new ATOM 0 HH22 ARG B 16 5.680 6.307 0.613 1.00 0.00 H new