USER MOD reduce.3.24.130724 H: found=0, std=0, add=675, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 677 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 81 MET CE :methyl -107:sc= -0.96 (180deg=-2.26) USER MOD Set 1.2: A 153 MET CE :methyl -112:sc= -7.64! (180deg=-12.8!) USER MOD Set 2.1: A 69 SER OG : rot -153:sc= -3.12! USER MOD Set 2.2: A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.208 K(o=-0.21,f=-2!) USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.267 USER MOD Single : A 16 GLN : amide:sc= -3.3! C(o=-3.3!,f=-4.1!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc= -0.98 K(o=-0.98,f=-2.7!) USER MOD Single : A 21 LYS NZ :NH3+ -119:sc= -0.0643 (180deg=-0.277!) USER MOD Single : A 35 SER OG : rot -104:sc= -0.27 USER MOD Single : A 37 SER OG : rot -88:sc= -1.37! USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.0354 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 136:sc= 0.0076 (180deg=-0.874) USER MOD Single : A 45 MET CE :methyl -174:sc= -1.19 (180deg=-1.32) USER MOD Single : A 47 MET CE :methyl -151:sc= -1.54! (180deg=-3.34!) USER MOD Single : A 50 GLN : amide:sc= -0.965 X(o=-0.96,f=-0.5) USER MOD Single : A 51 ASN : amide:sc= -4.97! C(o=-5!,f=-5.9!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -0.039 K(o=-0.039,f=-1.7!) USER MOD Single : A 60 MET CE :methyl -175:sc= -19.5! (180deg=-20.4!) USER MOD Single : A 80 MET CE :methyl -116:sc= -2.32 (180deg=-4.11!) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 154 MET CE :methyl -135:sc= -12.2! (180deg=-19.9!) USER MOD Single : A 155 GLN : amide:sc= -1.82! K(o=-1.8!,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 44 N ILE A 4 -8.322 5.672 12.383 1.00 0.00 N ATOM 45 CA ILE A 4 -9.278 5.815 11.299 1.00 0.00 C ATOM 46 C ILE A 4 -9.110 7.185 10.643 1.00 0.00 C ATOM 47 O ILE A 4 -9.040 7.302 9.420 1.00 0.00 O ATOM 48 CB ILE A 4 -10.700 5.661 11.844 1.00 0.00 C ATOM 49 CG1 ILE A 4 -11.703 5.760 10.686 1.00 0.00 C ATOM 50 CG2 ILE A 4 -10.970 6.752 12.889 1.00 0.00 C ATOM 51 CD1 ILE A 4 -12.069 7.222 10.441 1.00 0.00 C ATOM 0 HA ILE A 4 -9.100 5.041 10.552 1.00 0.00 H new ATOM 0 HB ILE A 4 -10.811 4.687 12.321 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -11.273 5.327 9.783 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -12.599 5.186 10.919 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -11.983 6.642 13.277 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -10.256 6.657 13.707 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -10.863 7.733 12.426 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -12.781 7.286 9.618 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -12.517 7.641 11.342 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -11.170 7.785 10.188 1.00 0.00 H new ATOM 63 N TYR A 5 -9.019 8.220 11.463 1.00 0.00 N ATOM 64 CA TYR A 5 -8.836 9.563 10.940 1.00 0.00 C ATOM 65 C TYR A 5 -7.427 9.702 10.384 1.00 0.00 C ATOM 66 O TYR A 5 -7.182 10.461 9.447 1.00 0.00 O ATOM 67 CB TYR A 5 -9.082 10.598 12.039 1.00 0.00 C ATOM 68 CG TYR A 5 -10.531 10.530 12.485 1.00 0.00 C ATOM 69 CD1 TYR A 5 -10.903 11.022 13.739 1.00 0.00 C ATOM 70 CD2 TYR A 5 -11.501 9.968 11.643 1.00 0.00 C ATOM 71 CE1 TYR A 5 -12.237 10.953 14.150 1.00 0.00 C ATOM 72 CE2 TYR A 5 -12.839 9.901 12.058 1.00 0.00 C ATOM 73 CZ TYR A 5 -13.207 10.395 13.313 1.00 0.00 C ATOM 74 OH TYR A 5 -14.523 10.331 13.723 1.00 0.00 O ATOM 0 H TYR A 5 -9.068 8.158 12.480 1.00 0.00 H new ATOM 0 HA TYR A 5 -9.554 9.739 10.139 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -8.421 10.409 12.885 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -8.851 11.597 11.670 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -10.159 11.456 14.391 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -11.217 9.586 10.673 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -12.520 11.333 15.120 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -13.585 9.468 11.408 1.00 0.00 H new ATOM 0 HH TYR A 5 -15.065 9.915 13.020 1.00 0.00 H new ATOM 84 N LYS A 6 -6.505 8.951 10.967 1.00 0.00 N ATOM 85 CA LYS A 6 -5.127 8.988 10.517 1.00 0.00 C ATOM 86 C LYS A 6 -5.080 8.596 9.045 1.00 0.00 C ATOM 87 O LYS A 6 -4.444 9.260 8.218 1.00 0.00 O ATOM 88 CB LYS A 6 -4.277 8.019 11.365 1.00 0.00 C ATOM 89 CG LYS A 6 -2.816 8.093 10.909 1.00 0.00 C ATOM 90 CD LYS A 6 -2.117 9.252 11.626 1.00 0.00 C ATOM 91 CE LYS A 6 -2.204 10.511 10.761 1.00 0.00 C ATOM 92 NZ LYS A 6 -0.912 10.709 10.038 1.00 0.00 N1+ ATOM 0 H LYS A 6 -6.685 8.316 11.744 1.00 0.00 H new ATOM 0 HA LYS A 6 -4.720 9.993 10.634 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -4.354 8.279 12.421 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -4.652 7.001 11.259 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -2.307 7.155 11.129 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.767 8.236 9.830 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.584 9.430 12.595 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.074 9.000 11.817 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -3.022 10.419 10.047 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -2.421 11.379 11.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -0.971 11.565 9.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.141 10.815 10.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.723 9.885 9.432 1.00 0.00 H new ATOM 106 N ALA A 7 -5.799 7.533 8.726 1.00 0.00 N ATOM 107 CA ALA A 7 -5.888 7.066 7.356 1.00 0.00 C ATOM 108 C ALA A 7 -6.572 8.124 6.509 1.00 0.00 C ATOM 109 O ALA A 7 -6.244 8.311 5.337 1.00 0.00 O ATOM 110 CB ALA A 7 -6.654 5.740 7.297 1.00 0.00 C ATOM 0 H ALA A 7 -6.329 6.978 9.398 1.00 0.00 H new ATOM 0 HA ALA A 7 -4.886 6.893 6.963 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -6.714 5.400 6.263 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -6.133 4.992 7.895 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -7.660 5.883 7.691 1.00 0.00 H new ATOM 116 N ALA A 8 -7.525 8.819 7.119 1.00 0.00 N ATOM 117 CA ALA A 8 -8.258 9.866 6.424 1.00 0.00 C ATOM 118 C ALA A 8 -7.289 10.922 5.911 1.00 0.00 C ATOM 119 O ALA A 8 -7.430 11.420 4.794 1.00 0.00 O ATOM 120 CB ALA A 8 -9.262 10.535 7.382 1.00 0.00 C ATOM 0 H ALA A 8 -7.806 8.676 8.089 1.00 0.00 H new ATOM 0 HA ALA A 8 -8.794 9.418 5.587 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.805 11.317 6.852 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -9.967 9.789 7.750 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.725 10.973 8.224 1.00 0.00 H new ATOM 126 N VAL A 9 -6.301 11.255 6.732 1.00 0.00 N ATOM 127 CA VAL A 9 -5.317 12.252 6.344 1.00 0.00 C ATOM 128 C VAL A 9 -4.550 11.749 5.124 1.00 0.00 C ATOM 129 O VAL A 9 -4.350 12.477 4.151 1.00 0.00 O ATOM 130 CB VAL A 9 -4.344 12.511 7.501 1.00 0.00 C ATOM 131 CG1 VAL A 9 -3.247 13.483 7.051 1.00 0.00 C ATOM 132 CG2 VAL A 9 -5.102 13.103 8.689 1.00 0.00 C ATOM 0 H VAL A 9 -6.162 10.854 7.659 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.824 13.185 6.099 1.00 0.00 H new ATOM 0 HB VAL A 9 -3.885 11.569 7.800 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -2.559 13.663 7.877 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.701 13.052 6.212 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.700 14.426 6.744 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -4.408 13.286 9.509 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.568 14.043 8.392 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.872 12.403 9.014 1.00 0.00 H new ATOM 142 N GLU A 10 -4.142 10.482 5.188 1.00 0.00 N ATOM 143 CA GLU A 10 -3.415 9.851 4.088 1.00 0.00 C ATOM 144 C GLU A 10 -4.339 9.637 2.893 1.00 0.00 C ATOM 145 O GLU A 10 -3.891 9.587 1.746 1.00 0.00 O ATOM 146 CB GLU A 10 -2.810 8.516 4.531 1.00 0.00 C ATOM 147 CG GLU A 10 -2.022 7.926 3.366 1.00 0.00 C ATOM 148 CD GLU A 10 -1.398 6.596 3.773 1.00 0.00 C ATOM 149 OE1 GLU A 10 -1.508 6.246 4.936 1.00 0.00 O ATOM 150 OE2 GLU A 10 -0.826 5.945 2.914 1.00 0.00 O1- ATOM 0 H GLU A 10 -4.303 9.873 5.990 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.604 10.516 3.792 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -2.158 8.664 5.392 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -3.597 7.829 4.841 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -2.680 7.780 2.509 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -1.243 8.622 3.055 1.00 0.00 H new ATOM 157 N GLN A 11 -5.628 9.502 3.177 1.00 0.00 N ATOM 158 CA GLN A 11 -6.623 9.283 2.135 1.00 0.00 C ATOM 159 C GLN A 11 -6.795 10.536 1.287 1.00 0.00 C ATOM 160 O GLN A 11 -6.971 10.451 0.071 1.00 0.00 O ATOM 161 CB GLN A 11 -7.960 8.909 2.775 1.00 0.00 C ATOM 162 CG GLN A 11 -7.928 7.450 3.232 1.00 0.00 C ATOM 163 CD GLN A 11 -8.240 6.527 2.056 1.00 0.00 C ATOM 164 OE1 GLN A 11 -7.410 6.352 1.164 1.00 0.00 O ATOM 165 NE2 GLN A 11 -9.397 5.924 2.001 1.00 0.00 N ATOM 0 H GLN A 11 -6.010 9.540 4.122 1.00 0.00 H new ATOM 0 HA GLN A 11 -6.283 8.471 1.492 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -8.161 9.561 3.625 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -8.769 9.058 2.060 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -6.947 7.210 3.643 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -8.654 7.294 4.030 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -10.084 6.070 2.741 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -9.614 5.307 1.218 1.00 0.00 H new ATOM 174 N LEU A 12 -6.742 11.698 1.927 1.00 0.00 N ATOM 175 CA LEU A 12 -6.897 12.949 1.198 1.00 0.00 C ATOM 176 C LEU A 12 -5.861 13.042 0.080 1.00 0.00 C ATOM 177 O LEU A 12 -4.665 12.869 0.313 1.00 0.00 O ATOM 178 CB LEU A 12 -6.735 14.148 2.144 1.00 0.00 C ATOM 179 CG LEU A 12 -7.777 14.077 3.263 1.00 0.00 C ATOM 180 CD1 LEU A 12 -7.841 15.417 3.996 1.00 0.00 C ATOM 181 CD2 LEU A 12 -9.141 13.743 2.655 1.00 0.00 C ATOM 0 H LEU A 12 -6.596 11.800 2.931 1.00 0.00 H new ATOM 0 HA LEU A 12 -7.898 12.969 0.766 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -5.732 14.153 2.570 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.849 15.078 1.588 1.00 0.00 H new ATOM 0 HG LEU A 12 -7.499 13.302 3.977 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -8.584 15.361 4.792 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -6.865 15.643 4.426 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -8.119 16.203 3.294 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.889 13.691 3.446 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -9.421 14.518 1.942 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -9.086 12.782 2.144 1.00 0.00 H new ATOM 193 N THR A 13 -6.334 13.326 -1.132 1.00 0.00 N ATOM 194 CA THR A 13 -5.445 13.449 -2.284 1.00 0.00 C ATOM 195 C THR A 13 -4.493 14.615 -2.086 1.00 0.00 C ATOM 196 O THR A 13 -4.545 15.303 -1.067 1.00 0.00 O ATOM 197 CB THR A 13 -6.264 13.663 -3.559 1.00 0.00 C ATOM 198 OG1 THR A 13 -5.393 13.701 -4.683 1.00 0.00 O ATOM 199 CG2 THR A 13 -7.022 14.982 -3.451 1.00 0.00 C ATOM 0 H THR A 13 -7.321 13.474 -1.341 1.00 0.00 H new ATOM 0 HA THR A 13 -4.868 12.529 -2.380 1.00 0.00 H new ATOM 0 HB THR A 13 -6.973 12.844 -3.683 1.00 0.00 H new ATOM 0 HG1 THR A 13 -5.918 13.836 -5.499 1.00 0.00 H new ATOM 0 HG21 THR A 13 -7.608 15.140 -4.357 1.00 0.00 H new ATOM 0 HG22 THR A 13 -7.688 14.949 -2.589 1.00 0.00 H new ATOM 0 HG23 THR A 13 -6.312 15.801 -3.330 1.00 0.00 H new ATOM 207 N GLU A 14 -3.622 14.827 -3.060 1.00 0.00 N ATOM 208 CA GLU A 14 -2.661 15.911 -2.975 1.00 0.00 C ATOM 209 C GLU A 14 -3.378 17.254 -2.897 1.00 0.00 C ATOM 210 O GLU A 14 -2.981 18.137 -2.138 1.00 0.00 O ATOM 211 CB GLU A 14 -1.755 15.891 -4.201 1.00 0.00 C ATOM 212 CG GLU A 14 -0.844 14.662 -4.159 1.00 0.00 C ATOM 213 CD GLU A 14 0.173 14.808 -3.033 1.00 0.00 C ATOM 214 OE1 GLU A 14 0.301 15.906 -2.515 1.00 0.00 O ATOM 215 OE2 GLU A 14 0.812 13.821 -2.706 1.00 0.00 O1- ATOM 0 H GLU A 14 -3.562 14.267 -3.911 1.00 0.00 H new ATOM 0 HA GLU A 14 -2.063 15.777 -2.074 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -2.358 15.876 -5.109 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -1.153 16.799 -4.233 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -1.440 13.762 -4.008 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -0.329 14.547 -5.113 1.00 0.00 H new ATOM 222 N GLU A 15 -4.434 17.407 -3.684 1.00 0.00 N ATOM 223 CA GLU A 15 -5.188 18.654 -3.688 1.00 0.00 C ATOM 224 C GLU A 15 -5.958 18.827 -2.382 1.00 0.00 C ATOM 225 O GLU A 15 -6.013 19.923 -1.825 1.00 0.00 O ATOM 226 CB GLU A 15 -6.177 18.659 -4.842 1.00 0.00 C ATOM 227 CG GLU A 15 -6.748 20.066 -5.014 1.00 0.00 C ATOM 228 CD GLU A 15 -7.690 20.100 -6.215 1.00 0.00 C ATOM 229 OE1 GLU A 15 -7.834 19.072 -6.857 1.00 0.00 O ATOM 230 OE2 GLU A 15 -8.251 21.151 -6.474 1.00 0.00 O1- ATOM 0 H GLU A 15 -4.786 16.692 -4.321 1.00 0.00 H new ATOM 0 HA GLU A 15 -4.479 19.475 -3.798 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -5.683 18.340 -5.760 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -6.981 17.949 -4.649 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -7.283 20.364 -4.112 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -5.938 20.782 -5.155 1.00 0.00 H new ATOM 237 N GLN A 16 -6.565 17.738 -1.904 1.00 0.00 N ATOM 238 CA GLN A 16 -7.342 17.795 -0.669 1.00 0.00 C ATOM 239 C GLN A 16 -6.461 18.185 0.510 1.00 0.00 C ATOM 240 O GLN A 16 -6.842 19.015 1.336 1.00 0.00 O ATOM 241 CB GLN A 16 -7.988 16.435 -0.384 1.00 0.00 C ATOM 242 CG GLN A 16 -9.125 16.181 -1.373 1.00 0.00 C ATOM 243 CD GLN A 16 -9.745 14.805 -1.126 1.00 0.00 C ATOM 244 OE1 GLN A 16 -10.235 14.532 -0.030 1.00 0.00 O ATOM 245 NE2 GLN A 16 -9.751 13.914 -2.082 1.00 0.00 N ATOM 0 H GLN A 16 -6.533 16.820 -2.347 1.00 0.00 H new ATOM 0 HA GLN A 16 -8.118 18.550 -0.798 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -7.242 15.644 -0.464 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -8.370 16.411 0.637 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -9.886 16.954 -1.269 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -8.748 16.240 -2.394 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -9.346 14.138 -2.991 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -10.161 12.994 -1.919 1.00 0.00 H new ATOM 254 N LYS A 17 -5.277 17.593 0.576 1.00 0.00 N ATOM 255 CA LYS A 17 -4.353 17.899 1.654 1.00 0.00 C ATOM 256 C LYS A 17 -3.777 19.292 1.459 1.00 0.00 C ATOM 257 O LYS A 17 -3.450 19.977 2.424 1.00 0.00 O ATOM 258 CB LYS A 17 -3.229 16.863 1.694 1.00 0.00 C ATOM 259 CG LYS A 17 -3.249 16.130 3.039 1.00 0.00 C ATOM 260 CD LYS A 17 -2.183 15.032 3.035 1.00 0.00 C ATOM 261 CE LYS A 17 -2.657 13.859 2.175 1.00 0.00 C ATOM 262 NZ LYS A 17 -1.688 12.731 2.292 1.00 0.00 N1+ ATOM 0 H LYS A 17 -4.938 16.906 -0.097 1.00 0.00 H new ATOM 0 HA LYS A 17 -4.890 17.867 2.602 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -3.350 16.150 0.879 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -2.266 17.352 1.550 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -3.061 16.832 3.851 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.233 15.696 3.215 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -1.244 15.425 2.646 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -1.990 14.695 4.053 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -3.647 13.536 2.496 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -2.745 14.170 1.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -2.011 11.934 1.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -0.751 13.043 1.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -1.626 12.429 3.285 1.00 0.00 H new ATOM 276 N ASN A 18 -3.659 19.711 0.202 1.00 0.00 N ATOM 277 CA ASN A 18 -3.126 21.032 -0.097 1.00 0.00 C ATOM 278 C ASN A 18 -4.027 22.113 0.500 1.00 0.00 C ATOM 279 O ASN A 18 -3.553 23.020 1.181 1.00 0.00 O ATOM 280 CB ASN A 18 -3.043 21.225 -1.615 1.00 0.00 C ATOM 281 CG ASN A 18 -2.362 22.552 -1.939 1.00 0.00 C ATOM 282 OD1 ASN A 18 -2.163 23.382 -1.052 1.00 0.00 O ATOM 283 ND2 ASN A 18 -1.992 22.803 -3.167 1.00 0.00 N ATOM 0 H ASN A 18 -3.922 19.161 -0.616 1.00 0.00 H new ATOM 0 HA ASN A 18 -2.130 21.114 0.339 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -2.486 20.403 -2.064 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -4.044 21.206 -2.047 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -1.537 23.688 -3.392 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -2.158 22.114 -3.901 1.00 0.00 H new ATOM 290 N GLU A 19 -5.332 22.001 0.253 1.00 0.00 N ATOM 291 CA GLU A 19 -6.279 22.972 0.791 1.00 0.00 C ATOM 292 C GLU A 19 -6.274 22.930 2.313 1.00 0.00 C ATOM 293 O GLU A 19 -6.236 23.966 2.986 1.00 0.00 O ATOM 294 CB GLU A 19 -7.689 22.674 0.258 1.00 0.00 C ATOM 295 CG GLU A 19 -7.833 23.217 -1.159 1.00 0.00 C ATOM 296 CD GLU A 19 -9.025 22.564 -1.856 1.00 0.00 C ATOM 297 OE1 GLU A 19 -9.770 21.866 -1.188 1.00 0.00 O ATOM 298 OE2 GLU A 19 -9.173 22.767 -3.052 1.00 0.00 O1- ATOM 0 H GLU A 19 -5.751 21.259 -0.308 1.00 0.00 H new ATOM 0 HA GLU A 19 -5.980 23.970 0.471 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.870 21.599 0.265 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -8.437 23.128 0.909 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -7.967 24.298 -1.130 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -6.921 23.024 -1.725 1.00 0.00 H new ATOM 305 N PHE A 20 -6.289 21.720 2.853 1.00 0.00 N ATOM 306 CA PHE A 20 -6.271 21.550 4.293 1.00 0.00 C ATOM 307 C PHE A 20 -4.927 22.004 4.846 1.00 0.00 C ATOM 308 O PHE A 20 -4.848 22.595 5.923 1.00 0.00 O ATOM 309 CB PHE A 20 -6.527 20.078 4.661 1.00 0.00 C ATOM 310 CG PHE A 20 -7.975 19.729 4.387 1.00 0.00 C ATOM 311 CD1 PHE A 20 -8.295 18.683 3.508 1.00 0.00 C ATOM 312 CD2 PHE A 20 -8.997 20.459 5.004 1.00 0.00 C ATOM 313 CE1 PHE A 20 -9.636 18.370 3.251 1.00 0.00 C ATOM 314 CE2 PHE A 20 -10.339 20.144 4.748 1.00 0.00 C ATOM 315 CZ PHE A 20 -10.657 19.100 3.872 1.00 0.00 C ATOM 0 H PHE A 20 -6.313 20.851 2.319 1.00 0.00 H new ATOM 0 HA PHE A 20 -7.062 22.158 4.732 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -5.870 19.429 4.082 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -6.295 19.910 5.713 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -7.508 18.119 3.030 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.752 21.266 5.678 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -9.882 17.566 2.574 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -11.127 20.707 5.227 1.00 0.00 H new ATOM 0 HZ PHE A 20 -11.691 18.857 3.675 1.00 0.00 H new ATOM 325 N LYS A 21 -3.873 21.729 4.092 1.00 0.00 N ATOM 326 CA LYS A 21 -2.535 22.113 4.503 1.00 0.00 C ATOM 327 C LYS A 21 -2.453 23.625 4.647 1.00 0.00 C ATOM 328 O LYS A 21 -1.834 24.138 5.580 1.00 0.00 O ATOM 329 CB LYS A 21 -1.507 21.632 3.474 1.00 0.00 C ATOM 330 CG LYS A 21 -0.093 21.923 3.985 1.00 0.00 C ATOM 331 CD LYS A 21 0.179 21.058 5.213 1.00 0.00 C ATOM 332 CE LYS A 21 1.678 21.063 5.527 1.00 0.00 C ATOM 333 NZ LYS A 21 2.098 22.433 5.943 1.00 0.00 N1+ ATOM 0 H LYS A 21 -3.920 21.243 3.196 1.00 0.00 H new ATOM 0 HA LYS A 21 -2.315 21.649 5.464 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.628 20.563 3.297 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -1.670 22.134 2.520 1.00 0.00 H new ATOM 0 HG2 LYS A 21 0.640 21.712 3.206 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.006 22.978 4.238 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.382 21.436 6.067 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -0.161 20.038 5.034 1.00 0.00 H new ATOM 0 HE2 LYS A 21 1.896 20.348 6.321 1.00 0.00 H new ATOM 0 HE3 LYS A 21 2.244 20.749 4.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 2.812 22.794 5.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.272 23.065 5.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 2.503 22.396 6.900 1.00 0.00 H new ATOM 347 N ALA A 22 -3.087 24.333 3.716 1.00 0.00 N ATOM 348 CA ALA A 22 -3.087 25.786 3.748 1.00 0.00 C ATOM 349 C ALA A 22 -3.719 26.272 5.044 1.00 0.00 C ATOM 350 O ALA A 22 -3.214 27.190 5.688 1.00 0.00 O ATOM 351 CB ALA A 22 -3.883 26.328 2.560 1.00 0.00 C ATOM 0 H ALA A 22 -3.603 23.924 2.937 1.00 0.00 H new ATOM 0 HA ALA A 22 -2.059 26.144 3.690 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -3.881 27.418 2.587 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -3.427 25.987 1.631 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.910 25.966 2.614 1.00 0.00 H new ATOM 357 N ALA A 23 -4.821 25.637 5.426 1.00 0.00 N ATOM 358 CA ALA A 23 -5.501 26.004 6.661 1.00 0.00 C ATOM 359 C ALA A 23 -4.568 25.793 7.847 1.00 0.00 C ATOM 360 O ALA A 23 -4.533 26.600 8.773 1.00 0.00 O ATOM 361 CB ALA A 23 -6.769 25.166 6.842 1.00 0.00 C ATOM 0 H ALA A 23 -5.258 24.876 4.906 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.782 27.056 6.606 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -7.265 25.452 7.769 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -7.442 25.338 6.002 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.504 24.110 6.884 1.00 0.00 H new ATOM 367 N PHE A 24 -3.806 24.706 7.802 1.00 0.00 N ATOM 368 CA PHE A 24 -2.870 24.404 8.877 1.00 0.00 C ATOM 369 C PHE A 24 -1.898 25.563 9.086 1.00 0.00 C ATOM 370 O PHE A 24 -1.693 26.022 10.211 1.00 0.00 O ATOM 371 CB PHE A 24 -2.085 23.133 8.547 1.00 0.00 C ATOM 372 CG PHE A 24 -0.805 23.098 9.357 1.00 0.00 C ATOM 373 CD1 PHE A 24 -0.839 22.898 10.745 1.00 0.00 C ATOM 374 CD2 PHE A 24 0.423 23.272 8.707 1.00 0.00 C ATOM 375 CE1 PHE A 24 0.357 22.875 11.477 1.00 0.00 C ATOM 376 CE2 PHE A 24 1.615 23.247 9.438 1.00 0.00 C ATOM 377 CZ PHE A 24 1.582 23.049 10.823 1.00 0.00 C ATOM 0 H PHE A 24 -3.817 24.026 7.042 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.439 24.252 9.794 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.690 22.253 8.767 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.854 23.103 7.482 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -1.784 22.762 11.249 1.00 0.00 H new ATOM 0 HD2 PHE A 24 0.450 23.426 7.638 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.333 22.723 12.546 1.00 0.00 H new ATOM 0 HE2 PHE A 24 2.561 23.380 8.934 1.00 0.00 H new ATOM 0 HZ PHE A 24 2.503 23.030 11.388 1.00 0.00 H new ATOM 387 N ASP A 25 -1.313 26.038 7.989 1.00 0.00 N ATOM 388 CA ASP A 25 -0.373 27.155 8.047 1.00 0.00 C ATOM 389 C ASP A 25 -1.053 28.407 8.580 1.00 0.00 C ATOM 390 O ASP A 25 -0.481 29.136 9.388 1.00 0.00 O ATOM 391 CB ASP A 25 0.197 27.435 6.659 1.00 0.00 C ATOM 392 CG ASP A 25 0.954 28.758 6.668 1.00 0.00 C ATOM 393 OD1 ASP A 25 0.334 29.771 6.386 1.00 0.00 O ATOM 394 OD2 ASP A 25 2.138 28.742 6.961 1.00 0.00 O1- ATOM 0 H ASP A 25 -1.472 25.668 7.052 1.00 0.00 H new ATOM 0 HA ASP A 25 0.437 26.882 8.723 1.00 0.00 H new ATOM 0 HB2 ASP A 25 0.864 26.626 6.360 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -0.609 27.472 5.926 1.00 0.00 H new ATOM 399 N ILE A 26 -2.276 28.649 8.131 1.00 0.00 N ATOM 400 CA ILE A 26 -3.019 29.817 8.581 1.00 0.00 C ATOM 401 C ILE A 26 -3.158 29.814 10.095 1.00 0.00 C ATOM 402 O ILE A 26 -2.964 30.840 10.743 1.00 0.00 O ATOM 403 CB ILE A 26 -4.408 29.829 7.939 1.00 0.00 C ATOM 404 CG1 ILE A 26 -4.330 30.455 6.547 1.00 0.00 C ATOM 405 CG2 ILE A 26 -5.384 30.619 8.809 1.00 0.00 C ATOM 406 CD1 ILE A 26 -4.428 29.368 5.477 1.00 0.00 C ATOM 0 H ILE A 26 -2.771 28.059 7.462 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.471 30.710 8.281 1.00 0.00 H new ATOM 0 HB ILE A 26 -4.765 28.803 7.852 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -5.137 31.177 6.418 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.393 31.001 6.437 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -6.369 30.620 8.342 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -5.450 30.156 9.794 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -5.030 31.645 8.913 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -4.371 29.824 4.489 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -3.606 28.663 5.599 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -5.377 28.841 5.580 1.00 0.00 H new ATOM 418 N PHE A 27 -3.489 28.663 10.660 1.00 0.00 N ATOM 419 CA PHE A 27 -3.642 28.570 12.102 1.00 0.00 C ATOM 420 C PHE A 27 -2.323 28.892 12.797 1.00 0.00 C ATOM 421 O PHE A 27 -2.300 29.585 13.813 1.00 0.00 O ATOM 422 CB PHE A 27 -4.098 27.165 12.495 1.00 0.00 C ATOM 423 CG PHE A 27 -5.594 27.072 12.391 1.00 0.00 C ATOM 424 CD1 PHE A 27 -6.195 26.953 11.144 1.00 0.00 C ATOM 425 CD2 PHE A 27 -6.373 27.086 13.546 1.00 0.00 C ATOM 426 CE1 PHE A 27 -7.583 26.853 11.044 1.00 0.00 C ATOM 427 CE2 PHE A 27 -7.763 26.987 13.455 1.00 0.00 C ATOM 428 CZ PHE A 27 -8.372 26.872 12.202 1.00 0.00 C ATOM 0 H PHE A 27 -3.654 27.794 10.152 1.00 0.00 H new ATOM 0 HA PHE A 27 -4.395 29.292 12.416 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -3.632 26.425 11.844 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.780 26.940 13.513 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -5.587 26.938 10.251 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -5.901 27.174 14.513 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -8.049 26.761 10.074 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -8.366 26.999 14.351 1.00 0.00 H new ATOM 0 HZ PHE A 27 -9.447 26.798 12.127 1.00 0.00 H new ATOM 438 N VAL A 28 -1.228 28.390 12.232 1.00 0.00 N ATOM 439 CA VAL A 28 0.099 28.630 12.793 1.00 0.00 C ATOM 440 C VAL A 28 0.868 29.624 11.934 1.00 0.00 C ATOM 441 O VAL A 28 2.097 29.620 11.916 1.00 0.00 O ATOM 442 CB VAL A 28 0.882 27.321 12.882 1.00 0.00 C ATOM 443 CG1 VAL A 28 0.206 26.392 13.881 1.00 0.00 C ATOM 444 CG2 VAL A 28 0.904 26.653 11.512 1.00 0.00 C ATOM 0 H VAL A 28 -1.233 27.816 11.389 1.00 0.00 H new ATOM 0 HA VAL A 28 -0.024 29.044 13.794 1.00 0.00 H new ATOM 0 HB VAL A 28 1.901 27.528 13.208 1.00 0.00 H new ATOM 0 HG11 VAL A 28 0.764 25.458 13.945 1.00 0.00 H new ATOM 0 HG12 VAL A 28 0.182 26.868 14.861 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.813 26.184 13.553 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.462 25.719 11.572 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.117 26.446 11.192 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.383 27.316 10.792 1.00 0.00 H new ATOM 454 N LEU A 29 0.137 30.466 11.213 1.00 0.00 N ATOM 455 CA LEU A 29 0.767 31.454 10.346 1.00 0.00 C ATOM 456 C LEU A 29 1.767 32.292 11.139 1.00 0.00 C ATOM 457 O LEU A 29 1.382 33.087 11.997 1.00 0.00 O ATOM 458 CB LEU A 29 -0.299 32.366 9.735 1.00 0.00 C ATOM 459 CG LEU A 29 0.093 32.723 8.304 1.00 0.00 C ATOM 460 CD1 LEU A 29 -1.092 32.458 7.372 1.00 0.00 C ATOM 461 CD2 LEU A 29 0.471 34.200 8.242 1.00 0.00 C ATOM 0 H LEU A 29 -0.883 30.485 11.211 1.00 0.00 H new ATOM 0 HA LEU A 29 1.296 30.933 9.548 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.268 31.867 9.744 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.402 33.272 10.332 1.00 0.00 H new ATOM 0 HG LEU A 29 0.942 32.115 7.992 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.814 32.712 6.349 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.366 31.404 7.422 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.941 33.069 7.680 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.752 34.461 7.222 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.380 34.807 8.550 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.312 34.389 8.910 1.00 0.00 H new ATOM 473 N GLY A 30 3.052 32.110 10.843 1.00 0.00 N ATOM 474 CA GLY A 30 4.102 32.854 11.535 1.00 0.00 C ATOM 475 C GLY A 30 4.525 32.146 12.820 1.00 0.00 C ATOM 476 O GLY A 30 5.364 32.648 13.567 1.00 0.00 O ATOM 0 H GLY A 30 3.390 31.459 10.134 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.964 32.967 10.878 1.00 0.00 H new ATOM 0 HA3 GLY A 30 3.746 33.857 11.770 1.00 0.00 H new ATOM 480 N ALA A 31 3.943 30.976 13.068 1.00 0.00 N ATOM 481 CA ALA A 31 4.272 30.209 14.264 1.00 0.00 C ATOM 482 C ALA A 31 5.742 29.802 14.244 1.00 0.00 C ATOM 483 O ALA A 31 6.267 29.383 13.212 1.00 0.00 O ATOM 484 CB ALA A 31 3.385 28.958 14.347 1.00 0.00 C ATOM 0 H ALA A 31 3.247 30.542 12.462 1.00 0.00 H new ATOM 0 HA ALA A 31 4.092 30.833 15.139 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.638 28.392 15.243 1.00 0.00 H new ATOM 0 HB2 ALA A 31 2.338 29.257 14.390 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.549 28.337 13.467 1.00 0.00 H new ATOM 490 N GLU A 32 6.404 29.938 15.388 1.00 0.00 N ATOM 491 CA GLU A 32 7.814 29.590 15.486 1.00 0.00 C ATOM 492 C GLU A 32 8.021 28.094 15.266 1.00 0.00 C ATOM 493 O GLU A 32 8.977 27.681 14.610 1.00 0.00 O ATOM 494 CB GLU A 32 8.356 29.979 16.861 1.00 0.00 C ATOM 495 CG GLU A 32 8.387 31.504 16.981 1.00 0.00 C ATOM 496 CD GLU A 32 7.008 32.020 17.376 1.00 0.00 C ATOM 497 OE1 GLU A 32 6.124 31.201 17.574 1.00 0.00 O ATOM 498 OE2 GLU A 32 6.852 33.226 17.473 1.00 0.00 O1- ATOM 0 H GLU A 32 5.990 30.284 16.253 1.00 0.00 H new ATOM 0 HA GLU A 32 8.352 30.137 14.712 1.00 0.00 H new ATOM 0 HB2 GLU A 32 7.729 29.554 17.645 1.00 0.00 H new ATOM 0 HB3 GLU A 32 9.358 29.572 16.998 1.00 0.00 H new ATOM 0 HG2 GLU A 32 9.124 31.804 17.725 1.00 0.00 H new ATOM 0 HG3 GLU A 32 8.693 31.946 16.033 1.00 0.00 H new ATOM 505 N ASP A 33 7.123 27.284 15.822 1.00 0.00 N ATOM 506 CA ASP A 33 7.226 25.836 15.680 1.00 0.00 C ATOM 507 C ASP A 33 6.337 25.340 14.544 1.00 0.00 C ATOM 508 O ASP A 33 6.567 24.267 13.985 1.00 0.00 O ATOM 509 CB ASP A 33 6.808 25.160 16.987 1.00 0.00 C ATOM 510 CG ASP A 33 6.757 23.649 16.802 1.00 0.00 C ATOM 511 OD1 ASP A 33 5.698 23.150 16.455 1.00 0.00 O ATOM 512 OD2 ASP A 33 7.776 23.011 17.008 1.00 0.00 O1- ATOM 0 H ASP A 33 6.324 27.603 16.370 1.00 0.00 H new ATOM 0 HA ASP A 33 8.261 25.584 15.449 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.513 25.414 17.778 1.00 0.00 H new ATOM 0 HB3 ASP A 33 5.831 25.529 17.300 1.00 0.00 H new ATOM 517 N GLY A 34 5.321 26.128 14.211 1.00 0.00 N ATOM 518 CA GLY A 34 4.400 25.765 13.140 1.00 0.00 C ATOM 519 C GLY A 34 3.236 24.937 13.676 1.00 0.00 C ATOM 520 O GLY A 34 2.269 24.676 12.963 1.00 0.00 O ATOM 0 H GLY A 34 5.115 27.018 14.664 1.00 0.00 H new ATOM 0 HA2 GLY A 34 4.019 26.667 12.662 1.00 0.00 H new ATOM 0 HA3 GLY A 34 4.931 25.199 12.375 1.00 0.00 H new ATOM 524 N SER A 35 3.332 24.531 14.939 1.00 0.00 N ATOM 525 CA SER A 35 2.274 23.739 15.555 1.00 0.00 C ATOM 526 C SER A 35 1.127 24.651 15.984 1.00 0.00 C ATOM 527 O SER A 35 1.360 25.722 16.542 1.00 0.00 O ATOM 528 CB SER A 35 2.817 22.991 16.771 1.00 0.00 C ATOM 529 OG SER A 35 3.104 23.920 17.809 1.00 0.00 O ATOM 0 H SER A 35 4.123 24.735 15.550 1.00 0.00 H new ATOM 0 HA SER A 35 1.907 23.015 14.827 1.00 0.00 H new ATOM 0 HB2 SER A 35 2.088 22.258 17.116 1.00 0.00 H new ATOM 0 HB3 SER A 35 3.719 22.441 16.501 1.00 0.00 H new ATOM 0 HG SER A 35 4.072 24.064 17.861 1.00 0.00 H new ATOM 535 N ILE A 36 -0.110 24.232 15.722 1.00 0.00 N ATOM 536 CA ILE A 36 -1.268 25.046 16.083 1.00 0.00 C ATOM 537 C ILE A 36 -1.502 25.009 17.590 1.00 0.00 C ATOM 538 O ILE A 36 -2.025 24.032 18.120 1.00 0.00 O ATOM 539 CB ILE A 36 -2.505 24.499 15.372 1.00 0.00 C ATOM 540 CG1 ILE A 36 -2.319 24.617 13.855 1.00 0.00 C ATOM 541 CG2 ILE A 36 -3.747 25.281 15.810 1.00 0.00 C ATOM 542 CD1 ILE A 36 -3.404 23.804 13.142 1.00 0.00 C ATOM 0 H ILE A 36 -0.334 23.347 15.268 1.00 0.00 H new ATOM 0 HA ILE A 36 -1.081 26.077 15.781 1.00 0.00 H new ATOM 0 HB ILE A 36 -2.638 23.450 15.636 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.375 25.662 13.551 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -1.331 24.254 13.570 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.625 24.886 15.299 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.879 25.181 16.887 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -3.623 26.334 15.556 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.272 23.888 12.063 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.327 22.757 13.437 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.386 24.187 13.418 1.00 0.00 H new ATOM 554 N SER A 37 -1.132 26.096 18.262 1.00 0.00 N ATOM 555 CA SER A 37 -1.314 26.201 19.707 1.00 0.00 C ATOM 556 C SER A 37 -2.594 26.961 20.018 1.00 0.00 C ATOM 557 O SER A 37 -3.190 27.564 19.135 1.00 0.00 O ATOM 558 CB SER A 37 -0.121 26.921 20.337 1.00 0.00 C ATOM 559 OG SER A 37 -0.130 28.287 19.944 1.00 0.00 O ATOM 0 H SER A 37 -0.705 26.915 17.830 1.00 0.00 H new ATOM 0 HA SER A 37 -1.385 25.196 20.124 1.00 0.00 H new ATOM 0 HB2 SER A 37 -0.168 26.844 21.423 1.00 0.00 H new ATOM 0 HB3 SER A 37 0.810 26.448 20.024 1.00 0.00 H new ATOM 0 HG SER A 37 0.353 28.387 19.097 1.00 0.00 H new ATOM 565 N THR A 38 -3.020 26.928 21.271 1.00 0.00 N ATOM 566 CA THR A 38 -4.242 27.619 21.650 1.00 0.00 C ATOM 567 C THR A 38 -4.232 29.047 21.127 1.00 0.00 C ATOM 568 O THR A 38 -5.257 29.559 20.679 1.00 0.00 O ATOM 569 CB THR A 38 -4.390 27.608 23.167 1.00 0.00 C ATOM 570 OG1 THR A 38 -3.099 27.613 23.767 1.00 0.00 O ATOM 571 CG2 THR A 38 -5.169 26.363 23.599 1.00 0.00 C ATOM 0 H THR A 38 -2.547 26.439 22.031 1.00 0.00 H new ATOM 0 HA THR A 38 -5.093 27.101 21.207 1.00 0.00 H new ATOM 0 HB THR A 38 -4.937 28.494 23.489 1.00 0.00 H new ATOM 0 HG1 THR A 38 -3.192 27.608 24.743 1.00 0.00 H new ATOM 0 HG21 THR A 38 -5.273 26.357 24.684 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.157 26.374 23.139 1.00 0.00 H new ATOM 0 HG23 THR A 38 -4.632 25.469 23.282 1.00 0.00 H new ATOM 579 N LYS A 39 -3.071 29.681 21.165 1.00 0.00 N ATOM 580 CA LYS A 39 -2.954 31.041 20.670 1.00 0.00 C ATOM 581 C LYS A 39 -3.104 31.062 19.151 1.00 0.00 C ATOM 582 O LYS A 39 -3.886 31.840 18.606 1.00 0.00 O ATOM 583 CB LYS A 39 -1.596 31.624 21.070 1.00 0.00 C ATOM 584 CG LYS A 39 -1.745 32.421 22.370 1.00 0.00 C ATOM 585 CD LYS A 39 -1.108 33.799 22.193 1.00 0.00 C ATOM 586 CE LYS A 39 0.222 33.848 22.945 1.00 0.00 C ATOM 587 NZ LYS A 39 1.174 34.729 22.211 1.00 0.00 N1+ ATOM 0 H LYS A 39 -2.206 29.281 21.529 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.746 31.647 21.109 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -0.869 30.823 21.204 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -1.217 32.269 20.277 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -2.799 32.525 22.627 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -1.267 31.890 23.193 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -0.947 34.003 21.135 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -1.779 34.572 22.568 1.00 0.00 H new ATOM 0 HE2 LYS A 39 0.067 34.224 23.956 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.637 32.844 23.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 2.079 34.763 22.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.330 34.351 21.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 0.778 35.688 22.144 1.00 0.00 H new ATOM 601 N GLU A 40 -2.366 30.187 18.472 1.00 0.00 N ATOM 602 CA GLU A 40 -2.437 30.101 17.017 1.00 0.00 C ATOM 603 C GLU A 40 -3.825 29.648 16.569 1.00 0.00 C ATOM 604 O GLU A 40 -4.405 30.203 15.626 1.00 0.00 O ATOM 605 CB GLU A 40 -1.376 29.114 16.518 1.00 0.00 C ATOM 606 CG GLU A 40 -0.014 29.809 16.468 1.00 0.00 C ATOM 607 CD GLU A 40 0.165 30.708 17.686 1.00 0.00 C ATOM 608 OE1 GLU A 40 0.149 30.188 18.790 1.00 0.00 O ATOM 609 OE2 GLU A 40 0.306 31.904 17.498 1.00 0.00 O1- ATOM 0 H GLU A 40 -1.715 29.531 18.904 1.00 0.00 H new ATOM 0 HA GLU A 40 -2.249 31.088 16.594 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.330 28.248 17.179 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -1.644 28.745 15.528 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.781 29.064 16.437 1.00 0.00 H new ATOM 0 HG3 GLU A 40 0.067 30.400 15.556 1.00 0.00 H new ATOM 616 N LEU A 41 -4.350 28.645 17.261 1.00 0.00 N ATOM 617 CA LEU A 41 -5.664 28.117 16.943 1.00 0.00 C ATOM 618 C LEU A 41 -6.726 29.171 17.197 1.00 0.00 C ATOM 619 O LEU A 41 -7.556 29.447 16.337 1.00 0.00 O ATOM 620 CB LEU A 41 -5.953 26.866 17.785 1.00 0.00 C ATOM 621 CG LEU A 41 -7.071 26.056 17.125 1.00 0.00 C ATOM 622 CD1 LEU A 41 -6.802 24.562 17.312 1.00 0.00 C ATOM 623 CD2 LEU A 41 -8.414 26.411 17.765 1.00 0.00 C ATOM 0 H LEU A 41 -3.885 28.184 18.043 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.684 27.842 15.888 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -5.053 26.258 17.874 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.245 27.153 18.795 1.00 0.00 H new ATOM 0 HG LEU A 41 -7.102 26.292 16.061 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.599 23.987 16.841 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -5.848 24.304 16.852 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.766 24.329 18.376 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -9.207 25.832 17.292 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.382 26.180 18.830 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.612 27.474 17.630 1.00 0.00 H new ATOM 635 N GLY A 42 -6.685 29.778 18.374 1.00 0.00 N ATOM 636 CA GLY A 42 -7.648 30.814 18.705 1.00 0.00 C ATOM 637 C GLY A 42 -7.513 31.985 17.736 1.00 0.00 C ATOM 638 O GLY A 42 -8.495 32.654 17.423 1.00 0.00 O ATOM 0 H GLY A 42 -6.005 29.574 19.106 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.659 30.409 18.660 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.488 31.157 19.727 1.00 0.00 H new ATOM 642 N LYS A 43 -6.290 32.227 17.258 1.00 0.00 N ATOM 643 CA LYS A 43 -6.060 33.319 16.317 1.00 0.00 C ATOM 644 C LYS A 43 -6.995 33.179 15.121 1.00 0.00 C ATOM 645 O LYS A 43 -7.751 34.095 14.801 1.00 0.00 O ATOM 646 CB LYS A 43 -4.603 33.290 15.843 1.00 0.00 C ATOM 647 CG LYS A 43 -4.488 33.924 14.455 1.00 0.00 C ATOM 648 CD LYS A 43 -4.369 32.817 13.407 1.00 0.00 C ATOM 649 CE LYS A 43 -2.944 32.793 12.852 1.00 0.00 C ATOM 650 NZ LYS A 43 -2.844 33.732 11.699 1.00 0.00 N1+ ATOM 0 H LYS A 43 -5.458 31.690 17.503 1.00 0.00 H new ATOM 0 HA LYS A 43 -6.259 34.269 16.814 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -3.972 33.828 16.550 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -4.243 32.262 15.812 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -5.362 34.543 14.251 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -3.617 34.578 14.411 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -4.614 31.852 13.852 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -5.082 32.987 12.600 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -2.235 33.078 13.629 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -2.682 31.783 12.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -1.967 34.285 11.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -2.835 33.191 10.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -3.661 34.376 11.704 1.00 0.00 H new ATOM 664 N VAL A 44 -6.967 32.015 14.484 1.00 0.00 N ATOM 665 CA VAL A 44 -7.853 31.764 13.349 1.00 0.00 C ATOM 666 C VAL A 44 -9.301 31.742 13.832 1.00 0.00 C ATOM 667 O VAL A 44 -10.221 32.139 13.113 1.00 0.00 O ATOM 668 CB VAL A 44 -7.476 30.428 12.675 1.00 0.00 C ATOM 669 CG1 VAL A 44 -8.733 29.688 12.225 1.00 0.00 C ATOM 670 CG2 VAL A 44 -6.598 30.702 11.451 1.00 0.00 C ATOM 0 H VAL A 44 -6.351 31.239 14.727 1.00 0.00 H new ATOM 0 HA VAL A 44 -7.743 32.560 12.612 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.935 29.815 13.395 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.452 28.747 11.751 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.364 29.484 13.090 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.282 30.303 11.512 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -6.332 29.758 10.975 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -7.145 31.324 10.742 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.691 31.220 11.763 1.00 0.00 H new ATOM 680 N MET A 45 -9.496 31.287 15.061 1.00 0.00 N ATOM 681 CA MET A 45 -10.829 31.222 15.623 1.00 0.00 C ATOM 682 C MET A 45 -11.436 32.621 15.637 1.00 0.00 C ATOM 683 O MET A 45 -12.593 32.812 15.259 1.00 0.00 O ATOM 684 CB MET A 45 -10.745 30.655 17.051 1.00 0.00 C ATOM 685 CG MET A 45 -10.355 29.172 17.008 1.00 0.00 C ATOM 686 SD MET A 45 -11.732 28.193 16.363 1.00 0.00 S ATOM 687 CE MET A 45 -12.753 28.254 17.855 1.00 0.00 C ATOM 0 H MET A 45 -8.754 30.961 15.680 1.00 0.00 H new ATOM 0 HA MET A 45 -11.462 30.571 15.021 1.00 0.00 H new ATOM 0 HB2 MET A 45 -10.011 31.215 17.630 1.00 0.00 H new ATOM 0 HB3 MET A 45 -11.705 30.772 17.554 1.00 0.00 H new ATOM 0 HG2 MET A 45 -9.475 29.036 16.379 1.00 0.00 H new ATOM 0 HG3 MET A 45 -10.089 28.828 18.007 1.00 0.00 H new ATOM 0 HE1 MET A 45 -13.627 27.615 17.724 1.00 0.00 H new ATOM 0 HE2 MET A 45 -12.172 27.904 18.708 1.00 0.00 H new ATOM 0 HE3 MET A 45 -13.077 29.280 18.033 1.00 0.00 H new ATOM 697 N ARG A 46 -10.633 33.599 16.037 1.00 0.00 N ATOM 698 CA ARG A 46 -11.078 34.985 16.058 1.00 0.00 C ATOM 699 C ARG A 46 -11.309 35.470 14.638 1.00 0.00 C ATOM 700 O ARG A 46 -12.250 36.218 14.369 1.00 0.00 O ATOM 701 CB ARG A 46 -10.040 35.868 16.764 1.00 0.00 C ATOM 702 CG ARG A 46 -9.975 35.499 18.251 1.00 0.00 C ATOM 703 CD ARG A 46 -8.863 36.303 18.929 1.00 0.00 C ATOM 704 NE ARG A 46 -9.216 37.717 18.985 1.00 0.00 N ATOM 705 CZ ARG A 46 -9.910 38.211 20.006 1.00 0.00 C ATOM 706 NH1 ARG A 46 -10.278 37.427 20.983 1.00 0.00 N1+ ATOM 707 NH2 ARG A 46 -10.222 39.477 20.034 1.00 0.00 N ATOM 0 H ARG A 46 -9.673 33.458 16.350 1.00 0.00 H new ATOM 0 HA ARG A 46 -12.015 35.050 16.611 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -9.061 35.735 16.303 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -10.305 36.919 16.651 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -10.932 35.706 18.730 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -9.787 34.431 18.364 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.695 35.924 19.937 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -7.929 36.177 18.381 1.00 0.00 H new ATOM 0 HE ARG A 46 -8.926 38.337 18.229 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -10.033 36.437 20.962 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -10.810 37.804 21.767 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.934 40.090 19.272 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -10.754 39.854 20.818 1.00 0.00 H new ATOM 721 N MET A 47 -10.444 35.031 13.735 1.00 0.00 N ATOM 722 CA MET A 47 -10.557 35.417 12.339 1.00 0.00 C ATOM 723 C MET A 47 -11.950 35.066 11.825 1.00 0.00 C ATOM 724 O MET A 47 -12.471 35.710 10.912 1.00 0.00 O ATOM 725 CB MET A 47 -9.483 34.694 11.513 1.00 0.00 C ATOM 726 CG MET A 47 -10.093 33.485 10.821 1.00 0.00 C ATOM 727 SD MET A 47 -8.825 32.231 10.544 1.00 0.00 S ATOM 728 CE MET A 47 -7.596 33.321 9.794 1.00 0.00 C ATOM 0 H MET A 47 -9.661 34.411 13.944 1.00 0.00 H new ATOM 0 HA MET A 47 -10.406 36.492 12.243 1.00 0.00 H new ATOM 0 HB2 MET A 47 -9.061 35.374 10.773 1.00 0.00 H new ATOM 0 HB3 MET A 47 -8.664 34.380 12.160 1.00 0.00 H new ATOM 0 HG2 MET A 47 -10.897 33.073 11.431 1.00 0.00 H new ATOM 0 HG3 MET A 47 -10.535 33.784 9.871 1.00 0.00 H new ATOM 0 HE1 MET A 47 -6.979 32.750 9.100 1.00 0.00 H new ATOM 0 HE2 MET A 47 -8.101 34.123 9.256 1.00 0.00 H new ATOM 0 HE3 MET A 47 -6.965 33.748 10.573 1.00 0.00 H new ATOM 738 N LEU A 48 -12.540 34.025 12.410 1.00 0.00 N ATOM 739 CA LEU A 48 -13.867 33.586 11.998 1.00 0.00 C ATOM 740 C LEU A 48 -14.942 34.206 12.884 1.00 0.00 C ATOM 741 O LEU A 48 -16.135 33.949 12.704 1.00 0.00 O ATOM 742 CB LEU A 48 -13.971 32.067 12.073 1.00 0.00 C ATOM 743 CG LEU A 48 -12.799 31.444 11.328 1.00 0.00 C ATOM 744 CD1 LEU A 48 -12.982 29.940 11.280 1.00 0.00 C ATOM 745 CD2 LEU A 48 -12.716 32.013 9.909 1.00 0.00 C ATOM 0 H LEU A 48 -12.124 33.477 13.162 1.00 0.00 H new ATOM 0 HA LEU A 48 -14.022 33.911 10.969 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -13.969 31.742 13.113 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -14.913 31.734 11.637 1.00 0.00 H new ATOM 0 HG LEU A 48 -11.870 31.678 11.849 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -12.145 29.488 10.747 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -13.021 29.546 12.295 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -13.912 29.703 10.763 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -11.874 31.561 9.384 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -13.639 31.791 9.373 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -12.576 33.093 9.958 1.00 0.00 H new ATOM 757 N GLY A 49 -14.511 35.014 13.849 1.00 0.00 N ATOM 758 CA GLY A 49 -15.434 35.661 14.774 1.00 0.00 C ATOM 759 C GLY A 49 -15.475 34.922 16.106 1.00 0.00 C ATOM 760 O GLY A 49 -16.274 35.249 16.984 1.00 0.00 O ATOM 0 H GLY A 49 -13.528 35.236 14.010 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -15.128 36.695 14.936 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.433 35.689 14.338 1.00 0.00 H new ATOM 764 N GLN A 50 -14.613 33.920 16.254 1.00 0.00 N ATOM 765 CA GLN A 50 -14.573 33.142 17.487 1.00 0.00 C ATOM 766 C GLN A 50 -13.626 33.763 18.499 1.00 0.00 C ATOM 767 O GLN A 50 -12.514 34.153 18.164 1.00 0.00 O ATOM 768 CB GLN A 50 -14.099 31.729 17.193 1.00 0.00 C ATOM 769 CG GLN A 50 -14.904 31.151 16.020 1.00 0.00 C ATOM 770 CD GLN A 50 -16.380 31.518 16.168 1.00 0.00 C ATOM 771 OE1 GLN A 50 -16.989 32.037 15.232 1.00 0.00 O ATOM 772 NE2 GLN A 50 -16.992 31.289 17.297 1.00 0.00 N ATOM 0 H GLN A 50 -13.940 33.630 15.544 1.00 0.00 H new ATOM 0 HA GLN A 50 -15.581 33.128 17.901 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -13.036 31.734 16.951 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -14.222 31.102 18.076 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -14.517 31.538 15.077 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -14.791 30.067 15.990 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -16.488 30.859 18.072 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -17.975 31.540 17.404 1.00 0.00 H new ATOM 781 N ASN A 51 -14.048 33.842 19.747 1.00 0.00 N ATOM 782 CA ASN A 51 -13.184 34.422 20.757 1.00 0.00 C ATOM 783 C ASN A 51 -13.054 33.502 21.959 1.00 0.00 C ATOM 784 O ASN A 51 -13.402 33.872 23.079 1.00 0.00 O ATOM 785 CB ASN A 51 -13.759 35.764 21.203 1.00 0.00 C ATOM 786 CG ASN A 51 -12.776 36.510 22.105 1.00 0.00 C ATOM 787 OD1 ASN A 51 -11.980 35.886 22.808 1.00 0.00 O ATOM 788 ND2 ASN A 51 -12.790 37.817 22.131 1.00 0.00 N ATOM 0 H ASN A 51 -14.958 33.522 20.080 1.00 0.00 H new ATOM 0 HA ASN A 51 -12.193 34.563 20.325 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -13.990 36.373 20.329 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -14.696 35.603 21.736 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -12.141 38.322 22.734 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -13.450 38.332 21.548 1.00 0.00 H new ATOM 795 N PRO A 52 -12.551 32.320 21.744 1.00 0.00 N ATOM 796 CA PRO A 52 -12.356 31.321 22.829 1.00 0.00 C ATOM 797 C PRO A 52 -11.137 31.629 23.693 1.00 0.00 C ATOM 798 O PRO A 52 -10.118 32.109 23.197 1.00 0.00 O ATOM 799 CB PRO A 52 -12.180 30.013 22.064 1.00 0.00 C ATOM 800 CG PRO A 52 -11.599 30.400 20.748 1.00 0.00 C ATOM 801 CD PRO A 52 -12.111 31.802 20.435 1.00 0.00 C ATOM 0 HA PRO A 52 -13.187 31.304 23.534 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.520 29.330 22.599 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -13.134 29.501 21.937 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -10.510 30.386 20.787 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -11.899 29.697 19.971 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -11.329 32.425 20.001 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -12.932 31.777 19.719 1.00 0.00 H new ATOM 809 N THR A 53 -11.240 31.340 24.987 1.00 0.00 N ATOM 810 CA THR A 53 -10.128 31.579 25.898 1.00 0.00 C ATOM 811 C THR A 53 -9.111 30.450 25.804 1.00 0.00 C ATOM 812 O THR A 53 -9.447 29.320 25.455 1.00 0.00 O ATOM 813 CB THR A 53 -10.649 31.697 27.333 1.00 0.00 C ATOM 814 OG1 THR A 53 -11.294 30.488 27.706 1.00 0.00 O ATOM 815 CG2 THR A 53 -11.635 32.861 27.415 1.00 0.00 C ATOM 0 H THR A 53 -12.073 30.944 25.424 1.00 0.00 H new ATOM 0 HA THR A 53 -9.638 32.511 25.616 1.00 0.00 H new ATOM 0 HB THR A 53 -9.817 31.879 28.013 1.00 0.00 H new ATOM 0 HG1 THR A 53 -11.625 30.564 28.625 1.00 0.00 H new ATOM 0 HG21 THR A 53 -12.009 32.950 28.435 1.00 0.00 H new ATOM 0 HG22 THR A 53 -11.131 33.785 27.132 1.00 0.00 H new ATOM 0 HG23 THR A 53 -12.469 32.680 26.737 1.00 0.00 H new ATOM 823 N PRO A 54 -7.882 30.741 26.112 1.00 0.00 N ATOM 824 CA PRO A 54 -6.780 29.735 26.077 1.00 0.00 C ATOM 825 C PRO A 54 -7.095 28.512 26.936 1.00 0.00 C ATOM 826 O PRO A 54 -6.750 27.387 26.581 1.00 0.00 O ATOM 827 CB PRO A 54 -5.584 30.497 26.642 1.00 0.00 C ATOM 828 CG PRO A 54 -5.890 31.929 26.383 1.00 0.00 C ATOM 829 CD PRO A 54 -7.400 32.065 26.518 1.00 0.00 C ATOM 0 HA PRO A 54 -6.611 29.344 25.074 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -5.460 30.305 27.708 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -4.657 30.196 26.154 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -5.375 32.573 27.095 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -5.559 32.225 25.388 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -7.695 32.307 27.539 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -7.794 32.853 25.877 1.00 0.00 H new ATOM 837 N GLU A 55 -7.751 28.746 28.067 1.00 0.00 N ATOM 838 CA GLU A 55 -8.103 27.656 28.968 1.00 0.00 C ATOM 839 C GLU A 55 -9.049 26.678 28.277 1.00 0.00 C ATOM 840 O GLU A 55 -8.925 25.463 28.434 1.00 0.00 O ATOM 841 CB GLU A 55 -8.777 28.214 30.223 1.00 0.00 C ATOM 842 CG GLU A 55 -7.753 28.988 31.054 1.00 0.00 C ATOM 843 CD GLU A 55 -7.710 30.446 30.605 1.00 0.00 C ATOM 844 OE1 GLU A 55 -8.276 30.743 29.566 1.00 0.00 O ATOM 845 OE2 GLU A 55 -7.118 31.246 31.311 1.00 0.00 O1- ATOM 0 H GLU A 55 -8.047 29.671 28.379 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.190 27.130 29.248 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.603 28.868 29.944 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -9.199 27.401 30.813 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -8.013 28.932 32.111 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -6.767 28.536 30.944 1.00 0.00 H new ATOM 852 N GLU A 56 -9.989 27.217 27.504 1.00 0.00 N ATOM 853 CA GLU A 56 -10.947 26.382 26.788 1.00 0.00 C ATOM 854 C GLU A 56 -10.320 25.862 25.496 1.00 0.00 C ATOM 855 O GLU A 56 -10.582 24.735 25.072 1.00 0.00 O ATOM 856 CB GLU A 56 -12.210 27.185 26.474 1.00 0.00 C ATOM 857 CG GLU A 56 -13.438 26.405 26.950 1.00 0.00 C ATOM 858 CD GLU A 56 -13.489 26.400 28.475 1.00 0.00 C ATOM 859 OE1 GLU A 56 -13.143 27.410 29.064 1.00 0.00 O ATOM 860 OE2 GLU A 56 -13.874 25.384 29.032 1.00 0.00 O1- ATOM 0 H GLU A 56 -10.107 28.220 27.359 1.00 0.00 H new ATOM 0 HA GLU A 56 -11.218 25.533 27.416 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -12.169 28.156 26.967 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -12.278 27.374 25.403 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -14.345 26.857 26.548 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.398 25.382 26.575 1.00 0.00 H new ATOM 867 N LEU A 57 -9.473 26.688 24.887 1.00 0.00 N ATOM 868 CA LEU A 57 -8.783 26.303 23.662 1.00 0.00 C ATOM 869 C LEU A 57 -7.831 25.143 23.918 1.00 0.00 C ATOM 870 O LEU A 57 -7.703 24.243 23.093 1.00 0.00 O ATOM 871 CB LEU A 57 -8.028 27.491 23.073 1.00 0.00 C ATOM 872 CG LEU A 57 -9.017 28.369 22.323 1.00 0.00 C ATOM 873 CD1 LEU A 57 -8.357 29.665 21.931 1.00 0.00 C ATOM 874 CD2 LEU A 57 -9.453 27.675 21.043 1.00 0.00 C ATOM 0 H LEU A 57 -9.249 27.625 25.222 1.00 0.00 H new ATOM 0 HA LEU A 57 -9.533 25.978 22.941 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -7.541 28.060 23.865 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.243 27.145 22.400 1.00 0.00 H new ATOM 0 HG LEU A 57 -9.872 28.554 22.973 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -9.071 30.289 21.394 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -8.020 30.187 22.827 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -7.501 29.458 21.288 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -10.162 28.308 20.509 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.582 27.493 20.413 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -9.928 26.725 21.288 1.00 0.00 H new ATOM 886 N GLN A 58 -7.158 25.173 25.061 1.00 0.00 N ATOM 887 CA GLN A 58 -6.211 24.119 25.396 1.00 0.00 C ATOM 888 C GLN A 58 -6.869 22.747 25.297 1.00 0.00 C ATOM 889 O GLN A 58 -6.339 21.844 24.651 1.00 0.00 O ATOM 890 CB GLN A 58 -5.682 24.337 26.816 1.00 0.00 C ATOM 891 CG GLN A 58 -4.313 25.022 26.771 1.00 0.00 C ATOM 892 CD GLN A 58 -3.574 24.788 28.087 1.00 0.00 C ATOM 893 OE1 GLN A 58 -4.142 24.238 29.032 1.00 0.00 O ATOM 894 NE2 GLN A 58 -2.334 25.175 28.207 1.00 0.00 N ATOM 0 H GLN A 58 -7.249 25.907 25.764 1.00 0.00 H new ATOM 0 HA GLN A 58 -5.385 24.157 24.686 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -6.384 24.948 27.384 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -5.601 23.381 27.333 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -3.727 24.630 25.940 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -4.437 26.091 26.598 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -1.864 25.630 27.425 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.835 25.022 29.083 1.00 0.00 H new ATOM 903 N GLU A 59 -8.027 22.596 25.928 1.00 0.00 N ATOM 904 CA GLU A 59 -8.739 21.326 25.883 1.00 0.00 C ATOM 905 C GLU A 59 -9.142 21.005 24.445 1.00 0.00 C ATOM 906 O GLU A 59 -8.976 19.879 23.962 1.00 0.00 O ATOM 907 CB GLU A 59 -9.981 21.403 26.776 1.00 0.00 C ATOM 908 CG GLU A 59 -10.700 20.056 26.771 1.00 0.00 C ATOM 909 CD GLU A 59 -11.921 20.113 27.682 1.00 0.00 C ATOM 910 OE1 GLU A 59 -12.152 21.158 28.268 1.00 0.00 O ATOM 911 OE2 GLU A 59 -12.610 19.110 27.777 1.00 0.00 O1- ATOM 0 H GLU A 59 -8.488 23.327 26.470 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.086 20.533 26.248 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.694 21.670 27.793 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -10.650 22.185 26.418 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -11.005 19.801 25.756 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.022 19.271 27.107 1.00 0.00 H new ATOM 918 N MET A 60 -9.649 22.018 23.754 1.00 0.00 N ATOM 919 CA MET A 60 -10.056 21.852 22.364 1.00 0.00 C ATOM 920 C MET A 60 -8.876 21.388 21.525 1.00 0.00 C ATOM 921 O MET A 60 -9.012 20.499 20.684 1.00 0.00 O ATOM 922 CB MET A 60 -10.599 23.174 21.812 1.00 0.00 C ATOM 923 CG MET A 60 -10.774 23.066 20.296 1.00 0.00 C ATOM 924 SD MET A 60 -10.047 24.526 19.517 1.00 0.00 S ATOM 925 CE MET A 60 -8.335 24.202 20.010 1.00 0.00 C ATOM 0 H MET A 60 -9.788 22.956 24.129 1.00 0.00 H new ATOM 0 HA MET A 60 -10.842 21.099 22.318 1.00 0.00 H new ATOM 0 HB2 MET A 60 -11.553 23.411 22.282 1.00 0.00 H new ATOM 0 HB3 MET A 60 -9.915 23.988 22.052 1.00 0.00 H new ATOM 0 HG2 MET A 60 -10.292 22.161 19.925 1.00 0.00 H new ATOM 0 HG3 MET A 60 -11.832 22.991 20.043 1.00 0.00 H new ATOM 0 HE1 MET A 60 -7.705 25.038 19.707 1.00 0.00 H new ATOM 0 HE2 MET A 60 -8.284 24.083 21.092 1.00 0.00 H new ATOM 0 HE3 MET A 60 -7.984 23.290 19.528 1.00 0.00 H new ATOM 935 N ILE A 61 -7.718 21.991 21.763 1.00 0.00 N ATOM 936 CA ILE A 61 -6.514 21.630 21.029 1.00 0.00 C ATOM 937 C ILE A 61 -6.157 20.164 21.253 1.00 0.00 C ATOM 938 O ILE A 61 -5.876 19.429 20.306 1.00 0.00 O ATOM 939 CB ILE A 61 -5.353 22.473 21.506 1.00 0.00 C ATOM 940 CG1 ILE A 61 -5.579 23.922 21.052 1.00 0.00 C ATOM 941 CG2 ILE A 61 -4.075 21.901 20.906 1.00 0.00 C ATOM 942 CD1 ILE A 61 -4.261 24.677 20.976 1.00 0.00 C ATOM 0 H ILE A 61 -7.588 22.729 22.455 1.00 0.00 H new ATOM 0 HA ILE A 61 -6.706 21.800 19.970 1.00 0.00 H new ATOM 0 HB ILE A 61 -5.271 22.461 22.593 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.065 23.930 20.076 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.252 24.425 21.747 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.221 22.493 21.236 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -3.949 20.869 21.234 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.139 21.931 19.818 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.446 25.701 20.652 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.790 24.687 21.959 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.600 24.185 20.262 1.00 0.00 H new ATOM 954 N ASP A 62 -6.168 19.750 22.519 1.00 0.00 N ATOM 955 CA ASP A 62 -5.837 18.375 22.874 1.00 0.00 C ATOM 956 C ASP A 62 -6.742 17.400 22.137 1.00 0.00 C ATOM 957 O ASP A 62 -6.399 16.230 21.959 1.00 0.00 O ATOM 958 CB ASP A 62 -5.966 18.174 24.378 1.00 0.00 C ATOM 959 CG ASP A 62 -5.570 16.744 24.749 1.00 0.00 C ATOM 960 OD1 ASP A 62 -6.445 15.893 24.771 1.00 0.00 O ATOM 961 OD2 ASP A 62 -4.398 16.522 25.004 1.00 0.00 O1- ATOM 0 H ASP A 62 -6.402 20.347 23.312 1.00 0.00 H new ATOM 0 HA ASP A 62 -4.806 18.182 22.579 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -5.329 18.885 24.904 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -6.991 18.370 24.693 1.00 0.00 H new ATOM 966 N GLU A 63 -7.898 17.888 21.709 1.00 0.00 N ATOM 967 CA GLU A 63 -8.845 17.048 20.985 1.00 0.00 C ATOM 968 C GLU A 63 -8.145 16.313 19.846 1.00 0.00 C ATOM 969 O GLU A 63 -8.427 15.143 19.585 1.00 0.00 O ATOM 970 CB GLU A 63 -9.958 17.917 20.400 1.00 0.00 C ATOM 971 CG GLU A 63 -10.917 17.048 19.592 1.00 0.00 C ATOM 972 CD GLU A 63 -11.578 16.014 20.499 1.00 0.00 C ATOM 973 OE1 GLU A 63 -11.580 16.227 21.703 1.00 0.00 O ATOM 974 OE2 GLU A 63 -12.069 15.026 19.981 1.00 0.00 O1- ATOM 0 H GLU A 63 -8.202 18.852 21.848 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.263 16.320 21.680 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.497 18.423 21.201 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -9.531 18.693 19.764 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -11.678 17.672 19.123 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.377 16.547 18.789 1.00 0.00 H new ATOM 981 N VAL A 64 -7.236 17.004 19.170 1.00 0.00 N ATOM 982 CA VAL A 64 -6.500 16.405 18.060 1.00 0.00 C ATOM 983 C VAL A 64 -5.014 16.302 18.385 1.00 0.00 C ATOM 984 O VAL A 64 -4.239 15.745 17.606 1.00 0.00 O ATOM 985 CB VAL A 64 -6.692 17.239 16.794 1.00 0.00 C ATOM 986 CG1 VAL A 64 -7.992 16.824 16.105 1.00 0.00 C ATOM 987 CG2 VAL A 64 -6.793 18.714 17.170 1.00 0.00 C ATOM 0 H VAL A 64 -6.990 17.974 19.368 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.890 15.400 17.896 1.00 0.00 H new ATOM 0 HB VAL A 64 -5.846 17.079 16.126 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.131 17.418 15.202 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.943 15.768 15.841 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.831 16.990 16.781 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -6.930 19.311 16.268 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.643 18.862 17.836 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.878 19.024 17.675 1.00 0.00 H new ATOM 997 N ASP A 65 -4.620 16.844 19.529 1.00 0.00 N ATOM 998 CA ASP A 65 -3.220 16.808 19.926 1.00 0.00 C ATOM 999 C ASP A 65 -2.814 15.395 20.335 1.00 0.00 C ATOM 1000 O ASP A 65 -3.316 14.856 21.323 1.00 0.00 O ATOM 1001 CB ASP A 65 -2.990 17.765 21.094 1.00 0.00 C ATOM 1002 CG ASP A 65 -1.502 17.931 21.344 1.00 0.00 C ATOM 1003 OD1 ASP A 65 -0.745 17.122 20.839 1.00 0.00 O ATOM 1004 OD2 ASP A 65 -1.141 18.869 22.030 1.00 0.00 O1- ATOM 0 H ASP A 65 -5.241 17.308 20.191 1.00 0.00 H new ATOM 0 HA ASP A 65 -2.610 17.115 19.076 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.441 18.733 20.876 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -3.477 17.381 21.990 1.00 0.00 H new ATOM 1009 N GLU A 66 -1.909 14.797 19.566 1.00 0.00 N ATOM 1010 CA GLU A 66 -1.447 13.440 19.851 1.00 0.00 C ATOM 1011 C GLU A 66 -0.700 13.376 21.181 1.00 0.00 C ATOM 1012 O GLU A 66 -0.944 12.484 21.995 1.00 0.00 O ATOM 1013 CB GLU A 66 -0.530 12.964 18.734 1.00 0.00 C ATOM 1014 CG GLU A 66 -0.119 11.519 19.002 1.00 0.00 C ATOM 1015 CD GLU A 66 0.780 11.016 17.879 1.00 0.00 C ATOM 1016 OE1 GLU A 66 1.828 11.605 17.673 1.00 0.00 O ATOM 1017 OE2 GLU A 66 0.404 10.047 17.237 1.00 0.00 O1- ATOM 0 H GLU A 66 -1.482 15.226 18.745 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.322 12.793 19.916 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -1.040 13.037 17.773 1.00 0.00 H new ATOM 0 HB3 GLU A 66 0.353 13.601 18.676 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.405 11.452 19.956 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -1.005 10.889 19.080 1.00 0.00 H new ATOM 1024 N ASP A 67 0.211 14.320 21.398 1.00 0.00 N ATOM 1025 CA ASP A 67 0.984 14.345 22.636 1.00 0.00 C ATOM 1026 C ASP A 67 0.327 15.257 23.669 1.00 0.00 C ATOM 1027 O ASP A 67 0.757 15.316 24.821 1.00 0.00 O ATOM 1028 CB ASP A 67 2.401 14.841 22.348 1.00 0.00 C ATOM 1029 CG ASP A 67 2.351 16.270 21.817 1.00 0.00 C ATOM 1030 OD1 ASP A 67 1.262 16.806 21.719 1.00 0.00 O ATOM 1031 OD2 ASP A 67 3.405 16.806 21.514 1.00 0.00 O1- ATOM 0 H ASP A 67 0.431 15.069 20.742 1.00 0.00 H new ATOM 0 HA ASP A 67 1.021 13.333 23.039 1.00 0.00 H new ATOM 0 HB2 ASP A 67 3.001 14.802 23.257 1.00 0.00 H new ATOM 0 HB3 ASP A 67 2.883 14.189 21.619 1.00 0.00 H new ATOM 1036 N GLY A 68 -0.721 15.957 23.256 1.00 0.00 N ATOM 1037 CA GLY A 68 -1.427 16.852 24.162 1.00 0.00 C ATOM 1038 C GLY A 68 -0.557 18.047 24.539 1.00 0.00 C ATOM 1039 O GLY A 68 -0.769 18.680 25.573 1.00 0.00 O ATOM 0 H GLY A 68 -1.098 15.923 22.309 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.346 17.201 23.691 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.716 16.310 25.062 1.00 0.00 H new ATOM 1043 N SER A 69 0.419 18.352 23.691 1.00 0.00 N ATOM 1044 CA SER A 69 1.316 19.475 23.940 1.00 0.00 C ATOM 1045 C SER A 69 0.577 20.797 23.791 1.00 0.00 C ATOM 1046 O SER A 69 1.180 21.867 23.855 1.00 0.00 O ATOM 1047 CB SER A 69 2.493 19.433 22.964 1.00 0.00 C ATOM 1048 OG SER A 69 2.064 18.889 21.726 1.00 0.00 O ATOM 0 H SER A 69 0.609 17.840 22.829 1.00 0.00 H new ATOM 0 HA SER A 69 1.689 19.395 24.961 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.890 20.437 22.814 1.00 0.00 H new ATOM 0 HB3 SER A 69 3.301 18.829 23.378 1.00 0.00 H new ATOM 0 HG SER A 69 2.824 18.466 21.274 1.00 0.00 H new ATOM 1054 N GLY A 70 -0.731 20.717 23.589 1.00 0.00 N ATOM 1055 CA GLY A 70 -1.534 21.918 23.433 1.00 0.00 C ATOM 1056 C GLY A 70 -1.306 22.531 22.063 1.00 0.00 C ATOM 1057 O GLY A 70 -1.628 23.697 21.831 1.00 0.00 O ATOM 0 H GLY A 70 -1.253 19.842 23.530 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -2.589 21.677 23.560 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -1.276 22.639 24.209 1.00 0.00 H new ATOM 1061 N THR A 71 -0.754 21.736 21.155 1.00 0.00 N ATOM 1062 CA THR A 71 -0.493 22.211 19.804 1.00 0.00 C ATOM 1063 C THR A 71 -0.845 21.143 18.767 1.00 0.00 C ATOM 1064 O THR A 71 -0.306 20.035 18.791 1.00 0.00 O ATOM 1065 CB THR A 71 0.978 22.600 19.674 1.00 0.00 C ATOM 1066 OG1 THR A 71 1.765 21.728 20.467 1.00 0.00 O ATOM 1067 CG2 THR A 71 1.171 24.047 20.134 1.00 0.00 C ATOM 0 H THR A 71 -0.481 20.769 21.328 1.00 0.00 H new ATOM 0 HA THR A 71 -1.120 23.083 19.617 1.00 0.00 H new ATOM 0 HB THR A 71 1.289 22.517 18.632 1.00 0.00 H new ATOM 0 HG1 THR A 71 2.710 21.974 20.384 1.00 0.00 H new ATOM 0 HG21 THR A 71 2.222 24.322 20.040 1.00 0.00 H new ATOM 0 HG22 THR A 71 0.566 24.709 19.515 1.00 0.00 H new ATOM 0 HG23 THR A 71 0.863 24.142 21.175 1.00 0.00 H new ATOM 1075 N VAL A 72 -1.742 21.497 17.847 1.00 0.00 N ATOM 1076 CA VAL A 72 -2.155 20.575 16.786 1.00 0.00 C ATOM 1077 C VAL A 72 -1.420 20.899 15.486 1.00 0.00 C ATOM 1078 O VAL A 72 -1.721 21.883 14.814 1.00 0.00 O ATOM 1079 CB VAL A 72 -3.685 20.639 16.564 1.00 0.00 C ATOM 1080 CG1 VAL A 72 -4.236 21.982 17.052 1.00 0.00 C ATOM 1081 CG2 VAL A 72 -3.996 20.484 15.076 1.00 0.00 C ATOM 0 H VAL A 72 -2.195 22.410 17.814 1.00 0.00 H new ATOM 0 HA VAL A 72 -1.896 19.563 17.096 1.00 0.00 H new ATOM 0 HB VAL A 72 -4.153 19.831 17.127 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -5.313 22.014 16.890 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -4.025 22.097 18.115 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -3.762 22.793 16.499 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -5.074 20.529 14.923 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -3.516 21.288 14.518 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -3.620 19.524 14.724 1.00 0.00 H new ATOM 1091 N ASP A 73 -0.458 20.060 15.130 1.00 0.00 N ATOM 1092 CA ASP A 73 0.304 20.271 13.907 1.00 0.00 C ATOM 1093 C ASP A 73 -0.541 19.932 12.687 1.00 0.00 C ATOM 1094 O ASP A 73 -1.758 19.780 12.786 1.00 0.00 O ATOM 1095 CB ASP A 73 1.550 19.398 13.917 1.00 0.00 C ATOM 1096 CG ASP A 73 2.210 19.440 15.290 1.00 0.00 C ATOM 1097 OD1 ASP A 73 1.840 18.633 16.127 1.00 0.00 O ATOM 1098 OD2 ASP A 73 3.080 20.274 15.483 1.00 0.00 O1- ATOM 0 H ASP A 73 -0.188 19.234 15.664 1.00 0.00 H new ATOM 0 HA ASP A 73 0.593 21.321 13.857 1.00 0.00 H new ATOM 0 HB2 ASP A 73 1.286 18.371 13.664 1.00 0.00 H new ATOM 0 HB3 ASP A 73 2.251 19.743 13.157 1.00 0.00 H new ATOM 1103 N PHE A 74 0.106 19.819 11.533 1.00 0.00 N ATOM 1104 CA PHE A 74 -0.611 19.508 10.306 1.00 0.00 C ATOM 1105 C PHE A 74 -1.375 18.192 10.430 1.00 0.00 C ATOM 1106 O PHE A 74 -2.568 18.130 10.135 1.00 0.00 O ATOM 1107 CB PHE A 74 0.370 19.414 9.136 1.00 0.00 C ATOM 1108 CG PHE A 74 -0.248 18.605 8.016 1.00 0.00 C ATOM 1109 CD1 PHE A 74 -1.620 18.711 7.736 1.00 0.00 C ATOM 1110 CD2 PHE A 74 0.555 17.742 7.260 1.00 0.00 C ATOM 1111 CE1 PHE A 74 -2.184 17.947 6.702 1.00 0.00 C ATOM 1112 CE2 PHE A 74 -0.009 16.982 6.228 1.00 0.00 C ATOM 1113 CZ PHE A 74 -1.377 17.085 5.948 1.00 0.00 C ATOM 0 H PHE A 74 1.113 19.937 11.423 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.327 20.310 10.125 1.00 0.00 H new ATOM 0 HB2 PHE A 74 0.623 20.413 8.780 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.299 18.948 9.464 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -2.240 19.379 8.315 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.611 17.663 7.473 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -3.240 18.024 6.488 1.00 0.00 H new ATOM 0 HE2 PHE A 74 0.612 16.316 5.647 1.00 0.00 H new ATOM 0 HZ PHE A 74 -1.810 16.500 5.150 1.00 0.00 H new ATOM 1123 N ASP A 75 -0.688 17.142 10.861 1.00 0.00 N ATOM 1124 CA ASP A 75 -1.330 15.843 11.003 1.00 0.00 C ATOM 1125 C ASP A 75 -2.443 15.897 12.052 1.00 0.00 C ATOM 1126 O ASP A 75 -3.536 15.359 11.849 1.00 0.00 O ATOM 1127 CB ASP A 75 -0.295 14.807 11.413 1.00 0.00 C ATOM 1128 CG ASP A 75 0.659 14.530 10.255 1.00 0.00 C ATOM 1129 OD1 ASP A 75 0.341 14.923 9.143 1.00 0.00 O ATOM 1130 OD2 ASP A 75 1.695 13.933 10.497 1.00 0.00 O1- ATOM 0 H ASP A 75 0.300 17.163 11.115 1.00 0.00 H new ATOM 0 HA ASP A 75 -1.771 15.568 10.045 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.265 15.164 12.278 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -0.792 13.885 11.713 1.00 0.00 H new ATOM 1135 N GLU A 76 -2.154 16.554 13.172 1.00 0.00 N ATOM 1136 CA GLU A 76 -3.128 16.675 14.251 1.00 0.00 C ATOM 1137 C GLU A 76 -4.330 17.488 13.786 1.00 0.00 C ATOM 1138 O GLU A 76 -5.472 17.176 14.124 1.00 0.00 O ATOM 1139 CB GLU A 76 -2.478 17.340 15.472 1.00 0.00 C ATOM 1140 CG GLU A 76 -1.407 16.402 16.042 1.00 0.00 C ATOM 1141 CD GLU A 76 -0.674 17.060 17.209 1.00 0.00 C ATOM 1142 OE1 GLU A 76 -1.265 17.900 17.858 1.00 0.00 O ATOM 1143 OE2 GLU A 76 0.475 16.718 17.427 1.00 0.00 O1- ATOM 0 H GLU A 76 -1.259 17.008 13.355 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.469 15.679 14.532 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.031 18.293 15.188 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.232 17.555 16.229 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -1.871 15.474 16.375 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.694 16.140 15.260 1.00 0.00 H new ATOM 1150 N PHE A 77 -4.068 18.531 13.006 1.00 0.00 N ATOM 1151 CA PHE A 77 -5.140 19.381 12.502 1.00 0.00 C ATOM 1152 C PHE A 77 -5.936 18.646 11.421 1.00 0.00 C ATOM 1153 O PHE A 77 -7.163 18.763 11.339 1.00 0.00 O ATOM 1154 CB PHE A 77 -4.543 20.684 11.938 1.00 0.00 C ATOM 1155 CG PHE A 77 -4.814 20.777 10.456 1.00 0.00 C ATOM 1156 CD1 PHE A 77 -6.059 21.216 10.007 1.00 0.00 C ATOM 1157 CD2 PHE A 77 -3.831 20.410 9.537 1.00 0.00 C ATOM 1158 CE1 PHE A 77 -6.320 21.290 8.639 1.00 0.00 C ATOM 1159 CE2 PHE A 77 -4.091 20.486 8.166 1.00 0.00 C ATOM 1160 CZ PHE A 77 -5.336 20.926 7.718 1.00 0.00 C ATOM 0 H PHE A 77 -3.131 18.807 12.711 1.00 0.00 H new ATOM 0 HA PHE A 77 -5.818 19.625 13.320 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.976 21.543 12.450 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -3.469 20.711 12.122 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -6.821 21.499 10.718 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -2.868 20.067 9.885 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -7.285 21.629 8.292 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -3.329 20.204 7.455 1.00 0.00 H new ATOM 0 HZ PHE A 77 -5.539 20.985 6.659 1.00 0.00 H new ATOM 1170 N LEU A 78 -5.226 17.901 10.583 1.00 0.00 N ATOM 1171 CA LEU A 78 -5.870 17.167 9.506 1.00 0.00 C ATOM 1172 C LEU A 78 -6.931 16.243 10.087 1.00 0.00 C ATOM 1173 O LEU A 78 -7.999 16.063 9.504 1.00 0.00 O ATOM 1174 CB LEU A 78 -4.826 16.365 8.727 1.00 0.00 C ATOM 1175 CG LEU A 78 -5.207 16.321 7.247 1.00 0.00 C ATOM 1176 CD1 LEU A 78 -6.557 15.673 7.079 1.00 0.00 C ATOM 1177 CD2 LEU A 78 -5.317 17.723 6.685 1.00 0.00 C ATOM 0 H LEU A 78 -4.213 17.791 10.629 1.00 0.00 H new ATOM 0 HA LEU A 78 -6.349 17.867 8.821 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.842 16.819 8.846 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.760 15.353 9.125 1.00 0.00 H new ATOM 0 HG LEU A 78 -4.434 15.757 6.725 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -6.819 15.647 6.021 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.524 14.656 7.470 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.306 16.247 7.624 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -5.589 17.672 5.631 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -6.082 18.275 7.231 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.359 18.233 6.788 1.00 0.00 H new ATOM 1189 N VAL A 79 -6.638 15.679 11.256 1.00 0.00 N ATOM 1190 CA VAL A 79 -7.592 14.803 11.924 1.00 0.00 C ATOM 1191 C VAL A 79 -8.875 15.567 12.214 1.00 0.00 C ATOM 1192 O VAL A 79 -9.975 15.049 12.055 1.00 0.00 O ATOM 1193 CB VAL A 79 -7.001 14.273 13.225 1.00 0.00 C ATOM 1194 CG1 VAL A 79 -8.095 13.600 14.049 1.00 0.00 C ATOM 1195 CG2 VAL A 79 -5.909 13.247 12.908 1.00 0.00 C ATOM 0 H VAL A 79 -5.758 15.811 11.754 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.814 13.960 11.270 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.576 15.102 13.791 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.670 13.222 14.979 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -8.877 14.324 14.276 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.521 12.772 13.482 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -5.486 12.867 13.838 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.339 12.421 12.341 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.124 13.721 12.319 1.00 0.00 H new ATOM 1205 N MET A 80 -8.733 16.809 12.629 1.00 0.00 N ATOM 1206 CA MET A 80 -9.899 17.623 12.913 1.00 0.00 C ATOM 1207 C MET A 80 -10.786 17.703 11.680 1.00 0.00 C ATOM 1208 O MET A 80 -12.010 17.593 11.774 1.00 0.00 O ATOM 1209 CB MET A 80 -9.469 19.026 13.331 1.00 0.00 C ATOM 1210 CG MET A 80 -10.694 19.946 13.392 1.00 0.00 C ATOM 1211 SD MET A 80 -10.144 21.669 13.367 1.00 0.00 S ATOM 1212 CE MET A 80 -11.757 22.431 13.663 1.00 0.00 C ATOM 0 H MET A 80 -7.836 17.273 12.776 1.00 0.00 H new ATOM 0 HA MET A 80 -10.459 17.166 13.729 1.00 0.00 H new ATOM 0 HB2 MET A 80 -8.979 18.992 14.304 1.00 0.00 H new ATOM 0 HB3 MET A 80 -8.741 19.420 12.622 1.00 0.00 H new ATOM 0 HG2 MET A 80 -11.354 19.750 12.547 1.00 0.00 H new ATOM 0 HG3 MET A 80 -11.268 19.748 14.297 1.00 0.00 H new ATOM 0 HE1 MET A 80 -12.042 23.027 12.796 1.00 0.00 H new ATOM 0 HE2 MET A 80 -12.502 21.653 13.829 1.00 0.00 H new ATOM 0 HE3 MET A 80 -11.700 23.073 14.542 1.00 0.00 H new ATOM 1222 N MET A 81 -10.166 17.894 10.521 1.00 0.00 N ATOM 1223 CA MET A 81 -10.925 17.985 9.279 1.00 0.00 C ATOM 1224 C MET A 81 -11.708 16.702 9.036 1.00 0.00 C ATOM 1225 O MET A 81 -12.904 16.732 8.745 1.00 0.00 O ATOM 1226 CB MET A 81 -9.975 18.216 8.111 1.00 0.00 C ATOM 1227 CG MET A 81 -9.364 19.606 8.203 1.00 0.00 C ATOM 1228 SD MET A 81 -10.673 20.857 8.162 1.00 0.00 S ATOM 1229 CE MET A 81 -10.723 21.188 9.941 1.00 0.00 C ATOM 0 H MET A 81 -9.156 17.988 10.415 1.00 0.00 H new ATOM 0 HA MET A 81 -11.622 18.819 9.362 1.00 0.00 H new ATOM 0 HB2 MET A 81 -9.187 17.463 8.118 1.00 0.00 H new ATOM 0 HB3 MET A 81 -10.512 18.107 7.168 1.00 0.00 H new ATOM 0 HG2 MET A 81 -8.788 19.700 9.124 1.00 0.00 H new ATOM 0 HG3 MET A 81 -8.672 19.764 7.376 1.00 0.00 H new ATOM 0 HE1 MET A 81 -11.627 20.753 10.367 1.00 0.00 H new ATOM 0 HE2 MET A 81 -9.848 20.746 10.418 1.00 0.00 H new ATOM 0 HE3 MET A 81 -10.724 22.265 10.111 1.00 0.00 H new ATOM 1239 N VAL A 82 -11.031 15.572 9.186 1.00 0.00 N ATOM 1240 CA VAL A 82 -11.679 14.275 8.996 1.00 0.00 C ATOM 1241 C VAL A 82 -12.670 14.007 10.122 1.00 0.00 C ATOM 1242 O VAL A 82 -13.684 13.338 9.923 1.00 0.00 O ATOM 1243 CB VAL A 82 -10.637 13.144 8.926 1.00 0.00 C ATOM 1244 CG1 VAL A 82 -9.349 13.599 9.588 1.00 0.00 C ATOM 1245 CG2 VAL A 82 -11.159 11.904 9.662 1.00 0.00 C ATOM 0 H VAL A 82 -10.043 15.523 9.436 1.00 0.00 H new ATOM 0 HA VAL A 82 -12.219 14.302 8.049 1.00 0.00 H new ATOM 0 HB VAL A 82 -10.453 12.898 7.880 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.612 12.798 9.538 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.965 14.478 9.071 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.544 13.848 10.631 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.416 11.109 9.608 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -11.348 12.153 10.706 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -12.085 11.567 9.196 1.00 0.00 H new ATOM 1616 N ILE A 148 -16.560 24.724 14.730 1.00 0.00 N ATOM 1617 CA ILE A 148 -16.065 25.822 13.905 1.00 0.00 C ATOM 1618 C ILE A 148 -16.394 25.572 12.436 1.00 0.00 C ATOM 1619 O ILE A 148 -15.742 24.766 11.774 1.00 0.00 O ATOM 1620 CB ILE A 148 -14.552 25.960 14.075 1.00 0.00 C ATOM 1621 CG1 ILE A 148 -14.047 27.106 13.197 1.00 0.00 C ATOM 1622 CG2 ILE A 148 -13.868 24.658 13.660 1.00 0.00 C ATOM 1623 CD1 ILE A 148 -12.599 27.422 13.565 1.00 0.00 C ATOM 0 HA ILE A 148 -16.551 26.744 14.225 1.00 0.00 H new ATOM 0 HB ILE A 148 -14.321 26.171 15.119 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -14.115 26.831 12.145 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -14.671 27.989 13.337 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -12.790 24.759 13.782 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -14.229 23.842 14.286 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -14.097 24.444 12.616 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -12.235 28.239 12.941 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -12.546 27.715 14.614 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -11.981 26.539 13.403 1.00 0.00 H new ATOM 1635 N SER A 149 -17.410 26.268 11.935 1.00 0.00 N ATOM 1636 CA SER A 149 -17.816 26.109 10.543 1.00 0.00 C ATOM 1637 C SER A 149 -16.591 25.943 9.652 1.00 0.00 C ATOM 1638 O SER A 149 -15.909 26.916 9.336 1.00 0.00 O ATOM 1639 CB SER A 149 -18.614 27.330 10.093 1.00 0.00 C ATOM 1640 OG SER A 149 -19.586 26.932 9.136 1.00 0.00 O ATOM 0 H SER A 149 -17.962 26.941 12.466 1.00 0.00 H new ATOM 0 HA SER A 149 -18.439 25.218 10.460 1.00 0.00 H new ATOM 0 HB2 SER A 149 -19.101 27.796 10.950 1.00 0.00 H new ATOM 0 HB3 SER A 149 -17.946 28.076 9.661 1.00 0.00 H new ATOM 0 HG SER A 149 -20.100 27.715 8.847 1.00 0.00 H new ATOM 1646 N ALA A 150 -16.322 24.704 9.251 1.00 0.00 N ATOM 1647 CA ALA A 150 -15.174 24.417 8.399 1.00 0.00 C ATOM 1648 C ALA A 150 -15.286 25.162 7.074 1.00 0.00 C ATOM 1649 O ALA A 150 -14.292 25.667 6.554 1.00 0.00 O ATOM 1650 CB ALA A 150 -15.084 22.913 8.134 1.00 0.00 C ATOM 0 H ALA A 150 -16.880 23.887 9.501 1.00 0.00 H new ATOM 0 HA ALA A 150 -14.273 24.751 8.914 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -14.224 22.707 7.497 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -14.970 22.383 9.080 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -15.993 22.576 7.636 1.00 0.00 H new ATOM 1656 N ASP A 151 -16.499 25.221 6.533 1.00 0.00 N ATOM 1657 CA ASP A 151 -16.726 25.901 5.265 1.00 0.00 C ATOM 1658 C ASP A 151 -16.026 27.255 5.248 1.00 0.00 C ATOM 1659 O ASP A 151 -14.952 27.408 4.670 1.00 0.00 O ATOM 1660 CB ASP A 151 -18.224 26.110 5.053 1.00 0.00 C ATOM 1661 CG ASP A 151 -18.589 25.827 3.601 1.00 0.00 C ATOM 1662 OD1 ASP A 151 -17.708 25.911 2.762 1.00 0.00 O ATOM 1663 OD2 ASP A 151 -19.745 25.523 3.348 1.00 0.00 O1- ATOM 0 H ASP A 151 -17.334 24.809 6.950 1.00 0.00 H new ATOM 0 HA ASP A 151 -16.320 25.281 4.465 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -18.788 25.452 5.713 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -18.497 27.133 5.313 1.00 0.00 H new ATOM 1668 N ALA A 152 -16.643 28.233 5.890 1.00 0.00 N ATOM 1669 CA ALA A 152 -16.075 29.569 5.945 1.00 0.00 C ATOM 1670 C ALA A 152 -14.722 29.551 6.636 1.00 0.00 C ATOM 1671 O ALA A 152 -13.821 30.308 6.274 1.00 0.00 O ATOM 1672 CB ALA A 152 -17.019 30.500 6.685 1.00 0.00 C ATOM 0 H ALA A 152 -17.533 28.128 6.378 1.00 0.00 H new ATOM 0 HA ALA A 152 -15.937 29.928 4.925 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -16.588 31.500 6.723 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -17.976 30.537 6.164 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -17.172 30.132 7.700 1.00 0.00 H new ATOM 1678 N MET A 153 -14.584 28.695 7.640 1.00 0.00 N ATOM 1679 CA MET A 153 -13.334 28.607 8.375 1.00 0.00 C ATOM 1680 C MET A 153 -12.160 28.519 7.412 1.00 0.00 C ATOM 1681 O MET A 153 -11.204 29.294 7.506 1.00 0.00 O ATOM 1682 CB MET A 153 -13.356 27.353 9.259 1.00 0.00 C ATOM 1683 CG MET A 153 -11.950 27.062 9.796 1.00 0.00 C ATOM 1684 SD MET A 153 -11.916 25.416 10.551 1.00 0.00 S ATOM 1685 CE MET A 153 -10.117 25.197 10.529 1.00 0.00 C ATOM 0 H MET A 153 -15.315 28.059 7.960 1.00 0.00 H new ATOM 0 HA MET A 153 -13.221 29.499 8.991 1.00 0.00 H new ATOM 0 HB2 MET A 153 -14.048 27.496 10.089 1.00 0.00 H new ATOM 0 HB3 MET A 153 -13.718 26.500 8.685 1.00 0.00 H new ATOM 0 HG2 MET A 153 -11.222 27.117 8.986 1.00 0.00 H new ATOM 0 HG3 MET A 153 -11.667 27.816 10.531 1.00 0.00 H new ATOM 0 HE1 MET A 153 -9.855 24.409 9.823 1.00 0.00 H new ATOM 0 HE2 MET A 153 -9.641 26.129 10.225 1.00 0.00 H new ATOM 0 HE3 MET A 153 -9.772 24.921 11.525 1.00 0.00 H new ATOM 1695 N MET A 154 -12.240 27.590 6.474 1.00 0.00 N ATOM 1696 CA MET A 154 -11.177 27.435 5.500 1.00 0.00 C ATOM 1697 C MET A 154 -11.167 28.611 4.536 1.00 0.00 C ATOM 1698 O MET A 154 -10.119 28.983 4.009 1.00 0.00 O ATOM 1699 CB MET A 154 -11.358 26.143 4.716 1.00 0.00 C ATOM 1700 CG MET A 154 -10.597 25.012 5.411 1.00 0.00 C ATOM 1701 SD MET A 154 -9.732 24.018 4.175 1.00 0.00 S ATOM 1702 CE MET A 154 -8.208 24.991 4.167 1.00 0.00 C ATOM 0 H MET A 154 -13.019 26.941 6.368 1.00 0.00 H new ATOM 0 HA MET A 154 -10.228 27.400 6.036 1.00 0.00 H new ATOM 0 HB2 MET A 154 -12.417 25.893 4.646 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.992 26.269 3.697 1.00 0.00 H new ATOM 0 HG2 MET A 154 -9.884 25.424 6.125 1.00 0.00 H new ATOM 0 HG3 MET A 154 -11.289 24.387 5.976 1.00 0.00 H new ATOM 0 HE1 MET A 154 -7.890 25.161 3.138 1.00 0.00 H new ATOM 0 HE2 MET A 154 -8.386 25.949 4.655 1.00 0.00 H new ATOM 0 HE3 MET A 154 -7.428 24.450 4.703 1.00 0.00 H new ATOM 1712 N GLN A 155 -12.344 29.184 4.298 1.00 0.00 N ATOM 1713 CA GLN A 155 -12.451 30.307 3.378 1.00 0.00 C ATOM 1714 C GLN A 155 -11.607 31.472 3.877 1.00 0.00 C ATOM 1715 O GLN A 155 -10.912 32.124 3.098 1.00 0.00 O ATOM 1716 CB GLN A 155 -13.910 30.759 3.263 1.00 0.00 C ATOM 1717 CG GLN A 155 -14.726 29.674 2.571 1.00 0.00 C ATOM 1718 CD GLN A 155 -16.113 30.199 2.216 1.00 0.00 C ATOM 1719 OE1 GLN A 155 -16.992 29.423 1.840 1.00 0.00 O ATOM 1720 NE2 GLN A 155 -16.360 31.476 2.300 1.00 0.00 N ATOM 0 H GLN A 155 -13.224 28.893 4.724 1.00 0.00 H new ATOM 0 HA GLN A 155 -12.092 29.988 2.400 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -14.319 30.960 4.253 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -13.970 31.690 2.699 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -14.213 29.344 1.668 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -14.815 28.805 3.223 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -15.630 32.117 2.612 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -17.283 31.834 2.054 1.00 0.00 H new ATOM 1729 N ALA A 156 -11.668 31.724 5.181 1.00 0.00 N ATOM 1730 CA ALA A 156 -10.897 32.808 5.774 1.00 0.00 C ATOM 1731 C ALA A 156 -9.403 32.541 5.630 1.00 0.00 C ATOM 1732 O ALA A 156 -8.629 33.434 5.287 1.00 0.00 O ATOM 1733 CB ALA A 156 -11.248 32.944 7.261 1.00 0.00 C ATOM 0 H ALA A 156 -12.239 31.196 5.841 1.00 0.00 H new ATOM 0 HA ALA A 156 -11.144 33.733 5.253 1.00 0.00 H new ATOM 0 HB1 ALA A 156 -10.668 33.756 7.699 1.00 0.00 H new ATOM 0 HB2 ALA A 156 -12.311 33.160 7.366 1.00 0.00 H new ATOM 0 HB3 ALA A 156 -11.014 32.013 7.777 1.00 0.00 H new ATOM 1739 N LEU A 157 -9.004 31.302 5.895 1.00 0.00 N ATOM 1740 CA LEU A 157 -7.590 30.931 5.805 1.00 0.00 C ATOM 1741 C LEU A 157 -7.106 31.005 4.365 1.00 0.00 C ATOM 1742 O LEU A 157 -6.007 31.490 4.094 1.00 0.00 O ATOM 1743 CB LEU A 157 -7.375 29.512 6.324 1.00 0.00 C ATOM 1744 CG LEU A 157 -8.510 29.137 7.272 1.00 0.00 C ATOM 1745 CD1 LEU A 157 -8.216 27.801 7.936 1.00 0.00 C ATOM 1746 CD2 LEU A 157 -8.672 30.211 8.346 1.00 0.00 C ATOM 0 H LEU A 157 -9.628 30.544 6.171 1.00 0.00 H new ATOM 0 HA LEU A 157 -7.023 31.634 6.415 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -7.337 28.811 5.490 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -6.418 29.444 6.841 1.00 0.00 H new ATOM 0 HG LEU A 157 -9.433 29.059 6.697 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -9.032 27.543 8.611 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -8.118 27.029 7.173 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -7.287 27.872 8.501 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -9.485 29.934 9.018 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -7.746 30.300 8.914 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -8.901 31.166 7.874 1.00 0.00 H new ATOM 1758 N LEU A 158 -7.926 30.513 3.446 1.00 0.00 N ATOM 1759 CA LEU A 158 -7.561 30.522 2.039 1.00 0.00 C ATOM 1760 C LEU A 158 -7.796 31.906 1.443 1.00 0.00 C ATOM 1761 O LEU A 158 -7.416 32.166 0.304 1.00 0.00 O ATOM 1762 CB LEU A 158 -8.377 29.483 1.269 1.00 0.00 C ATOM 1763 CG LEU A 158 -8.159 28.106 1.890 1.00 0.00 C ATOM 1764 CD1 LEU A 158 -8.923 27.041 1.093 1.00 0.00 C ATOM 1765 CD2 LEU A 158 -6.671 27.762 1.910 1.00 0.00 C ATOM 0 H LEU A 158 -8.839 30.107 3.648 1.00 0.00 H new ATOM 0 HA LEU A 158 -6.503 30.272 1.956 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -9.435 29.743 1.296 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -8.078 29.473 0.221 1.00 0.00 H new ATOM 0 HG LEU A 158 -8.533 28.125 2.914 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -8.761 26.062 1.545 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -9.988 27.273 1.103 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -8.564 27.030 0.064 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -6.531 26.777 2.356 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -6.285 27.757 0.891 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -6.133 28.506 2.498 1.00 0.00 H new