USER MOD reduce.3.24.130724 H: found=0, std=0, add=608, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 606 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 123 ASN : amide:sc= -3.15 K(o=-7.6,f=-15!) USER MOD Set 1.2: A 179 MET CE :methyl -171:sc= -4.47 (180deg=-4.03) USER MOD Single : A 113 ASN : amide:sc= -0.0921 K(o=-0.092,f=-0.65) USER MOD Single : A 114 LYS NZ :NH3+ 141:sc= 0 (180deg=-0.0749) USER MOD Single : A 122 HIS :FLIP no HD1:sc=-0.00156 F(o=-0.81,f=-0.0016) USER MOD Single : A 124 CYS SG : rot 180:sc= -0.892 USER MOD Single : A 127 THR OG1 : rot 180:sc=0.000456 USER MOD Single : A 132 TYR OH : rot 165:sc= 0.682 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 MET CE :methyl -166:sc= -5.43! (180deg=-5.84!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 179:sc= 0 (180deg=-9.92e-05) USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 166 SER OG : rot -162:sc= -0.576 USER MOD Single : A 169 GLN : amide:sc= -0.0262 X(o=-0.026,f=0) USER MOD Single : A 172 ASN : amide:sc= -0.0369 X(o=-0.037,f=0) USER MOD Single : A 173 MET CE :methyl -145:sc= -0.0531 (180deg=-1.35) USER MOD Single : A 174 HIS : no HE2:sc= -1.72! C(o=-1.7!,f=-1.4!) USER MOD Single : A 176 HIS : no HD1:sc= -5.66! C(o=-5.7!,f=-5.6!) USER MOD Single : A 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.00917) USER MOD ----------------------------------------------------------------- ATOM 110 N ASN A 113 -5.207 -7.264 10.221 1.00 0.00 N ATOM 111 CA ASN A 113 -4.686 -8.552 9.776 1.00 0.00 C ATOM 112 C ASN A 113 -5.790 -9.398 9.150 1.00 0.00 C ATOM 113 O ASN A 113 -5.874 -10.604 9.387 1.00 0.00 O ATOM 114 CB ASN A 113 -4.056 -9.303 10.951 1.00 0.00 C ATOM 115 CG ASN A 113 -3.326 -8.377 11.905 1.00 0.00 C ATOM 116 OD1 ASN A 113 -2.743 -7.375 11.491 1.00 0.00 O ATOM 117 ND2 ASN A 113 -3.356 -8.709 13.190 1.00 0.00 N ATOM 0 HA ASN A 113 -3.923 -8.367 9.020 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -4.834 -9.840 11.494 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -3.360 -10.050 10.570 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -2.883 -8.124 13.879 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -3.852 -9.549 13.488 1.00 0.00 H new ATOM 124 N LYS A 114 -6.636 -8.759 8.349 1.00 0.00 N ATOM 125 CA LYS A 114 -7.735 -9.452 7.686 1.00 0.00 C ATOM 126 C LYS A 114 -7.434 -9.656 6.205 1.00 0.00 C ATOM 127 O LYS A 114 -6.805 -8.811 5.568 1.00 0.00 O ATOM 128 CB LYS A 114 -9.035 -8.662 7.850 1.00 0.00 C ATOM 129 CG LYS A 114 -10.286 -9.506 7.668 1.00 0.00 C ATOM 130 CD LYS A 114 -11.438 -8.682 7.118 1.00 0.00 C ATOM 131 CE LYS A 114 -12.060 -7.806 8.194 1.00 0.00 C ATOM 132 NZ LYS A 114 -12.925 -8.591 9.117 1.00 0.00 N ATOM 0 H LYS A 114 -6.582 -7.761 8.143 1.00 0.00 H new ATOM 0 HA LYS A 114 -7.850 -10.430 8.153 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -9.053 -8.210 8.841 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.049 -7.846 7.127 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -10.073 -10.333 6.991 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -10.574 -9.943 8.624 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -11.081 -8.057 6.300 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -12.197 -9.346 6.704 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -11.271 -7.316 8.764 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -12.650 -7.019 7.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -12.799 -8.244 10.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -13.921 -8.482 8.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -12.660 -9.596 9.071 1.00 0.00 H new ATOM 146 N ILE A 115 -7.890 -10.780 5.663 1.00 0.00 N ATOM 147 CA ILE A 115 -7.672 -11.093 4.256 1.00 0.00 C ATOM 148 C ILE A 115 -8.986 -11.420 3.555 1.00 0.00 C ATOM 149 O ILE A 115 -9.952 -11.842 4.191 1.00 0.00 O ATOM 150 CB ILE A 115 -6.703 -12.278 4.086 1.00 0.00 C ATOM 151 CG1 ILE A 115 -7.356 -13.573 4.574 1.00 0.00 C ATOM 152 CG2 ILE A 115 -5.407 -12.015 4.839 1.00 0.00 C ATOM 153 CD1 ILE A 115 -6.705 -14.822 4.024 1.00 0.00 C ATOM 0 H ILE A 115 -8.413 -11.489 6.177 1.00 0.00 H new ATOM 0 HA ILE A 115 -7.231 -10.206 3.801 1.00 0.00 H new ATOM 0 HB ILE A 115 -6.469 -12.388 3.027 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -7.317 -13.602 5.663 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -8.409 -13.568 4.293 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.733 -12.861 4.709 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -4.936 -11.113 4.449 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -5.623 -11.882 5.899 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -7.219 -15.701 4.412 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -6.767 -14.816 2.936 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -5.658 -14.851 4.327 1.00 0.00 H new ATOM 165 N PHE A 116 -9.014 -11.225 2.241 1.00 0.00 N ATOM 166 CA PHE A 116 -10.210 -11.501 1.453 1.00 0.00 C ATOM 167 C PHE A 116 -10.051 -12.794 0.658 1.00 0.00 C ATOM 168 O PHE A 116 -9.327 -12.840 -0.336 1.00 0.00 O ATOM 169 CB PHE A 116 -10.500 -10.337 0.503 1.00 0.00 C ATOM 170 CG PHE A 116 -11.399 -10.707 -0.641 1.00 0.00 C ATOM 171 CD1 PHE A 116 -12.769 -10.812 -0.458 1.00 0.00 C ATOM 172 CD2 PHE A 116 -10.875 -10.950 -1.901 1.00 0.00 C ATOM 173 CE1 PHE A 116 -13.598 -11.153 -1.509 1.00 0.00 C ATOM 174 CE2 PHE A 116 -11.700 -11.292 -2.956 1.00 0.00 C ATOM 175 CZ PHE A 116 -13.064 -11.392 -2.760 1.00 0.00 C ATOM 0 H PHE A 116 -8.223 -10.877 1.699 1.00 0.00 H new ATOM 0 HA PHE A 116 -11.048 -11.618 2.140 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -10.958 -9.524 1.066 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -9.558 -9.959 0.107 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -13.193 -10.625 0.517 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.810 -10.871 -2.060 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -14.664 -11.233 -1.352 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -11.279 -11.481 -3.932 1.00 0.00 H new ATOM 0 HZ PHE A 116 -13.711 -11.656 -3.583 1.00 0.00 H new ATOM 185 N VAL A 117 -10.734 -13.843 1.104 1.00 0.00 N ATOM 186 CA VAL A 117 -10.670 -15.137 0.435 1.00 0.00 C ATOM 187 C VAL A 117 -11.918 -15.384 -0.404 1.00 0.00 C ATOM 188 O VAL A 117 -13.038 -15.356 0.106 1.00 0.00 O ATOM 189 CB VAL A 117 -10.511 -16.286 1.449 1.00 0.00 C ATOM 190 CG1 VAL A 117 -10.533 -17.631 0.740 1.00 0.00 C ATOM 191 CG2 VAL A 117 -9.228 -16.116 2.249 1.00 0.00 C ATOM 0 H VAL A 117 -11.338 -13.822 1.926 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.796 -15.114 -0.216 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.351 -16.255 2.142 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.419 -18.430 1.472 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.481 -17.751 0.216 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -9.714 -17.677 0.022 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.131 -16.936 2.960 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -8.374 -16.120 1.572 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.258 -15.169 2.789 1.00 0.00 H new ATOM 201 N GLY A 118 -11.718 -15.627 -1.696 1.00 0.00 N ATOM 202 CA GLY A 118 -12.837 -15.876 -2.586 1.00 0.00 C ATOM 203 C GLY A 118 -12.692 -17.178 -3.349 1.00 0.00 C ATOM 204 O GLY A 118 -11.756 -17.941 -3.116 1.00 0.00 O ATOM 0 H GLY A 118 -10.801 -15.656 -2.142 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -13.760 -15.899 -2.007 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.925 -15.052 -3.294 1.00 0.00 H new ATOM 208 N GLY A 119 -13.623 -17.433 -4.264 1.00 0.00 N ATOM 209 CA GLY A 119 -13.578 -18.653 -5.048 1.00 0.00 C ATOM 210 C GLY A 119 -13.551 -19.898 -4.183 1.00 0.00 C ATOM 211 O GLY A 119 -13.207 -20.982 -4.654 1.00 0.00 O ATOM 0 H GLY A 119 -14.407 -16.816 -4.476 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -14.446 -18.690 -5.706 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -12.695 -18.639 -5.686 1.00 0.00 H new ATOM 215 N ILE A 120 -13.914 -19.742 -2.914 1.00 0.00 N ATOM 216 CA ILE A 120 -13.930 -20.863 -1.982 1.00 0.00 C ATOM 217 C ILE A 120 -14.962 -21.907 -2.395 1.00 0.00 C ATOM 218 O ILE A 120 -16.079 -21.586 -2.800 1.00 0.00 O ATOM 219 CB ILE A 120 -14.235 -20.396 -0.546 1.00 0.00 C ATOM 220 CG1 ILE A 120 -13.196 -19.370 -0.089 1.00 0.00 C ATOM 221 CG2 ILE A 120 -14.266 -21.586 0.402 1.00 0.00 C ATOM 222 CD1 ILE A 120 -13.631 -18.567 1.117 1.00 0.00 C ATOM 0 H ILE A 120 -14.201 -18.851 -2.508 1.00 0.00 H new ATOM 0 HA ILE A 120 -12.936 -21.309 -2.007 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.216 -19.921 -0.534 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -12.265 -19.887 0.145 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -12.984 -18.688 -0.912 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -14.483 -21.240 1.413 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -15.040 -22.285 0.084 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -13.298 -22.087 0.389 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -12.846 -17.860 1.386 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -14.545 -18.022 0.881 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -13.815 -19.240 1.955 1.00 0.00 H new ATOM 234 N PRO A 121 -14.581 -23.189 -2.289 1.00 0.00 N ATOM 235 CA PRO A 121 -15.460 -24.307 -2.645 1.00 0.00 C ATOM 236 C PRO A 121 -16.618 -24.468 -1.667 1.00 0.00 C ATOM 237 O PRO A 121 -16.619 -23.876 -0.587 1.00 0.00 O ATOM 238 CB PRO A 121 -14.531 -25.522 -2.579 1.00 0.00 C ATOM 239 CG PRO A 121 -13.454 -25.125 -1.629 1.00 0.00 C ATOM 240 CD PRO A 121 -13.264 -23.645 -1.814 1.00 0.00 C ATOM 0 HA PRO A 121 -15.929 -24.164 -3.619 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -15.062 -26.407 -2.228 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -14.124 -25.763 -3.561 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -13.735 -25.357 -0.602 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -12.531 -25.666 -1.837 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -12.982 -23.156 -0.881 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -12.478 -23.428 -2.538 1.00 0.00 H new ATOM 248 N HIS A 122 -17.604 -25.274 -2.051 1.00 0.00 N ATOM 249 CA HIS A 122 -18.768 -25.513 -1.206 1.00 0.00 C ATOM 250 C HIS A 122 -18.461 -26.564 -0.143 1.00 0.00 C ATOM 251 O HIS A 122 -19.331 -26.940 0.641 1.00 0.00 O ATOM 252 CB HIS A 122 -19.957 -25.963 -2.056 1.00 0.00 C ATOM 253 CG HIS A 122 -19.683 -27.193 -2.865 1.00 0.00 C ATOM 254 ND1 HIS A 122 -19.016 -27.354 -4.032 1.00 0.00 N flip ATOM 255 CD2 HIS A 122 -20.118 -28.449 -2.497 1.00 0.00 C flip ATOM 256 CE1 HIS A 122 -19.058 -28.691 -4.343 1.00 0.00 C flip ATOM 257 NE2 HIS A 122 -19.728 -29.330 -3.401 1.00 0.00 N flip ATOM 0 H HIS A 122 -17.619 -25.772 -2.941 1.00 0.00 H new ATOM 0 HA HIS A 122 -19.021 -24.578 -0.705 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -20.810 -26.150 -1.403 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -20.241 -25.152 -2.727 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -20.688 -28.677 -1.609 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -18.615 -29.146 -5.216 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -19.913 -30.333 -3.376 1.00 0.00 H new ATOM 265 N ASN A 123 -17.218 -27.033 -0.123 1.00 0.00 N ATOM 266 CA ASN A 123 -16.797 -28.041 0.843 1.00 0.00 C ATOM 267 C ASN A 123 -15.889 -27.430 1.906 1.00 0.00 C ATOM 268 O ASN A 123 -15.848 -27.897 3.045 1.00 0.00 O ATOM 269 CB ASN A 123 -16.071 -29.186 0.133 1.00 0.00 C ATOM 270 CG ASN A 123 -15.194 -28.698 -1.004 1.00 0.00 C ATOM 271 OD1 ASN A 123 -14.302 -27.873 -0.805 1.00 0.00 O ATOM 272 ND2 ASN A 123 -15.445 -29.206 -2.205 1.00 0.00 N ATOM 0 H ASN A 123 -16.485 -26.731 -0.765 1.00 0.00 H new ATOM 0 HA ASN A 123 -17.688 -28.433 1.333 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -15.458 -29.727 0.854 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -16.805 -29.892 -0.255 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -14.888 -28.915 -3.008 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -16.194 -29.888 -2.324 1.00 0.00 H new ATOM 279 N CYS A 124 -15.163 -26.384 1.526 1.00 0.00 N ATOM 280 CA CYS A 124 -14.255 -25.709 2.446 1.00 0.00 C ATOM 281 C CYS A 124 -15.031 -24.888 3.471 1.00 0.00 C ATOM 282 O CYS A 124 -15.978 -24.182 3.128 1.00 0.00 O ATOM 283 CB CYS A 124 -13.293 -24.805 1.674 1.00 0.00 C ATOM 284 SG CYS A 124 -12.278 -23.739 2.725 1.00 0.00 S ATOM 0 H CYS A 124 -15.186 -25.985 0.587 1.00 0.00 H new ATOM 0 HA CYS A 124 -13.682 -26.470 2.975 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -12.637 -25.427 1.064 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -13.868 -24.181 0.989 1.00 0.00 H new ATOM 0 HG CYS A 124 -11.496 -23.014 1.981 1.00 0.00 H new ATOM 290 N GLY A 125 -14.624 -24.989 4.733 1.00 0.00 N ATOM 291 CA GLY A 125 -15.293 -24.252 5.790 1.00 0.00 C ATOM 292 C GLY A 125 -14.321 -23.670 6.796 1.00 0.00 C ATOM 293 O GLY A 125 -13.116 -23.906 6.712 1.00 0.00 O ATOM 0 H GLY A 125 -13.843 -25.568 5.042 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -15.882 -23.447 5.351 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -15.991 -24.913 6.304 1.00 0.00 H new ATOM 297 N GLU A 126 -14.845 -22.905 7.749 1.00 0.00 N ATOM 298 CA GLU A 126 -14.013 -22.285 8.773 1.00 0.00 C ATOM 299 C GLU A 126 -12.842 -23.191 9.145 1.00 0.00 C ATOM 300 O GLU A 126 -11.689 -22.896 8.828 1.00 0.00 O ATOM 301 CB GLU A 126 -14.846 -21.974 10.018 1.00 0.00 C ATOM 302 CG GLU A 126 -14.082 -21.207 11.085 1.00 0.00 C ATOM 303 CD GLU A 126 -14.999 -20.469 12.042 1.00 0.00 C ATOM 304 OE1 GLU A 126 -15.486 -21.099 13.003 1.00 0.00 O ATOM 305 OE2 GLU A 126 -15.228 -19.260 11.828 1.00 0.00 O ATOM 0 H GLU A 126 -15.841 -22.700 7.833 1.00 0.00 H new ATOM 0 HA GLU A 126 -13.616 -21.354 8.368 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -15.722 -21.396 9.724 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.210 -22.909 10.445 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -13.457 -21.900 11.648 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -13.413 -20.493 10.605 1.00 0.00 H new ATOM 312 N THR A 127 -13.146 -24.295 9.820 1.00 0.00 N ATOM 313 CA THR A 127 -12.121 -25.243 10.237 1.00 0.00 C ATOM 314 C THR A 127 -11.022 -25.361 9.187 1.00 0.00 C ATOM 315 O THR A 127 -9.874 -24.993 9.433 1.00 0.00 O ATOM 316 CB THR A 127 -12.718 -26.638 10.498 1.00 0.00 C ATOM 317 OG1 THR A 127 -13.856 -26.530 11.360 1.00 0.00 O ATOM 318 CG2 THR A 127 -11.685 -27.561 11.126 1.00 0.00 C ATOM 0 H THR A 127 -14.095 -24.555 10.090 1.00 0.00 H new ATOM 0 HA THR A 127 -11.695 -24.860 11.164 1.00 0.00 H new ATOM 0 HB THR A 127 -13.026 -27.062 9.542 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.231 -27.421 11.520 1.00 0.00 H new ATOM 0 HG21 THR A 127 -12.131 -28.540 11.301 1.00 0.00 H new ATOM 0 HG22 THR A 127 -10.833 -27.665 10.454 1.00 0.00 H new ATOM 0 HG23 THR A 127 -11.350 -27.140 12.074 1.00 0.00 H new ATOM 326 N GLU A 128 -11.382 -25.877 8.016 1.00 0.00 N ATOM 327 CA GLU A 128 -10.425 -26.044 6.928 1.00 0.00 C ATOM 328 C GLU A 128 -9.609 -24.771 6.722 1.00 0.00 C ATOM 329 O GLU A 128 -8.389 -24.767 6.893 1.00 0.00 O ATOM 330 CB GLU A 128 -11.150 -26.413 5.633 1.00 0.00 C ATOM 331 CG GLU A 128 -11.921 -27.719 5.718 1.00 0.00 C ATOM 332 CD GLU A 128 -11.168 -28.794 6.478 1.00 0.00 C ATOM 333 OE1 GLU A 128 -9.935 -28.890 6.304 1.00 0.00 O ATOM 334 OE2 GLU A 128 -11.811 -29.537 7.247 1.00 0.00 O ATOM 0 H GLU A 128 -12.329 -26.186 7.796 1.00 0.00 H new ATOM 0 HA GLU A 128 -9.745 -26.852 7.197 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -11.839 -25.610 5.371 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -10.421 -26.483 4.826 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -12.880 -27.539 6.205 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -12.137 -28.075 4.711 1.00 0.00 H new ATOM 341 N LEU A 129 -10.290 -23.692 6.354 1.00 0.00 N ATOM 342 CA LEU A 129 -9.630 -22.412 6.123 1.00 0.00 C ATOM 343 C LEU A 129 -8.455 -22.225 7.078 1.00 0.00 C ATOM 344 O LEU A 129 -7.370 -21.811 6.669 1.00 0.00 O ATOM 345 CB LEU A 129 -10.626 -21.263 6.292 1.00 0.00 C ATOM 346 CG LEU A 129 -11.768 -21.210 5.277 1.00 0.00 C ATOM 347 CD1 LEU A 129 -12.854 -20.255 5.745 1.00 0.00 C ATOM 348 CD2 LEU A 129 -11.246 -20.798 3.908 1.00 0.00 C ATOM 0 H LEU A 129 -11.300 -23.678 6.209 1.00 0.00 H new ATOM 0 HA LEU A 129 -9.249 -22.407 5.102 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -11.057 -21.327 7.291 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -10.077 -20.323 6.241 1.00 0.00 H new ATOM 0 HG LEU A 129 -12.201 -22.207 5.194 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -13.658 -20.230 5.010 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -13.248 -20.594 6.703 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -12.435 -19.255 5.858 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -12.073 -20.766 3.198 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -10.787 -19.812 3.975 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -10.504 -21.521 3.569 1.00 0.00 H new ATOM 360 N ARG A 130 -8.678 -22.537 8.350 1.00 0.00 N ATOM 361 CA ARG A 130 -7.637 -22.405 9.363 1.00 0.00 C ATOM 362 C ARG A 130 -6.515 -23.410 9.123 1.00 0.00 C ATOM 363 O ARG A 130 -5.352 -23.034 8.984 1.00 0.00 O ATOM 364 CB ARG A 130 -8.227 -22.606 10.760 1.00 0.00 C ATOM 365 CG ARG A 130 -9.372 -21.659 11.080 1.00 0.00 C ATOM 366 CD ARG A 130 -9.581 -21.525 12.580 1.00 0.00 C ATOM 367 NE ARG A 130 -10.107 -20.212 12.944 1.00 0.00 N ATOM 368 CZ ARG A 130 -10.549 -19.909 14.160 1.00 0.00 C ATOM 369 NH1 ARG A 130 -10.529 -20.820 15.123 1.00 0.00 N ATOM 370 NH2 ARG A 130 -11.013 -18.692 14.414 1.00 0.00 N ATOM 0 H ARG A 130 -9.570 -22.883 8.704 1.00 0.00 H new ATOM 0 HA ARG A 130 -7.222 -21.400 9.293 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -8.580 -23.633 10.852 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -7.439 -22.473 11.501 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -9.165 -20.678 10.651 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -10.288 -22.024 10.615 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -10.269 -22.298 12.921 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -8.634 -21.692 13.094 1.00 0.00 H new ATOM 0 HE ARG A 130 -10.137 -19.488 12.226 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -10.174 -21.757 14.932 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -10.869 -20.584 16.055 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -11.031 -17.989 13.676 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -11.352 -18.460 15.348 1.00 0.00 H new ATOM 384 N GLU A 131 -6.873 -24.690 9.078 1.00 0.00 N ATOM 385 CA GLU A 131 -5.895 -25.748 8.856 1.00 0.00 C ATOM 386 C GLU A 131 -4.969 -25.400 7.694 1.00 0.00 C ATOM 387 O GLU A 131 -3.829 -25.860 7.635 1.00 0.00 O ATOM 388 CB GLU A 131 -6.602 -27.077 8.579 1.00 0.00 C ATOM 389 CG GLU A 131 -7.353 -27.629 9.779 1.00 0.00 C ATOM 390 CD GLU A 131 -6.447 -28.367 10.744 1.00 0.00 C ATOM 391 OE1 GLU A 131 -5.295 -27.925 10.935 1.00 0.00 O ATOM 392 OE2 GLU A 131 -6.890 -29.389 11.310 1.00 0.00 O ATOM 0 H GLU A 131 -7.832 -25.018 9.192 1.00 0.00 H new ATOM 0 HA GLU A 131 -5.293 -25.846 9.760 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -7.302 -26.942 7.754 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -5.864 -27.811 8.254 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -7.846 -26.810 10.303 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -8.137 -28.304 9.434 1.00 0.00 H new ATOM 399 N TYR A 132 -5.469 -24.585 6.772 1.00 0.00 N ATOM 400 CA TYR A 132 -4.688 -24.176 5.610 1.00 0.00 C ATOM 401 C TYR A 132 -4.067 -22.800 5.827 1.00 0.00 C ATOM 402 O TYR A 132 -2.986 -22.506 5.317 1.00 0.00 O ATOM 403 CB TYR A 132 -5.569 -24.159 4.359 1.00 0.00 C ATOM 404 CG TYR A 132 -4.785 -24.095 3.068 1.00 0.00 C ATOM 405 CD1 TYR A 132 -4.172 -22.917 2.661 1.00 0.00 C ATOM 406 CD2 TYR A 132 -4.657 -25.215 2.255 1.00 0.00 C ATOM 407 CE1 TYR A 132 -3.456 -22.854 1.482 1.00 0.00 C ATOM 408 CE2 TYR A 132 -3.941 -25.162 1.074 1.00 0.00 C ATOM 409 CZ TYR A 132 -3.343 -23.979 0.692 1.00 0.00 C ATOM 410 OH TYR A 132 -2.629 -23.921 -0.483 1.00 0.00 O ATOM 0 H TYR A 132 -6.411 -24.195 6.806 1.00 0.00 H new ATOM 0 HA TYR A 132 -3.884 -24.899 5.471 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -6.193 -25.053 4.352 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.241 -23.302 4.409 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -4.257 -22.034 3.278 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -5.125 -26.142 2.551 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.987 -21.929 1.180 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -3.850 -26.042 0.454 1.00 0.00 H new ATOM 0 HH TYR A 132 -2.441 -24.830 -0.797 1.00 0.00 H new ATOM 420 N PHE A 133 -4.759 -21.959 6.589 1.00 0.00 N ATOM 421 CA PHE A 133 -4.277 -20.613 6.875 1.00 0.00 C ATOM 422 C PHE A 133 -3.566 -20.565 8.224 1.00 0.00 C ATOM 423 O PHE A 133 -3.360 -19.492 8.793 1.00 0.00 O ATOM 424 CB PHE A 133 -5.440 -19.618 6.862 1.00 0.00 C ATOM 425 CG PHE A 133 -5.988 -19.355 5.489 1.00 0.00 C ATOM 426 CD1 PHE A 133 -5.143 -19.018 4.444 1.00 0.00 C ATOM 427 CD2 PHE A 133 -7.349 -19.443 5.244 1.00 0.00 C ATOM 428 CE1 PHE A 133 -5.645 -18.775 3.179 1.00 0.00 C ATOM 429 CE2 PHE A 133 -7.856 -19.202 3.981 1.00 0.00 C ATOM 430 CZ PHE A 133 -7.003 -18.866 2.948 1.00 0.00 C ATOM 0 H PHE A 133 -5.655 -22.186 7.019 1.00 0.00 H new ATOM 0 HA PHE A 133 -3.564 -20.337 6.099 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -6.240 -19.998 7.497 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -5.107 -18.676 7.298 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -4.080 -18.944 4.620 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -8.021 -19.703 6.049 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -4.976 -18.514 2.373 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -8.918 -19.276 3.802 1.00 0.00 H new ATOM 0 HZ PHE A 133 -7.398 -18.675 1.961 1.00 0.00 H new ATOM 440 N LYS A 134 -3.194 -21.735 8.732 1.00 0.00 N ATOM 441 CA LYS A 134 -2.506 -21.829 10.014 1.00 0.00 C ATOM 442 C LYS A 134 -0.994 -21.886 9.817 1.00 0.00 C ATOM 443 O LYS A 134 -0.228 -21.465 10.684 1.00 0.00 O ATOM 444 CB LYS A 134 -2.978 -23.067 10.780 1.00 0.00 C ATOM 445 CG LYS A 134 -2.511 -24.376 10.167 1.00 0.00 C ATOM 446 CD LYS A 134 -2.645 -25.529 11.147 1.00 0.00 C ATOM 447 CE LYS A 134 -2.083 -26.819 10.569 1.00 0.00 C ATOM 448 NZ LYS A 134 -0.598 -26.870 10.665 1.00 0.00 N ATOM 0 H LYS A 134 -3.358 -22.632 8.275 1.00 0.00 H new ATOM 0 HA LYS A 134 -2.746 -20.937 10.593 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -2.618 -23.008 11.807 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.067 -23.064 10.823 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -3.095 -24.588 9.272 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -1.471 -24.282 9.854 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -2.122 -25.285 12.072 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -3.695 -25.671 11.403 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -2.510 -27.670 11.098 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -2.383 -26.910 9.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -0.254 -27.764 10.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -0.188 -26.072 10.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -0.312 -26.809 11.663 1.00 0.00 H new ATOM 462 N LYS A 135 -0.570 -22.407 8.670 1.00 0.00 N ATOM 463 CA LYS A 135 0.849 -22.516 8.357 1.00 0.00 C ATOM 464 C LYS A 135 1.469 -21.138 8.153 1.00 0.00 C ATOM 465 O LYS A 135 2.632 -20.913 8.489 1.00 0.00 O ATOM 466 CB LYS A 135 1.052 -23.370 7.103 1.00 0.00 C ATOM 467 CG LYS A 135 0.264 -22.880 5.901 1.00 0.00 C ATOM 468 CD LYS A 135 0.897 -23.335 4.596 1.00 0.00 C ATOM 469 CE LYS A 135 0.394 -24.709 4.182 1.00 0.00 C ATOM 470 NZ LYS A 135 1.051 -25.187 2.934 1.00 0.00 N ATOM 0 H LYS A 135 -1.190 -22.761 7.942 1.00 0.00 H new ATOM 0 HA LYS A 135 1.345 -22.996 9.200 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.112 -23.384 6.851 1.00 0.00 H new ATOM 0 HB3 LYS A 135 0.763 -24.398 7.322 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -0.759 -23.252 5.959 1.00 0.00 H new ATOM 0 HG3 LYS A 135 0.209 -21.792 5.920 1.00 0.00 H new ATOM 0 HD2 LYS A 135 0.674 -22.613 3.811 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.981 -23.361 4.706 1.00 0.00 H new ATOM 0 HE2 LYS A 135 0.580 -25.421 4.986 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.685 -24.671 4.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 0.681 -26.127 2.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 0.853 -24.521 2.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.078 -25.248 3.084 1.00 0.00 H new ATOM 484 N PHE A 136 0.685 -20.217 7.600 1.00 0.00 N ATOM 485 CA PHE A 136 1.158 -18.860 7.351 1.00 0.00 C ATOM 486 C PHE A 136 1.425 -18.129 8.663 1.00 0.00 C ATOM 487 O PHE A 136 2.309 -17.276 8.742 1.00 0.00 O ATOM 488 CB PHE A 136 0.132 -18.085 6.522 1.00 0.00 C ATOM 489 CG PHE A 136 0.045 -18.545 5.095 1.00 0.00 C ATOM 490 CD1 PHE A 136 1.142 -18.451 4.254 1.00 0.00 C ATOM 491 CD2 PHE A 136 -1.135 -19.071 4.594 1.00 0.00 C ATOM 492 CE1 PHE A 136 1.064 -18.873 2.940 1.00 0.00 C ATOM 493 CE2 PHE A 136 -1.219 -19.495 3.281 1.00 0.00 C ATOM 494 CZ PHE A 136 -0.118 -19.396 2.453 1.00 0.00 C ATOM 0 H PHE A 136 -0.280 -20.386 7.316 1.00 0.00 H new ATOM 0 HA PHE A 136 2.093 -18.923 6.794 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -0.849 -18.183 6.988 1.00 0.00 H new ATOM 0 HB3 PHE A 136 0.388 -17.026 6.539 1.00 0.00 H new ATOM 0 HD1 PHE A 136 2.069 -18.043 4.629 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -1.999 -19.151 5.237 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.926 -18.794 2.295 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -2.145 -19.903 2.903 1.00 0.00 H new ATOM 0 HZ PHE A 136 -0.181 -19.727 1.427 1.00 0.00 H new ATOM 504 N GLY A 137 0.654 -18.468 9.692 1.00 0.00 N ATOM 505 CA GLY A 137 0.822 -17.835 10.986 1.00 0.00 C ATOM 506 C GLY A 137 -0.134 -18.381 12.028 1.00 0.00 C ATOM 507 O GLY A 137 0.041 -19.497 12.517 1.00 0.00 O ATOM 0 H GLY A 137 -0.084 -19.170 9.652 1.00 0.00 H new ATOM 0 HA2 GLY A 137 1.847 -17.979 11.327 1.00 0.00 H new ATOM 0 HA3 GLY A 137 0.668 -16.761 10.884 1.00 0.00 H new ATOM 511 N VAL A 138 -1.148 -17.592 12.370 1.00 0.00 N ATOM 512 CA VAL A 138 -2.135 -18.003 13.361 1.00 0.00 C ATOM 513 C VAL A 138 -3.483 -17.340 13.101 1.00 0.00 C ATOM 514 O VAL A 138 -3.632 -16.128 13.258 1.00 0.00 O ATOM 515 CB VAL A 138 -1.673 -17.658 14.790 1.00 0.00 C ATOM 516 CG1 VAL A 138 -2.768 -17.976 15.796 1.00 0.00 C ATOM 517 CG2 VAL A 138 -0.392 -18.404 15.130 1.00 0.00 C ATOM 0 H VAL A 138 -1.307 -16.665 11.975 1.00 0.00 H new ATOM 0 HA VAL A 138 -2.242 -19.084 13.272 1.00 0.00 H new ATOM 0 HB VAL A 138 -1.467 -16.589 14.839 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -2.424 -17.726 16.800 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -3.658 -17.392 15.562 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -3.008 -19.038 15.749 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -0.080 -18.149 16.143 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -0.568 -19.478 15.064 1.00 0.00 H new ATOM 0 HG23 VAL A 138 0.391 -18.121 14.427 1.00 0.00 H new ATOM 527 N VAL A 139 -4.464 -18.144 12.702 1.00 0.00 N ATOM 528 CA VAL A 139 -5.802 -17.636 12.421 1.00 0.00 C ATOM 529 C VAL A 139 -6.568 -17.365 13.710 1.00 0.00 C ATOM 530 O VAL A 139 -6.877 -18.285 14.468 1.00 0.00 O ATOM 531 CB VAL A 139 -6.606 -18.624 11.556 1.00 0.00 C ATOM 532 CG1 VAL A 139 -7.958 -18.032 11.187 1.00 0.00 C ATOM 533 CG2 VAL A 139 -5.822 -19.001 10.308 1.00 0.00 C ATOM 0 H VAL A 139 -4.357 -19.149 12.566 1.00 0.00 H new ATOM 0 HA VAL A 139 -5.678 -16.702 11.873 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.778 -19.531 12.136 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -8.512 -18.744 10.576 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -8.521 -17.818 12.095 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.810 -17.110 10.625 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -6.406 -19.700 9.709 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -5.617 -18.105 9.723 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -4.881 -19.469 10.597 1.00 0.00 H new ATOM 543 N THR A 140 -6.874 -16.094 13.955 1.00 0.00 N ATOM 544 CA THR A 140 -7.605 -15.701 15.153 1.00 0.00 C ATOM 545 C THR A 140 -9.107 -15.671 14.896 1.00 0.00 C ATOM 546 O THR A 140 -9.900 -16.054 15.755 1.00 0.00 O ATOM 547 CB THR A 140 -7.154 -14.317 15.656 1.00 0.00 C ATOM 548 OG1 THR A 140 -7.382 -13.329 14.645 1.00 0.00 O ATOM 549 CG2 THR A 140 -5.680 -14.332 16.034 1.00 0.00 C ATOM 0 H THR A 140 -6.627 -15.320 13.339 1.00 0.00 H new ATOM 0 HA THR A 140 -7.385 -16.447 15.917 1.00 0.00 H new ATOM 0 HB THR A 140 -7.738 -14.070 16.543 1.00 0.00 H new ATOM 0 HG1 THR A 140 -7.094 -12.452 14.974 1.00 0.00 H new ATOM 0 HG21 THR A 140 -5.385 -13.344 16.386 1.00 0.00 H new ATOM 0 HG22 THR A 140 -5.515 -15.064 16.825 1.00 0.00 H new ATOM 0 HG23 THR A 140 -5.083 -14.600 15.162 1.00 0.00 H new ATOM 557 N GLU A 141 -9.491 -15.214 13.708 1.00 0.00 N ATOM 558 CA GLU A 141 -10.899 -15.134 13.339 1.00 0.00 C ATOM 559 C GLU A 141 -11.104 -15.538 11.882 1.00 0.00 C ATOM 560 O GLU A 141 -10.195 -15.420 11.060 1.00 0.00 O ATOM 561 CB GLU A 141 -11.430 -13.717 13.567 1.00 0.00 C ATOM 562 CG GLU A 141 -12.910 -13.668 13.904 1.00 0.00 C ATOM 563 CD GLU A 141 -13.186 -13.965 15.366 1.00 0.00 C ATOM 564 OE1 GLU A 141 -12.343 -13.603 16.213 1.00 0.00 O ATOM 565 OE2 GLU A 141 -14.243 -14.560 15.662 1.00 0.00 O ATOM 0 H GLU A 141 -8.847 -14.894 12.985 1.00 0.00 H new ATOM 0 HA GLU A 141 -11.453 -15.828 13.971 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -10.866 -13.253 14.376 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -11.250 -13.122 12.671 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -13.302 -12.682 13.657 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -13.444 -14.388 13.284 1.00 0.00 H new ATOM 572 N VAL A 142 -12.304 -16.016 11.569 1.00 0.00 N ATOM 573 CA VAL A 142 -12.630 -16.437 10.212 1.00 0.00 C ATOM 574 C VAL A 142 -13.993 -15.905 9.783 1.00 0.00 C ATOM 575 O VAL A 142 -15.030 -16.452 10.158 1.00 0.00 O ATOM 576 CB VAL A 142 -12.627 -17.972 10.085 1.00 0.00 C ATOM 577 CG1 VAL A 142 -13.030 -18.392 8.680 1.00 0.00 C ATOM 578 CG2 VAL A 142 -11.260 -18.533 10.446 1.00 0.00 C ATOM 0 H VAL A 142 -13.067 -16.121 12.238 1.00 0.00 H new ATOM 0 HA VAL A 142 -11.861 -16.024 9.559 1.00 0.00 H new ATOM 0 HB VAL A 142 -13.358 -18.379 10.784 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -13.022 -19.480 8.609 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -14.032 -18.021 8.463 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -12.325 -17.976 7.960 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -11.276 -19.619 10.351 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -10.508 -18.121 9.773 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -11.015 -18.262 11.473 1.00 0.00 H new ATOM 588 N VAL A 143 -13.983 -14.835 8.995 1.00 0.00 N ATOM 589 CA VAL A 143 -15.219 -14.229 8.513 1.00 0.00 C ATOM 590 C VAL A 143 -15.740 -14.953 7.277 1.00 0.00 C ATOM 591 O VAL A 143 -14.965 -15.374 6.419 1.00 0.00 O ATOM 592 CB VAL A 143 -15.019 -12.739 8.176 1.00 0.00 C ATOM 593 CG1 VAL A 143 -16.317 -12.128 7.670 1.00 0.00 C ATOM 594 CG2 VAL A 143 -14.503 -11.984 9.391 1.00 0.00 C ATOM 0 H VAL A 143 -13.133 -14.370 8.677 1.00 0.00 H new ATOM 0 HA VAL A 143 -15.950 -14.317 9.317 1.00 0.00 H new ATOM 0 HB VAL A 143 -14.275 -12.659 7.384 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -16.157 -11.075 7.437 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -16.641 -12.654 6.772 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -17.085 -12.217 8.439 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -14.367 -10.933 9.136 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -15.223 -12.070 10.205 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -13.549 -12.407 9.704 1.00 0.00 H new ATOM 604 N MET A 144 -17.059 -15.094 7.193 1.00 0.00 N ATOM 605 CA MET A 144 -17.684 -15.766 6.060 1.00 0.00 C ATOM 606 C MET A 144 -19.024 -15.122 5.718 1.00 0.00 C ATOM 607 O MET A 144 -19.830 -14.836 6.604 1.00 0.00 O ATOM 608 CB MET A 144 -17.883 -17.252 6.367 1.00 0.00 C ATOM 609 CG MET A 144 -16.637 -18.092 6.137 1.00 0.00 C ATOM 610 SD MET A 144 -16.973 -19.862 6.193 1.00 0.00 S ATOM 611 CE MET A 144 -16.348 -20.376 4.595 1.00 0.00 C ATOM 0 H MET A 144 -17.715 -14.752 7.895 1.00 0.00 H new ATOM 0 HA MET A 144 -17.022 -15.666 5.200 1.00 0.00 H new ATOM 0 HB2 MET A 144 -18.198 -17.361 7.405 1.00 0.00 H new ATOM 0 HB3 MET A 144 -18.691 -17.638 5.746 1.00 0.00 H new ATOM 0 HG2 MET A 144 -16.206 -17.838 5.168 1.00 0.00 H new ATOM 0 HG3 MET A 144 -15.891 -17.844 6.892 1.00 0.00 H new ATOM 0 HE1 MET A 144 -16.701 -21.383 4.373 1.00 0.00 H new ATOM 0 HE2 MET A 144 -16.704 -19.689 3.827 1.00 0.00 H new ATOM 0 HE3 MET A 144 -15.258 -20.369 4.611 1.00 0.00 H new ATOM 621 N ILE A 145 -19.255 -14.897 4.429 1.00 0.00 N ATOM 622 CA ILE A 145 -20.498 -14.287 3.971 1.00 0.00 C ATOM 623 C ILE A 145 -21.457 -15.339 3.424 1.00 0.00 C ATOM 624 O ILE A 145 -21.054 -16.236 2.683 1.00 0.00 O ATOM 625 CB ILE A 145 -20.238 -13.229 2.883 1.00 0.00 C ATOM 626 CG1 ILE A 145 -19.348 -12.111 3.429 1.00 0.00 C ATOM 627 CG2 ILE A 145 -21.554 -12.663 2.370 1.00 0.00 C ATOM 628 CD1 ILE A 145 -18.683 -11.286 2.350 1.00 0.00 C ATOM 0 H ILE A 145 -18.598 -15.128 3.683 1.00 0.00 H new ATOM 0 HA ILE A 145 -20.950 -13.802 4.836 1.00 0.00 H new ATOM 0 HB ILE A 145 -19.720 -13.705 2.051 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -19.949 -11.454 4.059 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -18.579 -12.548 4.066 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -21.354 -11.916 1.601 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -22.156 -13.467 1.947 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -22.096 -12.199 3.194 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -18.068 -10.513 2.810 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -18.055 -11.930 1.734 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -19.446 -10.820 1.727 1.00 0.00 H new ATOM 640 N TYR A 146 -22.728 -15.221 3.792 1.00 0.00 N ATOM 641 CA TYR A 146 -23.745 -16.162 3.339 1.00 0.00 C ATOM 642 C TYR A 146 -25.135 -15.718 3.784 1.00 0.00 C ATOM 643 O TYR A 146 -25.275 -14.844 4.640 1.00 0.00 O ATOM 644 CB TYR A 146 -23.449 -17.563 3.875 1.00 0.00 C ATOM 645 CG TYR A 146 -22.992 -17.576 5.317 1.00 0.00 C ATOM 646 CD1 TYR A 146 -23.727 -16.931 6.304 1.00 0.00 C ATOM 647 CD2 TYR A 146 -21.826 -18.231 5.691 1.00 0.00 C ATOM 648 CE1 TYR A 146 -23.313 -16.939 7.622 1.00 0.00 C ATOM 649 CE2 TYR A 146 -21.405 -18.246 7.006 1.00 0.00 C ATOM 650 CZ TYR A 146 -22.152 -17.599 7.968 1.00 0.00 C ATOM 651 OH TYR A 146 -21.735 -17.610 9.280 1.00 0.00 O ATOM 0 H TYR A 146 -23.078 -14.483 4.403 1.00 0.00 H new ATOM 0 HA TYR A 146 -23.722 -16.185 2.249 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -24.346 -18.176 3.781 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -22.681 -18.025 3.255 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -24.637 -16.415 6.036 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -21.238 -18.738 4.940 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -23.895 -16.431 8.377 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -20.496 -18.761 7.280 1.00 0.00 H new ATOM 0 HH TYR A 146 -20.901 -18.119 9.354 1.00 0.00 H new ATOM 661 N ASP A 147 -26.160 -16.326 3.197 1.00 0.00 N ATOM 662 CA ASP A 147 -27.540 -15.996 3.533 1.00 0.00 C ATOM 663 C ASP A 147 -28.036 -16.852 4.694 1.00 0.00 C ATOM 664 O ASP A 147 -28.178 -18.068 4.566 1.00 0.00 O ATOM 665 CB ASP A 147 -28.444 -16.192 2.316 1.00 0.00 C ATOM 666 CG ASP A 147 -29.874 -15.764 2.582 1.00 0.00 C ATOM 667 OD1 ASP A 147 -30.069 -14.689 3.188 1.00 0.00 O ATOM 668 OD2 ASP A 147 -30.798 -16.503 2.184 1.00 0.00 O ATOM 0 H ASP A 147 -26.061 -17.050 2.486 1.00 0.00 H new ATOM 0 HA ASP A 147 -27.574 -14.950 3.836 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -28.047 -15.621 1.477 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -28.431 -17.242 2.022 1.00 0.00 H new ATOM 673 N ALA A 148 -28.297 -16.209 5.828 1.00 0.00 N ATOM 674 CA ALA A 148 -28.778 -16.911 7.011 1.00 0.00 C ATOM 675 C ALA A 148 -29.668 -18.088 6.627 1.00 0.00 C ATOM 676 O ALA A 148 -29.382 -19.233 6.975 1.00 0.00 O ATOM 677 CB ALA A 148 -29.529 -15.954 7.924 1.00 0.00 C ATOM 0 H ALA A 148 -28.183 -15.203 5.952 1.00 0.00 H new ATOM 0 HA ALA A 148 -27.914 -17.303 7.547 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -29.882 -16.492 8.803 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -28.863 -15.149 8.235 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -30.381 -15.534 7.389 1.00 0.00 H new ATOM 683 N GLU A 149 -30.748 -17.798 5.909 1.00 0.00 N ATOM 684 CA GLU A 149 -31.681 -18.833 5.480 1.00 0.00 C ATOM 685 C GLU A 149 -30.938 -20.112 5.102 1.00 0.00 C ATOM 686 O GLU A 149 -31.334 -21.211 5.490 1.00 0.00 O ATOM 687 CB GLU A 149 -32.511 -18.343 4.292 1.00 0.00 C ATOM 688 CG GLU A 149 -33.572 -19.332 3.841 1.00 0.00 C ATOM 689 CD GLU A 149 -34.582 -18.713 2.894 1.00 0.00 C ATOM 690 OE1 GLU A 149 -35.063 -17.599 3.187 1.00 0.00 O ATOM 691 OE2 GLU A 149 -34.892 -19.343 1.862 1.00 0.00 O ATOM 0 H GLU A 149 -30.999 -16.855 5.612 1.00 0.00 H new ATOM 0 HA GLU A 149 -32.348 -19.053 6.314 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -32.993 -17.403 4.560 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -31.844 -18.132 3.456 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -33.090 -20.177 3.350 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -34.092 -19.725 4.715 1.00 0.00 H new ATOM 698 N LYS A 150 -29.858 -19.959 4.343 1.00 0.00 N ATOM 699 CA LYS A 150 -29.058 -21.099 3.912 1.00 0.00 C ATOM 700 C LYS A 150 -28.079 -21.520 5.003 1.00 0.00 C ATOM 701 O LYS A 150 -27.852 -22.710 5.220 1.00 0.00 O ATOM 702 CB LYS A 150 -28.295 -20.758 2.631 1.00 0.00 C ATOM 703 CG LYS A 150 -27.926 -21.974 1.800 1.00 0.00 C ATOM 704 CD LYS A 150 -29.146 -22.583 1.129 1.00 0.00 C ATOM 705 CE LYS A 150 -28.945 -24.063 0.842 1.00 0.00 C ATOM 706 NZ LYS A 150 -28.175 -24.284 -0.414 1.00 0.00 N ATOM 0 H LYS A 150 -29.517 -19.056 4.014 1.00 0.00 H new ATOM 0 HA LYS A 150 -29.734 -21.931 3.714 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -28.902 -20.085 2.025 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -27.385 -20.218 2.893 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -27.197 -21.690 1.042 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -27.450 -22.720 2.437 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -30.018 -22.451 1.769 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -29.351 -22.055 0.198 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -28.420 -24.527 1.677 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -29.915 -24.553 0.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -28.044 -25.304 -0.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -28.697 -23.878 -1.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -27.246 -23.824 -0.337 1.00 0.00 H new ATOM 720 N GLN A 151 -27.503 -20.536 5.687 1.00 0.00 N ATOM 721 CA GLN A 151 -26.549 -20.806 6.756 1.00 0.00 C ATOM 722 C GLN A 151 -25.344 -21.577 6.228 1.00 0.00 C ATOM 723 O GLN A 151 -24.920 -22.568 6.822 1.00 0.00 O ATOM 724 CB GLN A 151 -27.221 -21.594 7.881 1.00 0.00 C ATOM 725 CG GLN A 151 -27.834 -20.714 8.958 1.00 0.00 C ATOM 726 CD GLN A 151 -27.820 -21.369 10.325 1.00 0.00 C ATOM 727 OE1 GLN A 151 -28.436 -22.416 10.531 1.00 0.00 O ATOM 728 NE2 GLN A 151 -27.116 -20.756 11.269 1.00 0.00 N ATOM 0 H GLN A 151 -27.680 -19.546 5.520 1.00 0.00 H new ATOM 0 HA GLN A 151 -26.202 -19.850 7.149 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -27.999 -22.228 7.455 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -26.486 -22.256 8.339 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -27.289 -19.771 9.005 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -28.862 -20.474 8.685 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -26.621 -19.890 11.055 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -27.070 -21.151 12.208 1.00 0.00 H new ATOM 737 N ARG A 152 -24.797 -21.116 5.108 1.00 0.00 N ATOM 738 CA ARG A 152 -23.641 -21.764 4.499 1.00 0.00 C ATOM 739 C ARG A 152 -22.887 -20.793 3.596 1.00 0.00 C ATOM 740 O ARG A 152 -23.479 -20.006 2.856 1.00 0.00 O ATOM 741 CB ARG A 152 -24.081 -22.989 3.694 1.00 0.00 C ATOM 742 CG ARG A 152 -23.189 -23.286 2.500 1.00 0.00 C ATOM 743 CD ARG A 152 -23.164 -24.772 2.180 1.00 0.00 C ATOM 744 NE ARG A 152 -24.263 -25.161 1.300 1.00 0.00 N ATOM 745 CZ ARG A 152 -24.240 -25.003 -0.019 1.00 0.00 C ATOM 746 NH1 ARG A 152 -23.180 -24.467 -0.607 1.00 0.00 N ATOM 747 NH2 ARG A 152 -25.280 -25.381 -0.752 1.00 0.00 N ATOM 0 H ARG A 152 -25.135 -20.296 4.604 1.00 0.00 H new ATOM 0 HA ARG A 152 -22.973 -22.084 5.298 1.00 0.00 H new ATOM 0 HB2 ARG A 152 -24.096 -23.859 4.351 1.00 0.00 H new ATOM 0 HB3 ARG A 152 -25.102 -22.836 3.345 1.00 0.00 H new ATOM 0 HG2 ARG A 152 -23.545 -22.732 1.632 1.00 0.00 H new ATOM 0 HG3 ARG A 152 -22.176 -22.940 2.706 1.00 0.00 H new ATOM 0 HD2 ARG A 152 -22.215 -25.025 1.708 1.00 0.00 H new ATOM 0 HD3 ARG A 152 -23.222 -25.343 3.106 1.00 0.00 H new ATOM 0 HE ARG A 152 -25.094 -25.577 1.721 1.00 0.00 H new ATOM 0 HH11 ARG A 152 -22.379 -24.175 -0.047 1.00 0.00 H new ATOM 0 HH12 ARG A 152 -23.165 -24.347 -1.620 1.00 0.00 H new ATOM 0 HH21 ARG A 152 -26.098 -25.793 -0.303 1.00 0.00 H new ATOM 0 HH22 ARG A 152 -25.261 -25.259 -1.765 1.00 0.00 H new ATOM 761 N PRO A 153 -21.548 -20.847 3.655 1.00 0.00 N ATOM 762 CA PRO A 153 -20.684 -19.980 2.849 1.00 0.00 C ATOM 763 C PRO A 153 -20.730 -20.332 1.367 1.00 0.00 C ATOM 764 O PRO A 153 -20.225 -21.375 0.951 1.00 0.00 O ATOM 765 CB PRO A 153 -19.287 -20.243 3.419 1.00 0.00 C ATOM 766 CG PRO A 153 -19.368 -21.611 4.003 1.00 0.00 C ATOM 767 CD PRO A 153 -20.775 -21.760 4.514 1.00 0.00 C ATOM 0 HA PRO A 153 -20.991 -18.936 2.902 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -18.525 -20.189 2.641 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -19.023 -19.504 4.176 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -19.143 -22.369 3.253 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -18.645 -21.735 4.809 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -21.127 -22.788 4.428 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -20.852 -21.484 5.566 1.00 0.00 H new ATOM 775 N ARG A 154 -21.338 -19.456 0.574 1.00 0.00 N ATOM 776 CA ARG A 154 -21.450 -19.675 -0.863 1.00 0.00 C ATOM 777 C ARG A 154 -20.097 -20.046 -1.464 1.00 0.00 C ATOM 778 O ARG A 154 -19.962 -21.069 -2.134 1.00 0.00 O ATOM 779 CB ARG A 154 -21.999 -18.424 -1.551 1.00 0.00 C ATOM 780 CG ARG A 154 -23.348 -17.976 -1.012 1.00 0.00 C ATOM 781 CD ARG A 154 -23.655 -16.539 -1.404 1.00 0.00 C ATOM 782 NE ARG A 154 -24.083 -16.431 -2.796 1.00 0.00 N ATOM 783 CZ ARG A 154 -24.794 -15.414 -3.270 1.00 0.00 C ATOM 784 NH1 ARG A 154 -25.155 -14.422 -2.467 1.00 0.00 N ATOM 785 NH2 ARG A 154 -25.145 -15.387 -4.549 1.00 0.00 N ATOM 0 H ARG A 154 -21.761 -18.588 0.902 1.00 0.00 H new ATOM 0 HA ARG A 154 -22.140 -20.503 -1.025 1.00 0.00 H new ATOM 0 HB2 ARG A 154 -21.282 -17.611 -1.434 1.00 0.00 H new ATOM 0 HB3 ARG A 154 -22.090 -18.618 -2.620 1.00 0.00 H new ATOM 0 HG2 ARG A 154 -24.130 -18.633 -1.393 1.00 0.00 H new ATOM 0 HG3 ARG A 154 -23.356 -18.068 0.074 1.00 0.00 H new ATOM 0 HD2 ARG A 154 -24.435 -16.145 -0.753 1.00 0.00 H new ATOM 0 HD3 ARG A 154 -22.769 -15.924 -1.248 1.00 0.00 H new ATOM 0 HE ARG A 154 -23.822 -17.178 -3.440 1.00 0.00 H new ATOM 0 HH11 ARG A 154 -24.887 -14.439 -1.483 1.00 0.00 H new ATOM 0 HH12 ARG A 154 -25.701 -13.642 -2.833 1.00 0.00 H new ATOM 0 HH21 ARG A 154 -24.869 -16.148 -5.170 1.00 0.00 H new ATOM 0 HH22 ARG A 154 -25.691 -14.605 -4.912 1.00 0.00 H new ATOM 799 N GLY A 155 -19.096 -19.205 -1.219 1.00 0.00 N ATOM 800 CA GLY A 155 -17.767 -19.461 -1.743 1.00 0.00 C ATOM 801 C GLY A 155 -16.886 -18.228 -1.717 1.00 0.00 C ATOM 802 O GLY A 155 -16.159 -17.955 -2.672 1.00 0.00 O ATOM 0 H GLY A 155 -19.182 -18.351 -0.667 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -17.296 -20.252 -1.160 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -17.848 -19.825 -2.767 1.00 0.00 H new ATOM 806 N PHE A 156 -16.951 -17.479 -0.621 1.00 0.00 N ATOM 807 CA PHE A 156 -16.155 -16.266 -0.475 1.00 0.00 C ATOM 808 C PHE A 156 -16.285 -15.697 0.935 1.00 0.00 C ATOM 809 O PHE A 156 -17.233 -16.005 1.655 1.00 0.00 O ATOM 810 CB PHE A 156 -16.589 -15.219 -1.502 1.00 0.00 C ATOM 811 CG PHE A 156 -18.056 -14.901 -1.451 1.00 0.00 C ATOM 812 CD1 PHE A 156 -18.532 -13.895 -0.626 1.00 0.00 C ATOM 813 CD2 PHE A 156 -18.959 -15.609 -2.229 1.00 0.00 C ATOM 814 CE1 PHE A 156 -19.881 -13.600 -0.577 1.00 0.00 C ATOM 815 CE2 PHE A 156 -20.309 -15.317 -2.184 1.00 0.00 C ATOM 816 CZ PHE A 156 -20.771 -14.313 -1.356 1.00 0.00 C ATOM 0 H PHE A 156 -17.547 -17.691 0.179 1.00 0.00 H new ATOM 0 HA PHE A 156 -15.110 -16.524 -0.649 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -16.021 -14.303 -1.338 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -16.337 -15.575 -2.501 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -17.841 -13.335 -0.014 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -18.604 -16.397 -2.877 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -20.239 -12.813 0.070 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -21.003 -15.874 -2.796 1.00 0.00 H new ATOM 0 HZ PHE A 156 -21.826 -14.086 -1.318 1.00 0.00 H new ATOM 826 N GLY A 157 -15.324 -14.863 1.321 1.00 0.00 N ATOM 827 CA GLY A 157 -15.348 -14.264 2.643 1.00 0.00 C ATOM 828 C GLY A 157 -14.018 -13.646 3.024 1.00 0.00 C ATOM 829 O GLY A 157 -13.248 -13.229 2.158 1.00 0.00 O ATOM 0 H GLY A 157 -14.529 -14.592 0.742 1.00 0.00 H new ATOM 0 HA2 GLY A 157 -16.124 -13.499 2.678 1.00 0.00 H new ATOM 0 HA3 GLY A 157 -15.616 -15.023 3.378 1.00 0.00 H new ATOM 833 N PHE A 158 -13.746 -13.584 4.323 1.00 0.00 N ATOM 834 CA PHE A 158 -12.501 -13.010 4.818 1.00 0.00 C ATOM 835 C PHE A 158 -11.981 -13.791 6.021 1.00 0.00 C ATOM 836 O PHE A 158 -12.697 -14.611 6.598 1.00 0.00 O ATOM 837 CB PHE A 158 -12.707 -11.542 5.198 1.00 0.00 C ATOM 838 CG PHE A 158 -13.316 -10.718 4.100 1.00 0.00 C ATOM 839 CD1 PHE A 158 -14.670 -10.809 3.819 1.00 0.00 C ATOM 840 CD2 PHE A 158 -12.536 -9.853 3.350 1.00 0.00 C ATOM 841 CE1 PHE A 158 -15.233 -10.052 2.808 1.00 0.00 C ATOM 842 CE2 PHE A 158 -13.094 -9.094 2.339 1.00 0.00 C ATOM 843 CZ PHE A 158 -14.445 -9.193 2.069 1.00 0.00 C ATOM 0 H PHE A 158 -14.372 -13.925 5.053 1.00 0.00 H new ATOM 0 HA PHE A 158 -11.760 -13.071 4.021 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -13.347 -11.489 6.079 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -11.746 -11.109 5.476 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -15.292 -11.478 4.395 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -11.479 -9.771 3.558 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -16.289 -10.133 2.597 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -12.475 -8.424 1.761 1.00 0.00 H new ATOM 0 HZ PHE A 158 -14.884 -8.599 1.281 1.00 0.00 H new ATOM 853 N ILE A 159 -10.733 -13.530 6.394 1.00 0.00 N ATOM 854 CA ILE A 159 -10.118 -14.208 7.529 1.00 0.00 C ATOM 855 C ILE A 159 -9.105 -13.305 8.225 1.00 0.00 C ATOM 856 O ILE A 159 -8.333 -12.600 7.574 1.00 0.00 O ATOM 857 CB ILE A 159 -9.417 -15.509 7.095 1.00 0.00 C ATOM 858 CG1 ILE A 159 -10.406 -16.434 6.384 1.00 0.00 C ATOM 859 CG2 ILE A 159 -8.802 -16.206 8.300 1.00 0.00 C ATOM 860 CD1 ILE A 159 -9.874 -17.834 6.166 1.00 0.00 C ATOM 0 H ILE A 159 -10.128 -12.854 5.927 1.00 0.00 H new ATOM 0 HA ILE A 159 -10.921 -14.453 8.224 1.00 0.00 H new ATOM 0 HB ILE A 159 -8.618 -15.259 6.397 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -11.324 -16.490 6.969 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -10.669 -15.999 5.419 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -8.310 -17.124 7.978 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -8.070 -15.547 8.767 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -9.585 -16.447 9.019 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -10.628 -18.435 5.657 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -8.972 -17.790 5.555 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -9.638 -18.288 7.129 1.00 0.00 H new ATOM 872 N THR A 160 -9.111 -13.333 9.554 1.00 0.00 N ATOM 873 CA THR A 160 -8.193 -12.518 10.340 1.00 0.00 C ATOM 874 C THR A 160 -7.045 -13.357 10.888 1.00 0.00 C ATOM 875 O THR A 160 -7.210 -14.545 11.170 1.00 0.00 O ATOM 876 CB THR A 160 -8.916 -11.830 11.513 1.00 0.00 C ATOM 877 OG1 THR A 160 -10.012 -11.048 11.022 1.00 0.00 O ATOM 878 CG2 THR A 160 -7.959 -10.939 12.290 1.00 0.00 C ATOM 0 H THR A 160 -9.742 -13.912 10.109 1.00 0.00 H new ATOM 0 HA THR A 160 -7.795 -11.755 9.671 1.00 0.00 H new ATOM 0 HB THR A 160 -9.293 -12.603 12.183 1.00 0.00 H new ATOM 0 HG1 THR A 160 -10.468 -10.615 11.774 1.00 0.00 H new ATOM 0 HG21 THR A 160 -8.492 -10.464 13.113 1.00 0.00 H new ATOM 0 HG22 THR A 160 -7.142 -11.541 12.686 1.00 0.00 H new ATOM 0 HG23 THR A 160 -7.557 -10.172 11.628 1.00 0.00 H new ATOM 886 N PHE A 161 -5.881 -12.733 11.038 1.00 0.00 N ATOM 887 CA PHE A 161 -4.704 -13.424 11.553 1.00 0.00 C ATOM 888 C PHE A 161 -4.207 -12.767 12.837 1.00 0.00 C ATOM 889 O PHE A 161 -4.730 -11.738 13.263 1.00 0.00 O ATOM 890 CB PHE A 161 -3.590 -13.428 10.504 1.00 0.00 C ATOM 891 CG PHE A 161 -3.872 -14.328 9.335 1.00 0.00 C ATOM 892 CD1 PHE A 161 -4.705 -13.911 8.309 1.00 0.00 C ATOM 893 CD2 PHE A 161 -3.303 -15.589 9.260 1.00 0.00 C ATOM 894 CE1 PHE A 161 -4.966 -14.737 7.232 1.00 0.00 C ATOM 895 CE2 PHE A 161 -3.560 -16.419 8.186 1.00 0.00 C ATOM 896 CZ PHE A 161 -4.392 -15.992 7.169 1.00 0.00 C ATOM 0 H PHE A 161 -5.728 -11.751 10.810 1.00 0.00 H new ATOM 0 HA PHE A 161 -4.986 -14.453 11.778 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -3.439 -12.411 10.142 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -2.658 -13.740 10.976 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -5.155 -12.930 8.351 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -2.650 -15.927 10.051 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -5.619 -14.401 6.440 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -3.111 -17.400 8.141 1.00 0.00 H new ATOM 0 HZ PHE A 161 -4.593 -16.638 6.327 1.00 0.00 H new ATOM 906 N GLU A 162 -3.193 -13.370 13.449 1.00 0.00 N ATOM 907 CA GLU A 162 -2.625 -12.844 14.685 1.00 0.00 C ATOM 908 C GLU A 162 -1.678 -11.683 14.398 1.00 0.00 C ATOM 909 O GLU A 162 -1.691 -10.670 15.097 1.00 0.00 O ATOM 910 CB GLU A 162 -1.883 -13.948 15.442 1.00 0.00 C ATOM 911 CG GLU A 162 -1.398 -13.523 16.817 1.00 0.00 C ATOM 912 CD GLU A 162 -0.233 -14.360 17.310 1.00 0.00 C ATOM 913 OE1 GLU A 162 0.830 -14.339 16.655 1.00 0.00 O ATOM 914 OE2 GLU A 162 -0.385 -15.035 18.349 1.00 0.00 O ATOM 0 H GLU A 162 -2.748 -14.223 13.109 1.00 0.00 H new ATOM 0 HA GLU A 162 -3.444 -12.477 15.304 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -2.542 -14.810 15.549 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -1.028 -14.272 14.849 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -1.100 -12.475 16.785 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -2.221 -13.598 17.528 1.00 0.00 H new ATOM 921 N ASP A 163 -0.855 -11.840 13.367 1.00 0.00 N ATOM 922 CA ASP A 163 0.099 -10.805 12.986 1.00 0.00 C ATOM 923 C ASP A 163 -0.053 -10.441 11.512 1.00 0.00 C ATOM 924 O ASP A 163 -0.165 -11.317 10.656 1.00 0.00 O ATOM 925 CB ASP A 163 1.529 -11.273 13.264 1.00 0.00 C ATOM 926 CG ASP A 163 1.959 -11.002 14.692 1.00 0.00 C ATOM 927 OD1 ASP A 163 1.481 -10.008 15.278 1.00 0.00 O ATOM 928 OD2 ASP A 163 2.775 -11.783 15.224 1.00 0.00 O ATOM 0 H ASP A 163 -0.829 -12.674 12.780 1.00 0.00 H new ATOM 0 HA ASP A 163 -0.108 -9.917 13.584 1.00 0.00 H new ATOM 0 HB2 ASP A 163 1.604 -12.341 13.061 1.00 0.00 H new ATOM 0 HB3 ASP A 163 2.212 -10.770 12.580 1.00 0.00 H new ATOM 933 N GLU A 164 -0.056 -9.143 11.226 1.00 0.00 N ATOM 934 CA GLU A 164 -0.197 -8.664 9.856 1.00 0.00 C ATOM 935 C GLU A 164 0.668 -9.484 8.902 1.00 0.00 C ATOM 936 O GLU A 164 0.223 -9.867 7.821 1.00 0.00 O ATOM 937 CB GLU A 164 0.187 -7.186 9.767 1.00 0.00 C ATOM 938 CG GLU A 164 -0.101 -6.563 8.411 1.00 0.00 C ATOM 939 CD GLU A 164 0.132 -5.064 8.397 1.00 0.00 C ATOM 940 OE1 GLU A 164 -0.402 -4.372 9.288 1.00 0.00 O ATOM 941 OE2 GLU A 164 0.849 -4.585 7.493 1.00 0.00 O ATOM 0 H GLU A 164 0.037 -8.405 11.924 1.00 0.00 H new ATOM 0 HA GLU A 164 -1.241 -8.779 9.563 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -0.354 -6.632 10.534 1.00 0.00 H new ATOM 0 HB3 GLU A 164 1.249 -7.081 9.987 1.00 0.00 H new ATOM 0 HG2 GLU A 164 0.532 -7.032 7.658 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -1.135 -6.769 8.133 1.00 0.00 H new ATOM 948 N GLN A 165 1.905 -9.746 9.311 1.00 0.00 N ATOM 949 CA GLN A 165 2.832 -10.518 8.493 1.00 0.00 C ATOM 950 C GLN A 165 2.099 -11.616 7.728 1.00 0.00 C ATOM 951 O GLN A 165 2.323 -11.808 6.533 1.00 0.00 O ATOM 952 CB GLN A 165 3.926 -11.133 9.367 1.00 0.00 C ATOM 953 CG GLN A 165 5.015 -11.838 8.573 1.00 0.00 C ATOM 954 CD GLN A 165 6.180 -12.273 9.440 1.00 0.00 C ATOM 955 OE1 GLN A 165 6.144 -12.137 10.663 1.00 0.00 O ATOM 956 NE2 GLN A 165 7.223 -12.800 8.809 1.00 0.00 N ATOM 0 H GLN A 165 2.288 -9.435 10.204 1.00 0.00 H new ATOM 0 HA GLN A 165 3.290 -9.841 7.772 1.00 0.00 H new ATOM 0 HB2 GLN A 165 4.380 -10.348 9.973 1.00 0.00 H new ATOM 0 HB3 GLN A 165 3.472 -11.845 10.056 1.00 0.00 H new ATOM 0 HG2 GLN A 165 4.590 -12.711 8.077 1.00 0.00 H new ATOM 0 HG3 GLN A 165 5.378 -11.172 7.791 1.00 0.00 H new ATOM 0 HE21 GLN A 165 7.210 -12.894 7.793 1.00 0.00 H new ATOM 0 HE22 GLN A 165 8.037 -13.111 9.340 1.00 0.00 H new ATOM 965 N SER A 166 1.224 -12.333 8.426 1.00 0.00 N ATOM 966 CA SER A 166 0.461 -13.414 7.813 1.00 0.00 C ATOM 967 C SER A 166 -0.232 -12.937 6.540 1.00 0.00 C ATOM 968 O SER A 166 -0.048 -13.512 5.467 1.00 0.00 O ATOM 969 CB SER A 166 -0.577 -13.956 8.798 1.00 0.00 C ATOM 970 OG SER A 166 0.004 -14.901 9.681 1.00 0.00 O ATOM 0 H SER A 166 1.026 -12.185 9.416 1.00 0.00 H new ATOM 0 HA SER A 166 1.156 -14.212 7.551 1.00 0.00 H new ATOM 0 HB2 SER A 166 -1.004 -13.133 9.371 1.00 0.00 H new ATOM 0 HB3 SER A 166 -1.396 -14.421 8.249 1.00 0.00 H new ATOM 0 HG SER A 166 -0.703 -15.436 10.099 1.00 0.00 H new ATOM 976 N VAL A 167 -1.029 -11.881 6.667 1.00 0.00 N ATOM 977 CA VAL A 167 -1.749 -11.324 5.528 1.00 0.00 C ATOM 978 C VAL A 167 -0.872 -11.304 4.281 1.00 0.00 C ATOM 979 O VAL A 167 -1.223 -11.884 3.253 1.00 0.00 O ATOM 980 CB VAL A 167 -2.241 -9.894 5.819 1.00 0.00 C ATOM 981 CG1 VAL A 167 -2.869 -9.282 4.577 1.00 0.00 C ATOM 982 CG2 VAL A 167 -3.226 -9.896 6.979 1.00 0.00 C ATOM 0 H VAL A 167 -1.192 -11.394 7.548 1.00 0.00 H new ATOM 0 HA VAL A 167 -2.611 -11.968 5.353 1.00 0.00 H new ATOM 0 HB VAL A 167 -1.383 -9.283 6.101 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -3.211 -8.272 4.802 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -2.130 -9.245 3.776 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -3.717 -9.890 4.261 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -3.564 -8.878 7.171 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -4.083 -10.521 6.728 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -2.738 -10.291 7.870 1.00 0.00 H new ATOM 992 N ASP A 168 0.270 -10.633 4.378 1.00 0.00 N ATOM 993 CA ASP A 168 1.199 -10.538 3.258 1.00 0.00 C ATOM 994 C ASP A 168 1.487 -11.916 2.673 1.00 0.00 C ATOM 995 O ASP A 168 1.366 -12.126 1.466 1.00 0.00 O ATOM 996 CB ASP A 168 2.504 -9.877 3.705 1.00 0.00 C ATOM 997 CG ASP A 168 3.378 -9.471 2.535 1.00 0.00 C ATOM 998 OD1 ASP A 168 3.588 -10.308 1.632 1.00 0.00 O ATOM 999 OD2 ASP A 168 3.851 -8.315 2.521 1.00 0.00 O ATOM 0 H ASP A 168 0.575 -10.147 5.221 1.00 0.00 H new ATOM 0 HA ASP A 168 0.736 -9.924 2.485 1.00 0.00 H new ATOM 0 HB2 ASP A 168 2.275 -8.997 4.306 1.00 0.00 H new ATOM 0 HB3 ASP A 168 3.056 -10.565 4.345 1.00 0.00 H new ATOM 1004 N GLN A 169 1.869 -12.852 3.536 1.00 0.00 N ATOM 1005 CA GLN A 169 2.177 -14.210 3.103 1.00 0.00 C ATOM 1006 C GLN A 169 1.082 -14.751 2.188 1.00 0.00 C ATOM 1007 O GLN A 169 1.346 -15.134 1.049 1.00 0.00 O ATOM 1008 CB GLN A 169 2.344 -15.129 4.315 1.00 0.00 C ATOM 1009 CG GLN A 169 3.464 -14.703 5.251 1.00 0.00 C ATOM 1010 CD GLN A 169 4.838 -15.036 4.706 1.00 0.00 C ATOM 1011 OE1 GLN A 169 5.648 -14.146 4.443 1.00 0.00 O ATOM 1012 NE2 GLN A 169 5.110 -16.325 4.533 1.00 0.00 N ATOM 0 H GLN A 169 1.973 -12.695 4.539 1.00 0.00 H new ATOM 0 HA GLN A 169 3.113 -14.183 2.544 1.00 0.00 H new ATOM 0 HB2 GLN A 169 1.407 -15.157 4.872 1.00 0.00 H new ATOM 0 HB3 GLN A 169 2.538 -16.144 3.967 1.00 0.00 H new ATOM 0 HG2 GLN A 169 3.397 -13.629 5.426 1.00 0.00 H new ATOM 0 HG3 GLN A 169 3.332 -15.192 6.216 1.00 0.00 H new ATOM 0 HE21 GLN A 169 4.409 -17.030 4.764 1.00 0.00 H new ATOM 0 HE22 GLN A 169 6.019 -16.610 4.169 1.00 0.00 H new ATOM 1021 N ALA A 170 -0.146 -14.778 2.695 1.00 0.00 N ATOM 1022 CA ALA A 170 -1.280 -15.269 1.923 1.00 0.00 C ATOM 1023 C ALA A 170 -1.471 -14.455 0.648 1.00 0.00 C ATOM 1024 O ALA A 170 -1.430 -14.995 -0.458 1.00 0.00 O ATOM 1025 CB ALA A 170 -2.546 -15.238 2.766 1.00 0.00 C ATOM 0 H ALA A 170 -0.381 -14.465 3.637 1.00 0.00 H new ATOM 0 HA ALA A 170 -1.073 -16.300 1.636 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -3.385 -15.608 2.176 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -2.414 -15.870 3.644 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -2.748 -14.215 3.082 1.00 0.00 H new ATOM 1031 N VAL A 171 -1.679 -13.152 0.809 1.00 0.00 N ATOM 1032 CA VAL A 171 -1.876 -12.263 -0.330 1.00 0.00 C ATOM 1033 C VAL A 171 -0.870 -12.556 -1.436 1.00 0.00 C ATOM 1034 O VAL A 171 -1.243 -12.946 -2.542 1.00 0.00 O ATOM 1035 CB VAL A 171 -1.751 -10.784 0.085 1.00 0.00 C ATOM 1036 CG1 VAL A 171 -1.757 -9.884 -1.141 1.00 0.00 C ATOM 1037 CG2 VAL A 171 -2.870 -10.403 1.042 1.00 0.00 C ATOM 0 H VAL A 171 -1.715 -12.689 1.717 1.00 0.00 H new ATOM 0 HA VAL A 171 -2.884 -12.444 -0.703 1.00 0.00 H new ATOM 0 HB VAL A 171 -0.801 -10.648 0.601 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -1.668 -8.843 -0.829 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -0.917 -10.142 -1.786 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -2.690 -10.020 -1.688 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -2.766 -9.355 1.325 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -3.833 -10.553 0.554 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -2.814 -11.027 1.934 1.00 0.00 H new ATOM 1047 N ASN A 172 0.410 -12.366 -1.131 1.00 0.00 N ATOM 1048 CA ASN A 172 1.472 -12.610 -2.100 1.00 0.00 C ATOM 1049 C ASN A 172 1.122 -13.787 -3.005 1.00 0.00 C ATOM 1050 O ASN A 172 1.107 -13.659 -4.229 1.00 0.00 O ATOM 1051 CB ASN A 172 2.795 -12.881 -1.381 1.00 0.00 C ATOM 1052 CG ASN A 172 3.987 -12.798 -2.314 1.00 0.00 C ATOM 1053 OD1 ASN A 172 4.705 -13.779 -2.510 1.00 0.00 O ATOM 1054 ND2 ASN A 172 4.205 -11.624 -2.894 1.00 0.00 N ATOM 0 H ASN A 172 0.737 -12.044 -0.220 1.00 0.00 H new ATOM 0 HA ASN A 172 1.578 -11.718 -2.718 1.00 0.00 H new ATOM 0 HB2 ASN A 172 2.920 -12.162 -0.572 1.00 0.00 H new ATOM 0 HB3 ASN A 172 2.762 -13.871 -0.925 1.00 0.00 H new ATOM 0 HD21 ASN A 172 4.993 -11.508 -3.531 1.00 0.00 H new ATOM 0 HD22 ASN A 172 3.584 -10.838 -2.703 1.00 0.00 H new ATOM 1061 N MET A 173 0.840 -14.933 -2.394 1.00 0.00 N ATOM 1062 CA MET A 173 0.488 -16.133 -3.145 1.00 0.00 C ATOM 1063 C MET A 173 -0.723 -15.880 -4.037 1.00 0.00 C ATOM 1064 O MET A 173 -0.752 -16.301 -5.194 1.00 0.00 O ATOM 1065 CB MET A 173 0.199 -17.292 -2.189 1.00 0.00 C ATOM 1066 CG MET A 173 1.434 -18.095 -1.815 1.00 0.00 C ATOM 1067 SD MET A 173 1.850 -19.343 -3.048 1.00 0.00 S ATOM 1068 CE MET A 173 0.535 -20.530 -2.785 1.00 0.00 C ATOM 0 H MET A 173 0.848 -15.056 -1.382 1.00 0.00 H new ATOM 0 HA MET A 173 1.335 -16.397 -3.779 1.00 0.00 H new ATOM 0 HB2 MET A 173 -0.257 -16.898 -1.281 1.00 0.00 H new ATOM 0 HB3 MET A 173 -0.531 -17.958 -2.649 1.00 0.00 H new ATOM 0 HG2 MET A 173 2.279 -17.418 -1.690 1.00 0.00 H new ATOM 0 HG3 MET A 173 1.269 -18.581 -0.853 1.00 0.00 H new ATOM 0 HE1 MET A 173 0.918 -21.538 -2.945 1.00 0.00 H new ATOM 0 HE2 MET A 173 0.163 -20.440 -1.764 1.00 0.00 H new ATOM 0 HE3 MET A 173 -0.277 -20.335 -3.486 1.00 0.00 H new ATOM 1078 N HIS A 174 -1.720 -15.190 -3.493 1.00 0.00 N ATOM 1079 CA HIS A 174 -2.934 -14.881 -4.241 1.00 0.00 C ATOM 1080 C HIS A 174 -3.562 -16.152 -4.806 1.00 0.00 C ATOM 1081 O HIS A 174 -4.256 -16.114 -5.822 1.00 0.00 O ATOM 1082 CB HIS A 174 -2.624 -13.903 -5.375 1.00 0.00 C ATOM 1083 CG HIS A 174 -3.811 -13.582 -6.230 1.00 0.00 C ATOM 1084 ND1 HIS A 174 -3.715 -13.301 -7.576 1.00 0.00 N ATOM 1085 CD2 HIS A 174 -5.127 -13.501 -5.923 1.00 0.00 C ATOM 1086 CE1 HIS A 174 -4.920 -13.059 -8.061 1.00 0.00 C ATOM 1087 NE2 HIS A 174 -5.795 -13.174 -7.078 1.00 0.00 N ATOM 0 H HIS A 174 -1.712 -14.834 -2.537 1.00 0.00 H new ATOM 0 HA HIS A 174 -3.646 -14.419 -3.557 1.00 0.00 H new ATOM 0 HB2 HIS A 174 -2.232 -12.979 -4.950 1.00 0.00 H new ATOM 0 HB3 HIS A 174 -1.838 -14.324 -6.002 1.00 0.00 H new ATOM 0 HD1 HIS A 174 -2.849 -13.283 -8.114 1.00 0.00 H new ATOM 0 HD2 HIS A 174 -5.569 -13.663 -4.951 1.00 0.00 H new ATOM 0 HE1 HIS A 174 -5.150 -12.810 -9.086 1.00 0.00 H new ATOM 1095 N PHE A 175 -3.312 -17.275 -4.142 1.00 0.00 N ATOM 1096 CA PHE A 175 -3.852 -18.557 -4.579 1.00 0.00 C ATOM 1097 C PHE A 175 -3.571 -19.646 -3.548 1.00 0.00 C ATOM 1098 O PHE A 175 -2.615 -19.555 -2.777 1.00 0.00 O ATOM 1099 CB PHE A 175 -3.253 -18.953 -5.931 1.00 0.00 C ATOM 1100 CG PHE A 175 -4.013 -18.406 -7.106 1.00 0.00 C ATOM 1101 CD1 PHE A 175 -5.392 -18.525 -7.172 1.00 0.00 C ATOM 1102 CD2 PHE A 175 -3.348 -17.774 -8.144 1.00 0.00 C ATOM 1103 CE1 PHE A 175 -6.093 -18.024 -8.252 1.00 0.00 C ATOM 1104 CE2 PHE A 175 -4.044 -17.271 -9.227 1.00 0.00 C ATOM 1105 CZ PHE A 175 -5.418 -17.395 -9.280 1.00 0.00 C ATOM 0 H PHE A 175 -2.739 -17.324 -3.299 1.00 0.00 H new ATOM 0 HA PHE A 175 -4.932 -18.451 -4.684 1.00 0.00 H new ATOM 0 HB2 PHE A 175 -2.222 -18.602 -5.980 1.00 0.00 H new ATOM 0 HB3 PHE A 175 -3.223 -20.040 -6.002 1.00 0.00 H new ATOM 0 HD1 PHE A 175 -5.925 -19.015 -6.370 1.00 0.00 H new ATOM 0 HD2 PHE A 175 -2.273 -17.673 -8.107 1.00 0.00 H new ATOM 0 HE1 PHE A 175 -7.168 -18.124 -8.292 1.00 0.00 H new ATOM 0 HE2 PHE A 175 -3.514 -16.782 -10.031 1.00 0.00 H new ATOM 0 HZ PHE A 175 -5.964 -17.001 -10.124 1.00 0.00 H new ATOM 1115 N HIS A 176 -4.411 -20.676 -3.539 1.00 0.00 N ATOM 1116 CA HIS A 176 -4.253 -21.783 -2.603 1.00 0.00 C ATOM 1117 C HIS A 176 -4.992 -23.023 -3.098 1.00 0.00 C ATOM 1118 O HIS A 176 -5.919 -22.925 -3.902 1.00 0.00 O ATOM 1119 CB HIS A 176 -4.770 -21.386 -1.219 1.00 0.00 C ATOM 1120 CG HIS A 176 -4.164 -20.121 -0.694 1.00 0.00 C ATOM 1121 ND1 HIS A 176 -2.874 -20.048 -0.212 1.00 0.00 N ATOM 1122 CD2 HIS A 176 -4.678 -18.875 -0.579 1.00 0.00 C ATOM 1123 CE1 HIS A 176 -2.622 -18.812 0.179 1.00 0.00 C ATOM 1124 NE2 HIS A 176 -3.701 -18.079 -0.034 1.00 0.00 N ATOM 0 H HIS A 176 -5.208 -20.767 -4.169 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.191 -22.018 -2.533 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -5.853 -21.269 -1.264 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.566 -22.195 -0.518 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -5.672 -18.564 -0.863 1.00 0.00 H new ATOM 0 HE1 HIS A 176 -1.692 -18.460 0.601 1.00 0.00 H new ATOM 0 HE2 HIS A 176 -3.793 -17.084 0.173 1.00 0.00 H new ATOM 1132 N ASP A 177 -4.574 -24.188 -2.614 1.00 0.00 N ATOM 1133 CA ASP A 177 -5.196 -25.447 -3.007 1.00 0.00 C ATOM 1134 C ASP A 177 -5.855 -26.124 -1.810 1.00 0.00 C ATOM 1135 O ASP A 177 -5.262 -26.994 -1.172 1.00 0.00 O ATOM 1136 CB ASP A 177 -4.157 -26.381 -3.629 1.00 0.00 C ATOM 1137 CG ASP A 177 -3.541 -25.805 -4.889 1.00 0.00 C ATOM 1138 OD1 ASP A 177 -4.241 -25.754 -5.922 1.00 0.00 O ATOM 1139 OD2 ASP A 177 -2.359 -25.405 -4.841 1.00 0.00 O ATOM 0 H ASP A 177 -3.807 -24.286 -1.949 1.00 0.00 H new ATOM 0 HA ASP A 177 -5.966 -25.228 -3.747 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -3.370 -26.580 -2.902 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -4.625 -27.337 -3.862 1.00 0.00 H new ATOM 1144 N ILE A 178 -7.085 -25.718 -1.510 1.00 0.00 N ATOM 1145 CA ILE A 178 -7.824 -26.286 -0.390 1.00 0.00 C ATOM 1146 C ILE A 178 -8.778 -27.380 -0.858 1.00 0.00 C ATOM 1147 O ILE A 178 -9.791 -27.101 -1.499 1.00 0.00 O ATOM 1148 CB ILE A 178 -8.627 -25.207 0.360 1.00 0.00 C ATOM 1149 CG1 ILE A 178 -7.693 -24.107 0.868 1.00 0.00 C ATOM 1150 CG2 ILE A 178 -9.400 -25.828 1.514 1.00 0.00 C ATOM 1151 CD1 ILE A 178 -8.418 -22.852 1.302 1.00 0.00 C ATOM 0 H ILE A 178 -7.590 -24.998 -2.027 1.00 0.00 H new ATOM 0 HA ILE A 178 -7.087 -26.716 0.288 1.00 0.00 H new ATOM 0 HB ILE A 178 -9.342 -24.760 -0.331 1.00 0.00 H new ATOM 0 HG12 ILE A 178 -7.115 -24.492 1.708 1.00 0.00 H new ATOM 0 HG13 ILE A 178 -6.982 -23.853 0.082 1.00 0.00 H new ATOM 0 HG21 ILE A 178 -9.962 -25.053 2.034 1.00 0.00 H new ATOM 0 HG22 ILE A 178 -10.089 -26.579 1.128 1.00 0.00 H new ATOM 0 HG23 ILE A 178 -8.703 -26.298 2.208 1.00 0.00 H new ATOM 0 HD11 ILE A 178 -7.694 -22.115 1.650 1.00 0.00 H new ATOM 0 HD12 ILE A 178 -8.974 -22.443 0.459 1.00 0.00 H new ATOM 0 HD13 ILE A 178 -9.109 -23.092 2.110 1.00 0.00 H new ATOM 1163 N MET A 179 -8.448 -28.625 -0.533 1.00 0.00 N ATOM 1164 CA MET A 179 -9.277 -29.761 -0.918 1.00 0.00 C ATOM 1165 C MET A 179 -9.388 -29.863 -2.436 1.00 0.00 C ATOM 1166 O MET A 179 -10.473 -30.075 -2.975 1.00 0.00 O ATOM 1167 CB MET A 179 -10.671 -29.635 -0.300 1.00 0.00 C ATOM 1168 CG MET A 179 -10.685 -29.811 1.210 1.00 0.00 C ATOM 1169 SD MET A 179 -12.234 -30.507 1.814 1.00 0.00 S ATOM 1170 CE MET A 179 -13.202 -29.019 2.056 1.00 0.00 C ATOM 0 H MET A 179 -7.612 -28.873 -0.004 1.00 0.00 H new ATOM 0 HA MET A 179 -8.803 -30.668 -0.544 1.00 0.00 H new ATOM 0 HB2 MET A 179 -11.082 -28.656 -0.547 1.00 0.00 H new ATOM 0 HB3 MET A 179 -11.328 -30.379 -0.750 1.00 0.00 H new ATOM 0 HG2 MET A 179 -9.860 -30.461 1.504 1.00 0.00 H new ATOM 0 HG3 MET A 179 -10.515 -28.845 1.686 1.00 0.00 H new ATOM 0 HE1 MET A 179 -14.127 -29.267 2.576 1.00 0.00 H new ATOM 0 HE2 MET A 179 -12.631 -28.306 2.651 1.00 0.00 H new ATOM 0 HE3 MET A 179 -13.438 -28.577 1.088 1.00 0.00 H new ATOM 1180 N GLY A 180 -8.258 -29.711 -3.119 1.00 0.00 N ATOM 1181 CA GLY A 180 -8.251 -29.789 -4.568 1.00 0.00 C ATOM 1182 C GLY A 180 -9.042 -28.668 -5.213 1.00 0.00 C ATOM 1183 O GLY A 180 -9.723 -28.876 -6.217 1.00 0.00 O ATOM 0 H GLY A 180 -7.347 -29.535 -2.695 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -7.222 -29.756 -4.926 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -8.666 -30.748 -4.879 1.00 0.00 H new ATOM 1187 N LYS A 181 -8.954 -27.475 -4.634 1.00 0.00 N ATOM 1188 CA LYS A 181 -9.667 -26.316 -5.158 1.00 0.00 C ATOM 1189 C LYS A 181 -8.793 -25.067 -5.098 1.00 0.00 C ATOM 1190 O LYS A 181 -8.113 -24.819 -4.102 1.00 0.00 O ATOM 1191 CB LYS A 181 -10.957 -26.086 -4.368 1.00 0.00 C ATOM 1192 CG LYS A 181 -11.862 -25.028 -4.975 1.00 0.00 C ATOM 1193 CD LYS A 181 -12.640 -25.573 -6.161 1.00 0.00 C ATOM 1194 CE LYS A 181 -13.863 -24.721 -6.464 1.00 0.00 C ATOM 1195 NZ LYS A 181 -14.804 -25.412 -7.388 1.00 0.00 N ATOM 0 H LYS A 181 -8.396 -27.286 -3.802 1.00 0.00 H new ATOM 0 HA LYS A 181 -9.916 -26.514 -6.200 1.00 0.00 H new ATOM 0 HB2 LYS A 181 -11.505 -27.026 -4.302 1.00 0.00 H new ATOM 0 HB3 LYS A 181 -10.702 -25.793 -3.350 1.00 0.00 H new ATOM 0 HG2 LYS A 181 -12.558 -24.665 -4.218 1.00 0.00 H new ATOM 0 HG3 LYS A 181 -11.263 -24.175 -5.293 1.00 0.00 H new ATOM 0 HD2 LYS A 181 -11.993 -25.607 -7.037 1.00 0.00 H new ATOM 0 HD3 LYS A 181 -12.951 -26.597 -5.954 1.00 0.00 H new ATOM 0 HE2 LYS A 181 -14.378 -24.481 -5.534 1.00 0.00 H new ATOM 0 HE3 LYS A 181 -13.547 -23.776 -6.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 -15.624 -24.799 -7.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 -14.320 -25.619 -8.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 -15.125 -26.301 -6.955 1.00 0.00 H new ATOM 1209 N LYS A 182 -8.816 -24.283 -6.171 1.00 0.00 N ATOM 1210 CA LYS A 182 -8.028 -23.058 -6.240 1.00 0.00 C ATOM 1211 C LYS A 182 -8.744 -21.910 -5.536 1.00 0.00 C ATOM 1212 O LYS A 182 -9.662 -21.305 -6.089 1.00 0.00 O ATOM 1213 CB LYS A 182 -7.756 -22.685 -7.699 1.00 0.00 C ATOM 1214 CG LYS A 182 -6.492 -21.865 -7.892 1.00 0.00 C ATOM 1215 CD LYS A 182 -5.244 -22.704 -7.667 1.00 0.00 C ATOM 1216 CE LYS A 182 -4.862 -23.480 -8.918 1.00 0.00 C ATOM 1217 NZ LYS A 182 -4.044 -22.659 -9.852 1.00 0.00 N ATOM 0 H LYS A 182 -9.372 -24.474 -7.005 1.00 0.00 H new ATOM 0 HA LYS A 182 -7.080 -23.236 -5.733 1.00 0.00 H new ATOM 0 HB2 LYS A 182 -7.681 -23.597 -8.291 1.00 0.00 H new ATOM 0 HB3 LYS A 182 -8.606 -22.123 -8.086 1.00 0.00 H new ATOM 0 HG2 LYS A 182 -6.476 -21.451 -8.900 1.00 0.00 H new ATOM 0 HG3 LYS A 182 -6.495 -21.022 -7.201 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -4.418 -22.057 -7.372 1.00 0.00 H new ATOM 0 HD3 LYS A 182 -5.414 -23.399 -6.844 1.00 0.00 H new ATOM 0 HE2 LYS A 182 -4.304 -24.373 -8.635 1.00 0.00 H new ATOM 0 HE3 LYS A 182 -5.765 -23.817 -9.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 -3.804 -23.224 -10.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 -4.586 -21.820 -10.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 -3.170 -22.359 -9.376 1.00 0.00 H new ATOM 1231 N VAL A 183 -8.316 -21.614 -4.312 1.00 0.00 N ATOM 1232 CA VAL A 183 -8.914 -20.537 -3.533 1.00 0.00 C ATOM 1233 C VAL A 183 -8.154 -19.230 -3.728 1.00 0.00 C ATOM 1234 O VAL A 183 -6.931 -19.187 -3.600 1.00 0.00 O ATOM 1235 CB VAL A 183 -8.946 -20.880 -2.032 1.00 0.00 C ATOM 1236 CG1 VAL A 183 -9.973 -20.023 -1.309 1.00 0.00 C ATOM 1237 CG2 VAL A 183 -9.237 -22.360 -1.830 1.00 0.00 C ATOM 0 H VAL A 183 -7.557 -22.105 -3.839 1.00 0.00 H new ATOM 0 HA VAL A 183 -9.936 -20.417 -3.892 1.00 0.00 H new ATOM 0 HB VAL A 183 -7.966 -20.664 -1.607 1.00 0.00 H new ATOM 0 HG11 VAL A 183 -9.981 -20.280 -0.250 1.00 0.00 H new ATOM 0 HG12 VAL A 183 -9.715 -18.970 -1.425 1.00 0.00 H new ATOM 0 HG13 VAL A 183 -10.961 -20.203 -1.733 1.00 0.00 H new ATOM 0 HG21 VAL A 183 -9.256 -22.585 -0.764 1.00 0.00 H new ATOM 0 HG22 VAL A 183 -10.204 -22.604 -2.270 1.00 0.00 H new ATOM 0 HG23 VAL A 183 -8.460 -22.953 -2.312 1.00 0.00 H new ATOM 1247 N GLU A 184 -8.888 -18.165 -4.039 1.00 0.00 N ATOM 1248 CA GLU A 184 -8.282 -16.856 -4.252 1.00 0.00 C ATOM 1249 C GLU A 184 -8.159 -16.093 -2.936 1.00 0.00 C ATOM 1250 O GLU A 184 -8.986 -16.245 -2.038 1.00 0.00 O ATOM 1251 CB GLU A 184 -9.108 -16.044 -5.251 1.00 0.00 C ATOM 1252 CG GLU A 184 -8.283 -15.064 -6.068 1.00 0.00 C ATOM 1253 CD GLU A 184 -9.119 -14.291 -7.069 1.00 0.00 C ATOM 1254 OE1 GLU A 184 -10.001 -13.519 -6.637 1.00 0.00 O ATOM 1255 OE2 GLU A 184 -8.891 -14.458 -8.286 1.00 0.00 O ATOM 0 H GLU A 184 -9.902 -18.184 -4.149 1.00 0.00 H new ATOM 0 HA GLU A 184 -7.282 -17.008 -4.658 1.00 0.00 H new ATOM 0 HB2 GLU A 184 -9.619 -16.728 -5.928 1.00 0.00 H new ATOM 0 HB3 GLU A 184 -9.879 -15.495 -4.711 1.00 0.00 H new ATOM 0 HG2 GLU A 184 -7.788 -14.363 -5.396 1.00 0.00 H new ATOM 0 HG3 GLU A 184 -7.499 -15.607 -6.597 1.00 0.00 H new ATOM 1262 N VAL A 185 -7.119 -15.271 -2.831 1.00 0.00 N ATOM 1263 CA VAL A 185 -6.887 -14.483 -1.626 1.00 0.00 C ATOM 1264 C VAL A 185 -6.234 -13.147 -1.961 1.00 0.00 C ATOM 1265 O VAL A 185 -5.338 -13.074 -2.802 1.00 0.00 O ATOM 1266 CB VAL A 185 -5.996 -15.240 -0.623 1.00 0.00 C ATOM 1267 CG1 VAL A 185 -5.595 -14.330 0.527 1.00 0.00 C ATOM 1268 CG2 VAL A 185 -6.710 -16.481 -0.108 1.00 0.00 C ATOM 0 H VAL A 185 -6.424 -15.134 -3.565 1.00 0.00 H new ATOM 0 HA VAL A 185 -7.862 -14.304 -1.172 1.00 0.00 H new ATOM 0 HB VAL A 185 -5.089 -15.558 -1.137 1.00 0.00 H new ATOM 0 HG11 VAL A 185 -4.966 -14.882 1.225 1.00 0.00 H new ATOM 0 HG12 VAL A 185 -5.042 -13.475 0.138 1.00 0.00 H new ATOM 0 HG13 VAL A 185 -6.489 -13.980 1.043 1.00 0.00 H new ATOM 0 HG21 VAL A 185 -6.066 -17.004 0.599 1.00 0.00 H new ATOM 0 HG22 VAL A 185 -7.634 -16.189 0.390 1.00 0.00 H new ATOM 0 HG23 VAL A 185 -6.941 -17.141 -0.944 1.00 0.00 H new ATOM 1278 N LYS A 186 -6.689 -12.089 -1.297 1.00 0.00 N ATOM 1279 CA LYS A 186 -6.149 -10.754 -1.522 1.00 0.00 C ATOM 1280 C LYS A 186 -6.038 -9.984 -0.210 1.00 0.00 C ATOM 1281 O LYS A 186 -6.553 -10.418 0.821 1.00 0.00 O ATOM 1282 CB LYS A 186 -7.034 -9.982 -2.504 1.00 0.00 C ATOM 1283 CG LYS A 186 -7.219 -10.686 -3.837 1.00 0.00 C ATOM 1284 CD LYS A 186 -7.424 -9.692 -4.968 1.00 0.00 C ATOM 1285 CE LYS A 186 -8.897 -9.370 -5.167 1.00 0.00 C ATOM 1286 NZ LYS A 186 -9.612 -10.460 -5.886 1.00 0.00 N ATOM 0 H LYS A 186 -7.431 -12.131 -0.598 1.00 0.00 H new ATOM 0 HA LYS A 186 -5.151 -10.860 -1.947 1.00 0.00 H new ATOM 0 HB2 LYS A 186 -8.011 -9.820 -2.049 1.00 0.00 H new ATOM 0 HB3 LYS A 186 -6.597 -8.999 -2.679 1.00 0.00 H new ATOM 0 HG2 LYS A 186 -6.346 -11.304 -4.048 1.00 0.00 H new ATOM 0 HG3 LYS A 186 -8.077 -11.356 -3.780 1.00 0.00 H new ATOM 0 HD2 LYS A 186 -6.876 -8.775 -4.752 1.00 0.00 H new ATOM 0 HD3 LYS A 186 -7.012 -10.099 -5.891 1.00 0.00 H new ATOM 0 HE2 LYS A 186 -9.367 -9.206 -4.197 1.00 0.00 H new ATOM 0 HE3 LYS A 186 -8.993 -8.441 -5.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 186 -10.610 -10.473 -5.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 186 -9.555 -10.295 -6.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 186 -9.172 -11.374 -5.657 1.00 0.00 H new ATOM 1300 N ARG A 187 -5.363 -8.840 -0.255 1.00 0.00 N ATOM 1301 CA ARG A 187 -5.184 -8.011 0.930 1.00 0.00 C ATOM 1302 C ARG A 187 -6.425 -7.162 1.192 1.00 0.00 C ATOM 1303 O ARG A 187 -6.761 -6.278 0.405 1.00 0.00 O ATOM 1304 CB ARG A 187 -3.960 -7.108 0.767 1.00 0.00 C ATOM 1305 CG ARG A 187 -3.308 -6.722 2.085 1.00 0.00 C ATOM 1306 CD ARG A 187 -3.975 -5.502 2.700 1.00 0.00 C ATOM 1307 NE ARG A 187 -3.392 -4.255 2.212 1.00 0.00 N ATOM 1308 CZ ARG A 187 -2.304 -3.699 2.732 1.00 0.00 C ATOM 1309 NH1 ARG A 187 -1.683 -4.276 3.752 1.00 0.00 N ATOM 1310 NH2 ARG A 187 -1.834 -2.563 2.233 1.00 0.00 N ATOM 0 H ARG A 187 -4.931 -8.466 -1.100 1.00 0.00 H new ATOM 0 HA ARG A 187 -5.029 -8.670 1.784 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -3.225 -7.616 0.143 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -4.255 -6.202 0.238 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -3.367 -7.559 2.780 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -2.250 -6.516 1.922 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -5.041 -5.518 2.471 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -3.881 -5.546 3.785 1.00 0.00 H new ATOM 0 HE ARG A 187 -3.846 -3.785 1.428 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -2.041 -5.149 4.139 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -0.847 -3.847 4.149 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -2.309 -2.115 1.449 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -0.998 -2.137 2.634 1.00 0.00 H new ATOM 1324 N ALA A 188 -7.101 -7.438 2.302 1.00 0.00 N ATOM 1325 CA ALA A 188 -8.303 -6.699 2.668 1.00 0.00 C ATOM 1326 C ALA A 188 -7.952 -5.389 3.364 1.00 0.00 C ATOM 1327 O ALA A 188 -6.807 -5.176 3.763 1.00 0.00 O ATOM 1328 CB ALA A 188 -9.195 -7.550 3.560 1.00 0.00 C ATOM 0 H ALA A 188 -6.837 -8.168 2.964 1.00 0.00 H new ATOM 0 HA ALA A 188 -8.845 -6.460 1.753 1.00 0.00 H new ATOM 0 HB1 ALA A 188 -10.089 -6.985 3.826 1.00 0.00 H new ATOM 0 HB2 ALA A 188 -9.483 -8.456 3.028 1.00 0.00 H new ATOM 0 HB3 ALA A 188 -8.653 -7.819 4.467 1.00 0.00 H new