USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 545 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 Single : A 249 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 251 GLN : amide:sc= -0.2 X(o=-0.2,f=-0.073) USER MOD Single : A 252 CYS SG : rot -129:sc= -7.29! USER MOD Single : A 254 SER OG : rot 180:sc= 0.0208 USER MOD Single : A 260 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 267 GLN : amide:sc= -0.0045 X(o=-0.0045,f=-0.11) USER MOD Single : A 275 SER OG : rot -40:sc= -2.76! USER MOD Single : A 276 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 278 THR OG1 : rot 43:sc= 0.0522 USER MOD Single : A 279 THR OG1 : rot 180:sc= 0.132 USER MOD Single : A 280 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 281 ASN : amide:sc= -0.952 K(o=-0.95,f=0.91) USER MOD Single : A 284 ASN : amide:sc= -4.45! C(o=-4.5!,f=-3.6!) USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 299 SER OG : rot 82:sc= 0.487 USER MOD Single : A 300 THR OG1 : rot 61:sc= 0.359 USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 305 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 306 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 309 HIS : no HE2:sc= -15.7! C(o=-16!,f=-20!) USER MOD Single : A 310 THR OG1 : rot -44:sc= 0.0976 USER MOD Single : A 311 ASN : amide:sc= -0.162 X(o=-0.16,f=0) USER MOD Single : A 312 CYS SG : rot 170:sc= -1.33 USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -5.774 -15.643 3.130 1.00 0.00 N ATOM 76 CA ARG A 247 -4.966 -14.813 2.241 1.00 0.00 C ATOM 77 C ARG A 247 -5.487 -13.399 2.206 1.00 0.00 C ATOM 78 O ARG A 247 -6.496 -13.070 2.828 1.00 0.00 O ATOM 79 CB ARG A 247 -4.930 -15.396 0.826 1.00 0.00 C ATOM 80 CG ARG A 247 -6.224 -16.080 0.407 1.00 0.00 C ATOM 81 CD ARG A 247 -6.283 -16.291 -1.097 1.00 0.00 C ATOM 82 NE ARG A 247 -7.562 -15.867 -1.660 1.00 0.00 N ATOM 83 CZ ARG A 247 -7.849 -15.905 -2.959 1.00 0.00 C ATOM 84 NH1 ARG A 247 -6.953 -16.349 -3.831 1.00 0.00 N ATOM 85 NH2 ARG A 247 -9.038 -15.500 -3.387 1.00 0.00 N ATOM 0 HA ARG A 247 -3.950 -14.800 2.634 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -4.708 -14.596 0.120 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -4.113 -16.115 0.760 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -6.309 -17.041 0.914 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -7.075 -15.477 0.724 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -5.475 -15.735 -1.573 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -6.120 -17.345 -1.322 1.00 0.00 H new ATOM 0 HE ARG A 247 -8.277 -15.521 -1.020 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -6.038 -16.664 -3.507 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -7.179 -16.376 -4.825 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -9.731 -15.160 -2.721 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -9.259 -15.529 -4.382 1.00 0.00 H new ATOM 99 N TRP A 248 -4.751 -12.558 1.511 1.00 0.00 N ATOM 100 CA TRP A 248 -5.092 -11.153 1.429 1.00 0.00 C ATOM 101 C TRP A 248 -5.070 -10.597 0.017 1.00 0.00 C ATOM 102 O TRP A 248 -4.675 -11.253 -0.944 1.00 0.00 O ATOM 103 CB TRP A 248 -4.101 -10.361 2.256 1.00 0.00 C ATOM 104 CG TRP A 248 -4.416 -10.295 3.706 1.00 0.00 C ATOM 105 CD1 TRP A 248 -3.828 -11.005 4.703 1.00 0.00 C ATOM 106 CD2 TRP A 248 -5.391 -9.458 4.316 1.00 0.00 C ATOM 107 NE1 TRP A 248 -4.341 -10.612 5.921 1.00 0.00 N ATOM 108 CE2 TRP A 248 -5.314 -9.663 5.701 1.00 0.00 C ATOM 109 CE3 TRP A 248 -6.311 -8.541 3.818 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -6.129 -8.969 6.593 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -7.125 -7.867 4.699 1.00 0.00 C ATOM 112 CH2 TRP A 248 -7.026 -8.078 6.075 1.00 0.00 C ATOM 0 H TRP A 248 -3.912 -12.822 0.994 1.00 0.00 H new ATOM 0 HA TRP A 248 -6.113 -11.062 1.799 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -3.112 -10.801 2.133 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -4.049 -9.346 1.863 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -3.072 -11.764 4.563 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -4.049 -10.965 6.832 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -6.385 -8.361 2.756 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -6.054 -9.130 7.658 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -7.852 -7.164 4.320 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -7.671 -7.526 6.743 1.00 0.00 H new ATOM 123 N MET A 249 -5.475 -9.340 -0.041 1.00 0.00 N ATOM 124 CA MET A 249 -5.516 -8.542 -1.255 1.00 0.00 C ATOM 125 C MET A 249 -5.510 -7.080 -0.837 1.00 0.00 C ATOM 126 O MET A 249 -6.519 -6.383 -0.922 1.00 0.00 O ATOM 127 CB MET A 249 -6.763 -8.820 -2.067 1.00 0.00 C ATOM 128 CG MET A 249 -6.755 -10.156 -2.792 1.00 0.00 C ATOM 129 SD MET A 249 -7.154 -10.000 -4.544 1.00 0.00 S ATOM 130 CE MET A 249 -8.455 -11.221 -4.705 1.00 0.00 C ATOM 0 H MET A 249 -5.795 -8.830 0.782 1.00 0.00 H new ATOM 0 HA MET A 249 -4.657 -8.790 -1.878 1.00 0.00 H new ATOM 0 HB2 MET A 249 -7.628 -8.785 -1.405 1.00 0.00 H new ATOM 0 HB3 MET A 249 -6.890 -8.023 -2.800 1.00 0.00 H new ATOM 0 HG2 MET A 249 -5.772 -10.616 -2.687 1.00 0.00 H new ATOM 0 HG3 MET A 249 -7.473 -10.826 -2.318 1.00 0.00 H new ATOM 0 HE1 MET A 249 -8.807 -11.244 -5.736 1.00 0.00 H new ATOM 0 HE2 MET A 249 -8.068 -12.203 -4.432 1.00 0.00 H new ATOM 0 HE3 MET A 249 -9.282 -10.960 -4.045 1.00 0.00 H new ATOM 140 N VAL A 250 -4.371 -6.659 -0.334 1.00 0.00 N ATOM 141 CA VAL A 250 -4.179 -5.303 0.182 1.00 0.00 C ATOM 142 C VAL A 250 -4.908 -4.257 -0.642 1.00 0.00 C ATOM 143 O VAL A 250 -5.147 -4.451 -1.832 1.00 0.00 O ATOM 144 CB VAL A 250 -2.694 -4.918 0.226 1.00 0.00 C ATOM 145 CG1 VAL A 250 -2.549 -3.447 0.599 1.00 0.00 C ATOM 146 CG2 VAL A 250 -1.928 -5.814 1.190 1.00 0.00 C ATOM 0 H VAL A 250 -3.539 -7.245 -0.267 1.00 0.00 H new ATOM 0 HA VAL A 250 -4.593 -5.319 1.190 1.00 0.00 H new ATOM 0 HB VAL A 250 -2.263 -5.065 -0.764 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -1.492 -3.181 0.628 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -3.057 -2.832 -0.143 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -2.994 -3.275 1.579 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -0.878 -5.521 1.203 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -2.346 -5.712 2.192 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -2.011 -6.852 0.866 1.00 0.00 H new ATOM 156 N GLN A 251 -5.235 -3.130 -0.007 1.00 0.00 N ATOM 157 CA GLN A 251 -5.899 -2.057 -0.707 1.00 0.00 C ATOM 158 C GLN A 251 -5.744 -0.778 0.072 1.00 0.00 C ATOM 159 O GLN A 251 -6.711 -0.121 0.455 1.00 0.00 O ATOM 160 CB GLN A 251 -7.361 -2.401 -0.927 1.00 0.00 C ATOM 161 CG GLN A 251 -8.102 -1.404 -1.802 1.00 0.00 C ATOM 162 CD GLN A 251 -9.106 -2.070 -2.724 1.00 0.00 C ATOM 163 OE1 GLN A 251 -10.272 -1.680 -2.775 1.00 0.00 O ATOM 164 NE2 GLN A 251 -8.656 -3.081 -3.456 1.00 0.00 N ATOM 0 H GLN A 251 -5.049 -2.948 0.979 1.00 0.00 H new ATOM 0 HA GLN A 251 -5.442 -1.919 -1.687 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -7.427 -3.389 -1.382 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -7.860 -2.462 0.040 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -8.619 -0.684 -1.168 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -7.382 -0.844 -2.399 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -7.681 -3.370 -3.381 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -9.285 -3.569 -4.094 1.00 0.00 H new ATOM 173 N CYS A 252 -4.493 -0.452 0.287 1.00 0.00 N ATOM 174 CA CYS A 252 -4.103 0.737 1.015 1.00 0.00 C ATOM 175 C CYS A 252 -3.827 1.867 0.041 1.00 0.00 C ATOM 176 O CYS A 252 -4.286 1.837 -1.100 1.00 0.00 O ATOM 177 CB CYS A 252 -2.852 0.430 1.844 1.00 0.00 C ATOM 178 SG CYS A 252 -1.549 -0.411 0.914 1.00 0.00 S ATOM 0 H CYS A 252 -3.705 -1.010 -0.042 1.00 0.00 H new ATOM 0 HA CYS A 252 -4.909 1.043 1.682 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -2.455 1.363 2.245 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -3.135 -0.189 2.696 1.00 0.00 H new ATOM 0 HG CYS A 252 -1.161 -1.465 1.568 1.00 0.00 H new ATOM 184 N GLY A 253 -3.066 2.855 0.481 1.00 0.00 N ATOM 185 CA GLY A 253 -2.739 3.956 -0.385 1.00 0.00 C ATOM 186 C GLY A 253 -3.822 5.004 -0.448 1.00 0.00 C ATOM 187 O GLY A 253 -4.209 5.571 0.573 1.00 0.00 O ATOM 0 H GLY A 253 -2.672 2.911 1.420 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -1.814 4.419 -0.040 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -2.551 3.576 -1.389 1.00 0.00 H new ATOM 191 N SER A 254 -4.281 5.304 -1.662 1.00 0.00 N ATOM 192 CA SER A 254 -5.289 6.340 -1.857 1.00 0.00 C ATOM 193 C SER A 254 -4.829 7.590 -1.127 1.00 0.00 C ATOM 194 O SER A 254 -5.328 7.919 -0.050 1.00 0.00 O ATOM 195 CB SER A 254 -6.652 5.876 -1.337 1.00 0.00 C ATOM 196 OG SER A 254 -7.493 5.466 -2.401 1.00 0.00 O ATOM 0 H SER A 254 -3.972 4.846 -2.520 1.00 0.00 H new ATOM 0 HA SER A 254 -5.404 6.552 -2.920 1.00 0.00 H new ATOM 0 HB2 SER A 254 -6.516 5.050 -0.638 1.00 0.00 H new ATOM 0 HB3 SER A 254 -7.128 6.686 -0.784 1.00 0.00 H new ATOM 0 HG SER A 254 -8.356 5.173 -2.041 1.00 0.00 H new ATOM 202 N PHE A 255 -3.814 8.238 -1.690 1.00 0.00 N ATOM 203 CA PHE A 255 -3.217 9.402 -1.057 1.00 0.00 C ATOM 204 C PHE A 255 -3.134 10.605 -1.977 1.00 0.00 C ATOM 205 O PHE A 255 -2.451 10.573 -3.002 1.00 0.00 O ATOM 206 CB PHE A 255 -1.806 9.076 -0.493 1.00 0.00 C ATOM 207 CG PHE A 255 -1.069 7.915 -1.151 1.00 0.00 C ATOM 208 CD1 PHE A 255 -1.744 6.779 -1.545 1.00 0.00 C ATOM 209 CD2 PHE A 255 0.306 7.961 -1.368 1.00 0.00 C ATOM 210 CE1 PHE A 255 -1.097 5.721 -2.140 1.00 0.00 C ATOM 211 CE2 PHE A 255 0.959 6.892 -1.961 1.00 0.00 C ATOM 212 CZ PHE A 255 0.258 5.776 -2.348 1.00 0.00 C ATOM 0 H PHE A 255 -3.391 7.976 -2.580 1.00 0.00 H new ATOM 0 HA PHE A 255 -3.884 9.665 -0.236 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.187 9.969 -0.582 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -1.904 8.860 0.571 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -2.810 6.718 -1.382 1.00 0.00 H new ATOM 0 HD2 PHE A 255 0.867 8.835 -1.072 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -1.655 4.848 -2.443 1.00 0.00 H new ATOM 0 HE2 PHE A 255 2.026 6.937 -2.120 1.00 0.00 H new ATOM 0 HZ PHE A 255 0.770 4.947 -2.813 1.00 0.00 H new ATOM 222 N ARG A 256 -3.792 11.696 -1.569 1.00 0.00 N ATOM 223 CA ARG A 256 -3.750 12.942 -2.327 1.00 0.00 C ATOM 224 C ARG A 256 -2.300 13.289 -2.637 1.00 0.00 C ATOM 225 O ARG A 256 -2.005 14.009 -3.590 1.00 0.00 O ATOM 226 CB ARG A 256 -4.407 14.076 -1.537 1.00 0.00 C ATOM 227 CG ARG A 256 -4.986 15.173 -2.415 1.00 0.00 C ATOM 228 CD ARG A 256 -6.259 15.751 -1.819 1.00 0.00 C ATOM 229 NE ARG A 256 -6.766 16.880 -2.597 1.00 0.00 N ATOM 230 CZ ARG A 256 -6.273 18.114 -2.521 1.00 0.00 C ATOM 231 NH1 ARG A 256 -5.261 18.383 -1.704 1.00 0.00 N ATOM 232 NH2 ARG A 256 -6.791 19.081 -3.263 1.00 0.00 N ATOM 0 H ARG A 256 -4.357 11.737 -0.721 1.00 0.00 H new ATOM 0 HA ARG A 256 -4.303 12.813 -3.258 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -5.201 13.662 -0.916 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -3.670 14.513 -0.863 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -4.249 15.966 -2.541 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -5.196 14.773 -3.407 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -7.021 14.974 -1.770 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -6.066 16.074 -0.796 1.00 0.00 H new ATOM 0 HE ARG A 256 -7.543 16.712 -3.236 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -4.858 17.642 -1.131 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -4.887 19.331 -1.650 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -7.568 18.880 -3.893 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -6.413 20.027 -3.205 1.00 0.00 H new ATOM 246 N GLY A 257 -1.403 12.728 -1.825 1.00 0.00 N ATOM 247 CA GLY A 257 0.013 12.912 -1.994 1.00 0.00 C ATOM 248 C GLY A 257 0.478 12.283 -3.287 1.00 0.00 C ATOM 249 O GLY A 257 1.234 11.324 -3.278 1.00 0.00 O ATOM 0 H GLY A 257 -1.653 12.134 -1.034 1.00 0.00 H new ATOM 0 HA2 GLY A 257 0.250 13.976 -1.995 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.546 12.467 -1.154 1.00 0.00 H new ATOM 253 N ALA A 258 -0.015 12.811 -4.398 1.00 0.00 N ATOM 254 CA ALA A 258 0.306 12.295 -5.727 1.00 0.00 C ATOM 255 C ALA A 258 1.805 12.134 -5.929 1.00 0.00 C ATOM 256 O ALA A 258 2.285 11.050 -6.261 1.00 0.00 O ATOM 257 CB ALA A 258 -0.275 13.206 -6.798 1.00 0.00 C ATOM 0 H ALA A 258 -0.649 13.610 -4.407 1.00 0.00 H new ATOM 0 HA ALA A 258 -0.143 11.305 -5.812 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -0.029 12.811 -7.784 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -1.358 13.254 -6.686 1.00 0.00 H new ATOM 0 HB3 ALA A 258 0.146 14.206 -6.692 1.00 0.00 H new ATOM 263 N GLU A 259 2.541 13.215 -5.728 1.00 0.00 N ATOM 264 CA GLU A 259 3.992 13.174 -5.889 1.00 0.00 C ATOM 265 C GLU A 259 4.597 12.238 -4.856 1.00 0.00 C ATOM 266 O GLU A 259 5.377 11.347 -5.191 1.00 0.00 O ATOM 267 CB GLU A 259 4.591 14.576 -5.753 1.00 0.00 C ATOM 268 CG GLU A 259 5.900 14.753 -6.508 1.00 0.00 C ATOM 269 CD GLU A 259 5.810 15.805 -7.596 1.00 0.00 C ATOM 270 OE1 GLU A 259 5.425 16.952 -7.283 1.00 0.00 O ATOM 271 OE2 GLU A 259 6.124 15.482 -8.761 1.00 0.00 O ATOM 0 H GLU A 259 2.166 14.124 -5.456 1.00 0.00 H new ATOM 0 HA GLU A 259 4.224 12.802 -6.887 1.00 0.00 H new ATOM 0 HB2 GLU A 259 3.869 15.308 -6.117 1.00 0.00 H new ATOM 0 HB3 GLU A 259 4.758 14.790 -4.697 1.00 0.00 H new ATOM 0 HG2 GLU A 259 6.686 15.030 -5.805 1.00 0.00 H new ATOM 0 HG3 GLU A 259 6.190 13.801 -6.952 1.00 0.00 H new ATOM 278 N GLN A 260 4.208 12.427 -3.603 1.00 0.00 N ATOM 279 CA GLN A 260 4.689 11.575 -2.529 1.00 0.00 C ATOM 280 C GLN A 260 4.219 10.147 -2.764 1.00 0.00 C ATOM 281 O GLN A 260 4.876 9.190 -2.363 1.00 0.00 O ATOM 282 CB GLN A 260 4.175 12.076 -1.176 1.00 0.00 C ATOM 283 CG GLN A 260 5.273 12.275 -0.143 1.00 0.00 C ATOM 284 CD GLN A 260 5.048 13.502 0.718 1.00 0.00 C ATOM 285 OE1 GLN A 260 4.506 13.411 1.820 1.00 0.00 O ATOM 286 NE2 GLN A 260 5.464 14.660 0.218 1.00 0.00 N ATOM 0 H GLN A 260 3.563 13.160 -3.308 1.00 0.00 H new ATOM 0 HA GLN A 260 5.779 11.603 -2.518 1.00 0.00 H new ATOM 0 HB2 GLN A 260 3.651 13.020 -1.323 1.00 0.00 H new ATOM 0 HB3 GLN A 260 3.447 11.364 -0.787 1.00 0.00 H new ATOM 0 HG2 GLN A 260 5.330 11.393 0.495 1.00 0.00 H new ATOM 0 HG3 GLN A 260 6.233 12.363 -0.651 1.00 0.00 H new ATOM 0 HE21 GLN A 260 5.908 14.689 -0.700 1.00 0.00 H new ATOM 0 HE22 GLN A 260 5.339 15.520 0.752 1.00 0.00 H new ATOM 295 N ALA A 261 3.071 10.020 -3.423 1.00 0.00 N ATOM 296 CA ALA A 261 2.495 8.723 -3.724 1.00 0.00 C ATOM 297 C ALA A 261 3.430 7.905 -4.600 1.00 0.00 C ATOM 298 O ALA A 261 3.644 6.717 -4.364 1.00 0.00 O ATOM 299 CB ALA A 261 1.143 8.878 -4.385 1.00 0.00 C ATOM 0 H ALA A 261 2.521 10.810 -3.759 1.00 0.00 H new ATOM 0 HA ALA A 261 2.357 8.188 -2.784 1.00 0.00 H new ATOM 0 HB1 ALA A 261 0.729 7.893 -4.602 1.00 0.00 H new ATOM 0 HB2 ALA A 261 0.470 9.415 -3.716 1.00 0.00 H new ATOM 0 HB3 ALA A 261 1.254 9.438 -5.314 1.00 0.00 H new ATOM 305 N GLU A 262 3.992 8.559 -5.608 1.00 0.00 N ATOM 306 CA GLU A 262 4.918 7.908 -6.522 1.00 0.00 C ATOM 307 C GLU A 262 6.141 7.408 -5.763 1.00 0.00 C ATOM 308 O GLU A 262 6.466 6.222 -5.802 1.00 0.00 O ATOM 309 CB GLU A 262 5.333 8.885 -7.629 1.00 0.00 C ATOM 310 CG GLU A 262 4.808 8.503 -9.004 1.00 0.00 C ATOM 311 CD GLU A 262 4.091 9.648 -9.695 1.00 0.00 C ATOM 312 OE1 GLU A 262 4.347 10.815 -9.330 1.00 0.00 O ATOM 313 OE2 GLU A 262 3.273 9.378 -10.599 1.00 0.00 O ATOM 0 H GLU A 262 3.821 9.544 -5.813 1.00 0.00 H new ATOM 0 HA GLU A 262 4.423 7.051 -6.980 1.00 0.00 H new ATOM 0 HB2 GLU A 262 4.973 9.882 -7.376 1.00 0.00 H new ATOM 0 HB3 GLU A 262 6.421 8.938 -7.666 1.00 0.00 H new ATOM 0 HG2 GLU A 262 5.639 8.171 -9.627 1.00 0.00 H new ATOM 0 HG3 GLU A 262 4.126 7.658 -8.906 1.00 0.00 H new ATOM 320 N THR A 263 6.802 8.315 -5.052 1.00 0.00 N ATOM 321 CA THR A 263 7.970 7.951 -4.263 1.00 0.00 C ATOM 322 C THR A 263 7.560 7.001 -3.144 1.00 0.00 C ATOM 323 O THR A 263 8.350 6.173 -2.692 1.00 0.00 O ATOM 324 CB THR A 263 8.631 9.201 -3.678 1.00 0.00 C ATOM 325 OG1 THR A 263 9.026 10.087 -4.711 1.00 0.00 O ATOM 326 CG2 THR A 263 9.854 8.897 -2.840 1.00 0.00 C ATOM 0 H THR A 263 6.550 9.302 -5.007 1.00 0.00 H new ATOM 0 HA THR A 263 8.690 7.451 -4.910 1.00 0.00 H new ATOM 0 HB THR A 263 7.876 9.654 -3.035 1.00 0.00 H new ATOM 0 HG1 THR A 263 9.445 10.881 -4.318 1.00 0.00 H new ATOM 0 HG21 THR A 263 10.273 9.827 -2.457 1.00 0.00 H new ATOM 0 HG22 THR A 263 9.573 8.255 -2.006 1.00 0.00 H new ATOM 0 HG23 THR A 263 10.599 8.390 -3.454 1.00 0.00 H new ATOM 334 N VAL A 264 6.306 7.125 -2.711 1.00 0.00 N ATOM 335 CA VAL A 264 5.770 6.280 -1.656 1.00 0.00 C ATOM 336 C VAL A 264 5.712 4.824 -2.118 1.00 0.00 C ATOM 337 O VAL A 264 5.986 3.905 -1.345 1.00 0.00 O ATOM 338 CB VAL A 264 4.362 6.763 -1.213 1.00 0.00 C ATOM 339 CG1 VAL A 264 3.501 5.602 -0.735 1.00 0.00 C ATOM 340 CG2 VAL A 264 4.485 7.811 -0.117 1.00 0.00 C ATOM 0 H VAL A 264 5.643 7.807 -3.079 1.00 0.00 H new ATOM 0 HA VAL A 264 6.437 6.350 -0.796 1.00 0.00 H new ATOM 0 HB VAL A 264 3.874 7.208 -2.080 1.00 0.00 H new ATOM 0 HG11 VAL A 264 2.523 5.975 -0.432 1.00 0.00 H new ATOM 0 HG12 VAL A 264 3.380 4.881 -1.544 1.00 0.00 H new ATOM 0 HG13 VAL A 264 3.983 5.117 0.114 1.00 0.00 H new ATOM 0 HG21 VAL A 264 3.491 8.141 0.184 1.00 0.00 H new ATOM 0 HG22 VAL A 264 5.000 7.381 0.742 1.00 0.00 H new ATOM 0 HG23 VAL A 264 5.052 8.663 -0.491 1.00 0.00 H new ATOM 350 N ARG A 265 5.360 4.621 -3.385 1.00 0.00 N ATOM 351 CA ARG A 265 5.274 3.277 -3.949 1.00 0.00 C ATOM 352 C ARG A 265 6.601 2.540 -3.794 1.00 0.00 C ATOM 353 O ARG A 265 6.634 1.370 -3.415 1.00 0.00 O ATOM 354 CB ARG A 265 4.901 3.347 -5.432 1.00 0.00 C ATOM 355 CG ARG A 265 4.003 2.205 -5.876 1.00 0.00 C ATOM 356 CD ARG A 265 4.490 1.563 -7.166 1.00 0.00 C ATOM 357 NE ARG A 265 5.918 1.257 -7.121 1.00 0.00 N ATOM 358 CZ ARG A 265 6.429 0.183 -6.525 1.00 0.00 C ATOM 359 NH1 ARG A 265 5.634 -0.688 -5.917 1.00 0.00 N ATOM 360 NH2 ARG A 265 7.740 -0.020 -6.535 1.00 0.00 N ATOM 0 H ARG A 265 5.130 5.369 -4.040 1.00 0.00 H new ATOM 0 HA ARG A 265 4.501 2.732 -3.407 1.00 0.00 H new ATOM 0 HB2 ARG A 265 4.399 4.294 -5.630 1.00 0.00 H new ATOM 0 HB3 ARG A 265 5.812 3.338 -6.030 1.00 0.00 H new ATOM 0 HG2 ARG A 265 3.960 1.451 -5.090 1.00 0.00 H new ATOM 0 HG3 ARG A 265 2.988 2.576 -6.017 1.00 0.00 H new ATOM 0 HD2 ARG A 265 3.929 0.647 -7.349 1.00 0.00 H new ATOM 0 HD3 ARG A 265 4.289 2.233 -8.002 1.00 0.00 H new ATOM 0 HE ARG A 265 6.562 1.906 -7.574 1.00 0.00 H new ATOM 0 HH11 ARG A 265 4.625 -0.536 -5.905 1.00 0.00 H new ATOM 0 HH12 ARG A 265 6.031 -1.510 -5.462 1.00 0.00 H new ATOM 0 HH21 ARG A 265 8.356 0.647 -7.000 1.00 0.00 H new ATOM 0 HH22 ARG A 265 8.132 -0.843 -6.078 1.00 0.00 H new ATOM 374 N ALA A 266 7.693 3.236 -4.094 1.00 0.00 N ATOM 375 CA ALA A 266 9.024 2.652 -3.992 1.00 0.00 C ATOM 376 C ALA A 266 9.335 2.242 -2.558 1.00 0.00 C ATOM 377 O ALA A 266 9.918 1.186 -2.319 1.00 0.00 O ATOM 378 CB ALA A 266 10.069 3.634 -4.506 1.00 0.00 C ATOM 0 H ALA A 266 7.681 4.206 -4.410 1.00 0.00 H new ATOM 0 HA ALA A 266 9.051 1.754 -4.609 1.00 0.00 H new ATOM 0 HB1 ALA A 266 11.060 3.187 -4.425 1.00 0.00 H new ATOM 0 HB2 ALA A 266 9.863 3.872 -5.550 1.00 0.00 H new ATOM 0 HB3 ALA A 266 10.033 4.547 -3.912 1.00 0.00 H new ATOM 384 N GLN A 267 8.937 3.078 -1.602 1.00 0.00 N ATOM 385 CA GLN A 267 9.173 2.788 -0.191 1.00 0.00 C ATOM 386 C GLN A 267 8.593 1.427 0.174 1.00 0.00 C ATOM 387 O GLN A 267 9.177 0.678 0.954 1.00 0.00 O ATOM 388 CB GLN A 267 8.556 3.874 0.691 1.00 0.00 C ATOM 389 CG GLN A 267 9.309 4.099 1.992 1.00 0.00 C ATOM 390 CD GLN A 267 10.051 5.421 2.016 1.00 0.00 C ATOM 391 OE1 GLN A 267 9.476 6.475 1.744 1.00 0.00 O ATOM 392 NE2 GLN A 267 11.337 5.372 2.343 1.00 0.00 N ATOM 0 H GLN A 267 8.452 3.958 -1.778 1.00 0.00 H new ATOM 0 HA GLN A 267 10.249 2.770 -0.020 1.00 0.00 H new ATOM 0 HB2 GLN A 267 8.524 4.810 0.133 1.00 0.00 H new ATOM 0 HB3 GLN A 267 7.525 3.603 0.919 1.00 0.00 H new ATOM 0 HG2 GLN A 267 8.606 4.066 2.824 1.00 0.00 H new ATOM 0 HG3 GLN A 267 10.019 3.286 2.142 1.00 0.00 H new ATOM 0 HE21 GLN A 267 11.774 4.477 2.561 1.00 0.00 H new ATOM 0 HE22 GLN A 267 11.888 6.230 2.376 1.00 0.00 H new ATOM 401 N LEU A 268 7.442 1.114 -0.408 1.00 0.00 N ATOM 402 CA LEU A 268 6.772 -0.159 -0.166 1.00 0.00 C ATOM 403 C LEU A 268 7.641 -1.318 -0.627 1.00 0.00 C ATOM 404 O LEU A 268 7.972 -2.204 0.155 1.00 0.00 O ATOM 405 CB LEU A 268 5.421 -0.182 -0.902 1.00 0.00 C ATOM 406 CG LEU A 268 4.222 0.350 -0.105 1.00 0.00 C ATOM 407 CD1 LEU A 268 3.695 1.627 -0.735 1.00 0.00 C ATOM 408 CD2 LEU A 268 3.109 -0.695 -0.029 1.00 0.00 C ATOM 0 H LEU A 268 6.950 1.729 -1.056 1.00 0.00 H new ATOM 0 HA LEU A 268 6.599 -0.267 0.905 1.00 0.00 H new ATOM 0 HB2 LEU A 268 5.516 0.404 -1.816 1.00 0.00 H new ATOM 0 HB3 LEU A 268 5.208 -1.208 -1.202 1.00 0.00 H new ATOM 0 HG LEU A 268 4.559 0.567 0.909 1.00 0.00 H new ATOM 0 HD11 LEU A 268 2.845 1.993 -0.159 1.00 0.00 H new ATOM 0 HD12 LEU A 268 4.481 2.382 -0.740 1.00 0.00 H new ATOM 0 HD13 LEU A 268 3.380 1.425 -1.759 1.00 0.00 H new ATOM 0 HD21 LEU A 268 2.271 -0.293 0.541 1.00 0.00 H new ATOM 0 HD22 LEU A 268 2.776 -0.946 -1.036 1.00 0.00 H new ATOM 0 HD23 LEU A 268 3.485 -1.592 0.463 1.00 0.00 H new ATOM 420 N ALA A 269 8.006 -1.303 -1.895 1.00 0.00 N ATOM 421 CA ALA A 269 8.837 -2.357 -2.461 1.00 0.00 C ATOM 422 C ALA A 269 10.269 -2.287 -1.943 1.00 0.00 C ATOM 423 O ALA A 269 10.999 -3.278 -1.976 1.00 0.00 O ATOM 424 CB ALA A 269 8.820 -2.274 -3.979 1.00 0.00 C ATOM 0 H ALA A 269 7.741 -0.573 -2.556 1.00 0.00 H new ATOM 0 HA ALA A 269 8.421 -3.315 -2.147 1.00 0.00 H new ATOM 0 HB1 ALA A 269 9.444 -3.066 -4.394 1.00 0.00 H new ATOM 0 HB2 ALA A 269 7.798 -2.392 -4.338 1.00 0.00 H new ATOM 0 HB3 ALA A 269 9.206 -1.305 -4.295 1.00 0.00 H new ATOM 430 N PHE A 270 10.673 -1.114 -1.470 1.00 0.00 N ATOM 431 CA PHE A 270 12.023 -0.930 -0.956 1.00 0.00 C ATOM 432 C PHE A 270 12.088 -1.226 0.535 1.00 0.00 C ATOM 433 O PHE A 270 13.153 -1.532 1.070 1.00 0.00 O ATOM 434 CB PHE A 270 12.506 0.493 -1.238 1.00 0.00 C ATOM 435 CG PHE A 270 12.825 0.741 -2.687 1.00 0.00 C ATOM 436 CD1 PHE A 270 12.453 -0.174 -3.663 1.00 0.00 C ATOM 437 CD2 PHE A 270 13.496 1.890 -3.073 1.00 0.00 C ATOM 438 CE1 PHE A 270 12.747 0.054 -4.994 1.00 0.00 C ATOM 439 CE2 PHE A 270 13.792 2.122 -4.404 1.00 0.00 C ATOM 440 CZ PHE A 270 13.417 1.204 -5.364 1.00 0.00 C ATOM 0 H PHE A 270 10.087 -0.280 -1.432 1.00 0.00 H new ATOM 0 HA PHE A 270 12.679 -1.634 -1.467 1.00 0.00 H new ATOM 0 HB2 PHE A 270 11.740 1.199 -0.917 1.00 0.00 H new ATOM 0 HB3 PHE A 270 13.395 0.692 -0.639 1.00 0.00 H new ATOM 0 HD1 PHE A 270 11.928 -1.074 -3.379 1.00 0.00 H new ATOM 0 HD2 PHE A 270 13.791 2.612 -2.326 1.00 0.00 H new ATOM 0 HE1 PHE A 270 12.453 -0.666 -5.744 1.00 0.00 H new ATOM 0 HE2 PHE A 270 14.316 3.021 -4.692 1.00 0.00 H new ATOM 0 HZ PHE A 270 13.647 1.385 -6.404 1.00 0.00 H new ATOM 450 N GLU A 271 10.943 -1.143 1.203 1.00 0.00 N ATOM 451 CA GLU A 271 10.885 -1.413 2.628 1.00 0.00 C ATOM 452 C GLU A 271 10.584 -2.888 2.890 1.00 0.00 C ATOM 453 O GLU A 271 10.734 -3.365 4.015 1.00 0.00 O ATOM 454 CB GLU A 271 9.833 -0.525 3.288 1.00 0.00 C ATOM 455 CG GLU A 271 9.527 -0.895 4.731 1.00 0.00 C ATOM 456 CD GLU A 271 10.741 -0.785 5.632 1.00 0.00 C ATOM 457 OE1 GLU A 271 11.685 -0.051 5.268 1.00 0.00 O ATOM 458 OE2 GLU A 271 10.750 -1.431 6.701 1.00 0.00 O ATOM 0 H GLU A 271 10.049 -0.892 0.781 1.00 0.00 H new ATOM 0 HA GLU A 271 11.858 -1.186 3.063 1.00 0.00 H new ATOM 0 HB2 GLU A 271 10.173 0.510 3.254 1.00 0.00 H new ATOM 0 HB3 GLU A 271 8.912 -0.578 2.707 1.00 0.00 H new ATOM 0 HG2 GLU A 271 8.738 -0.245 5.109 1.00 0.00 H new ATOM 0 HG3 GLU A 271 9.144 -1.915 4.767 1.00 0.00 H new ATOM 465 N GLY A 272 10.170 -3.615 1.848 1.00 0.00 N ATOM 466 CA GLY A 272 9.879 -5.029 2.018 1.00 0.00 C ATOM 467 C GLY A 272 8.441 -5.400 1.699 1.00 0.00 C ATOM 468 O GLY A 272 7.990 -6.489 2.051 1.00 0.00 O ATOM 0 H GLY A 272 10.033 -3.254 0.904 1.00 0.00 H new ATOM 0 HA2 GLY A 272 10.545 -5.607 1.377 1.00 0.00 H new ATOM 0 HA3 GLY A 272 10.099 -5.315 3.047 1.00 0.00 H new ATOM 472 N PHE A 273 7.723 -4.513 1.018 1.00 0.00 N ATOM 473 CA PHE A 273 6.341 -4.789 0.644 1.00 0.00 C ATOM 474 C PHE A 273 5.994 -4.116 -0.675 1.00 0.00 C ATOM 475 O PHE A 273 5.475 -3.007 -0.704 1.00 0.00 O ATOM 476 CB PHE A 273 5.354 -4.383 1.752 1.00 0.00 C ATOM 477 CG PHE A 273 5.369 -2.932 2.187 1.00 0.00 C ATOM 478 CD1 PHE A 273 6.536 -2.298 2.602 1.00 0.00 C ATOM 479 CD2 PHE A 273 4.180 -2.219 2.248 1.00 0.00 C ATOM 480 CE1 PHE A 273 6.506 -0.990 3.063 1.00 0.00 C ATOM 481 CE2 PHE A 273 4.160 -0.913 2.696 1.00 0.00 C ATOM 482 CZ PHE A 273 5.318 -0.303 3.104 1.00 0.00 C ATOM 0 H PHE A 273 8.072 -3.603 0.716 1.00 0.00 H new ATOM 0 HA PHE A 273 6.247 -5.867 0.512 1.00 0.00 H new ATOM 0 HB2 PHE A 273 4.346 -4.625 1.414 1.00 0.00 H new ATOM 0 HB3 PHE A 273 5.554 -5.001 2.627 1.00 0.00 H new ATOM 0 HD1 PHE A 273 7.475 -2.830 2.565 1.00 0.00 H new ATOM 0 HD2 PHE A 273 3.259 -2.692 1.941 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.418 -0.512 3.390 1.00 0.00 H new ATOM 0 HE2 PHE A 273 3.227 -0.369 2.725 1.00 0.00 H new ATOM 0 HZ PHE A 273 5.296 0.717 3.457 1.00 0.00 H new ATOM 492 N ASP A 274 6.308 -4.808 -1.768 1.00 0.00 N ATOM 493 CA ASP A 274 6.063 -4.296 -3.111 1.00 0.00 C ATOM 494 C ASP A 274 4.578 -4.277 -3.466 1.00 0.00 C ATOM 495 O ASP A 274 4.038 -5.253 -3.985 1.00 0.00 O ATOM 496 CB ASP A 274 6.827 -5.133 -4.138 1.00 0.00 C ATOM 497 CG ASP A 274 6.729 -4.561 -5.539 1.00 0.00 C ATOM 498 OD1 ASP A 274 5.597 -4.437 -6.052 1.00 0.00 O ATOM 499 OD2 ASP A 274 7.785 -4.238 -6.123 1.00 0.00 O ATOM 0 H ASP A 274 6.737 -5.733 -1.747 1.00 0.00 H new ATOM 0 HA ASP A 274 6.418 -3.266 -3.131 1.00 0.00 H new ATOM 0 HB2 ASP A 274 7.875 -5.193 -3.846 1.00 0.00 H new ATOM 0 HB3 ASP A 274 6.436 -6.151 -4.136 1.00 0.00 H new ATOM 504 N SER A 275 3.941 -3.141 -3.216 1.00 0.00 N ATOM 505 CA SER A 275 2.530 -2.948 -3.535 1.00 0.00 C ATOM 506 C SER A 275 2.410 -2.360 -4.942 1.00 0.00 C ATOM 507 O SER A 275 3.262 -1.574 -5.357 1.00 0.00 O ATOM 508 CB SER A 275 1.907 -1.963 -2.555 1.00 0.00 C ATOM 509 OG SER A 275 2.339 -0.640 -2.822 1.00 0.00 O ATOM 0 H SER A 275 4.385 -2.329 -2.788 1.00 0.00 H new ATOM 0 HA SER A 275 2.018 -3.908 -3.473 1.00 0.00 H new ATOM 0 HB2 SER A 275 0.820 -2.015 -2.623 1.00 0.00 H new ATOM 0 HB3 SER A 275 2.177 -2.239 -1.536 1.00 0.00 H new ATOM 0 HG SER A 275 3.291 -0.647 -3.052 1.00 0.00 H new ATOM 515 N LYS A 276 1.353 -2.702 -5.661 1.00 0.00 N ATOM 516 CA LYS A 276 1.145 -2.153 -6.999 1.00 0.00 C ATOM 517 C LYS A 276 0.029 -1.116 -6.963 1.00 0.00 C ATOM 518 O LYS A 276 -1.147 -1.459 -6.908 1.00 0.00 O ATOM 519 CB LYS A 276 0.801 -3.251 -7.998 1.00 0.00 C ATOM 520 CG LYS A 276 1.932 -4.242 -8.230 1.00 0.00 C ATOM 521 CD LYS A 276 1.874 -5.398 -7.243 1.00 0.00 C ATOM 522 CE LYS A 276 1.672 -6.729 -7.952 1.00 0.00 C ATOM 523 NZ LYS A 276 2.941 -7.245 -8.534 1.00 0.00 N ATOM 0 H LYS A 276 0.630 -3.350 -5.348 1.00 0.00 H new ATOM 0 HA LYS A 276 2.073 -1.680 -7.322 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.077 -3.791 -7.643 1.00 0.00 H new ATOM 0 HB3 LYS A 276 0.530 -2.793 -8.949 1.00 0.00 H new ATOM 0 HG2 LYS A 276 1.875 -4.628 -9.248 1.00 0.00 H new ATOM 0 HG3 LYS A 276 2.890 -3.730 -8.136 1.00 0.00 H new ATOM 0 HD2 LYS A 276 2.797 -5.430 -6.664 1.00 0.00 H new ATOM 0 HD3 LYS A 276 1.060 -5.234 -6.537 1.00 0.00 H new ATOM 0 HE2 LYS A 276 1.272 -7.459 -7.248 1.00 0.00 H new ATOM 0 HE3 LYS A 276 0.931 -6.611 -8.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 2.761 -8.153 -9.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 3.310 -6.561 -9.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 3.640 -7.382 -7.776 1.00 0.00 H new ATOM 537 N ILE A 277 0.412 0.152 -6.966 1.00 0.00 N ATOM 538 CA ILE A 277 -0.543 1.245 -6.898 1.00 0.00 C ATOM 539 C ILE A 277 -1.115 1.617 -8.261 1.00 0.00 C ATOM 540 O ILE A 277 -0.549 1.290 -9.304 1.00 0.00 O ATOM 541 CB ILE A 277 0.104 2.491 -6.262 1.00 0.00 C ATOM 542 CG1 ILE A 277 1.015 3.214 -7.264 1.00 0.00 C ATOM 543 CG2 ILE A 277 0.883 2.098 -5.015 1.00 0.00 C ATOM 544 CD1 ILE A 277 1.616 4.496 -6.724 1.00 0.00 C ATOM 0 H ILE A 277 1.386 0.450 -7.015 1.00 0.00 H new ATOM 0 HA ILE A 277 -1.367 0.892 -6.278 1.00 0.00 H new ATOM 0 HB ILE A 277 -0.690 3.181 -5.977 1.00 0.00 H new ATOM 0 HG12 ILE A 277 1.820 2.542 -7.560 1.00 0.00 H new ATOM 0 HG13 ILE A 277 0.443 3.442 -8.163 1.00 0.00 H new ATOM 0 HG21 ILE A 277 1.336 2.986 -4.574 1.00 0.00 H new ATOM 0 HG22 ILE A 277 0.207 1.639 -4.293 1.00 0.00 H new ATOM 0 HG23 ILE A 277 1.665 1.387 -5.283 1.00 0.00 H new ATOM 0 HD11 ILE A 277 2.247 4.951 -7.487 1.00 0.00 H new ATOM 0 HD12 ILE A 277 0.817 5.187 -6.454 1.00 0.00 H new ATOM 0 HD13 ILE A 277 2.216 4.273 -5.842 1.00 0.00 H new ATOM 556 N THR A 278 -2.239 2.323 -8.222 1.00 0.00 N ATOM 557 CA THR A 278 -2.918 2.784 -9.425 1.00 0.00 C ATOM 558 C THR A 278 -3.972 3.826 -9.067 1.00 0.00 C ATOM 559 O THR A 278 -4.938 3.530 -8.365 1.00 0.00 O ATOM 560 CB THR A 278 -3.579 1.618 -10.160 1.00 0.00 C ATOM 561 OG1 THR A 278 -4.221 0.747 -9.246 1.00 0.00 O ATOM 562 CG2 THR A 278 -2.611 0.795 -10.980 1.00 0.00 C ATOM 0 H THR A 278 -2.705 2.591 -7.355 1.00 0.00 H new ATOM 0 HA THR A 278 -2.173 3.233 -10.082 1.00 0.00 H new ATOM 0 HB THR A 278 -4.298 2.078 -10.838 1.00 0.00 H new ATOM 0 HG1 THR A 278 -4.702 1.274 -8.575 1.00 0.00 H new ATOM 0 HG21 THR A 278 -3.149 -0.014 -11.474 1.00 0.00 H new ATOM 0 HG22 THR A 278 -2.140 1.429 -11.731 1.00 0.00 H new ATOM 0 HG23 THR A 278 -1.845 0.376 -10.327 1.00 0.00 H new ATOM 570 N THR A 279 -3.779 5.047 -9.552 1.00 0.00 N ATOM 571 CA THR A 279 -4.717 6.133 -9.279 1.00 0.00 C ATOM 572 C THR A 279 -6.111 5.772 -9.789 1.00 0.00 C ATOM 573 O THR A 279 -6.246 5.050 -10.776 1.00 0.00 O ATOM 574 CB THR A 279 -4.236 7.429 -9.940 1.00 0.00 C ATOM 575 OG1 THR A 279 -2.929 7.273 -10.466 1.00 0.00 O ATOM 576 CG2 THR A 279 -4.211 8.608 -8.992 1.00 0.00 C ATOM 0 H THR A 279 -2.984 5.311 -10.135 1.00 0.00 H new ATOM 0 HA THR A 279 -4.766 6.285 -8.201 1.00 0.00 H new ATOM 0 HB THR A 279 -4.956 7.633 -10.732 1.00 0.00 H new ATOM 0 HG1 THR A 279 -2.643 8.112 -10.885 1.00 0.00 H new ATOM 0 HG21 THR A 279 -3.861 9.494 -9.522 1.00 0.00 H new ATOM 0 HG22 THR A 279 -5.215 8.788 -8.608 1.00 0.00 H new ATOM 0 HG23 THR A 279 -3.538 8.393 -8.162 1.00 0.00 H new ATOM 584 N ASN A 280 -7.148 6.271 -9.118 1.00 0.00 N ATOM 585 CA ASN A 280 -8.521 5.981 -9.530 1.00 0.00 C ATOM 586 C ASN A 280 -9.527 6.800 -8.732 1.00 0.00 C ATOM 587 O ASN A 280 -10.431 7.414 -9.298 1.00 0.00 O ATOM 588 CB ASN A 280 -8.817 4.488 -9.374 1.00 0.00 C ATOM 589 CG ASN A 280 -9.610 3.932 -10.541 1.00 0.00 C ATOM 590 OD1 ASN A 280 -10.805 4.197 -10.677 1.00 0.00 O ATOM 591 ND2 ASN A 280 -8.948 3.155 -11.390 1.00 0.00 N ATOM 0 H ASN A 280 -7.066 6.871 -8.297 1.00 0.00 H new ATOM 0 HA ASN A 280 -8.619 6.258 -10.580 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -7.878 3.942 -9.283 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -9.372 4.325 -8.450 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -9.429 2.751 -12.194 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -7.958 2.962 -11.239 1.00 0.00 H new ATOM 598 N ASN A 281 -9.361 6.812 -7.416 1.00 0.00 N ATOM 599 CA ASN A 281 -10.252 7.566 -6.540 1.00 0.00 C ATOM 600 C ASN A 281 -9.883 9.048 -6.533 1.00 0.00 C ATOM 601 O ASN A 281 -10.346 9.809 -5.684 1.00 0.00 O ATOM 602 CB ASN A 281 -10.173 7.015 -5.119 1.00 0.00 C ATOM 603 CG ASN A 281 -11.410 7.333 -4.304 1.00 0.00 C ATOM 604 OD1 ASN A 281 -11.759 8.497 -4.111 1.00 0.00 O ATOM 605 ND2 ASN A 281 -12.082 6.295 -3.820 1.00 0.00 N ATOM 0 H ASN A 281 -8.618 6.309 -6.931 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.269 7.462 -6.917 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -10.036 5.934 -5.159 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -9.297 7.429 -4.620 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -12.923 6.447 -3.264 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -11.757 5.346 -4.005 1.00 0.00 H new ATOM 612 N GLY A 282 -9.031 9.445 -7.472 1.00 0.00 N ATOM 613 CA GLY A 282 -8.591 10.822 -7.548 1.00 0.00 C ATOM 614 C GLY A 282 -7.131 10.944 -7.179 1.00 0.00 C ATOM 615 O GLY A 282 -6.414 11.804 -7.695 1.00 0.00 O ATOM 0 H GLY A 282 -8.636 8.832 -8.185 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.748 11.203 -8.557 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -9.192 11.437 -6.878 1.00 0.00 H new ATOM 619 N TRP A 283 -6.693 10.068 -6.282 1.00 0.00 N ATOM 620 CA TRP A 283 -5.321 10.047 -5.828 1.00 0.00 C ATOM 621 C TRP A 283 -4.726 8.657 -5.977 1.00 0.00 C ATOM 622 O TRP A 283 -5.437 7.682 -6.219 1.00 0.00 O ATOM 623 CB TRP A 283 -5.247 10.506 -4.378 1.00 0.00 C ATOM 624 CG TRP A 283 -6.250 9.860 -3.470 1.00 0.00 C ATOM 625 CD1 TRP A 283 -6.708 8.577 -3.525 1.00 0.00 C ATOM 626 CD2 TRP A 283 -6.910 10.472 -2.357 1.00 0.00 C ATOM 627 NE1 TRP A 283 -7.627 8.359 -2.527 1.00 0.00 N ATOM 628 CE2 TRP A 283 -7.764 9.508 -1.794 1.00 0.00 C ATOM 629 CE3 TRP A 283 -6.864 11.746 -1.786 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -8.565 9.776 -0.686 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -7.656 12.012 -0.686 1.00 0.00 C ATOM 632 CH2 TRP A 283 -8.496 11.031 -0.146 1.00 0.00 C ATOM 0 H TRP A 283 -7.284 9.356 -5.854 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.739 10.732 -6.445 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -4.246 10.303 -3.996 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.388 11.586 -4.344 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -6.394 7.839 -4.248 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -8.125 7.485 -2.359 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -6.221 12.510 -2.197 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -9.216 9.022 -0.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -7.627 12.993 -0.235 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -9.102 11.270 0.715 1.00 0.00 H new ATOM 643 N ASN A 284 -3.413 8.584 -5.844 1.00 0.00 N ATOM 644 CA ASN A 284 -2.698 7.319 -5.976 1.00 0.00 C ATOM 645 C ASN A 284 -3.252 6.267 -5.020 1.00 0.00 C ATOM 646 O ASN A 284 -3.158 6.406 -3.803 1.00 0.00 O ATOM 647 CB ASN A 284 -1.197 7.532 -5.729 1.00 0.00 C ATOM 648 CG ASN A 284 -0.383 7.354 -6.997 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.485 6.331 -7.673 1.00 0.00 O ATOM 650 ND2 ASN A 284 0.425 8.355 -7.329 1.00 0.00 N ATOM 0 H ASN A 284 -2.816 9.386 -5.644 1.00 0.00 H new ATOM 0 HA ASN A 284 -2.842 6.953 -6.993 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -1.033 8.533 -5.330 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -0.850 6.827 -4.973 1.00 0.00 H new ATOM 0 HD21 ASN A 284 0.992 8.293 -8.174 1.00 0.00 H new ATOM 0 HD22 ASN A 284 0.478 9.185 -6.739 1.00 0.00 H new ATOM 657 N ARG A 285 -3.827 5.212 -5.589 1.00 0.00 N ATOM 658 CA ARG A 285 -4.394 4.127 -4.797 1.00 0.00 C ATOM 659 C ARG A 285 -3.409 2.963 -4.711 1.00 0.00 C ATOM 660 O ARG A 285 -2.878 2.521 -5.729 1.00 0.00 O ATOM 661 CB ARG A 285 -5.709 3.648 -5.418 1.00 0.00 C ATOM 662 CG ARG A 285 -6.597 2.884 -4.449 1.00 0.00 C ATOM 663 CD ARG A 285 -7.451 1.849 -5.167 1.00 0.00 C ATOM 664 NE ARG A 285 -8.877 2.044 -4.912 1.00 0.00 N ATOM 665 CZ ARG A 285 -9.842 1.535 -5.674 1.00 0.00 C ATOM 666 NH1 ARG A 285 -9.541 0.797 -6.735 1.00 0.00 N ATOM 667 NH2 ARG A 285 -11.114 1.762 -5.373 1.00 0.00 N ATOM 0 H ARG A 285 -3.912 5.086 -6.598 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.591 4.500 -3.792 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -6.257 4.510 -5.797 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -5.486 3.010 -6.273 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -5.978 2.389 -3.700 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -7.242 3.583 -3.918 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -7.263 1.905 -6.239 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -7.158 0.850 -4.844 1.00 0.00 H new ATOM 0 HE ARG A 285 -9.148 2.603 -4.103 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -8.565 0.617 -6.971 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -10.286 0.410 -7.315 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -11.352 2.327 -4.558 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -11.854 1.372 -5.957 1.00 0.00 H new ATOM 681 N VAL A 286 -3.163 2.462 -3.502 1.00 0.00 N ATOM 682 CA VAL A 286 -2.235 1.347 -3.328 1.00 0.00 C ATOM 683 C VAL A 286 -2.978 0.031 -3.139 1.00 0.00 C ATOM 684 O VAL A 286 -4.120 -0.011 -2.687 1.00 0.00 O ATOM 685 CB VAL A 286 -1.263 1.559 -2.138 1.00 0.00 C ATOM 686 CG1 VAL A 286 -0.369 0.344 -1.906 1.00 0.00 C ATOM 687 CG2 VAL A 286 -0.410 2.803 -2.346 1.00 0.00 C ATOM 0 H VAL A 286 -3.587 2.805 -2.640 1.00 0.00 H new ATOM 0 HA VAL A 286 -1.646 1.305 -4.244 1.00 0.00 H new ATOM 0 HB VAL A 286 -1.878 1.696 -1.248 1.00 0.00 H new ATOM 0 HG11 VAL A 286 0.295 0.537 -1.064 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -0.988 -0.527 -1.689 1.00 0.00 H new ATOM 0 HG13 VAL A 286 0.225 0.153 -2.800 1.00 0.00 H new ATOM 0 HG21 VAL A 286 0.263 2.929 -1.498 1.00 0.00 H new ATOM 0 HG22 VAL A 286 0.174 2.695 -3.260 1.00 0.00 H new ATOM 0 HG23 VAL A 286 -1.056 3.677 -2.430 1.00 0.00 H new ATOM 697 N VAL A 287 -2.280 -1.029 -3.489 1.00 0.00 N ATOM 698 CA VAL A 287 -2.764 -2.404 -3.396 1.00 0.00 C ATOM 699 C VAL A 287 -1.570 -3.325 -3.620 1.00 0.00 C ATOM 700 O VAL A 287 -0.709 -3.011 -4.436 1.00 0.00 O ATOM 701 CB VAL A 287 -3.831 -2.743 -4.467 1.00 0.00 C ATOM 702 CG1 VAL A 287 -5.221 -2.291 -4.050 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.460 -2.146 -5.814 1.00 0.00 C ATOM 0 H VAL A 287 -1.331 -0.963 -3.858 1.00 0.00 H new ATOM 0 HA VAL A 287 -3.226 -2.533 -2.417 1.00 0.00 H new ATOM 0 HB VAL A 287 -3.853 -3.829 -4.561 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -5.937 -2.549 -4.830 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -5.502 -2.788 -3.121 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -5.222 -1.212 -3.899 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -4.226 -2.399 -6.547 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -3.388 -1.062 -5.724 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -2.500 -2.548 -6.138 1.00 0.00 H new ATOM 713 N ILE A 288 -1.503 -4.451 -2.927 1.00 0.00 N ATOM 714 CA ILE A 288 -0.377 -5.367 -3.121 1.00 0.00 C ATOM 715 C ILE A 288 -0.870 -6.732 -3.551 1.00 0.00 C ATOM 716 O ILE A 288 -0.799 -7.700 -2.793 1.00 0.00 O ATOM 717 CB ILE A 288 0.507 -5.528 -1.862 1.00 0.00 C ATOM 718 CG1 ILE A 288 0.386 -4.324 -0.926 1.00 0.00 C ATOM 719 CG2 ILE A 288 1.955 -5.764 -2.253 1.00 0.00 C ATOM 720 CD1 ILE A 288 0.997 -4.559 0.437 1.00 0.00 C ATOM 0 H ILE A 288 -2.194 -4.753 -2.240 1.00 0.00 H new ATOM 0 HA ILE A 288 0.239 -4.919 -3.901 1.00 0.00 H new ATOM 0 HB ILE A 288 0.147 -6.401 -1.317 1.00 0.00 H new ATOM 0 HG12 ILE A 288 0.869 -3.463 -1.389 1.00 0.00 H new ATOM 0 HG13 ILE A 288 -0.667 -4.072 -0.805 1.00 0.00 H new ATOM 0 HG21 ILE A 288 2.561 -5.875 -1.354 1.00 0.00 H new ATOM 0 HG22 ILE A 288 2.027 -6.671 -2.853 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.318 -4.916 -2.833 1.00 0.00 H new ATOM 0 HD11 ILE A 288 0.876 -3.665 1.049 1.00 0.00 H new ATOM 0 HD12 ILE A 288 0.498 -5.400 0.919 1.00 0.00 H new ATOM 0 HD13 ILE A 288 2.058 -4.782 0.326 1.00 0.00 H new ATOM 732 N GLY A 289 -1.374 -6.793 -4.779 1.00 0.00 N ATOM 733 CA GLY A 289 -1.894 -8.038 -5.323 1.00 0.00 C ATOM 734 C GLY A 289 -2.507 -8.913 -4.247 1.00 0.00 C ATOM 735 O GLY A 289 -3.055 -8.399 -3.274 1.00 0.00 O ATOM 0 H GLY A 289 -1.433 -5.996 -5.413 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -2.644 -7.817 -6.082 1.00 0.00 H new ATOM 0 HA3 GLY A 289 -1.090 -8.582 -5.818 1.00 0.00 H new ATOM 739 N PRO A 290 -2.417 -10.241 -4.375 1.00 0.00 N ATOM 740 CA PRO A 290 -2.952 -11.155 -3.385 1.00 0.00 C ATOM 741 C PRO A 290 -1.901 -11.504 -2.335 1.00 0.00 C ATOM 742 O PRO A 290 -0.993 -12.295 -2.592 1.00 0.00 O ATOM 743 CB PRO A 290 -3.303 -12.373 -4.229 1.00 0.00 C ATOM 744 CG PRO A 290 -2.274 -12.389 -5.317 1.00 0.00 C ATOM 745 CD PRO A 290 -1.777 -10.967 -5.485 1.00 0.00 C ATOM 0 HA PRO A 290 -3.795 -10.749 -2.826 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -3.269 -13.288 -3.638 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.311 -12.295 -4.638 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -1.451 -13.056 -5.059 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -2.704 -12.759 -6.248 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -0.690 -10.913 -5.425 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -2.064 -10.554 -6.452 1.00 0.00 H new ATOM 753 N VAL A 291 -2.023 -10.903 -1.159 1.00 0.00 N ATOM 754 CA VAL A 291 -1.073 -11.147 -0.075 1.00 0.00 C ATOM 755 C VAL A 291 -1.495 -12.359 0.750 1.00 0.00 C ATOM 756 O VAL A 291 -2.464 -13.038 0.416 1.00 0.00 O ATOM 757 CB VAL A 291 -0.898 -9.916 0.858 1.00 0.00 C ATOM 758 CG1 VAL A 291 0.456 -9.258 0.634 1.00 0.00 C ATOM 759 CG2 VAL A 291 -2.013 -8.897 0.663 1.00 0.00 C ATOM 0 H VAL A 291 -2.767 -10.244 -0.929 1.00 0.00 H new ATOM 0 HA VAL A 291 -0.110 -11.341 -0.548 1.00 0.00 H new ATOM 0 HB VAL A 291 -0.951 -10.279 1.884 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.557 -8.399 1.297 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.249 -9.975 0.846 1.00 0.00 H new ATOM 0 HG13 VAL A 291 0.533 -8.928 -0.402 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -1.855 -8.052 1.333 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -2.010 -8.547 -0.369 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -2.974 -9.362 0.886 1.00 0.00 H new ATOM 769 N LYS A 292 -0.758 -12.633 1.824 1.00 0.00 N ATOM 770 CA LYS A 292 -1.062 -13.775 2.682 1.00 0.00 C ATOM 771 C LYS A 292 -1.312 -13.336 4.119 1.00 0.00 C ATOM 772 O LYS A 292 -0.611 -12.474 4.649 1.00 0.00 O ATOM 773 CB LYS A 292 0.081 -14.790 2.637 1.00 0.00 C ATOM 774 CG LYS A 292 1.429 -14.206 3.026 1.00 0.00 C ATOM 775 CD LYS A 292 2.548 -15.217 2.842 1.00 0.00 C ATOM 776 CE LYS A 292 2.948 -15.345 1.381 1.00 0.00 C ATOM 777 NZ LYS A 292 4.425 -15.461 1.217 1.00 0.00 N ATOM 0 H LYS A 292 0.049 -12.084 2.119 1.00 0.00 H new ATOM 0 HA LYS A 292 -1.972 -14.242 2.307 1.00 0.00 H new ATOM 0 HB2 LYS A 292 -0.153 -15.618 3.306 1.00 0.00 H new ATOM 0 HB3 LYS A 292 0.150 -15.203 1.630 1.00 0.00 H new ATOM 0 HG2 LYS A 292 1.632 -13.323 2.421 1.00 0.00 H new ATOM 0 HG3 LYS A 292 1.399 -13.880 4.066 1.00 0.00 H new ATOM 0 HD2 LYS A 292 3.413 -14.915 3.432 1.00 0.00 H new ATOM 0 HD3 LYS A 292 2.228 -16.188 3.219 1.00 0.00 H new ATOM 0 HE2 LYS A 292 2.465 -16.221 0.948 1.00 0.00 H new ATOM 0 HE3 LYS A 292 2.589 -14.477 0.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 4.656 -15.546 0.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 4.885 -14.614 1.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 4.765 -16.304 1.722 1.00 0.00 H new ATOM 791 N GLY A 293 -2.320 -13.938 4.744 1.00 0.00 N ATOM 792 CA GLY A 293 -2.654 -13.601 6.117 1.00 0.00 C ATOM 793 C GLY A 293 -1.773 -14.316 7.118 1.00 0.00 C ATOM 794 O GLY A 293 -1.756 -15.546 7.175 1.00 0.00 O ATOM 0 H GLY A 293 -2.912 -14.654 4.324 1.00 0.00 H new ATOM 0 HA2 GLY A 293 -2.559 -12.524 6.257 1.00 0.00 H new ATOM 0 HA3 GLY A 293 -3.696 -13.856 6.307 1.00 0.00 H new ATOM 798 N LYS A 294 -1.038 -13.545 7.910 1.00 0.00 N ATOM 799 CA LYS A 294 -0.146 -14.109 8.918 1.00 0.00 C ATOM 800 C LYS A 294 0.633 -13.011 9.633 1.00 0.00 C ATOM 801 O LYS A 294 0.711 -12.991 10.861 1.00 0.00 O ATOM 802 CB LYS A 294 0.826 -15.104 8.275 1.00 0.00 C ATOM 803 CG LYS A 294 0.430 -16.558 8.474 1.00 0.00 C ATOM 804 CD LYS A 294 1.639 -17.433 8.766 1.00 0.00 C ATOM 805 CE LYS A 294 1.404 -18.872 8.334 1.00 0.00 C ATOM 806 NZ LYS A 294 1.966 -19.844 9.312 1.00 0.00 N ATOM 0 H LYS A 294 -1.042 -12.526 7.874 1.00 0.00 H new ATOM 0 HA LYS A 294 -0.758 -14.633 9.652 1.00 0.00 H new ATOM 0 HB2 LYS A 294 0.891 -14.897 7.207 1.00 0.00 H new ATOM 0 HB3 LYS A 294 1.821 -14.947 8.691 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -0.281 -16.633 9.297 1.00 0.00 H new ATOM 0 HG3 LYS A 294 -0.077 -16.923 7.581 1.00 0.00 H new ATOM 0 HD2 LYS A 294 2.511 -17.034 8.248 1.00 0.00 H new ATOM 0 HD3 LYS A 294 1.861 -17.404 9.833 1.00 0.00 H new ATOM 0 HE2 LYS A 294 0.334 -19.047 8.222 1.00 0.00 H new ATOM 0 HE3 LYS A 294 1.858 -19.036 7.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 1.785 -20.813 8.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 2.991 -19.694 9.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 1.515 -19.705 10.239 1.00 0.00 H new ATOM 820 N GLU A 295 1.215 -12.100 8.857 1.00 0.00 N ATOM 821 CA GLU A 295 1.991 -11.004 9.425 1.00 0.00 C ATOM 822 C GLU A 295 2.465 -10.022 8.352 1.00 0.00 C ATOM 823 O GLU A 295 2.752 -8.865 8.652 1.00 0.00 O ATOM 824 CB GLU A 295 3.195 -11.560 10.186 1.00 0.00 C ATOM 825 CG GLU A 295 3.477 -10.836 11.492 1.00 0.00 C ATOM 826 CD GLU A 295 2.328 -10.938 12.475 1.00 0.00 C ATOM 827 OE1 GLU A 295 1.415 -10.087 12.412 1.00 0.00 O ATOM 828 OE2 GLU A 295 2.339 -11.868 13.309 1.00 0.00 O ATOM 0 H GLU A 295 1.164 -12.100 7.838 1.00 0.00 H new ATOM 0 HA GLU A 295 1.340 -10.459 10.108 1.00 0.00 H new ATOM 0 HB2 GLU A 295 3.026 -12.616 10.395 1.00 0.00 H new ATOM 0 HB3 GLU A 295 4.077 -11.499 9.549 1.00 0.00 H new ATOM 0 HG2 GLU A 295 4.377 -11.251 11.946 1.00 0.00 H new ATOM 0 HG3 GLU A 295 3.680 -9.785 11.284 1.00 0.00 H new ATOM 835 N ASN A 296 2.554 -10.482 7.107 1.00 0.00 N ATOM 836 CA ASN A 296 3.000 -9.626 6.016 1.00 0.00 C ATOM 837 C ASN A 296 2.027 -8.474 5.801 1.00 0.00 C ATOM 838 O ASN A 296 2.369 -7.312 6.019 1.00 0.00 O ATOM 839 CB ASN A 296 3.149 -10.437 4.726 1.00 0.00 C ATOM 840 CG ASN A 296 4.450 -10.143 4.006 1.00 0.00 C ATOM 841 OD1 ASN A 296 4.642 -9.054 3.466 1.00 0.00 O ATOM 842 ND2 ASN A 296 5.352 -11.117 3.994 1.00 0.00 N ATOM 0 H ASN A 296 2.324 -11.437 6.831 1.00 0.00 H new ATOM 0 HA ASN A 296 3.972 -9.212 6.285 1.00 0.00 H new ATOM 0 HB2 ASN A 296 3.099 -11.500 4.961 1.00 0.00 H new ATOM 0 HB3 ASN A 296 2.312 -10.217 4.063 1.00 0.00 H new ATOM 0 HD21 ASN A 296 6.247 -10.978 3.524 1.00 0.00 H new ATOM 0 HD22 ASN A 296 5.151 -12.004 4.455 1.00 0.00 H new ATOM 849 N ALA A 297 0.810 -8.803 5.377 1.00 0.00 N ATOM 850 CA ALA A 297 -0.216 -7.792 5.139 1.00 0.00 C ATOM 851 C ALA A 297 -0.396 -6.904 6.372 1.00 0.00 C ATOM 852 O ALA A 297 -0.674 -5.712 6.255 1.00 0.00 O ATOM 853 CB ALA A 297 -1.534 -8.456 4.769 1.00 0.00 C ATOM 0 H ALA A 297 0.510 -9.760 5.191 1.00 0.00 H new ATOM 0 HA ALA A 297 0.106 -7.164 4.308 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -2.290 -7.691 4.594 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.401 -9.049 3.864 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -1.856 -9.105 5.584 1.00 0.00 H new ATOM 859 N ASP A 298 -0.223 -7.495 7.555 1.00 0.00 N ATOM 860 CA ASP A 298 -0.350 -6.754 8.808 1.00 0.00 C ATOM 861 C ASP A 298 0.854 -5.846 8.996 1.00 0.00 C ATOM 862 O ASP A 298 0.709 -4.647 9.232 1.00 0.00 O ATOM 863 CB ASP A 298 -0.480 -7.715 9.991 1.00 0.00 C ATOM 864 CG ASP A 298 -1.218 -7.098 11.161 1.00 0.00 C ATOM 865 OD1 ASP A 298 -0.578 -6.368 11.949 1.00 0.00 O ATOM 866 OD2 ASP A 298 -2.436 -7.341 11.291 1.00 0.00 O ATOM 0 H ASP A 298 0.005 -8.482 7.671 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.252 -6.143 8.763 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -1.004 -8.614 9.668 1.00 0.00 H new ATOM 0 HB3 ASP A 298 0.514 -8.024 10.315 1.00 0.00 H new ATOM 871 N SER A 299 2.050 -6.411 8.857 1.00 0.00 N ATOM 872 CA SER A 299 3.269 -5.624 8.979 1.00 0.00 C ATOM 873 C SER A 299 3.227 -4.493 7.963 1.00 0.00 C ATOM 874 O SER A 299 3.780 -3.418 8.185 1.00 0.00 O ATOM 875 CB SER A 299 4.504 -6.498 8.753 1.00 0.00 C ATOM 876 OG SER A 299 4.763 -7.316 9.881 1.00 0.00 O ATOM 0 H SER A 299 2.199 -7.401 8.662 1.00 0.00 H new ATOM 0 HA SER A 299 3.333 -5.212 9.986 1.00 0.00 H new ATOM 0 HB2 SER A 299 4.355 -7.123 7.873 1.00 0.00 H new ATOM 0 HB3 SER A 299 5.369 -5.866 8.552 1.00 0.00 H new ATOM 0 HG SER A 299 4.193 -8.112 9.845 1.00 0.00 H new ATOM 882 N THR A 300 2.533 -4.746 6.852 1.00 0.00 N ATOM 883 CA THR A 300 2.375 -3.754 5.803 1.00 0.00 C ATOM 884 C THR A 300 1.701 -2.510 6.364 1.00 0.00 C ATOM 885 O THR A 300 1.912 -1.405 5.877 1.00 0.00 O ATOM 886 CB THR A 300 1.541 -4.327 4.657 1.00 0.00 C ATOM 887 OG1 THR A 300 2.001 -5.617 4.297 1.00 0.00 O ATOM 888 CG2 THR A 300 1.564 -3.470 3.415 1.00 0.00 C ATOM 0 H THR A 300 2.072 -5.636 6.661 1.00 0.00 H new ATOM 0 HA THR A 300 3.360 -3.485 5.421 1.00 0.00 H new ATOM 0 HB THR A 300 0.519 -4.364 5.035 1.00 0.00 H new ATOM 0 HG1 THR A 300 1.914 -6.221 5.064 1.00 0.00 H new ATOM 0 HG21 THR A 300 0.952 -3.934 2.641 1.00 0.00 H new ATOM 0 HG22 THR A 300 1.167 -2.482 3.647 1.00 0.00 H new ATOM 0 HG23 THR A 300 2.589 -3.374 3.058 1.00 0.00 H new ATOM 896 N LEU A 301 0.896 -2.696 7.403 1.00 0.00 N ATOM 897 CA LEU A 301 0.207 -1.581 8.036 1.00 0.00 C ATOM 898 C LEU A 301 1.223 -0.660 8.690 1.00 0.00 C ATOM 899 O LEU A 301 1.137 0.563 8.578 1.00 0.00 O ATOM 900 CB LEU A 301 -0.803 -2.095 9.068 1.00 0.00 C ATOM 901 CG LEU A 301 -2.230 -1.572 8.902 1.00 0.00 C ATOM 902 CD1 LEU A 301 -3.118 -2.101 10.017 1.00 0.00 C ATOM 903 CD2 LEU A 301 -2.244 -0.048 8.875 1.00 0.00 C ATOM 0 H LEU A 301 0.705 -3.606 7.823 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.340 -1.020 7.278 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -0.825 -3.184 9.020 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -0.449 -1.827 10.063 1.00 0.00 H new ATOM 0 HG LEU A 301 -2.623 -1.930 7.950 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -4.131 -1.721 9.887 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -3.132 -3.190 9.985 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -2.728 -1.771 10.980 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -3.269 0.304 8.756 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -1.834 0.336 9.809 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -1.639 0.307 8.040 1.00 0.00 H new ATOM 915 N ASN A 302 2.204 -1.263 9.345 1.00 0.00 N ATOM 916 CA ASN A 302 3.267 -0.511 9.992 1.00 0.00 C ATOM 917 C ASN A 302 4.317 -0.130 8.959 1.00 0.00 C ATOM 918 O ASN A 302 4.999 0.885 9.090 1.00 0.00 O ATOM 919 CB ASN A 302 3.898 -1.341 11.112 1.00 0.00 C ATOM 920 CG ASN A 302 3.290 -1.039 12.468 1.00 0.00 C ATOM 921 OD1 ASN A 302 2.315 -1.668 12.879 1.00 0.00 O ATOM 922 ND2 ASN A 302 3.865 -0.072 13.173 1.00 0.00 N ATOM 0 H ASN A 302 2.285 -2.275 9.442 1.00 0.00 H new ATOM 0 HA ASN A 302 2.851 0.396 10.431 1.00 0.00 H new ATOM 0 HB2 ASN A 302 3.774 -2.401 10.889 1.00 0.00 H new ATOM 0 HB3 ASN A 302 4.970 -1.146 11.146 1.00 0.00 H new ATOM 0 HD21 ASN A 302 3.500 0.175 14.093 1.00 0.00 H new ATOM 0 HD22 ASN A 302 4.672 0.424 12.795 1.00 0.00 H new ATOM 929 N ARG A 303 4.424 -0.953 7.921 1.00 0.00 N ATOM 930 CA ARG A 303 5.368 -0.709 6.846 1.00 0.00 C ATOM 931 C ARG A 303 4.855 0.405 5.940 1.00 0.00 C ATOM 932 O ARG A 303 5.623 1.262 5.503 1.00 0.00 O ATOM 933 CB ARG A 303 5.596 -1.990 6.039 1.00 0.00 C ATOM 934 CG ARG A 303 7.051 -2.430 5.995 1.00 0.00 C ATOM 935 CD ARG A 303 7.332 -3.542 6.993 1.00 0.00 C ATOM 936 NE ARG A 303 7.790 -4.764 6.337 1.00 0.00 N ATOM 937 CZ ARG A 303 8.095 -5.885 6.989 1.00 0.00 C ATOM 938 NH1 ARG A 303 7.989 -5.943 8.310 1.00 0.00 N ATOM 939 NH2 ARG A 303 8.505 -6.951 6.316 1.00 0.00 N ATOM 0 H ARG A 303 3.864 -1.798 7.805 1.00 0.00 H new ATOM 0 HA ARG A 303 6.319 -0.398 7.278 1.00 0.00 H new ATOM 0 HB2 ARG A 303 4.995 -2.792 6.468 1.00 0.00 H new ATOM 0 HB3 ARG A 303 5.241 -1.836 5.020 1.00 0.00 H new ATOM 0 HG2 ARG A 303 7.298 -2.772 4.990 1.00 0.00 H new ATOM 0 HG3 ARG A 303 7.696 -1.578 6.209 1.00 0.00 H new ATOM 0 HD2 ARG A 303 8.087 -3.208 7.705 1.00 0.00 H new ATOM 0 HD3 ARG A 303 6.428 -3.754 7.564 1.00 0.00 H new ATOM 0 HE ARG A 303 7.882 -4.759 5.321 1.00 0.00 H new ATOM 0 HH11 ARG A 303 7.672 -5.126 8.833 1.00 0.00 H new ATOM 0 HH12 ARG A 303 8.224 -6.804 8.803 1.00 0.00 H new ATOM 0 HH21 ARG A 303 8.587 -6.912 5.300 1.00 0.00 H new ATOM 0 HH22 ARG A 303 8.739 -7.810 6.814 1.00 0.00 H new ATOM 953 N LEU A 304 3.547 0.400 5.677 1.00 0.00 N ATOM 954 CA LEU A 304 2.938 1.424 4.836 1.00 0.00 C ATOM 955 C LEU A 304 3.236 2.801 5.403 1.00 0.00 C ATOM 956 O LEU A 304 3.431 3.762 4.659 1.00 0.00 O ATOM 957 CB LEU A 304 1.430 1.194 4.708 1.00 0.00 C ATOM 958 CG LEU A 304 1.039 0.052 3.763 1.00 0.00 C ATOM 959 CD1 LEU A 304 -0.317 -0.519 4.138 1.00 0.00 C ATOM 960 CD2 LEU A 304 1.048 0.522 2.312 1.00 0.00 C ATOM 0 H LEU A 304 2.895 -0.299 6.033 1.00 0.00 H new ATOM 0 HA LEU A 304 3.367 1.361 3.836 1.00 0.00 H new ATOM 0 HB2 LEU A 304 1.022 0.986 5.697 1.00 0.00 H new ATOM 0 HB3 LEU A 304 0.963 2.115 4.358 1.00 0.00 H new ATOM 0 HG LEU A 304 1.780 -0.741 3.866 1.00 0.00 H new ATOM 0 HD11 LEU A 304 -0.573 -1.328 3.454 1.00 0.00 H new ATOM 0 HD12 LEU A 304 -0.280 -0.904 5.157 1.00 0.00 H new ATOM 0 HD13 LEU A 304 -1.072 0.264 4.073 1.00 0.00 H new ATOM 0 HD21 LEU A 304 0.768 -0.305 1.660 1.00 0.00 H new ATOM 0 HD22 LEU A 304 0.336 1.338 2.190 1.00 0.00 H new ATOM 0 HD23 LEU A 304 2.047 0.869 2.048 1.00 0.00 H new ATOM 972 N LYS A 305 3.319 2.889 6.730 1.00 0.00 N ATOM 973 CA LYS A 305 3.647 4.150 7.372 1.00 0.00 C ATOM 974 C LYS A 305 5.047 4.578 6.941 1.00 0.00 C ATOM 975 O LYS A 305 5.354 5.768 6.869 1.00 0.00 O ATOM 976 CB LYS A 305 3.572 4.018 8.896 1.00 0.00 C ATOM 977 CG LYS A 305 2.715 5.087 9.557 1.00 0.00 C ATOM 978 CD LYS A 305 3.513 6.352 9.827 1.00 0.00 C ATOM 979 CE LYS A 305 2.604 7.564 9.966 1.00 0.00 C ATOM 980 NZ LYS A 305 1.893 7.578 11.275 1.00 0.00 N ATOM 0 H LYS A 305 3.165 2.110 7.370 1.00 0.00 H new ATOM 0 HA LYS A 305 2.925 4.907 7.068 1.00 0.00 H new ATOM 0 HB2 LYS A 305 3.172 3.036 9.148 1.00 0.00 H new ATOM 0 HB3 LYS A 305 4.580 4.067 9.307 1.00 0.00 H new ATOM 0 HG2 LYS A 305 1.865 5.321 8.916 1.00 0.00 H new ATOM 0 HG3 LYS A 305 2.311 4.703 10.494 1.00 0.00 H new ATOM 0 HD2 LYS A 305 4.097 6.227 10.739 1.00 0.00 H new ATOM 0 HD3 LYS A 305 4.221 6.518 9.015 1.00 0.00 H new ATOM 0 HE2 LYS A 305 3.195 8.474 9.864 1.00 0.00 H new ATOM 0 HE3 LYS A 305 1.874 7.565 9.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 1.284 8.419 11.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 1.309 6.722 11.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 2.589 7.603 12.048 1.00 0.00 H new ATOM 994 N MET A 306 5.884 3.586 6.631 1.00 0.00 N ATOM 995 CA MET A 306 7.245 3.837 6.176 1.00 0.00 C ATOM 996 C MET A 306 7.214 4.604 4.861 1.00 0.00 C ATOM 997 O MET A 306 8.084 5.431 4.588 1.00 0.00 O ATOM 998 CB MET A 306 8.001 2.515 5.996 1.00 0.00 C ATOM 999 CG MET A 306 9.510 2.681 5.937 1.00 0.00 C ATOM 1000 SD MET A 306 10.204 3.282 7.488 1.00 0.00 S ATOM 1001 CE MET A 306 10.403 1.747 8.389 1.00 0.00 C ATOM 0 H MET A 306 5.638 2.598 6.689 1.00 0.00 H new ATOM 0 HA MET A 306 7.763 4.433 6.927 1.00 0.00 H new ATOM 0 HB2 MET A 306 7.749 1.847 6.820 1.00 0.00 H new ATOM 0 HB3 MET A 306 7.661 2.033 5.079 1.00 0.00 H new ATOM 0 HG2 MET A 306 9.967 1.724 5.686 1.00 0.00 H new ATOM 0 HG3 MET A 306 9.764 3.376 5.136 1.00 0.00 H new ATOM 0 HE1 MET A 306 10.824 1.954 9.373 1.00 0.00 H new ATOM 0 HE2 MET A 306 9.433 1.264 8.504 1.00 0.00 H new ATOM 0 HE3 MET A 306 11.074 1.087 7.839 1.00 0.00 H new ATOM 1011 N ALA A 307 6.193 4.325 4.057 1.00 0.00 N ATOM 1012 CA ALA A 307 6.023 4.986 2.773 1.00 0.00 C ATOM 1013 C ALA A 307 5.334 6.334 2.953 1.00 0.00 C ATOM 1014 O ALA A 307 5.853 7.370 2.539 1.00 0.00 O ATOM 1015 CB ALA A 307 5.223 4.102 1.829 1.00 0.00 C ATOM 0 H ALA A 307 5.468 3.641 4.276 1.00 0.00 H new ATOM 0 HA ALA A 307 7.007 5.159 2.338 1.00 0.00 H new ATOM 0 HB1 ALA A 307 5.103 4.608 0.871 1.00 0.00 H new ATOM 0 HB2 ALA A 307 5.750 3.160 1.678 1.00 0.00 H new ATOM 0 HB3 ALA A 307 4.242 3.903 2.260 1.00 0.00 H new ATOM 1021 N GLY A 308 4.164 6.311 3.585 1.00 0.00 N ATOM 1022 CA GLY A 308 3.424 7.536 3.823 1.00 0.00 C ATOM 1023 C GLY A 308 2.132 7.611 3.034 1.00 0.00 C ATOM 1024 O GLY A 308 2.033 8.370 2.069 1.00 0.00 O ATOM 0 H GLY A 308 3.716 5.465 3.936 1.00 0.00 H new ATOM 0 HA2 GLY A 308 3.199 7.617 4.886 1.00 0.00 H new ATOM 0 HA3 GLY A 308 4.051 8.389 3.564 1.00 0.00 H new ATOM 1028 N HIS A 309 1.133 6.835 3.448 1.00 0.00 N ATOM 1029 CA HIS A 309 -0.161 6.840 2.768 1.00 0.00 C ATOM 1030 C HIS A 309 -1.236 7.451 3.653 1.00 0.00 C ATOM 1031 O HIS A 309 -1.471 6.983 4.768 1.00 0.00 O ATOM 1032 CB HIS A 309 -0.596 5.426 2.382 1.00 0.00 C ATOM 1033 CG HIS A 309 0.491 4.579 1.806 1.00 0.00 C ATOM 1034 ND1 HIS A 309 0.656 4.419 0.453 1.00 0.00 N ATOM 1035 CD2 HIS A 309 1.457 3.829 2.394 1.00 0.00 C ATOM 1036 CE1 HIS A 309 1.670 3.613 0.225 1.00 0.00 C ATOM 1037 NE2 HIS A 309 2.176 3.240 1.386 1.00 0.00 N ATOM 0 H HIS A 309 1.193 6.200 4.244 1.00 0.00 H new ATOM 0 HA HIS A 309 -0.040 7.438 1.865 1.00 0.00 H new ATOM 0 HB2 HIS A 309 -0.997 4.929 3.265 1.00 0.00 H new ATOM 0 HB3 HIS A 309 -1.408 5.494 1.658 1.00 0.00 H new ATOM 0 HD1 HIS A 309 0.080 4.858 -0.266 1.00 0.00 H new ATOM 0 HD2 HIS A 309 1.627 3.717 3.455 1.00 0.00 H new ATOM 0 HE1 HIS A 309 2.028 3.308 -0.747 1.00 0.00 H new ATOM 1046 N THR A 310 -1.895 8.494 3.158 1.00 0.00 N ATOM 1047 CA THR A 310 -2.949 9.148 3.927 1.00 0.00 C ATOM 1048 C THR A 310 -4.097 8.187 4.301 1.00 0.00 C ATOM 1049 O THR A 310 -5.034 8.596 4.987 1.00 0.00 O ATOM 1050 CB THR A 310 -3.501 10.348 3.149 1.00 0.00 C ATOM 1051 OG1 THR A 310 -4.131 11.265 4.026 1.00 0.00 O ATOM 1052 CG2 THR A 310 -4.507 9.973 2.081 1.00 0.00 C ATOM 0 H THR A 310 -1.721 8.901 2.239 1.00 0.00 H new ATOM 0 HA THR A 310 -2.499 9.487 4.860 1.00 0.00 H new ATOM 0 HB THR A 310 -2.633 10.792 2.661 1.00 0.00 H new ATOM 0 HG1 THR A 310 -4.696 10.776 4.660 1.00 0.00 H new ATOM 0 HG21 THR A 310 -4.852 10.874 1.574 1.00 0.00 H new ATOM 0 HG22 THR A 310 -4.038 9.306 1.357 1.00 0.00 H new ATOM 0 HG23 THR A 310 -5.356 9.468 2.542 1.00 0.00 H new ATOM 1060 N ASN A 311 -4.040 6.919 3.861 1.00 0.00 N ATOM 1061 CA ASN A 311 -5.103 5.963 4.185 1.00 0.00 C ATOM 1062 C ASN A 311 -4.800 4.554 3.660 1.00 0.00 C ATOM 1063 O ASN A 311 -4.956 4.274 2.473 1.00 0.00 O ATOM 1064 CB ASN A 311 -6.438 6.447 3.614 1.00 0.00 C ATOM 1065 CG ASN A 311 -7.611 5.629 4.115 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -8.415 5.129 3.329 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -7.715 5.488 5.432 1.00 0.00 N ATOM 0 H ASN A 311 -3.283 6.541 3.291 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.162 5.905 5.272 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -6.587 7.493 3.882 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -6.403 6.399 2.526 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -8.484 4.948 5.828 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -7.026 5.920 6.047 1.00 0.00 H new ATOM 1074 N CYS A 312 -4.381 3.672 4.565 1.00 0.00 N ATOM 1075 CA CYS A 312 -4.067 2.277 4.219 1.00 0.00 C ATOM 1076 C CYS A 312 -5.143 1.331 4.751 1.00 0.00 C ATOM 1077 O CYS A 312 -5.748 1.603 5.787 1.00 0.00 O ATOM 1078 CB CYS A 312 -2.707 1.868 4.806 1.00 0.00 C ATOM 1079 SG CYS A 312 -1.584 3.243 5.161 1.00 0.00 S ATOM 0 H CYS A 312 -4.249 3.896 5.551 1.00 0.00 H new ATOM 0 HA CYS A 312 -4.030 2.206 3.132 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -2.878 1.311 5.727 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -2.217 1.188 4.109 1.00 0.00 H new ATOM 0 HG CYS A 312 -0.567 2.807 5.843 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.373 0.206 4.060 1.00 0.00 N ATOM 1086 CA ILE A 313 -6.365 -0.757 4.508 1.00 0.00 C ATOM 1087 C ILE A 313 -6.190 -2.078 3.783 1.00 0.00 C ATOM 1088 O ILE A 313 -6.393 -2.167 2.572 1.00 0.00 O ATOM 1089 CB ILE A 313 -7.809 -0.261 4.302 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -7.941 0.522 2.992 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -8.250 0.591 5.484 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -8.943 -0.077 2.029 1.00 0.00 C ATOM 0 H ILE A 313 -4.888 -0.050 3.200 1.00 0.00 H new ATOM 0 HA ILE A 313 -6.203 -0.889 5.578 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.462 -1.132 4.238 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -8.235 1.547 3.219 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -6.966 0.570 2.507 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -9.272 0.934 5.324 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -8.205 -0.003 6.397 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -7.589 1.452 5.578 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -8.985 0.529 1.124 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -8.640 -1.092 1.773 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -9.928 -0.100 2.496 1.00 0.00 H new ATOM 1104 N ARG A 314 -5.811 -3.100 4.531 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.608 -4.418 3.957 1.00 0.00 C ATOM 1106 C ARG A 314 -6.942 -5.026 3.559 1.00 0.00 C ATOM 1107 O ARG A 314 -7.818 -5.230 4.399 1.00 0.00 O ATOM 1108 CB ARG A 314 -4.855 -5.329 4.949 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.387 -5.584 4.588 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.788 -4.491 3.696 1.00 0.00 C ATOM 1111 NE ARG A 314 -3.110 -3.147 4.164 1.00 0.00 N ATOM 1112 CZ ARG A 314 -2.579 -2.597 5.248 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -1.736 -3.290 6.001 1.00 0.00 N ATOM 1114 NH2 ARG A 314 -2.894 -1.353 5.580 1.00 0.00 N ATOM 0 H ARG A 314 -5.638 -3.042 5.535 1.00 0.00 H new ATOM 0 HA ARG A 314 -4.996 -4.322 3.060 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -4.899 -4.880 5.941 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.373 -6.286 5.009 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -2.801 -5.658 5.504 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.306 -6.545 4.079 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -1.705 -4.610 3.660 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -3.157 -4.615 2.678 1.00 0.00 H new ATOM 0 HE ARG A 314 -3.782 -2.599 3.627 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -1.495 -4.248 5.747 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -1.329 -2.865 6.834 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -3.544 -0.820 5.002 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -2.486 -0.929 6.413 1.00 0.00 H new ATOM 1128 N LEU A 315 -7.090 -5.301 2.268 1.00 0.00 N ATOM 1129 CA LEU A 315 -8.318 -5.885 1.748 1.00 0.00 C ATOM 1130 C LEU A 315 -8.168 -7.392 1.645 1.00 0.00 C ATOM 1131 O LEU A 315 -7.336 -7.892 0.893 1.00 0.00 O ATOM 1132 CB LEU A 315 -8.665 -5.307 0.378 1.00 0.00 C ATOM 1133 CG LEU A 315 -10.051 -4.667 0.267 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -11.121 -5.742 0.170 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -10.319 -3.746 1.449 1.00 0.00 C ATOM 0 H LEU A 315 -6.374 -5.128 1.563 1.00 0.00 H new ATOM 0 HA LEU A 315 -9.128 -5.644 2.436 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -7.916 -4.559 0.118 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.591 -6.103 -0.363 1.00 0.00 H new ATOM 0 HG LEU A 315 -10.080 -4.065 -0.641 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -12.102 -5.273 0.092 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -10.941 -6.356 -0.712 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -11.089 -6.369 1.061 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -11.310 -3.303 1.348 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -10.271 -4.319 2.375 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -9.569 -2.956 1.472 1.00 0.00 H new ATOM 1147 N ALA A 316 -8.960 -8.112 2.415 1.00 0.00 N ATOM 1148 CA ALA A 316 -8.891 -9.566 2.423 1.00 0.00 C ATOM 1149 C ALA A 316 -9.766 -10.186 1.342 1.00 0.00 C ATOM 1150 O ALA A 316 -10.831 -9.666 1.010 1.00 0.00 O ATOM 1151 CB ALA A 316 -9.267 -10.100 3.793 1.00 0.00 C ATOM 0 H ALA A 316 -9.659 -7.717 3.044 1.00 0.00 H new ATOM 0 HA ALA A 316 -7.862 -9.850 2.201 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -9.212 -11.189 3.787 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -8.577 -9.706 4.539 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -10.283 -9.790 4.038 1.00 0.00 H new ATOM 1157 N ALA A 317 -9.300 -11.307 0.800 1.00 0.00 N ATOM 1158 CA ALA A 317 -10.022 -12.017 -0.245 1.00 0.00 C ATOM 1159 C ALA A 317 -11.171 -12.833 0.341 1.00 0.00 C ATOM 1160 O ALA A 317 -11.533 -12.665 1.505 1.00 0.00 O ATOM 1161 CB ALA A 317 -9.065 -12.916 -1.017 1.00 0.00 C ATOM 0 H ALA A 317 -8.419 -11.744 1.071 1.00 0.00 H new ATOM 0 HA ALA A 317 -10.449 -11.284 -0.930 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.612 -13.444 -1.798 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -8.281 -12.309 -1.470 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.616 -13.639 -0.336 1.00 0.00 H new