USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=13 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 154:sc= -0.616 (180deg=-1.92!) USER MOD Single : A 251 GLN : amide:sc= -0.0518 X(o=-0.052,f=0) USER MOD Single : A 252 CYS SG : rot 58:sc= -7.91! USER MOD Single : A 254 SER OG : rot 96:sc= -0.221! 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= -0.0597 K(o=-0.06,f=-0.98) USER MOD Single : A 275 SER OG : rot 98:sc= -6.88! USER MOD Single : A 276 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0614) USER MOD Single : A 278 THR OG1 : rot 180:sc= 0 USER MOD Single : A 279 THR OG1 : rot 180:sc= 0 USER MOD Single : A 280 ASN : amide:sc= -0.334 X(o=-0.33,f=0) USER MOD Single : A 281 ASN : amide:sc= -0.491 X(o=-0.49,f=-0.32) USER MOD Single : A 284 ASN : amide:sc= -3.15 K(o=-3.1,f=-12!) 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 88:sc= 0.01 USER MOD Single : A 300 THR OG1 : rot 78:sc= 0.447 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= -24.6! C(o=-25!,f=-25!) USER MOD Single : A 310 THR OG1 : rot 180:sc= 0 USER MOD Single : A 311 ASN : amide:sc= -0.53 X(o=-0.53,f=-0.5) USER MOD Single : A 312 CYS SG : rot -5:sc= -5.84! USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -6.172 -15.638 2.839 1.00 0.00 N ATOM 76 CA ARG A 247 -5.270 -14.790 2.065 1.00 0.00 C ATOM 77 C ARG A 247 -5.782 -13.372 1.995 1.00 0.00 C ATOM 78 O ARG A 247 -6.851 -13.047 2.512 1.00 0.00 O ATOM 79 CB ARG A 247 -5.058 -15.346 0.650 1.00 0.00 C ATOM 80 CG ARG A 247 -6.055 -16.424 0.250 1.00 0.00 C ATOM 81 CD ARG A 247 -5.659 -17.088 -1.059 1.00 0.00 C ATOM 82 NE ARG A 247 -4.265 -17.526 -1.052 1.00 0.00 N ATOM 83 CZ ARG A 247 -3.583 -17.848 -2.149 1.00 0.00 C ATOM 84 NH1 ARG A 247 -4.162 -17.785 -3.341 1.00 0.00 N ATOM 85 NH2 ARG A 247 -2.318 -18.235 -2.053 1.00 0.00 N ATOM 0 HA ARG A 247 -4.309 -14.786 2.579 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -5.121 -14.525 -0.064 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -4.050 -15.754 0.579 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -6.116 -17.176 1.037 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -7.048 -15.985 0.151 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -6.307 -17.945 -1.241 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -5.815 -16.390 -1.881 1.00 0.00 H new ATOM 0 HE ARG A 247 -3.786 -17.589 -0.154 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -5.135 -17.489 -3.420 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -3.634 -18.033 -4.178 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -1.868 -18.286 -1.139 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -1.795 -18.482 -2.893 1.00 0.00 H new ATOM 99 N TRP A 248 -4.975 -12.526 1.391 1.00 0.00 N ATOM 100 CA TRP A 248 -5.288 -11.118 1.287 1.00 0.00 C ATOM 101 C TRP A 248 -5.158 -10.565 -0.123 1.00 0.00 C ATOM 102 O TRP A 248 -4.750 -11.246 -1.062 1.00 0.00 O ATOM 103 CB TRP A 248 -4.348 -10.347 2.194 1.00 0.00 C ATOM 104 CG TRP A 248 -4.765 -10.287 3.622 1.00 0.00 C ATOM 105 CD1 TRP A 248 -4.248 -11.011 4.650 1.00 0.00 C ATOM 106 CD2 TRP A 248 -5.772 -9.449 4.178 1.00 0.00 C ATOM 107 NE1 TRP A 248 -4.846 -10.638 5.832 1.00 0.00 N ATOM 108 CE2 TRP A 248 -5.795 -9.679 5.561 1.00 0.00 C ATOM 109 CE3 TRP A 248 -6.648 -8.517 3.635 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -6.666 -8.997 6.409 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -7.516 -7.850 4.470 1.00 0.00 C ATOM 112 CH2 TRP A 248 -7.517 -8.087 5.846 1.00 0.00 C ATOM 0 H TRP A 248 -4.089 -12.793 0.961 1.00 0.00 H new ATOM 0 HA TRP A 248 -6.332 -11.003 1.579 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -3.359 -10.801 2.138 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -4.254 -9.329 1.815 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -3.482 -11.766 4.553 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -4.623 -11.010 6.755 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -6.648 -8.319 2.573 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -6.669 -9.181 7.473 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -8.207 -7.132 4.054 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -8.203 -7.541 6.477 1.00 0.00 H new ATOM 123 N MET A 249 -5.499 -9.291 -0.206 1.00 0.00 N ATOM 124 CA MET A 249 -5.441 -8.490 -1.422 1.00 0.00 C ATOM 125 C MET A 249 -5.530 -7.037 -0.986 1.00 0.00 C ATOM 126 O MET A 249 -6.535 -6.354 -1.188 1.00 0.00 O ATOM 127 CB MET A 249 -6.587 -8.810 -2.356 1.00 0.00 C ATOM 128 CG MET A 249 -6.436 -10.129 -3.094 1.00 0.00 C ATOM 129 SD MET A 249 -7.608 -10.301 -4.455 1.00 0.00 S ATOM 130 CE MET A 249 -7.323 -8.773 -5.347 1.00 0.00 C ATOM 0 H MET A 249 -5.837 -8.764 0.600 1.00 0.00 H new ATOM 0 HA MET A 249 -4.519 -8.700 -1.965 1.00 0.00 H new ATOM 0 HB2 MET A 249 -7.514 -8.831 -1.783 1.00 0.00 H new ATOM 0 HB3 MET A 249 -6.682 -8.006 -3.086 1.00 0.00 H new ATOM 0 HG2 MET A 249 -5.420 -10.210 -3.482 1.00 0.00 H new ATOM 0 HG3 MET A 249 -6.576 -10.952 -2.393 1.00 0.00 H new ATOM 0 HE1 MET A 249 -7.588 -8.909 -6.396 1.00 0.00 H new ATOM 0 HE2 MET A 249 -7.937 -7.981 -4.917 1.00 0.00 H new ATOM 0 HE3 MET A 249 -6.271 -8.498 -5.271 1.00 0.00 H new ATOM 140 N VAL A 250 -4.489 -6.630 -0.306 1.00 0.00 N ATOM 141 CA VAL A 250 -4.387 -5.308 0.299 1.00 0.00 C ATOM 142 C VAL A 250 -4.786 -4.152 -0.606 1.00 0.00 C ATOM 143 O VAL A 250 -4.694 -4.221 -1.831 1.00 0.00 O ATOM 144 CB VAL A 250 -2.968 -5.039 0.818 1.00 0.00 C ATOM 145 CG1 VAL A 250 -2.917 -3.686 1.511 1.00 0.00 C ATOM 146 CG2 VAL A 250 -2.518 -6.151 1.755 1.00 0.00 C ATOM 0 H VAL A 250 -3.667 -7.213 -0.149 1.00 0.00 H new ATOM 0 HA VAL A 250 -5.108 -5.342 1.116 1.00 0.00 H new ATOM 0 HB VAL A 250 -2.281 -5.020 -0.028 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -1.907 -3.502 1.877 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -3.195 -2.904 0.804 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -3.613 -3.680 2.350 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -1.510 -5.941 2.111 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -3.199 -6.209 2.605 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -2.523 -7.101 1.221 1.00 0.00 H new ATOM 156 N GLN A 251 -5.186 -3.066 0.056 1.00 0.00 N ATOM 157 CA GLN A 251 -5.562 -1.830 -0.592 1.00 0.00 C ATOM 158 C GLN A 251 -5.099 -0.710 0.309 1.00 0.00 C ATOM 159 O GLN A 251 -5.885 0.076 0.837 1.00 0.00 O ATOM 160 CB GLN A 251 -7.066 -1.775 -0.806 1.00 0.00 C ATOM 161 CG GLN A 251 -7.500 -0.789 -1.878 1.00 0.00 C ATOM 162 CD GLN A 251 -9.007 -0.716 -2.027 1.00 0.00 C ATOM 163 OE1 GLN A 251 -9.570 -1.211 -3.003 1.00 0.00 O ATOM 164 NE2 GLN A 251 -9.670 -0.095 -1.057 1.00 0.00 N ATOM 0 H GLN A 251 -5.256 -3.030 1.073 1.00 0.00 H new ATOM 0 HA GLN A 251 -5.102 -1.746 -1.577 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -7.421 -2.770 -1.076 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -7.547 -1.509 0.135 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -7.114 0.201 -1.634 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -7.058 -1.077 -2.832 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -9.163 0.301 -0.265 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -10.686 -0.015 -1.104 1.00 0.00 H new ATOM 173 N CYS A 252 -3.796 -0.706 0.510 1.00 0.00 N ATOM 174 CA CYS A 252 -3.140 0.242 1.389 1.00 0.00 C ATOM 175 C CYS A 252 -2.677 1.483 0.649 1.00 0.00 C ATOM 176 O CYS A 252 -1.481 1.773 0.597 1.00 0.00 O ATOM 177 CB CYS A 252 -1.951 -0.435 2.069 1.00 0.00 C ATOM 178 SG CYS A 252 -0.846 -1.307 0.928 1.00 0.00 S ATOM 0 H CYS A 252 -3.158 -1.365 0.065 1.00 0.00 H new ATOM 0 HA CYS A 252 -3.866 0.563 2.136 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -1.377 0.318 2.609 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -2.324 -1.143 2.809 1.00 0.00 H new ATOM 0 HG CYS A 252 -0.394 -0.473 0.039 1.00 0.00 H new ATOM 184 N GLY A 253 -3.621 2.225 0.079 1.00 0.00 N ATOM 185 CA GLY A 253 -3.247 3.421 -0.638 1.00 0.00 C ATOM 186 C GLY A 253 -4.374 4.416 -0.813 1.00 0.00 C ATOM 187 O GLY A 253 -5.316 4.453 -0.021 1.00 0.00 O ATOM 0 H GLY A 253 -4.620 2.021 0.101 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -2.427 3.907 -0.109 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -2.870 3.139 -1.621 1.00 0.00 H new ATOM 191 N SER A 254 -4.258 5.234 -1.859 1.00 0.00 N ATOM 192 CA SER A 254 -5.246 6.264 -2.170 1.00 0.00 C ATOM 193 C SER A 254 -5.016 7.483 -1.289 1.00 0.00 C ATOM 194 O SER A 254 -5.774 7.747 -0.356 1.00 0.00 O ATOM 195 CB SER A 254 -6.673 5.726 -1.994 1.00 0.00 C ATOM 196 OG SER A 254 -6.703 4.311 -2.066 1.00 0.00 O ATOM 0 H SER A 254 -3.476 5.200 -2.514 1.00 0.00 H new ATOM 0 HA SER A 254 -5.129 6.557 -3.213 1.00 0.00 H new ATOM 0 HB2 SER A 254 -7.071 6.052 -1.033 1.00 0.00 H new ATOM 0 HB3 SER A 254 -7.320 6.145 -2.765 1.00 0.00 H new ATOM 0 HG SER A 254 -6.673 3.937 -1.161 1.00 0.00 H new ATOM 202 N PHE A 255 -3.937 8.207 -1.581 1.00 0.00 N ATOM 203 CA PHE A 255 -3.567 9.386 -0.801 1.00 0.00 C ATOM 204 C PHE A 255 -3.491 10.642 -1.663 1.00 0.00 C ATOM 205 O PHE A 255 -2.848 10.650 -2.713 1.00 0.00 O ATOM 206 CB PHE A 255 -2.217 9.172 -0.071 1.00 0.00 C ATOM 207 CG PHE A 255 -1.380 8.017 -0.586 1.00 0.00 C ATOM 208 CD1 PHE A 255 -1.933 6.755 -0.734 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.032 8.185 -0.911 1.00 0.00 C ATOM 210 CE1 PHE A 255 -1.180 5.698 -1.199 1.00 0.00 C ATOM 211 CE2 PHE A 255 0.716 7.117 -1.372 1.00 0.00 C ATOM 212 CZ PHE A 255 0.139 5.881 -1.520 1.00 0.00 C ATOM 0 H PHE A 255 -3.304 7.998 -2.352 1.00 0.00 H new ATOM 0 HA PHE A 255 -4.354 9.529 -0.061 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.631 10.088 -0.149 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -2.417 9.011 0.988 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -2.971 6.597 -0.481 1.00 0.00 H new ATOM 0 HD2 PHE A 255 0.429 9.155 -0.802 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -1.631 4.723 -1.310 1.00 0.00 H new ATOM 0 HE2 PHE A 255 1.759 7.256 -1.617 1.00 0.00 H new ATOM 0 HZ PHE A 255 0.725 5.052 -1.890 1.00 0.00 H new ATOM 222 N ARG A 256 -4.142 11.714 -1.197 1.00 0.00 N ATOM 223 CA ARG A 256 -4.144 12.995 -1.910 1.00 0.00 C ATOM 224 C ARG A 256 -2.746 13.335 -2.412 1.00 0.00 C ATOM 225 O ARG A 256 -2.585 14.018 -3.424 1.00 0.00 O ATOM 226 CB ARG A 256 -4.657 14.112 -1.000 1.00 0.00 C ATOM 227 CG ARG A 256 -5.017 15.387 -1.747 1.00 0.00 C ATOM 228 CD ARG A 256 -5.919 16.286 -0.917 1.00 0.00 C ATOM 229 NE ARG A 256 -7.002 16.859 -1.713 1.00 0.00 N ATOM 230 CZ ARG A 256 -7.713 17.921 -1.342 1.00 0.00 C ATOM 231 NH1 ARG A 256 -7.460 18.531 -0.191 1.00 0.00 N ATOM 232 NH2 ARG A 256 -8.682 18.376 -2.126 1.00 0.00 N ATOM 0 H ARG A 256 -4.675 11.719 -0.327 1.00 0.00 H new ATOM 0 HA ARG A 256 -4.810 12.904 -2.768 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -5.535 13.756 -0.461 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -3.896 14.340 -0.254 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -4.106 15.926 -2.008 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -5.516 15.133 -2.682 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -6.340 15.714 -0.091 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -5.327 17.089 -0.479 1.00 0.00 H new ATOM 0 HE ARG A 256 -7.226 16.419 -2.606 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -6.716 18.186 0.416 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -8.009 19.344 0.087 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -8.881 17.912 -3.012 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -9.228 19.190 -1.843 1.00 0.00 H new ATOM 246 N GLY A 257 -1.742 12.829 -1.707 1.00 0.00 N ATOM 247 CA GLY A 257 -0.369 13.046 -2.089 1.00 0.00 C ATOM 248 C GLY A 257 -0.039 12.285 -3.349 1.00 0.00 C ATOM 249 O GLY A 257 0.782 11.384 -3.335 1.00 0.00 O ATOM 0 H GLY A 257 -1.863 12.265 -0.866 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -0.194 14.110 -2.245 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.292 12.729 -1.283 1.00 0.00 H new ATOM 253 N ALA A 258 -0.708 12.638 -4.436 1.00 0.00 N ATOM 254 CA ALA A 258 -0.513 11.970 -5.721 1.00 0.00 C ATOM 255 C ALA A 258 0.962 11.836 -6.066 1.00 0.00 C ATOM 256 O ALA A 258 1.450 10.737 -6.330 1.00 0.00 O ATOM 257 CB ALA A 258 -1.251 12.717 -6.822 1.00 0.00 C ATOM 0 H ALA A 258 -1.397 13.390 -4.457 1.00 0.00 H new ATOM 0 HA ALA A 258 -0.924 10.964 -5.638 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -1.097 12.208 -7.773 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -2.316 12.743 -6.593 1.00 0.00 H new ATOM 0 HB3 ALA A 258 -0.869 13.736 -6.889 1.00 0.00 H new ATOM 263 N GLU A 259 1.671 12.953 -6.053 1.00 0.00 N ATOM 264 CA GLU A 259 3.099 12.940 -6.355 1.00 0.00 C ATOM 265 C GLU A 259 3.843 12.210 -5.252 1.00 0.00 C ATOM 266 O GLU A 259 4.669 11.337 -5.514 1.00 0.00 O ATOM 267 CB GLU A 259 3.633 14.366 -6.510 1.00 0.00 C ATOM 268 CG GLU A 259 4.472 14.567 -7.761 1.00 0.00 C ATOM 269 CD GLU A 259 4.837 16.021 -7.989 1.00 0.00 C ATOM 270 OE1 GLU A 259 3.922 16.871 -7.982 1.00 0.00 O ATOM 271 OE2 GLU A 259 6.038 16.309 -8.176 1.00 0.00 O ATOM 0 H GLU A 259 1.288 13.874 -5.839 1.00 0.00 H new ATOM 0 HA GLU A 259 3.257 12.419 -7.299 1.00 0.00 H new ATOM 0 HB2 GLU A 259 2.793 15.060 -6.531 1.00 0.00 H new ATOM 0 HB3 GLU A 259 4.233 14.618 -5.636 1.00 0.00 H new ATOM 0 HG2 GLU A 259 5.384 13.975 -7.682 1.00 0.00 H new ATOM 0 HG3 GLU A 259 3.924 14.194 -8.626 1.00 0.00 H new ATOM 278 N GLN A 260 3.518 12.550 -4.011 1.00 0.00 N ATOM 279 CA GLN A 260 4.129 11.902 -2.863 1.00 0.00 C ATOM 280 C GLN A 260 3.776 10.426 -2.871 1.00 0.00 C ATOM 281 O GLN A 260 4.556 9.586 -2.439 1.00 0.00 O ATOM 282 CB GLN A 260 3.629 12.534 -1.562 1.00 0.00 C ATOM 283 CG GLN A 260 4.715 12.711 -0.513 1.00 0.00 C ATOM 284 CD GLN A 260 4.351 13.744 0.534 1.00 0.00 C ATOM 285 OE1 GLN A 260 3.545 13.483 1.427 1.00 0.00 O ATOM 286 NE2 GLN A 260 4.945 14.927 0.430 1.00 0.00 N ATOM 0 H GLN A 260 2.835 13.270 -3.776 1.00 0.00 H new ATOM 0 HA GLN A 260 5.210 12.027 -2.923 1.00 0.00 H new ATOM 0 HB2 GLN A 260 3.190 13.506 -1.786 1.00 0.00 H new ATOM 0 HB3 GLN A 260 2.834 11.913 -1.149 1.00 0.00 H new ATOM 0 HG2 GLN A 260 4.903 11.755 -0.025 1.00 0.00 H new ATOM 0 HG3 GLN A 260 5.643 13.007 -1.002 1.00 0.00 H new ATOM 0 HE21 GLN A 260 5.607 15.101 -0.326 1.00 0.00 H new ATOM 0 HE22 GLN A 260 4.739 15.662 1.106 1.00 0.00 H new ATOM 295 N ALA A 261 2.581 10.132 -3.368 1.00 0.00 N ATOM 296 CA ALA A 261 2.088 8.774 -3.438 1.00 0.00 C ATOM 297 C ALA A 261 2.999 7.894 -4.276 1.00 0.00 C ATOM 298 O ALA A 261 3.351 6.785 -3.878 1.00 0.00 O ATOM 299 CB ALA A 261 0.687 8.754 -3.983 1.00 0.00 C ATOM 0 H ALA A 261 1.933 10.830 -3.731 1.00 0.00 H new ATOM 0 HA ALA A 261 2.078 8.369 -2.426 1.00 0.00 H new ATOM 0 HB1 ALA A 261 0.329 7.725 -4.030 1.00 0.00 H new ATOM 0 HB2 ALA A 261 0.035 9.336 -3.331 1.00 0.00 H new ATOM 0 HB3 ALA A 261 0.680 9.187 -4.983 1.00 0.00 H new ATOM 305 N GLU A 262 3.382 8.401 -5.441 1.00 0.00 N ATOM 306 CA GLU A 262 4.261 7.667 -6.339 1.00 0.00 C ATOM 307 C GLU A 262 5.580 7.348 -5.646 1.00 0.00 C ATOM 308 O GLU A 262 6.041 6.207 -5.662 1.00 0.00 O ATOM 309 CB GLU A 262 4.504 8.485 -7.614 1.00 0.00 C ATOM 310 CG GLU A 262 3.856 7.886 -8.852 1.00 0.00 C ATOM 311 CD GLU A 262 4.846 7.651 -9.976 1.00 0.00 C ATOM 312 OE1 GLU A 262 5.578 8.599 -10.330 1.00 0.00 O ATOM 313 OE2 GLU A 262 4.891 6.518 -10.500 1.00 0.00 O ATOM 0 H GLU A 262 3.097 9.318 -5.785 1.00 0.00 H new ATOM 0 HA GLU A 262 3.784 6.726 -6.613 1.00 0.00 H new ATOM 0 HB2 GLU A 262 4.122 9.495 -7.466 1.00 0.00 H new ATOM 0 HB3 GLU A 262 5.578 8.572 -7.781 1.00 0.00 H new ATOM 0 HG2 GLU A 262 3.382 6.941 -8.588 1.00 0.00 H new ATOM 0 HG3 GLU A 262 3.067 8.551 -9.202 1.00 0.00 H new ATOM 320 N THR A 263 6.171 8.357 -5.019 1.00 0.00 N ATOM 321 CA THR A 263 7.422 8.175 -4.299 1.00 0.00 C ATOM 322 C THR A 263 7.166 7.424 -2.997 1.00 0.00 C ATOM 323 O THR A 263 8.038 6.723 -2.484 1.00 0.00 O ATOM 324 CB THR A 263 8.068 9.530 -4.007 1.00 0.00 C ATOM 325 OG1 THR A 263 8.359 10.216 -5.212 1.00 0.00 O ATOM 326 CG2 THR A 263 9.356 9.425 -3.218 1.00 0.00 C ATOM 0 H THR A 263 5.804 9.308 -4.995 1.00 0.00 H new ATOM 0 HA THR A 263 8.103 7.591 -4.918 1.00 0.00 H new ATOM 0 HB THR A 263 7.338 10.073 -3.407 1.00 0.00 H new ATOM 0 HG1 THR A 263 8.770 11.081 -5.005 1.00 0.00 H new ATOM 0 HG21 THR A 263 9.760 10.423 -3.047 1.00 0.00 H new ATOM 0 HG22 THR A 263 9.158 8.944 -2.260 1.00 0.00 H new ATOM 0 HG23 THR A 263 10.079 8.832 -3.779 1.00 0.00 H new ATOM 334 N VAL A 264 5.953 7.576 -2.477 1.00 0.00 N ATOM 335 CA VAL A 264 5.553 6.918 -1.244 1.00 0.00 C ATOM 336 C VAL A 264 5.342 5.427 -1.477 1.00 0.00 C ATOM 337 O VAL A 264 5.657 4.605 -0.617 1.00 0.00 O ATOM 338 CB VAL A 264 4.260 7.553 -0.670 1.00 0.00 C ATOM 339 CG1 VAL A 264 3.501 6.569 0.209 1.00 0.00 C ATOM 340 CG2 VAL A 264 4.592 8.816 0.109 1.00 0.00 C ATOM 0 H VAL A 264 5.226 8.155 -2.897 1.00 0.00 H new ATOM 0 HA VAL A 264 6.355 7.052 -0.518 1.00 0.00 H new ATOM 0 HB VAL A 264 3.615 7.816 -1.509 1.00 0.00 H new ATOM 0 HG11 VAL A 264 2.600 7.046 0.595 1.00 0.00 H new ATOM 0 HG12 VAL A 264 3.225 5.694 -0.379 1.00 0.00 H new ATOM 0 HG13 VAL A 264 4.134 6.262 1.041 1.00 0.00 H new ATOM 0 HG21 VAL A 264 3.674 9.250 0.506 1.00 0.00 H new ATOM 0 HG22 VAL A 264 5.263 8.570 0.932 1.00 0.00 H new ATOM 0 HG23 VAL A 264 5.077 9.534 -0.552 1.00 0.00 H new ATOM 350 N ARG A 265 4.809 5.081 -2.644 1.00 0.00 N ATOM 351 CA ARG A 265 4.565 3.686 -2.974 1.00 0.00 C ATOM 352 C ARG A 265 5.879 2.935 -3.138 1.00 0.00 C ATOM 353 O ARG A 265 6.035 1.821 -2.638 1.00 0.00 O ATOM 354 CB ARG A 265 3.736 3.565 -4.254 1.00 0.00 C ATOM 355 CG ARG A 265 3.445 2.119 -4.637 1.00 0.00 C ATOM 356 CD ARG A 265 4.089 1.740 -5.963 1.00 0.00 C ATOM 357 NE ARG A 265 5.446 1.227 -5.790 1.00 0.00 N ATOM 358 CZ ARG A 265 6.243 0.886 -6.799 1.00 0.00 C ATOM 359 NH1 ARG A 265 5.826 1.009 -8.053 1.00 0.00 N ATOM 360 NH2 ARG A 265 7.459 0.419 -6.556 1.00 0.00 N ATOM 0 H ARG A 265 4.540 5.744 -3.371 1.00 0.00 H new ATOM 0 HA ARG A 265 4.004 3.242 -2.151 1.00 0.00 H new ATOM 0 HB2 ARG A 265 2.794 4.097 -4.123 1.00 0.00 H new ATOM 0 HB3 ARG A 265 4.266 4.053 -5.072 1.00 0.00 H new ATOM 0 HG2 ARG A 265 3.811 1.456 -3.853 1.00 0.00 H new ATOM 0 HG3 ARG A 265 2.367 1.971 -4.702 1.00 0.00 H new ATOM 0 HD2 ARG A 265 3.478 0.986 -6.460 1.00 0.00 H new ATOM 0 HD3 ARG A 265 4.113 2.612 -6.616 1.00 0.00 H new ATOM 0 HE ARG A 265 5.803 1.124 -4.840 1.00 0.00 H new ATOM 0 HH11 ARG A 265 4.891 1.366 -8.247 1.00 0.00 H new ATOM 0 HH12 ARG A 265 6.441 0.746 -8.823 1.00 0.00 H new ATOM 0 HH21 ARG A 265 7.785 0.321 -5.594 1.00 0.00 H new ATOM 0 HH22 ARG A 265 8.069 0.158 -7.330 1.00 0.00 H new ATOM 374 N ALA A 266 6.823 3.550 -3.839 1.00 0.00 N ATOM 375 CA ALA A 266 8.121 2.933 -4.060 1.00 0.00 C ATOM 376 C ALA A 266 8.829 2.667 -2.738 1.00 0.00 C ATOM 377 O ALA A 266 9.692 1.796 -2.654 1.00 0.00 O ATOM 378 CB ALA A 266 8.981 3.812 -4.956 1.00 0.00 C ATOM 0 H ALA A 266 6.713 4.472 -4.262 1.00 0.00 H new ATOM 0 HA ALA A 266 7.962 1.977 -4.558 1.00 0.00 H new ATOM 0 HB1 ALA A 266 9.949 3.336 -5.112 1.00 0.00 H new ATOM 0 HB2 ALA A 266 8.485 3.948 -5.917 1.00 0.00 H new ATOM 0 HB3 ALA A 266 9.126 4.783 -4.482 1.00 0.00 H new ATOM 384 N GLN A 267 8.462 3.418 -1.702 1.00 0.00 N ATOM 385 CA GLN A 267 9.075 3.250 -0.391 1.00 0.00 C ATOM 386 C GLN A 267 8.394 2.135 0.413 1.00 0.00 C ATOM 387 O GLN A 267 8.739 1.900 1.569 1.00 0.00 O ATOM 388 CB GLN A 267 9.046 4.572 0.380 1.00 0.00 C ATOM 389 CG GLN A 267 10.025 4.622 1.541 1.00 0.00 C ATOM 390 CD GLN A 267 11.441 4.928 1.096 1.00 0.00 C ATOM 391 OE1 GLN A 267 11.657 5.707 0.168 1.00 0.00 O ATOM 392 NE2 GLN A 267 12.414 4.312 1.756 1.00 0.00 N ATOM 0 H GLN A 267 7.747 4.144 -1.746 1.00 0.00 H new ATOM 0 HA GLN A 267 10.113 2.954 -0.541 1.00 0.00 H new ATOM 0 HB2 GLN A 267 9.269 5.388 -0.307 1.00 0.00 H new ATOM 0 HB3 GLN A 267 8.038 4.740 0.759 1.00 0.00 H new ATOM 0 HG2 GLN A 267 9.700 5.380 2.253 1.00 0.00 H new ATOM 0 HG3 GLN A 267 10.011 3.666 2.065 1.00 0.00 H new ATOM 0 HE21 GLN A 267 12.188 3.674 2.519 1.00 0.00 H new ATOM 0 HE22 GLN A 267 13.388 4.477 1.500 1.00 0.00 H new ATOM 401 N LEU A 268 7.446 1.439 -0.214 1.00 0.00 N ATOM 402 CA LEU A 268 6.741 0.333 0.426 1.00 0.00 C ATOM 403 C LEU A 268 7.095 -0.962 -0.290 1.00 0.00 C ATOM 404 O LEU A 268 7.057 -2.035 0.301 1.00 0.00 O ATOM 405 CB LEU A 268 5.212 0.624 0.456 1.00 0.00 C ATOM 406 CG LEU A 268 4.291 -0.287 -0.384 1.00 0.00 C ATOM 407 CD1 LEU A 268 3.276 -1.022 0.493 1.00 0.00 C ATOM 408 CD2 LEU A 268 3.568 0.530 -1.445 1.00 0.00 C ATOM 0 H LEU A 268 7.148 1.625 -1.172 1.00 0.00 H new ATOM 0 HA LEU A 268 7.052 0.224 1.465 1.00 0.00 H new ATOM 0 HB2 LEU A 268 4.881 0.571 1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 268 5.060 1.651 0.125 1.00 0.00 H new ATOM 0 HG LEU A 268 4.918 -1.035 -0.870 1.00 0.00 H new ATOM 0 HD11 LEU A 268 2.645 -1.654 -0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 268 3.803 -1.641 1.219 1.00 0.00 H new ATOM 0 HD13 LEU A 268 2.656 -0.296 1.018 1.00 0.00 H new ATOM 0 HD21 LEU A 268 2.922 -0.124 -2.030 1.00 0.00 H new ATOM 0 HD22 LEU A 268 2.965 1.299 -0.963 1.00 0.00 H new ATOM 0 HD23 LEU A 268 4.299 1.001 -2.102 1.00 0.00 H new ATOM 420 N ALA A 269 7.499 -0.846 -1.549 1.00 0.00 N ATOM 421 CA ALA A 269 7.921 -2.000 -2.320 1.00 0.00 C ATOM 422 C ALA A 269 9.440 -2.067 -2.334 1.00 0.00 C ATOM 423 O ALA A 269 10.026 -3.149 -2.355 1.00 0.00 O ATOM 424 CB ALA A 269 7.363 -1.937 -3.734 1.00 0.00 C ATOM 0 H ALA A 269 7.542 0.039 -2.055 1.00 0.00 H new ATOM 0 HA ALA A 269 7.531 -2.906 -1.855 1.00 0.00 H new ATOM 0 HB1 ALA A 269 7.692 -2.812 -4.294 1.00 0.00 H new ATOM 0 HB2 ALA A 269 6.274 -1.920 -3.695 1.00 0.00 H new ATOM 0 HB3 ALA A 269 7.723 -1.034 -4.227 1.00 0.00 H new ATOM 430 N PHE A 270 10.073 -0.898 -2.286 1.00 0.00 N ATOM 431 CA PHE A 270 11.522 -0.822 -2.254 1.00 0.00 C ATOM 432 C PHE A 270 12.008 -1.045 -0.829 1.00 0.00 C ATOM 433 O PHE A 270 13.100 -1.567 -0.608 1.00 0.00 O ATOM 434 CB PHE A 270 12.012 0.530 -2.775 1.00 0.00 C ATOM 435 CG PHE A 270 13.488 0.568 -3.048 1.00 0.00 C ATOM 436 CD1 PHE A 270 14.400 0.500 -2.008 1.00 0.00 C ATOM 437 CD2 PHE A 270 13.963 0.672 -4.346 1.00 0.00 C ATOM 438 CE1 PHE A 270 15.760 0.534 -2.256 1.00 0.00 C ATOM 439 CE2 PHE A 270 15.321 0.707 -4.601 1.00 0.00 C ATOM 440 CZ PHE A 270 16.220 0.638 -3.554 1.00 0.00 C ATOM 0 H PHE A 270 9.602 0.006 -2.269 1.00 0.00 H new ATOM 0 HA PHE A 270 11.928 -1.598 -2.903 1.00 0.00 H new ATOM 0 HB2 PHE A 270 11.475 0.773 -3.692 1.00 0.00 H new ATOM 0 HB3 PHE A 270 11.765 1.302 -2.046 1.00 0.00 H new ATOM 0 HD1 PHE A 270 14.045 0.419 -0.991 1.00 0.00 H new ATOM 0 HD2 PHE A 270 13.264 0.726 -5.168 1.00 0.00 H new ATOM 0 HE1 PHE A 270 16.461 0.479 -1.436 1.00 0.00 H new ATOM 0 HE2 PHE A 270 15.679 0.788 -5.617 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.282 0.665 -3.751 1.00 0.00 H new ATOM 450 N GLU A 271 11.172 -0.665 0.142 1.00 0.00 N ATOM 451 CA GLU A 271 11.512 -0.852 1.544 1.00 0.00 C ATOM 452 C GLU A 271 11.685 -2.333 1.834 1.00 0.00 C ATOM 453 O GLU A 271 12.479 -2.723 2.690 1.00 0.00 O ATOM 454 CB GLU A 271 10.423 -0.266 2.446 1.00 0.00 C ATOM 455 CG GLU A 271 10.840 1.014 3.151 1.00 0.00 C ATOM 456 CD GLU A 271 11.600 0.749 4.437 1.00 0.00 C ATOM 457 OE1 GLU A 271 11.050 0.055 5.319 1.00 0.00 O ATOM 458 OE2 GLU A 271 12.743 1.235 4.563 1.00 0.00 O ATOM 0 H GLU A 271 10.264 -0.230 -0.021 1.00 0.00 H new ATOM 0 HA GLU A 271 12.447 -0.331 1.750 1.00 0.00 H new ATOM 0 HB2 GLU A 271 9.534 -0.068 1.847 1.00 0.00 H new ATOM 0 HB3 GLU A 271 10.144 -1.008 3.194 1.00 0.00 H new ATOM 0 HG2 GLU A 271 11.462 1.608 2.481 1.00 0.00 H new ATOM 0 HG3 GLU A 271 9.953 1.608 3.373 1.00 0.00 H new ATOM 465 N GLY A 272 10.941 -3.160 1.102 1.00 0.00 N ATOM 466 CA GLY A 272 11.039 -4.591 1.289 1.00 0.00 C ATOM 467 C GLY A 272 9.695 -5.265 1.476 1.00 0.00 C ATOM 468 O GLY A 272 9.639 -6.408 1.932 1.00 0.00 O ATOM 0 H GLY A 272 10.277 -2.863 0.387 1.00 0.00 H new ATOM 0 HA2 GLY A 272 11.541 -5.030 0.426 1.00 0.00 H new ATOM 0 HA3 GLY A 272 11.664 -4.795 2.159 1.00 0.00 H new ATOM 472 N PHE A 273 8.606 -4.583 1.121 1.00 0.00 N ATOM 473 CA PHE A 273 7.287 -5.182 1.263 1.00 0.00 C ATOM 474 C PHE A 273 6.405 -4.922 0.049 1.00 0.00 C ATOM 475 O PHE A 273 5.898 -3.823 -0.152 1.00 0.00 O ATOM 476 CB PHE A 273 6.609 -4.756 2.574 1.00 0.00 C ATOM 477 CG PHE A 273 6.214 -3.300 2.735 1.00 0.00 C ATOM 478 CD1 PHE A 273 7.163 -2.286 2.923 1.00 0.00 C ATOM 479 CD2 PHE A 273 4.872 -2.957 2.802 1.00 0.00 C ATOM 480 CE1 PHE A 273 6.769 -0.984 3.157 1.00 0.00 C ATOM 481 CE2 PHE A 273 4.491 -1.664 3.052 1.00 0.00 C ATOM 482 CZ PHE A 273 5.435 -0.679 3.230 1.00 0.00 C ATOM 0 H PHE A 273 8.612 -3.636 0.741 1.00 0.00 H new ATOM 0 HA PHE A 273 7.431 -6.261 1.315 1.00 0.00 H new ATOM 0 HB2 PHE A 273 5.710 -5.361 2.696 1.00 0.00 H new ATOM 0 HB3 PHE A 273 7.279 -5.012 3.394 1.00 0.00 H new ATOM 0 HD1 PHE A 273 8.215 -2.526 2.884 1.00 0.00 H new ATOM 0 HD2 PHE A 273 4.119 -3.717 2.656 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.510 -0.208 3.282 1.00 0.00 H new ATOM 0 HE2 PHE A 273 3.441 -1.417 3.110 1.00 0.00 H new ATOM 0 HZ PHE A 273 5.124 0.336 3.428 1.00 0.00 H new ATOM 492 N ASP A 274 6.244 -5.974 -0.761 1.00 0.00 N ATOM 493 CA ASP A 274 5.444 -5.930 -1.987 1.00 0.00 C ATOM 494 C ASP A 274 4.266 -4.969 -1.878 1.00 0.00 C ATOM 495 O ASP A 274 3.791 -4.675 -0.784 1.00 0.00 O ATOM 496 CB ASP A 274 4.935 -7.331 -2.332 1.00 0.00 C ATOM 497 CG ASP A 274 6.063 -8.327 -2.513 1.00 0.00 C ATOM 498 OD1 ASP A 274 7.152 -8.101 -1.945 1.00 0.00 O ATOM 499 OD2 ASP A 274 5.857 -9.334 -3.223 1.00 0.00 O ATOM 0 H ASP A 274 6.668 -6.884 -0.582 1.00 0.00 H new ATOM 0 HA ASP A 274 6.094 -5.563 -2.781 1.00 0.00 H new ATOM 0 HB2 ASP A 274 4.271 -7.678 -1.541 1.00 0.00 H new ATOM 0 HB3 ASP A 274 4.344 -7.285 -3.247 1.00 0.00 H new ATOM 504 N SER A 275 3.814 -4.485 -3.032 1.00 0.00 N ATOM 505 CA SER A 275 2.698 -3.547 -3.114 1.00 0.00 C ATOM 506 C SER A 275 2.606 -2.985 -4.530 1.00 0.00 C ATOM 507 O SER A 275 3.553 -3.085 -5.309 1.00 0.00 O ATOM 508 CB SER A 275 2.882 -2.397 -2.124 1.00 0.00 C ATOM 509 OG SER A 275 1.860 -1.426 -2.278 1.00 0.00 O ATOM 0 H SER A 275 4.212 -4.733 -3.938 1.00 0.00 H new ATOM 0 HA SER A 275 1.780 -4.079 -2.865 1.00 0.00 H new ATOM 0 HB2 SER A 275 2.870 -2.784 -1.105 1.00 0.00 H new ATOM 0 HB3 SER A 275 3.856 -1.933 -2.277 1.00 0.00 H new ATOM 0 HG SER A 275 1.161 -1.578 -1.608 1.00 0.00 H new ATOM 515 N LYS A 276 1.466 -2.397 -4.857 1.00 0.00 N ATOM 516 CA LYS A 276 1.254 -1.819 -6.184 1.00 0.00 C ATOM 517 C LYS A 276 0.580 -0.455 -6.092 1.00 0.00 C ATOM 518 O LYS A 276 -0.034 -0.123 -5.082 1.00 0.00 O ATOM 519 CB LYS A 276 0.414 -2.760 -7.050 1.00 0.00 C ATOM 520 CG LYS A 276 1.073 -4.108 -7.295 1.00 0.00 C ATOM 521 CD LYS A 276 0.040 -5.208 -7.475 1.00 0.00 C ATOM 522 CE LYS A 276 -0.729 -5.042 -8.775 1.00 0.00 C ATOM 523 NZ LYS A 276 0.109 -5.366 -9.962 1.00 0.00 N ATOM 0 H LYS A 276 0.671 -2.305 -4.225 1.00 0.00 H new ATOM 0 HA LYS A 276 2.231 -1.686 -6.648 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.551 -2.918 -6.570 1.00 0.00 H new ATOM 0 HB3 LYS A 276 0.218 -2.281 -8.009 1.00 0.00 H new ATOM 0 HG2 LYS A 276 1.703 -4.050 -8.183 1.00 0.00 H new ATOM 0 HG3 LYS A 276 1.725 -4.353 -6.457 1.00 0.00 H new ATOM 0 HD2 LYS A 276 0.535 -6.179 -7.465 1.00 0.00 H new ATOM 0 HD3 LYS A 276 -0.655 -5.197 -6.636 1.00 0.00 H new ATOM 0 HE2 LYS A 276 -1.606 -5.689 -8.763 1.00 0.00 H new ATOM 0 HE3 LYS A 276 -1.090 -4.017 -8.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 -0.491 -5.406 -10.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 0.835 -4.631 -10.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 0.570 -6.288 -9.821 1.00 0.00 H new ATOM 537 N ILE A 277 0.716 0.333 -7.155 1.00 0.00 N ATOM 538 CA ILE A 277 0.135 1.674 -7.200 1.00 0.00 C ATOM 539 C ILE A 277 -0.804 1.848 -8.393 1.00 0.00 C ATOM 540 O ILE A 277 -0.572 1.292 -9.466 1.00 0.00 O ATOM 541 CB ILE A 277 1.241 2.747 -7.275 1.00 0.00 C ATOM 542 CG1 ILE A 277 0.650 4.150 -7.140 1.00 0.00 C ATOM 543 CG2 ILE A 277 2.025 2.620 -8.572 1.00 0.00 C ATOM 544 CD1 ILE A 277 0.620 4.654 -5.714 1.00 0.00 C ATOM 0 H ILE A 277 1.224 0.067 -7.998 1.00 0.00 H new ATOM 0 HA ILE A 277 -0.440 1.798 -6.282 1.00 0.00 H new ATOM 0 HB ILE A 277 1.925 2.585 -6.442 1.00 0.00 H new ATOM 0 HG12 ILE A 277 1.231 4.841 -7.750 1.00 0.00 H new ATOM 0 HG13 ILE A 277 -0.364 4.149 -7.539 1.00 0.00 H new ATOM 0 HG21 ILE A 277 2.800 3.386 -8.605 1.00 0.00 H new ATOM 0 HG22 ILE A 277 2.487 1.634 -8.623 1.00 0.00 H new ATOM 0 HG23 ILE A 277 1.351 2.749 -9.419 1.00 0.00 H new ATOM 0 HD11 ILE A 277 0.189 5.655 -5.691 1.00 0.00 H new ATOM 0 HD12 ILE A 277 0.015 3.984 -5.104 1.00 0.00 H new ATOM 0 HD13 ILE A 277 1.635 4.687 -5.318 1.00 0.00 H new ATOM 556 N THR A 278 -1.857 2.638 -8.195 1.00 0.00 N ATOM 557 CA THR A 278 -2.830 2.909 -9.246 1.00 0.00 C ATOM 558 C THR A 278 -3.755 4.055 -8.842 1.00 0.00 C ATOM 559 O THR A 278 -4.471 3.962 -7.850 1.00 0.00 O ATOM 560 CB THR A 278 -3.657 1.661 -9.551 1.00 0.00 C ATOM 561 OG1 THR A 278 -3.894 0.914 -8.372 1.00 0.00 O ATOM 562 CG2 THR A 278 -3.003 0.739 -10.557 1.00 0.00 C ATOM 0 H THR A 278 -2.057 3.103 -7.310 1.00 0.00 H new ATOM 0 HA THR A 278 -2.283 3.197 -10.143 1.00 0.00 H new ATOM 0 HB THR A 278 -4.590 2.031 -9.976 1.00 0.00 H new ATOM 0 HG1 THR A 278 -4.426 0.120 -8.589 1.00 0.00 H new ATOM 0 HG21 THR A 278 -3.643 -0.127 -10.727 1.00 0.00 H new ATOM 0 HG22 THR A 278 -2.855 1.272 -11.496 1.00 0.00 H new ATOM 0 HG23 THR A 278 -2.039 0.407 -10.173 1.00 0.00 H new ATOM 570 N THR A 279 -3.737 5.132 -9.618 1.00 0.00 N ATOM 571 CA THR A 279 -4.580 6.291 -9.337 1.00 0.00 C ATOM 572 C THR A 279 -5.919 6.163 -10.060 1.00 0.00 C ATOM 573 O THR A 279 -5.983 5.603 -11.155 1.00 0.00 O ATOM 574 CB THR A 279 -3.874 7.576 -9.770 1.00 0.00 C ATOM 575 OG1 THR A 279 -4.652 8.712 -9.438 1.00 0.00 O ATOM 576 CG2 THR A 279 -3.591 7.633 -11.256 1.00 0.00 C ATOM 0 H THR A 279 -3.149 5.228 -10.446 1.00 0.00 H new ATOM 0 HA THR A 279 -4.763 6.333 -8.263 1.00 0.00 H new ATOM 0 HB THR A 279 -2.924 7.577 -9.235 1.00 0.00 H new ATOM 0 HG1 THR A 279 -4.183 9.524 -9.722 1.00 0.00 H new ATOM 0 HG21 THR A 279 -3.089 8.571 -11.495 1.00 0.00 H new ATOM 0 HG22 THR A 279 -2.951 6.797 -11.537 1.00 0.00 H new ATOM 0 HG23 THR A 279 -4.529 7.573 -11.808 1.00 0.00 H new ATOM 584 N ASN A 280 -6.990 6.679 -9.454 1.00 0.00 N ATOM 585 CA ASN A 280 -8.312 6.603 -10.075 1.00 0.00 C ATOM 586 C ASN A 280 -9.371 7.299 -9.228 1.00 0.00 C ATOM 587 O ASN A 280 -10.201 8.045 -9.748 1.00 0.00 O ATOM 588 CB ASN A 280 -8.710 5.143 -10.304 1.00 0.00 C ATOM 589 CG ASN A 280 -9.581 4.968 -11.532 1.00 0.00 C ATOM 590 OD1 ASN A 280 -9.203 4.283 -12.483 1.00 0.00 O ATOM 591 ND2 ASN A 280 -10.754 5.589 -11.519 1.00 0.00 N ATOM 0 H ASN A 280 -6.969 7.147 -8.548 1.00 0.00 H new ATOM 0 HA ASN A 280 -8.253 7.117 -11.034 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -7.811 4.536 -10.410 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -9.243 4.773 -9.428 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -11.382 5.509 -12.318 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -11.027 6.146 -10.710 1.00 0.00 H new ATOM 598 N ASN A 281 -9.336 7.058 -7.923 1.00 0.00 N ATOM 599 CA ASN A 281 -10.293 7.671 -7.009 1.00 0.00 C ATOM 600 C ASN A 281 -9.918 9.121 -6.712 1.00 0.00 C ATOM 601 O ASN A 281 -10.505 9.756 -5.835 1.00 0.00 O ATOM 602 CB ASN A 281 -10.352 6.879 -5.704 1.00 0.00 C ATOM 603 CG ASN A 281 -11.461 7.354 -4.786 1.00 0.00 C ATOM 604 OD1 ASN A 281 -11.207 8.016 -3.780 1.00 0.00 O ATOM 605 ND2 ASN A 281 -12.699 7.020 -5.130 1.00 0.00 N ATOM 0 H ASN A 281 -8.657 6.444 -7.474 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.272 7.659 -7.488 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -10.499 5.823 -5.930 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -9.396 6.964 -5.188 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -13.486 7.314 -4.551 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -12.863 6.470 -5.973 1.00 0.00 H new ATOM 612 N GLY A 282 -8.928 9.637 -7.435 1.00 0.00 N ATOM 613 CA GLY A 282 -8.482 10.998 -7.224 1.00 0.00 C ATOM 614 C GLY A 282 -7.046 11.040 -6.752 1.00 0.00 C ATOM 615 O GLY A 282 -6.308 11.977 -7.056 1.00 0.00 O ATOM 0 H GLY A 282 -8.426 9.132 -8.166 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.579 11.562 -8.152 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -9.123 11.483 -6.488 1.00 0.00 H new ATOM 619 N TRP A 283 -6.653 10.014 -6.006 1.00 0.00 N ATOM 620 CA TRP A 283 -5.311 9.914 -5.484 1.00 0.00 C ATOM 621 C TRP A 283 -4.695 8.562 -5.818 1.00 0.00 C ATOM 622 O TRP A 283 -5.398 7.603 -6.135 1.00 0.00 O ATOM 623 CB TRP A 283 -5.318 10.122 -3.976 1.00 0.00 C ATOM 624 CG TRP A 283 -6.532 9.593 -3.276 1.00 0.00 C ATOM 625 CD1 TRP A 283 -7.102 8.370 -3.444 1.00 0.00 C ATOM 626 CD2 TRP A 283 -7.315 10.268 -2.284 1.00 0.00 C ATOM 627 NE1 TRP A 283 -8.199 8.241 -2.628 1.00 0.00 N ATOM 628 CE2 TRP A 283 -8.349 9.393 -1.904 1.00 0.00 C ATOM 629 CE3 TRP A 283 -7.243 11.525 -1.683 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -9.303 9.737 -0.949 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -8.186 11.865 -0.734 1.00 0.00 C ATOM 632 CH2 TRP A 283 -9.206 10.974 -0.375 1.00 0.00 C ATOM 0 H TRP A 283 -7.260 9.235 -5.751 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.707 10.692 -5.951 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -4.434 9.644 -3.553 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.233 11.189 -3.770 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -6.744 7.609 -4.122 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -8.803 7.421 -2.571 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -6.463 12.220 -1.956 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -10.090 9.052 -0.672 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -8.137 12.834 -0.260 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -9.930 11.270 0.370 1.00 0.00 H new ATOM 643 N ASN A 284 -3.374 8.505 -5.747 1.00 0.00 N ATOM 644 CA ASN A 284 -2.635 7.283 -6.042 1.00 0.00 C ATOM 645 C ASN A 284 -3.055 6.142 -5.118 1.00 0.00 C ATOM 646 O ASN A 284 -2.650 6.094 -3.956 1.00 0.00 O ATOM 647 CB ASN A 284 -1.133 7.550 -5.900 1.00 0.00 C ATOM 648 CG ASN A 284 -0.437 7.673 -7.241 1.00 0.00 C ATOM 649 OD1 ASN A 284 0.413 6.855 -7.591 1.00 0.00 O ATOM 650 ND2 ASN A 284 -0.793 8.704 -7.999 1.00 0.00 N ATOM 0 H ASN A 284 -2.786 9.297 -5.486 1.00 0.00 H new ATOM 0 HA ASN A 284 -2.861 6.982 -7.065 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -0.982 8.467 -5.330 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -0.676 6.742 -5.329 1.00 0.00 H new ATOM 0 HD21 ASN A 284 -0.357 8.841 -8.911 1.00 0.00 H new ATOM 0 HD22 ASN A 284 -1.503 9.358 -7.669 1.00 0.00 H new ATOM 657 N ARG A 285 -3.855 5.217 -5.644 1.00 0.00 N ATOM 658 CA ARG A 285 -4.307 4.072 -4.860 1.00 0.00 C ATOM 659 C ARG A 285 -3.212 3.015 -4.794 1.00 0.00 C ATOM 660 O ARG A 285 -2.378 2.918 -5.693 1.00 0.00 O ATOM 661 CB ARG A 285 -5.584 3.465 -5.450 1.00 0.00 C ATOM 662 CG ARG A 285 -6.561 4.495 -5.996 1.00 0.00 C ATOM 663 CD ARG A 285 -7.796 3.831 -6.585 1.00 0.00 C ATOM 664 NE ARG A 285 -7.457 2.890 -7.651 1.00 0.00 N ATOM 665 CZ ARG A 285 -7.188 1.601 -7.449 1.00 0.00 C ATOM 666 NH1 ARG A 285 -7.211 1.091 -6.223 1.00 0.00 N ATOM 667 NH2 ARG A 285 -6.892 0.818 -8.479 1.00 0.00 N ATOM 0 H ARG A 285 -4.201 5.238 -6.603 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.531 4.422 -3.852 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -5.311 2.777 -6.250 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -6.084 2.877 -4.681 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -6.858 5.176 -5.198 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -6.069 5.096 -6.761 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -8.336 3.306 -5.797 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -8.467 4.596 -6.976 1.00 0.00 H new ATOM 0 HE ARG A 285 -7.424 3.242 -8.608 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -7.436 1.687 -5.427 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -7.004 0.103 -6.078 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -6.871 1.203 -9.423 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -6.686 -0.169 -8.326 1.00 0.00 H new ATOM 681 N VAL A 286 -3.213 2.227 -3.727 1.00 0.00 N ATOM 682 CA VAL A 286 -2.210 1.182 -3.556 1.00 0.00 C ATOM 683 C VAL A 286 -2.858 -0.150 -3.202 1.00 0.00 C ATOM 684 O VAL A 286 -3.926 -0.199 -2.592 1.00 0.00 O ATOM 685 CB VAL A 286 -1.190 1.547 -2.458 1.00 0.00 C ATOM 686 CG1 VAL A 286 -0.027 0.564 -2.409 1.00 0.00 C ATOM 687 CG2 VAL A 286 -0.679 2.966 -2.650 1.00 0.00 C ATOM 0 H VAL A 286 -3.893 2.290 -2.970 1.00 0.00 H new ATOM 0 HA VAL A 286 -1.689 1.092 -4.509 1.00 0.00 H new ATOM 0 HB VAL A 286 -1.710 1.486 -1.502 1.00 0.00 H new ATOM 0 HG11 VAL A 286 0.666 0.860 -1.622 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -0.405 -0.437 -2.202 1.00 0.00 H new ATOM 0 HG13 VAL A 286 0.491 0.565 -3.368 1.00 0.00 H new ATOM 0 HG21 VAL A 286 0.039 3.203 -1.865 1.00 0.00 H new ATOM 0 HG22 VAL A 286 -0.194 3.050 -3.623 1.00 0.00 H new ATOM 0 HG23 VAL A 286 -1.515 3.664 -2.600 1.00 0.00 H new ATOM 697 N VAL A 287 -2.182 -1.216 -3.583 1.00 0.00 N ATOM 698 CA VAL A 287 -2.631 -2.580 -3.327 1.00 0.00 C ATOM 699 C VAL A 287 -1.456 -3.533 -3.487 1.00 0.00 C ATOM 700 O VAL A 287 -0.651 -3.365 -4.397 1.00 0.00 O ATOM 701 CB VAL A 287 -3.737 -3.029 -4.305 1.00 0.00 C ATOM 702 CG1 VAL A 287 -5.037 -2.274 -4.066 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.275 -2.867 -5.747 1.00 0.00 C ATOM 0 H VAL A 287 -1.295 -1.164 -4.085 1.00 0.00 H new ATOM 0 HA VAL A 287 -3.034 -2.600 -2.314 1.00 0.00 H new ATOM 0 HB VAL A 287 -3.933 -4.085 -4.120 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -5.792 -2.617 -4.773 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -5.383 -2.458 -3.049 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -4.868 -1.206 -4.205 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -4.068 -3.189 -6.422 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -3.039 -1.820 -5.938 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -2.387 -3.476 -5.915 1.00 0.00 H new ATOM 713 N ILE A 288 -1.356 -4.541 -2.632 1.00 0.00 N ATOM 714 CA ILE A 288 -0.261 -5.499 -2.747 1.00 0.00 C ATOM 715 C ILE A 288 -0.782 -6.829 -3.258 1.00 0.00 C ATOM 716 O ILE A 288 -1.849 -7.281 -2.839 1.00 0.00 O ATOM 717 CB ILE A 288 0.474 -5.724 -1.406 1.00 0.00 C ATOM 718 CG1 ILE A 288 0.826 -4.395 -0.731 1.00 0.00 C ATOM 719 CG2 ILE A 288 1.730 -6.554 -1.622 1.00 0.00 C ATOM 720 CD1 ILE A 288 0.237 -4.247 0.647 1.00 0.00 C ATOM 0 H ILE A 288 -2.005 -4.717 -1.865 1.00 0.00 H new ATOM 0 HA ILE A 288 0.454 -5.076 -3.452 1.00 0.00 H new ATOM 0 HB ILE A 288 -0.201 -6.268 -0.745 1.00 0.00 H new ATOM 0 HG12 ILE A 288 1.910 -4.306 -0.666 1.00 0.00 H new ATOM 0 HG13 ILE A 288 0.476 -3.574 -1.357 1.00 0.00 H new ATOM 0 HG21 ILE A 288 2.236 -6.703 -0.668 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.459 -7.522 -2.044 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.397 -6.033 -2.309 1.00 0.00 H new ATOM 0 HD11 ILE A 288 0.527 -3.283 1.065 1.00 0.00 H new ATOM 0 HD12 ILE A 288 -0.850 -4.304 0.586 1.00 0.00 H new ATOM 0 HD13 ILE A 288 0.607 -5.047 1.289 1.00 0.00 H new ATOM 732 N GLY A 289 -0.031 -7.454 -4.166 1.00 0.00 N ATOM 733 CA GLY A 289 -0.443 -8.736 -4.717 1.00 0.00 C ATOM 734 C GLY A 289 -1.121 -9.601 -3.676 1.00 0.00 C ATOM 735 O GLY A 289 -0.797 -9.497 -2.494 1.00 0.00 O ATOM 0 H GLY A 289 0.853 -7.096 -4.528 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -1.123 -8.571 -5.552 1.00 0.00 H new ATOM 0 HA3 GLY A 289 0.428 -9.258 -5.113 1.00 0.00 H new ATOM 739 N PRO A 290 -2.078 -10.456 -4.072 1.00 0.00 N ATOM 740 CA PRO A 290 -2.796 -11.318 -3.141 1.00 0.00 C ATOM 741 C PRO A 290 -1.878 -11.868 -2.050 1.00 0.00 C ATOM 742 O PRO A 290 -1.197 -12.875 -2.239 1.00 0.00 O ATOM 743 CB PRO A 290 -3.339 -12.449 -4.032 1.00 0.00 C ATOM 744 CG PRO A 290 -2.960 -12.098 -5.442 1.00 0.00 C ATOM 745 CD PRO A 290 -2.547 -10.651 -5.442 1.00 0.00 C ATOM 0 HA PRO A 290 -3.581 -10.784 -2.607 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -2.913 -13.410 -3.743 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.421 -12.537 -3.931 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -2.144 -12.731 -5.791 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -3.800 -12.259 -6.118 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -1.762 -10.453 -6.172 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -3.380 -9.991 -5.683 1.00 0.00 H new ATOM 753 N VAL A 291 -1.858 -11.174 -0.919 1.00 0.00 N ATOM 754 CA VAL A 291 -1.014 -11.553 0.213 1.00 0.00 C ATOM 755 C VAL A 291 -1.636 -12.692 1.015 1.00 0.00 C ATOM 756 O VAL A 291 -2.652 -13.259 0.617 1.00 0.00 O ATOM 757 CB VAL A 291 -0.731 -10.354 1.157 1.00 0.00 C ATOM 758 CG1 VAL A 291 0.620 -9.732 0.841 1.00 0.00 C ATOM 759 CG2 VAL A 291 -1.831 -9.300 1.077 1.00 0.00 C ATOM 0 H VAL A 291 -2.421 -10.339 -0.758 1.00 0.00 H new ATOM 0 HA VAL A 291 -0.068 -11.889 -0.211 1.00 0.00 H new ATOM 0 HB VAL A 291 -0.714 -10.738 2.177 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.800 -8.893 1.513 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.404 -10.478 0.973 1.00 0.00 H new ATOM 0 HG13 VAL A 291 0.626 -9.378 -0.190 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -1.596 -8.477 1.752 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -1.901 -8.923 0.056 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -2.783 -9.745 1.365 1.00 0.00 H new ATOM 769 N LYS A 292 -1.014 -13.027 2.142 1.00 0.00 N ATOM 770 CA LYS A 292 -1.508 -14.102 2.995 1.00 0.00 C ATOM 771 C LYS A 292 -1.814 -13.591 4.399 1.00 0.00 C ATOM 772 O LYS A 292 -1.024 -12.855 4.989 1.00 0.00 O ATOM 773 CB LYS A 292 -0.485 -15.238 3.065 1.00 0.00 C ATOM 774 CG LYS A 292 0.034 -15.675 1.704 1.00 0.00 C ATOM 775 CD LYS A 292 1.407 -15.088 1.415 1.00 0.00 C ATOM 776 CE LYS A 292 2.480 -15.730 2.279 1.00 0.00 C ATOM 777 NZ LYS A 292 3.794 -15.046 2.133 1.00 0.00 N ATOM 0 H LYS A 292 -0.169 -12.570 2.485 1.00 0.00 H new ATOM 0 HA LYS A 292 -2.432 -14.480 2.558 1.00 0.00 H new ATOM 0 HB2 LYS A 292 0.357 -14.920 3.681 1.00 0.00 H new ATOM 0 HB3 LYS A 292 -0.939 -16.094 3.563 1.00 0.00 H new ATOM 0 HG2 LYS A 292 0.087 -16.763 1.666 1.00 0.00 H new ATOM 0 HG3 LYS A 292 -0.666 -15.363 0.929 1.00 0.00 H new ATOM 0 HD2 LYS A 292 1.651 -15.232 0.363 1.00 0.00 H new ATOM 0 HD3 LYS A 292 1.389 -14.013 1.594 1.00 0.00 H new ATOM 0 HE2 LYS A 292 2.170 -15.701 3.324 1.00 0.00 H new ATOM 0 HE3 LYS A 292 2.585 -16.780 2.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 4.498 -15.514 2.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 4.103 -15.095 1.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 3.700 -14.050 2.417 1.00 0.00 H new ATOM 791 N GLY A 293 -2.968 -13.988 4.927 1.00 0.00 N ATOM 792 CA GLY A 293 -3.360 -13.561 6.256 1.00 0.00 C ATOM 793 C GLY A 293 -2.580 -14.268 7.344 1.00 0.00 C ATOM 794 O GLY A 293 -2.712 -15.478 7.526 1.00 0.00 O ATOM 0 H GLY A 293 -3.638 -14.598 4.458 1.00 0.00 H new ATOM 0 HA2 GLY A 293 -3.212 -12.485 6.347 1.00 0.00 H new ATOM 0 HA3 GLY A 293 -4.425 -13.749 6.396 1.00 0.00 H new ATOM 798 N LYS A 294 -1.762 -13.512 8.068 1.00 0.00 N ATOM 799 CA LYS A 294 -0.955 -14.077 9.143 1.00 0.00 C ATOM 800 C LYS A 294 -0.131 -12.998 9.838 1.00 0.00 C ATOM 801 O LYS A 294 -0.107 -12.918 11.066 1.00 0.00 O ATOM 802 CB LYS A 294 -0.030 -15.168 8.596 1.00 0.00 C ATOM 803 CG LYS A 294 0.155 -16.341 9.546 1.00 0.00 C ATOM 804 CD LYS A 294 0.736 -17.551 8.832 1.00 0.00 C ATOM 805 CE LYS A 294 -0.338 -18.575 8.499 1.00 0.00 C ATOM 806 NZ LYS A 294 -0.205 -19.808 9.324 1.00 0.00 N ATOM 0 H LYS A 294 -1.640 -12.509 7.930 1.00 0.00 H new ATOM 0 HA LYS A 294 -1.633 -14.516 9.876 1.00 0.00 H new ATOM 0 HB2 LYS A 294 -0.433 -15.535 7.652 1.00 0.00 H new ATOM 0 HB3 LYS A 294 0.944 -14.731 8.377 1.00 0.00 H new ATOM 0 HG2 LYS A 294 0.814 -16.048 10.363 1.00 0.00 H new ATOM 0 HG3 LYS A 294 -0.805 -16.606 9.990 1.00 0.00 H new ATOM 0 HD2 LYS A 294 1.230 -17.230 7.915 1.00 0.00 H new ATOM 0 HD3 LYS A 294 1.498 -18.013 9.460 1.00 0.00 H new ATOM 0 HE2 LYS A 294 -1.322 -18.135 8.660 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -0.275 -18.836 7.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -0.955 -20.481 9.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 0.724 -20.243 9.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 -0.290 -19.563 10.331 1.00 0.00 H new ATOM 820 N GLU A 295 0.551 -12.173 9.049 1.00 0.00 N ATOM 821 CA GLU A 295 1.379 -11.107 9.604 1.00 0.00 C ATOM 822 C GLU A 295 1.996 -10.227 8.515 1.00 0.00 C ATOM 823 O GLU A 295 2.392 -9.094 8.783 1.00 0.00 O ATOM 824 CB GLU A 295 2.485 -11.710 10.470 1.00 0.00 C ATOM 825 CG GLU A 295 2.676 -10.998 11.799 1.00 0.00 C ATOM 826 CD GLU A 295 3.791 -11.604 12.630 1.00 0.00 C ATOM 827 OE1 GLU A 295 4.961 -11.227 12.419 1.00 0.00 O ATOM 828 OE2 GLU A 295 3.491 -12.457 13.492 1.00 0.00 O ATOM 0 H GLU A 295 0.547 -12.221 8.030 1.00 0.00 H new ATOM 0 HA GLU A 295 0.733 -10.472 10.211 1.00 0.00 H new ATOM 0 HB2 GLU A 295 2.255 -12.759 10.659 1.00 0.00 H new ATOM 0 HB3 GLU A 295 3.423 -11.684 9.916 1.00 0.00 H new ATOM 0 HG2 GLU A 295 2.895 -9.946 11.615 1.00 0.00 H new ATOM 0 HG3 GLU A 295 1.745 -11.036 12.364 1.00 0.00 H new ATOM 835 N ASN A 296 2.088 -10.745 7.294 1.00 0.00 N ATOM 836 CA ASN A 296 2.668 -9.986 6.192 1.00 0.00 C ATOM 837 C ASN A 296 1.849 -8.734 5.904 1.00 0.00 C ATOM 838 O ASN A 296 2.333 -7.615 6.070 1.00 0.00 O ATOM 839 CB ASN A 296 2.764 -10.853 4.936 1.00 0.00 C ATOM 840 CG ASN A 296 4.079 -11.601 4.848 1.00 0.00 C ATOM 841 OD1 ASN A 296 4.144 -12.801 5.113 1.00 0.00 O ATOM 842 ND2 ASN A 296 5.138 -10.891 4.476 1.00 0.00 N ATOM 0 H ASN A 296 1.770 -11.681 7.044 1.00 0.00 H new ATOM 0 HA ASN A 296 3.672 -9.680 6.485 1.00 0.00 H new ATOM 0 HB2 ASN A 296 1.941 -11.568 4.928 1.00 0.00 H new ATOM 0 HB3 ASN A 296 2.648 -10.223 4.054 1.00 0.00 H new ATOM 0 HD21 ASN A 296 6.051 -11.339 4.401 1.00 0.00 H new ATOM 0 HD22 ASN A 296 5.038 -9.898 4.266 1.00 0.00 H new ATOM 849 N ALA A 297 0.604 -8.926 5.482 1.00 0.00 N ATOM 850 CA ALA A 297 -0.278 -7.801 5.186 1.00 0.00 C ATOM 851 C ALA A 297 -0.340 -6.849 6.377 1.00 0.00 C ATOM 852 O ALA A 297 -0.332 -5.630 6.214 1.00 0.00 O ATOM 853 CB ALA A 297 -1.671 -8.301 4.833 1.00 0.00 C ATOM 0 H ALA A 297 0.184 -9.844 5.338 1.00 0.00 H new ATOM 0 HA ALA A 297 0.123 -7.259 4.330 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -2.318 -7.451 4.615 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.614 -8.948 3.958 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -2.080 -8.862 5.673 1.00 0.00 H new ATOM 859 N ASP A 298 -0.386 -7.419 7.580 1.00 0.00 N ATOM 860 CA ASP A 298 -0.433 -6.623 8.802 1.00 0.00 C ATOM 861 C ASP A 298 0.868 -5.855 8.987 1.00 0.00 C ATOM 862 O ASP A 298 0.858 -4.641 9.187 1.00 0.00 O ATOM 863 CB ASP A 298 -0.694 -7.520 10.014 1.00 0.00 C ATOM 864 CG ASP A 298 -2.160 -7.562 10.398 1.00 0.00 C ATOM 865 OD1 ASP A 298 -2.583 -6.719 11.216 1.00 0.00 O ATOM 866 OD2 ASP A 298 -2.885 -8.437 9.880 1.00 0.00 O ATOM 0 H ASP A 298 -0.392 -8.427 7.733 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.251 -5.907 8.715 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -0.350 -8.531 9.795 1.00 0.00 H new ATOM 0 HB3 ASP A 298 -0.110 -7.161 10.861 1.00 0.00 H new ATOM 871 N SER A 299 1.993 -6.563 8.900 1.00 0.00 N ATOM 872 CA SER A 299 3.295 -5.926 9.039 1.00 0.00 C ATOM 873 C SER A 299 3.479 -4.905 7.927 1.00 0.00 C ATOM 874 O SER A 299 4.100 -3.860 8.118 1.00 0.00 O ATOM 875 CB SER A 299 4.414 -6.970 8.992 1.00 0.00 C ATOM 876 OG SER A 299 4.592 -7.584 10.256 1.00 0.00 O ATOM 0 H SER A 299 2.027 -7.569 8.735 1.00 0.00 H new ATOM 0 HA SER A 299 3.343 -5.422 10.004 1.00 0.00 H new ATOM 0 HB2 SER A 299 4.177 -7.728 8.246 1.00 0.00 H new ATOM 0 HB3 SER A 299 5.345 -6.496 8.680 1.00 0.00 H new ATOM 0 HG SER A 299 3.991 -8.354 10.333 1.00 0.00 H new ATOM 882 N THR A 300 2.906 -5.215 6.770 1.00 0.00 N ATOM 883 CA THR A 300 2.967 -4.329 5.619 1.00 0.00 C ATOM 884 C THR A 300 2.322 -2.992 5.967 1.00 0.00 C ATOM 885 O THR A 300 2.865 -1.931 5.663 1.00 0.00 O ATOM 886 CB THR A 300 2.257 -4.983 4.428 1.00 0.00 C ATOM 887 OG1 THR A 300 3.087 -5.963 3.829 1.00 0.00 O ATOM 888 CG2 THR A 300 1.852 -4.007 3.347 1.00 0.00 C ATOM 0 H THR A 300 2.391 -6.080 6.606 1.00 0.00 H new ATOM 0 HA THR A 300 4.007 -4.151 5.347 1.00 0.00 H new ATOM 0 HB THR A 300 1.352 -5.424 4.846 1.00 0.00 H new ATOM 0 HG1 THR A 300 3.071 -6.780 4.370 1.00 0.00 H new ATOM 0 HG21 THR A 300 1.356 -4.544 2.539 1.00 0.00 H new ATOM 0 HG22 THR A 300 1.169 -3.266 3.763 1.00 0.00 H new ATOM 0 HG23 THR A 300 2.739 -3.506 2.959 1.00 0.00 H new ATOM 896 N LEU A 301 1.168 -3.056 6.627 1.00 0.00 N ATOM 897 CA LEU A 301 0.452 -1.855 7.038 1.00 0.00 C ATOM 898 C LEU A 301 1.382 -0.923 7.800 1.00 0.00 C ATOM 899 O LEU A 301 1.576 0.231 7.419 1.00 0.00 O ATOM 900 CB LEU A 301 -0.744 -2.226 7.914 1.00 0.00 C ATOM 901 CG LEU A 301 -1.513 -1.038 8.495 1.00 0.00 C ATOM 902 CD1 LEU A 301 -2.258 -0.296 7.396 1.00 0.00 C ATOM 903 CD2 LEU A 301 -2.476 -1.506 9.576 1.00 0.00 C ATOM 0 H LEU A 301 0.710 -3.929 6.888 1.00 0.00 H new ATOM 0 HA LEU A 301 0.091 -1.343 6.146 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -1.432 -2.832 7.325 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -0.393 -2.850 8.736 1.00 0.00 H new ATOM 0 HG LEU A 301 -0.798 -0.350 8.947 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -2.799 0.546 7.828 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -1.545 0.071 6.657 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -2.964 -0.973 6.914 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -3.015 -0.649 9.979 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -3.187 -2.213 9.149 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -1.917 -1.992 10.376 1.00 0.00 H new ATOM 915 N ASN A 302 1.972 -1.444 8.870 1.00 0.00 N ATOM 916 CA ASN A 302 2.902 -0.669 9.676 1.00 0.00 C ATOM 917 C ASN A 302 4.103 -0.262 8.833 1.00 0.00 C ATOM 918 O ASN A 302 4.739 0.760 9.088 1.00 0.00 O ATOM 919 CB ASN A 302 3.363 -1.484 10.885 1.00 0.00 C ATOM 920 CG ASN A 302 2.468 -1.284 12.093 1.00 0.00 C ATOM 921 OD1 ASN A 302 1.371 -1.839 12.166 1.00 0.00 O ATOM 922 ND2 ASN A 302 2.933 -0.487 13.049 1.00 0.00 N ATOM 0 H ASN A 302 1.822 -2.398 9.197 1.00 0.00 H new ATOM 0 HA ASN A 302 2.396 0.228 10.032 1.00 0.00 H new ATOM 0 HB2 ASN A 302 3.381 -2.541 10.621 1.00 0.00 H new ATOM 0 HB3 ASN A 302 4.384 -1.202 11.142 1.00 0.00 H new ATOM 0 HD21 ASN A 302 2.375 -0.314 13.885 1.00 0.00 H new ATOM 0 HD22 ASN A 302 3.848 -0.048 12.947 1.00 0.00 H new ATOM 929 N ARG A 303 4.399 -1.070 7.819 1.00 0.00 N ATOM 930 CA ARG A 303 5.514 -0.797 6.929 1.00 0.00 C ATOM 931 C ARG A 303 5.185 0.367 5.996 1.00 0.00 C ATOM 932 O ARG A 303 6.060 1.157 5.651 1.00 0.00 O ATOM 933 CB ARG A 303 5.874 -2.044 6.119 1.00 0.00 C ATOM 934 CG ARG A 303 6.523 -3.144 6.946 1.00 0.00 C ATOM 935 CD ARG A 303 7.933 -3.444 6.466 1.00 0.00 C ATOM 936 NE ARG A 303 8.518 -4.590 7.159 1.00 0.00 N ATOM 937 CZ ARG A 303 9.549 -5.291 6.693 1.00 0.00 C ATOM 938 NH1 ARG A 303 10.114 -4.967 5.535 1.00 0.00 N ATOM 939 NH2 ARG A 303 10.021 -6.319 7.387 1.00 0.00 N ATOM 0 H ARG A 303 3.879 -1.919 7.596 1.00 0.00 H new ATOM 0 HA ARG A 303 6.375 -0.519 7.537 1.00 0.00 H new ATOM 0 HB2 ARG A 303 4.970 -2.437 5.653 1.00 0.00 H new ATOM 0 HB3 ARG A 303 6.551 -1.760 5.313 1.00 0.00 H new ATOM 0 HG2 ARG A 303 6.550 -2.845 7.994 1.00 0.00 H new ATOM 0 HG3 ARG A 303 5.918 -4.049 6.889 1.00 0.00 H new ATOM 0 HD2 ARG A 303 7.916 -3.639 5.394 1.00 0.00 H new ATOM 0 HD3 ARG A 303 8.562 -2.568 6.621 1.00 0.00 H new ATOM 0 HE ARG A 303 8.112 -4.869 8.052 1.00 0.00 H new ATOM 0 HH11 ARG A 303 9.758 -4.177 4.997 1.00 0.00 H new ATOM 0 HH12 ARG A 303 10.904 -5.508 5.184 1.00 0.00 H new ATOM 0 HH21 ARG A 303 9.594 -6.572 8.278 1.00 0.00 H new ATOM 0 HH22 ARG A 303 10.811 -6.856 7.029 1.00 0.00 H new ATOM 953 N LEU A 304 3.918 0.487 5.601 1.00 0.00 N ATOM 954 CA LEU A 304 3.504 1.581 4.724 1.00 0.00 C ATOM 955 C LEU A 304 3.738 2.909 5.416 1.00 0.00 C ATOM 956 O LEU A 304 4.105 3.894 4.776 1.00 0.00 O ATOM 957 CB LEU A 304 2.056 1.393 4.262 1.00 0.00 C ATOM 958 CG LEU A 304 1.943 0.475 3.040 1.00 0.00 C ATOM 959 CD1 LEU A 304 1.236 -0.825 3.386 1.00 0.00 C ATOM 960 CD2 LEU A 304 1.263 1.159 1.860 1.00 0.00 C ATOM 0 H LEU A 304 3.169 -0.151 5.870 1.00 0.00 H new ATOM 0 HA LEU A 304 4.113 1.575 3.820 1.00 0.00 H new ATOM 0 HB2 LEU A 304 1.468 0.977 5.080 1.00 0.00 H new ATOM 0 HB3 LEU A 304 1.625 2.365 4.023 1.00 0.00 H new ATOM 0 HG LEU A 304 2.963 0.241 2.735 1.00 0.00 H new ATOM 0 HD11 LEU A 304 1.173 -1.453 2.497 1.00 0.00 H new ATOM 0 HD12 LEU A 304 1.796 -1.349 4.161 1.00 0.00 H new ATOM 0 HD13 LEU A 304 0.231 -0.607 3.749 1.00 0.00 H new ATOM 0 HD21 LEU A 304 1.208 0.466 1.020 1.00 0.00 H new ATOM 0 HD22 LEU A 304 0.256 1.463 2.146 1.00 0.00 H new ATOM 0 HD23 LEU A 304 1.838 2.038 1.568 1.00 0.00 H new ATOM 972 N LYS A 305 3.606 2.923 6.734 1.00 0.00 N ATOM 973 CA LYS A 305 3.884 4.133 7.487 1.00 0.00 C ATOM 974 C LYS A 305 5.339 4.538 7.237 1.00 0.00 C ATOM 975 O LYS A 305 5.701 5.710 7.345 1.00 0.00 O ATOM 976 CB LYS A 305 3.637 3.909 8.982 1.00 0.00 C ATOM 977 CG LYS A 305 2.577 4.829 9.567 1.00 0.00 C ATOM 978 CD LYS A 305 1.676 4.091 10.545 1.00 0.00 C ATOM 979 CE LYS A 305 0.382 3.647 9.882 1.00 0.00 C ATOM 980 NZ LYS A 305 -0.120 2.364 10.446 1.00 0.00 N ATOM 0 H LYS A 305 3.313 2.123 7.295 1.00 0.00 H new ATOM 0 HA LYS A 305 3.217 4.930 7.159 1.00 0.00 H new ATOM 0 HB2 LYS A 305 3.336 2.874 9.141 1.00 0.00 H new ATOM 0 HB3 LYS A 305 4.572 4.056 9.522 1.00 0.00 H new ATOM 0 HG2 LYS A 305 3.059 5.665 10.074 1.00 0.00 H new ATOM 0 HG3 LYS A 305 1.974 5.250 8.762 1.00 0.00 H new ATOM 0 HD2 LYS A 305 2.201 3.221 10.940 1.00 0.00 H new ATOM 0 HD3 LYS A 305 1.449 4.738 11.392 1.00 0.00 H new ATOM 0 HE2 LYS A 305 -0.375 4.421 10.010 1.00 0.00 H new ATOM 0 HE3 LYS A 305 0.544 3.534 8.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -1.004 2.096 9.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 0.591 1.619 10.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 -0.299 2.479 11.464 1.00 0.00 H new ATOM 994 N MET A 306 6.159 3.545 6.868 1.00 0.00 N ATOM 995 CA MET A 306 7.567 3.770 6.561 1.00 0.00 C ATOM 996 C MET A 306 7.686 4.559 5.268 1.00 0.00 C ATOM 997 O MET A 306 8.511 5.465 5.145 1.00 0.00 O ATOM 998 CB MET A 306 8.308 2.432 6.419 1.00 0.00 C ATOM 999 CG MET A 306 8.033 1.461 7.555 1.00 0.00 C ATOM 1000 SD MET A 306 9.243 1.586 8.886 1.00 0.00 S ATOM 1001 CE MET A 306 8.541 0.461 10.090 1.00 0.00 C ATOM 0 H MET A 306 5.863 2.573 6.776 1.00 0.00 H new ATOM 0 HA MET A 306 8.018 4.334 7.378 1.00 0.00 H new ATOM 0 HB2 MET A 306 8.022 1.966 5.476 1.00 0.00 H new ATOM 0 HB3 MET A 306 9.380 2.623 6.367 1.00 0.00 H new ATOM 0 HG2 MET A 306 7.037 1.650 7.956 1.00 0.00 H new ATOM 0 HG3 MET A 306 8.032 0.443 7.165 1.00 0.00 H new ATOM 0 HE1 MET A 306 9.178 0.430 10.974 1.00 0.00 H new ATOM 0 HE2 MET A 306 7.546 0.805 10.372 1.00 0.00 H new ATOM 0 HE3 MET A 306 8.471 -0.537 9.658 1.00 0.00 H new ATOM 1011 N ALA A 307 6.843 4.201 4.308 1.00 0.00 N ATOM 1012 CA ALA A 307 6.823 4.860 3.014 1.00 0.00 C ATOM 1013 C ALA A 307 6.225 6.256 3.131 1.00 0.00 C ATOM 1014 O ALA A 307 6.837 7.243 2.721 1.00 0.00 O ATOM 1015 CB ALA A 307 6.038 4.017 2.022 1.00 0.00 C ATOM 0 H ALA A 307 6.159 3.450 4.406 1.00 0.00 H new ATOM 0 HA ALA A 307 7.846 4.965 2.654 1.00 0.00 H new ATOM 0 HB1 ALA A 307 6.025 4.514 1.052 1.00 0.00 H new ATOM 0 HB2 ALA A 307 6.509 3.039 1.922 1.00 0.00 H new ATOM 0 HB3 ALA A 307 5.016 3.892 2.379 1.00 0.00 H new ATOM 1021 N GLY A 308 5.029 6.334 3.706 1.00 0.00 N ATOM 1022 CA GLY A 308 4.373 7.616 3.882 1.00 0.00 C ATOM 1023 C GLY A 308 3.104 7.754 3.062 1.00 0.00 C ATOM 1024 O GLY A 308 2.964 8.700 2.287 1.00 0.00 O ATOM 0 H GLY A 308 4.503 5.532 4.053 1.00 0.00 H new ATOM 0 HA2 GLY A 308 4.133 7.753 4.937 1.00 0.00 H new ATOM 0 HA3 GLY A 308 5.065 8.412 3.606 1.00 0.00 H new ATOM 1028 N HIS A 309 2.169 6.825 3.239 1.00 0.00 N ATOM 1029 CA HIS A 309 0.904 6.882 2.507 1.00 0.00 C ATOM 1030 C HIS A 309 -0.210 7.387 3.419 1.00 0.00 C ATOM 1031 O HIS A 309 -0.381 6.889 4.532 1.00 0.00 O ATOM 1032 CB HIS A 309 0.513 5.512 1.938 1.00 0.00 C ATOM 1033 CG HIS A 309 1.659 4.575 1.691 1.00 0.00 C ATOM 1034 ND1 HIS A 309 1.973 4.087 0.442 1.00 0.00 N ATOM 1035 CD2 HIS A 309 2.550 4.007 2.541 1.00 0.00 C ATOM 1036 CE1 HIS A 309 3.000 3.266 0.534 1.00 0.00 C ATOM 1037 NE2 HIS A 309 3.370 3.199 1.795 1.00 0.00 N ATOM 0 H HIS A 309 2.259 6.032 3.874 1.00 0.00 H new ATOM 0 HA HIS A 309 1.042 7.571 1.673 1.00 0.00 H new ATOM 0 HB2 HIS A 309 -0.184 5.035 2.627 1.00 0.00 H new ATOM 0 HB3 HIS A 309 -0.020 5.664 1.000 1.00 0.00 H new ATOM 0 HD1 HIS A 309 1.485 4.325 -0.422 1.00 0.00 H new ATOM 0 HD2 HIS A 309 2.604 4.162 3.608 1.00 0.00 H new ATOM 0 HE1 HIS A 309 3.460 2.737 -0.287 1.00 0.00 H new ATOM 1046 N THR A 310 -0.961 8.383 2.954 1.00 0.00 N ATOM 1047 CA THR A 310 -2.047 8.944 3.755 1.00 0.00 C ATOM 1048 C THR A 310 -3.371 8.208 3.531 1.00 0.00 C ATOM 1049 O THR A 310 -4.424 8.840 3.452 1.00 0.00 O ATOM 1050 CB THR A 310 -2.220 10.431 3.434 1.00 0.00 C ATOM 1051 OG1 THR A 310 -0.962 11.074 3.340 1.00 0.00 O ATOM 1052 CG2 THR A 310 -3.040 11.173 4.467 1.00 0.00 C ATOM 0 H THR A 310 -0.840 8.814 2.038 1.00 0.00 H new ATOM 0 HA THR A 310 -1.775 8.820 4.803 1.00 0.00 H new ATOM 0 HB THR A 310 -2.750 10.462 2.482 1.00 0.00 H new ATOM 0 HG1 THR A 310 -1.094 12.023 3.133 1.00 0.00 H new ATOM 0 HG21 THR A 310 -3.125 12.221 4.180 1.00 0.00 H new ATOM 0 HG22 THR A 310 -4.035 10.732 4.527 1.00 0.00 H new ATOM 0 HG23 THR A 310 -2.552 11.101 5.439 1.00 0.00 H new ATOM 1060 N ASN A 311 -3.320 6.873 3.445 1.00 0.00 N ATOM 1061 CA ASN A 311 -4.527 6.065 3.243 1.00 0.00 C ATOM 1062 C ASN A 311 -4.171 4.611 2.939 1.00 0.00 C ATOM 1063 O ASN A 311 -3.687 4.299 1.852 1.00 0.00 O ATOM 1064 CB ASN A 311 -5.377 6.622 2.096 1.00 0.00 C ATOM 1065 CG ASN A 311 -6.815 6.145 2.159 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -7.723 6.914 2.476 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -7.031 4.870 1.858 1.00 0.00 N ATOM 0 H ASN A 311 -2.458 6.332 3.512 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.100 6.108 4.169 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -5.357 7.711 2.128 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -4.939 6.323 1.144 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -7.978 4.493 1.884 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -6.249 4.267 1.600 1.00 0.00 H new ATOM 1074 N CYS A 312 -4.421 3.724 3.896 1.00 0.00 N ATOM 1075 CA CYS A 312 -4.134 2.302 3.711 1.00 0.00 C ATOM 1076 C CYS A 312 -5.145 1.422 4.450 1.00 0.00 C ATOM 1077 O CYS A 312 -5.613 1.784 5.529 1.00 0.00 O ATOM 1078 CB CYS A 312 -2.714 1.976 4.186 1.00 0.00 C ATOM 1079 SG CYS A 312 -1.419 2.877 3.306 1.00 0.00 S ATOM 0 H CYS A 312 -4.820 3.961 4.804 1.00 0.00 H new ATOM 0 HA CYS A 312 -4.215 2.088 2.645 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -2.638 2.199 5.250 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -2.540 0.906 4.071 1.00 0.00 H new ATOM 0 HG CYS A 312 -1.949 3.565 2.339 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.475 0.261 3.871 1.00 0.00 N ATOM 1086 CA ILE A 313 -6.423 -0.659 4.486 1.00 0.00 C ATOM 1087 C ILE A 313 -6.314 -2.035 3.845 1.00 0.00 C ATOM 1088 O ILE A 313 -6.561 -2.190 2.648 1.00 0.00 O ATOM 1089 CB ILE A 313 -7.876 -0.157 4.353 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -8.123 0.398 2.948 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -8.174 0.899 5.406 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -9.586 0.622 2.636 1.00 0.00 C ATOM 0 H ILE A 313 -5.097 -0.058 2.979 1.00 0.00 H new ATOM 0 HA ILE A 313 -6.173 -0.719 5.545 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.549 -0.999 4.513 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -7.588 1.341 2.839 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -7.705 -0.292 2.215 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -9.203 1.241 5.297 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -8.037 0.471 6.399 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -7.496 1.742 5.278 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -9.686 1.016 1.625 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -10.123 -0.323 2.712 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -10.004 1.335 3.346 1.00 0.00 H new ATOM 1104 N ARG A 314 -5.943 -3.031 4.638 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.803 -4.386 4.123 1.00 0.00 C ATOM 1106 C ARG A 314 -7.155 -4.933 3.700 1.00 0.00 C ATOM 1107 O ARG A 314 -8.030 -5.173 4.532 1.00 0.00 O ATOM 1108 CB ARG A 314 -5.155 -5.314 5.163 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.665 -5.572 4.915 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.841 -4.277 4.865 1.00 0.00 C ATOM 1111 NE ARG A 314 -3.479 -3.180 5.595 1.00 0.00 N ATOM 1112 CZ ARG A 314 -3.738 -3.206 6.901 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -3.368 -4.247 7.639 1.00 0.00 N ATOM 1114 NH2 ARG A 314 -4.360 -2.183 7.474 1.00 0.00 N ATOM 0 H ARG A 314 -5.735 -2.928 5.631 1.00 0.00 H new ATOM 0 HA ARG A 314 -5.149 -4.347 3.252 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -5.279 -4.877 6.154 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.684 -6.267 5.166 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -3.275 -6.216 5.704 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.545 -6.111 3.975 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -1.852 -4.462 5.285 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -2.696 -3.982 3.826 1.00 0.00 H new ATOM 0 HE ARG A 314 -3.741 -2.345 5.071 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -2.883 -5.032 7.206 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -3.569 -4.261 8.639 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -4.639 -1.378 6.914 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -4.559 -2.202 8.474 1.00 0.00 H new ATOM 1128 N LEU A 315 -7.311 -5.133 2.398 1.00 0.00 N ATOM 1129 CA LEU A 315 -8.544 -5.670 1.843 1.00 0.00 C ATOM 1130 C LEU A 315 -8.359 -7.143 1.536 1.00 0.00 C ATOM 1131 O LEU A 315 -7.452 -7.524 0.798 1.00 0.00 O ATOM 1132 CB LEU A 315 -8.948 -4.930 0.574 1.00 0.00 C ATOM 1133 CG LEU A 315 -10.452 -4.724 0.396 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -10.726 -3.558 -0.540 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -11.100 -5.996 -0.129 1.00 0.00 C ATOM 0 H LEU A 315 -6.593 -4.929 1.703 1.00 0.00 H new ATOM 0 HA LEU A 315 -9.337 -5.538 2.579 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -8.460 -3.955 0.569 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.568 -5.481 -0.286 1.00 0.00 H new ATOM 0 HG LEU A 315 -10.887 -4.489 1.368 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -11.802 -3.428 -0.654 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -10.292 -2.648 -0.125 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -10.280 -3.761 -1.514 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -12.171 -5.835 -0.251 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -10.660 -6.258 -1.091 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -10.933 -6.808 0.579 1.00 0.00 H new ATOM 1147 N ALA A 316 -9.201 -7.968 2.119 1.00 0.00 N ATOM 1148 CA ALA A 316 -9.107 -9.408 1.928 1.00 0.00 C ATOM 1149 C ALA A 316 -9.866 -9.873 0.695 1.00 0.00 C ATOM 1150 O ALA A 316 -10.928 -9.347 0.363 1.00 0.00 O ATOM 1151 CB ALA A 316 -9.597 -10.132 3.169 1.00 0.00 C ATOM 0 H ALA A 316 -9.961 -7.671 2.731 1.00 0.00 H new ATOM 0 HA ALA A 316 -8.057 -9.653 1.765 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -9.522 -11.209 3.015 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -8.985 -9.844 4.024 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -10.636 -9.864 3.360 1.00 0.00 H new ATOM 1157 N ALA A 317 -9.302 -10.871 0.022 1.00 0.00 N ATOM 1158 CA ALA A 317 -9.901 -11.430 -1.180 1.00 0.00 C ATOM 1159 C ALA A 317 -11.207 -12.149 -0.861 1.00 0.00 C ATOM 1160 O ALA A 317 -12.147 -12.133 -1.656 1.00 0.00 O ATOM 1161 CB ALA A 317 -8.918 -12.379 -1.851 1.00 0.00 C ATOM 0 H ALA A 317 -8.423 -11.311 0.294 1.00 0.00 H new ATOM 0 HA ALA A 317 -10.132 -10.613 -1.864 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.371 -12.795 -2.751 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -8.012 -11.835 -2.119 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.666 -13.187 -1.164 1.00 0.00 H new