USER MOD reduce.3.24.130724 H: found=0, std=0, add=501, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 502 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 354 THR OG1 : rot -20:sc= -1.63 USER MOD Set 1.2: A 358 ASN : amide:sc= -0.603 K(o=-2.2,f=-3.4) USER MOD Single : A 315 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 ASN : amide:sc= -0.0511 X(o=-0.051,f=0) USER MOD Single : A 324 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 329 LYS NZ :NH3+ -162:sc=-0.00649 (180deg=-0.149) USER MOD Single : A 330 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 334 MET CE :methyl 141:sc= -3.16! (180deg=-7.51!) USER MOD Single : A 338 SER OG : rot 178:sc= 0.252 USER MOD Single : A 339 LYS NZ :NH3+ -159:sc= -0.124 (180deg=-1.05) USER MOD Single : A 340 LYS NZ :NH3+ -175:sc= -0.916 (180deg=-0.992) USER MOD Single : A 347 SER OG : rot 180:sc= 0 USER MOD Single : A 351 LYS NZ :NH3+ -117:sc= 0 (180deg=-0.61) USER MOD Single : A 355 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 356 ASN : amide:sc= -0.31 K(o=-0.31,f=-1.5!) USER MOD Single : A 361 TYR OH : rot 180:sc= 0 USER MOD Single : A 364 TYR OH : rot 180:sc= 0 USER MOD Single : A 365 ASN : amide:sc= -0.0805 K(o=-0.081,f=-2.2!) USER MOD Single : A 366 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 310 7.304 12.621 -3.755 1.00 0.00 N ATOM 2 CA PHE A 310 6.188 11.763 -3.431 1.00 0.00 C ATOM 3 C PHE A 310 6.349 11.213 -2.014 1.00 0.00 C ATOM 4 O PHE A 310 6.034 11.895 -1.036 1.00 0.00 O ATOM 5 CB PHE A 310 6.060 10.609 -4.433 1.00 0.00 C ATOM 6 CG PHE A 310 5.270 10.918 -5.631 1.00 0.00 C ATOM 7 CD1 PHE A 310 3.904 11.017 -5.556 1.00 0.00 C ATOM 8 CD2 PHE A 310 5.895 11.073 -6.841 1.00 0.00 C ATOM 9 CE1 PHE A 310 3.167 11.273 -6.675 1.00 0.00 C ATOM 10 CE2 PHE A 310 5.172 11.325 -7.968 1.00 0.00 C ATOM 11 CZ PHE A 310 3.796 11.429 -7.896 1.00 0.00 C ATOM 0 HA PHE A 310 5.276 12.358 -3.488 1.00 0.00 H new ATOM 0 HB2 PHE A 310 7.059 10.303 -4.743 1.00 0.00 H new ATOM 0 HB3 PHE A 310 5.608 9.756 -3.927 1.00 0.00 H new ATOM 0 HD1 PHE A 310 3.409 10.891 -4.605 1.00 0.00 H new ATOM 0 HD2 PHE A 310 6.970 10.995 -6.902 1.00 0.00 H new ATOM 0 HE1 PHE A 310 2.092 11.354 -6.607 1.00 0.00 H new ATOM 0 HE2 PHE A 310 5.674 11.443 -8.917 1.00 0.00 H new ATOM 0 HZ PHE A 310 3.217 11.630 -8.785 1.00 0.00 H new ATOM 21 N ALA A 311 6.855 9.987 -1.906 1.00 0.00 N ATOM 22 CA ALA A 311 7.068 9.368 -0.608 1.00 0.00 C ATOM 23 C ALA A 311 8.383 8.613 -0.573 1.00 0.00 C ATOM 24 O ALA A 311 8.918 8.209 -1.606 1.00 0.00 O ATOM 25 CB ALA A 311 5.925 8.427 -0.267 1.00 0.00 C ATOM 0 H ALA A 311 7.123 9.407 -2.701 1.00 0.00 H new ATOM 0 HA ALA A 311 7.105 10.164 0.135 1.00 0.00 H new ATOM 0 HB1 ALA A 311 6.105 7.975 0.708 1.00 0.00 H new ATOM 0 HB2 ALA A 311 4.989 8.985 -0.241 1.00 0.00 H new ATOM 0 HB3 ALA A 311 5.860 7.645 -1.023 1.00 0.00 H new ATOM 31 N ARG A 312 8.894 8.417 0.626 1.00 0.00 N ATOM 32 CA ARG A 312 10.138 7.701 0.809 1.00 0.00 C ATOM 33 C ARG A 312 9.952 6.587 1.820 1.00 0.00 C ATOM 34 O ARG A 312 8.980 6.578 2.569 1.00 0.00 O ATOM 35 CB ARG A 312 11.230 8.655 1.284 1.00 0.00 C ATOM 36 CG ARG A 312 12.626 8.112 1.101 1.00 0.00 C ATOM 37 CD ARG A 312 13.536 8.585 2.213 1.00 0.00 C ATOM 38 NE ARG A 312 13.970 9.967 2.019 1.00 0.00 N ATOM 39 CZ ARG A 312 14.193 10.816 3.017 1.00 0.00 C ATOM 40 NH1 ARG A 312 14.018 10.429 4.273 1.00 0.00 N ATOM 41 NH2 ARG A 312 14.593 12.054 2.760 1.00 0.00 N ATOM 0 H ARG A 312 8.464 8.746 1.491 1.00 0.00 H new ATOM 0 HA ARG A 312 10.437 7.269 -0.146 1.00 0.00 H new ATOM 0 HB2 ARG A 312 11.141 9.596 0.741 1.00 0.00 H new ATOM 0 HB3 ARG A 312 11.072 8.880 2.339 1.00 0.00 H new ATOM 0 HG2 ARG A 312 12.598 7.022 1.086 1.00 0.00 H new ATOM 0 HG3 ARG A 312 13.023 8.434 0.138 1.00 0.00 H new ATOM 0 HD2 ARG A 312 13.016 8.500 3.167 1.00 0.00 H new ATOM 0 HD3 ARG A 312 14.410 7.935 2.267 1.00 0.00 H new ATOM 0 HE ARG A 312 14.110 10.298 1.065 1.00 0.00 H new ATOM 0 HH11 ARG A 312 13.711 9.477 4.475 1.00 0.00 H new ATOM 0 HH12 ARG A 312 14.190 11.083 5.037 1.00 0.00 H new ATOM 0 HH21 ARG A 312 14.730 12.356 1.795 1.00 0.00 H new ATOM 0 HH22 ARG A 312 14.764 12.704 3.527 1.00 0.00 H new ATOM 55 N ALA A 313 10.883 5.654 1.842 1.00 0.00 N ATOM 56 CA ALA A 313 10.802 4.542 2.794 1.00 0.00 C ATOM 57 C ALA A 313 11.743 4.772 3.968 1.00 0.00 C ATOM 58 O ALA A 313 12.889 5.186 3.793 1.00 0.00 O ATOM 59 CB ALA A 313 11.118 3.209 2.130 1.00 0.00 C ATOM 0 H ALA A 313 11.696 5.634 1.226 1.00 0.00 H new ATOM 0 HA ALA A 313 9.776 4.502 3.160 1.00 0.00 H new ATOM 0 HB1 ALA A 313 11.048 2.409 2.867 1.00 0.00 H new ATOM 0 HB2 ALA A 313 10.405 3.025 1.326 1.00 0.00 H new ATOM 0 HB3 ALA A 313 12.128 3.237 1.720 1.00 0.00 H new ATOM 65 N LEU A 314 11.243 4.502 5.169 1.00 0.00 N ATOM 66 CA LEU A 314 12.020 4.674 6.386 1.00 0.00 C ATOM 67 C LEU A 314 12.878 3.443 6.635 1.00 0.00 C ATOM 68 O LEU A 314 14.094 3.535 6.797 1.00 0.00 O ATOM 69 CB LEU A 314 11.091 4.910 7.579 1.00 0.00 C ATOM 70 CG LEU A 314 10.968 6.364 8.039 1.00 0.00 C ATOM 71 CD1 LEU A 314 12.327 6.917 8.438 1.00 0.00 C ATOM 72 CD2 LEU A 314 10.340 7.219 6.949 1.00 0.00 C ATOM 0 H LEU A 314 10.294 4.160 5.324 1.00 0.00 H new ATOM 0 HA LEU A 314 12.668 5.542 6.267 1.00 0.00 H new ATOM 0 HB2 LEU A 314 10.097 4.543 7.322 1.00 0.00 H new ATOM 0 HB3 LEU A 314 11.445 4.310 8.418 1.00 0.00 H new ATOM 0 HG LEU A 314 10.318 6.392 8.913 1.00 0.00 H new ATOM 0 HD11 LEU A 314 12.218 7.952 8.762 1.00 0.00 H new ATOM 0 HD12 LEU A 314 12.736 6.322 9.255 1.00 0.00 H new ATOM 0 HD13 LEU A 314 13.003 6.874 7.584 1.00 0.00 H new ATOM 0 HD21 LEU A 314 10.261 8.250 7.295 1.00 0.00 H new ATOM 0 HD22 LEU A 314 10.962 7.183 6.055 1.00 0.00 H new ATOM 0 HD23 LEU A 314 9.346 6.838 6.715 1.00 0.00 H new ATOM 84 N TYR A 315 12.223 2.286 6.654 1.00 0.00 N ATOM 85 CA TYR A 315 12.901 1.018 6.873 1.00 0.00 C ATOM 86 C TYR A 315 12.436 -0.011 5.849 1.00 0.00 C ATOM 87 O TYR A 315 11.315 0.068 5.344 1.00 0.00 O ATOM 88 CB TYR A 315 12.636 0.503 8.290 1.00 0.00 C ATOM 89 CG TYR A 315 12.314 1.594 9.289 1.00 0.00 C ATOM 90 CD1 TYR A 315 13.324 2.364 9.852 1.00 0.00 C ATOM 91 CD2 TYR A 315 11.002 1.855 9.666 1.00 0.00 C ATOM 92 CE1 TYR A 315 13.035 3.361 10.764 1.00 0.00 C ATOM 93 CE2 TYR A 315 10.706 2.852 10.577 1.00 0.00 C ATOM 94 CZ TYR A 315 11.726 3.602 11.121 1.00 0.00 C ATOM 95 OH TYR A 315 11.437 4.596 12.027 1.00 0.00 O ATOM 0 H TYR A 315 11.215 2.203 6.519 1.00 0.00 H new ATOM 0 HA TYR A 315 13.973 1.177 6.756 1.00 0.00 H new ATOM 0 HB2 TYR A 315 11.807 -0.205 8.260 1.00 0.00 H new ATOM 0 HB3 TYR A 315 13.512 -0.046 8.636 1.00 0.00 H new ATOM 0 HD1 TYR A 315 14.351 2.181 9.573 1.00 0.00 H new ATOM 0 HD2 TYR A 315 10.201 1.269 9.240 1.00 0.00 H new ATOM 0 HE1 TYR A 315 13.832 3.949 11.195 1.00 0.00 H new ATOM 0 HE2 TYR A 315 9.681 3.042 10.861 1.00 0.00 H new ATOM 0 HH TYR A 315 10.468 4.637 12.169 1.00 0.00 H new ATOM 105 N ASP A 316 13.302 -0.971 5.546 1.00 0.00 N ATOM 106 CA ASP A 316 12.986 -2.017 4.578 1.00 0.00 C ATOM 107 C ASP A 316 11.637 -2.661 4.888 1.00 0.00 C ATOM 108 O ASP A 316 11.510 -3.412 5.856 1.00 0.00 O ATOM 109 CB ASP A 316 14.092 -3.080 4.581 1.00 0.00 C ATOM 110 CG ASP A 316 13.645 -4.400 3.981 1.00 0.00 C ATOM 111 OD1 ASP A 316 13.068 -5.224 4.720 1.00 0.00 O ATOM 112 OD2 ASP A 316 13.881 -4.613 2.773 1.00 0.00 O ATOM 0 H ASP A 316 14.232 -1.047 5.958 1.00 0.00 H new ATOM 0 HA ASP A 316 12.925 -1.563 3.589 1.00 0.00 H new ATOM 0 HB2 ASP A 316 14.950 -2.705 4.023 1.00 0.00 H new ATOM 0 HB3 ASP A 316 14.426 -3.247 5.605 1.00 0.00 H new ATOM 117 N PHE A 317 10.626 -2.366 4.066 1.00 0.00 N ATOM 118 CA PHE A 317 9.306 -2.925 4.278 1.00 0.00 C ATOM 119 C PHE A 317 9.180 -4.301 3.617 1.00 0.00 C ATOM 120 O PHE A 317 10.072 -4.723 2.879 1.00 0.00 O ATOM 121 CB PHE A 317 8.218 -1.974 3.768 1.00 0.00 C ATOM 122 CG PHE A 317 6.829 -2.393 4.152 1.00 0.00 C ATOM 123 CD1 PHE A 317 6.399 -2.319 5.469 1.00 0.00 C ATOM 124 CD2 PHE A 317 5.958 -2.877 3.193 1.00 0.00 C ATOM 125 CE1 PHE A 317 5.128 -2.725 5.818 1.00 0.00 C ATOM 126 CE2 PHE A 317 4.682 -3.279 3.535 1.00 0.00 C ATOM 127 CZ PHE A 317 4.267 -3.203 4.849 1.00 0.00 C ATOM 0 H PHE A 317 10.703 -1.749 3.258 1.00 0.00 H new ATOM 0 HA PHE A 317 9.166 -3.052 5.351 1.00 0.00 H new ATOM 0 HB2 PHE A 317 8.408 -0.974 4.158 1.00 0.00 H new ATOM 0 HB3 PHE A 317 8.282 -1.910 2.682 1.00 0.00 H new ATOM 0 HD1 PHE A 317 7.066 -1.940 6.229 1.00 0.00 H new ATOM 0 HD2 PHE A 317 6.280 -2.941 2.164 1.00 0.00 H new ATOM 0 HE1 PHE A 317 4.806 -2.669 6.847 1.00 0.00 H new ATOM 0 HE2 PHE A 317 4.010 -3.652 2.776 1.00 0.00 H new ATOM 0 HZ PHE A 317 3.270 -3.517 5.120 1.00 0.00 H new ATOM 137 N VAL A 318 8.075 -4.999 3.891 1.00 0.00 N ATOM 138 CA VAL A 318 7.837 -6.326 3.337 1.00 0.00 C ATOM 139 C VAL A 318 6.338 -6.638 3.331 1.00 0.00 C ATOM 140 O VAL A 318 5.612 -6.220 4.233 1.00 0.00 O ATOM 141 CB VAL A 318 8.601 -7.405 4.147 1.00 0.00 C ATOM 142 CG1 VAL A 318 7.836 -8.722 4.193 1.00 0.00 C ATOM 143 CG2 VAL A 318 9.992 -7.618 3.571 1.00 0.00 C ATOM 0 H VAL A 318 7.329 -4.660 4.498 1.00 0.00 H new ATOM 0 HA VAL A 318 8.206 -6.338 2.311 1.00 0.00 H new ATOM 0 HB VAL A 318 8.695 -7.042 5.171 1.00 0.00 H new ATOM 0 HG11 VAL A 318 8.404 -9.453 4.769 1.00 0.00 H new ATOM 0 HG12 VAL A 318 6.866 -8.563 4.664 1.00 0.00 H new ATOM 0 HG13 VAL A 318 7.691 -9.094 3.179 1.00 0.00 H new ATOM 0 HG21 VAL A 318 10.514 -8.379 4.152 1.00 0.00 H new ATOM 0 HG22 VAL A 318 9.910 -7.946 2.535 1.00 0.00 H new ATOM 0 HG23 VAL A 318 10.550 -6.683 3.613 1.00 0.00 H new ATOM 153 N PRO A 319 5.854 -7.372 2.312 1.00 0.00 N ATOM 154 CA PRO A 319 4.435 -7.731 2.195 1.00 0.00 C ATOM 155 C PRO A 319 3.851 -8.281 3.490 1.00 0.00 C ATOM 156 O PRO A 319 4.011 -9.463 3.799 1.00 0.00 O ATOM 157 CB PRO A 319 4.437 -8.811 1.117 1.00 0.00 C ATOM 158 CG PRO A 319 5.604 -8.478 0.261 1.00 0.00 C ATOM 159 CD PRO A 319 6.647 -7.908 1.185 1.00 0.00 C ATOM 0 HA PRO A 319 3.820 -6.863 1.960 1.00 0.00 H new ATOM 0 HB2 PRO A 319 4.534 -9.806 1.552 1.00 0.00 H new ATOM 0 HB3 PRO A 319 3.509 -8.803 0.545 1.00 0.00 H new ATOM 0 HG2 PRO A 319 5.978 -9.365 -0.250 1.00 0.00 H new ATOM 0 HG3 PRO A 319 5.330 -7.758 -0.510 1.00 0.00 H new ATOM 0 HD2 PRO A 319 7.350 -8.672 1.517 1.00 0.00 H new ATOM 0 HD3 PRO A 319 7.231 -7.127 0.698 1.00 0.00 H new ATOM 167 N GLU A 320 3.159 -7.424 4.238 1.00 0.00 N ATOM 168 CA GLU A 320 2.538 -7.842 5.487 1.00 0.00 C ATOM 169 C GLU A 320 1.616 -9.023 5.233 1.00 0.00 C ATOM 170 O GLU A 320 1.456 -9.896 6.085 1.00 0.00 O ATOM 171 CB GLU A 320 1.755 -6.692 6.120 1.00 0.00 C ATOM 172 CG GLU A 320 1.619 -6.807 7.629 1.00 0.00 C ATOM 173 CD GLU A 320 0.897 -5.624 8.242 1.00 0.00 C ATOM 174 OE1 GLU A 320 1.539 -4.568 8.427 1.00 0.00 O ATOM 175 OE2 GLU A 320 -0.310 -5.752 8.537 1.00 0.00 O ATOM 0 H GLU A 320 3.016 -6.442 4.001 1.00 0.00 H new ATOM 0 HA GLU A 320 3.324 -8.140 6.181 1.00 0.00 H new ATOM 0 HB2 GLU A 320 2.249 -5.751 5.879 1.00 0.00 H new ATOM 0 HB3 GLU A 320 0.760 -6.653 5.676 1.00 0.00 H new ATOM 0 HG2 GLU A 320 1.080 -7.723 7.873 1.00 0.00 H new ATOM 0 HG3 GLU A 320 2.610 -6.893 8.074 1.00 0.00 H new ATOM 182 N ASN A 321 1.027 -9.054 4.038 1.00 0.00 N ATOM 183 CA ASN A 321 0.140 -10.135 3.654 1.00 0.00 C ATOM 184 C ASN A 321 0.582 -10.703 2.312 1.00 0.00 C ATOM 185 O ASN A 321 0.805 -9.952 1.363 1.00 0.00 O ATOM 186 CB ASN A 321 -1.304 -9.635 3.569 1.00 0.00 C ATOM 187 CG ASN A 321 -2.270 -10.520 4.333 1.00 0.00 C ATOM 188 OD1 ASN A 321 -2.464 -10.351 5.537 1.00 0.00 O ATOM 189 ND2 ASN A 321 -2.880 -11.471 3.636 1.00 0.00 N ATOM 0 H ASN A 321 1.153 -8.338 3.322 1.00 0.00 H new ATOM 0 HA ASN A 321 0.187 -10.920 4.409 1.00 0.00 H new ATOM 0 HB2 ASN A 321 -1.357 -8.620 3.962 1.00 0.00 H new ATOM 0 HB3 ASN A 321 -1.608 -9.588 2.523 1.00 0.00 H new ATOM 0 HD21 ASN A 321 -3.540 -12.098 4.097 1.00 0.00 H new ATOM 0 HD22 ASN A 321 -2.689 -11.575 2.639 1.00 0.00 H new ATOM 196 N PRO A 322 0.725 -12.036 2.207 1.00 0.00 N ATOM 197 CA PRO A 322 1.147 -12.678 0.962 1.00 0.00 C ATOM 198 C PRO A 322 0.020 -12.715 -0.060 1.00 0.00 C ATOM 199 O PRO A 322 -0.175 -13.710 -0.758 1.00 0.00 O ATOM 200 CB PRO A 322 1.524 -14.090 1.405 1.00 0.00 C ATOM 201 CG PRO A 322 0.678 -14.348 2.603 1.00 0.00 C ATOM 202 CD PRO A 322 0.495 -13.017 3.286 1.00 0.00 C ATOM 0 HA PRO A 322 1.963 -12.146 0.472 1.00 0.00 H new ATOM 0 HB2 PRO A 322 1.328 -14.818 0.618 1.00 0.00 H new ATOM 0 HB3 PRO A 322 2.585 -14.159 1.647 1.00 0.00 H new ATOM 0 HG2 PRO A 322 -0.284 -14.773 2.316 1.00 0.00 H new ATOM 0 HG3 PRO A 322 1.157 -15.065 3.270 1.00 0.00 H new ATOM 0 HD2 PRO A 322 -0.504 -12.919 3.710 1.00 0.00 H new ATOM 0 HD3 PRO A 322 1.203 -12.886 4.104 1.00 0.00 H new ATOM 210 N GLU A 323 -0.720 -11.616 -0.137 1.00 0.00 N ATOM 211 CA GLU A 323 -1.832 -11.501 -1.064 1.00 0.00 C ATOM 212 C GLU A 323 -1.790 -10.157 -1.780 1.00 0.00 C ATOM 213 O GLU A 323 -2.053 -10.077 -2.981 1.00 0.00 O ATOM 214 CB GLU A 323 -3.159 -11.666 -0.315 1.00 0.00 C ATOM 215 CG GLU A 323 -4.367 -11.151 -1.083 1.00 0.00 C ATOM 216 CD GLU A 323 -5.683 -11.597 -0.475 1.00 0.00 C ATOM 217 OE1 GLU A 323 -5.659 -12.227 0.604 1.00 0.00 O ATOM 218 OE2 GLU A 323 -6.740 -11.316 -1.079 1.00 0.00 O ATOM 0 H GLU A 323 -0.566 -10.787 0.437 1.00 0.00 H new ATOM 0 HA GLU A 323 -1.750 -12.291 -1.810 1.00 0.00 H new ATOM 0 HB2 GLU A 323 -3.308 -12.722 -0.088 1.00 0.00 H new ATOM 0 HB3 GLU A 323 -3.095 -11.141 0.638 1.00 0.00 H new ATOM 0 HG2 GLU A 323 -4.336 -10.062 -1.112 1.00 0.00 H new ATOM 0 HG3 GLU A 323 -4.312 -11.499 -2.114 1.00 0.00 H new ATOM 225 N MET A 324 -1.460 -9.096 -1.042 1.00 0.00 N ATOM 226 CA MET A 324 -1.395 -7.767 -1.635 1.00 0.00 C ATOM 227 C MET A 324 -0.563 -6.790 -0.806 1.00 0.00 C ATOM 228 O MET A 324 -1.055 -6.213 0.165 1.00 0.00 O ATOM 229 CB MET A 324 -2.806 -7.210 -1.756 1.00 0.00 C ATOM 230 CG MET A 324 -2.913 -6.003 -2.673 1.00 0.00 C ATOM 231 SD MET A 324 -4.602 -5.703 -3.233 1.00 0.00 S ATOM 232 CE MET A 324 -4.576 -6.489 -4.842 1.00 0.00 C ATOM 0 H MET A 324 -1.237 -9.133 -0.047 1.00 0.00 H new ATOM 0 HA MET A 324 -0.917 -7.871 -2.609 1.00 0.00 H new ATOM 0 HB2 MET A 324 -3.466 -7.995 -2.126 1.00 0.00 H new ATOM 0 HB3 MET A 324 -3.164 -6.934 -0.764 1.00 0.00 H new ATOM 0 HG2 MET A 324 -2.546 -5.120 -2.150 1.00 0.00 H new ATOM 0 HG3 MET A 324 -2.268 -6.151 -3.539 1.00 0.00 H new ATOM 0 HE1 MET A 324 -5.554 -6.386 -5.313 1.00 0.00 H new ATOM 0 HE2 MET A 324 -3.820 -6.013 -5.467 1.00 0.00 H new ATOM 0 HE3 MET A 324 -4.338 -7.546 -4.727 1.00 0.00 H new ATOM 242 N GLU A 325 0.679 -6.568 -1.224 1.00 0.00 N ATOM 243 CA GLU A 325 1.555 -5.613 -0.551 1.00 0.00 C ATOM 244 C GLU A 325 2.820 -5.359 -1.356 1.00 0.00 C ATOM 245 O GLU A 325 3.115 -6.074 -2.314 1.00 0.00 O ATOM 246 CB GLU A 325 1.894 -6.042 0.871 1.00 0.00 C ATOM 247 CG GLU A 325 2.002 -4.866 1.825 1.00 0.00 C ATOM 248 CD GLU A 325 1.422 -5.168 3.192 1.00 0.00 C ATOM 249 OE1 GLU A 325 0.752 -6.213 3.336 1.00 0.00 O ATOM 250 OE2 GLU A 325 1.632 -4.358 4.118 1.00 0.00 O ATOM 0 H GLU A 325 1.102 -7.036 -2.025 1.00 0.00 H new ATOM 0 HA GLU A 325 1.001 -4.677 -0.482 1.00 0.00 H new ATOM 0 HB2 GLU A 325 1.128 -6.729 1.232 1.00 0.00 H new ATOM 0 HB3 GLU A 325 2.837 -6.589 0.867 1.00 0.00 H new ATOM 0 HG2 GLU A 325 3.050 -4.586 1.933 1.00 0.00 H new ATOM 0 HG3 GLU A 325 1.485 -4.007 1.397 1.00 0.00 H new ATOM 257 N VAL A 326 3.562 -4.332 -0.963 1.00 0.00 N ATOM 258 CA VAL A 326 4.798 -3.975 -1.652 1.00 0.00 C ATOM 259 C VAL A 326 6.016 -4.201 -0.756 1.00 0.00 C ATOM 260 O VAL A 326 5.920 -4.144 0.469 1.00 0.00 O ATOM 261 CB VAL A 326 4.761 -2.505 -2.145 1.00 0.00 C ATOM 262 CG1 VAL A 326 3.705 -1.698 -1.407 1.00 0.00 C ATOM 263 CG2 VAL A 326 6.124 -1.849 -2.008 1.00 0.00 C ATOM 0 H VAL A 326 3.331 -3.731 -0.172 1.00 0.00 H new ATOM 0 HA VAL A 326 4.885 -4.627 -2.521 1.00 0.00 H new ATOM 0 HB VAL A 326 4.493 -2.523 -3.201 1.00 0.00 H new ATOM 0 HG11 VAL A 326 3.706 -0.673 -1.777 1.00 0.00 H new ATOM 0 HG12 VAL A 326 2.724 -2.143 -1.574 1.00 0.00 H new ATOM 0 HG13 VAL A 326 3.927 -1.699 -0.340 1.00 0.00 H new ATOM 0 HG21 VAL A 326 6.069 -0.819 -2.361 1.00 0.00 H new ATOM 0 HG22 VAL A 326 6.429 -1.858 -0.962 1.00 0.00 H new ATOM 0 HG23 VAL A 326 6.854 -2.398 -2.603 1.00 0.00 H new ATOM 273 N ALA A 327 7.166 -4.439 -1.386 1.00 0.00 N ATOM 274 CA ALA A 327 8.412 -4.654 -0.662 1.00 0.00 C ATOM 275 C ALA A 327 9.268 -3.398 -0.742 1.00 0.00 C ATOM 276 O ALA A 327 9.403 -2.799 -1.809 1.00 0.00 O ATOM 277 CB ALA A 327 9.161 -5.850 -1.229 1.00 0.00 C ATOM 0 H ALA A 327 7.257 -4.487 -2.401 1.00 0.00 H new ATOM 0 HA ALA A 327 8.186 -4.865 0.383 1.00 0.00 H new ATOM 0 HB1 ALA A 327 10.089 -5.994 -0.675 1.00 0.00 H new ATOM 0 HB2 ALA A 327 8.542 -6.743 -1.139 1.00 0.00 H new ATOM 0 HB3 ALA A 327 9.390 -5.671 -2.280 1.00 0.00 H new ATOM 283 N LEU A 328 9.819 -2.979 0.391 1.00 0.00 N ATOM 284 CA LEU A 328 10.625 -1.768 0.434 1.00 0.00 C ATOM 285 C LEU A 328 12.008 -2.016 1.010 1.00 0.00 C ATOM 286 O LEU A 328 12.168 -2.792 1.949 1.00 0.00 O ATOM 287 CB LEU A 328 9.917 -0.713 1.276 1.00 0.00 C ATOM 288 CG LEU A 328 8.808 0.064 0.557 1.00 0.00 C ATOM 289 CD1 LEU A 328 8.406 1.292 1.355 1.00 0.00 C ATOM 290 CD2 LEU A 328 9.242 0.461 -0.844 1.00 0.00 C ATOM 0 H LEU A 328 9.723 -3.458 1.287 1.00 0.00 H new ATOM 0 HA LEU A 328 10.747 -1.423 -0.593 1.00 0.00 H new ATOM 0 HB2 LEU A 328 9.488 -1.199 2.152 1.00 0.00 H new ATOM 0 HB3 LEU A 328 10.660 -0.002 1.638 1.00 0.00 H new ATOM 0 HG LEU A 328 7.941 -0.592 0.473 1.00 0.00 H new ATOM 0 HD11 LEU A 328 7.618 1.828 0.826 1.00 0.00 H new ATOM 0 HD12 LEU A 328 8.041 0.985 2.335 1.00 0.00 H new ATOM 0 HD13 LEU A 328 9.270 1.945 1.477 1.00 0.00 H new ATOM 0 HD21 LEU A 328 8.437 1.011 -1.332 1.00 0.00 H new ATOM 0 HD22 LEU A 328 10.129 1.092 -0.785 1.00 0.00 H new ATOM 0 HD23 LEU A 328 9.472 -0.435 -1.421 1.00 0.00 H new ATOM 302 N LYS A 329 13.000 -1.323 0.455 1.00 0.00 N ATOM 303 CA LYS A 329 14.374 -1.439 0.924 1.00 0.00 C ATOM 304 C LYS A 329 14.829 -0.119 1.547 1.00 0.00 C ATOM 305 O LYS A 329 15.153 0.831 0.838 1.00 0.00 O ATOM 306 CB LYS A 329 15.299 -1.821 -0.232 1.00 0.00 C ATOM 307 CG LYS A 329 14.658 -2.766 -1.238 1.00 0.00 C ATOM 308 CD LYS A 329 14.600 -2.148 -2.626 1.00 0.00 C ATOM 309 CE LYS A 329 14.524 -3.211 -3.710 1.00 0.00 C ATOM 310 NZ LYS A 329 15.817 -3.932 -3.872 1.00 0.00 N ATOM 0 H LYS A 329 12.875 -0.674 -0.322 1.00 0.00 H new ATOM 0 HA LYS A 329 14.420 -2.222 1.681 1.00 0.00 H new ATOM 0 HB2 LYS A 329 15.615 -0.915 -0.748 1.00 0.00 H new ATOM 0 HB3 LYS A 329 16.197 -2.288 0.172 1.00 0.00 H new ATOM 0 HG2 LYS A 329 15.224 -3.697 -1.276 1.00 0.00 H new ATOM 0 HG3 LYS A 329 13.650 -3.020 -0.909 1.00 0.00 H new ATOM 0 HD2 LYS A 329 13.732 -1.493 -2.697 1.00 0.00 H new ATOM 0 HD3 LYS A 329 15.482 -1.527 -2.786 1.00 0.00 H new ATOM 0 HE2 LYS A 329 13.738 -3.925 -3.464 1.00 0.00 H new ATOM 0 HE3 LYS A 329 14.247 -2.746 -4.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 329 15.831 -4.417 -4.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 329 16.602 -3.251 -3.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 329 15.922 -4.632 -3.110 1.00 0.00 H new ATOM 324 N LYS A 330 14.845 -0.091 2.879 1.00 0.00 N ATOM 325 CA LYS A 330 15.245 1.083 3.661 1.00 0.00 C ATOM 326 C LYS A 330 15.060 2.409 2.914 1.00 0.00 C ATOM 327 O LYS A 330 13.979 2.995 2.939 1.00 0.00 O ATOM 328 CB LYS A 330 16.690 0.944 4.129 1.00 0.00 C ATOM 329 CG LYS A 330 16.975 1.723 5.399 1.00 0.00 C ATOM 330 CD LYS A 330 17.348 0.797 6.545 1.00 0.00 C ATOM 331 CE LYS A 330 17.840 1.576 7.753 1.00 0.00 C ATOM 332 NZ LYS A 330 19.274 1.300 8.045 1.00 0.00 N ATOM 0 H LYS A 330 14.578 -0.890 3.454 1.00 0.00 H new ATOM 0 HA LYS A 330 14.577 1.115 4.522 1.00 0.00 H new ATOM 0 HB2 LYS A 330 16.913 -0.110 4.297 1.00 0.00 H new ATOM 0 HB3 LYS A 330 17.357 1.289 3.339 1.00 0.00 H new ATOM 0 HG2 LYS A 330 17.786 2.429 5.221 1.00 0.00 H new ATOM 0 HG3 LYS A 330 16.098 2.309 5.673 1.00 0.00 H new ATOM 0 HD2 LYS A 330 16.482 0.197 6.826 1.00 0.00 H new ATOM 0 HD3 LYS A 330 18.123 0.104 6.217 1.00 0.00 H new ATOM 0 HE2 LYS A 330 17.704 2.643 7.577 1.00 0.00 H new ATOM 0 HE3 LYS A 330 17.236 1.317 8.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 19.571 1.850 8.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 19.400 0.286 8.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 19.854 1.571 7.225 1.00 0.00 H new ATOM 346 N GLY A 331 16.131 2.893 2.283 1.00 0.00 N ATOM 347 CA GLY A 331 16.075 4.165 1.573 1.00 0.00 C ATOM 348 C GLY A 331 15.293 4.121 0.271 1.00 0.00 C ATOM 349 O GLY A 331 15.546 4.918 -0.633 1.00 0.00 O ATOM 0 H GLY A 331 17.038 2.427 2.251 1.00 0.00 H new ATOM 0 HA2 GLY A 331 15.627 4.913 2.227 1.00 0.00 H new ATOM 0 HA3 GLY A 331 17.092 4.495 1.361 1.00 0.00 H new ATOM 353 N ASP A 332 14.344 3.200 0.166 1.00 0.00 N ATOM 354 CA ASP A 332 13.540 3.069 -1.018 1.00 0.00 C ATOM 355 C ASP A 332 12.499 4.184 -1.083 1.00 0.00 C ATOM 356 O ASP A 332 11.768 4.398 -0.133 1.00 0.00 O ATOM 357 CB ASP A 332 12.877 1.695 -1.013 1.00 0.00 C ATOM 358 CG ASP A 332 12.482 1.230 -2.400 1.00 0.00 C ATOM 359 OD1 ASP A 332 12.853 1.907 -3.382 1.00 0.00 O ATOM 360 OD2 ASP A 332 11.803 0.188 -2.506 1.00 0.00 O ATOM 0 H ASP A 332 14.119 2.531 0.902 1.00 0.00 H new ATOM 0 HA ASP A 332 14.169 3.158 -1.904 1.00 0.00 H new ATOM 0 HB2 ASP A 332 13.559 0.969 -0.572 1.00 0.00 H new ATOM 0 HB3 ASP A 332 11.991 1.726 -0.379 1.00 0.00 H new ATOM 365 N LEU A 333 12.429 4.906 -2.191 1.00 0.00 N ATOM 366 CA LEU A 333 11.458 5.993 -2.299 1.00 0.00 C ATOM 367 C LEU A 333 10.268 5.554 -3.158 1.00 0.00 C ATOM 368 O LEU A 333 10.451 5.080 -4.279 1.00 0.00 O ATOM 369 CB LEU A 333 12.111 7.227 -2.915 1.00 0.00 C ATOM 370 CG LEU A 333 13.307 7.764 -2.138 1.00 0.00 C ATOM 371 CD1 LEU A 333 14.604 7.194 -2.689 1.00 0.00 C ATOM 372 CD2 LEU A 333 13.329 9.284 -2.171 1.00 0.00 C ATOM 0 H LEU A 333 13.017 4.767 -3.013 1.00 0.00 H new ATOM 0 HA LEU A 333 11.104 6.242 -1.299 1.00 0.00 H new ATOM 0 HB2 LEU A 333 12.431 6.985 -3.928 1.00 0.00 H new ATOM 0 HB3 LEU A 333 11.363 8.016 -2.997 1.00 0.00 H new ATOM 0 HG LEU A 333 13.211 7.448 -1.099 1.00 0.00 H new ATOM 0 HD11 LEU A 333 15.446 7.590 -2.121 1.00 0.00 H new ATOM 0 HD12 LEU A 333 14.588 6.107 -2.605 1.00 0.00 H new ATOM 0 HD13 LEU A 333 14.709 7.476 -3.737 1.00 0.00 H new ATOM 0 HD21 LEU A 333 14.190 9.648 -1.611 1.00 0.00 H new ATOM 0 HD22 LEU A 333 13.398 9.625 -3.204 1.00 0.00 H new ATOM 0 HD23 LEU A 333 12.414 9.671 -1.722 1.00 0.00 H new ATOM 384 N MET A 334 9.055 5.682 -2.621 1.00 0.00 N ATOM 385 CA MET A 334 7.846 5.254 -3.332 1.00 0.00 C ATOM 386 C MET A 334 6.752 6.329 -3.327 1.00 0.00 C ATOM 387 O MET A 334 6.852 7.317 -2.613 1.00 0.00 O ATOM 388 CB MET A 334 7.350 3.950 -2.718 1.00 0.00 C ATOM 389 CG MET A 334 7.933 2.724 -3.382 1.00 0.00 C ATOM 390 SD MET A 334 9.718 2.580 -3.176 1.00 0.00 S ATOM 391 CE MET A 334 10.227 2.141 -4.836 1.00 0.00 C ATOM 0 H MET A 334 8.881 6.078 -1.697 1.00 0.00 H new ATOM 0 HA MET A 334 8.098 5.093 -4.380 1.00 0.00 H new ATOM 0 HB2 MET A 334 7.601 3.936 -1.657 1.00 0.00 H new ATOM 0 HB3 MET A 334 6.263 3.912 -2.789 1.00 0.00 H new ATOM 0 HG2 MET A 334 7.454 1.835 -2.971 1.00 0.00 H new ATOM 0 HG3 MET A 334 7.698 2.750 -4.446 1.00 0.00 H new ATOM 0 HE1 MET A 334 11.159 2.652 -5.078 1.00 0.00 H new ATOM 0 HE2 MET A 334 10.378 1.063 -4.897 1.00 0.00 H new ATOM 0 HE3 MET A 334 9.454 2.440 -5.544 1.00 0.00 H new ATOM 401 N ALA A 335 5.713 6.148 -4.153 1.00 0.00 N ATOM 402 CA ALA A 335 4.617 7.126 -4.233 1.00 0.00 C ATOM 403 C ALA A 335 3.384 6.616 -3.491 1.00 0.00 C ATOM 404 O ALA A 335 2.937 5.499 -3.724 1.00 0.00 O ATOM 405 CB ALA A 335 4.279 7.423 -5.687 1.00 0.00 C ATOM 0 H ALA A 335 5.607 5.343 -4.770 1.00 0.00 H new ATOM 0 HA ALA A 335 4.944 8.050 -3.756 1.00 0.00 H new ATOM 0 HB1 ALA A 335 3.466 8.148 -5.731 1.00 0.00 H new ATOM 0 HB2 ALA A 335 5.157 7.831 -6.189 1.00 0.00 H new ATOM 0 HB3 ALA A 335 3.972 6.503 -6.184 1.00 0.00 H new ATOM 411 N ILE A 336 2.842 7.426 -2.581 1.00 0.00 N ATOM 412 CA ILE A 336 1.686 7.001 -1.785 1.00 0.00 C ATOM 413 C ILE A 336 0.373 7.543 -2.324 1.00 0.00 C ATOM 414 O ILE A 336 0.260 8.716 -2.684 1.00 0.00 O ATOM 415 CB ILE A 336 1.820 7.450 -0.316 1.00 0.00 C ATOM 416 CG1 ILE A 336 3.167 7.009 0.264 1.00 0.00 C ATOM 417 CG2 ILE A 336 0.661 6.910 0.512 1.00 0.00 C ATOM 418 CD1 ILE A 336 3.179 5.605 0.832 1.00 0.00 C ATOM 0 H ILE A 336 3.178 8.367 -2.377 1.00 0.00 H new ATOM 0 HA ILE A 336 1.673 5.913 -1.849 1.00 0.00 H new ATOM 0 HB ILE A 336 1.783 8.539 -0.281 1.00 0.00 H new ATOM 0 HG12 ILE A 336 3.924 7.077 -0.517 1.00 0.00 H new ATOM 0 HG13 ILE A 336 3.456 7.707 1.050 1.00 0.00 H new ATOM 0 HG21 ILE A 336 0.770 7.236 1.546 1.00 0.00 H new ATOM 0 HG22 ILE A 336 -0.280 7.287 0.110 1.00 0.00 H new ATOM 0 HG23 ILE A 336 0.662 5.821 0.473 1.00 0.00 H new ATOM 0 HD11 ILE A 336 4.172 5.378 1.220 1.00 0.00 H new ATOM 0 HD12 ILE A 336 2.449 5.532 1.638 1.00 0.00 H new ATOM 0 HD13 ILE A 336 2.925 4.893 0.047 1.00 0.00 H new ATOM 430 N LEU A 337 -0.614 6.651 -2.378 1.00 0.00 N ATOM 431 CA LEU A 337 -1.938 6.973 -2.877 1.00 0.00 C ATOM 432 C LEU A 337 -3.026 6.517 -1.900 1.00 0.00 C ATOM 433 O LEU A 337 -3.994 5.864 -2.294 1.00 0.00 O ATOM 434 CB LEU A 337 -2.130 6.290 -4.231 1.00 0.00 C ATOM 435 CG LEU A 337 -1.229 6.797 -5.365 1.00 0.00 C ATOM 436 CD1 LEU A 337 -1.088 8.312 -5.315 1.00 0.00 C ATOM 437 CD2 LEU A 337 0.141 6.128 -5.303 1.00 0.00 C ATOM 0 H LEU A 337 -0.512 5.683 -2.074 1.00 0.00 H new ATOM 0 HA LEU A 337 -2.024 8.054 -2.984 1.00 0.00 H new ATOM 0 HB2 LEU A 337 -1.958 5.221 -4.106 1.00 0.00 H new ATOM 0 HB3 LEU A 337 -3.170 6.413 -4.535 1.00 0.00 H new ATOM 0 HG LEU A 337 -1.699 6.533 -6.312 1.00 0.00 H new ATOM 0 HD11 LEU A 337 -0.445 8.645 -6.130 1.00 0.00 H new ATOM 0 HD12 LEU A 337 -2.071 8.772 -5.418 1.00 0.00 H new ATOM 0 HD13 LEU A 337 -0.648 8.605 -4.362 1.00 0.00 H new ATOM 0 HD21 LEU A 337 0.765 6.501 -6.115 1.00 0.00 H new ATOM 0 HD22 LEU A 337 0.614 6.356 -4.348 1.00 0.00 H new ATOM 0 HD23 LEU A 337 0.024 5.049 -5.402 1.00 0.00 H new ATOM 449 N SER A 338 -2.863 6.868 -0.625 1.00 0.00 N ATOM 450 CA SER A 338 -3.832 6.502 0.409 1.00 0.00 C ATOM 451 C SER A 338 -3.559 7.262 1.701 1.00 0.00 C ATOM 452 O SER A 338 -2.454 7.764 1.919 1.00 0.00 O ATOM 453 CB SER A 338 -3.809 4.996 0.675 1.00 0.00 C ATOM 454 OG SER A 338 -4.323 4.694 1.960 1.00 0.00 O ATOM 0 H SER A 338 -2.067 7.407 -0.282 1.00 0.00 H new ATOM 0 HA SER A 338 -4.822 6.775 0.044 1.00 0.00 H new ATOM 0 HB2 SER A 338 -4.397 4.481 -0.085 1.00 0.00 H new ATOM 0 HB3 SER A 338 -2.787 4.625 0.593 1.00 0.00 H new ATOM 0 HG SER A 338 -4.324 3.723 2.092 1.00 0.00 H new ATOM 460 N LYS A 339 -4.583 7.366 2.546 1.00 0.00 N ATOM 461 CA LYS A 339 -4.492 8.076 3.799 1.00 0.00 C ATOM 462 C LYS A 339 -4.867 7.117 4.915 1.00 0.00 C ATOM 463 O LYS A 339 -4.293 6.034 5.016 1.00 0.00 O ATOM 464 CB LYS A 339 -5.503 9.198 3.725 1.00 0.00 C ATOM 465 CG LYS A 339 -5.603 9.875 2.365 1.00 0.00 C ATOM 466 CD LYS A 339 -4.251 10.280 1.800 1.00 0.00 C ATOM 467 CE LYS A 339 -4.393 11.489 0.892 1.00 0.00 C ATOM 468 NZ LYS A 339 -5.673 11.455 0.128 1.00 0.00 N ATOM 0 H LYS A 339 -5.500 6.954 2.370 1.00 0.00 H new ATOM 0 HA LYS A 339 -3.491 8.466 3.985 1.00 0.00 H new ATOM 0 HB2 LYS A 339 -6.483 8.804 3.992 1.00 0.00 H new ATOM 0 HB3 LYS A 339 -5.247 9.949 4.472 1.00 0.00 H new ATOM 0 HG2 LYS A 339 -6.095 9.200 1.665 1.00 0.00 H new ATOM 0 HG3 LYS A 339 -6.234 10.760 2.452 1.00 0.00 H new ATOM 0 HD2 LYS A 339 -3.564 10.509 2.615 1.00 0.00 H new ATOM 0 HD3 LYS A 339 -3.819 9.448 1.243 1.00 0.00 H new ATOM 0 HE2 LYS A 339 -4.349 12.400 1.489 1.00 0.00 H new ATOM 0 HE3 LYS A 339 -3.554 11.523 0.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 339 -5.592 12.063 -0.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 339 -5.874 10.479 -0.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 339 -6.447 11.799 0.732 1.00 0.00 H new ATOM 482 N LYS A 340 -5.900 7.463 5.689 1.00 0.00 N ATOM 483 CA LYS A 340 -6.395 6.544 6.696 1.00 0.00 C ATOM 484 C LYS A 340 -6.741 5.284 5.918 1.00 0.00 C ATOM 485 O LYS A 340 -6.734 4.167 6.439 1.00 0.00 O ATOM 486 CB LYS A 340 -7.640 7.124 7.380 1.00 0.00 C ATOM 487 CG LYS A 340 -7.900 6.629 8.797 1.00 0.00 C ATOM 488 CD LYS A 340 -7.896 5.108 8.879 1.00 0.00 C ATOM 489 CE LYS A 340 -9.055 4.593 9.716 1.00 0.00 C ATOM 490 NZ LYS A 340 -10.117 3.976 8.874 1.00 0.00 N ATOM 0 H LYS A 340 -6.394 8.353 5.634 1.00 0.00 H new ATOM 0 HA LYS A 340 -5.669 6.354 7.487 1.00 0.00 H new ATOM 0 HB2 LYS A 340 -7.547 8.210 7.404 1.00 0.00 H new ATOM 0 HB3 LYS A 340 -8.511 6.892 6.767 1.00 0.00 H new ATOM 0 HG2 LYS A 340 -7.139 7.030 9.467 1.00 0.00 H new ATOM 0 HG3 LYS A 340 -8.861 7.008 9.143 1.00 0.00 H new ATOM 0 HD2 LYS A 340 -7.956 4.688 7.875 1.00 0.00 H new ATOM 0 HD3 LYS A 340 -6.955 4.768 9.311 1.00 0.00 H new ATOM 0 HE2 LYS A 340 -8.687 3.858 10.432 1.00 0.00 H new ATOM 0 HE3 LYS A 340 -9.480 5.415 10.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 340 -10.926 3.714 9.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 340 -10.427 4.657 8.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 340 -9.741 3.125 8.409 1.00 0.00 H new ATOM 504 N ASP A 341 -6.989 5.541 4.618 1.00 0.00 N ATOM 505 CA ASP A 341 -7.300 4.550 3.587 1.00 0.00 C ATOM 506 C ASP A 341 -8.775 4.598 3.159 1.00 0.00 C ATOM 507 O ASP A 341 -9.061 4.867 1.991 1.00 0.00 O ATOM 508 CB ASP A 341 -6.895 3.127 3.992 1.00 0.00 C ATOM 509 CG ASP A 341 -6.230 2.371 2.858 1.00 0.00 C ATOM 510 OD1 ASP A 341 -6.939 1.988 1.904 1.00 0.00 O ATOM 511 OD2 ASP A 341 -5.001 2.163 2.925 1.00 0.00 O ATOM 0 H ASP A 341 -6.975 6.492 4.249 1.00 0.00 H new ATOM 0 HA ASP A 341 -6.695 4.825 2.723 1.00 0.00 H new ATOM 0 HB2 ASP A 341 -6.215 3.174 4.842 1.00 0.00 H new ATOM 0 HB3 ASP A 341 -7.779 2.580 4.321 1.00 0.00 H new ATOM 516 N PRO A 342 -9.743 4.343 4.069 1.00 0.00 N ATOM 517 CA PRO A 342 -11.163 4.370 3.722 1.00 0.00 C ATOM 518 C PRO A 342 -11.727 5.788 3.697 1.00 0.00 C ATOM 519 O PRO A 342 -11.951 6.359 2.630 1.00 0.00 O ATOM 520 CB PRO A 342 -11.834 3.547 4.836 1.00 0.00 C ATOM 521 CG PRO A 342 -10.736 3.115 5.761 1.00 0.00 C ATOM 522 CD PRO A 342 -9.560 4.010 5.484 1.00 0.00 C ATOM 0 HA PRO A 342 -11.338 3.972 2.722 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -12.577 4.143 5.366 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -12.355 2.684 4.421 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -11.050 3.200 6.801 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -10.476 2.070 5.591 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -9.569 4.899 6.115 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -8.612 3.502 5.662 1.00 0.00 H new ATOM 530 N LEU A 343 -11.959 6.346 4.881 1.00 0.00 N ATOM 531 CA LEU A 343 -12.504 7.695 5.000 1.00 0.00 C ATOM 532 C LEU A 343 -11.393 8.738 5.074 1.00 0.00 C ATOM 533 O LEU A 343 -11.353 9.676 4.279 1.00 0.00 O ATOM 534 CB LEU A 343 -13.387 7.798 6.244 1.00 0.00 C ATOM 535 CG LEU A 343 -14.491 6.746 6.345 1.00 0.00 C ATOM 536 CD1 LEU A 343 -14.066 5.617 7.271 1.00 0.00 C ATOM 537 CD2 LEU A 343 -15.786 7.379 6.831 1.00 0.00 C ATOM 0 H LEU A 343 -11.778 5.885 5.773 1.00 0.00 H new ATOM 0 HA LEU A 343 -13.102 7.892 4.110 1.00 0.00 H new ATOM 0 HB2 LEU A 343 -12.753 7.723 7.128 1.00 0.00 H new ATOM 0 HB3 LEU A 343 -13.846 8.787 6.264 1.00 0.00 H new ATOM 0 HG LEU A 343 -14.664 6.329 5.353 1.00 0.00 H new ATOM 0 HD11 LEU A 343 -14.864 4.877 7.332 1.00 0.00 H new ATOM 0 HD12 LEU A 343 -13.163 5.147 6.881 1.00 0.00 H new ATOM 0 HD13 LEU A 343 -13.866 6.017 8.265 1.00 0.00 H new ATOM 0 HD21 LEU A 343 -16.562 6.616 6.897 1.00 0.00 H new ATOM 0 HD22 LEU A 343 -15.628 7.822 7.814 1.00 0.00 H new ATOM 0 HD23 LEU A 343 -16.098 8.153 6.130 1.00 0.00 H new ATOM 549 N GLY A 344 -10.505 8.571 6.044 1.00 0.00 N ATOM 550 CA GLY A 344 -9.412 9.508 6.226 1.00 0.00 C ATOM 551 C GLY A 344 -9.350 10.024 7.649 1.00 0.00 C ATOM 552 O GLY A 344 -9.110 11.210 7.877 1.00 0.00 O ATOM 0 H GLY A 344 -10.522 7.800 6.712 1.00 0.00 H new ATOM 0 HA2 GLY A 344 -8.470 9.022 5.973 1.00 0.00 H new ATOM 0 HA3 GLY A 344 -9.532 10.346 5.540 1.00 0.00 H new ATOM 556 N ARG A 345 -9.596 9.132 8.607 1.00 0.00 N ATOM 557 CA ARG A 345 -9.596 9.504 10.011 1.00 0.00 C ATOM 558 C ARG A 345 -8.281 9.176 10.726 1.00 0.00 C ATOM 559 O ARG A 345 -7.214 9.619 10.302 1.00 0.00 O ATOM 560 CB ARG A 345 -10.767 8.857 10.710 1.00 0.00 C ATOM 561 CG ARG A 345 -11.616 9.847 11.488 1.00 0.00 C ATOM 562 CD ARG A 345 -11.086 11.263 11.435 1.00 0.00 C ATOM 563 NE ARG A 345 -11.823 12.167 12.315 1.00 0.00 N ATOM 564 CZ ARG A 345 -11.606 13.477 12.377 1.00 0.00 C ATOM 565 NH1 ARG A 345 -10.684 14.039 11.606 1.00 0.00 N ATOM 566 NH2 ARG A 345 -12.314 14.229 13.207 1.00 0.00 N ATOM 0 H ARG A 345 -9.797 8.148 8.431 1.00 0.00 H new ATOM 0 HA ARG A 345 -9.695 10.589 10.056 1.00 0.00 H new ATOM 0 HB2 ARG A 345 -11.391 8.354 9.971 1.00 0.00 H new ATOM 0 HB3 ARG A 345 -10.398 8.090 11.391 1.00 0.00 H new ATOM 0 HG2 ARG A 345 -12.632 9.832 11.094 1.00 0.00 H new ATOM 0 HG3 ARG A 345 -11.673 9.527 12.528 1.00 0.00 H new ATOM 0 HD2 ARG A 345 -10.033 11.265 11.717 1.00 0.00 H new ATOM 0 HD3 ARG A 345 -11.143 11.631 10.411 1.00 0.00 H new ATOM 0 HE ARG A 345 -12.545 11.770 12.916 1.00 0.00 H new ATOM 0 HH11 ARG A 345 -10.139 13.465 10.963 1.00 0.00 H new ATOM 0 HH12 ARG A 345 -10.521 15.045 11.657 1.00 0.00 H new ATOM 0 HH21 ARG A 345 -13.027 13.803 13.799 1.00 0.00 H new ATOM 0 HH22 ARG A 345 -12.146 15.234 13.254 1.00 0.00 H new ATOM 580 N ASP A 346 -8.364 8.437 11.839 1.00 0.00 N ATOM 581 CA ASP A 346 -7.177 8.107 12.627 1.00 0.00 C ATOM 582 C ASP A 346 -6.476 6.838 12.163 1.00 0.00 C ATOM 583 O ASP A 346 -6.989 6.097 11.338 1.00 0.00 O ATOM 584 CB ASP A 346 -7.545 7.989 14.104 1.00 0.00 C ATOM 585 CG ASP A 346 -6.551 8.691 15.007 1.00 0.00 C ATOM 586 OD1 ASP A 346 -6.510 9.939 14.991 1.00 0.00 O ATOM 587 OD2 ASP A 346 -5.810 7.993 15.732 1.00 0.00 O ATOM 0 H ASP A 346 -9.236 8.060 12.210 1.00 0.00 H new ATOM 0 HA ASP A 346 -6.471 8.924 12.479 1.00 0.00 H new ATOM 0 HB2 ASP A 346 -8.537 8.412 14.263 1.00 0.00 H new ATOM 0 HB3 ASP A 346 -7.600 6.936 14.379 1.00 0.00 H new ATOM 592 N SER A 347 -5.272 6.633 12.697 1.00 0.00 N ATOM 593 CA SER A 347 -4.428 5.495 12.344 1.00 0.00 C ATOM 594 C SER A 347 -3.758 5.789 11.019 1.00 0.00 C ATOM 595 O SER A 347 -4.282 6.562 10.216 1.00 0.00 O ATOM 596 CB SER A 347 -5.214 4.187 12.256 1.00 0.00 C ATOM 597 OG SER A 347 -5.704 3.795 13.527 1.00 0.00 O ATOM 0 H SER A 347 -4.854 7.255 13.389 1.00 0.00 H new ATOM 0 HA SER A 347 -3.687 5.361 13.132 1.00 0.00 H new ATOM 0 HB2 SER A 347 -6.047 4.307 11.564 1.00 0.00 H new ATOM 0 HB3 SER A 347 -4.574 3.402 11.852 1.00 0.00 H new ATOM 0 HG SER A 347 -6.204 2.957 13.440 1.00 0.00 H new ATOM 603 N ASP A 348 -2.588 5.215 10.790 1.00 0.00 N ATOM 604 CA ASP A 348 -1.882 5.492 9.556 1.00 0.00 C ATOM 605 C ASP A 348 -1.513 4.235 8.772 1.00 0.00 C ATOM 606 O ASP A 348 -0.513 3.567 9.054 1.00 0.00 O ATOM 607 CB ASP A 348 -0.646 6.294 9.877 1.00 0.00 C ATOM 608 CG ASP A 348 -0.936 7.780 9.980 1.00 0.00 C ATOM 609 OD1 ASP A 348 -1.320 8.382 8.956 1.00 0.00 O ATOM 610 OD2 ASP A 348 -0.778 8.340 11.085 1.00 0.00 O ATOM 0 H ASP A 348 -2.119 4.571 11.426 1.00 0.00 H new ATOM 0 HA ASP A 348 -2.554 6.057 8.910 1.00 0.00 H new ATOM 0 HB2 ASP A 348 -0.221 5.943 10.817 1.00 0.00 H new ATOM 0 HB3 ASP A 348 0.105 6.125 9.105 1.00 0.00 H new ATOM 615 N TRP A 349 -2.306 3.972 7.742 1.00 0.00 N ATOM 616 CA TRP A 349 -2.087 2.853 6.837 1.00 0.00 C ATOM 617 C TRP A 349 -2.031 3.418 5.431 1.00 0.00 C ATOM 618 O TRP A 349 -3.054 3.817 4.877 1.00 0.00 O ATOM 619 CB TRP A 349 -3.216 1.826 6.959 1.00 0.00 C ATOM 620 CG TRP A 349 -2.779 0.539 7.587 1.00 0.00 C ATOM 621 CD1 TRP A 349 -3.158 0.048 8.803 1.00 0.00 C ATOM 622 CD2 TRP A 349 -1.879 -0.420 7.028 1.00 0.00 C ATOM 623 NE1 TRP A 349 -2.544 -1.160 9.034 1.00 0.00 N ATOM 624 CE2 TRP A 349 -1.754 -1.468 7.959 1.00 0.00 C ATOM 625 CE3 TRP A 349 -1.165 -0.493 5.830 1.00 0.00 C ATOM 626 CZ2 TRP A 349 -0.944 -2.576 7.728 1.00 0.00 C ATOM 627 CZ3 TRP A 349 -0.362 -1.591 5.603 1.00 0.00 C ATOM 628 CH2 TRP A 349 -0.255 -2.620 6.546 1.00 0.00 C ATOM 0 H TRP A 349 -3.125 4.534 7.510 1.00 0.00 H new ATOM 0 HA TRP A 349 -1.158 2.339 7.084 1.00 0.00 H new ATOM 0 HB2 TRP A 349 -4.025 2.254 7.550 1.00 0.00 H new ATOM 0 HB3 TRP A 349 -3.620 1.620 5.968 1.00 0.00 H new ATOM 0 HD1 TRP A 349 -3.840 0.537 9.483 1.00 0.00 H new ATOM 0 HE1 TRP A 349 -2.658 -1.733 9.870 1.00 0.00 H new ATOM 0 HE3 TRP A 349 -1.240 0.295 5.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 349 -0.862 -3.371 8.454 1.00 0.00 H new ATOM 0 HZ3 TRP A 349 0.195 -1.658 4.680 1.00 0.00 H new ATOM 0 HH2 TRP A 349 0.384 -3.465 6.337 1.00 0.00 H new ATOM 639 N TRP A 350 -0.831 3.516 4.875 1.00 0.00 N ATOM 640 CA TRP A 350 -0.675 4.116 3.561 1.00 0.00 C ATOM 641 C TRP A 350 -0.317 3.101 2.491 1.00 0.00 C ATOM 642 O TRP A 350 0.422 2.151 2.726 1.00 0.00 O ATOM 643 CB TRP A 350 0.381 5.224 3.622 1.00 0.00 C ATOM 644 CG TRP A 350 -0.019 6.395 4.480 1.00 0.00 C ATOM 645 CD1 TRP A 350 -0.914 6.399 5.513 1.00 0.00 C ATOM 646 CD2 TRP A 350 0.467 7.734 4.372 1.00 0.00 C ATOM 647 NE1 TRP A 350 -1.006 7.655 6.056 1.00 0.00 N ATOM 648 CE2 TRP A 350 -0.169 8.494 5.372 1.00 0.00 C ATOM 649 CE3 TRP A 350 1.380 8.363 3.528 1.00 0.00 C ATOM 650 CZ2 TRP A 350 0.083 9.851 5.548 1.00 0.00 C ATOM 651 CZ3 TRP A 350 1.629 9.709 3.702 1.00 0.00 C ATOM 652 CH2 TRP A 350 0.984 10.440 4.707 1.00 0.00 C ATOM 0 H TRP A 350 0.035 3.193 5.307 1.00 0.00 H new ATOM 0 HA TRP A 350 -1.639 4.539 3.279 1.00 0.00 H new ATOM 0 HB2 TRP A 350 1.312 4.806 4.005 1.00 0.00 H new ATOM 0 HB3 TRP A 350 0.582 5.578 2.611 1.00 0.00 H new ATOM 0 HD1 TRP A 350 -1.469 5.537 5.853 1.00 0.00 H new ATOM 0 HE1 TRP A 350 -1.601 7.920 6.841 1.00 0.00 H new ATOM 0 HE3 TRP A 350 1.884 7.807 2.751 1.00 0.00 H new ATOM 0 HZ2 TRP A 350 -0.415 10.418 6.321 1.00 0.00 H new ATOM 0 HZ3 TRP A 350 2.333 10.207 3.052 1.00 0.00 H new ATOM 0 HH2 TRP A 350 1.203 11.491 4.820 1.00 0.00 H new ATOM 663 N LYS A 351 -0.852 3.341 1.307 1.00 0.00 N ATOM 664 CA LYS A 351 -0.626 2.501 0.158 1.00 0.00 C ATOM 665 C LYS A 351 0.371 3.180 -0.765 1.00 0.00 C ATOM 666 O LYS A 351 0.320 4.394 -0.950 1.00 0.00 O ATOM 667 CB LYS A 351 -1.964 2.262 -0.542 1.00 0.00 C ATOM 668 CG LYS A 351 -2.292 3.259 -1.645 1.00 0.00 C ATOM 669 CD LYS A 351 -1.706 2.832 -2.982 1.00 0.00 C ATOM 670 CE LYS A 351 -2.771 2.753 -4.063 1.00 0.00 C ATOM 671 NZ LYS A 351 -3.250 1.358 -4.267 1.00 0.00 N ATOM 0 H LYS A 351 -1.463 4.137 1.120 1.00 0.00 H new ATOM 0 HA LYS A 351 -0.212 1.537 0.454 1.00 0.00 H new ATOM 0 HB2 LYS A 351 -1.962 1.258 -0.967 1.00 0.00 H new ATOM 0 HB3 LYS A 351 -2.759 2.291 0.203 1.00 0.00 H new ATOM 0 HG2 LYS A 351 -3.374 3.357 -1.737 1.00 0.00 H new ATOM 0 HG3 LYS A 351 -1.904 4.241 -1.375 1.00 0.00 H new ATOM 0 HD2 LYS A 351 -0.933 3.539 -3.283 1.00 0.00 H new ATOM 0 HD3 LYS A 351 -1.224 1.860 -2.874 1.00 0.00 H new ATOM 0 HE2 LYS A 351 -3.613 3.390 -3.791 1.00 0.00 H new ATOM 0 HE3 LYS A 351 -2.368 3.139 -4.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 -3.020 1.050 -5.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 -2.785 0.728 -3.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 -4.280 1.321 -4.128 1.00 0.00 H new ATOM 685 N VAL A 352 1.297 2.416 -1.318 1.00 0.00 N ATOM 686 CA VAL A 352 2.303 2.999 -2.185 1.00 0.00 C ATOM 687 C VAL A 352 2.417 2.279 -3.522 1.00 0.00 C ATOM 688 O VAL A 352 1.971 1.142 -3.684 1.00 0.00 O ATOM 689 CB VAL A 352 3.690 3.012 -1.499 1.00 0.00 C ATOM 690 CG1 VAL A 352 4.496 1.776 -1.863 1.00 0.00 C ATOM 691 CG2 VAL A 352 4.441 4.276 -1.844 1.00 0.00 C ATOM 0 H VAL A 352 1.373 1.408 -1.185 1.00 0.00 H new ATOM 0 HA VAL A 352 1.976 4.021 -2.377 1.00 0.00 H new ATOM 0 HB VAL A 352 3.535 2.994 -0.420 1.00 0.00 H new ATOM 0 HG11 VAL A 352 5.465 1.814 -1.366 1.00 0.00 H new ATOM 0 HG12 VAL A 352 3.959 0.884 -1.542 1.00 0.00 H new ATOM 0 HG13 VAL A 352 4.643 1.742 -2.943 1.00 0.00 H new ATOM 0 HG21 VAL A 352 5.414 4.267 -1.352 1.00 0.00 H new ATOM 0 HG22 VAL A 352 4.580 4.333 -2.924 1.00 0.00 H new ATOM 0 HG23 VAL A 352 3.871 5.142 -1.505 1.00 0.00 H new ATOM 701 N ARG A 353 3.055 2.964 -4.461 1.00 0.00 N ATOM 702 CA ARG A 353 3.296 2.442 -5.792 1.00 0.00 C ATOM 703 C ARG A 353 4.781 2.556 -6.104 1.00 0.00 C ATOM 704 O ARG A 353 5.361 3.643 -6.014 1.00 0.00 O ATOM 705 CB ARG A 353 2.479 3.206 -6.821 1.00 0.00 C ATOM 706 CG ARG A 353 2.569 2.631 -8.223 1.00 0.00 C ATOM 707 CD ARG A 353 1.577 3.302 -9.159 1.00 0.00 C ATOM 708 NE ARG A 353 2.224 3.815 -10.365 1.00 0.00 N ATOM 709 CZ ARG A 353 1.655 4.685 -11.195 1.00 0.00 C ATOM 710 NH1 ARG A 353 0.435 5.145 -10.949 1.00 0.00 N ATOM 711 NH2 ARG A 353 2.310 5.100 -12.271 1.00 0.00 N ATOM 0 H ARG A 353 3.421 3.905 -4.316 1.00 0.00 H new ATOM 0 HA ARG A 353 2.992 1.396 -5.832 1.00 0.00 H new ATOM 0 HB2 ARG A 353 1.435 3.215 -6.508 1.00 0.00 H new ATOM 0 HB3 ARG A 353 2.815 4.243 -6.841 1.00 0.00 H new ATOM 0 HG2 ARG A 353 3.581 2.761 -8.608 1.00 0.00 H new ATOM 0 HG3 ARG A 353 2.375 1.559 -8.192 1.00 0.00 H new ATOM 0 HD2 ARG A 353 0.802 2.588 -9.439 1.00 0.00 H new ATOM 0 HD3 ARG A 353 1.082 4.121 -8.637 1.00 0.00 H new ATOM 0 HE ARG A 353 3.165 3.487 -10.583 1.00 0.00 H new ATOM 0 HH11 ARG A 353 -0.071 4.832 -10.120 1.00 0.00 H new ATOM 0 HH12 ARG A 353 0.003 5.812 -11.588 1.00 0.00 H new ATOM 0 HH21 ARG A 353 3.250 4.752 -12.462 1.00 0.00 H new ATOM 0 HH22 ARG A 353 1.874 5.767 -12.908 1.00 0.00 H new ATOM 725 N THR A 354 5.400 1.430 -6.436 1.00 0.00 N ATOM 726 CA THR A 354 6.826 1.407 -6.727 1.00 0.00 C ATOM 727 C THR A 354 7.095 1.195 -8.212 1.00 0.00 C ATOM 728 O THR A 354 6.801 0.132 -8.763 1.00 0.00 O ATOM 729 CB THR A 354 7.537 0.308 -5.913 1.00 0.00 C ATOM 730 OG1 THR A 354 7.577 -0.917 -6.652 1.00 0.00 O ATOM 731 CG2 THR A 354 6.827 0.084 -4.586 1.00 0.00 C ATOM 0 H THR A 354 4.938 0.524 -6.510 1.00 0.00 H new ATOM 0 HA THR A 354 7.224 2.380 -6.440 1.00 0.00 H new ATOM 0 HB THR A 354 8.558 0.637 -5.718 1.00 0.00 H new ATOM 0 HG1 THR A 354 6.895 -0.897 -7.355 1.00 0.00 H new ATOM 0 HG21 THR A 354 7.343 -0.695 -4.025 1.00 0.00 H new ATOM 0 HG22 THR A 354 6.831 1.010 -4.010 1.00 0.00 H new ATOM 0 HG23 THR A 354 5.798 -0.223 -4.771 1.00 0.00 H new ATOM 739 N LYS A 355 7.667 2.218 -8.846 1.00 0.00 N ATOM 740 CA LYS A 355 7.999 2.168 -10.266 1.00 0.00 C ATOM 741 C LYS A 355 6.843 1.617 -11.093 1.00 0.00 C ATOM 742 O LYS A 355 7.056 0.930 -12.092 1.00 0.00 O ATOM 743 CB LYS A 355 9.243 1.313 -10.473 1.00 0.00 C ATOM 744 CG LYS A 355 10.320 1.579 -9.438 1.00 0.00 C ATOM 745 CD LYS A 355 11.039 0.300 -9.042 1.00 0.00 C ATOM 746 CE LYS A 355 10.692 -0.119 -7.623 1.00 0.00 C ATOM 747 NZ LYS A 355 11.370 -1.387 -7.234 1.00 0.00 N ATOM 0 H LYS A 355 7.911 3.098 -8.392 1.00 0.00 H new ATOM 0 HA LYS A 355 8.193 3.186 -10.604 1.00 0.00 H new ATOM 0 HB2 LYS A 355 8.964 0.260 -10.438 1.00 0.00 H new ATOM 0 HB3 LYS A 355 9.647 1.503 -11.468 1.00 0.00 H new ATOM 0 HG2 LYS A 355 11.040 2.294 -9.836 1.00 0.00 H new ATOM 0 HG3 LYS A 355 9.873 2.035 -8.555 1.00 0.00 H new ATOM 0 HD2 LYS A 355 10.771 -0.498 -9.734 1.00 0.00 H new ATOM 0 HD3 LYS A 355 12.116 0.446 -9.126 1.00 0.00 H new ATOM 0 HE2 LYS A 355 10.979 0.673 -6.931 1.00 0.00 H new ATOM 0 HE3 LYS A 355 9.613 -0.243 -7.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 355 11.106 -1.637 -6.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 355 11.077 -2.149 -7.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 355 12.401 -1.262 -7.292 1.00 0.00 H new ATOM 761 N ASN A 356 5.620 1.920 -10.666 1.00 0.00 N ATOM 762 CA ASN A 356 4.430 1.448 -11.364 1.00 0.00 C ATOM 763 C ASN A 356 4.494 -0.063 -11.549 1.00 0.00 C ATOM 764 O ASN A 356 4.165 -0.590 -12.612 1.00 0.00 O ATOM 765 CB ASN A 356 4.297 2.144 -12.720 1.00 0.00 C ATOM 766 CG ASN A 356 2.949 1.898 -13.368 1.00 0.00 C ATOM 767 OD1 ASN A 356 1.995 1.493 -12.705 1.00 0.00 O ATOM 768 ND2 ASN A 356 2.866 2.140 -14.670 1.00 0.00 N ATOM 0 H ASN A 356 5.428 2.489 -9.842 1.00 0.00 H new ATOM 0 HA ASN A 356 3.554 1.690 -10.763 1.00 0.00 H new ATOM 0 HB2 ASN A 356 4.444 3.216 -12.591 1.00 0.00 H new ATOM 0 HB3 ASN A 356 5.086 1.792 -13.385 1.00 0.00 H new ATOM 0 HD21 ASN A 356 1.985 1.991 -15.161 1.00 0.00 H new ATOM 0 HD22 ASN A 356 3.684 2.475 -15.180 1.00 0.00 H new ATOM 775 N GLY A 357 4.931 -0.753 -10.501 1.00 0.00 N ATOM 776 CA GLY A 357 5.048 -2.196 -10.552 1.00 0.00 C ATOM 777 C GLY A 357 4.571 -2.859 -9.277 1.00 0.00 C ATOM 778 O GLY A 357 3.827 -3.839 -9.327 1.00 0.00 O ATOM 0 H GLY A 357 5.207 -0.334 -9.613 1.00 0.00 H new ATOM 0 HA2 GLY A 357 4.469 -2.575 -11.394 1.00 0.00 H new ATOM 0 HA3 GLY A 357 6.088 -2.467 -10.732 1.00 0.00 H new ATOM 782 N ASN A 358 4.993 -2.331 -8.130 1.00 0.00 N ATOM 783 CA ASN A 358 4.587 -2.899 -6.849 1.00 0.00 C ATOM 784 C ASN A 358 3.678 -1.940 -6.089 1.00 0.00 C ATOM 785 O ASN A 358 4.148 -1.050 -5.382 1.00 0.00 O ATOM 786 CB ASN A 358 5.811 -3.248 -6.004 1.00 0.00 C ATOM 787 CG ASN A 358 6.941 -3.829 -6.833 1.00 0.00 C ATOM 788 OD1 ASN A 358 6.709 -4.436 -7.879 1.00 0.00 O ATOM 789 ND2 ASN A 358 8.171 -3.651 -6.367 1.00 0.00 N ATOM 0 H ASN A 358 5.609 -1.520 -8.062 1.00 0.00 H new ATOM 0 HA ASN A 358 4.028 -3.813 -7.050 1.00 0.00 H new ATOM 0 HB2 ASN A 358 6.163 -2.352 -5.492 1.00 0.00 H new ATOM 0 HB3 ASN A 358 5.525 -3.964 -5.233 1.00 0.00 H new ATOM 0 HD21 ASN A 358 8.970 -4.024 -6.880 1.00 0.00 H new ATOM 0 HD22 ASN A 358 8.317 -3.141 -5.496 1.00 0.00 H new ATOM 796 N ILE A 359 2.372 -2.129 -6.241 1.00 0.00 N ATOM 797 CA ILE A 359 1.397 -1.281 -5.568 1.00 0.00 C ATOM 798 C ILE A 359 0.656 -2.051 -4.482 1.00 0.00 C ATOM 799 O ILE A 359 -0.043 -3.026 -4.763 1.00 0.00 O ATOM 800 CB ILE A 359 0.368 -0.696 -6.554 1.00 0.00 C ATOM 801 CG1 ILE A 359 0.993 -0.498 -7.939 1.00 0.00 C ATOM 802 CG2 ILE A 359 -0.177 0.621 -6.019 1.00 0.00 C ATOM 803 CD1 ILE A 359 -0.002 -0.612 -9.074 1.00 0.00 C ATOM 0 H ILE A 359 1.965 -2.861 -6.823 1.00 0.00 H new ATOM 0 HA ILE A 359 1.958 -0.462 -5.118 1.00 0.00 H new ATOM 0 HB ILE A 359 -0.456 -1.402 -6.655 1.00 0.00 H new ATOM 0 HG12 ILE A 359 1.466 0.483 -7.978 1.00 0.00 H new ATOM 0 HG13 ILE A 359 1.781 -1.237 -8.082 1.00 0.00 H new ATOM 0 HG21 ILE A 359 -0.904 1.027 -6.723 1.00 0.00 H new ATOM 0 HG22 ILE A 359 -0.660 0.451 -5.057 1.00 0.00 H new ATOM 0 HG23 ILE A 359 0.642 1.330 -5.894 1.00 0.00 H new ATOM 0 HD11 ILE A 359 0.511 -0.461 -10.024 1.00 0.00 H new ATOM 0 HD12 ILE A 359 -0.457 -1.602 -9.061 1.00 0.00 H new ATOM 0 HD13 ILE A 359 -0.777 0.145 -8.956 1.00 0.00 H new ATOM 815 N GLY A 360 0.810 -1.603 -3.241 1.00 0.00 N ATOM 816 CA GLY A 360 0.147 -2.254 -2.124 1.00 0.00 C ATOM 817 C GLY A 360 -0.017 -1.325 -0.940 1.00 0.00 C ATOM 818 O GLY A 360 -0.091 -0.110 -1.114 1.00 0.00 O ATOM 0 H GLY A 360 1.383 -0.799 -2.987 1.00 0.00 H new ATOM 0 HA2 GLY A 360 -0.832 -2.611 -2.442 1.00 0.00 H new ATOM 0 HA3 GLY A 360 0.722 -3.129 -1.821 1.00 0.00 H new ATOM 822 N TYR A 361 -0.069 -1.887 0.266 1.00 0.00 N ATOM 823 CA TYR A 361 -0.221 -1.072 1.470 1.00 0.00 C ATOM 824 C TYR A 361 1.052 -1.094 2.304 1.00 0.00 C ATOM 825 O TYR A 361 1.966 -1.873 2.033 1.00 0.00 O ATOM 826 CB TYR A 361 -1.401 -1.556 2.311 1.00 0.00 C ATOM 827 CG TYR A 361 -2.726 -1.482 1.589 1.00 0.00 C ATOM 828 CD1 TYR A 361 -3.179 -2.548 0.822 1.00 0.00 C ATOM 829 CD2 TYR A 361 -3.522 -0.346 1.671 1.00 0.00 C ATOM 830 CE1 TYR A 361 -4.390 -2.483 0.157 1.00 0.00 C ATOM 831 CE2 TYR A 361 -4.733 -0.274 1.009 1.00 0.00 C ATOM 832 CZ TYR A 361 -5.162 -1.345 0.254 1.00 0.00 C ATOM 833 OH TYR A 361 -6.368 -1.276 -0.405 1.00 0.00 O ATOM 0 H TYR A 361 -0.009 -2.891 0.435 1.00 0.00 H new ATOM 0 HA TYR A 361 -0.415 -0.047 1.153 1.00 0.00 H new ATOM 0 HB2 TYR A 361 -1.220 -2.586 2.617 1.00 0.00 H new ATOM 0 HB3 TYR A 361 -1.458 -0.958 3.221 1.00 0.00 H new ATOM 0 HD1 TYR A 361 -2.577 -3.441 0.744 1.00 0.00 H new ATOM 0 HD2 TYR A 361 -3.189 0.494 2.262 1.00 0.00 H new ATOM 0 HE1 TYR A 361 -4.729 -3.320 -0.435 1.00 0.00 H new ATOM 0 HE2 TYR A 361 -5.340 0.616 1.083 1.00 0.00 H new ATOM 0 HH TYR A 361 -6.786 -0.407 -0.231 1.00 0.00 H new ATOM 843 N ILE A 362 1.101 -0.236 3.319 1.00 0.00 N ATOM 844 CA ILE A 362 2.260 -0.156 4.198 1.00 0.00 C ATOM 845 C ILE A 362 2.086 0.924 5.264 1.00 0.00 C ATOM 846 O ILE A 362 1.742 2.067 4.955 1.00 0.00 O ATOM 847 CB ILE A 362 3.561 0.142 3.417 1.00 0.00 C ATOM 848 CG1 ILE A 362 4.657 0.619 4.378 1.00 0.00 C ATOM 849 CG2 ILE A 362 3.304 1.182 2.333 1.00 0.00 C ATOM 850 CD1 ILE A 362 5.992 0.865 3.714 1.00 0.00 C ATOM 0 H ILE A 362 0.350 0.414 3.552 1.00 0.00 H new ATOM 0 HA ILE A 362 2.339 -1.134 4.673 1.00 0.00 H new ATOM 0 HB ILE A 362 3.899 -0.775 2.935 1.00 0.00 H new ATOM 0 HG12 ILE A 362 4.328 1.539 4.860 1.00 0.00 H new ATOM 0 HG13 ILE A 362 4.785 -0.125 5.164 1.00 0.00 H new ATOM 0 HG21 ILE A 362 4.230 1.381 1.793 1.00 0.00 H new ATOM 0 HG22 ILE A 362 2.552 0.806 1.639 1.00 0.00 H new ATOM 0 HG23 ILE A 362 2.946 2.104 2.791 1.00 0.00 H new ATOM 0 HD11 ILE A 362 6.713 1.200 4.460 1.00 0.00 H new ATOM 0 HD12 ILE A 362 6.346 -0.058 3.256 1.00 0.00 H new ATOM 0 HD13 ILE A 362 5.881 1.632 2.947 1.00 0.00 H new ATOM 862 N PRO A 363 2.349 0.576 6.535 1.00 0.00 N ATOM 863 CA PRO A 363 2.257 1.513 7.652 1.00 0.00 C ATOM 864 C PRO A 363 2.938 2.837 7.322 1.00 0.00 C ATOM 865 O PRO A 363 4.041 2.849 6.775 1.00 0.00 O ATOM 866 CB PRO A 363 3.014 0.806 8.792 1.00 0.00 C ATOM 867 CG PRO A 363 3.587 -0.448 8.204 1.00 0.00 C ATOM 868 CD PRO A 363 2.775 -0.752 6.981 1.00 0.00 C ATOM 0 HA PRO A 363 1.223 1.753 7.901 1.00 0.00 H new ATOM 0 HB2 PRO A 363 3.803 1.445 9.189 1.00 0.00 H new ATOM 0 HB3 PRO A 363 2.343 0.576 9.620 1.00 0.00 H new ATOM 0 HG2 PRO A 363 4.638 -0.312 7.948 1.00 0.00 H new ATOM 0 HG3 PRO A 363 3.536 -1.270 8.918 1.00 0.00 H new ATOM 0 HD2 PRO A 363 3.365 -1.264 6.221 1.00 0.00 H new ATOM 0 HD3 PRO A 363 1.924 -1.394 7.210 1.00 0.00 H new ATOM 876 N TYR A 364 2.288 3.948 7.647 1.00 0.00 N ATOM 877 CA TYR A 364 2.865 5.260 7.365 1.00 0.00 C ATOM 878 C TYR A 364 4.140 5.476 8.179 1.00 0.00 C ATOM 879 O TYR A 364 4.993 6.285 7.813 1.00 0.00 O ATOM 880 CB TYR A 364 1.839 6.366 7.641 1.00 0.00 C ATOM 881 CG TYR A 364 2.356 7.520 8.477 1.00 0.00 C ATOM 882 CD1 TYR A 364 2.311 7.473 9.864 1.00 0.00 C ATOM 883 CD2 TYR A 364 2.878 8.658 7.877 1.00 0.00 C ATOM 884 CE1 TYR A 364 2.771 8.524 10.630 1.00 0.00 C ATOM 885 CE2 TYR A 364 3.343 9.715 8.637 1.00 0.00 C ATOM 886 CZ TYR A 364 3.286 9.644 10.012 1.00 0.00 C ATOM 887 OH TYR A 364 3.746 10.694 10.773 1.00 0.00 O ATOM 0 H TYR A 364 1.374 3.970 8.100 1.00 0.00 H new ATOM 0 HA TYR A 364 3.133 5.302 6.309 1.00 0.00 H new ATOM 0 HB2 TYR A 364 1.483 6.757 6.688 1.00 0.00 H new ATOM 0 HB3 TYR A 364 0.979 5.926 8.147 1.00 0.00 H new ATOM 0 HD1 TYR A 364 1.909 6.598 10.352 1.00 0.00 H new ATOM 0 HD2 TYR A 364 2.921 8.718 6.800 1.00 0.00 H new ATOM 0 HE1 TYR A 364 2.728 8.470 11.708 1.00 0.00 H new ATOM 0 HE2 TYR A 364 3.749 10.592 8.155 1.00 0.00 H new ATOM 0 HH TYR A 364 4.077 11.404 10.184 1.00 0.00 H new ATOM 897 N ASN A 365 4.267 4.740 9.279 1.00 0.00 N ATOM 898 CA ASN A 365 5.439 4.848 10.139 1.00 0.00 C ATOM 899 C ASN A 365 6.666 4.235 9.470 1.00 0.00 C ATOM 900 O ASN A 365 7.780 4.338 9.982 1.00 0.00 O ATOM 901 CB ASN A 365 5.182 4.160 11.482 1.00 0.00 C ATOM 902 CG ASN A 365 4.238 4.948 12.368 1.00 0.00 C ATOM 903 OD1 ASN A 365 4.022 6.142 12.158 1.00 0.00 O ATOM 904 ND2 ASN A 365 3.672 4.282 13.368 1.00 0.00 N ATOM 0 H ASN A 365 3.573 4.063 9.595 1.00 0.00 H new ATOM 0 HA ASN A 365 5.631 5.907 10.312 1.00 0.00 H new ATOM 0 HB2 ASN A 365 4.765 3.168 11.305 1.00 0.00 H new ATOM 0 HB3 ASN A 365 6.130 4.019 12.001 1.00 0.00 H new ATOM 0 HD21 ASN A 365 3.029 4.760 14.000 1.00 0.00 H new ATOM 0 HD22 ASN A 365 3.880 3.293 13.504 1.00 0.00 H new ATOM 911 N TYR A 366 6.451 3.597 8.323 1.00 0.00 N ATOM 912 CA TYR A 366 7.535 2.966 7.580 1.00 0.00 C ATOM 913 C TYR A 366 7.823 3.724 6.288 1.00 0.00 C ATOM 914 O TYR A 366 8.507 3.214 5.400 1.00 0.00 O ATOM 915 CB TYR A 366 7.180 1.512 7.257 1.00 0.00 C ATOM 916 CG TYR A 366 7.685 0.512 8.275 1.00 0.00 C ATOM 917 CD1 TYR A 366 7.060 0.372 9.507 1.00 0.00 C ATOM 918 CD2 TYR A 366 8.783 -0.295 8.000 1.00 0.00 C ATOM 919 CE1 TYR A 366 7.516 -0.541 10.438 1.00 0.00 C ATOM 920 CE2 TYR A 366 9.244 -1.211 8.927 1.00 0.00 C ATOM 921 CZ TYR A 366 8.606 -1.330 10.143 1.00 0.00 C ATOM 922 OH TYR A 366 9.062 -2.242 11.067 1.00 0.00 O ATOM 0 H TYR A 366 5.533 3.504 7.888 1.00 0.00 H new ATOM 0 HA TYR A 366 8.429 2.989 8.203 1.00 0.00 H new ATOM 0 HB2 TYR A 366 6.096 1.422 7.182 1.00 0.00 H new ATOM 0 HB3 TYR A 366 7.590 1.258 6.279 1.00 0.00 H new ATOM 0 HD1 TYR A 366 6.204 0.987 9.741 1.00 0.00 H new ATOM 0 HD2 TYR A 366 9.284 -0.205 7.047 1.00 0.00 H new ATOM 0 HE1 TYR A 366 7.020 -0.636 11.393 1.00 0.00 H new ATOM 0 HE2 TYR A 366 10.099 -1.830 8.700 1.00 0.00 H new ATOM 0 HH TYR A 366 9.837 -2.718 10.702 1.00 0.00 H new ATOM 932 N ILE A 367 7.295 4.942 6.186 1.00 0.00 N ATOM 933 CA ILE A 367 7.494 5.765 4.995 1.00 0.00 C ATOM 934 C ILE A 367 7.489 7.256 5.320 1.00 0.00 C ATOM 935 O ILE A 367 6.645 7.735 6.078 1.00 0.00 O ATOM 936 CB ILE A 367 6.409 5.501 3.932 1.00 0.00 C ATOM 937 CG1 ILE A 367 5.023 5.460 4.578 1.00 0.00 C ATOM 938 CG2 ILE A 367 6.693 4.208 3.184 1.00 0.00 C ATOM 939 CD1 ILE A 367 4.033 6.413 3.944 1.00 0.00 C ATOM 0 H ILE A 367 6.728 5.380 6.912 1.00 0.00 H new ATOM 0 HA ILE A 367 8.471 5.484 4.603 1.00 0.00 H new ATOM 0 HB ILE A 367 6.427 6.320 3.213 1.00 0.00 H new ATOM 0 HG12 ILE A 367 4.631 4.445 4.513 1.00 0.00 H new ATOM 0 HG13 ILE A 367 5.117 5.698 5.637 1.00 0.00 H new ATOM 0 HG21 ILE A 367 5.915 4.041 2.439 1.00 0.00 H new ATOM 0 HG22 ILE A 367 7.661 4.279 2.689 1.00 0.00 H new ATOM 0 HG23 ILE A 367 6.706 3.376 3.888 1.00 0.00 H new ATOM 0 HD11 ILE A 367 3.072 6.331 4.452 1.00 0.00 H new ATOM 0 HD12 ILE A 367 4.404 7.434 4.032 1.00 0.00 H new ATOM 0 HD13 ILE A 367 3.909 6.161 2.891 1.00 0.00 H new ATOM 951 N GLU A 368 8.427 7.986 4.720 1.00 0.00 N ATOM 952 CA GLU A 368 8.529 9.425 4.920 1.00 0.00 C ATOM 953 C GLU A 368 7.630 10.159 3.926 1.00 0.00 C ATOM 954 O GLU A 368 7.174 9.572 2.944 1.00 0.00 O ATOM 955 CB GLU A 368 9.977 9.888 4.747 1.00 0.00 C ATOM 956 CG GLU A 368 10.271 11.225 5.406 1.00 0.00 C ATOM 957 CD GLU A 368 11.384 11.983 4.710 1.00 0.00 C ATOM 958 OE1 GLU A 368 11.391 12.011 3.461 1.00 0.00 O ATOM 959 OE2 GLU A 368 12.249 12.546 5.412 1.00 0.00 O ATOM 0 H GLU A 368 9.129 7.600 4.089 1.00 0.00 H new ATOM 0 HA GLU A 368 8.205 9.656 5.935 1.00 0.00 H new ATOM 0 HB2 GLU A 368 10.643 9.133 5.164 1.00 0.00 H new ATOM 0 HB3 GLU A 368 10.202 9.960 3.683 1.00 0.00 H new ATOM 0 HG2 GLU A 368 9.366 11.833 5.406 1.00 0.00 H new ATOM 0 HG3 GLU A 368 10.544 11.060 6.448 1.00 0.00 H new ATOM 966 N ILE A 369 7.379 11.439 4.183 1.00 0.00 N ATOM 967 CA ILE A 369 6.532 12.242 3.308 1.00 0.00 C ATOM 968 C ILE A 369 7.335 13.341 2.616 1.00 0.00 C ATOM 969 O ILE A 369 7.969 14.166 3.273 1.00 0.00 O ATOM 970 CB ILE A 369 5.365 12.876 4.096 1.00 0.00 C ATOM 971 CG1 ILE A 369 4.348 11.802 4.488 1.00 0.00 C ATOM 972 CG2 ILE A 369 4.693 13.976 3.284 1.00 0.00 C ATOM 973 CD1 ILE A 369 4.765 10.985 5.691 1.00 0.00 C ATOM 0 H ILE A 369 7.750 11.942 4.989 1.00 0.00 H new ATOM 0 HA ILE A 369 6.127 11.572 2.549 1.00 0.00 H new ATOM 0 HB ILE A 369 5.768 13.326 5.003 1.00 0.00 H new ATOM 0 HG12 ILE A 369 3.390 12.279 4.697 1.00 0.00 H new ATOM 0 HG13 ILE A 369 4.193 11.134 3.641 1.00 0.00 H new ATOM 0 HG21 ILE A 369 3.875 14.406 3.861 1.00 0.00 H new ATOM 0 HG22 ILE A 369 5.421 14.753 3.052 1.00 0.00 H new ATOM 0 HG23 ILE A 369 4.302 13.557 2.357 1.00 0.00 H new ATOM 0 HD11 ILE A 369 3.997 10.244 5.911 1.00 0.00 H new ATOM 0 HD12 ILE A 369 5.707 10.479 5.479 1.00 0.00 H new ATOM 0 HD13 ILE A 369 4.892 11.642 6.551 1.00 0.00 H new ATOM 985 N ILE A 370 7.299 13.344 1.286 1.00 0.00 N ATOM 986 CA ILE A 370 8.020 14.341 0.501 1.00 0.00 C ATOM 987 C ILE A 370 7.054 15.209 -0.298 1.00 0.00 C ATOM 988 O ILE A 370 7.353 16.406 -0.490 1.00 0.00 O ATOM 989 CB ILE A 370 9.020 13.684 -0.471 1.00 0.00 C ATOM 990 CG1 ILE A 370 9.029 12.164 -0.277 1.00 0.00 C ATOM 991 CG2 ILE A 370 10.415 14.263 -0.273 1.00 0.00 C ATOM 992 CD1 ILE A 370 10.083 11.448 -1.092 1.00 0.00 C ATOM 993 OXT ILE A 370 6.003 14.684 -0.723 1.00 0.00 O ATOM 0 H ILE A 370 6.778 12.667 0.729 1.00 0.00 H new ATOM 0 HA ILE A 370 8.570 14.961 1.209 1.00 0.00 H new ATOM 0 HB ILE A 370 8.706 13.898 -1.493 1.00 0.00 H new ATOM 0 HG12 ILE A 370 9.188 11.943 0.779 1.00 0.00 H new ATOM 0 HG13 ILE A 370 8.048 11.768 -0.541 1.00 0.00 H new ATOM 0 HG21 ILE A 370 11.108 13.788 -0.967 1.00 0.00 H new ATOM 0 HG22 ILE A 370 10.393 15.337 -0.460 1.00 0.00 H new ATOM 0 HG23 ILE A 370 10.743 14.079 0.750 1.00 0.00 H new ATOM 0 HD11 ILE A 370 10.026 10.377 -0.900 1.00 0.00 H new ATOM 0 HD12 ILE A 370 9.913 11.636 -2.152 1.00 0.00 H new ATOM 0 HD13 ILE A 370 11.071 11.814 -0.812 1.00 0.00 H new TER 1005 ILE A 370