USER MOD reduce.3.24.130724 H: found=0, std=0, add=600, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 599 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 366 TYR OH : rot -28:sc= 0.0753 USER MOD Set 1.2: A 387 SER OG : rot -72:sc= 0.211 USER MOD Set 1.3: A 391 GLN : amide:sc= 0.967 K(o=1.3,f=0.64) USER MOD Set 2.1: A 353 ASN : amide:sc= 1.21 K(o=2.3,f=-3.9!) USER MOD Set 2.2: A 356 THR OG1 : rot 77:sc= 1.11 USER MOD Single : A 337 TYR OH : rot -155:sc= -1.14 USER MOD Single : A 338 SER OG : rot -154:sc= 1.28 USER MOD Single : A 339 SER OG : rot 180:sc= 0 USER MOD Single : A 344 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 350 LYS NZ :NH3+ 167:sc= 1.17 (180deg=0.786) USER MOD Single : A 359 HIS : no HE2:sc= 0.721 K(o=0.72,f=-4.5!) USER MOD Single : A 367 GLN : amide:sc= 1.05 K(o=1.1,f=-0.0024) USER MOD Single : A 370 HIS : no HD1:sc= -0.0253 X(o=-0.025,f=0) USER MOD Single : A 373 SER OG : rot 99:sc= 0.309 USER MOD Single : A 375 THR OG1 : rot -35:sc= 0.525 USER MOD Single : A 376 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 379 CYS SG : rot 26:sc= 0.557 USER MOD Single : A 393 SER OG : rot -78:sc= 1.13 USER MOD Single : A 395 THR OG1 : rot 180:sc= 0.0187 USER MOD Single : A 407 GLN : amide:sc= 0.884 K(o=0.88,f=0) USER MOD Single : A 414 SER OG : rot 160:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 24 N LEU A 336 3.195 4.619 -11.765 1.00 0.00 N ATOM 25 CA LEU A 336 3.319 3.448 -10.901 1.00 0.00 C ATOM 26 C LEU A 336 3.395 3.866 -9.427 1.00 0.00 C ATOM 27 O LEU A 336 3.508 5.054 -9.111 1.00 0.00 O ATOM 28 CB LEU A 336 4.536 2.600 -11.314 1.00 0.00 C ATOM 29 CG LEU A 336 4.205 1.382 -12.191 1.00 0.00 C ATOM 30 CD1 LEU A 336 5.497 0.590 -12.366 1.00 0.00 C ATOM 31 CD2 LEU A 336 3.165 0.433 -11.591 1.00 0.00 C ATOM 0 HA LEU A 336 2.429 2.831 -11.020 1.00 0.00 H new ATOM 0 HB2 LEU A 336 5.239 3.236 -11.851 1.00 0.00 H new ATOM 0 HB3 LEU A 336 5.043 2.254 -10.413 1.00 0.00 H new ATOM 0 HG LEU A 336 3.785 1.763 -13.122 1.00 0.00 H new ATOM 0 HD11 LEU A 336 5.305 -0.287 -12.985 1.00 0.00 H new ATOM 0 HD12 LEU A 336 6.246 1.218 -12.848 1.00 0.00 H new ATOM 0 HD13 LEU A 336 5.864 0.272 -11.390 1.00 0.00 H new ATOM 0 HD21 LEU A 336 2.992 -0.397 -12.276 1.00 0.00 H new ATOM 0 HD22 LEU A 336 3.530 0.048 -10.639 1.00 0.00 H new ATOM 0 HD23 LEU A 336 2.231 0.971 -11.431 1.00 0.00 H new ATOM 43 N TYR A 337 3.472 2.883 -8.528 1.00 0.00 N ATOM 44 CA TYR A 337 3.566 3.161 -7.102 1.00 0.00 C ATOM 45 C TYR A 337 5.036 3.133 -6.687 1.00 0.00 C ATOM 46 O TYR A 337 5.555 4.151 -6.228 1.00 0.00 O ATOM 47 CB TYR A 337 2.708 2.178 -6.298 1.00 0.00 C ATOM 48 CG TYR A 337 2.251 2.773 -4.979 1.00 0.00 C ATOM 49 CD1 TYR A 337 3.145 3.151 -3.956 1.00 0.00 C ATOM 50 CD2 TYR A 337 0.884 3.050 -4.838 1.00 0.00 C ATOM 51 CE1 TYR A 337 2.659 3.806 -2.803 1.00 0.00 C ATOM 52 CE2 TYR A 337 0.411 3.741 -3.720 1.00 0.00 C ATOM 53 CZ TYR A 337 1.280 4.092 -2.675 1.00 0.00 C ATOM 54 OH TYR A 337 0.743 4.621 -1.555 1.00 0.00 O ATOM 0 H TYR A 337 3.471 1.891 -8.766 1.00 0.00 H new ATOM 0 HA TYR A 337 3.172 4.154 -6.888 1.00 0.00 H new ATOM 0 HB2 TYR A 337 1.837 1.890 -6.887 1.00 0.00 H new ATOM 0 HB3 TYR A 337 3.279 1.269 -6.108 1.00 0.00 H new ATOM 0 HD1 TYR A 337 4.200 2.940 -4.054 1.00 0.00 H new ATOM 0 HD2 TYR A 337 0.191 2.726 -5.600 1.00 0.00 H new ATOM 0 HE1 TYR A 337 3.343 4.089 -2.016 1.00 0.00 H new ATOM 0 HE2 TYR A 337 -0.634 4.008 -3.659 1.00 0.00 H new ATOM 0 HH TYR A 337 -0.206 4.382 -1.503 1.00 0.00 H new ATOM 64 N SER A 338 5.701 1.992 -6.874 1.00 0.00 N ATOM 65 CA SER A 338 7.117 1.751 -6.609 1.00 0.00 C ATOM 66 C SER A 338 8.061 2.662 -7.394 1.00 0.00 C ATOM 67 O SER A 338 9.133 3.003 -6.907 1.00 0.00 O ATOM 68 CB SER A 338 7.378 0.275 -6.929 1.00 0.00 C ATOM 69 OG SER A 338 7.020 0.035 -8.284 1.00 0.00 O ATOM 0 H SER A 338 5.235 1.161 -7.237 1.00 0.00 H new ATOM 0 HA SER A 338 7.327 1.984 -5.565 1.00 0.00 H new ATOM 0 HB2 SER A 338 8.428 0.033 -6.766 1.00 0.00 H new ATOM 0 HB3 SER A 338 6.797 -0.365 -6.265 1.00 0.00 H new ATOM 0 HG SER A 338 6.780 -0.909 -8.397 1.00 0.00 H new ATOM 75 N SER A 339 7.644 3.083 -8.590 1.00 0.00 N ATOM 76 CA SER A 339 8.434 3.886 -9.507 1.00 0.00 C ATOM 77 C SER A 339 8.955 5.160 -8.848 1.00 0.00 C ATOM 78 O SER A 339 10.021 5.619 -9.243 1.00 0.00 O ATOM 79 CB SER A 339 7.631 4.174 -10.775 1.00 0.00 C ATOM 80 OG SER A 339 8.403 4.825 -11.761 1.00 0.00 O ATOM 0 H SER A 339 6.716 2.864 -8.952 1.00 0.00 H new ATOM 0 HA SER A 339 9.318 3.315 -9.790 1.00 0.00 H new ATOM 0 HB2 SER A 339 7.245 3.238 -11.178 1.00 0.00 H new ATOM 0 HB3 SER A 339 6.769 4.793 -10.524 1.00 0.00 H new ATOM 0 HG SER A 339 7.851 4.988 -12.554 1.00 0.00 H new ATOM 86 N LEU A 340 8.158 5.808 -7.990 1.00 0.00 N ATOM 87 CA LEU A 340 8.540 7.020 -7.271 1.00 0.00 C ATOM 88 C LEU A 340 9.765 6.757 -6.375 1.00 0.00 C ATOM 89 O LEU A 340 9.591 6.175 -5.307 1.00 0.00 O ATOM 90 CB LEU A 340 7.324 7.534 -6.463 1.00 0.00 C ATOM 91 CG LEU A 340 6.943 8.958 -6.879 1.00 0.00 C ATOM 92 CD1 LEU A 340 5.551 9.306 -6.343 1.00 0.00 C ATOM 93 CD2 LEU A 340 7.968 9.983 -6.367 1.00 0.00 C ATOM 0 H LEU A 340 7.211 5.495 -7.775 1.00 0.00 H new ATOM 0 HA LEU A 340 8.832 7.795 -7.980 1.00 0.00 H new ATOM 0 HB2 LEU A 340 6.475 6.868 -6.616 1.00 0.00 H new ATOM 0 HB3 LEU A 340 7.557 7.514 -5.398 1.00 0.00 H new ATOM 0 HG LEU A 340 6.935 8.999 -7.968 1.00 0.00 H new ATOM 0 HD11 LEU A 340 5.288 10.320 -6.644 1.00 0.00 H new ATOM 0 HD12 LEU A 340 4.820 8.607 -6.748 1.00 0.00 H new ATOM 0 HD13 LEU A 340 5.553 9.239 -5.255 1.00 0.00 H new ATOM 0 HD21 LEU A 340 7.669 10.984 -6.679 1.00 0.00 H new ATOM 0 HD22 LEU A 340 8.013 9.940 -5.279 1.00 0.00 H new ATOM 0 HD23 LEU A 340 8.950 9.753 -6.780 1.00 0.00 H new ATOM 152 N LYS A 344 8.363 10.916 -1.266 1.00 0.00 N ATOM 153 CA LYS A 344 6.952 10.634 -1.462 1.00 0.00 C ATOM 154 C LYS A 344 6.587 9.205 -1.036 1.00 0.00 C ATOM 155 O LYS A 344 5.433 9.019 -0.675 1.00 0.00 O ATOM 156 CB LYS A 344 6.444 11.089 -2.844 1.00 0.00 C ATOM 157 CG LYS A 344 4.952 11.497 -2.800 1.00 0.00 C ATOM 158 CD LYS A 344 4.517 12.333 -4.017 1.00 0.00 C ATOM 159 CE LYS A 344 3.043 12.762 -3.903 1.00 0.00 C ATOM 160 NZ LYS A 344 2.613 13.624 -5.024 1.00 0.00 N ATOM 0 HA LYS A 344 6.380 11.259 -0.776 1.00 0.00 H new ATOM 0 HB2 LYS A 344 7.041 11.932 -3.192 1.00 0.00 H new ATOM 0 HB3 LYS A 344 6.580 10.283 -3.565 1.00 0.00 H new ATOM 0 HG2 LYS A 344 4.337 10.598 -2.746 1.00 0.00 H new ATOM 0 HG3 LYS A 344 4.764 12.067 -1.890 1.00 0.00 H new ATOM 0 HD2 LYS A 344 5.150 13.217 -4.099 1.00 0.00 H new ATOM 0 HD3 LYS A 344 4.660 11.753 -4.929 1.00 0.00 H new ATOM 0 HE2 LYS A 344 2.412 11.874 -3.870 1.00 0.00 H new ATOM 0 HE3 LYS A 344 2.895 13.294 -2.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 344 1.614 13.884 -4.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 344 3.195 14.486 -5.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 344 2.727 13.110 -5.921 1.00 0.00 H new ATOM 174 N ARG A 345 7.389 8.135 -1.238 1.00 0.00 N ATOM 175 CA ARG A 345 7.118 6.896 -0.493 1.00 0.00 C ATOM 176 C ARG A 345 7.228 7.079 1.014 1.00 0.00 C ATOM 177 O ARG A 345 6.322 6.634 1.688 1.00 0.00 O ATOM 178 CB ARG A 345 7.919 5.672 -0.960 1.00 0.00 C ATOM 179 CG ARG A 345 7.755 5.191 -2.416 1.00 0.00 C ATOM 180 CD ARG A 345 6.367 5.144 -3.080 1.00 0.00 C ATOM 181 NE ARG A 345 5.659 6.435 -3.044 1.00 0.00 N ATOM 182 CZ ARG A 345 4.569 6.807 -3.717 1.00 0.00 C ATOM 183 NH1 ARG A 345 4.164 6.140 -4.793 1.00 0.00 N ATOM 184 NH2 ARG A 345 3.895 7.872 -3.289 1.00 0.00 N ATOM 0 H ARG A 345 8.185 8.105 -1.875 1.00 0.00 H new ATOM 0 HA ARG A 345 6.078 6.675 -0.733 1.00 0.00 H new ATOM 0 HB2 ARG A 345 8.975 5.888 -0.800 1.00 0.00 H new ATOM 0 HB3 ARG A 345 7.661 4.839 -0.306 1.00 0.00 H new ATOM 0 HG2 ARG A 345 8.385 5.828 -3.036 1.00 0.00 H new ATOM 0 HG3 ARG A 345 8.169 4.184 -2.469 1.00 0.00 H new ATOM 0 HD2 ARG A 345 6.479 4.828 -4.117 1.00 0.00 H new ATOM 0 HD3 ARG A 345 5.759 4.390 -2.581 1.00 0.00 H new ATOM 0 HE ARG A 345 6.055 7.139 -2.421 1.00 0.00 H new ATOM 0 HH11 ARG A 345 4.689 5.328 -5.117 1.00 0.00 H new ATOM 0 HH12 ARG A 345 3.328 6.440 -5.294 1.00 0.00 H new ATOM 0 HH21 ARG A 345 4.216 8.381 -2.465 1.00 0.00 H new ATOM 0 HH22 ARG A 345 3.058 8.179 -3.785 1.00 0.00 H new ATOM 198 N GLU A 346 8.249 7.748 1.538 1.00 0.00 N ATOM 199 CA GLU A 346 8.492 7.809 2.988 1.00 0.00 C ATOM 200 C GLU A 346 7.285 8.414 3.725 1.00 0.00 C ATOM 201 O GLU A 346 6.755 7.818 4.661 1.00 0.00 O ATOM 202 CB GLU A 346 9.765 8.626 3.287 1.00 0.00 C ATOM 203 CG GLU A 346 11.064 8.058 2.686 1.00 0.00 C ATOM 204 CD GLU A 346 11.579 6.804 3.403 1.00 0.00 C ATOM 205 OE1 GLU A 346 10.817 6.169 4.159 1.00 0.00 O ATOM 206 OE2 GLU A 346 12.749 6.420 3.198 1.00 0.00 O ATOM 0 H GLU A 346 8.931 8.262 0.981 1.00 0.00 H new ATOM 0 HA GLU A 346 8.635 6.791 3.349 1.00 0.00 H new ATOM 0 HB2 GLU A 346 9.623 9.640 2.913 1.00 0.00 H new ATOM 0 HB3 GLU A 346 9.885 8.699 4.368 1.00 0.00 H new ATOM 0 HG2 GLU A 346 10.895 7.821 1.636 1.00 0.00 H new ATOM 0 HG3 GLU A 346 11.836 8.827 2.719 1.00 0.00 H new ATOM 213 N GLU A 347 6.796 9.566 3.253 1.00 0.00 N ATOM 214 CA GLU A 347 5.559 10.187 3.733 1.00 0.00 C ATOM 215 C GLU A 347 4.385 9.209 3.640 1.00 0.00 C ATOM 216 O GLU A 347 3.584 9.089 4.560 1.00 0.00 O ATOM 217 CB GLU A 347 5.320 11.469 2.911 1.00 0.00 C ATOM 218 CG GLU A 347 3.940 12.135 3.066 1.00 0.00 C ATOM 219 CD GLU A 347 3.504 12.437 4.504 1.00 0.00 C ATOM 220 OE1 GLU A 347 4.343 12.760 5.379 1.00 0.00 O ATOM 221 OE2 GLU A 347 2.287 12.376 4.785 1.00 0.00 O ATOM 0 H GLU A 347 7.256 10.100 2.516 1.00 0.00 H new ATOM 0 HA GLU A 347 5.648 10.451 4.787 1.00 0.00 H new ATOM 0 HB2 GLU A 347 6.083 12.197 3.184 1.00 0.00 H new ATOM 0 HB3 GLU A 347 5.468 11.232 1.858 1.00 0.00 H new ATOM 0 HG2 GLU A 347 3.943 13.069 2.503 1.00 0.00 H new ATOM 0 HG3 GLU A 347 3.192 11.489 2.607 1.00 0.00 H new ATOM 228 N VAL A 348 4.287 8.481 2.535 1.00 0.00 N ATOM 229 CA VAL A 348 3.214 7.538 2.286 1.00 0.00 C ATOM 230 C VAL A 348 3.297 6.305 3.181 1.00 0.00 C ATOM 231 O VAL A 348 2.246 5.769 3.507 1.00 0.00 O ATOM 232 CB VAL A 348 3.235 7.203 0.793 1.00 0.00 C ATOM 233 CG1 VAL A 348 2.568 5.896 0.384 1.00 0.00 C ATOM 234 CG2 VAL A 348 2.568 8.340 0.013 1.00 0.00 C ATOM 0 H VAL A 348 4.966 8.533 1.775 1.00 0.00 H new ATOM 0 HA VAL A 348 2.254 7.985 2.544 1.00 0.00 H new ATOM 0 HB VAL A 348 4.292 7.080 0.557 1.00 0.00 H new ATOM 0 HG11 VAL A 348 2.647 5.769 -0.696 1.00 0.00 H new ATOM 0 HG12 VAL A 348 3.062 5.063 0.884 1.00 0.00 H new ATOM 0 HG13 VAL A 348 1.517 5.919 0.670 1.00 0.00 H new ATOM 0 HG21 VAL A 348 2.580 8.107 -1.052 1.00 0.00 H new ATOM 0 HG22 VAL A 348 1.537 8.455 0.348 1.00 0.00 H new ATOM 0 HG23 VAL A 348 3.112 9.269 0.187 1.00 0.00 H new ATOM 244 N GLU A 349 4.475 5.819 3.566 1.00 0.00 N ATOM 245 CA GLU A 349 4.581 4.745 4.552 1.00 0.00 C ATOM 246 C GLU A 349 3.994 5.171 5.902 1.00 0.00 C ATOM 247 O GLU A 349 3.322 4.404 6.590 1.00 0.00 O ATOM 248 CB GLU A 349 6.014 4.206 4.671 1.00 0.00 C ATOM 249 CG GLU A 349 6.496 3.633 3.326 1.00 0.00 C ATOM 250 CD GLU A 349 7.722 2.725 3.411 1.00 0.00 C ATOM 251 OE1 GLU A 349 8.070 2.240 4.515 1.00 0.00 O ATOM 252 OE2 GLU A 349 8.350 2.532 2.349 1.00 0.00 O ATOM 0 H GLU A 349 5.371 6.152 3.210 1.00 0.00 H new ATOM 0 HA GLU A 349 3.978 3.910 4.194 1.00 0.00 H new ATOM 0 HB2 GLU A 349 6.682 5.005 4.991 1.00 0.00 H new ATOM 0 HB3 GLU A 349 6.053 3.431 5.437 1.00 0.00 H new ATOM 0 HG2 GLU A 349 5.678 3.072 2.874 1.00 0.00 H new ATOM 0 HG3 GLU A 349 6.723 4.462 2.656 1.00 0.00 H new ATOM 259 N LYS A 350 4.186 6.443 6.247 1.00 0.00 N ATOM 260 CA LYS A 350 3.508 7.114 7.345 1.00 0.00 C ATOM 261 C LYS A 350 2.010 7.331 7.097 1.00 0.00 C ATOM 262 O LYS A 350 1.266 7.377 8.077 1.00 0.00 O ATOM 263 CB LYS A 350 4.338 8.378 7.637 1.00 0.00 C ATOM 264 CG LYS A 350 3.719 9.440 8.556 1.00 0.00 C ATOM 265 CD LYS A 350 3.017 10.461 7.640 1.00 0.00 C ATOM 266 CE LYS A 350 2.578 11.742 8.346 1.00 0.00 C ATOM 267 NZ LYS A 350 2.451 12.831 7.355 1.00 0.00 N ATOM 0 H LYS A 350 4.839 7.050 5.752 1.00 0.00 H new ATOM 0 HA LYS A 350 3.473 6.496 8.242 1.00 0.00 H new ATOM 0 HB2 LYS A 350 5.284 8.064 8.077 1.00 0.00 H new ATOM 0 HB3 LYS A 350 4.572 8.854 6.684 1.00 0.00 H new ATOM 0 HG2 LYS A 350 3.008 8.987 9.247 1.00 0.00 H new ATOM 0 HG3 LYS A 350 4.486 9.925 9.160 1.00 0.00 H new ATOM 0 HD2 LYS A 350 3.691 10.723 6.824 1.00 0.00 H new ATOM 0 HD3 LYS A 350 2.142 9.989 7.193 1.00 0.00 H new ATOM 0 HE2 LYS A 350 1.626 11.583 8.852 1.00 0.00 H new ATOM 0 HE3 LYS A 350 3.304 12.015 9.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 350 1.948 13.634 7.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 350 3.398 13.137 7.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 350 1.918 12.489 6.530 1.00 0.00 H new ATOM 281 N LEU A 351 1.541 7.443 5.851 1.00 0.00 N ATOM 282 CA LEU A 351 0.113 7.549 5.546 1.00 0.00 C ATOM 283 C LEU A 351 -0.567 6.182 5.625 1.00 0.00 C ATOM 284 O LEU A 351 -1.496 6.014 6.410 1.00 0.00 O ATOM 285 CB LEU A 351 -0.165 8.158 4.163 1.00 0.00 C ATOM 286 CG LEU A 351 0.218 9.630 3.960 1.00 0.00 C ATOM 287 CD1 LEU A 351 0.042 10.012 2.483 1.00 0.00 C ATOM 288 CD2 LEU A 351 -0.653 10.534 4.829 1.00 0.00 C ATOM 0 H LEU A 351 2.141 7.463 5.026 1.00 0.00 H new ATOM 0 HA LEU A 351 -0.299 8.220 6.300 1.00 0.00 H new ATOM 0 HB2 LEU A 351 0.366 7.564 3.419 1.00 0.00 H new ATOM 0 HB3 LEU A 351 -1.230 8.053 3.955 1.00 0.00 H new ATOM 0 HG LEU A 351 1.260 9.762 4.250 1.00 0.00 H new ATOM 0 HD11 LEU A 351 0.315 11.058 2.343 1.00 0.00 H new ATOM 0 HD12 LEU A 351 0.684 9.384 1.866 1.00 0.00 H new ATOM 0 HD13 LEU A 351 -0.998 9.866 2.191 1.00 0.00 H new ATOM 0 HD21 LEU A 351 -0.368 11.574 4.672 1.00 0.00 H new ATOM 0 HD22 LEU A 351 -1.700 10.400 4.558 1.00 0.00 H new ATOM 0 HD23 LEU A 351 -0.514 10.274 5.878 1.00 0.00 H new ATOM 300 N LEU A 352 -0.138 5.215 4.800 1.00 0.00 N ATOM 301 CA LEU A 352 -0.533 3.800 4.795 1.00 0.00 C ATOM 302 C LEU A 352 0.093 3.137 6.021 1.00 0.00 C ATOM 303 O LEU A 352 0.874 2.199 5.909 1.00 0.00 O ATOM 304 CB LEU A 352 -0.138 3.113 3.465 1.00 0.00 C ATOM 305 CG LEU A 352 -0.889 3.601 2.204 1.00 0.00 C ATOM 306 CD1 LEU A 352 -0.341 2.933 0.942 1.00 0.00 C ATOM 307 CD2 LEU A 352 -2.397 3.308 2.205 1.00 0.00 C ATOM 0 H LEU A 352 0.542 5.417 4.067 1.00 0.00 H new ATOM 0 HA LEU A 352 -1.617 3.701 4.857 1.00 0.00 H new ATOM 0 HB2 LEU A 352 0.931 3.258 3.307 1.00 0.00 H new ATOM 0 HB3 LEU A 352 -0.302 2.040 3.570 1.00 0.00 H new ATOM 0 HG LEU A 352 -0.731 4.679 2.215 1.00 0.00 H new ATOM 0 HD11 LEU A 352 -0.888 3.295 0.072 1.00 0.00 H new ATOM 0 HD12 LEU A 352 0.716 3.174 0.832 1.00 0.00 H new ATOM 0 HD13 LEU A 352 -0.460 1.852 1.021 1.00 0.00 H new ATOM 0 HD21 LEU A 352 -2.841 3.685 1.284 1.00 0.00 H new ATOM 0 HD22 LEU A 352 -2.559 2.232 2.272 1.00 0.00 H new ATOM 0 HD23 LEU A 352 -2.862 3.799 3.060 1.00 0.00 H new ATOM 319 N ASN A 353 -0.260 3.665 7.189 1.00 0.00 N ATOM 320 CA ASN A 353 0.315 3.398 8.491 1.00 0.00 C ATOM 321 C ASN A 353 0.082 1.955 8.931 1.00 0.00 C ATOM 322 O ASN A 353 -0.715 1.222 8.336 1.00 0.00 O ATOM 323 CB ASN A 353 -0.283 4.378 9.521 1.00 0.00 C ATOM 324 CG ASN A 353 -1.646 3.926 10.054 1.00 0.00 C ATOM 325 OD1 ASN A 353 -2.551 3.564 9.307 1.00 0.00 O ATOM 326 ND2 ASN A 353 -1.827 3.908 11.364 1.00 0.00 N ATOM 0 H ASN A 353 -1.018 4.345 7.247 1.00 0.00 H new ATOM 0 HA ASN A 353 1.393 3.542 8.425 1.00 0.00 H new ATOM 0 HB2 ASN A 353 0.410 4.487 10.356 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -0.386 5.361 9.062 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -2.717 3.594 11.752 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -1.077 4.208 11.987 1.00 0.00 H new ATOM 333 N GLY A 354 0.737 1.577 10.036 1.00 0.00 N ATOM 334 CA GLY A 354 0.565 0.314 10.746 1.00 0.00 C ATOM 335 C GLY A 354 -0.826 0.190 11.374 1.00 0.00 C ATOM 336 O GLY A 354 -0.950 0.184 12.592 1.00 0.00 O ATOM 0 H GLY A 354 1.434 2.177 10.477 1.00 0.00 H new ATOM 0 HA2 GLY A 354 0.725 -0.514 10.056 1.00 0.00 H new ATOM 0 HA3 GLY A 354 1.323 0.231 11.525 1.00 0.00 H new ATOM 340 N ASP A 355 -1.839 0.064 10.522 1.00 0.00 N ATOM 341 CA ASP A 355 -3.265 -0.143 10.751 1.00 0.00 C ATOM 342 C ASP A 355 -3.957 -0.155 9.394 1.00 0.00 C ATOM 343 O ASP A 355 -4.429 -1.198 8.930 1.00 0.00 O ATOM 344 CB ASP A 355 -3.898 0.956 11.625 1.00 0.00 C ATOM 345 CG ASP A 355 -5.426 0.850 11.588 1.00 0.00 C ATOM 346 OD1 ASP A 355 -5.949 -0.193 12.027 1.00 0.00 O ATOM 347 OD2 ASP A 355 -6.051 1.785 11.028 1.00 0.00 O ATOM 0 H ASP A 355 -1.652 0.111 9.520 1.00 0.00 H new ATOM 0 HA ASP A 355 -3.390 -1.085 11.285 1.00 0.00 H new ATOM 0 HB2 ASP A 355 -3.545 0.862 12.652 1.00 0.00 H new ATOM 0 HB3 ASP A 355 -3.586 1.938 11.269 1.00 0.00 H new ATOM 352 N THR A 356 -3.965 0.997 8.719 1.00 0.00 N ATOM 353 CA THR A 356 -4.776 1.171 7.529 1.00 0.00 C ATOM 354 C THR A 356 -4.249 0.258 6.426 1.00 0.00 C ATOM 355 O THR A 356 -5.035 -0.271 5.637 1.00 0.00 O ATOM 356 CB THR A 356 -4.750 2.630 7.055 1.00 0.00 C ATOM 357 OG1 THR A 356 -4.995 3.511 8.134 1.00 0.00 O ATOM 358 CG2 THR A 356 -5.863 2.799 6.005 1.00 0.00 C ATOM 0 H THR A 356 -3.418 1.817 8.982 1.00 0.00 H new ATOM 0 HA THR A 356 -5.808 0.911 7.766 1.00 0.00 H new ATOM 0 HB THR A 356 -3.771 2.864 6.637 1.00 0.00 H new ATOM 0 HG1 THR A 356 -4.188 3.585 8.685 1.00 0.00 H new ATOM 0 HG21 THR A 356 -5.872 3.828 5.646 1.00 0.00 H new ATOM 0 HG22 THR A 356 -5.679 2.125 5.168 1.00 0.00 H new ATOM 0 HG23 THR A 356 -6.827 2.564 6.456 1.00 0.00 H new ATOM 366 N TRP A 357 -2.924 0.059 6.373 1.00 0.00 N ATOM 367 CA TRP A 357 -2.308 -0.815 5.395 1.00 0.00 C ATOM 368 C TRP A 357 -3.012 -2.183 5.425 1.00 0.00 C ATOM 369 O TRP A 357 -3.418 -2.654 4.376 1.00 0.00 O ATOM 370 CB TRP A 357 -0.788 -0.909 5.605 1.00 0.00 C ATOM 371 CG TRP A 357 -0.349 -2.036 6.496 1.00 0.00 C ATOM 372 CD1 TRP A 357 -0.222 -2.010 7.837 1.00 0.00 C ATOM 373 CD2 TRP A 357 -0.151 -3.427 6.114 1.00 0.00 C ATOM 374 NE1 TRP A 357 0.016 -3.283 8.316 1.00 0.00 N ATOM 375 CE2 TRP A 357 0.112 -4.196 7.280 1.00 0.00 C ATOM 376 CE3 TRP A 357 -0.251 -4.122 4.895 1.00 0.00 C ATOM 377 CZ2 TRP A 357 0.352 -5.577 7.188 1.00 0.00 C ATOM 378 CZ3 TRP A 357 0.052 -5.489 4.792 1.00 0.00 C ATOM 379 CH2 TRP A 357 0.364 -6.208 5.948 1.00 0.00 C ATOM 0 H TRP A 357 -2.262 0.503 7.009 1.00 0.00 H new ATOM 0 HA TRP A 357 -2.436 -0.398 4.396 1.00 0.00 H new ATOM 0 HB2 TRP A 357 -0.306 -1.022 4.634 1.00 0.00 H new ATOM 0 HB3 TRP A 357 -0.434 0.031 6.029 1.00 0.00 H new ATOM 0 HD1 TRP A 357 -0.296 -1.123 8.448 1.00 0.00 H new ATOM 0 HE1 TRP A 357 0.109 -3.520 9.304 1.00 0.00 H new ATOM 0 HE3 TRP A 357 -0.570 -3.588 4.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 357 0.528 -6.152 8.085 1.00 0.00 H new ATOM 0 HZ3 TRP A 357 0.044 -5.979 3.830 1.00 0.00 H new ATOM 0 HH2 TRP A 357 0.615 -7.256 5.879 1.00 0.00 H new ATOM 390 N ARG A 358 -3.143 -2.832 6.596 1.00 0.00 N ATOM 391 CA ARG A 358 -3.891 -4.076 6.807 1.00 0.00 C ATOM 392 C ARG A 358 -5.229 -4.113 6.077 1.00 0.00 C ATOM 393 O ARG A 358 -5.536 -5.129 5.460 1.00 0.00 O ATOM 394 CB ARG A 358 -4.005 -4.478 8.294 1.00 0.00 C ATOM 395 CG ARG A 358 -3.140 -5.709 8.624 1.00 0.00 C ATOM 396 CD ARG A 358 -3.453 -6.261 10.022 1.00 0.00 C ATOM 397 NE ARG A 358 -2.478 -7.275 10.476 1.00 0.00 N ATOM 398 CZ ARG A 358 -2.539 -8.609 10.322 1.00 0.00 C ATOM 399 NH1 ARG A 358 -3.449 -9.177 9.540 1.00 0.00 N ATOM 400 NH2 ARG A 358 -1.677 -9.375 10.976 1.00 0.00 N ATOM 0 H ARG A 358 -2.712 -2.487 7.453 1.00 0.00 H new ATOM 0 HA ARG A 358 -3.284 -4.851 6.339 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -3.699 -3.641 8.921 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -5.047 -4.691 8.534 1.00 0.00 H new ATOM 0 HG2 ARG A 358 -3.312 -6.486 7.879 1.00 0.00 H new ATOM 0 HG3 ARG A 358 -2.085 -5.439 8.566 1.00 0.00 H new ATOM 0 HD2 ARG A 358 -3.471 -5.437 10.736 1.00 0.00 H new ATOM 0 HD3 ARG A 358 -4.450 -6.701 10.018 1.00 0.00 H new ATOM 0 HE ARG A 358 -1.658 -6.919 10.967 1.00 0.00 H new ATOM 0 HH11 ARG A 358 -4.123 -8.599 9.039 1.00 0.00 H new ATOM 0 HH12 ARG A 358 -3.474 -10.192 9.440 1.00 0.00 H new ATOM 0 HH21 ARG A 358 -0.979 -8.951 11.587 1.00 0.00 H new ATOM 0 HH22 ARG A 358 -1.712 -10.389 10.868 1.00 0.00 H new ATOM 414 N HIS A 359 -6.034 -3.051 6.210 1.00 0.00 N ATOM 415 CA HIS A 359 -7.352 -2.963 5.583 1.00 0.00 C ATOM 416 C HIS A 359 -7.180 -3.148 4.071 1.00 0.00 C ATOM 417 O HIS A 359 -7.788 -4.011 3.443 1.00 0.00 O ATOM 418 CB HIS A 359 -8.023 -1.591 5.827 1.00 0.00 C ATOM 419 CG HIS A 359 -8.266 -1.095 7.237 1.00 0.00 C ATOM 420 ND1 HIS A 359 -7.432 -1.148 8.342 1.00 0.00 N ATOM 421 CD2 HIS A 359 -9.327 -0.294 7.570 1.00 0.00 C ATOM 422 CE1 HIS A 359 -8.006 -0.419 9.318 1.00 0.00 C ATOM 423 NE2 HIS A 359 -9.146 0.149 8.880 1.00 0.00 N ATOM 0 H HIS A 359 -5.785 -2.228 6.758 1.00 0.00 H new ATOM 0 HA HIS A 359 -7.986 -3.735 6.020 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -7.414 -0.841 5.322 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -8.989 -1.611 5.322 1.00 0.00 H new ATOM 0 HD1 HIS A 359 -6.545 -1.648 8.405 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -10.160 -0.048 6.928 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -7.607 -0.305 10.315 1.00 0.00 H new ATOM 431 N LEU A 360 -6.336 -2.292 3.500 1.00 0.00 N ATOM 432 CA LEU A 360 -5.995 -2.200 2.102 1.00 0.00 C ATOM 433 C LEU A 360 -5.332 -3.471 1.568 1.00 0.00 C ATOM 434 O LEU A 360 -5.545 -3.806 0.411 1.00 0.00 O ATOM 435 CB LEU A 360 -5.137 -0.941 1.997 1.00 0.00 C ATOM 436 CG LEU A 360 -4.333 -0.826 0.704 1.00 0.00 C ATOM 437 CD1 LEU A 360 -5.274 -0.505 -0.451 1.00 0.00 C ATOM 438 CD2 LEU A 360 -3.303 0.279 0.879 1.00 0.00 C ATOM 0 H LEU A 360 -5.840 -1.595 4.055 1.00 0.00 H new ATOM 0 HA LEU A 360 -6.874 -2.119 1.463 1.00 0.00 H new ATOM 0 HB2 LEU A 360 -5.784 -0.068 2.086 1.00 0.00 H new ATOM 0 HB3 LEU A 360 -4.448 -0.915 2.841 1.00 0.00 H new ATOM 0 HG LEU A 360 -3.825 -1.764 0.482 1.00 0.00 H new ATOM 0 HD11 LEU A 360 -4.701 -0.423 -1.375 1.00 0.00 H new ATOM 0 HD12 LEU A 360 -6.012 -1.301 -0.551 1.00 0.00 H new ATOM 0 HD13 LEU A 360 -5.783 0.439 -0.254 1.00 0.00 H new ATOM 0 HD21 LEU A 360 -2.717 0.378 -0.035 1.00 0.00 H new ATOM 0 HD22 LEU A 360 -3.811 1.220 1.088 1.00 0.00 H new ATOM 0 HD23 LEU A 360 -2.642 0.032 1.709 1.00 0.00 H new ATOM 450 N ALA A 361 -4.473 -4.124 2.347 1.00 0.00 N ATOM 451 CA ALA A 361 -3.650 -5.254 1.942 1.00 0.00 C ATOM 452 C ALA A 361 -4.484 -6.313 1.211 1.00 0.00 C ATOM 453 O ALA A 361 -4.109 -6.726 0.117 1.00 0.00 O ATOM 454 CB ALA A 361 -2.896 -5.796 3.167 1.00 0.00 C ATOM 0 H ALA A 361 -4.327 -3.865 3.323 1.00 0.00 H new ATOM 0 HA ALA A 361 -2.902 -4.931 1.218 1.00 0.00 H new ATOM 0 HB1 ALA A 361 -2.278 -6.643 2.869 1.00 0.00 H new ATOM 0 HB2 ALA A 361 -2.262 -5.012 3.580 1.00 0.00 H new ATOM 0 HB3 ALA A 361 -3.613 -6.118 3.922 1.00 0.00 H new ATOM 460 N GLY A 362 -5.629 -6.709 1.775 1.00 0.00 N ATOM 461 CA GLY A 362 -6.532 -7.653 1.126 1.00 0.00 C ATOM 462 C GLY A 362 -7.128 -7.089 -0.160 1.00 0.00 C ATOM 463 O GLY A 362 -7.232 -7.784 -1.171 1.00 0.00 O ATOM 0 H GLY A 362 -5.951 -6.385 2.687 1.00 0.00 H new ATOM 0 HA2 GLY A 362 -5.993 -8.573 0.901 1.00 0.00 H new ATOM 0 HA3 GLY A 362 -7.337 -7.915 1.813 1.00 0.00 H new ATOM 467 N GLU A 363 -7.497 -5.809 -0.138 1.00 0.00 N ATOM 468 CA GLU A 363 -8.105 -5.115 -1.262 1.00 0.00 C ATOM 469 C GLU A 363 -7.132 -4.939 -2.438 1.00 0.00 C ATOM 470 O GLU A 363 -7.571 -4.649 -3.557 1.00 0.00 O ATOM 471 CB GLU A 363 -8.656 -3.765 -0.764 1.00 0.00 C ATOM 472 CG GLU A 363 -9.802 -3.930 0.250 1.00 0.00 C ATOM 473 CD GLU A 363 -11.135 -4.230 -0.439 1.00 0.00 C ATOM 474 OE1 GLU A 363 -11.209 -5.183 -1.249 1.00 0.00 O ATOM 475 OE2 GLU A 363 -12.074 -3.420 -0.315 1.00 0.00 O ATOM 0 H GLU A 363 -7.377 -5.216 0.683 1.00 0.00 H new ATOM 0 HA GLU A 363 -8.923 -5.721 -1.652 1.00 0.00 H new ATOM 0 HB2 GLU A 363 -7.849 -3.195 -0.304 1.00 0.00 H new ATOM 0 HB3 GLU A 363 -9.011 -3.185 -1.616 1.00 0.00 H new ATOM 0 HG2 GLU A 363 -9.561 -4.737 0.942 1.00 0.00 H new ATOM 0 HG3 GLU A 363 -9.896 -3.020 0.842 1.00 0.00 H new ATOM 482 N LEU A 364 -5.832 -5.159 -2.214 1.00 0.00 N ATOM 483 CA LEU A 364 -4.777 -5.200 -3.228 1.00 0.00 C ATOM 484 C LEU A 364 -4.561 -6.608 -3.798 1.00 0.00 C ATOM 485 O LEU A 364 -3.490 -6.901 -4.327 1.00 0.00 O ATOM 486 CB LEU A 364 -3.476 -4.634 -2.631 1.00 0.00 C ATOM 487 CG LEU A 364 -3.556 -3.134 -2.328 1.00 0.00 C ATOM 488 CD1 LEU A 364 -2.290 -2.681 -1.604 1.00 0.00 C ATOM 489 CD2 LEU A 364 -3.704 -2.285 -3.590 1.00 0.00 C ATOM 0 H LEU A 364 -5.471 -5.321 -1.274 1.00 0.00 H new ATOM 0 HA LEU A 364 -5.091 -4.581 -4.068 1.00 0.00 H new ATOM 0 HB2 LEU A 364 -3.241 -5.172 -1.713 1.00 0.00 H new ATOM 0 HB3 LEU A 364 -2.656 -4.815 -3.326 1.00 0.00 H new ATOM 0 HG LEU A 364 -4.441 -2.991 -1.708 1.00 0.00 H new ATOM 0 HD11 LEU A 364 -2.354 -1.614 -1.392 1.00 0.00 H new ATOM 0 HD12 LEU A 364 -2.189 -3.231 -0.669 1.00 0.00 H new ATOM 0 HD13 LEU A 364 -1.422 -2.874 -2.234 1.00 0.00 H new ATOM 0 HD21 LEU A 364 -3.756 -1.231 -3.316 1.00 0.00 H new ATOM 0 HD22 LEU A 364 -2.845 -2.449 -4.241 1.00 0.00 H new ATOM 0 HD23 LEU A 364 -4.616 -2.569 -4.114 1.00 0.00 H new ATOM 501 N GLY A 365 -5.606 -7.438 -3.814 1.00 0.00 N ATOM 502 CA GLY A 365 -5.565 -8.817 -4.287 1.00 0.00 C ATOM 503 C GLY A 365 -4.471 -9.686 -3.681 1.00 0.00 C ATOM 504 O GLY A 365 -3.991 -10.604 -4.344 1.00 0.00 O ATOM 0 H GLY A 365 -6.531 -7.157 -3.488 1.00 0.00 H new ATOM 0 HA2 GLY A 365 -6.529 -9.282 -4.082 1.00 0.00 H new ATOM 0 HA3 GLY A 365 -5.439 -8.808 -5.370 1.00 0.00 H new ATOM 508 N TYR A 366 -4.137 -9.464 -2.412 1.00 0.00 N ATOM 509 CA TYR A 366 -3.251 -10.326 -1.654 1.00 0.00 C ATOM 510 C TYR A 366 -4.087 -11.060 -0.610 1.00 0.00 C ATOM 511 O TYR A 366 -4.667 -10.440 0.278 1.00 0.00 O ATOM 512 CB TYR A 366 -2.124 -9.484 -1.047 1.00 0.00 C ATOM 513 CG TYR A 366 -0.995 -9.058 -1.982 1.00 0.00 C ATOM 514 CD1 TYR A 366 -0.451 -9.945 -2.936 1.00 0.00 C ATOM 515 CD2 TYR A 366 -0.382 -7.809 -1.768 1.00 0.00 C ATOM 516 CE1 TYR A 366 0.712 -9.604 -3.647 1.00 0.00 C ATOM 517 CE2 TYR A 366 0.803 -7.478 -2.442 1.00 0.00 C ATOM 518 CZ TYR A 366 1.358 -8.379 -3.375 1.00 0.00 C ATOM 519 OH TYR A 366 2.571 -8.097 -3.924 1.00 0.00 O ATOM 0 H TYR A 366 -4.483 -8.666 -1.879 1.00 0.00 H new ATOM 0 HA TYR A 366 -2.772 -11.075 -2.284 1.00 0.00 H new ATOM 0 HB2 TYR A 366 -2.566 -8.585 -0.619 1.00 0.00 H new ATOM 0 HB3 TYR A 366 -1.687 -10.048 -0.223 1.00 0.00 H new ATOM 0 HD1 TYR A 366 -0.933 -10.894 -3.121 1.00 0.00 H new ATOM 0 HD2 TYR A 366 -0.826 -7.103 -1.082 1.00 0.00 H new ATOM 0 HE1 TYR A 366 1.108 -10.274 -4.396 1.00 0.00 H new ATOM 0 HE2 TYR A 366 1.290 -6.534 -2.247 1.00 0.00 H new ATOM 0 HH TYR A 366 3.057 -8.932 -4.091 1.00 0.00 H new ATOM 529 N GLN A 367 -4.204 -12.384 -0.761 1.00 0.00 N ATOM 530 CA GLN A 367 -4.888 -13.269 0.182 1.00 0.00 C ATOM 531 C GLN A 367 -4.386 -13.056 1.628 1.00 0.00 C ATOM 532 O GLN A 367 -3.253 -12.605 1.811 1.00 0.00 O ATOM 533 CB GLN A 367 -4.694 -14.726 -0.285 1.00 0.00 C ATOM 534 CG GLN A 367 -5.987 -15.341 -0.840 1.00 0.00 C ATOM 535 CD GLN A 367 -5.890 -16.854 -1.051 1.00 0.00 C ATOM 536 OE1 GLN A 367 -6.191 -17.356 -2.128 1.00 0.00 O ATOM 537 NE2 GLN A 367 -5.514 -17.621 -0.039 1.00 0.00 N ATOM 0 H GLN A 367 -3.815 -12.880 -1.563 1.00 0.00 H new ATOM 0 HA GLN A 367 -5.952 -13.035 0.196 1.00 0.00 H new ATOM 0 HB2 GLN A 367 -3.921 -14.758 -1.053 1.00 0.00 H new ATOM 0 HB3 GLN A 367 -4.338 -15.328 0.551 1.00 0.00 H new ATOM 0 HG2 GLN A 367 -6.807 -15.128 -0.154 1.00 0.00 H new ATOM 0 HG3 GLN A 367 -6.232 -14.863 -1.788 1.00 0.00 H new ATOM 0 HE21 GLN A 367 -5.264 -17.199 0.855 1.00 0.00 H new ATOM 0 HE22 GLN A 367 -5.474 -18.634 -0.154 1.00 0.00 H new ATOM 546 N PRO A 368 -5.151 -13.437 2.671 1.00 0.00 N ATOM 547 CA PRO A 368 -4.800 -13.115 4.052 1.00 0.00 C ATOM 548 C PRO A 368 -3.489 -13.761 4.501 1.00 0.00 C ATOM 549 O PRO A 368 -2.791 -13.188 5.335 1.00 0.00 O ATOM 550 CB PRO A 368 -5.993 -13.548 4.907 1.00 0.00 C ATOM 551 CG PRO A 368 -6.679 -14.617 4.060 1.00 0.00 C ATOM 552 CD PRO A 368 -6.411 -14.161 2.626 1.00 0.00 C ATOM 0 HA PRO A 368 -4.613 -12.047 4.159 1.00 0.00 H new ATOM 0 HB2 PRO A 368 -5.672 -13.946 5.870 1.00 0.00 H new ATOM 0 HB3 PRO A 368 -6.661 -12.712 5.114 1.00 0.00 H new ATOM 0 HG2 PRO A 368 -6.265 -15.607 4.251 1.00 0.00 H new ATOM 0 HG3 PRO A 368 -7.747 -14.672 4.271 1.00 0.00 H new ATOM 0 HD2 PRO A 368 -6.349 -15.013 1.950 1.00 0.00 H new ATOM 0 HD3 PRO A 368 -7.216 -13.523 2.261 1.00 0.00 H new ATOM 560 N GLU A 369 -3.106 -14.891 3.907 1.00 0.00 N ATOM 561 CA GLU A 369 -1.837 -15.557 4.153 1.00 0.00 C ATOM 562 C GLU A 369 -0.659 -14.635 3.806 1.00 0.00 C ATOM 563 O GLU A 369 0.369 -14.681 4.481 1.00 0.00 O ATOM 564 CB GLU A 369 -1.761 -16.859 3.334 1.00 0.00 C ATOM 565 CG GLU A 369 -2.788 -17.939 3.735 1.00 0.00 C ATOM 566 CD GLU A 369 -4.249 -17.638 3.357 1.00 0.00 C ATOM 567 OE1 GLU A 369 -4.484 -16.827 2.429 1.00 0.00 O ATOM 568 OE2 GLU A 369 -5.150 -18.218 3.995 1.00 0.00 O ATOM 0 H GLU A 369 -3.688 -15.377 3.225 1.00 0.00 H new ATOM 0 HA GLU A 369 -1.773 -15.801 5.213 1.00 0.00 H new ATOM 0 HB2 GLU A 369 -1.902 -16.617 2.281 1.00 0.00 H new ATOM 0 HB3 GLU A 369 -0.759 -17.276 3.434 1.00 0.00 H new ATOM 0 HG2 GLU A 369 -2.498 -18.881 3.271 1.00 0.00 H new ATOM 0 HG3 GLU A 369 -2.733 -18.085 4.814 1.00 0.00 H new ATOM 575 N HIS A 370 -0.811 -13.779 2.786 1.00 0.00 N ATOM 576 CA HIS A 370 0.155 -12.742 2.440 1.00 0.00 C ATOM 577 C HIS A 370 0.112 -11.629 3.482 1.00 0.00 C ATOM 578 O HIS A 370 1.160 -11.169 3.914 1.00 0.00 O ATOM 579 CB HIS A 370 -0.146 -12.097 1.081 1.00 0.00 C ATOM 580 CG HIS A 370 -0.150 -13.006 -0.118 1.00 0.00 C ATOM 581 ND1 HIS A 370 0.726 -12.933 -1.176 1.00 0.00 N ATOM 582 CD2 HIS A 370 -1.096 -13.945 -0.424 1.00 0.00 C ATOM 583 CE1 HIS A 370 0.312 -13.813 -2.104 1.00 0.00 C ATOM 584 NE2 HIS A 370 -0.799 -14.446 -1.693 1.00 0.00 N ATOM 0 H HIS A 370 -1.625 -13.793 2.171 1.00 0.00 H new ATOM 0 HA HIS A 370 1.131 -13.226 2.402 1.00 0.00 H new ATOM 0 HB2 HIS A 370 -1.121 -11.614 1.143 1.00 0.00 H new ATOM 0 HB3 HIS A 370 0.589 -11.311 0.908 1.00 0.00 H new ATOM 0 HD2 HIS A 370 -1.923 -14.245 0.202 1.00 0.00 H new ATOM 0 HE1 HIS A 370 0.805 -13.987 -3.049 1.00 0.00 H new ATOM 0 HE2 HIS A 370 -1.323 -15.154 -2.207 1.00 0.00 H new ATOM 592 N ILE A 371 -1.084 -11.159 3.856 1.00 0.00 N ATOM 593 CA ILE A 371 -1.257 -10.015 4.752 1.00 0.00 C ATOM 594 C ILE A 371 -0.555 -10.314 6.076 1.00 0.00 C ATOM 595 O ILE A 371 0.207 -9.489 6.580 1.00 0.00 O ATOM 596 CB ILE A 371 -2.754 -9.680 4.969 1.00 0.00 C ATOM 597 CG1 ILE A 371 -3.506 -9.501 3.631 1.00 0.00 C ATOM 598 CG2 ILE A 371 -2.884 -8.417 5.844 1.00 0.00 C ATOM 599 CD1 ILE A 371 -5.015 -9.306 3.809 1.00 0.00 C ATOM 0 H ILE A 371 -1.964 -11.567 3.541 1.00 0.00 H new ATOM 0 HA ILE A 371 -0.807 -9.133 4.295 1.00 0.00 H new ATOM 0 HB ILE A 371 -3.217 -10.522 5.483 1.00 0.00 H new ATOM 0 HG12 ILE A 371 -3.095 -8.641 3.103 1.00 0.00 H new ATOM 0 HG13 ILE A 371 -3.330 -10.375 3.003 1.00 0.00 H new ATOM 0 HG21 ILE A 371 -3.938 -8.185 5.994 1.00 0.00 H new ATOM 0 HG22 ILE A 371 -2.410 -8.593 6.810 1.00 0.00 H new ATOM 0 HG23 ILE A 371 -2.395 -7.579 5.348 1.00 0.00 H new ATOM 0 HD11 ILE A 371 -5.484 -9.186 2.832 1.00 0.00 H new ATOM 0 HD12 ILE A 371 -5.438 -10.177 4.310 1.00 0.00 H new ATOM 0 HD13 ILE A 371 -5.198 -8.416 4.411 1.00 0.00 H new ATOM 611 N ASP A 372 -0.804 -11.486 6.651 1.00 0.00 N ATOM 612 CA ASP A 372 -0.163 -11.848 7.905 1.00 0.00 C ATOM 613 C ASP A 372 1.328 -12.120 7.679 1.00 0.00 C ATOM 614 O ASP A 372 2.131 -11.861 8.574 1.00 0.00 O ATOM 615 CB ASP A 372 -0.926 -12.970 8.622 1.00 0.00 C ATOM 616 CG ASP A 372 -1.807 -12.322 9.693 1.00 0.00 C ATOM 617 OD1 ASP A 372 -2.911 -11.839 9.353 1.00 0.00 O ATOM 618 OD2 ASP A 372 -1.332 -12.091 10.826 1.00 0.00 O ATOM 0 H ASP A 372 -1.437 -12.191 6.273 1.00 0.00 H new ATOM 0 HA ASP A 372 -0.208 -11.007 8.597 1.00 0.00 H new ATOM 0 HB2 ASP A 372 -1.535 -13.532 7.914 1.00 0.00 H new ATOM 0 HB3 ASP A 372 -0.231 -13.677 9.075 1.00 0.00 H new ATOM 623 N SER A 373 1.734 -12.571 6.484 1.00 0.00 N ATOM 624 CA SER A 373 3.147 -12.827 6.213 1.00 0.00 C ATOM 625 C SER A 373 3.911 -11.520 5.939 1.00 0.00 C ATOM 626 O SER A 373 5.126 -11.489 6.077 1.00 0.00 O ATOM 627 CB SER A 373 3.242 -13.678 4.943 1.00 0.00 C ATOM 628 OG SER A 373 3.162 -15.053 5.257 1.00 0.00 O ATOM 0 H SER A 373 1.109 -12.763 5.701 1.00 0.00 H new ATOM 0 HA SER A 373 3.579 -13.323 7.082 1.00 0.00 H new ATOM 0 HB2 SER A 373 2.438 -13.409 4.258 1.00 0.00 H new ATOM 0 HB3 SER A 373 4.181 -13.471 4.430 1.00 0.00 H new ATOM 0 HG SER A 373 2.250 -15.373 5.095 1.00 0.00 H new ATOM 634 N PHE A 374 3.215 -10.405 5.740 1.00 0.00 N ATOM 635 CA PHE A 374 3.811 -9.114 5.384 1.00 0.00 C ATOM 636 C PHE A 374 4.170 -8.369 6.661 1.00 0.00 C ATOM 637 O PHE A 374 5.108 -7.577 6.691 1.00 0.00 O ATOM 638 CB PHE A 374 2.807 -8.245 4.600 1.00 0.00 C ATOM 639 CG PHE A 374 2.958 -8.174 3.100 1.00 0.00 C ATOM 640 CD1 PHE A 374 4.175 -7.758 2.522 1.00 0.00 C ATOM 641 CD2 PHE A 374 1.868 -8.471 2.258 1.00 0.00 C ATOM 642 CE1 PHE A 374 4.292 -7.625 1.124 1.00 0.00 C ATOM 643 CE2 PHE A 374 1.989 -8.349 0.861 1.00 0.00 C ATOM 644 CZ PHE A 374 3.196 -7.909 0.287 1.00 0.00 C ATOM 0 H PHE A 374 2.199 -10.369 5.823 1.00 0.00 H new ATOM 0 HA PHE A 374 4.692 -9.299 4.769 1.00 0.00 H new ATOM 0 HB2 PHE A 374 1.804 -8.612 4.819 1.00 0.00 H new ATOM 0 HB3 PHE A 374 2.867 -7.229 4.991 1.00 0.00 H new ATOM 0 HD1 PHE A 374 5.023 -7.540 3.155 1.00 0.00 H new ATOM 0 HD2 PHE A 374 0.932 -8.795 2.688 1.00 0.00 H new ATOM 0 HE1 PHE A 374 5.228 -7.303 0.692 1.00 0.00 H new ATOM 0 HE2 PHE A 374 1.151 -8.595 0.226 1.00 0.00 H new ATOM 0 HZ PHE A 374 3.281 -7.791 -0.783 1.00 0.00 H new ATOM 654 N THR A 375 3.436 -8.614 7.747 1.00 0.00 N ATOM 655 CA THR A 375 3.778 -8.048 9.039 1.00 0.00 C ATOM 656 C THR A 375 4.932 -8.841 9.689 1.00 0.00 C ATOM 657 O THR A 375 5.288 -8.536 10.828 1.00 0.00 O ATOM 658 CB THR A 375 2.518 -7.880 9.904 1.00 0.00 C ATOM 659 OG1 THR A 375 2.806 -7.217 11.115 1.00 0.00 O ATOM 660 CG2 THR A 375 1.770 -9.175 10.197 1.00 0.00 C ATOM 0 H THR A 375 2.602 -9.201 7.751 1.00 0.00 H new ATOM 0 HA THR A 375 4.169 -7.038 8.920 1.00 0.00 H new ATOM 0 HB THR A 375 1.852 -7.269 9.294 1.00 0.00 H new ATOM 0 HG1 THR A 375 3.696 -7.481 11.429 1.00 0.00 H new ATOM 0 HG21 THR A 375 0.897 -8.959 10.812 1.00 0.00 H new ATOM 0 HG22 THR A 375 1.450 -9.630 9.260 1.00 0.00 H new ATOM 0 HG23 THR A 375 2.428 -9.863 10.729 1.00 0.00 H new ATOM 668 N HIS A 376 5.465 -9.868 9.012 1.00 0.00 N ATOM 669 CA HIS A 376 6.640 -10.626 9.414 1.00 0.00 C ATOM 670 C HIS A 376 7.916 -9.844 9.076 1.00 0.00 C ATOM 671 O HIS A 376 8.886 -9.927 9.833 1.00 0.00 O ATOM 672 CB HIS A 376 6.628 -12.009 8.742 1.00 0.00 C ATOM 673 CG HIS A 376 7.181 -13.119 9.602 1.00 0.00 C ATOM 674 ND1 HIS A 376 6.481 -14.241 9.985 1.00 0.00 N ATOM 675 CD2 HIS A 376 8.439 -13.208 10.137 1.00 0.00 C ATOM 676 CE1 HIS A 376 7.302 -14.992 10.738 1.00 0.00 C ATOM 677 NE2 HIS A 376 8.504 -14.406 10.864 1.00 0.00 N ATOM 0 H HIS A 376 5.066 -10.200 8.134 1.00 0.00 H new ATOM 0 HA HIS A 376 6.621 -10.778 10.493 1.00 0.00 H new ATOM 0 HB2 HIS A 376 5.604 -12.256 8.463 1.00 0.00 H new ATOM 0 HB3 HIS A 376 7.206 -11.957 7.819 1.00 0.00 H new ATOM 0 HD2 HIS A 376 9.235 -12.488 10.020 1.00 0.00 H new ATOM 0 HE1 HIS A 376 7.032 -15.939 11.182 1.00 0.00 H new ATOM 0 HE2 HIS A 376 9.305 -14.762 11.385 1.00 0.00 H new ATOM 685 N GLU A 377 7.964 -9.145 7.931 1.00 0.00 N ATOM 686 CA GLU A 377 9.110 -8.305 7.597 1.00 0.00 C ATOM 687 C GLU A 377 9.335 -7.219 8.662 1.00 0.00 C ATOM 688 O GLU A 377 8.452 -6.891 9.454 1.00 0.00 O ATOM 689 CB GLU A 377 8.933 -7.628 6.218 1.00 0.00 C ATOM 690 CG GLU A 377 9.279 -8.520 5.021 1.00 0.00 C ATOM 691 CD GLU A 377 8.165 -9.496 4.654 1.00 0.00 C ATOM 692 OE1 GLU A 377 7.150 -9.016 4.101 1.00 0.00 O ATOM 693 OE2 GLU A 377 8.378 -10.701 4.901 1.00 0.00 O ATOM 0 H GLU A 377 7.224 -9.149 7.229 1.00 0.00 H new ATOM 0 HA GLU A 377 9.980 -8.961 7.563 1.00 0.00 H new ATOM 0 HB2 GLU A 377 7.899 -7.296 6.121 1.00 0.00 H new ATOM 0 HB3 GLU A 377 9.559 -6.736 6.183 1.00 0.00 H new ATOM 0 HG2 GLU A 377 9.499 -7.890 4.159 1.00 0.00 H new ATOM 0 HG3 GLU A 377 10.186 -9.082 5.245 1.00 0.00 H new ATOM 700 N ALA A 378 10.499 -6.559 8.568 1.00 0.00 N ATOM 701 CA ALA A 378 10.918 -5.424 9.387 1.00 0.00 C ATOM 702 C ALA A 378 9.783 -4.413 9.565 1.00 0.00 C ATOM 703 O ALA A 378 9.556 -3.928 10.671 1.00 0.00 O ATOM 704 CB ALA A 378 12.172 -4.777 8.786 1.00 0.00 C ATOM 0 H ALA A 378 11.206 -6.820 7.881 1.00 0.00 H new ATOM 0 HA ALA A 378 11.169 -5.788 10.383 1.00 0.00 H new ATOM 0 HB1 ALA A 378 12.477 -3.932 9.403 1.00 0.00 H new ATOM 0 HB2 ALA A 378 12.978 -5.510 8.750 1.00 0.00 H new ATOM 0 HB3 ALA A 378 11.954 -4.429 7.776 1.00 0.00 H new ATOM 710 N CYS A 379 9.133 -4.044 8.461 1.00 0.00 N ATOM 711 CA CYS A 379 7.798 -3.473 8.455 1.00 0.00 C ATOM 712 C CYS A 379 7.086 -4.020 7.208 1.00 0.00 C ATOM 713 O CYS A 379 7.750 -4.103 6.171 1.00 0.00 O ATOM 714 CB CYS A 379 7.861 -1.939 8.373 1.00 0.00 C ATOM 715 SG CYS A 379 8.219 -1.203 9.992 1.00 0.00 S ATOM 0 H CYS A 379 9.534 -4.138 7.528 1.00 0.00 H new ATOM 0 HA CYS A 379 7.269 -3.737 9.371 1.00 0.00 H new ATOM 0 HB2 CYS A 379 8.630 -1.643 7.659 1.00 0.00 H new ATOM 0 HB3 CYS A 379 6.913 -1.554 7.998 1.00 0.00 H new ATOM 0 HG CYS A 379 8.868 -2.059 10.724 1.00 0.00 H new ATOM 721 N PRO A 380 5.756 -4.249 7.260 1.00 0.00 N ATOM 722 CA PRO A 380 4.915 -4.491 6.086 1.00 0.00 C ATOM 723 C PRO A 380 5.142 -3.380 5.087 1.00 0.00 C ATOM 724 O PRO A 380 5.735 -3.609 4.045 1.00 0.00 O ATOM 725 CB PRO A 380 3.472 -4.610 6.598 1.00 0.00 C ATOM 726 CG PRO A 380 3.491 -4.027 8.008 1.00 0.00 C ATOM 727 CD PRO A 380 4.939 -4.172 8.465 1.00 0.00 C ATOM 0 HA PRO A 380 5.156 -5.412 5.555 1.00 0.00 H new ATOM 0 HB2 PRO A 380 2.781 -4.063 5.956 1.00 0.00 H new ATOM 0 HB3 PRO A 380 3.143 -5.649 6.607 1.00 0.00 H new ATOM 0 HG2 PRO A 380 3.178 -2.983 8.010 1.00 0.00 H new ATOM 0 HG3 PRO A 380 2.811 -4.565 8.669 1.00 0.00 H new ATOM 0 HD2 PRO A 380 5.237 -3.323 9.080 1.00 0.00 H new ATOM 0 HD3 PRO A 380 5.064 -5.067 9.075 1.00 0.00 H new ATOM 735 N VAL A 381 4.653 -2.187 5.401 1.00 0.00 N ATOM 736 CA VAL A 381 4.527 -1.047 4.512 1.00 0.00 C ATOM 737 C VAL A 381 5.762 -0.845 3.592 1.00 0.00 C ATOM 738 O VAL A 381 5.590 -0.657 2.390 1.00 0.00 O ATOM 739 CB VAL A 381 4.103 0.170 5.357 1.00 0.00 C ATOM 740 CG1 VAL A 381 3.674 1.315 4.451 1.00 0.00 C ATOM 741 CG2 VAL A 381 2.976 -0.137 6.363 1.00 0.00 C ATOM 0 H VAL A 381 4.314 -1.981 6.341 1.00 0.00 H new ATOM 0 HA VAL A 381 3.742 -1.221 3.776 1.00 0.00 H new ATOM 0 HB VAL A 381 4.980 0.451 5.941 1.00 0.00 H new ATOM 0 HG11 VAL A 381 3.377 2.169 5.060 1.00 0.00 H new ATOM 0 HG12 VAL A 381 4.506 1.601 3.807 1.00 0.00 H new ATOM 0 HG13 VAL A 381 2.832 0.997 3.837 1.00 0.00 H new ATOM 0 HG21 VAL A 381 2.731 0.766 6.922 1.00 0.00 H new ATOM 0 HG22 VAL A 381 2.093 -0.482 5.826 1.00 0.00 H new ATOM 0 HG23 VAL A 381 3.306 -0.912 7.054 1.00 0.00 H new ATOM 751 N ARG A 382 6.996 -1.008 4.095 1.00 0.00 N ATOM 752 CA ARG A 382 8.212 -1.009 3.269 1.00 0.00 C ATOM 753 C ARG A 382 8.236 -2.113 2.216 1.00 0.00 C ATOM 754 O ARG A 382 8.302 -1.822 1.019 1.00 0.00 O ATOM 755 CB ARG A 382 9.483 -1.042 4.152 1.00 0.00 C ATOM 756 CG ARG A 382 10.433 0.145 3.916 1.00 0.00 C ATOM 757 CD ARG A 382 10.979 0.742 5.216 1.00 0.00 C ATOM 758 NE ARG A 382 11.982 1.787 4.940 1.00 0.00 N ATOM 759 CZ ARG A 382 11.716 3.080 4.696 1.00 0.00 C ATOM 760 NH1 ARG A 382 10.482 3.550 4.724 1.00 0.00 N ATOM 761 NH2 ARG A 382 12.713 3.916 4.425 1.00 0.00 N ATOM 0 H ARG A 382 7.178 -1.143 5.089 1.00 0.00 H new ATOM 0 HA ARG A 382 8.200 -0.072 2.712 1.00 0.00 H new ATOM 0 HB2 ARG A 382 9.186 -1.055 5.201 1.00 0.00 H new ATOM 0 HB3 ARG A 382 10.022 -1.970 3.962 1.00 0.00 H new ATOM 0 HG2 ARG A 382 11.267 -0.182 3.295 1.00 0.00 H new ATOM 0 HG3 ARG A 382 9.906 0.920 3.360 1.00 0.00 H new ATOM 0 HD2 ARG A 382 10.160 1.164 5.798 1.00 0.00 H new ATOM 0 HD3 ARG A 382 11.427 -0.046 5.822 1.00 0.00 H new ATOM 0 HE ARG A 382 12.962 1.503 4.934 1.00 0.00 H new ATOM 0 HH11 ARG A 382 9.703 2.926 4.935 1.00 0.00 H new ATOM 0 HH12 ARG A 382 10.308 4.537 4.535 1.00 0.00 H new ATOM 0 HH21 ARG A 382 13.674 3.574 4.403 1.00 0.00 H new ATOM 0 HH22 ARG A 382 12.517 4.900 4.239 1.00 0.00 H new ATOM 775 N ALA A 383 8.196 -3.384 2.631 1.00 0.00 N ATOM 776 CA ALA A 383 8.248 -4.479 1.667 1.00 0.00 C ATOM 777 C ALA A 383 6.943 -4.575 0.871 1.00 0.00 C ATOM 778 O ALA A 383 6.915 -5.173 -0.201 1.00 0.00 O ATOM 779 CB ALA A 383 8.492 -5.792 2.418 1.00 0.00 C ATOM 0 H ALA A 383 8.129 -3.672 3.607 1.00 0.00 H new ATOM 0 HA ALA A 383 9.060 -4.290 0.964 1.00 0.00 H new ATOM 0 HB1 ALA A 383 8.532 -6.616 1.706 1.00 0.00 H new ATOM 0 HB2 ALA A 383 9.437 -5.732 2.958 1.00 0.00 H new ATOM 0 HB3 ALA A 383 7.680 -5.963 3.125 1.00 0.00 H new ATOM 785 N LEU A 384 5.901 -3.869 1.297 1.00 0.00 N ATOM 786 CA LEU A 384 4.588 -3.855 0.697 1.00 0.00 C ATOM 787 C LEU A 384 4.574 -2.932 -0.509 1.00 0.00 C ATOM 788 O LEU A 384 4.001 -3.310 -1.522 1.00 0.00 O ATOM 789 CB LEU A 384 3.608 -3.378 1.761 1.00 0.00 C ATOM 790 CG LEU A 384 2.129 -3.412 1.388 1.00 0.00 C ATOM 791 CD1 LEU A 384 1.626 -4.856 1.322 1.00 0.00 C ATOM 792 CD2 LEU A 384 1.411 -2.673 2.512 1.00 0.00 C ATOM 0 H LEU A 384 5.962 -3.262 2.114 1.00 0.00 H new ATOM 0 HA LEU A 384 4.308 -4.849 0.348 1.00 0.00 H new ATOM 0 HB2 LEU A 384 3.749 -3.988 2.653 1.00 0.00 H new ATOM 0 HB3 LEU A 384 3.868 -2.354 2.031 1.00 0.00 H new ATOM 0 HG LEU A 384 1.952 -2.958 0.413 1.00 0.00 H new ATOM 0 HD11 LEU A 384 0.569 -4.861 1.055 1.00 0.00 H new ATOM 0 HD12 LEU A 384 2.193 -5.405 0.570 1.00 0.00 H new ATOM 0 HD13 LEU A 384 1.757 -5.332 2.294 1.00 0.00 H new ATOM 0 HD21 LEU A 384 0.340 -2.657 2.311 1.00 0.00 H new ATOM 0 HD22 LEU A 384 1.595 -3.182 3.458 1.00 0.00 H new ATOM 0 HD23 LEU A 384 1.784 -1.650 2.571 1.00 0.00 H new ATOM 804 N LEU A 385 5.231 -1.764 -0.464 1.00 0.00 N ATOM 805 CA LEU A 385 5.260 -0.894 -1.645 1.00 0.00 C ATOM 806 C LEU A 385 6.288 -1.432 -2.639 1.00 0.00 C ATOM 807 O LEU A 385 6.110 -1.231 -3.842 1.00 0.00 O ATOM 808 CB LEU A 385 5.579 0.584 -1.288 1.00 0.00 C ATOM 809 CG LEU A 385 4.566 1.199 -0.300 1.00 0.00 C ATOM 810 CD1 LEU A 385 4.981 2.637 0.023 1.00 0.00 C ATOM 811 CD2 LEU A 385 3.125 1.129 -0.823 1.00 0.00 C ATOM 0 H LEU A 385 5.734 -1.409 0.350 1.00 0.00 H new ATOM 0 HA LEU A 385 4.265 -0.901 -2.090 1.00 0.00 H new ATOM 0 HB2 LEU A 385 6.578 0.640 -0.857 1.00 0.00 H new ATOM 0 HB3 LEU A 385 5.593 1.178 -2.202 1.00 0.00 H new ATOM 0 HG LEU A 385 4.580 0.610 0.617 1.00 0.00 H new ATOM 0 HD11 LEU A 385 4.267 3.074 0.721 1.00 0.00 H new ATOM 0 HD12 LEU A 385 5.974 2.637 0.473 1.00 0.00 H new ATOM 0 HD13 LEU A 385 4.998 3.226 -0.894 1.00 0.00 H new ATOM 0 HD21 LEU A 385 2.450 1.574 -0.092 1.00 0.00 H new ATOM 0 HD22 LEU A 385 3.052 1.675 -1.764 1.00 0.00 H new ATOM 0 HD23 LEU A 385 2.847 0.088 -0.986 1.00 0.00 H new ATOM 823 N ALA A 386 7.312 -2.154 -2.166 1.00 0.00 N ATOM 824 CA ALA A 386 8.253 -2.853 -3.030 1.00 0.00 C ATOM 825 C ALA A 386 7.603 -4.061 -3.717 1.00 0.00 C ATOM 826 O ALA A 386 7.815 -4.255 -4.910 1.00 0.00 O ATOM 827 CB ALA A 386 9.463 -3.300 -2.201 1.00 0.00 C ATOM 0 H ALA A 386 7.506 -2.266 -1.171 1.00 0.00 H new ATOM 0 HA ALA A 386 8.574 -2.168 -3.815 1.00 0.00 H new ATOM 0 HB1 ALA A 386 10.171 -3.824 -2.843 1.00 0.00 H new ATOM 0 HB2 ALA A 386 9.947 -2.427 -1.764 1.00 0.00 H new ATOM 0 HB3 ALA A 386 9.132 -3.968 -1.405 1.00 0.00 H new ATOM 833 N SER A 387 6.779 -4.839 -3.006 1.00 0.00 N ATOM 834 CA SER A 387 6.241 -6.098 -3.511 1.00 0.00 C ATOM 835 C SER A 387 4.948 -5.819 -4.258 1.00 0.00 C ATOM 836 O SER A 387 4.779 -6.304 -5.379 1.00 0.00 O ATOM 837 CB SER A 387 5.998 -7.082 -2.355 1.00 0.00 C ATOM 838 OG SER A 387 5.482 -8.316 -2.820 1.00 0.00 O ATOM 0 H SER A 387 6.468 -4.609 -2.062 1.00 0.00 H new ATOM 0 HA SER A 387 6.960 -6.554 -4.191 1.00 0.00 H new ATOM 0 HB2 SER A 387 6.933 -7.256 -1.822 1.00 0.00 H new ATOM 0 HB3 SER A 387 5.301 -6.641 -1.642 1.00 0.00 H new ATOM 0 HG SER A 387 4.553 -8.195 -3.107 1.00 0.00 H new ATOM 844 N TRP A 388 4.020 -5.053 -3.672 1.00 0.00 N ATOM 845 CA TRP A 388 2.799 -4.739 -4.387 1.00 0.00 C ATOM 846 C TRP A 388 3.148 -3.976 -5.664 1.00 0.00 C ATOM 847 O TRP A 388 2.647 -4.293 -6.736 1.00 0.00 O ATOM 848 CB TRP A 388 1.804 -3.906 -3.571 1.00 0.00 C ATOM 849 CG TRP A 388 0.523 -3.784 -4.338 1.00 0.00 C ATOM 850 CD1 TRP A 388 -0.283 -4.819 -4.683 1.00 0.00 C ATOM 851 CD2 TRP A 388 0.048 -2.642 -5.109 1.00 0.00 C ATOM 852 NE1 TRP A 388 -1.224 -4.394 -5.597 1.00 0.00 N ATOM 853 CE2 TRP A 388 -1.016 -3.089 -5.945 1.00 0.00 C ATOM 854 CE3 TRP A 388 0.465 -1.301 -5.261 1.00 0.00 C ATOM 855 CZ2 TRP A 388 -1.619 -2.281 -6.905 1.00 0.00 C ATOM 856 CZ3 TRP A 388 -0.129 -0.483 -6.238 1.00 0.00 C ATOM 857 CH2 TRP A 388 -1.141 -0.979 -7.058 1.00 0.00 C ATOM 0 H TRP A 388 4.094 -4.655 -2.736 1.00 0.00 H new ATOM 0 HA TRP A 388 2.313 -5.690 -4.606 1.00 0.00 H new ATOM 0 HB2 TRP A 388 1.621 -4.378 -2.606 1.00 0.00 H new ATOM 0 HB3 TRP A 388 2.217 -2.918 -3.369 1.00 0.00 H new ATOM 0 HD1 TRP A 388 -0.200 -5.825 -4.299 1.00 0.00 H new ATOM 0 HE1 TRP A 388 -1.976 -4.977 -5.965 1.00 0.00 H new ATOM 0 HE3 TRP A 388 1.242 -0.903 -4.625 1.00 0.00 H new ATOM 0 HZ2 TRP A 388 -2.432 -2.651 -7.513 1.00 0.00 H new ATOM 0 HZ3 TRP A 388 0.202 0.539 -6.354 1.00 0.00 H new ATOM 0 HH2 TRP A 388 -1.562 -0.345 -7.824 1.00 0.00 H new ATOM 868 N GLY A 389 4.100 -3.045 -5.581 1.00 0.00 N ATOM 869 CA GLY A 389 4.571 -2.280 -6.720 1.00 0.00 C ATOM 870 C GLY A 389 5.435 -3.086 -7.694 1.00 0.00 C ATOM 871 O GLY A 389 6.062 -2.471 -8.558 1.00 0.00 O ATOM 0 H GLY A 389 4.567 -2.804 -4.707 1.00 0.00 H new ATOM 0 HA2 GLY A 389 3.711 -1.880 -7.258 1.00 0.00 H new ATOM 0 HA3 GLY A 389 5.146 -1.427 -6.360 1.00 0.00 H new ATOM 875 N ALA A 390 5.489 -4.415 -7.560 1.00 0.00 N ATOM 876 CA ALA A 390 6.065 -5.344 -8.520 1.00 0.00 C ATOM 877 C ALA A 390 4.987 -6.192 -9.214 1.00 0.00 C ATOM 878 O ALA A 390 5.324 -6.945 -10.125 1.00 0.00 O ATOM 879 CB ALA A 390 7.075 -6.250 -7.803 1.00 0.00 C ATOM 0 H ALA A 390 5.113 -4.888 -6.738 1.00 0.00 H new ATOM 0 HA ALA A 390 6.569 -4.766 -9.295 1.00 0.00 H new ATOM 0 HB1 ALA A 390 7.509 -6.948 -8.518 1.00 0.00 H new ATOM 0 HB2 ALA A 390 7.865 -5.640 -7.366 1.00 0.00 H new ATOM 0 HB3 ALA A 390 6.569 -6.807 -7.014 1.00 0.00 H new ATOM 885 N GLN A 391 3.714 -6.111 -8.803 1.00 0.00 N ATOM 886 CA GLN A 391 2.629 -6.775 -9.516 1.00 0.00 C ATOM 887 C GLN A 391 2.397 -5.973 -10.804 1.00 0.00 C ATOM 888 O GLN A 391 2.157 -4.765 -10.740 1.00 0.00 O ATOM 889 CB GLN A 391 1.355 -6.884 -8.643 1.00 0.00 C ATOM 890 CG GLN A 391 1.564 -7.432 -7.223 1.00 0.00 C ATOM 891 CD GLN A 391 2.423 -8.688 -7.155 1.00 0.00 C ATOM 892 OE1 GLN A 391 2.035 -9.759 -7.595 1.00 0.00 O ATOM 893 NE2 GLN A 391 3.595 -8.604 -6.544 1.00 0.00 N ATOM 0 H GLN A 391 3.416 -5.590 -7.978 1.00 0.00 H new ATOM 0 HA GLN A 391 2.890 -7.805 -9.759 1.00 0.00 H new ATOM 0 HB2 GLN A 391 0.903 -5.895 -8.568 1.00 0.00 H new ATOM 0 HB3 GLN A 391 0.638 -7.524 -9.158 1.00 0.00 H new ATOM 0 HG2 GLN A 391 2.026 -6.657 -6.612 1.00 0.00 H new ATOM 0 HG3 GLN A 391 0.591 -7.648 -6.783 1.00 0.00 H new ATOM 0 HE21 GLN A 391 3.916 -7.708 -6.178 1.00 0.00 H new ATOM 0 HE22 GLN A 391 4.177 -9.435 -6.440 1.00 0.00 H new ATOM 902 N ASP A 392 2.526 -6.600 -11.974 1.00 0.00 N ATOM 903 CA ASP A 392 2.326 -5.931 -13.263 1.00 0.00 C ATOM 904 C ASP A 392 0.877 -5.460 -13.403 1.00 0.00 C ATOM 905 O ASP A 392 -0.021 -6.286 -13.570 1.00 0.00 O ATOM 906 CB ASP A 392 2.749 -6.773 -14.472 1.00 0.00 C ATOM 907 CG ASP A 392 2.598 -5.959 -15.770 1.00 0.00 C ATOM 908 OD1 ASP A 392 2.623 -4.706 -15.689 1.00 0.00 O ATOM 909 OD2 ASP A 392 2.492 -6.596 -16.840 1.00 0.00 O ATOM 0 H ASP A 392 2.772 -7.586 -12.056 1.00 0.00 H new ATOM 0 HA ASP A 392 2.989 -5.066 -13.262 1.00 0.00 H new ATOM 0 HB2 ASP A 392 3.784 -7.095 -14.355 1.00 0.00 H new ATOM 0 HB3 ASP A 392 2.139 -7.675 -14.527 1.00 0.00 H new ATOM 914 N SER A 393 0.668 -4.156 -13.184 1.00 0.00 N ATOM 915 CA SER A 393 -0.543 -3.320 -13.205 1.00 0.00 C ATOM 916 C SER A 393 -0.612 -2.374 -11.994 1.00 0.00 C ATOM 917 O SER A 393 -1.512 -1.528 -11.951 1.00 0.00 O ATOM 918 CB SER A 393 -1.862 -4.098 -13.382 1.00 0.00 C ATOM 919 OG SER A 393 -2.035 -5.088 -12.392 1.00 0.00 O ATOM 0 H SER A 393 1.472 -3.572 -12.952 1.00 0.00 H new ATOM 0 HA SER A 393 -0.441 -2.718 -14.108 1.00 0.00 H new ATOM 0 HB2 SER A 393 -2.700 -3.402 -13.347 1.00 0.00 H new ATOM 0 HB3 SER A 393 -1.877 -4.565 -14.367 1.00 0.00 H new ATOM 0 HG SER A 393 -1.487 -5.870 -12.612 1.00 0.00 H new ATOM 925 N ALA A 394 0.327 -2.482 -11.038 1.00 0.00 N ATOM 926 CA ALA A 394 0.333 -1.836 -9.724 1.00 0.00 C ATOM 927 C ALA A 394 0.525 -0.305 -9.747 1.00 0.00 C ATOM 928 O ALA A 394 1.431 0.267 -9.128 1.00 0.00 O ATOM 929 CB ALA A 394 1.369 -2.525 -8.834 1.00 0.00 C ATOM 0 H ALA A 394 1.154 -3.062 -11.177 1.00 0.00 H new ATOM 0 HA ALA A 394 -0.667 -1.962 -9.310 1.00 0.00 H new ATOM 0 HB1 ALA A 394 1.380 -2.050 -7.853 1.00 0.00 H new ATOM 0 HB2 ALA A 394 1.111 -3.578 -8.724 1.00 0.00 H new ATOM 0 HB3 ALA A 394 2.355 -2.439 -9.290 1.00 0.00 H new ATOM 935 N THR A 395 -0.356 0.387 -10.455 1.00 0.00 N ATOM 936 CA THR A 395 -0.379 1.827 -10.610 1.00 0.00 C ATOM 937 C THR A 395 -0.750 2.493 -9.288 1.00 0.00 C ATOM 938 O THR A 395 -1.381 1.888 -8.419 1.00 0.00 O ATOM 939 CB THR A 395 -1.334 2.189 -11.760 1.00 0.00 C ATOM 940 OG1 THR A 395 -2.582 1.530 -11.636 1.00 0.00 O ATOM 941 CG2 THR A 395 -0.729 1.842 -13.125 1.00 0.00 C ATOM 0 H THR A 395 -1.113 -0.070 -10.963 1.00 0.00 H new ATOM 0 HA THR A 395 0.610 2.203 -10.873 1.00 0.00 H new ATOM 0 HB THR A 395 -1.491 3.266 -11.696 1.00 0.00 H new ATOM 0 HG1 THR A 395 -3.163 1.786 -12.383 1.00 0.00 H new ATOM 0 HG21 THR A 395 -1.432 2.112 -13.914 1.00 0.00 H new ATOM 0 HG22 THR A 395 0.200 2.395 -13.262 1.00 0.00 H new ATOM 0 HG23 THR A 395 -0.525 0.772 -13.171 1.00 0.00 H new ATOM 949 N LEU A 396 -0.412 3.773 -9.122 1.00 0.00 N ATOM 950 CA LEU A 396 -0.893 4.498 -7.960 1.00 0.00 C ATOM 951 C LEU A 396 -2.424 4.534 -7.997 1.00 0.00 C ATOM 952 O LEU A 396 -3.063 4.453 -6.958 1.00 0.00 O ATOM 953 CB LEU A 396 -0.228 5.882 -7.852 1.00 0.00 C ATOM 954 CG LEU A 396 0.285 6.130 -6.419 1.00 0.00 C ATOM 955 CD1 LEU A 396 1.130 7.404 -6.324 1.00 0.00 C ATOM 956 CD2 LEU A 396 -0.832 6.199 -5.374 1.00 0.00 C ATOM 0 H LEU A 396 0.175 4.310 -9.760 1.00 0.00 H new ATOM 0 HA LEU A 396 -0.606 3.984 -7.043 1.00 0.00 H new ATOM 0 HB2 LEU A 396 0.601 5.949 -8.557 1.00 0.00 H new ATOM 0 HB3 LEU A 396 -0.943 6.657 -8.127 1.00 0.00 H new ATOM 0 HG LEU A 396 0.904 5.261 -6.195 1.00 0.00 H new ATOM 0 HD11 LEU A 396 1.470 7.539 -5.297 1.00 0.00 H new ATOM 0 HD12 LEU A 396 1.993 7.318 -6.984 1.00 0.00 H new ATOM 0 HD13 LEU A 396 0.529 8.263 -6.623 1.00 0.00 H new ATOM 0 HD21 LEU A 396 -0.399 6.375 -4.389 1.00 0.00 H new ATOM 0 HD22 LEU A 396 -1.513 7.013 -5.622 1.00 0.00 H new ATOM 0 HD23 LEU A 396 -1.381 5.257 -5.365 1.00 0.00 H new ATOM 968 N ASP A 397 -3.013 4.526 -9.193 1.00 0.00 N ATOM 969 CA ASP A 397 -4.450 4.559 -9.427 1.00 0.00 C ATOM 970 C ASP A 397 -5.128 3.256 -8.989 1.00 0.00 C ATOM 971 O ASP A 397 -6.306 3.272 -8.634 1.00 0.00 O ATOM 972 CB ASP A 397 -4.739 4.755 -10.935 1.00 0.00 C ATOM 973 CG ASP A 397 -3.823 5.734 -11.680 1.00 0.00 C ATOM 974 OD1 ASP A 397 -2.585 5.524 -11.697 1.00 0.00 O ATOM 975 OD2 ASP A 397 -4.306 6.666 -12.360 1.00 0.00 O ATOM 0 H ASP A 397 -2.476 4.495 -10.059 1.00 0.00 H new ATOM 0 HA ASP A 397 -4.847 5.388 -8.841 1.00 0.00 H new ATOM 0 HB2 ASP A 397 -4.673 3.784 -11.425 1.00 0.00 H new ATOM 0 HB3 ASP A 397 -5.768 5.098 -11.045 1.00 0.00 H new ATOM 980 N ALA A 398 -4.375 2.155 -8.892 1.00 0.00 N ATOM 981 CA ALA A 398 -4.870 0.865 -8.424 1.00 0.00 C ATOM 982 C ALA A 398 -4.944 0.907 -6.905 1.00 0.00 C ATOM 983 O ALA A 398 -5.997 0.627 -6.333 1.00 0.00 O ATOM 984 CB ALA A 398 -3.957 -0.292 -8.872 1.00 0.00 C ATOM 0 H ALA A 398 -3.386 2.140 -9.142 1.00 0.00 H new ATOM 0 HA ALA A 398 -5.855 0.686 -8.855 1.00 0.00 H new ATOM 0 HB1 ALA A 398 -4.359 -1.236 -8.504 1.00 0.00 H new ATOM 0 HB2 ALA A 398 -3.910 -0.317 -9.961 1.00 0.00 H new ATOM 0 HB3 ALA A 398 -2.956 -0.142 -8.469 1.00 0.00 H new ATOM 990 N LEU A 399 -3.839 1.266 -6.245 1.00 0.00 N ATOM 991 CA LEU A 399 -3.820 1.324 -4.789 1.00 0.00 C ATOM 992 C LEU A 399 -4.782 2.387 -4.278 1.00 0.00 C ATOM 993 O LEU A 399 -5.447 2.182 -3.268 1.00 0.00 O ATOM 994 CB LEU A 399 -2.391 1.530 -4.273 1.00 0.00 C ATOM 995 CG LEU A 399 -2.278 1.363 -2.743 1.00 0.00 C ATOM 996 CD1 LEU A 399 -0.924 0.744 -2.360 1.00 0.00 C ATOM 997 CD2 LEU A 399 -2.489 2.671 -1.972 1.00 0.00 C ATOM 0 H LEU A 399 -2.958 1.517 -6.693 1.00 0.00 H new ATOM 0 HA LEU A 399 -4.166 0.368 -4.395 1.00 0.00 H new ATOM 0 HB2 LEU A 399 -1.727 0.817 -4.762 1.00 0.00 H new ATOM 0 HB3 LEU A 399 -2.049 2.527 -4.551 1.00 0.00 H new ATOM 0 HG LEU A 399 -3.085 0.690 -2.455 1.00 0.00 H new ATOM 0 HD11 LEU A 399 -0.867 0.636 -1.277 1.00 0.00 H new ATOM 0 HD12 LEU A 399 -0.826 -0.235 -2.828 1.00 0.00 H new ATOM 0 HD13 LEU A 399 -0.118 1.392 -2.703 1.00 0.00 H new ATOM 0 HD21 LEU A 399 -2.396 2.482 -0.903 1.00 0.00 H new ATOM 0 HD22 LEU A 399 -1.738 3.399 -2.278 1.00 0.00 H new ATOM 0 HD23 LEU A 399 -3.483 3.063 -2.186 1.00 0.00 H new ATOM 1009 N LEU A 400 -4.897 3.505 -4.992 1.00 0.00 N ATOM 1010 CA LEU A 400 -5.829 4.573 -4.700 1.00 0.00 C ATOM 1011 C LEU A 400 -7.262 4.035 -4.727 1.00 0.00 C ATOM 1012 O LEU A 400 -8.060 4.357 -3.847 1.00 0.00 O ATOM 1013 CB LEU A 400 -5.601 5.651 -5.778 1.00 0.00 C ATOM 1014 CG LEU A 400 -6.668 6.749 -5.900 1.00 0.00 C ATOM 1015 CD1 LEU A 400 -6.009 8.051 -6.379 1.00 0.00 C ATOM 1016 CD2 LEU A 400 -7.805 6.426 -6.884 1.00 0.00 C ATOM 0 H LEU A 400 -4.322 3.691 -5.814 1.00 0.00 H new ATOM 0 HA LEU A 400 -5.673 4.995 -3.707 1.00 0.00 H new ATOM 0 HB2 LEU A 400 -4.642 6.130 -5.581 1.00 0.00 H new ATOM 0 HB3 LEU A 400 -5.516 5.152 -6.743 1.00 0.00 H new ATOM 0 HG LEU A 400 -7.106 6.837 -4.906 1.00 0.00 H new ATOM 0 HD11 LEU A 400 -6.765 8.831 -6.466 1.00 0.00 H new ATOM 0 HD12 LEU A 400 -5.250 8.360 -5.661 1.00 0.00 H new ATOM 0 HD13 LEU A 400 -5.543 7.887 -7.351 1.00 0.00 H new ATOM 0 HD21 LEU A 400 -8.513 7.255 -6.907 1.00 0.00 H new ATOM 0 HD22 LEU A 400 -7.391 6.274 -7.881 1.00 0.00 H new ATOM 0 HD23 LEU A 400 -8.318 5.520 -6.562 1.00 0.00 H new ATOM 1028 N ALA A 401 -7.602 3.225 -5.735 1.00 0.00 N ATOM 1029 CA ALA A 401 -8.923 2.628 -5.854 1.00 0.00 C ATOM 1030 C ALA A 401 -9.168 1.626 -4.730 1.00 0.00 C ATOM 1031 O ALA A 401 -10.253 1.623 -4.149 1.00 0.00 O ATOM 1032 CB ALA A 401 -9.062 1.940 -7.210 1.00 0.00 C ATOM 0 H ALA A 401 -6.964 2.969 -6.488 1.00 0.00 H new ATOM 0 HA ALA A 401 -9.668 3.419 -5.775 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -10.054 1.495 -7.292 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -8.926 2.673 -8.005 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -8.306 1.160 -7.302 1.00 0.00 H new ATOM 1038 N ALA A 402 -8.175 0.781 -4.436 1.00 0.00 N ATOM 1039 CA ALA A 402 -8.226 -0.175 -3.343 1.00 0.00 C ATOM 1040 C ALA A 402 -8.489 0.564 -2.028 1.00 0.00 C ATOM 1041 O ALA A 402 -9.416 0.199 -1.317 1.00 0.00 O ATOM 1042 CB ALA A 402 -6.941 -1.013 -3.322 1.00 0.00 C ATOM 0 H ALA A 402 -7.303 0.747 -4.963 1.00 0.00 H new ATOM 0 HA ALA A 402 -9.050 -0.874 -3.484 1.00 0.00 H new ATOM 0 HB1 ALA A 402 -6.986 -1.728 -2.500 1.00 0.00 H new ATOM 0 HB2 ALA A 402 -6.842 -1.550 -4.265 1.00 0.00 H new ATOM 0 HB3 ALA A 402 -6.081 -0.357 -3.186 1.00 0.00 H new ATOM 1048 N LEU A 403 -7.760 1.647 -1.739 1.00 0.00 N ATOM 1049 CA LEU A 403 -7.977 2.457 -0.539 1.00 0.00 C ATOM 1050 C LEU A 403 -9.381 3.034 -0.492 1.00 0.00 C ATOM 1051 O LEU A 403 -10.081 2.934 0.518 1.00 0.00 O ATOM 1052 CB LEU A 403 -7.014 3.653 -0.516 1.00 0.00 C ATOM 1053 CG LEU A 403 -5.669 3.461 0.175 1.00 0.00 C ATOM 1054 CD1 LEU A 403 -4.829 4.704 -0.157 1.00 0.00 C ATOM 1055 CD2 LEU A 403 -5.885 3.312 1.688 1.00 0.00 C ATOM 0 H LEU A 403 -7.002 1.986 -2.332 1.00 0.00 H new ATOM 0 HA LEU A 403 -7.813 1.793 0.310 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -6.823 3.951 -1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -7.524 4.486 -0.033 1.00 0.00 H new ATOM 0 HG LEU A 403 -5.157 2.561 -0.164 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -3.850 4.619 0.315 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -4.705 4.781 -1.237 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -5.335 5.595 0.215 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.923 3.175 2.181 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -6.367 4.209 2.077 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -6.519 2.446 1.882 1.00 0.00 H new ATOM 1067 N ARG A 404 -9.795 3.682 -1.580 1.00 0.00 N ATOM 1068 CA ARG A 404 -11.063 4.391 -1.602 1.00 0.00 C ATOM 1069 C ARG A 404 -12.202 3.386 -1.422 1.00 0.00 C ATOM 1070 O ARG A 404 -13.241 3.765 -0.886 1.00 0.00 O ATOM 1071 CB ARG A 404 -11.157 5.256 -2.867 1.00 0.00 C ATOM 1072 CG ARG A 404 -12.404 6.152 -2.863 1.00 0.00 C ATOM 1073 CD ARG A 404 -12.289 7.280 -3.905 1.00 0.00 C ATOM 1074 NE ARG A 404 -12.690 8.590 -3.350 1.00 0.00 N ATOM 1075 CZ ARG A 404 -11.877 9.520 -2.816 1.00 0.00 C ATOM 1076 NH1 ARG A 404 -10.566 9.334 -2.755 1.00 0.00 N ATOM 1077 NH2 ARG A 404 -12.389 10.642 -2.332 1.00 0.00 N ATOM 0 H ARG A 404 -9.269 3.728 -2.453 1.00 0.00 H new ATOM 0 HA ARG A 404 -11.143 5.091 -0.770 1.00 0.00 H new ATOM 0 HB2 ARG A 404 -10.265 5.877 -2.948 1.00 0.00 H new ATOM 0 HB3 ARG A 404 -11.177 4.611 -3.746 1.00 0.00 H new ATOM 0 HG2 ARG A 404 -13.288 5.549 -3.073 1.00 0.00 H new ATOM 0 HG3 ARG A 404 -12.541 6.583 -1.871 1.00 0.00 H new ATOM 0 HD2 ARG A 404 -11.262 7.338 -4.265 1.00 0.00 H new ATOM 0 HD3 ARG A 404 -12.915 7.044 -4.765 1.00 0.00 H new ATOM 0 HE ARG A 404 -13.685 8.812 -3.374 1.00 0.00 H new ATOM 0 HH11 ARG A 404 -10.156 8.473 -3.117 1.00 0.00 H new ATOM 0 HH12 ARG A 404 -9.968 10.052 -2.346 1.00 0.00 H new ATOM 0 HH21 ARG A 404 -13.396 10.799 -2.365 1.00 0.00 H new ATOM 0 HH22 ARG A 404 -11.776 11.349 -1.926 1.00 0.00 H new ATOM 1091 N ARG A 405 -12.023 2.128 -1.842 1.00 0.00 N ATOM 1092 CA ARG A 405 -12.988 1.065 -1.614 1.00 0.00 C ATOM 1093 C ARG A 405 -13.292 0.852 -0.130 1.00 0.00 C ATOM 1094 O ARG A 405 -14.476 0.738 0.176 1.00 0.00 O ATOM 1095 CB ARG A 405 -12.539 -0.227 -2.312 1.00 0.00 C ATOM 1096 CG ARG A 405 -13.639 -1.287 -2.229 1.00 0.00 C ATOM 1097 CD ARG A 405 -13.504 -2.359 -3.318 1.00 0.00 C ATOM 1098 NE ARG A 405 -12.320 -3.207 -3.132 1.00 0.00 N ATOM 1099 CZ ARG A 405 -11.207 -3.294 -3.868 1.00 0.00 C ATOM 1100 NH1 ARG A 405 -10.938 -2.405 -4.823 1.00 0.00 N ATOM 1101 NH2 ARG A 405 -10.365 -4.287 -3.639 1.00 0.00 N ATOM 0 H ARG A 405 -11.194 1.825 -2.353 1.00 0.00 H new ATOM 0 HA ARG A 405 -13.932 1.376 -2.061 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -12.302 -0.021 -3.356 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -11.628 -0.602 -1.846 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -13.607 -1.763 -1.249 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -14.612 -0.804 -2.318 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -14.397 -2.984 -3.320 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -13.451 -1.876 -4.294 1.00 0.00 H new ATOM 0 HE ARG A 405 -12.351 -3.822 -2.319 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -11.587 -1.639 -5.004 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -10.083 -2.490 -5.373 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -10.569 -4.971 -2.911 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -9.511 -4.369 -4.191 1.00 0.00 H new ATOM 1115 N ILE A 406 -12.325 0.908 0.799 1.00 0.00 N ATOM 1116 CA ILE A 406 -12.655 0.784 2.224 1.00 0.00 C ATOM 1117 C ILE A 406 -12.975 2.163 2.824 1.00 0.00 C ATOM 1118 O ILE A 406 -12.833 2.374 4.026 1.00 0.00 O ATOM 1119 CB ILE A 406 -11.558 0.017 2.997 1.00 0.00 C ATOM 1120 CG1 ILE A 406 -10.180 0.711 3.008 1.00 0.00 C ATOM 1121 CG2 ILE A 406 -11.475 -1.428 2.501 1.00 0.00 C ATOM 1122 CD1 ILE A 406 -9.082 0.114 2.125 1.00 0.00 C ATOM 0 H ILE A 406 -11.334 1.035 0.596 1.00 0.00 H new ATOM 0 HA ILE A 406 -13.558 0.181 2.324 1.00 0.00 H new ATOM 0 HB ILE A 406 -11.862 0.015 4.044 1.00 0.00 H new ATOM 0 HG12 ILE A 406 -10.324 1.750 2.710 1.00 0.00 H new ATOM 0 HG13 ILE A 406 -9.817 0.722 4.036 1.00 0.00 H new ATOM 0 HG21 ILE A 406 -10.699 -1.958 3.053 1.00 0.00 H new ATOM 0 HG22 ILE A 406 -12.434 -1.922 2.658 1.00 0.00 H new ATOM 0 HG23 ILE A 406 -11.233 -1.435 1.438 1.00 0.00 H new ATOM 0 HD11 ILE A 406 -8.170 0.701 2.231 1.00 0.00 H new ATOM 0 HD12 ILE A 406 -8.889 -0.915 2.430 1.00 0.00 H new ATOM 0 HD13 ILE A 406 -9.404 0.129 1.084 1.00 0.00 H new ATOM 1134 N GLN A 407 -13.375 3.125 1.983 1.00 0.00 N ATOM 1135 CA GLN A 407 -13.608 4.525 2.308 1.00 0.00 C ATOM 1136 C GLN A 407 -12.377 5.191 2.942 1.00 0.00 C ATOM 1137 O GLN A 407 -12.495 6.273 3.522 1.00 0.00 O ATOM 1138 CB GLN A 407 -14.906 4.669 3.132 1.00 0.00 C ATOM 1139 CG GLN A 407 -15.542 6.071 3.031 1.00 0.00 C ATOM 1140 CD GLN A 407 -15.776 6.718 4.396 1.00 0.00 C ATOM 1141 OE1 GLN A 407 -16.907 6.918 4.819 1.00 0.00 O ATOM 1142 NE2 GLN A 407 -14.717 7.078 5.102 1.00 0.00 N ATOM 0 H GLN A 407 -13.554 2.927 0.998 1.00 0.00 H new ATOM 0 HA GLN A 407 -13.762 5.081 1.383 1.00 0.00 H new ATOM 0 HB2 GLN A 407 -15.627 3.925 2.793 1.00 0.00 H new ATOM 0 HB3 GLN A 407 -14.690 4.450 4.178 1.00 0.00 H new ATOM 0 HG2 GLN A 407 -14.896 6.715 2.435 1.00 0.00 H new ATOM 0 HG3 GLN A 407 -16.492 5.996 2.502 1.00 0.00 H new ATOM 0 HE21 GLN A 407 -13.779 6.906 4.739 1.00 0.00 H new ATOM 0 HE22 GLN A 407 -14.838 7.528 6.010 1.00 0.00 H new ATOM 1151 N ARG A 408 -11.177 4.619 2.783 1.00 0.00 N ATOM 1152 CA ARG A 408 -9.927 5.228 3.237 1.00 0.00 C ATOM 1153 C ARG A 408 -9.439 6.220 2.186 1.00 0.00 C ATOM 1154 O ARG A 408 -8.343 6.135 1.637 1.00 0.00 O ATOM 1155 CB ARG A 408 -8.896 4.159 3.626 1.00 0.00 C ATOM 1156 CG ARG A 408 -9.291 3.433 4.924 1.00 0.00 C ATOM 1157 CD ARG A 408 -9.256 4.368 6.143 1.00 0.00 C ATOM 1158 NE ARG A 408 -9.109 3.615 7.401 1.00 0.00 N ATOM 1159 CZ ARG A 408 -8.152 3.832 8.314 1.00 0.00 C ATOM 1160 NH1 ARG A 408 -7.461 4.973 8.318 1.00 0.00 N ATOM 1161 NH2 ARG A 408 -7.893 2.863 9.193 1.00 0.00 N ATOM 0 H ARG A 408 -11.049 3.713 2.332 1.00 0.00 H new ATOM 0 HA ARG A 408 -10.095 5.795 4.152 1.00 0.00 H new ATOM 0 HB2 ARG A 408 -8.801 3.434 2.818 1.00 0.00 H new ATOM 0 HB3 ARG A 408 -7.919 4.625 3.753 1.00 0.00 H new ATOM 0 HG2 ARG A 408 -10.293 3.017 4.816 1.00 0.00 H new ATOM 0 HG3 ARG A 408 -8.614 2.595 5.091 1.00 0.00 H new ATOM 0 HD2 ARG A 408 -8.429 5.070 6.040 1.00 0.00 H new ATOM 0 HD3 ARG A 408 -10.172 4.958 6.176 1.00 0.00 H new ATOM 0 HE ARG A 408 -9.785 2.875 7.591 1.00 0.00 H new ATOM 0 HH11 ARG A 408 -7.659 5.691 7.621 1.00 0.00 H new ATOM 0 HH12 ARG A 408 -6.735 5.127 9.018 1.00 0.00 H new ATOM 0 HH21 ARG A 408 -8.417 1.989 9.157 1.00 0.00 H new ATOM 0 HH22 ARG A 408 -7.171 2.996 9.901 1.00 0.00 H new ATOM 1175 N ALA A 409 -10.324 7.159 1.868 1.00 0.00 N ATOM 1176 CA ALA A 409 -10.055 8.311 1.034 1.00 0.00 C ATOM 1177 C ALA A 409 -9.145 9.316 1.755 1.00 0.00 C ATOM 1178 O ALA A 409 -8.536 10.157 1.101 1.00 0.00 O ATOM 1179 CB ALA A 409 -11.400 8.942 0.681 1.00 0.00 C ATOM 0 H ALA A 409 -11.287 7.131 2.202 1.00 0.00 H new ATOM 0 HA ALA A 409 -9.528 8.009 0.129 1.00 0.00 H new ATOM 0 HB1 ALA A 409 -11.237 9.816 0.051 1.00 0.00 H new ATOM 0 HB2 ALA A 409 -12.012 8.217 0.145 1.00 0.00 H new ATOM 0 HB3 ALA A 409 -11.912 9.244 1.595 1.00 0.00 H new ATOM 1185 N ASP A 410 -9.026 9.197 3.079 1.00 0.00 N ATOM 1186 CA ASP A 410 -8.087 9.908 3.939 1.00 0.00 C ATOM 1187 C ASP A 410 -6.674 9.821 3.374 1.00 0.00 C ATOM 1188 O ASP A 410 -6.061 10.852 3.086 1.00 0.00 O ATOM 1189 CB ASP A 410 -8.179 9.397 5.409 1.00 0.00 C ATOM 1190 CG ASP A 410 -7.971 7.880 5.638 1.00 0.00 C ATOM 1191 OD1 ASP A 410 -8.047 7.123 4.648 1.00 0.00 O ATOM 1192 OD2 ASP A 410 -7.823 7.434 6.800 1.00 0.00 O ATOM 0 H ASP A 410 -9.622 8.561 3.609 1.00 0.00 H new ATOM 0 HA ASP A 410 -8.358 10.964 3.960 1.00 0.00 H new ATOM 0 HB2 ASP A 410 -7.439 9.934 6.002 1.00 0.00 H new ATOM 0 HB3 ASP A 410 -9.159 9.668 5.802 1.00 0.00 H new ATOM 1197 N ILE A 411 -6.164 8.610 3.158 1.00 0.00 N ATOM 1198 CA ILE A 411 -4.821 8.452 2.621 1.00 0.00 C ATOM 1199 C ILE A 411 -4.812 8.834 1.150 1.00 0.00 C ATOM 1200 O ILE A 411 -3.802 9.353 0.695 1.00 0.00 O ATOM 1201 CB ILE A 411 -4.258 7.033 2.841 1.00 0.00 C ATOM 1202 CG1 ILE A 411 -4.324 6.692 4.352 1.00 0.00 C ATOM 1203 CG2 ILE A 411 -2.830 6.945 2.263 1.00 0.00 C ATOM 1204 CD1 ILE A 411 -4.002 5.240 4.678 1.00 0.00 C ATOM 0 H ILE A 411 -6.656 7.736 3.345 1.00 0.00 H new ATOM 0 HA ILE A 411 -4.159 9.123 3.168 1.00 0.00 H new ATOM 0 HB ILE A 411 -4.856 6.290 2.313 1.00 0.00 H new ATOM 0 HG12 ILE A 411 -3.628 7.336 4.889 1.00 0.00 H new ATOM 0 HG13 ILE A 411 -5.323 6.923 4.722 1.00 0.00 H new ATOM 0 HG21 ILE A 411 -2.435 5.941 2.420 1.00 0.00 H new ATOM 0 HG22 ILE A 411 -2.856 7.162 1.195 1.00 0.00 H new ATOM 0 HG23 ILE A 411 -2.189 7.670 2.765 1.00 0.00 H new ATOM 0 HD11 ILE A 411 -4.070 5.085 5.755 1.00 0.00 H new ATOM 0 HD12 ILE A 411 -4.713 4.587 4.171 1.00 0.00 H new ATOM 0 HD13 ILE A 411 -2.992 5.007 4.341 1.00 0.00 H new ATOM 1216 N VAL A 412 -5.881 8.582 0.390 1.00 0.00 N ATOM 1217 CA VAL A 412 -5.864 8.857 -1.041 1.00 0.00 C ATOM 1218 C VAL A 412 -5.634 10.351 -1.296 1.00 0.00 C ATOM 1219 O VAL A 412 -4.801 10.710 -2.131 1.00 0.00 O ATOM 1220 CB VAL A 412 -7.179 8.411 -1.710 1.00 0.00 C ATOM 1221 CG1 VAL A 412 -7.251 8.854 -3.175 1.00 0.00 C ATOM 1222 CG2 VAL A 412 -7.325 6.891 -1.655 1.00 0.00 C ATOM 0 H VAL A 412 -6.757 8.193 0.740 1.00 0.00 H new ATOM 0 HA VAL A 412 -5.044 8.287 -1.479 1.00 0.00 H new ATOM 0 HB VAL A 412 -7.989 8.885 -1.156 1.00 0.00 H new ATOM 0 HG11 VAL A 412 -8.193 8.520 -3.610 1.00 0.00 H new ATOM 0 HG12 VAL A 412 -7.191 9.941 -3.230 1.00 0.00 H new ATOM 0 HG13 VAL A 412 -6.420 8.416 -3.729 1.00 0.00 H new ATOM 0 HG21 VAL A 412 -8.260 6.598 -2.133 1.00 0.00 H new ATOM 0 HG22 VAL A 412 -6.489 6.426 -2.178 1.00 0.00 H new ATOM 0 HG23 VAL A 412 -7.330 6.563 -0.615 1.00 0.00 H new ATOM 1232 N GLU A 413 -6.405 11.222 -0.641 1.00 0.00 N ATOM 1233 CA GLU A 413 -6.300 12.653 -0.885 1.00 0.00 C ATOM 1234 C GLU A 413 -4.887 13.132 -0.524 1.00 0.00 C ATOM 1235 O GLU A 413 -4.267 13.888 -1.276 1.00 0.00 O ATOM 1236 CB GLU A 413 -7.421 13.395 -0.132 1.00 0.00 C ATOM 1237 CG GLU A 413 -8.697 13.617 -0.973 1.00 0.00 C ATOM 1238 CD GLU A 413 -9.521 12.364 -1.326 1.00 0.00 C ATOM 1239 OE1 GLU A 413 -9.050 11.491 -2.087 1.00 0.00 O ATOM 1240 OE2 GLU A 413 -10.719 12.298 -0.965 1.00 0.00 O ATOM 0 H GLU A 413 -7.102 10.960 0.056 1.00 0.00 H new ATOM 0 HA GLU A 413 -6.443 12.878 -1.942 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -7.681 12.829 0.763 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -7.044 14.362 0.201 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -9.344 14.308 -0.433 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -8.410 14.108 -1.903 1.00 0.00 H new ATOM 1247 N SER A 414 -4.342 12.624 0.586 1.00 0.00 N ATOM 1248 CA SER A 414 -3.005 12.954 1.059 1.00 0.00 C ATOM 1249 C SER A 414 -1.924 12.370 0.136 1.00 0.00 C ATOM 1250 O SER A 414 -0.895 13.004 -0.092 1.00 0.00 O ATOM 1251 CB SER A 414 -2.881 12.421 2.487 1.00 0.00 C ATOM 1252 OG SER A 414 -1.930 13.149 3.237 1.00 0.00 O ATOM 0 H SER A 414 -4.831 11.961 1.187 1.00 0.00 H new ATOM 0 HA SER A 414 -2.854 14.033 1.050 1.00 0.00 H new ATOM 0 HB2 SER A 414 -3.851 12.474 2.981 1.00 0.00 H new ATOM 0 HB3 SER A 414 -2.595 11.370 2.459 1.00 0.00 H new ATOM 0 HG SER A 414 -2.095 13.014 4.194 1.00 0.00 H new ATOM 1258 N LEU A 415 -2.177 11.200 -0.451 1.00 0.00 N ATOM 1259 CA LEU A 415 -1.360 10.599 -1.500 1.00 0.00 C ATOM 1260 C LEU A 415 -1.130 11.514 -2.679 1.00 0.00 C ATOM 1261 O LEU A 415 -0.036 11.455 -3.255 1.00 0.00 O ATOM 1262 CB LEU A 415 -1.939 9.267 -2.029 1.00 0.00 C ATOM 1263 CG LEU A 415 -1.254 8.009 -1.497 1.00 0.00 C ATOM 1264 CD1 LEU A 415 -2.096 6.765 -1.826 1.00 0.00 C ATOM 1265 CD2 LEU A 415 0.103 7.944 -2.218 1.00 0.00 C ATOM 0 H LEU A 415 -2.983 10.628 -0.200 1.00 0.00 H new ATOM 0 HA LEU A 415 -0.406 10.409 -1.007 1.00 0.00 H new ATOM 0 HB2 LEU A 415 -2.998 9.222 -1.774 1.00 0.00 H new ATOM 0 HB3 LEU A 415 -1.873 9.266 -3.117 1.00 0.00 H new ATOM 0 HG LEU A 415 -1.135 8.038 -0.414 1.00 0.00 H new ATOM 0 HD11 LEU A 415 -1.597 5.876 -1.441 1.00 0.00 H new ATOM 0 HD12 LEU A 415 -3.079 6.858 -1.364 1.00 0.00 H new ATOM 0 HD13 LEU A 415 -2.210 6.678 -2.907 1.00 0.00 H new ATOM 0 HD21 LEU A 415 0.651 7.063 -1.884 1.00 0.00 H new ATOM 0 HD22 LEU A 415 -0.059 7.884 -3.294 1.00 0.00 H new ATOM 0 HD23 LEU A 415 0.681 8.839 -1.988 1.00 0.00 H new