USER MOD reduce.3.24.130724 H: found=0, std=0, add=600, rem=0, adj=16 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 180:sc= 0.18 USER MOD Set 1.2: A 391 GLN : amide:sc= 0.611 K(o=1.8,f=-0.042) USER MOD Set 1.3: A 393 SER OG : rot 94:sc= 1.05 USER MOD Single : A 337 TYR OH : rot 8:sc= -0.422 USER MOD Single : A 338 SER OG : rot -147:sc= 0.98 USER MOD Single : A 339 SER OG : rot 180:sc= 0 USER MOD Single : A 344 LYS NZ :NH3+ 170:sc= 1.85 (180deg=1.55) USER MOD Single : A 350 LYS NZ :NH3+ -174:sc= -0.0164 (180deg=-0.135) USER MOD Single : A 353 ASN : amide:sc= 0.259 K(o=0.26,f=-0.79) USER MOD Single : A 356 THR OG1 : rot 180:sc= 0 USER MOD Single : A 359 HIS : no HE2:sc= 0.132 K(o=0.13,f=-1.2) USER MOD Single : A 367 GLN : amide:sc= 1.12 K(o=1.1,f=-0.0027) USER MOD Single : A 370 HIS : no HD1:sc= -0.313 K(o=-0.31,f=-1.1) USER MOD Single : A 373 SER OG : rot -23:sc= 0.174 USER MOD Single : A 375 THR OG1 : rot -27:sc= 0.546 USER MOD Single : A 376 HIS : no HE2:sc= 1.01 K(o=1,f=-3.3!) USER MOD Single : A 379 CYS SG : rot 29:sc= 0.544 USER MOD Single : A 387 SER OG : rot 85:sc= 1.24 USER MOD Single : A 395 THR OG1 : rot 164:sc= 1.19 USER MOD Single : A 407 GLN : amide:sc= 0.763 K(o=0.76,f=0) USER MOD Single : A 414 SER OG : rot 140:sc= -0.156 USER MOD ----------------------------------------------------------------- ATOM 24 N LEU A 336 3.096 3.153 -12.085 1.00 0.00 N ATOM 25 CA LEU A 336 3.197 2.388 -10.856 1.00 0.00 C ATOM 26 C LEU A 336 3.402 3.306 -9.657 1.00 0.00 C ATOM 27 O LEU A 336 3.699 4.493 -9.803 1.00 0.00 O ATOM 28 CB LEU A 336 4.407 1.437 -11.016 1.00 0.00 C ATOM 29 CG LEU A 336 3.931 -0.015 -11.011 1.00 0.00 C ATOM 30 CD1 LEU A 336 4.886 -0.899 -11.799 1.00 0.00 C ATOM 31 CD2 LEU A 336 3.853 -0.552 -9.579 1.00 0.00 C ATOM 0 HA LEU A 336 2.278 1.829 -10.679 1.00 0.00 H new ATOM 0 HB2 LEU A 336 4.931 1.654 -11.947 1.00 0.00 H new ATOM 0 HB3 LEU A 336 5.118 1.599 -10.205 1.00 0.00 H new ATOM 0 HG LEU A 336 2.943 -0.036 -11.471 1.00 0.00 H new ATOM 0 HD11 LEU A 336 4.527 -1.928 -11.782 1.00 0.00 H new ATOM 0 HD12 LEU A 336 4.938 -0.550 -12.830 1.00 0.00 H new ATOM 0 HD13 LEU A 336 5.878 -0.853 -11.350 1.00 0.00 H new ATOM 0 HD21 LEU A 336 3.512 -1.587 -9.597 1.00 0.00 H new ATOM 0 HD22 LEU A 336 4.839 -0.503 -9.118 1.00 0.00 H new ATOM 0 HD23 LEU A 336 3.152 0.051 -9.002 1.00 0.00 H new ATOM 43 N TYR A 337 3.460 2.704 -8.474 1.00 0.00 N ATOM 44 CA TYR A 337 3.778 3.405 -7.246 1.00 0.00 C ATOM 45 C TYR A 337 5.267 3.258 -6.925 1.00 0.00 C ATOM 46 O TYR A 337 5.888 4.226 -6.502 1.00 0.00 O ATOM 47 CB TYR A 337 2.846 2.928 -6.128 1.00 0.00 C ATOM 48 CG TYR A 337 2.841 3.749 -4.850 1.00 0.00 C ATOM 49 CD1 TYR A 337 3.505 4.990 -4.729 1.00 0.00 C ATOM 50 CD2 TYR A 337 2.114 3.251 -3.756 1.00 0.00 C ATOM 51 CE1 TYR A 337 3.552 5.651 -3.494 1.00 0.00 C ATOM 52 CE2 TYR A 337 2.123 3.926 -2.524 1.00 0.00 C ATOM 53 CZ TYR A 337 2.897 5.100 -2.378 1.00 0.00 C ATOM 54 OH TYR A 337 3.136 5.633 -1.164 1.00 0.00 O ATOM 0 H TYR A 337 3.285 1.707 -8.345 1.00 0.00 H new ATOM 0 HA TYR A 337 3.604 4.475 -7.357 1.00 0.00 H new ATOM 0 HB2 TYR A 337 1.829 2.902 -6.520 1.00 0.00 H new ATOM 0 HB3 TYR A 337 3.116 1.903 -5.873 1.00 0.00 H new ATOM 0 HD1 TYR A 337 3.979 5.432 -5.593 1.00 0.00 H new ATOM 0 HD2 TYR A 337 1.543 2.341 -3.863 1.00 0.00 H new ATOM 0 HE1 TYR A 337 4.091 6.582 -3.399 1.00 0.00 H new ATOM 0 HE2 TYR A 337 1.543 3.551 -1.694 1.00 0.00 H new ATOM 0 HH TYR A 337 3.670 6.448 -1.264 1.00 0.00 H new ATOM 64 N SER A 338 5.887 2.115 -7.236 1.00 0.00 N ATOM 65 CA SER A 338 7.341 1.955 -7.201 1.00 0.00 C ATOM 66 C SER A 338 8.071 2.883 -8.189 1.00 0.00 C ATOM 67 O SER A 338 9.288 3.038 -8.103 1.00 0.00 O ATOM 68 CB SER A 338 7.665 0.477 -7.440 1.00 0.00 C ATOM 69 OG SER A 338 7.133 0.075 -8.687 1.00 0.00 O ATOM 0 H SER A 338 5.390 1.271 -7.520 1.00 0.00 H new ATOM 0 HA SER A 338 7.709 2.257 -6.220 1.00 0.00 H new ATOM 0 HB2 SER A 338 8.744 0.323 -7.426 1.00 0.00 H new ATOM 0 HB3 SER A 338 7.246 -0.133 -6.640 1.00 0.00 H new ATOM 0 HG SER A 338 6.855 -0.863 -8.637 1.00 0.00 H new ATOM 75 N SER A 339 7.334 3.543 -9.094 1.00 0.00 N ATOM 76 CA SER A 339 7.838 4.630 -9.916 1.00 0.00 C ATOM 77 C SER A 339 8.400 5.735 -9.009 1.00 0.00 C ATOM 78 O SER A 339 9.437 6.312 -9.329 1.00 0.00 O ATOM 79 CB SER A 339 6.703 5.138 -10.821 1.00 0.00 C ATOM 80 OG SER A 339 7.183 5.896 -11.918 1.00 0.00 O ATOM 0 H SER A 339 6.353 3.325 -9.271 1.00 0.00 H new ATOM 0 HA SER A 339 8.651 4.289 -10.558 1.00 0.00 H new ATOM 0 HB2 SER A 339 6.131 4.288 -11.193 1.00 0.00 H new ATOM 0 HB3 SER A 339 6.019 5.749 -10.232 1.00 0.00 H new ATOM 0 HG SER A 339 6.427 6.195 -12.465 1.00 0.00 H new ATOM 86 N LEU A 340 7.694 6.095 -7.930 1.00 0.00 N ATOM 87 CA LEU A 340 8.259 6.770 -6.770 1.00 0.00 C ATOM 88 C LEU A 340 9.312 5.842 -6.149 1.00 0.00 C ATOM 89 O LEU A 340 8.918 4.831 -5.568 1.00 0.00 O ATOM 90 CB LEU A 340 7.128 7.132 -5.782 1.00 0.00 C ATOM 91 CG LEU A 340 6.933 8.647 -5.667 1.00 0.00 C ATOM 92 CD1 LEU A 340 5.551 8.949 -5.079 1.00 0.00 C ATOM 93 CD2 LEU A 340 8.036 9.272 -4.799 1.00 0.00 C ATOM 0 H LEU A 340 6.693 5.918 -7.844 1.00 0.00 H new ATOM 0 HA LEU A 340 8.746 7.705 -7.048 1.00 0.00 H new ATOM 0 HB2 LEU A 340 6.197 6.670 -6.111 1.00 0.00 H new ATOM 0 HB3 LEU A 340 7.359 6.720 -4.800 1.00 0.00 H new ATOM 0 HG LEU A 340 6.998 9.086 -6.663 1.00 0.00 H new ATOM 0 HD11 LEU A 340 5.417 10.028 -4.999 1.00 0.00 H new ATOM 0 HD12 LEU A 340 4.780 8.535 -5.729 1.00 0.00 H new ATOM 0 HD13 LEU A 340 5.470 8.499 -4.089 1.00 0.00 H new ATOM 0 HD21 LEU A 340 7.879 10.348 -4.730 1.00 0.00 H new ATOM 0 HD22 LEU A 340 8.004 8.836 -3.800 1.00 0.00 H new ATOM 0 HD23 LEU A 340 9.009 9.075 -5.250 1.00 0.00 H new ATOM 152 N LYS A 344 8.501 9.446 -0.558 1.00 0.00 N ATOM 153 CA LYS A 344 7.041 9.628 -0.406 1.00 0.00 C ATOM 154 C LYS A 344 6.397 8.331 0.102 1.00 0.00 C ATOM 155 O LYS A 344 5.505 8.401 0.932 1.00 0.00 O ATOM 156 CB LYS A 344 6.322 10.268 -1.610 1.00 0.00 C ATOM 157 CG LYS A 344 4.902 10.804 -1.273 1.00 0.00 C ATOM 158 CD LYS A 344 4.880 12.095 -0.420 1.00 0.00 C ATOM 159 CE LYS A 344 3.531 12.392 0.267 1.00 0.00 C ATOM 160 NZ LYS A 344 2.442 12.813 -0.646 1.00 0.00 N ATOM 0 HA LYS A 344 6.901 10.393 0.358 1.00 0.00 H new ATOM 0 HB2 LYS A 344 6.930 11.088 -1.992 1.00 0.00 H new ATOM 0 HB3 LYS A 344 6.243 9.531 -2.409 1.00 0.00 H new ATOM 0 HG2 LYS A 344 4.370 10.992 -2.205 1.00 0.00 H new ATOM 0 HG3 LYS A 344 4.352 10.026 -0.743 1.00 0.00 H new ATOM 0 HD2 LYS A 344 5.653 12.022 0.345 1.00 0.00 H new ATOM 0 HD3 LYS A 344 5.141 12.940 -1.057 1.00 0.00 H new ATOM 0 HE2 LYS A 344 3.210 11.500 0.804 1.00 0.00 H new ATOM 0 HE3 LYS A 344 3.684 13.174 1.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 344 1.540 12.826 -0.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 344 2.645 13.765 -1.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 344 2.376 12.144 -1.439 1.00 0.00 H new ATOM 174 N ARG A 345 6.840 7.146 -0.344 1.00 0.00 N ATOM 175 CA ARG A 345 6.409 5.871 0.227 1.00 0.00 C ATOM 176 C ARG A 345 6.609 5.819 1.738 1.00 0.00 C ATOM 177 O ARG A 345 5.778 5.219 2.402 1.00 0.00 O ATOM 178 CB ARG A 345 7.170 4.697 -0.422 1.00 0.00 C ATOM 179 CG ARG A 345 6.608 4.316 -1.799 1.00 0.00 C ATOM 180 CD ARG A 345 7.600 4.182 -2.958 1.00 0.00 C ATOM 181 NE ARG A 345 8.786 3.310 -2.794 1.00 0.00 N ATOM 182 CZ ARG A 345 9.052 2.189 -2.108 1.00 0.00 C ATOM 183 NH1 ARG A 345 8.186 1.624 -1.271 1.00 0.00 N ATOM 184 NH2 ARG A 345 10.249 1.639 -2.280 1.00 0.00 N ATOM 0 H ARG A 345 7.506 7.050 -1.110 1.00 0.00 H new ATOM 0 HA ARG A 345 5.343 5.782 0.019 1.00 0.00 H new ATOM 0 HB2 ARG A 345 8.222 4.964 -0.524 1.00 0.00 H new ATOM 0 HB3 ARG A 345 7.124 3.830 0.237 1.00 0.00 H new ATOM 0 HG2 ARG A 345 6.082 3.367 -1.696 1.00 0.00 H new ATOM 0 HG3 ARG A 345 5.865 5.064 -2.077 1.00 0.00 H new ATOM 0 HD2 ARG A 345 7.046 3.823 -3.825 1.00 0.00 H new ATOM 0 HD3 ARG A 345 7.959 5.182 -3.201 1.00 0.00 H new ATOM 0 HE ARG A 345 9.590 3.640 -3.329 1.00 0.00 H new ATOM 0 HH11 ARG A 345 7.268 2.044 -1.126 1.00 0.00 H new ATOM 0 HH12 ARG A 345 8.440 0.770 -0.774 1.00 0.00 H new ATOM 0 HH21 ARG A 345 10.922 2.070 -2.914 1.00 0.00 H new ATOM 0 HH22 ARG A 345 10.495 0.786 -1.778 1.00 0.00 H new ATOM 198 N GLU A 346 7.688 6.389 2.265 1.00 0.00 N ATOM 199 CA GLU A 346 7.971 6.444 3.699 1.00 0.00 C ATOM 200 C GLU A 346 7.023 7.416 4.392 1.00 0.00 C ATOM 201 O GLU A 346 6.446 7.098 5.429 1.00 0.00 O ATOM 202 CB GLU A 346 9.456 6.772 3.943 1.00 0.00 C ATOM 203 CG GLU A 346 10.390 5.811 3.183 1.00 0.00 C ATOM 204 CD GLU A 346 11.871 6.140 3.386 1.00 0.00 C ATOM 205 OE1 GLU A 346 12.317 7.185 2.856 1.00 0.00 O ATOM 206 OE2 GLU A 346 12.568 5.299 4.001 1.00 0.00 O ATOM 0 H GLU A 346 8.407 6.836 1.696 1.00 0.00 H new ATOM 0 HA GLU A 346 7.792 5.464 4.142 1.00 0.00 H new ATOM 0 HB2 GLU A 346 9.657 7.797 3.630 1.00 0.00 H new ATOM 0 HB3 GLU A 346 9.669 6.717 5.011 1.00 0.00 H new ATOM 0 HG2 GLU A 346 10.201 4.790 3.514 1.00 0.00 H new ATOM 0 HG3 GLU A 346 10.156 5.850 2.119 1.00 0.00 H new ATOM 213 N GLU A 347 6.765 8.575 3.786 1.00 0.00 N ATOM 214 CA GLU A 347 5.697 9.436 4.268 1.00 0.00 C ATOM 215 C GLU A 347 4.328 8.731 4.201 1.00 0.00 C ATOM 216 O GLU A 347 3.411 9.062 4.945 1.00 0.00 O ATOM 217 CB GLU A 347 5.707 10.779 3.520 1.00 0.00 C ATOM 218 CG GLU A 347 4.528 11.591 4.057 1.00 0.00 C ATOM 219 CD GLU A 347 4.598 13.094 3.904 1.00 0.00 C ATOM 220 OE1 GLU A 347 5.040 13.561 2.833 1.00 0.00 O ATOM 221 OE2 GLU A 347 4.109 13.711 4.882 1.00 0.00 O ATOM 0 H GLU A 347 7.273 8.930 2.976 1.00 0.00 H new ATOM 0 HA GLU A 347 5.877 9.651 5.321 1.00 0.00 H new ATOM 0 HB2 GLU A 347 6.647 11.306 3.684 1.00 0.00 H new ATOM 0 HB3 GLU A 347 5.612 10.624 2.445 1.00 0.00 H new ATOM 0 HG2 GLU A 347 3.623 11.242 3.559 1.00 0.00 H new ATOM 0 HG3 GLU A 347 4.416 11.364 5.117 1.00 0.00 H new ATOM 228 N VAL A 348 4.152 7.766 3.311 1.00 0.00 N ATOM 229 CA VAL A 348 2.948 6.966 3.204 1.00 0.00 C ATOM 230 C VAL A 348 2.929 5.832 4.226 1.00 0.00 C ATOM 231 O VAL A 348 1.840 5.446 4.623 1.00 0.00 O ATOM 232 CB VAL A 348 2.706 6.597 1.744 1.00 0.00 C ATOM 233 CG1 VAL A 348 1.513 5.647 1.564 1.00 0.00 C ATOM 234 CG2 VAL A 348 2.409 7.882 0.928 1.00 0.00 C ATOM 0 H VAL A 348 4.864 7.513 2.626 1.00 0.00 H new ATOM 0 HA VAL A 348 2.068 7.543 3.489 1.00 0.00 H new ATOM 0 HB VAL A 348 3.608 6.094 1.395 1.00 0.00 H new ATOM 0 HG11 VAL A 348 1.387 5.418 0.506 1.00 0.00 H new ATOM 0 HG12 VAL A 348 1.696 4.725 2.116 1.00 0.00 H new ATOM 0 HG13 VAL A 348 0.608 6.123 1.943 1.00 0.00 H new ATOM 0 HG21 VAL A 348 2.236 7.619 -0.115 1.00 0.00 H new ATOM 0 HG22 VAL A 348 1.522 8.372 1.330 1.00 0.00 H new ATOM 0 HG23 VAL A 348 3.260 8.560 0.995 1.00 0.00 H new ATOM 244 N GLU A 349 4.061 5.295 4.681 1.00 0.00 N ATOM 245 CA GLU A 349 4.089 4.449 5.893 1.00 0.00 C ATOM 246 C GLU A 349 3.360 5.121 7.067 1.00 0.00 C ATOM 247 O GLU A 349 2.645 4.450 7.808 1.00 0.00 O ATOM 248 CB GLU A 349 5.511 4.067 6.341 1.00 0.00 C ATOM 249 CG GLU A 349 6.347 3.303 5.309 1.00 0.00 C ATOM 250 CD GLU A 349 7.768 3.077 5.806 1.00 0.00 C ATOM 251 OE1 GLU A 349 8.535 4.058 5.853 1.00 0.00 O ATOM 252 OE2 GLU A 349 8.145 1.910 6.074 1.00 0.00 O ATOM 0 H GLU A 349 4.970 5.425 4.238 1.00 0.00 H new ATOM 0 HA GLU A 349 3.571 3.533 5.610 1.00 0.00 H new ATOM 0 HB2 GLU A 349 6.044 4.978 6.612 1.00 0.00 H new ATOM 0 HB3 GLU A 349 5.438 3.460 7.244 1.00 0.00 H new ATOM 0 HG2 GLU A 349 5.877 2.343 5.096 1.00 0.00 H new ATOM 0 HG3 GLU A 349 6.371 3.861 4.373 1.00 0.00 H new ATOM 259 N LYS A 350 3.459 6.451 7.189 1.00 0.00 N ATOM 260 CA LYS A 350 2.700 7.221 8.186 1.00 0.00 C ATOM 261 C LYS A 350 1.200 7.212 7.852 1.00 0.00 C ATOM 262 O LYS A 350 0.370 7.230 8.756 1.00 0.00 O ATOM 263 CB LYS A 350 3.272 8.659 8.200 1.00 0.00 C ATOM 264 CG LYS A 350 2.514 9.761 8.958 1.00 0.00 C ATOM 265 CD LYS A 350 2.863 11.184 8.444 1.00 0.00 C ATOM 266 CE LYS A 350 1.796 11.800 7.504 1.00 0.00 C ATOM 267 NZ LYS A 350 2.241 12.041 6.106 1.00 0.00 N ATOM 0 H LYS A 350 4.065 7.023 6.602 1.00 0.00 H new ATOM 0 HA LYS A 350 2.801 6.775 9.175 1.00 0.00 H new ATOM 0 HB2 LYS A 350 4.278 8.608 8.616 1.00 0.00 H new ATOM 0 HB3 LYS A 350 3.371 8.983 7.164 1.00 0.00 H new ATOM 0 HG2 LYS A 350 1.441 9.595 8.857 1.00 0.00 H new ATOM 0 HG3 LYS A 350 2.749 9.694 10.020 1.00 0.00 H new ATOM 0 HD2 LYS A 350 3.001 11.844 9.301 1.00 0.00 H new ATOM 0 HD3 LYS A 350 3.816 11.144 7.916 1.00 0.00 H new ATOM 0 HE2 LYS A 350 0.930 11.139 7.483 1.00 0.00 H new ATOM 0 HE3 LYS A 350 1.464 12.747 7.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 350 1.495 12.545 5.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 350 3.108 12.616 6.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 350 2.432 11.131 5.641 1.00 0.00 H new ATOM 281 N LEU A 351 0.847 7.287 6.569 1.00 0.00 N ATOM 282 CA LEU A 351 -0.524 7.446 6.087 1.00 0.00 C ATOM 283 C LEU A 351 -1.288 6.125 6.053 1.00 0.00 C ATOM 284 O LEU A 351 -2.320 5.985 6.705 1.00 0.00 O ATOM 285 CB LEU A 351 -0.522 8.107 4.703 1.00 0.00 C ATOM 286 CG LEU A 351 0.101 9.511 4.684 1.00 0.00 C ATOM 287 CD1 LEU A 351 0.407 9.948 3.246 1.00 0.00 C ATOM 288 CD2 LEU A 351 -0.820 10.479 5.421 1.00 0.00 C ATOM 0 H LEU A 351 1.530 7.237 5.813 1.00 0.00 H new ATOM 0 HA LEU A 351 -1.045 8.092 6.794 1.00 0.00 H new ATOM 0 HB2 LEU A 351 0.023 7.469 4.007 1.00 0.00 H new ATOM 0 HB3 LEU A 351 -1.548 8.171 4.340 1.00 0.00 H new ATOM 0 HG LEU A 351 1.058 9.505 5.206 1.00 0.00 H new ATOM 0 HD11 LEU A 351 0.848 10.945 3.255 1.00 0.00 H new ATOM 0 HD12 LEU A 351 1.107 9.246 2.793 1.00 0.00 H new ATOM 0 HD13 LEU A 351 -0.516 9.964 2.666 1.00 0.00 H new ATOM 0 HD21 LEU A 351 -0.382 11.477 5.410 1.00 0.00 H new ATOM 0 HD22 LEU A 351 -1.792 10.504 4.928 1.00 0.00 H new ATOM 0 HD23 LEU A 351 -0.945 10.149 6.452 1.00 0.00 H new ATOM 300 N LEU A 352 -0.803 5.156 5.269 1.00 0.00 N ATOM 301 CA LEU A 352 -1.215 3.755 5.249 1.00 0.00 C ATOM 302 C LEU A 352 -0.715 3.135 6.572 1.00 0.00 C ATOM 303 O LEU A 352 0.082 2.205 6.554 1.00 0.00 O ATOM 304 CB LEU A 352 -0.675 3.042 3.964 1.00 0.00 C ATOM 305 CG LEU A 352 -1.211 3.506 2.582 1.00 0.00 C ATOM 306 CD1 LEU A 352 -0.568 2.771 1.389 1.00 0.00 C ATOM 307 CD2 LEU A 352 -2.710 3.284 2.425 1.00 0.00 C ATOM 0 H LEU A 352 -0.066 5.345 4.590 1.00 0.00 H new ATOM 0 HA LEU A 352 -2.297 3.638 5.192 1.00 0.00 H new ATOM 0 HB2 LEU A 352 0.409 3.152 3.954 1.00 0.00 H new ATOM 0 HB3 LEU A 352 -0.886 1.977 4.062 1.00 0.00 H new ATOM 0 HG LEU A 352 -0.956 4.566 2.567 1.00 0.00 H new ATOM 0 HD11 LEU A 352 -0.992 3.148 0.458 1.00 0.00 H new ATOM 0 HD12 LEU A 352 0.508 2.942 1.393 1.00 0.00 H new ATOM 0 HD13 LEU A 352 -0.765 1.702 1.471 1.00 0.00 H new ATOM 0 HD21 LEU A 352 -3.027 3.627 1.440 1.00 0.00 H new ATOM 0 HD22 LEU A 352 -2.933 2.222 2.529 1.00 0.00 H new ATOM 0 HD23 LEU A 352 -3.243 3.844 3.193 1.00 0.00 H new ATOM 319 N ASN A 353 -1.154 3.661 7.725 1.00 0.00 N ATOM 320 CA ASN A 353 -0.617 3.308 9.043 1.00 0.00 C ATOM 321 C ASN A 353 -0.795 1.816 9.328 1.00 0.00 C ATOM 322 O ASN A 353 -1.660 1.165 8.717 1.00 0.00 O ATOM 323 CB ASN A 353 -1.287 4.136 10.155 1.00 0.00 C ATOM 324 CG ASN A 353 -0.563 3.928 11.485 1.00 0.00 C ATOM 325 OD1 ASN A 353 0.609 4.253 11.607 1.00 0.00 O ATOM 326 ND2 ASN A 353 -1.173 3.314 12.483 1.00 0.00 N ATOM 0 H ASN A 353 -1.902 4.353 7.766 1.00 0.00 H new ATOM 0 HA ASN A 353 0.449 3.537 9.032 1.00 0.00 H new ATOM 0 HB2 ASN A 353 -1.274 5.193 9.888 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -2.333 3.845 10.254 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -0.666 3.115 13.346 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -2.151 3.039 12.391 1.00 0.00 H new ATOM 333 N GLY A 354 -0.017 1.284 10.280 1.00 0.00 N ATOM 334 CA GLY A 354 -0.011 -0.119 10.662 1.00 0.00 C ATOM 335 C GLY A 354 -1.277 -0.542 11.407 1.00 0.00 C ATOM 336 O GLY A 354 -1.192 -1.045 12.518 1.00 0.00 O ATOM 0 H GLY A 354 0.644 1.844 10.818 1.00 0.00 H new ATOM 0 HA2 GLY A 354 0.100 -0.733 9.768 1.00 0.00 H new ATOM 0 HA3 GLY A 354 0.857 -0.314 11.292 1.00 0.00 H new ATOM 340 N ASP A 355 -2.405 -0.549 10.697 1.00 0.00 N ATOM 341 CA ASP A 355 -3.700 -1.103 11.080 1.00 0.00 C ATOM 342 C ASP A 355 -4.444 -1.150 9.742 1.00 0.00 C ATOM 343 O ASP A 355 -4.822 -2.201 9.220 1.00 0.00 O ATOM 344 CB ASP A 355 -4.569 -0.205 12.014 1.00 0.00 C ATOM 345 CG ASP A 355 -3.854 0.584 13.101 1.00 0.00 C ATOM 346 OD1 ASP A 355 -3.345 1.665 12.713 1.00 0.00 O ATOM 347 OD2 ASP A 355 -3.927 0.181 14.279 1.00 0.00 O ATOM 0 H ASP A 355 -2.437 -0.134 9.766 1.00 0.00 H new ATOM 0 HA ASP A 355 -3.543 -2.036 11.622 1.00 0.00 H new ATOM 0 HB2 ASP A 355 -5.113 0.503 11.388 1.00 0.00 H new ATOM 0 HB3 ASP A 355 -5.312 -0.841 12.495 1.00 0.00 H new ATOM 352 N THR A 356 -4.617 0.041 9.156 1.00 0.00 N ATOM 353 CA THR A 356 -5.453 0.306 8.004 1.00 0.00 C ATOM 354 C THR A 356 -4.880 -0.384 6.775 1.00 0.00 C ATOM 355 O THR A 356 -5.640 -0.980 6.011 1.00 0.00 O ATOM 356 CB THR A 356 -5.521 1.829 7.805 1.00 0.00 C ATOM 357 OG1 THR A 356 -6.190 2.420 8.902 1.00 0.00 O ATOM 358 CG2 THR A 356 -6.285 2.213 6.539 1.00 0.00 C ATOM 0 H THR A 356 -4.149 0.881 9.498 1.00 0.00 H new ATOM 0 HA THR A 356 -6.458 -0.085 8.160 1.00 0.00 H new ATOM 0 HB THR A 356 -4.494 2.184 7.721 1.00 0.00 H new ATOM 0 HG1 THR A 356 -6.231 3.391 8.775 1.00 0.00 H new ATOM 0 HG21 THR A 356 -6.306 3.298 6.442 1.00 0.00 H new ATOM 0 HG22 THR A 356 -5.790 1.780 5.670 1.00 0.00 H new ATOM 0 HG23 THR A 356 -7.305 1.834 6.601 1.00 0.00 H new ATOM 366 N TRP A 357 -3.556 -0.346 6.603 1.00 0.00 N ATOM 367 CA TRP A 357 -2.908 -0.938 5.449 1.00 0.00 C ATOM 368 C TRP A 357 -3.361 -2.395 5.243 1.00 0.00 C ATOM 369 O TRP A 357 -3.653 -2.745 4.114 1.00 0.00 O ATOM 370 CB TRP A 357 -1.391 -0.762 5.493 1.00 0.00 C ATOM 371 CG TRP A 357 -0.715 -1.842 6.257 1.00 0.00 C ATOM 372 CD1 TRP A 357 -0.642 -1.922 7.598 1.00 0.00 C ATOM 373 CD2 TRP A 357 -0.254 -3.119 5.749 1.00 0.00 C ATOM 374 NE1 TRP A 357 -0.133 -3.150 7.967 1.00 0.00 N ATOM 375 CE2 TRP A 357 0.079 -3.946 6.857 1.00 0.00 C ATOM 376 CE3 TRP A 357 -0.209 -3.697 4.464 1.00 0.00 C ATOM 377 CZ2 TRP A 357 0.462 -5.276 6.659 1.00 0.00 C ATOM 378 CZ3 TRP A 357 0.236 -5.010 4.267 1.00 0.00 C ATOM 379 CH2 TRP A 357 0.593 -5.776 5.374 1.00 0.00 C ATOM 0 H TRP A 357 -2.913 0.095 7.261 1.00 0.00 H new ATOM 0 HA TRP A 357 -3.232 -0.395 4.561 1.00 0.00 H new ATOM 0 HB2 TRP A 357 -1.001 -0.742 4.475 1.00 0.00 H new ATOM 0 HB3 TRP A 357 -1.153 0.201 5.944 1.00 0.00 H new ATOM 0 HD1 TRP A 357 -0.938 -1.141 8.283 1.00 0.00 H new ATOM 0 HE1 TRP A 357 0.061 -3.432 8.928 1.00 0.00 H new ATOM 0 HE3 TRP A 357 -0.525 -3.114 3.612 1.00 0.00 H new ATOM 0 HZ2 TRP A 357 0.656 -5.914 7.509 1.00 0.00 H new ATOM 0 HZ3 TRP A 357 0.301 -5.423 3.271 1.00 0.00 H new ATOM 0 HH2 TRP A 357 0.978 -6.775 5.228 1.00 0.00 H new ATOM 390 N ARG A 358 -3.375 -3.268 6.270 1.00 0.00 N ATOM 391 CA ARG A 358 -3.877 -4.655 6.182 1.00 0.00 C ATOM 392 C ARG A 358 -5.169 -4.763 5.366 1.00 0.00 C ATOM 393 O ARG A 358 -5.293 -5.631 4.507 1.00 0.00 O ATOM 394 CB ARG A 358 -4.035 -5.333 7.562 1.00 0.00 C ATOM 395 CG ARG A 358 -2.701 -5.529 8.303 1.00 0.00 C ATOM 396 CD ARG A 358 -2.802 -6.243 9.663 1.00 0.00 C ATOM 397 NE ARG A 358 -2.968 -7.710 9.577 1.00 0.00 N ATOM 398 CZ ARG A 358 -4.092 -8.419 9.717 1.00 0.00 C ATOM 399 NH1 ARG A 358 -5.280 -7.812 9.728 1.00 0.00 N ATOM 400 NH2 ARG A 358 -4.030 -9.736 9.858 1.00 0.00 N ATOM 0 H ARG A 358 -3.032 -3.026 7.200 1.00 0.00 H new ATOM 0 HA ARG A 358 -3.103 -5.204 5.646 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -4.700 -4.731 8.180 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -4.514 -6.303 7.429 1.00 0.00 H new ATOM 0 HG2 ARG A 358 -2.028 -6.098 7.662 1.00 0.00 H new ATOM 0 HG3 ARG A 358 -2.243 -4.552 8.457 1.00 0.00 H new ATOM 0 HD2 ARG A 358 -1.904 -6.025 10.240 1.00 0.00 H new ATOM 0 HD3 ARG A 358 -3.645 -5.827 10.215 1.00 0.00 H new ATOM 0 HE ARG A 358 -2.121 -8.246 9.388 1.00 0.00 H new ATOM 0 HH11 ARG A 358 -5.336 -6.798 9.629 1.00 0.00 H new ATOM 0 HH12 ARG A 358 -6.133 -8.362 9.835 1.00 0.00 H new ATOM 0 HH21 ARG A 358 -3.125 -10.207 9.860 1.00 0.00 H new ATOM 0 HH22 ARG A 358 -4.887 -10.278 9.965 1.00 0.00 H new ATOM 414 N HIS A 359 -6.146 -3.908 5.666 1.00 0.00 N ATOM 415 CA HIS A 359 -7.441 -3.865 4.997 1.00 0.00 C ATOM 416 C HIS A 359 -7.248 -3.570 3.509 1.00 0.00 C ATOM 417 O HIS A 359 -7.784 -4.281 2.663 1.00 0.00 O ATOM 418 CB HIS A 359 -8.344 -2.838 5.698 1.00 0.00 C ATOM 419 CG HIS A 359 -8.474 -3.092 7.185 1.00 0.00 C ATOM 420 ND1 HIS A 359 -7.578 -2.728 8.175 1.00 0.00 N ATOM 421 CD2 HIS A 359 -9.480 -3.802 7.785 1.00 0.00 C ATOM 422 CE1 HIS A 359 -8.047 -3.202 9.341 1.00 0.00 C ATOM 423 NE2 HIS A 359 -9.196 -3.870 9.152 1.00 0.00 N ATOM 0 H HIS A 359 -6.054 -3.208 6.402 1.00 0.00 H new ATOM 0 HA HIS A 359 -7.938 -4.833 5.065 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -7.941 -1.838 5.538 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -9.334 -2.860 5.242 1.00 0.00 H new ATOM 0 HD1 HIS A 359 -6.718 -2.196 8.043 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -10.339 -4.232 7.291 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -7.566 -3.065 10.298 1.00 0.00 H new ATOM 431 N LEU A 360 -6.440 -2.558 3.186 1.00 0.00 N ATOM 432 CA LEU A 360 -6.069 -2.228 1.818 1.00 0.00 C ATOM 433 C LEU A 360 -5.325 -3.382 1.132 1.00 0.00 C ATOM 434 O LEU A 360 -5.596 -3.665 -0.026 1.00 0.00 O ATOM 435 CB LEU A 360 -5.231 -0.946 1.855 1.00 0.00 C ATOM 436 CG LEU A 360 -4.519 -0.619 0.536 1.00 0.00 C ATOM 437 CD1 LEU A 360 -5.525 -0.271 -0.558 1.00 0.00 C ATOM 438 CD2 LEU A 360 -3.604 0.563 0.810 1.00 0.00 C ATOM 0 H LEU A 360 -6.022 -1.939 3.881 1.00 0.00 H new ATOM 0 HA LEU A 360 -6.966 -2.064 1.221 1.00 0.00 H new ATOM 0 HB2 LEU A 360 -5.878 -0.110 2.122 1.00 0.00 H new ATOM 0 HB3 LEU A 360 -4.485 -1.036 2.644 1.00 0.00 H new ATOM 0 HG LEU A 360 -3.952 -1.481 0.184 1.00 0.00 H new ATOM 0 HD11 LEU A 360 -4.993 -0.043 -1.482 1.00 0.00 H new ATOM 0 HD12 LEU A 360 -6.192 -1.118 -0.722 1.00 0.00 H new ATOM 0 HD13 LEU A 360 -6.109 0.597 -0.252 1.00 0.00 H new ATOM 0 HD21 LEU A 360 -3.074 0.832 -0.104 1.00 0.00 H new ATOM 0 HD22 LEU A 360 -4.198 1.412 1.149 1.00 0.00 H new ATOM 0 HD23 LEU A 360 -2.883 0.294 1.582 1.00 0.00 H new ATOM 450 N ALA A 361 -4.370 -4.016 1.810 1.00 0.00 N ATOM 451 CA ALA A 361 -3.609 -5.170 1.350 1.00 0.00 C ATOM 452 C ALA A 361 -4.558 -6.267 0.851 1.00 0.00 C ATOM 453 O ALA A 361 -4.377 -6.785 -0.251 1.00 0.00 O ATOM 454 CB ALA A 361 -2.632 -5.618 2.453 1.00 0.00 C ATOM 0 H ALA A 361 -4.093 -3.720 2.746 1.00 0.00 H new ATOM 0 HA ALA A 361 -2.992 -4.910 0.490 1.00 0.00 H new ATOM 0 HB1 ALA A 361 -2.064 -6.481 2.107 1.00 0.00 H new ATOM 0 HB2 ALA A 361 -1.947 -4.802 2.686 1.00 0.00 H new ATOM 0 HB3 ALA A 361 -3.193 -5.888 3.348 1.00 0.00 H new ATOM 460 N GLY A 362 -5.581 -6.595 1.647 1.00 0.00 N ATOM 461 CA GLY A 362 -6.624 -7.537 1.268 1.00 0.00 C ATOM 462 C GLY A 362 -7.440 -7.036 0.081 1.00 0.00 C ATOM 463 O GLY A 362 -7.677 -7.794 -0.859 1.00 0.00 O ATOM 0 H GLY A 362 -5.704 -6.206 2.582 1.00 0.00 H new ATOM 0 HA2 GLY A 362 -6.173 -8.497 1.019 1.00 0.00 H new ATOM 0 HA3 GLY A 362 -7.286 -7.707 2.117 1.00 0.00 H new ATOM 467 N GLU A 363 -7.845 -5.762 0.086 1.00 0.00 N ATOM 468 CA GLU A 363 -8.582 -5.178 -1.032 1.00 0.00 C ATOM 469 C GLU A 363 -7.739 -5.166 -2.322 1.00 0.00 C ATOM 470 O GLU A 363 -8.303 -5.103 -3.420 1.00 0.00 O ATOM 471 CB GLU A 363 -9.010 -3.744 -0.652 1.00 0.00 C ATOM 472 CG GLU A 363 -10.215 -3.676 0.302 1.00 0.00 C ATOM 473 CD GLU A 363 -11.538 -3.798 -0.461 1.00 0.00 C ATOM 474 OE1 GLU A 363 -11.794 -4.874 -1.043 1.00 0.00 O ATOM 475 OE2 GLU A 363 -12.242 -2.779 -0.633 1.00 0.00 O ATOM 0 H GLU A 363 -7.673 -5.116 0.856 1.00 0.00 H new ATOM 0 HA GLU A 363 -9.463 -5.789 -1.230 1.00 0.00 H new ATOM 0 HB2 GLU A 363 -8.165 -3.236 -0.188 1.00 0.00 H new ATOM 0 HB3 GLU A 363 -9.251 -3.196 -1.563 1.00 0.00 H new ATOM 0 HG2 GLU A 363 -10.143 -4.476 1.039 1.00 0.00 H new ATOM 0 HG3 GLU A 363 -10.195 -2.734 0.850 1.00 0.00 H new ATOM 482 N LEU A 364 -6.407 -5.240 -2.222 1.00 0.00 N ATOM 483 CA LEU A 364 -5.491 -5.417 -3.342 1.00 0.00 C ATOM 484 C LEU A 364 -5.159 -6.884 -3.639 1.00 0.00 C ATOM 485 O LEU A 364 -4.173 -7.141 -4.327 1.00 0.00 O ATOM 486 CB LEU A 364 -4.215 -4.601 -3.046 1.00 0.00 C ATOM 487 CG LEU A 364 -4.432 -3.079 -3.132 1.00 0.00 C ATOM 488 CD1 LEU A 364 -3.176 -2.341 -2.654 1.00 0.00 C ATOM 489 CD2 LEU A 364 -4.783 -2.670 -4.569 1.00 0.00 C ATOM 0 H LEU A 364 -5.926 -5.175 -1.325 1.00 0.00 H new ATOM 0 HA LEU A 364 -5.981 -5.055 -4.246 1.00 0.00 H new ATOM 0 HB2 LEU A 364 -3.853 -4.854 -2.049 1.00 0.00 H new ATOM 0 HB3 LEU A 364 -3.435 -4.890 -3.751 1.00 0.00 H new ATOM 0 HG LEU A 364 -5.265 -2.805 -2.484 1.00 0.00 H new ATOM 0 HD11 LEU A 364 -3.339 -1.265 -2.719 1.00 0.00 H new ATOM 0 HD12 LEU A 364 -2.965 -2.614 -1.620 1.00 0.00 H new ATOM 0 HD13 LEU A 364 -2.330 -2.618 -3.283 1.00 0.00 H new ATOM 0 HD21 LEU A 364 -4.933 -1.591 -4.614 1.00 0.00 H new ATOM 0 HD22 LEU A 364 -3.968 -2.951 -5.237 1.00 0.00 H new ATOM 0 HD23 LEU A 364 -5.697 -3.177 -4.879 1.00 0.00 H new ATOM 501 N GLY A 365 -6.055 -7.822 -3.325 1.00 0.00 N ATOM 502 CA GLY A 365 -5.979 -9.219 -3.735 1.00 0.00 C ATOM 503 C GLY A 365 -4.653 -9.930 -3.447 1.00 0.00 C ATOM 504 O GLY A 365 -4.226 -10.742 -4.266 1.00 0.00 O ATOM 0 H GLY A 365 -6.879 -7.620 -2.759 1.00 0.00 H new ATOM 0 HA2 GLY A 365 -6.779 -9.768 -3.237 1.00 0.00 H new ATOM 0 HA3 GLY A 365 -6.173 -9.274 -4.806 1.00 0.00 H new ATOM 508 N TYR A 366 -4.050 -9.717 -2.274 1.00 0.00 N ATOM 509 CA TYR A 366 -2.981 -10.577 -1.759 1.00 0.00 C ATOM 510 C TYR A 366 -3.588 -11.357 -0.593 1.00 0.00 C ATOM 511 O TYR A 366 -4.288 -10.776 0.237 1.00 0.00 O ATOM 512 CB TYR A 366 -1.743 -9.762 -1.333 1.00 0.00 C ATOM 513 CG TYR A 366 -0.796 -9.386 -2.471 1.00 0.00 C ATOM 514 CD1 TYR A 366 -1.240 -8.478 -3.434 1.00 0.00 C ATOM 515 CD2 TYR A 366 0.516 -9.902 -2.552 1.00 0.00 C ATOM 516 CE1 TYR A 366 -0.413 -8.111 -4.496 1.00 0.00 C ATOM 517 CE2 TYR A 366 1.367 -9.517 -3.610 1.00 0.00 C ATOM 518 CZ TYR A 366 0.898 -8.618 -4.599 1.00 0.00 C ATOM 519 OH TYR A 366 1.686 -8.222 -5.640 1.00 0.00 O ATOM 0 H TYR A 366 -4.289 -8.943 -1.654 1.00 0.00 H new ATOM 0 HA TYR A 366 -2.618 -11.256 -2.531 1.00 0.00 H new ATOM 0 HB2 TYR A 366 -2.079 -8.848 -0.843 1.00 0.00 H new ATOM 0 HB3 TYR A 366 -1.187 -10.335 -0.592 1.00 0.00 H new ATOM 0 HD1 TYR A 366 -2.231 -8.056 -3.356 1.00 0.00 H new ATOM 0 HD2 TYR A 366 0.869 -10.594 -1.802 1.00 0.00 H new ATOM 0 HE1 TYR A 366 -0.782 -7.430 -5.249 1.00 0.00 H new ATOM 0 HE2 TYR A 366 2.373 -9.907 -3.665 1.00 0.00 H new ATOM 0 HH TYR A 366 2.561 -8.657 -5.572 1.00 0.00 H new ATOM 529 N GLN A 367 -3.400 -12.683 -0.587 1.00 0.00 N ATOM 530 CA GLN A 367 -3.940 -13.579 0.437 1.00 0.00 C ATOM 531 C GLN A 367 -3.598 -13.105 1.860 1.00 0.00 C ATOM 532 O GLN A 367 -2.559 -12.469 2.051 1.00 0.00 O ATOM 533 CB GLN A 367 -3.382 -14.994 0.202 1.00 0.00 C ATOM 534 CG GLN A 367 -4.369 -15.912 -0.526 1.00 0.00 C ATOM 535 CD GLN A 367 -3.893 -17.365 -0.593 1.00 0.00 C ATOM 536 OE1 GLN A 367 -3.834 -17.958 -1.664 1.00 0.00 O ATOM 537 NE2 GLN A 367 -3.576 -17.992 0.529 1.00 0.00 N ATOM 0 H GLN A 367 -2.861 -13.168 -1.304 1.00 0.00 H new ATOM 0 HA GLN A 367 -5.027 -13.580 0.354 1.00 0.00 H new ATOM 0 HB2 GLN A 367 -2.462 -14.924 -0.379 1.00 0.00 H new ATOM 0 HB3 GLN A 367 -3.120 -15.439 1.162 1.00 0.00 H new ATOM 0 HG2 GLN A 367 -5.334 -15.874 -0.020 1.00 0.00 H new ATOM 0 HG3 GLN A 367 -4.525 -15.539 -1.538 1.00 0.00 H new ATOM 0 HE21 GLN A 367 -3.625 -17.499 1.420 1.00 0.00 H new ATOM 0 HE22 GLN A 367 -3.283 -18.969 0.502 1.00 0.00 H new ATOM 546 N PRO A 368 -4.351 -13.527 2.893 1.00 0.00 N ATOM 547 CA PRO A 368 -4.145 -13.036 4.250 1.00 0.00 C ATOM 548 C PRO A 368 -2.809 -13.491 4.833 1.00 0.00 C ATOM 549 O PRO A 368 -2.196 -12.741 5.589 1.00 0.00 O ATOM 550 CB PRO A 368 -5.344 -13.531 5.064 1.00 0.00 C ATOM 551 CG PRO A 368 -5.825 -14.760 4.295 1.00 0.00 C ATOM 552 CD PRO A 368 -5.503 -14.415 2.841 1.00 0.00 C ATOM 0 HA PRO A 368 -4.089 -11.948 4.270 1.00 0.00 H new ATOM 0 HB2 PRO A 368 -5.057 -13.785 6.085 1.00 0.00 H new ATOM 0 HB3 PRO A 368 -6.123 -12.771 5.131 1.00 0.00 H new ATOM 0 HG2 PRO A 368 -5.308 -15.664 4.618 1.00 0.00 H new ATOM 0 HG3 PRO A 368 -6.891 -14.933 4.440 1.00 0.00 H new ATOM 0 HD2 PRO A 368 -5.279 -15.313 2.266 1.00 0.00 H new ATOM 0 HD3 PRO A 368 -6.350 -13.929 2.357 1.00 0.00 H new ATOM 560 N GLU A 369 -2.313 -14.663 4.433 1.00 0.00 N ATOM 561 CA GLU A 369 -0.996 -15.146 4.818 1.00 0.00 C ATOM 562 C GLU A 369 0.071 -14.181 4.297 1.00 0.00 C ATOM 563 O GLU A 369 1.044 -13.897 4.990 1.00 0.00 O ATOM 564 CB GLU A 369 -0.742 -16.559 4.255 1.00 0.00 C ATOM 565 CG GLU A 369 -1.725 -17.647 4.733 1.00 0.00 C ATOM 566 CD GLU A 369 -3.138 -17.556 4.133 1.00 0.00 C ATOM 567 OE1 GLU A 369 -3.302 -16.908 3.071 1.00 0.00 O ATOM 568 OE2 GLU A 369 -4.069 -18.125 4.735 1.00 0.00 O ATOM 0 H GLU A 369 -2.823 -15.306 3.827 1.00 0.00 H new ATOM 0 HA GLU A 369 -0.947 -15.198 5.906 1.00 0.00 H new ATOM 0 HB2 GLU A 369 -0.781 -16.511 3.167 1.00 0.00 H new ATOM 0 HB3 GLU A 369 0.269 -16.863 4.525 1.00 0.00 H new ATOM 0 HG2 GLU A 369 -1.307 -18.624 4.492 1.00 0.00 H new ATOM 0 HG3 GLU A 369 -1.804 -17.593 5.819 1.00 0.00 H new ATOM 575 N HIS A 370 -0.110 -13.658 3.079 1.00 0.00 N ATOM 576 CA HIS A 370 0.819 -12.713 2.475 1.00 0.00 C ATOM 577 C HIS A 370 0.747 -11.381 3.220 1.00 0.00 C ATOM 578 O HIS A 370 1.783 -10.761 3.436 1.00 0.00 O ATOM 579 CB HIS A 370 0.513 -12.485 0.983 1.00 0.00 C ATOM 580 CG HIS A 370 0.327 -13.711 0.115 1.00 0.00 C ATOM 581 ND1 HIS A 370 0.461 -15.034 0.484 1.00 0.00 N ATOM 582 CD2 HIS A 370 -0.057 -13.692 -1.199 1.00 0.00 C ATOM 583 CE1 HIS A 370 0.160 -15.789 -0.587 1.00 0.00 C ATOM 584 NE2 HIS A 370 -0.157 -15.013 -1.636 1.00 0.00 N ATOM 0 H HIS A 370 -0.910 -13.883 2.487 1.00 0.00 H new ATOM 0 HA HIS A 370 1.822 -13.134 2.550 1.00 0.00 H new ATOM 0 HB2 HIS A 370 -0.393 -11.882 0.913 1.00 0.00 H new ATOM 0 HB3 HIS A 370 1.324 -11.892 0.560 1.00 0.00 H new ATOM 0 HD2 HIS A 370 -0.249 -12.810 -1.792 1.00 0.00 H new ATOM 0 HE1 HIS A 370 0.172 -16.869 -0.602 1.00 0.00 H new ATOM 0 HE2 HIS A 370 -0.420 -15.328 -2.570 1.00 0.00 H new ATOM 592 N ILE A 371 -0.455 -10.933 3.607 1.00 0.00 N ATOM 593 CA ILE A 371 -0.630 -9.692 4.354 1.00 0.00 C ATOM 594 C ILE A 371 0.120 -9.811 5.678 1.00 0.00 C ATOM 595 O ILE A 371 0.908 -8.933 6.019 1.00 0.00 O ATOM 596 CB ILE A 371 -2.129 -9.378 4.591 1.00 0.00 C ATOM 597 CG1 ILE A 371 -2.899 -9.262 3.258 1.00 0.00 C ATOM 598 CG2 ILE A 371 -2.298 -8.084 5.413 1.00 0.00 C ATOM 599 CD1 ILE A 371 -4.415 -9.163 3.442 1.00 0.00 C ATOM 0 H ILE A 371 -1.327 -11.423 3.409 1.00 0.00 H new ATOM 0 HA ILE A 371 -0.224 -8.863 3.774 1.00 0.00 H new ATOM 0 HB ILE A 371 -2.549 -10.210 5.156 1.00 0.00 H new ATOM 0 HG12 ILE A 371 -2.547 -8.383 2.718 1.00 0.00 H new ATOM 0 HG13 ILE A 371 -2.671 -10.129 2.638 1.00 0.00 H new ATOM 0 HG21 ILE A 371 -3.359 -7.886 5.566 1.00 0.00 H new ATOM 0 HG22 ILE A 371 -1.808 -8.200 6.380 1.00 0.00 H new ATOM 0 HG23 ILE A 371 -1.847 -7.250 4.876 1.00 0.00 H new ATOM 0 HD11 ILE A 371 -4.895 -9.084 2.467 1.00 0.00 H new ATOM 0 HD12 ILE A 371 -4.778 -10.054 3.954 1.00 0.00 H new ATOM 0 HD13 ILE A 371 -4.653 -8.281 4.036 1.00 0.00 H new ATOM 611 N ASP A 372 -0.099 -10.872 6.451 1.00 0.00 N ATOM 612 CA ASP A 372 0.528 -10.900 7.767 1.00 0.00 C ATOM 613 C ASP A 372 2.040 -11.122 7.601 1.00 0.00 C ATOM 614 O ASP A 372 2.837 -10.555 8.349 1.00 0.00 O ATOM 615 CB ASP A 372 -0.206 -11.868 8.709 1.00 0.00 C ATOM 616 CG ASP A 372 -1.199 -11.130 9.634 1.00 0.00 C ATOM 617 OD1 ASP A 372 -1.196 -9.878 9.738 1.00 0.00 O ATOM 618 OD2 ASP A 372 -2.134 -11.774 10.150 1.00 0.00 O ATOM 0 H ASP A 372 -0.672 -11.680 6.208 1.00 0.00 H new ATOM 0 HA ASP A 372 0.431 -9.940 8.273 1.00 0.00 H new ATOM 0 HB2 ASP A 372 -0.743 -12.611 8.119 1.00 0.00 H new ATOM 0 HB3 ASP A 372 0.522 -12.407 9.315 1.00 0.00 H new ATOM 623 N SER A 373 2.471 -11.824 6.544 1.00 0.00 N ATOM 624 CA SER A 373 3.876 -11.941 6.158 1.00 0.00 C ATOM 625 C SER A 373 4.479 -10.642 5.599 1.00 0.00 C ATOM 626 O SER A 373 5.697 -10.573 5.445 1.00 0.00 O ATOM 627 CB SER A 373 4.044 -13.097 5.163 1.00 0.00 C ATOM 628 OG SER A 373 5.408 -13.427 4.983 1.00 0.00 O ATOM 0 H SER A 373 1.839 -12.333 5.926 1.00 0.00 H new ATOM 0 HA SER A 373 4.436 -12.150 7.070 1.00 0.00 H new ATOM 0 HB2 SER A 373 3.501 -13.971 5.523 1.00 0.00 H new ATOM 0 HB3 SER A 373 3.605 -12.821 4.204 1.00 0.00 H new ATOM 0 HG SER A 373 5.965 -12.653 5.211 1.00 0.00 H new ATOM 634 N PHE A 374 3.687 -9.604 5.343 1.00 0.00 N ATOM 635 CA PHE A 374 4.182 -8.306 4.882 1.00 0.00 C ATOM 636 C PHE A 374 4.517 -7.440 6.087 1.00 0.00 C ATOM 637 O PHE A 374 5.455 -6.654 6.011 1.00 0.00 O ATOM 638 CB PHE A 374 3.133 -7.569 4.025 1.00 0.00 C ATOM 639 CG PHE A 374 3.290 -7.602 2.529 1.00 0.00 C ATOM 640 CD1 PHE A 374 4.535 -7.309 1.941 1.00 0.00 C ATOM 641 CD2 PHE A 374 2.195 -7.931 1.703 1.00 0.00 C ATOM 642 CE1 PHE A 374 4.690 -7.378 0.547 1.00 0.00 C ATOM 643 CE2 PHE A 374 2.343 -7.969 0.305 1.00 0.00 C ATOM 644 CZ PHE A 374 3.592 -7.696 -0.276 1.00 0.00 C ATOM 0 H PHE A 374 2.673 -9.639 5.450 1.00 0.00 H new ATOM 0 HA PHE A 374 5.067 -8.484 4.271 1.00 0.00 H new ATOM 0 HB2 PHE A 374 2.154 -7.983 4.267 1.00 0.00 H new ATOM 0 HB3 PHE A 374 3.123 -6.524 4.336 1.00 0.00 H new ATOM 0 HD1 PHE A 374 5.373 -7.031 2.563 1.00 0.00 H new ATOM 0 HD2 PHE A 374 1.236 -8.155 2.147 1.00 0.00 H new ATOM 0 HE1 PHE A 374 5.656 -7.186 0.104 1.00 0.00 H new ATOM 0 HE2 PHE A 374 1.496 -8.208 -0.322 1.00 0.00 H new ATOM 0 HZ PHE A 374 3.710 -7.730 -1.349 1.00 0.00 H new ATOM 654 N THR A 375 3.811 -7.593 7.210 1.00 0.00 N ATOM 655 CA THR A 375 4.154 -6.865 8.428 1.00 0.00 C ATOM 656 C THR A 375 5.346 -7.509 9.169 1.00 0.00 C ATOM 657 O THR A 375 5.697 -7.044 10.251 1.00 0.00 O ATOM 658 CB THR A 375 2.918 -6.571 9.295 1.00 0.00 C ATOM 659 OG1 THR A 375 3.236 -5.702 10.358 1.00 0.00 O ATOM 660 CG2 THR A 375 2.184 -7.800 9.827 1.00 0.00 C ATOM 0 H THR A 375 3.004 -8.211 7.299 1.00 0.00 H new ATOM 0 HA THR A 375 4.517 -5.878 8.143 1.00 0.00 H new ATOM 0 HB THR A 375 2.221 -6.089 8.610 1.00 0.00 H new ATOM 0 HG1 THR A 375 4.181 -5.807 10.595 1.00 0.00 H new ATOM 0 HG21 THR A 375 1.330 -7.483 10.425 1.00 0.00 H new ATOM 0 HG22 THR A 375 1.837 -8.407 8.991 1.00 0.00 H new ATOM 0 HG23 THR A 375 2.861 -8.389 10.446 1.00 0.00 H new ATOM 668 N HIS A 376 5.926 -8.588 8.628 1.00 0.00 N ATOM 669 CA HIS A 376 7.153 -9.211 9.116 1.00 0.00 C ATOM 670 C HIS A 376 8.380 -8.413 8.659 1.00 0.00 C ATOM 671 O HIS A 376 9.373 -8.385 9.385 1.00 0.00 O ATOM 672 CB HIS A 376 7.256 -10.677 8.668 1.00 0.00 C ATOM 673 CG HIS A 376 6.429 -11.631 9.498 1.00 0.00 C ATOM 674 ND1 HIS A 376 5.059 -11.626 9.653 1.00 0.00 N ATOM 675 CD2 HIS A 376 6.920 -12.665 10.250 1.00 0.00 C ATOM 676 CE1 HIS A 376 4.738 -12.638 10.474 1.00 0.00 C ATOM 677 NE2 HIS A 376 5.838 -13.302 10.866 1.00 0.00 N ATOM 0 H HIS A 376 5.538 -9.063 7.813 1.00 0.00 H new ATOM 0 HA HIS A 376 7.121 -9.203 10.206 1.00 0.00 H new ATOM 0 HB2 HIS A 376 6.942 -10.751 7.627 1.00 0.00 H new ATOM 0 HB3 HIS A 376 8.300 -10.987 8.709 1.00 0.00 H new ATOM 0 HD1 HIS A 376 4.407 -10.971 9.221 1.00 0.00 H new ATOM 0 HD2 HIS A 376 7.960 -12.940 10.350 1.00 0.00 H new ATOM 0 HE1 HIS A 376 3.732 -12.885 10.778 1.00 0.00 H new ATOM 685 N GLU A 377 8.374 -7.876 7.430 1.00 0.00 N ATOM 686 CA GLU A 377 9.387 -6.908 7.010 1.00 0.00 C ATOM 687 C GLU A 377 9.563 -5.729 7.965 1.00 0.00 C ATOM 688 O GLU A 377 8.703 -5.447 8.800 1.00 0.00 O ATOM 689 CB GLU A 377 9.072 -6.400 5.588 1.00 0.00 C ATOM 690 CG GLU A 377 9.567 -7.364 4.505 1.00 0.00 C ATOM 691 CD GLU A 377 11.021 -7.000 4.152 1.00 0.00 C ATOM 692 OE1 GLU A 377 11.774 -6.621 5.085 1.00 0.00 O ATOM 693 OE2 GLU A 377 11.350 -7.029 2.946 1.00 0.00 O ATOM 0 H GLU A 377 7.681 -8.097 6.715 1.00 0.00 H new ATOM 0 HA GLU A 377 10.337 -7.442 7.022 1.00 0.00 H new ATOM 0 HB2 GLU A 377 7.996 -6.261 5.484 1.00 0.00 H new ATOM 0 HB3 GLU A 377 9.535 -5.424 5.442 1.00 0.00 H new ATOM 0 HG2 GLU A 377 9.510 -8.393 4.860 1.00 0.00 H new ATOM 0 HG3 GLU A 377 8.934 -7.296 3.620 1.00 0.00 H new ATOM 700 N ALA A 378 10.646 -4.973 7.725 1.00 0.00 N ATOM 701 CA ALA A 378 11.102 -3.835 8.525 1.00 0.00 C ATOM 702 C ALA A 378 9.936 -2.923 8.904 1.00 0.00 C ATOM 703 O ALA A 378 9.811 -2.503 10.052 1.00 0.00 O ATOM 704 CB ALA A 378 12.199 -3.074 7.770 1.00 0.00 C ATOM 0 H ALA A 378 11.255 -5.151 6.927 1.00 0.00 H new ATOM 0 HA ALA A 378 11.526 -4.207 9.458 1.00 0.00 H new ATOM 0 HB1 ALA A 378 12.534 -2.228 8.370 1.00 0.00 H new ATOM 0 HB2 ALA A 378 13.040 -3.741 7.581 1.00 0.00 H new ATOM 0 HB3 ALA A 378 11.803 -2.711 6.821 1.00 0.00 H new ATOM 710 N CYS A 379 9.127 -2.582 7.904 1.00 0.00 N ATOM 711 CA CYS A 379 7.760 -2.118 8.034 1.00 0.00 C ATOM 712 C CYS A 379 7.027 -2.682 6.807 1.00 0.00 C ATOM 713 O CYS A 379 7.659 -2.774 5.747 1.00 0.00 O ATOM 714 CB CYS A 379 7.709 -0.582 8.043 1.00 0.00 C ATOM 715 SG CYS A 379 8.088 0.069 9.694 1.00 0.00 S ATOM 0 H CYS A 379 9.430 -2.627 6.931 1.00 0.00 H new ATOM 0 HA CYS A 379 7.302 -2.448 8.967 1.00 0.00 H new ATOM 0 HB2 CYS A 379 8.422 -0.186 7.319 1.00 0.00 H new ATOM 0 HB3 CYS A 379 6.720 -0.245 7.733 1.00 0.00 H new ATOM 0 HG CYS A 379 8.876 -0.757 10.316 1.00 0.00 H new ATOM 721 N PRO A 380 5.712 -2.973 6.892 1.00 0.00 N ATOM 722 CA PRO A 380 4.892 -3.370 5.750 1.00 0.00 C ATOM 723 C PRO A 380 5.038 -2.340 4.650 1.00 0.00 C ATOM 724 O PRO A 380 5.691 -2.625 3.659 1.00 0.00 O ATOM 725 CB PRO A 380 3.467 -3.570 6.277 1.00 0.00 C ATOM 726 CG PRO A 380 3.441 -2.815 7.606 1.00 0.00 C ATOM 727 CD PRO A 380 4.890 -2.866 8.090 1.00 0.00 C ATOM 0 HA PRO A 380 5.203 -4.310 5.294 1.00 0.00 H new ATOM 0 HB2 PRO A 380 2.727 -3.174 5.581 1.00 0.00 H new ATOM 0 HB3 PRO A 380 3.240 -4.627 6.416 1.00 0.00 H new ATOM 0 HG2 PRO A 380 3.100 -1.788 7.475 1.00 0.00 H new ATOM 0 HG3 PRO A 380 2.765 -3.286 8.320 1.00 0.00 H new ATOM 0 HD2 PRO A 380 5.143 -1.971 8.658 1.00 0.00 H new ATOM 0 HD3 PRO A 380 5.051 -3.718 8.750 1.00 0.00 H new ATOM 735 N VAL A 381 4.428 -1.168 4.786 1.00 0.00 N ATOM 736 CA VAL A 381 4.345 -0.162 3.737 1.00 0.00 C ATOM 737 C VAL A 381 5.642 0.053 2.915 1.00 0.00 C ATOM 738 O VAL A 381 5.552 0.147 1.692 1.00 0.00 O ATOM 739 CB VAL A 381 3.582 1.061 4.264 1.00 0.00 C ATOM 740 CG1 VAL A 381 3.436 2.160 3.207 1.00 0.00 C ATOM 741 CG2 VAL A 381 2.167 0.631 4.672 1.00 0.00 C ATOM 0 H VAL A 381 3.967 -0.885 5.651 1.00 0.00 H new ATOM 0 HA VAL A 381 3.735 -0.538 2.916 1.00 0.00 H new ATOM 0 HB VAL A 381 4.152 1.455 5.105 1.00 0.00 H new ATOM 0 HG11 VAL A 381 2.889 3.002 3.631 1.00 0.00 H new ATOM 0 HG12 VAL A 381 4.424 2.492 2.889 1.00 0.00 H new ATOM 0 HG13 VAL A 381 2.891 1.769 2.348 1.00 0.00 H new ATOM 0 HG21 VAL A 381 1.618 1.495 5.048 1.00 0.00 H new ATOM 0 HG22 VAL A 381 1.648 0.220 3.806 1.00 0.00 H new ATOM 0 HG23 VAL A 381 2.228 -0.128 5.452 1.00 0.00 H new ATOM 751 N ARG A 382 6.859 0.024 3.476 1.00 0.00 N ATOM 752 CA ARG A 382 8.061 0.053 2.628 1.00 0.00 C ATOM 753 C ARG A 382 8.136 -1.139 1.673 1.00 0.00 C ATOM 754 O ARG A 382 8.194 -0.905 0.455 1.00 0.00 O ATOM 755 CB ARG A 382 9.342 0.127 3.486 1.00 0.00 C ATOM 756 CG ARG A 382 9.988 1.520 3.544 1.00 0.00 C ATOM 757 CD ARG A 382 11.125 1.491 4.578 1.00 0.00 C ATOM 758 NE ARG A 382 11.538 2.833 5.025 1.00 0.00 N ATOM 759 CZ ARG A 382 11.333 3.356 6.242 1.00 0.00 C ATOM 760 NH1 ARG A 382 10.607 2.720 7.160 1.00 0.00 N ATOM 761 NH2 ARG A 382 11.900 4.522 6.526 1.00 0.00 N ATOM 0 H ARG A 382 7.037 -0.018 4.480 1.00 0.00 H new ATOM 0 HA ARG A 382 7.987 0.954 2.019 1.00 0.00 H new ATOM 0 HB2 ARG A 382 9.104 -0.192 4.501 1.00 0.00 H new ATOM 0 HB3 ARG A 382 10.070 -0.582 3.092 1.00 0.00 H new ATOM 0 HG2 ARG A 382 10.375 1.798 2.564 1.00 0.00 H new ATOM 0 HG3 ARG A 382 9.246 2.270 3.819 1.00 0.00 H new ATOM 0 HD2 ARG A 382 10.806 0.909 5.443 1.00 0.00 H new ATOM 0 HD3 ARG A 382 11.985 0.978 4.148 1.00 0.00 H new ATOM 0 HE ARG A 382 12.025 3.418 4.346 1.00 0.00 H new ATOM 0 HH11 ARG A 382 10.192 1.814 6.944 1.00 0.00 H new ATOM 0 HH12 ARG A 382 10.466 3.139 8.079 1.00 0.00 H new ATOM 0 HH21 ARG A 382 12.473 4.994 5.827 1.00 0.00 H new ATOM 0 HH22 ARG A 382 11.763 4.946 7.444 1.00 0.00 H new ATOM 775 N ALA A 383 8.191 -2.376 2.186 1.00 0.00 N ATOM 776 CA ALA A 383 8.398 -3.549 1.335 1.00 0.00 C ATOM 777 C ALA A 383 7.103 -4.009 0.657 1.00 0.00 C ATOM 778 O ALA A 383 7.143 -4.685 -0.370 1.00 0.00 O ATOM 779 CB ALA A 383 8.907 -4.694 2.216 1.00 0.00 C ATOM 0 H ALA A 383 8.095 -2.586 3.179 1.00 0.00 H new ATOM 0 HA ALA A 383 9.112 -3.280 0.556 1.00 0.00 H new ATOM 0 HB1 ALA A 383 9.069 -5.581 1.603 1.00 0.00 H new ATOM 0 HB2 ALA A 383 9.846 -4.402 2.686 1.00 0.00 H new ATOM 0 HB3 ALA A 383 8.169 -4.916 2.987 1.00 0.00 H new ATOM 785 N LEU A 384 5.966 -3.483 1.097 1.00 0.00 N ATOM 786 CA LEU A 384 4.640 -3.672 0.540 1.00 0.00 C ATOM 787 C LEU A 384 4.592 -2.949 -0.780 1.00 0.00 C ATOM 788 O LEU A 384 4.232 -3.525 -1.797 1.00 0.00 O ATOM 789 CB LEU A 384 3.627 -3.032 1.494 1.00 0.00 C ATOM 790 CG LEU A 384 2.165 -3.038 1.037 1.00 0.00 C ATOM 791 CD1 LEU A 384 1.668 -4.481 1.074 1.00 0.00 C ATOM 792 CD2 LEU A 384 1.388 -2.140 1.995 1.00 0.00 C ATOM 0 H LEU A 384 5.950 -2.869 1.912 1.00 0.00 H new ATOM 0 HA LEU A 384 4.413 -4.730 0.406 1.00 0.00 H new ATOM 0 HB2 LEU A 384 3.688 -3.547 2.453 1.00 0.00 H new ATOM 0 HB3 LEU A 384 3.927 -1.999 1.668 1.00 0.00 H new ATOM 0 HG LEU A 384 2.037 -2.661 0.022 1.00 0.00 H new ATOM 0 HD11 LEU A 384 0.627 -4.516 0.753 1.00 0.00 H new ATOM 0 HD12 LEU A 384 2.275 -5.092 0.406 1.00 0.00 H new ATOM 0 HD13 LEU A 384 1.747 -4.867 2.090 1.00 0.00 H new ATOM 0 HD21 LEU A 384 0.338 -2.118 1.702 1.00 0.00 H new ATOM 0 HD22 LEU A 384 1.474 -2.530 3.009 1.00 0.00 H new ATOM 0 HD23 LEU A 384 1.796 -1.130 1.959 1.00 0.00 H new ATOM 804 N LEU A 385 4.992 -1.682 -0.773 1.00 0.00 N ATOM 805 CA LEU A 385 4.885 -0.835 -1.942 1.00 0.00 C ATOM 806 C LEU A 385 6.016 -1.139 -2.919 1.00 0.00 C ATOM 807 O LEU A 385 5.885 -0.799 -4.090 1.00 0.00 O ATOM 808 CB LEU A 385 4.861 0.633 -1.509 1.00 0.00 C ATOM 809 CG LEU A 385 3.679 0.994 -0.588 1.00 0.00 C ATOM 810 CD1 LEU A 385 3.824 2.459 -0.175 1.00 0.00 C ATOM 811 CD2 LEU A 385 2.322 0.697 -1.227 1.00 0.00 C ATOM 0 H LEU A 385 5.397 -1.221 0.042 1.00 0.00 H new ATOM 0 HA LEU A 385 3.952 -1.039 -2.467 1.00 0.00 H new ATOM 0 HB2 LEU A 385 5.794 0.865 -0.995 1.00 0.00 H new ATOM 0 HB3 LEU A 385 4.822 1.263 -2.398 1.00 0.00 H new ATOM 0 HG LEU A 385 3.710 0.363 0.300 1.00 0.00 H new ATOM 0 HD11 LEU A 385 2.997 2.736 0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 385 4.767 2.596 0.355 1.00 0.00 H new ATOM 0 HD13 LEU A 385 3.812 3.090 -1.063 1.00 0.00 H new ATOM 0 HD21 LEU A 385 1.526 0.970 -0.534 1.00 0.00 H new ATOM 0 HD22 LEU A 385 2.218 1.275 -2.145 1.00 0.00 H new ATOM 0 HD23 LEU A 385 2.253 -0.366 -1.457 1.00 0.00 H new ATOM 823 N ALA A 386 7.102 -1.783 -2.473 1.00 0.00 N ATOM 824 CA ALA A 386 8.048 -2.401 -3.396 1.00 0.00 C ATOM 825 C ALA A 386 7.467 -3.660 -4.065 1.00 0.00 C ATOM 826 O ALA A 386 7.637 -3.824 -5.268 1.00 0.00 O ATOM 827 CB ALA A 386 9.334 -2.755 -2.639 1.00 0.00 C ATOM 0 H ALA A 386 7.342 -1.887 -1.487 1.00 0.00 H new ATOM 0 HA ALA A 386 8.263 -1.685 -4.189 1.00 0.00 H new ATOM 0 HB1 ALA A 386 10.044 -3.217 -3.325 1.00 0.00 H new ATOM 0 HB2 ALA A 386 9.771 -1.848 -2.220 1.00 0.00 H new ATOM 0 HB3 ALA A 386 9.102 -3.451 -1.833 1.00 0.00 H new ATOM 833 N SER A 387 6.754 -4.518 -3.327 1.00 0.00 N ATOM 834 CA SER A 387 6.367 -5.856 -3.789 1.00 0.00 C ATOM 835 C SER A 387 5.024 -5.855 -4.522 1.00 0.00 C ATOM 836 O SER A 387 4.904 -6.419 -5.607 1.00 0.00 O ATOM 837 CB SER A 387 6.331 -6.824 -2.611 1.00 0.00 C ATOM 838 OG SER A 387 7.568 -6.828 -1.927 1.00 0.00 O ATOM 0 H SER A 387 6.427 -4.302 -2.385 1.00 0.00 H new ATOM 0 HA SER A 387 7.119 -6.184 -4.506 1.00 0.00 H new ATOM 0 HB2 SER A 387 5.532 -6.540 -1.926 1.00 0.00 H new ATOM 0 HB3 SER A 387 6.104 -7.829 -2.967 1.00 0.00 H new ATOM 0 HG SER A 387 7.587 -6.092 -1.280 1.00 0.00 H new ATOM 844 N TRP A 388 3.995 -5.226 -3.946 1.00 0.00 N ATOM 845 CA TRP A 388 2.811 -4.823 -4.695 1.00 0.00 C ATOM 846 C TRP A 388 3.274 -4.006 -5.904 1.00 0.00 C ATOM 847 O TRP A 388 2.813 -4.231 -7.014 1.00 0.00 O ATOM 848 CB TRP A 388 1.856 -4.011 -3.803 1.00 0.00 C ATOM 849 CG TRP A 388 0.529 -3.785 -4.448 1.00 0.00 C ATOM 850 CD1 TRP A 388 -0.444 -4.719 -4.521 1.00 0.00 C ATOM 851 CD2 TRP A 388 0.029 -2.628 -5.186 1.00 0.00 C ATOM 852 NE1 TRP A 388 -1.439 -4.289 -5.371 1.00 0.00 N ATOM 853 CE2 TRP A 388 -1.210 -3.009 -5.781 1.00 0.00 C ATOM 854 CE3 TRP A 388 0.484 -1.313 -5.446 1.00 0.00 C ATOM 855 CZ2 TRP A 388 -1.950 -2.172 -6.605 1.00 0.00 C ATOM 856 CZ3 TRP A 388 -0.270 -0.453 -6.272 1.00 0.00 C ATOM 857 CH2 TRP A 388 -1.469 -0.887 -6.832 1.00 0.00 C ATOM 0 H TRP A 388 3.963 -4.985 -2.955 1.00 0.00 H new ATOM 0 HA TRP A 388 2.259 -5.700 -5.034 1.00 0.00 H new ATOM 0 HB2 TRP A 388 1.713 -4.534 -2.858 1.00 0.00 H new ATOM 0 HB3 TRP A 388 2.312 -3.049 -3.569 1.00 0.00 H new ATOM 0 HD1 TRP A 388 -0.442 -5.661 -3.993 1.00 0.00 H new ATOM 0 HE1 TRP A 388 -2.240 -4.853 -5.656 1.00 0.00 H new ATOM 0 HE3 TRP A 388 1.410 -0.967 -5.011 1.00 0.00 H new ATOM 0 HZ2 TRP A 388 -2.872 -2.509 -7.056 1.00 0.00 H new ATOM 0 HZ3 TRP A 388 0.085 0.548 -6.471 1.00 0.00 H new ATOM 0 HH2 TRP A 388 -2.037 -0.212 -7.455 1.00 0.00 H new ATOM 868 N GLY A 389 4.274 -3.137 -5.726 1.00 0.00 N ATOM 869 CA GLY A 389 4.887 -2.364 -6.794 1.00 0.00 C ATOM 870 C GLY A 389 5.713 -3.171 -7.804 1.00 0.00 C ATOM 871 O GLY A 389 6.504 -2.554 -8.522 1.00 0.00 O ATOM 0 H GLY A 389 4.685 -2.952 -4.811 1.00 0.00 H new ATOM 0 HA2 GLY A 389 4.101 -1.836 -7.334 1.00 0.00 H new ATOM 0 HA3 GLY A 389 5.531 -1.607 -6.347 1.00 0.00 H new ATOM 875 N ALA A 390 5.562 -4.498 -7.865 1.00 0.00 N ATOM 876 CA ALA A 390 6.232 -5.379 -8.813 1.00 0.00 C ATOM 877 C ALA A 390 5.248 -6.185 -9.675 1.00 0.00 C ATOM 878 O ALA A 390 5.698 -6.887 -10.579 1.00 0.00 O ATOM 879 CB ALA A 390 7.174 -6.318 -8.049 1.00 0.00 C ATOM 0 H ALA A 390 4.945 -5.002 -7.229 1.00 0.00 H new ATOM 0 HA ALA A 390 6.802 -4.755 -9.502 1.00 0.00 H new ATOM 0 HB1 ALA A 390 7.678 -6.980 -8.753 1.00 0.00 H new ATOM 0 HB2 ALA A 390 7.916 -5.729 -7.510 1.00 0.00 H new ATOM 0 HB3 ALA A 390 6.598 -6.913 -7.340 1.00 0.00 H new ATOM 885 N GLN A 391 3.933 -6.122 -9.424 1.00 0.00 N ATOM 886 CA GLN A 391 2.952 -6.728 -10.325 1.00 0.00 C ATOM 887 C GLN A 391 2.705 -5.734 -11.476 1.00 0.00 C ATOM 888 O GLN A 391 2.561 -4.530 -11.225 1.00 0.00 O ATOM 889 CB GLN A 391 1.682 -7.143 -9.540 1.00 0.00 C ATOM 890 CG GLN A 391 0.783 -5.967 -9.147 1.00 0.00 C ATOM 891 CD GLN A 391 -0.543 -6.384 -8.539 1.00 0.00 C ATOM 892 OE1 GLN A 391 -1.601 -5.891 -8.923 1.00 0.00 O ATOM 893 NE2 GLN A 391 -0.515 -7.282 -7.575 1.00 0.00 N ATOM 0 H GLN A 391 3.529 -5.660 -8.609 1.00 0.00 H new ATOM 0 HA GLN A 391 3.315 -7.657 -10.765 1.00 0.00 H new ATOM 0 HB2 GLN A 391 1.105 -7.842 -10.145 1.00 0.00 H new ATOM 0 HB3 GLN A 391 1.982 -7.675 -8.638 1.00 0.00 H new ATOM 0 HG2 GLN A 391 1.316 -5.337 -8.435 1.00 0.00 H new ATOM 0 HG3 GLN A 391 0.591 -5.358 -10.030 1.00 0.00 H new ATOM 0 HE21 GLN A 391 0.375 -7.678 -7.272 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -1.383 -7.581 -7.131 1.00 0.00 H new ATOM 902 N ASP A 392 2.643 -6.205 -12.726 1.00 0.00 N ATOM 903 CA ASP A 392 2.375 -5.356 -13.897 1.00 0.00 C ATOM 904 C ASP A 392 0.871 -5.089 -14.022 1.00 0.00 C ATOM 905 O ASP A 392 0.169 -5.593 -14.898 1.00 0.00 O ATOM 906 CB ASP A 392 2.980 -5.938 -15.184 1.00 0.00 C ATOM 907 CG ASP A 392 2.889 -4.946 -16.356 1.00 0.00 C ATOM 908 OD1 ASP A 392 2.824 -3.721 -16.091 1.00 0.00 O ATOM 909 OD2 ASP A 392 2.974 -5.417 -17.513 1.00 0.00 O ATOM 0 H ASP A 392 2.777 -7.189 -12.957 1.00 0.00 H new ATOM 0 HA ASP A 392 2.872 -4.398 -13.746 1.00 0.00 H new ATOM 0 HB2 ASP A 392 4.024 -6.200 -15.009 1.00 0.00 H new ATOM 0 HB3 ASP A 392 2.460 -6.859 -15.446 1.00 0.00 H new ATOM 914 N SER A 393 0.364 -4.346 -13.042 1.00 0.00 N ATOM 915 CA SER A 393 -1.029 -3.943 -12.877 1.00 0.00 C ATOM 916 C SER A 393 -1.171 -2.900 -11.761 1.00 0.00 C ATOM 917 O SER A 393 -2.173 -2.187 -11.699 1.00 0.00 O ATOM 918 CB SER A 393 -1.909 -5.178 -12.591 1.00 0.00 C ATOM 919 OG SER A 393 -1.342 -6.079 -11.651 1.00 0.00 O ATOM 0 H SER A 393 0.955 -3.986 -12.293 1.00 0.00 H new ATOM 0 HA SER A 393 -1.368 -3.483 -13.805 1.00 0.00 H new ATOM 0 HB2 SER A 393 -2.879 -4.844 -12.221 1.00 0.00 H new ATOM 0 HB3 SER A 393 -2.090 -5.709 -13.526 1.00 0.00 H new ATOM 0 HG SER A 393 -1.679 -5.872 -10.755 1.00 0.00 H new ATOM 925 N ALA A 394 -0.176 -2.800 -10.874 1.00 0.00 N ATOM 926 CA ALA A 394 -0.208 -2.006 -9.661 1.00 0.00 C ATOM 927 C ALA A 394 0.042 -0.519 -9.937 1.00 0.00 C ATOM 928 O ALA A 394 1.018 0.062 -9.463 1.00 0.00 O ATOM 929 CB ALA A 394 0.812 -2.609 -8.687 1.00 0.00 C ATOM 0 H ALA A 394 0.708 -3.295 -10.995 1.00 0.00 H new ATOM 0 HA ALA A 394 -1.202 -2.040 -9.215 1.00 0.00 H new ATOM 0 HB1 ALA A 394 0.814 -2.034 -7.761 1.00 0.00 H new ATOM 0 HB2 ALA A 394 0.542 -3.643 -8.472 1.00 0.00 H new ATOM 0 HB3 ALA A 394 1.805 -2.579 -9.135 1.00 0.00 H new ATOM 935 N THR A 395 -0.840 0.161 -10.662 1.00 0.00 N ATOM 936 CA THR A 395 -0.661 1.595 -10.853 1.00 0.00 C ATOM 937 C THR A 395 -0.890 2.282 -9.492 1.00 0.00 C ATOM 938 O THR A 395 -1.571 1.716 -8.636 1.00 0.00 O ATOM 939 CB THR A 395 -1.620 2.066 -11.952 1.00 0.00 C ATOM 940 OG1 THR A 395 -2.958 1.737 -11.646 1.00 0.00 O ATOM 941 CG2 THR A 395 -1.281 1.426 -13.306 1.00 0.00 C ATOM 0 H THR A 395 -1.661 -0.242 -11.114 1.00 0.00 H new ATOM 0 HA THR A 395 0.344 1.854 -11.186 1.00 0.00 H new ATOM 0 HB THR A 395 -1.505 3.148 -12.011 1.00 0.00 H new ATOM 0 HG1 THR A 395 -3.561 2.257 -12.216 1.00 0.00 H new ATOM 0 HG21 THR A 395 -1.981 1.782 -14.062 1.00 0.00 H new ATOM 0 HG22 THR A 395 -0.266 1.699 -13.594 1.00 0.00 H new ATOM 0 HG23 THR A 395 -1.356 0.342 -13.225 1.00 0.00 H new ATOM 949 N LEU A 396 -0.398 3.504 -9.233 1.00 0.00 N ATOM 950 CA LEU A 396 -0.769 4.128 -7.952 1.00 0.00 C ATOM 951 C LEU A 396 -2.287 4.351 -7.920 1.00 0.00 C ATOM 952 O LEU A 396 -2.898 4.235 -6.863 1.00 0.00 O ATOM 953 CB LEU A 396 0.031 5.396 -7.604 1.00 0.00 C ATOM 954 CG LEU A 396 -0.461 6.066 -6.291 1.00 0.00 C ATOM 955 CD1 LEU A 396 -0.456 5.164 -5.041 1.00 0.00 C ATOM 956 CD2 LEU A 396 0.385 7.304 -5.975 1.00 0.00 C ATOM 0 H LEU A 396 0.213 4.048 -9.842 1.00 0.00 H new ATOM 0 HA LEU A 396 -0.492 3.434 -7.159 1.00 0.00 H new ATOM 0 HB2 LEU A 396 1.086 5.141 -7.505 1.00 0.00 H new ATOM 0 HB3 LEU A 396 -0.049 6.109 -8.424 1.00 0.00 H new ATOM 0 HG LEU A 396 -1.502 6.315 -6.497 1.00 0.00 H new ATOM 0 HD11 LEU A 396 -0.817 5.730 -4.182 1.00 0.00 H new ATOM 0 HD12 LEU A 396 -1.106 4.306 -5.209 1.00 0.00 H new ATOM 0 HD13 LEU A 396 0.559 4.818 -4.846 1.00 0.00 H new ATOM 0 HD21 LEU A 396 0.028 7.763 -5.053 1.00 0.00 H new ATOM 0 HD22 LEU A 396 1.428 7.011 -5.855 1.00 0.00 H new ATOM 0 HD23 LEU A 396 0.301 8.020 -6.792 1.00 0.00 H new ATOM 968 N ASP A 397 -2.912 4.517 -9.086 1.00 0.00 N ATOM 969 CA ASP A 397 -4.356 4.638 -9.247 1.00 0.00 C ATOM 970 C ASP A 397 -5.098 3.328 -8.929 1.00 0.00 C ATOM 971 O ASP A 397 -6.285 3.390 -8.612 1.00 0.00 O ATOM 972 CB ASP A 397 -4.730 5.202 -10.635 1.00 0.00 C ATOM 973 CG ASP A 397 -3.823 4.755 -11.780 1.00 0.00 C ATOM 974 OD1 ASP A 397 -2.688 5.273 -11.886 1.00 0.00 O ATOM 975 OD2 ASP A 397 -4.190 3.892 -12.606 1.00 0.00 O ATOM 0 H ASP A 397 -2.408 4.572 -9.971 1.00 0.00 H new ATOM 0 HA ASP A 397 -4.695 5.362 -8.506 1.00 0.00 H new ATOM 0 HB2 ASP A 397 -5.754 4.907 -10.866 1.00 0.00 H new ATOM 0 HB3 ASP A 397 -4.715 6.291 -10.584 1.00 0.00 H new ATOM 980 N ALA A 398 -4.420 2.177 -8.847 1.00 0.00 N ATOM 981 CA ALA A 398 -4.997 0.928 -8.344 1.00 0.00 C ATOM 982 C ALA A 398 -5.036 0.953 -6.812 1.00 0.00 C ATOM 983 O ALA A 398 -6.092 0.711 -6.224 1.00 0.00 O ATOM 984 CB ALA A 398 -4.194 -0.300 -8.820 1.00 0.00 C ATOM 0 H ALA A 398 -3.445 2.087 -9.132 1.00 0.00 H new ATOM 0 HA ALA A 398 -6.009 0.845 -8.740 1.00 0.00 H new ATOM 0 HB1 ALA A 398 -4.651 -1.208 -8.427 1.00 0.00 H new ATOM 0 HB2 ALA A 398 -4.195 -0.335 -9.909 1.00 0.00 H new ATOM 0 HB3 ALA A 398 -3.168 -0.226 -8.460 1.00 0.00 H new ATOM 990 N LEU A 399 -3.906 1.246 -6.155 1.00 0.00 N ATOM 991 CA LEU A 399 -3.840 1.316 -4.691 1.00 0.00 C ATOM 992 C LEU A 399 -4.783 2.394 -4.173 1.00 0.00 C ATOM 993 O LEU A 399 -5.480 2.192 -3.184 1.00 0.00 O ATOM 994 CB LEU A 399 -2.391 1.532 -4.223 1.00 0.00 C ATOM 995 CG LEU A 399 -2.270 1.740 -2.698 1.00 0.00 C ATOM 996 CD1 LEU A 399 -1.038 1.016 -2.142 1.00 0.00 C ATOM 997 CD2 LEU A 399 -2.172 3.221 -2.306 1.00 0.00 C ATOM 0 H LEU A 399 -3.019 1.440 -6.620 1.00 0.00 H new ATOM 0 HA LEU A 399 -4.170 0.366 -4.271 1.00 0.00 H new ATOM 0 HB2 LEU A 399 -1.789 0.671 -4.515 1.00 0.00 H new ATOM 0 HB3 LEU A 399 -1.976 2.400 -4.736 1.00 0.00 H new ATOM 0 HG LEU A 399 -3.183 1.326 -2.270 1.00 0.00 H new ATOM 0 HD11 LEU A 399 -0.975 1.178 -1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 399 -1.122 -0.052 -2.344 1.00 0.00 H new ATOM 0 HD13 LEU A 399 -0.140 1.406 -2.621 1.00 0.00 H new ATOM 0 HD21 LEU A 399 -2.089 3.306 -1.222 1.00 0.00 H new ATOM 0 HD22 LEU A 399 -1.292 3.664 -2.773 1.00 0.00 H new ATOM 0 HD23 LEU A 399 -3.065 3.747 -2.644 1.00 0.00 H new ATOM 1009 N LEU A 400 -4.829 3.524 -4.868 1.00 0.00 N ATOM 1010 CA LEU A 400 -5.705 4.645 -4.610 1.00 0.00 C ATOM 1011 C LEU A 400 -7.174 4.222 -4.702 1.00 0.00 C ATOM 1012 O LEU A 400 -7.989 4.607 -3.863 1.00 0.00 O ATOM 1013 CB LEU A 400 -5.347 5.684 -5.685 1.00 0.00 C ATOM 1014 CG LEU A 400 -6.323 6.837 -5.955 1.00 0.00 C ATOM 1015 CD1 LEU A 400 -5.535 8.033 -6.515 1.00 0.00 C ATOM 1016 CD2 LEU A 400 -7.442 6.529 -6.964 1.00 0.00 C ATOM 0 H LEU A 400 -4.220 3.685 -5.670 1.00 0.00 H new ATOM 0 HA LEU A 400 -5.576 5.047 -3.605 1.00 0.00 H new ATOM 0 HB2 LEU A 400 -4.386 6.122 -5.413 1.00 0.00 H new ATOM 0 HB3 LEU A 400 -5.200 5.150 -6.624 1.00 0.00 H new ATOM 0 HG LEU A 400 -6.801 7.035 -4.996 1.00 0.00 H new ATOM 0 HD11 LEU A 400 -6.218 8.859 -6.711 1.00 0.00 H new ATOM 0 HD12 LEU A 400 -4.785 8.347 -5.789 1.00 0.00 H new ATOM 0 HD13 LEU A 400 -5.042 7.742 -7.443 1.00 0.00 H new ATOM 0 HD21 LEU A 400 -8.076 7.408 -7.084 1.00 0.00 H new ATOM 0 HD22 LEU A 400 -7.002 6.265 -7.926 1.00 0.00 H new ATOM 0 HD23 LEU A 400 -8.042 5.696 -6.599 1.00 0.00 H new ATOM 1028 N ALA A 401 -7.534 3.449 -5.733 1.00 0.00 N ATOM 1029 CA ALA A 401 -8.902 2.991 -5.913 1.00 0.00 C ATOM 1030 C ALA A 401 -9.293 2.076 -4.763 1.00 0.00 C ATOM 1031 O ALA A 401 -10.347 2.275 -4.157 1.00 0.00 O ATOM 1032 CB ALA A 401 -9.044 2.261 -7.246 1.00 0.00 C ATOM 0 H ALA A 401 -6.888 3.130 -6.455 1.00 0.00 H new ATOM 0 HA ALA A 401 -9.568 3.854 -5.921 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -10.073 1.923 -7.368 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -8.785 2.937 -8.061 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -8.375 1.400 -7.263 1.00 0.00 H new ATOM 1038 N ALA A 402 -8.448 1.081 -4.475 1.00 0.00 N ATOM 1039 CA ALA A 402 -8.639 0.156 -3.374 1.00 0.00 C ATOM 1040 C ALA A 402 -8.795 0.930 -2.065 1.00 0.00 C ATOM 1041 O ALA A 402 -9.768 0.704 -1.358 1.00 0.00 O ATOM 1042 CB ALA A 402 -7.498 -0.859 -3.347 1.00 0.00 C ATOM 0 H ALA A 402 -7.601 0.900 -5.014 1.00 0.00 H new ATOM 0 HA ALA A 402 -9.559 -0.412 -3.510 1.00 0.00 H new ATOM 0 HB1 ALA A 402 -7.646 -1.551 -2.518 1.00 0.00 H new ATOM 0 HB2 ALA A 402 -7.482 -1.414 -4.285 1.00 0.00 H new ATOM 0 HB3 ALA A 402 -6.550 -0.337 -3.218 1.00 0.00 H new ATOM 1048 N LEU A 403 -7.924 1.902 -1.777 1.00 0.00 N ATOM 1049 CA LEU A 403 -8.046 2.762 -0.605 1.00 0.00 C ATOM 1050 C LEU A 403 -9.418 3.395 -0.463 1.00 0.00 C ATOM 1051 O LEU A 403 -10.029 3.359 0.609 1.00 0.00 O ATOM 1052 CB LEU A 403 -7.030 3.909 -0.705 1.00 0.00 C ATOM 1053 CG LEU A 403 -5.734 3.722 0.065 1.00 0.00 C ATOM 1054 CD1 LEU A 403 -4.810 4.887 -0.314 1.00 0.00 C ATOM 1055 CD2 LEU A 403 -6.059 3.727 1.561 1.00 0.00 C ATOM 0 H LEU A 403 -7.111 2.112 -2.356 1.00 0.00 H new ATOM 0 HA LEU A 403 -7.869 2.121 0.259 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -6.786 4.060 -1.756 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -7.509 4.823 -0.354 1.00 0.00 H new ATOM 0 HG LEU A 403 -5.241 2.779 -0.173 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -3.865 4.790 0.220 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -4.624 4.869 -1.388 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -5.284 5.830 -0.043 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -5.141 3.594 2.133 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -6.520 4.678 1.830 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -6.748 2.913 1.786 1.00 0.00 H new ATOM 1067 N ARG A 404 -9.895 4.022 -1.536 1.00 0.00 N ATOM 1068 CA ARG A 404 -11.113 4.807 -1.463 1.00 0.00 C ATOM 1069 C ARG A 404 -12.285 3.852 -1.177 1.00 0.00 C ATOM 1070 O ARG A 404 -13.249 4.291 -0.551 1.00 0.00 O ATOM 1071 CB ARG A 404 -11.209 5.723 -2.696 1.00 0.00 C ATOM 1072 CG ARG A 404 -12.372 6.732 -2.661 1.00 0.00 C ATOM 1073 CD ARG A 404 -12.142 7.879 -3.676 1.00 0.00 C ATOM 1074 NE ARG A 404 -12.275 9.242 -3.100 1.00 0.00 N ATOM 1075 CZ ARG A 404 -11.281 10.071 -2.717 1.00 0.00 C ATOM 1076 NH1 ARG A 404 -10.030 9.648 -2.657 1.00 0.00 N ATOM 1077 NH2 ARG A 404 -11.531 11.330 -2.375 1.00 0.00 N ATOM 0 H ARG A 404 -9.457 3.999 -2.457 1.00 0.00 H new ATOM 0 HA ARG A 404 -11.132 5.513 -0.633 1.00 0.00 H new ATOM 0 HB2 ARG A 404 -10.273 6.272 -2.797 1.00 0.00 H new ATOM 0 HB3 ARG A 404 -11.312 5.102 -3.586 1.00 0.00 H new ATOM 0 HG2 ARG A 404 -13.308 6.222 -2.889 1.00 0.00 H new ATOM 0 HG3 ARG A 404 -12.470 7.144 -1.657 1.00 0.00 H new ATOM 0 HD2 ARG A 404 -11.145 7.774 -4.105 1.00 0.00 H new ATOM 0 HD3 ARG A 404 -12.854 7.772 -4.494 1.00 0.00 H new ATOM 0 HE ARG A 404 -13.226 9.591 -2.980 1.00 0.00 H new ATOM 0 HH11 ARG A 404 -9.805 8.684 -2.902 1.00 0.00 H new ATOM 0 HH12 ARG A 404 -9.289 10.286 -2.366 1.00 0.00 H new ATOM 0 HH21 ARG A 404 -12.487 11.685 -2.399 1.00 0.00 H new ATOM 0 HH22 ARG A 404 -10.767 11.942 -2.088 1.00 0.00 H new ATOM 1091 N ARG A 405 -12.225 2.568 -1.583 1.00 0.00 N ATOM 1092 CA ARG A 405 -13.221 1.562 -1.219 1.00 0.00 C ATOM 1093 C ARG A 405 -13.399 1.463 0.295 1.00 0.00 C ATOM 1094 O ARG A 405 -14.550 1.508 0.733 1.00 0.00 O ATOM 1095 CB ARG A 405 -12.874 0.168 -1.762 1.00 0.00 C ATOM 1096 CG ARG A 405 -12.729 0.096 -3.287 1.00 0.00 C ATOM 1097 CD ARG A 405 -13.132 -1.261 -3.880 1.00 0.00 C ATOM 1098 NE ARG A 405 -12.327 -2.383 -3.370 1.00 0.00 N ATOM 1099 CZ ARG A 405 -11.315 -3.020 -3.968 1.00 0.00 C ATOM 1100 NH1 ARG A 405 -10.713 -2.503 -5.039 1.00 0.00 N ATOM 1101 NH2 ARG A 405 -10.904 -4.184 -3.500 1.00 0.00 N ATOM 0 H ARG A 405 -11.477 2.206 -2.175 1.00 0.00 H new ATOM 0 HA ARG A 405 -14.152 1.897 -1.676 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -11.942 -0.164 -1.305 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -13.649 -0.532 -1.450 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -13.341 0.877 -3.739 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -11.694 0.307 -3.555 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -14.183 -1.448 -3.660 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -13.036 -1.218 -4.965 1.00 0.00 H new ATOM 0 HE ARG A 405 -12.573 -2.718 -2.439 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -11.023 -1.607 -5.415 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -9.942 -3.003 -5.482 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -11.358 -4.595 -2.684 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -10.132 -4.672 -3.954 1.00 0.00 H new ATOM 1115 N ILE A 406 -12.338 1.463 1.122 1.00 0.00 N ATOM 1116 CA ILE A 406 -12.527 1.357 2.577 1.00 0.00 C ATOM 1117 C ILE A 406 -12.714 2.751 3.188 1.00 0.00 C ATOM 1118 O ILE A 406 -12.434 2.983 4.365 1.00 0.00 O ATOM 1119 CB ILE A 406 -11.392 0.554 3.255 1.00 0.00 C ATOM 1120 CG1 ILE A 406 -9.960 1.101 3.055 1.00 0.00 C ATOM 1121 CG2 ILE A 406 -11.516 -0.920 2.870 1.00 0.00 C ATOM 1122 CD1 ILE A 406 -9.070 0.376 2.035 1.00 0.00 C ATOM 0 H ILE A 406 -11.367 1.533 0.818 1.00 0.00 H new ATOM 0 HA ILE A 406 -13.438 0.789 2.764 1.00 0.00 H new ATOM 0 HB ILE A 406 -11.538 0.674 4.329 1.00 0.00 H new ATOM 0 HG12 ILE A 406 -10.036 2.146 2.755 1.00 0.00 H new ATOM 0 HG13 ILE A 406 -9.453 1.082 4.020 1.00 0.00 H new ATOM 0 HG21 ILE A 406 -10.717 -1.489 3.346 1.00 0.00 H new ATOM 0 HG22 ILE A 406 -12.481 -1.303 3.201 1.00 0.00 H new ATOM 0 HG23 ILE A 406 -11.438 -1.021 1.788 1.00 0.00 H new ATOM 0 HD11 ILE A 406 -8.095 0.861 1.993 1.00 0.00 H new ATOM 0 HD12 ILE A 406 -8.945 -0.664 2.335 1.00 0.00 H new ATOM 0 HD13 ILE A 406 -9.537 0.416 1.051 1.00 0.00 H new ATOM 1134 N GLN A 407 -13.191 3.694 2.367 1.00 0.00 N ATOM 1135 CA GLN A 407 -13.432 5.092 2.667 1.00 0.00 C ATOM 1136 C GLN A 407 -12.176 5.768 3.224 1.00 0.00 C ATOM 1137 O GLN A 407 -12.262 6.864 3.778 1.00 0.00 O ATOM 1138 CB GLN A 407 -14.678 5.227 3.563 1.00 0.00 C ATOM 1139 CG GLN A 407 -15.977 4.857 2.818 1.00 0.00 C ATOM 1140 CD GLN A 407 -16.606 3.577 3.368 1.00 0.00 C ATOM 1141 OE1 GLN A 407 -17.358 3.621 4.332 1.00 0.00 O ATOM 1142 NE2 GLN A 407 -16.336 2.415 2.792 1.00 0.00 N ATOM 0 H GLN A 407 -13.435 3.471 1.402 1.00 0.00 H new ATOM 0 HA GLN A 407 -13.653 5.634 1.747 1.00 0.00 H new ATOM 0 HB2 GLN A 407 -14.567 4.584 4.436 1.00 0.00 H new ATOM 0 HB3 GLN A 407 -14.751 6.251 3.929 1.00 0.00 H new ATOM 0 HG2 GLN A 407 -16.690 5.677 2.903 1.00 0.00 H new ATOM 0 HG3 GLN A 407 -15.763 4.729 1.757 1.00 0.00 H new ATOM 0 HE21 GLN A 407 -15.709 2.378 1.988 1.00 0.00 H new ATOM 0 HE22 GLN A 407 -16.755 1.558 3.152 1.00 0.00 H new ATOM 1151 N ARG A 408 -10.991 5.178 3.010 1.00 0.00 N ATOM 1152 CA ARG A 408 -9.719 5.847 3.273 1.00 0.00 C ATOM 1153 C ARG A 408 -9.371 6.727 2.083 1.00 0.00 C ATOM 1154 O ARG A 408 -8.359 6.558 1.408 1.00 0.00 O ATOM 1155 CB ARG A 408 -8.631 4.841 3.657 1.00 0.00 C ATOM 1156 CG ARG A 408 -8.901 4.131 4.993 1.00 0.00 C ATOM 1157 CD ARG A 408 -8.521 4.940 6.250 1.00 0.00 C ATOM 1158 NE ARG A 408 -9.254 6.204 6.422 1.00 0.00 N ATOM 1159 CZ ARG A 408 -10.545 6.396 6.705 1.00 0.00 C ATOM 1160 NH1 ARG A 408 -11.401 5.374 6.765 1.00 0.00 N ATOM 1161 NH2 ARG A 408 -10.970 7.632 6.917 1.00 0.00 N ATOM 0 H ARG A 408 -10.893 4.228 2.651 1.00 0.00 H new ATOM 0 HA ARG A 408 -9.803 6.501 4.141 1.00 0.00 H new ATOM 0 HB2 ARG A 408 -8.543 4.094 2.868 1.00 0.00 H new ATOM 0 HB3 ARG A 408 -7.673 5.358 3.716 1.00 0.00 H new ATOM 0 HG2 ARG A 408 -9.961 3.881 5.047 1.00 0.00 H new ATOM 0 HG3 ARG A 408 -8.351 3.190 5.005 1.00 0.00 H new ATOM 0 HD2 ARG A 408 -8.689 4.318 7.129 1.00 0.00 H new ATOM 0 HD3 ARG A 408 -7.454 5.159 6.214 1.00 0.00 H new ATOM 0 HE ARG A 408 -8.699 7.052 6.309 1.00 0.00 H new ATOM 0 HH11 ARG A 408 -11.073 4.424 6.593 1.00 0.00 H new ATOM 0 HH12 ARG A 408 -12.383 5.543 6.983 1.00 0.00 H new ATOM 0 HH21 ARG A 408 -10.316 8.413 6.863 1.00 0.00 H new ATOM 0 HH22 ARG A 408 -11.952 7.803 7.135 1.00 0.00 H new ATOM 1175 N ALA A 409 -10.292 7.641 1.797 1.00 0.00 N ATOM 1176 CA ALA A 409 -10.149 8.668 0.791 1.00 0.00 C ATOM 1177 C ALA A 409 -9.164 9.745 1.247 1.00 0.00 C ATOM 1178 O ALA A 409 -8.562 10.396 0.409 1.00 0.00 O ATOM 1179 CB ALA A 409 -11.535 9.281 0.603 1.00 0.00 C ATOM 0 H ALA A 409 -11.189 7.682 2.281 1.00 0.00 H new ATOM 0 HA ALA A 409 -9.763 8.247 -0.137 1.00 0.00 H new ATOM 0 HB1 ALA A 409 -11.486 10.067 -0.150 1.00 0.00 H new ATOM 0 HB2 ALA A 409 -12.233 8.510 0.277 1.00 0.00 H new ATOM 0 HB3 ALA A 409 -11.877 9.704 1.548 1.00 0.00 H new ATOM 1185 N ASP A 410 -8.941 9.860 2.553 1.00 0.00 N ATOM 1186 CA ASP A 410 -7.915 10.688 3.169 1.00 0.00 C ATOM 1187 C ASP A 410 -6.544 10.279 2.639 1.00 0.00 C ATOM 1188 O ASP A 410 -5.850 11.099 2.043 1.00 0.00 O ATOM 1189 CB ASP A 410 -8.004 10.626 4.713 1.00 0.00 C ATOM 1190 CG ASP A 410 -8.288 9.245 5.331 1.00 0.00 C ATOM 1191 OD1 ASP A 410 -8.154 8.202 4.653 1.00 0.00 O ATOM 1192 OD2 ASP A 410 -8.796 9.184 6.471 1.00 0.00 O ATOM 0 H ASP A 410 -9.498 9.354 3.241 1.00 0.00 H new ATOM 0 HA ASP A 410 -8.077 11.732 2.899 1.00 0.00 H new ATOM 0 HB2 ASP A 410 -7.065 10.997 5.124 1.00 0.00 H new ATOM 0 HB3 ASP A 410 -8.787 11.312 5.037 1.00 0.00 H new ATOM 1197 N ILE A 411 -6.156 9.009 2.788 1.00 0.00 N ATOM 1198 CA ILE A 411 -4.812 8.588 2.409 1.00 0.00 C ATOM 1199 C ILE A 411 -4.586 8.791 0.901 1.00 0.00 C ATOM 1200 O ILE A 411 -3.453 9.005 0.496 1.00 0.00 O ATOM 1201 CB ILE A 411 -4.502 7.132 2.851 1.00 0.00 C ATOM 1202 CG1 ILE A 411 -4.863 6.852 4.336 1.00 0.00 C ATOM 1203 CG2 ILE A 411 -3.016 6.818 2.576 1.00 0.00 C ATOM 1204 CD1 ILE A 411 -4.787 5.379 4.778 1.00 0.00 C ATOM 0 H ILE A 411 -6.747 8.267 3.163 1.00 0.00 H new ATOM 0 HA ILE A 411 -4.106 9.223 2.944 1.00 0.00 H new ATOM 0 HB ILE A 411 -5.136 6.470 2.262 1.00 0.00 H new ATOM 0 HG12 ILE A 411 -4.195 7.436 4.969 1.00 0.00 H new ATOM 0 HG13 ILE A 411 -5.874 7.215 4.519 1.00 0.00 H new ATOM 0 HG21 ILE A 411 -2.797 5.796 2.886 1.00 0.00 H new ATOM 0 HG22 ILE A 411 -2.812 6.926 1.511 1.00 0.00 H new ATOM 0 HG23 ILE A 411 -2.388 7.510 3.137 1.00 0.00 H new ATOM 0 HD11 ILE A 411 -5.059 5.301 5.831 1.00 0.00 H new ATOM 0 HD12 ILE A 411 -5.477 4.784 4.180 1.00 0.00 H new ATOM 0 HD13 ILE A 411 -3.772 5.009 4.637 1.00 0.00 H new ATOM 1216 N VAL A 412 -5.610 8.700 0.050 1.00 0.00 N ATOM 1217 CA VAL A 412 -5.479 8.876 -1.397 1.00 0.00 C ATOM 1218 C VAL A 412 -4.981 10.268 -1.787 1.00 0.00 C ATOM 1219 O VAL A 412 -4.037 10.407 -2.560 1.00 0.00 O ATOM 1220 CB VAL A 412 -6.853 8.615 -2.051 1.00 0.00 C ATOM 1221 CG1 VAL A 412 -6.968 9.145 -3.485 1.00 0.00 C ATOM 1222 CG2 VAL A 412 -7.191 7.130 -1.993 1.00 0.00 C ATOM 0 H VAL A 412 -6.564 8.500 0.350 1.00 0.00 H new ATOM 0 HA VAL A 412 -4.732 8.166 -1.751 1.00 0.00 H new ATOM 0 HB VAL A 412 -7.582 9.180 -1.469 1.00 0.00 H new ATOM 0 HG11 VAL A 412 -7.961 8.924 -3.876 1.00 0.00 H new ATOM 0 HG12 VAL A 412 -6.809 10.223 -3.488 1.00 0.00 H new ATOM 0 HG13 VAL A 412 -6.216 8.665 -4.112 1.00 0.00 H new ATOM 0 HG21 VAL A 412 -8.162 6.960 -2.457 1.00 0.00 H new ATOM 0 HG22 VAL A 412 -6.429 6.562 -2.527 1.00 0.00 H new ATOM 0 HG23 VAL A 412 -7.224 6.805 -0.953 1.00 0.00 H new ATOM 1232 N GLU A 413 -5.688 11.309 -1.380 1.00 0.00 N ATOM 1233 CA GLU A 413 -5.233 12.668 -1.582 1.00 0.00 C ATOM 1234 C GLU A 413 -3.897 12.999 -0.892 1.00 0.00 C ATOM 1235 O GLU A 413 -3.044 13.673 -1.474 1.00 0.00 O ATOM 1236 CB GLU A 413 -6.349 13.632 -1.956 1.00 0.00 C ATOM 1237 CG GLU A 413 -7.499 13.725 -0.964 1.00 0.00 C ATOM 1238 CD GLU A 413 -8.727 12.897 -1.442 1.00 0.00 C ATOM 1239 OE1 GLU A 413 -8.571 11.862 -2.136 1.00 0.00 O ATOM 1240 OE2 GLU A 413 -9.900 13.269 -1.199 1.00 0.00 O ATOM 0 H GLU A 413 -6.587 11.234 -0.904 1.00 0.00 H new ATOM 0 HA GLU A 413 -4.738 12.916 -2.521 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -5.919 14.626 -2.081 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -6.752 13.335 -2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -7.171 13.364 0.011 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -7.788 14.768 -0.836 1.00 0.00 H new ATOM 1247 N SER A 414 -3.609 12.317 0.216 1.00 0.00 N ATOM 1248 CA SER A 414 -2.325 12.382 0.907 1.00 0.00 C ATOM 1249 C SER A 414 -1.195 11.631 0.184 1.00 0.00 C ATOM 1250 O SER A 414 -0.031 12.039 0.240 1.00 0.00 O ATOM 1251 CB SER A 414 -2.555 11.808 2.292 1.00 0.00 C ATOM 1252 OG SER A 414 -1.639 12.337 3.220 1.00 0.00 O ATOM 0 H SER A 414 -4.277 11.691 0.666 1.00 0.00 H new ATOM 0 HA SER A 414 -1.988 13.418 0.942 1.00 0.00 H new ATOM 0 HB2 SER A 414 -3.572 12.028 2.615 1.00 0.00 H new ATOM 0 HB3 SER A 414 -2.458 10.723 2.260 1.00 0.00 H new ATOM 0 HG SER A 414 -2.097 12.514 4.068 1.00 0.00 H new ATOM 1258 N LEU A 415 -1.514 10.570 -0.573 1.00 0.00 N ATOM 1259 CA LEU A 415 -0.582 9.925 -1.505 1.00 0.00 C ATOM 1260 C LEU A 415 -0.025 10.992 -2.430 1.00 0.00 C ATOM 1261 O LEU A 415 1.198 11.082 -2.576 1.00 0.00 O ATOM 1262 CB LEU A 415 -1.251 8.865 -2.392 1.00 0.00 C ATOM 1263 CG LEU A 415 -1.103 7.388 -2.092 1.00 0.00 C ATOM 1264 CD1 LEU A 415 0.315 6.903 -2.357 1.00 0.00 C ATOM 1265 CD2 LEU A 415 -1.584 6.859 -0.758 1.00 0.00 C ATOM 0 H LEU A 415 -2.435 10.133 -0.554 1.00 0.00 H new ATOM 0 HA LEU A 415 0.184 9.433 -0.905 1.00 0.00 H new ATOM 0 HB2 LEU A 415 -2.319 9.083 -2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 415 -0.886 9.022 -3.407 1.00 0.00 H new ATOM 0 HG LEU A 415 -1.818 6.963 -2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 415 0.384 5.839 -2.131 1.00 0.00 H new ATOM 0 HD12 LEU A 415 0.566 7.068 -3.405 1.00 0.00 H new ATOM 0 HD13 LEU A 415 1.012 7.454 -1.726 1.00 0.00 H new ATOM 0 HD21 LEU A 415 -1.404 5.785 -0.706 1.00 0.00 H new ATOM 0 HD22 LEU A 415 -1.044 7.357 0.047 1.00 0.00 H new ATOM 0 HD23 LEU A 415 -2.651 7.053 -0.653 1.00 0.00 H new