USER MOD reduce.3.24.130724 H: found=0, std=0, add=592, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 591 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 393 SER OG : rot -97:sc= 0.156 USER MOD Set 1.2: A 398 TYR OH : rot 154:sc= 0.195 USER MOD Set 1.3: A 410 TYR OH : rot 165:sc= 0 USER MOD Single : A 374 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 375 HIS : no HD1:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 379 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 381 GLN : amide:sc= 0.84 K(o=0.84,f=0) USER MOD Single : A 389 LYS NZ :NH3+ -146:sc= -0.245 (180deg=-1.33) USER MOD Single : A 390 ASN : amide:sc= -0.0781 K(o=-0.078,f=-5.7!) USER MOD Single : A 397 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 ASN : amide:sc= 0.765 K(o=0.76,f=0) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 405 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 HIS : no HE2:sc= -0.261 X(o=-0.26,f=-0.42) USER MOD Single : A 411 LYS NZ :NH3+ -126:sc= -0.615 (180deg=-0.791) USER MOD Single : A 413 ASN : amide:sc= 1.24 K(o=1.2,f=-8.5!) USER MOD Single : A 414 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 416 THR OG1 : rot 180:sc= 0.266 USER MOD Single : A 417 SER OG : rot 180:sc= 0.00538 USER MOD Single : A 419 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 421 LYS NZ :NH3+ 173:sc=-0.00987 (180deg=-0.107) USER MOD Single : A 426 THR OG1 : rot 80:sc= 0.918 USER MOD Single : A 427 MET CE :methyl 169:sc=-0.00417 (180deg=-0.166) USER MOD Single : A 428 LYS NZ :NH3+ -164:sc= 0.95 (180deg=0.0713!) USER MOD Single : A 429 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00928) USER MOD Single : A 431 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0324) USER MOD Single : A 434 SER OG : rot 95:sc= 0.683 USER MOD Single : A 435 SER OG : rot -170:sc= -0.168 USER MOD Single : A 437 SER OG : rot 180:sc= 0.0554 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 373 -41.666 -1.765 0.654 1.00 0.00 N ATOM 2 CA GLU A 373 -42.822 -2.042 1.524 1.00 0.00 C ATOM 3 C GLU A 373 -43.697 -3.101 0.850 1.00 0.00 C ATOM 4 O GLU A 373 -43.214 -4.213 0.662 1.00 0.00 O ATOM 5 CB GLU A 373 -43.557 -0.747 1.896 1.00 0.00 C ATOM 6 CG GLU A 373 -43.820 0.155 0.678 1.00 0.00 C ATOM 7 CD GLU A 373 -45.046 1.028 0.907 1.00 0.00 C ATOM 8 OE1 GLU A 373 -46.115 0.420 1.129 1.00 0.00 O ATOM 9 OE2 GLU A 373 -44.896 2.264 0.854 1.00 0.00 O ATOM 0 HA GLU A 373 -42.500 -2.454 2.480 1.00 0.00 H new ATOM 0 HB2 GLU A 373 -44.506 -0.996 2.371 1.00 0.00 H new ATOM 0 HB3 GLU A 373 -42.968 -0.197 2.630 1.00 0.00 H new ATOM 0 HG2 GLU A 373 -42.950 0.784 0.491 1.00 0.00 H new ATOM 0 HG3 GLU A 373 -43.966 -0.459 -0.210 1.00 0.00 H new ATOM 16 N LYS A 374 -44.940 -2.773 0.464 1.00 0.00 N ATOM 17 CA LYS A 374 -45.827 -3.704 -0.229 1.00 0.00 C ATOM 18 C LYS A 374 -45.120 -4.236 -1.477 1.00 0.00 C ATOM 19 O LYS A 374 -45.105 -5.441 -1.717 1.00 0.00 O ATOM 20 CB LYS A 374 -47.142 -3.009 -0.605 1.00 0.00 C ATOM 21 CG LYS A 374 -47.960 -2.651 0.643 1.00 0.00 C ATOM 22 CD LYS A 374 -49.303 -1.992 0.300 1.00 0.00 C ATOM 23 CE LYS A 374 -49.108 -0.648 -0.416 1.00 0.00 C ATOM 24 NZ LYS A 374 -50.327 0.179 -0.363 1.00 0.00 N ATOM 0 H LYS A 374 -45.353 -1.854 0.626 1.00 0.00 H new ATOM 0 HA LYS A 374 -46.066 -4.539 0.430 1.00 0.00 H new ATOM 0 HB2 LYS A 374 -46.928 -2.104 -1.174 1.00 0.00 H new ATOM 0 HB3 LYS A 374 -47.728 -3.661 -1.252 1.00 0.00 H new ATOM 0 HG2 LYS A 374 -48.141 -3.554 1.225 1.00 0.00 H new ATOM 0 HG3 LYS A 374 -47.379 -1.977 1.273 1.00 0.00 H new ATOM 0 HD2 LYS A 374 -49.886 -2.661 -0.333 1.00 0.00 H new ATOM 0 HD3 LYS A 374 -49.877 -1.838 1.214 1.00 0.00 H new ATOM 0 HE2 LYS A 374 -48.281 -0.107 0.044 1.00 0.00 H new ATOM 0 HE3 LYS A 374 -48.834 -0.826 -1.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 374 -50.158 1.079 -0.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 374 -51.110 -0.327 -0.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 374 -50.574 0.370 0.629 1.00 0.00 H new ATOM 38 N HIS A 375 -44.512 -3.324 -2.247 1.00 0.00 N ATOM 39 CA HIS A 375 -43.744 -3.635 -3.441 1.00 0.00 C ATOM 40 C HIS A 375 -42.263 -3.416 -3.121 1.00 0.00 C ATOM 41 O HIS A 375 -41.915 -2.533 -2.331 1.00 0.00 O ATOM 42 CB HIS A 375 -44.200 -2.750 -4.607 1.00 0.00 C ATOM 43 CG HIS A 375 -43.587 -3.151 -5.927 1.00 0.00 C ATOM 44 ND1 HIS A 375 -42.324 -2.738 -6.325 1.00 0.00 N ATOM 45 CD2 HIS A 375 -44.050 -3.932 -6.960 1.00 0.00 C ATOM 46 CE1 HIS A 375 -42.088 -3.270 -7.535 1.00 0.00 C ATOM 47 NE2 HIS A 375 -43.105 -4.011 -7.979 1.00 0.00 N ATOM 0 H HIS A 375 -44.547 -2.325 -2.044 1.00 0.00 H new ATOM 0 HA HIS A 375 -43.901 -4.671 -3.741 1.00 0.00 H new ATOM 0 HB2 HIS A 375 -45.286 -2.796 -4.688 1.00 0.00 H new ATOM 0 HB3 HIS A 375 -43.940 -1.713 -4.392 1.00 0.00 H new ATOM 0 HD2 HIS A 375 -45.015 -4.417 -6.978 1.00 0.00 H new ATOM 0 HE1 HIS A 375 -41.174 -3.115 -8.089 1.00 0.00 H new ATOM 0 HE2 HIS A 375 -43.174 -4.518 -8.861 1.00 0.00 H new ATOM 55 N ARG A 376 -41.390 -4.215 -3.742 1.00 0.00 N ATOM 56 CA ARG A 376 -39.944 -4.137 -3.570 1.00 0.00 C ATOM 57 C ARG A 376 -39.398 -3.012 -4.460 1.00 0.00 C ATOM 58 O ARG A 376 -38.598 -3.249 -5.361 1.00 0.00 O ATOM 59 CB ARG A 376 -39.337 -5.518 -3.877 1.00 0.00 C ATOM 60 CG ARG A 376 -37.843 -5.616 -3.531 1.00 0.00 C ATOM 61 CD ARG A 376 -37.365 -7.075 -3.568 1.00 0.00 C ATOM 62 NE ARG A 376 -37.640 -7.722 -4.862 1.00 0.00 N ATOM 63 CZ ARG A 376 -36.897 -7.603 -5.976 1.00 0.00 C ATOM 64 NH1 ARG A 376 -35.808 -6.822 -5.990 1.00 0.00 N ATOM 65 NH2 ARG A 376 -37.248 -8.272 -7.081 1.00 0.00 N ATOM 0 H ARG A 376 -41.679 -4.947 -4.390 1.00 0.00 H new ATOM 0 HA ARG A 376 -39.668 -3.888 -2.545 1.00 0.00 H new ATOM 0 HB2 ARG A 376 -39.883 -6.279 -3.319 1.00 0.00 H new ATOM 0 HB3 ARG A 376 -39.473 -5.740 -4.936 1.00 0.00 H new ATOM 0 HG2 ARG A 376 -37.263 -5.021 -4.236 1.00 0.00 H new ATOM 0 HG3 ARG A 376 -37.667 -5.197 -2.540 1.00 0.00 H new ATOM 0 HD2 ARG A 376 -36.294 -7.109 -3.368 1.00 0.00 H new ATOM 0 HD3 ARG A 376 -37.856 -7.636 -2.773 1.00 0.00 H new ATOM 0 HE ARG A 376 -38.469 -8.314 -4.918 1.00 0.00 H new ATOM 0 HH11 ARG A 376 -35.536 -6.311 -5.150 1.00 0.00 H new ATOM 0 HH12 ARG A 376 -35.251 -6.739 -6.840 1.00 0.00 H new ATOM 0 HH21 ARG A 376 -38.076 -8.868 -7.075 1.00 0.00 H new ATOM 0 HH22 ARG A 376 -36.688 -8.185 -7.929 1.00 0.00 H new ATOM 79 N ALA A 377 -39.856 -1.780 -4.204 1.00 0.00 N ATOM 80 CA ALA A 377 -39.474 -0.584 -4.946 1.00 0.00 C ATOM 81 C ALA A 377 -38.314 0.160 -4.278 1.00 0.00 C ATOM 82 O ALA A 377 -37.482 0.744 -4.969 1.00 0.00 O ATOM 83 CB ALA A 377 -40.686 0.346 -5.062 1.00 0.00 C ATOM 0 H ALA A 377 -40.520 -1.588 -3.454 1.00 0.00 H new ATOM 0 HA ALA A 377 -39.138 -0.894 -5.935 1.00 0.00 H new ATOM 0 HB1 ALA A 377 -40.406 1.242 -5.616 1.00 0.00 H new ATOM 0 HB2 ALA A 377 -41.491 -0.169 -5.587 1.00 0.00 H new ATOM 0 HB3 ALA A 377 -41.025 0.627 -4.065 1.00 0.00 H new ATOM 89 N ARG A 378 -38.273 0.161 -2.939 1.00 0.00 N ATOM 90 CA ARG A 378 -37.260 0.857 -2.157 1.00 0.00 C ATOM 91 C ARG A 378 -35.886 0.187 -2.269 1.00 0.00 C ATOM 92 O ARG A 378 -35.455 -0.528 -1.366 1.00 0.00 O ATOM 93 CB ARG A 378 -37.747 0.990 -0.705 1.00 0.00 C ATOM 94 CG ARG A 378 -36.892 1.990 0.088 1.00 0.00 C ATOM 95 CD ARG A 378 -37.440 2.192 1.504 1.00 0.00 C ATOM 96 NE ARG A 378 -37.284 0.979 2.320 1.00 0.00 N ATOM 97 CZ ARG A 378 -37.717 0.843 3.585 1.00 0.00 C ATOM 98 NH1 ARG A 378 -38.376 1.840 4.190 1.00 0.00 N ATOM 99 NH2 ARG A 378 -37.486 -0.300 4.245 1.00 0.00 N ATOM 0 H ARG A 378 -38.957 -0.332 -2.366 1.00 0.00 H new ATOM 0 HA ARG A 378 -37.120 1.859 -2.562 1.00 0.00 H new ATOM 0 HB2 ARG A 378 -38.788 1.314 -0.698 1.00 0.00 H new ATOM 0 HB3 ARG A 378 -37.713 0.015 -0.218 1.00 0.00 H new ATOM 0 HG2 ARG A 378 -35.864 1.631 0.141 1.00 0.00 H new ATOM 0 HG3 ARG A 378 -36.868 2.946 -0.435 1.00 0.00 H new ATOM 0 HD2 ARG A 378 -36.920 3.022 1.982 1.00 0.00 H new ATOM 0 HD3 ARG A 378 -38.494 2.464 1.452 1.00 0.00 H new ATOM 0 HE ARG A 378 -36.812 0.181 1.894 1.00 0.00 H new ATOM 0 HH11 ARG A 378 -38.553 2.711 3.690 1.00 0.00 H new ATOM 0 HH12 ARG A 378 -38.701 1.728 5.150 1.00 0.00 H new ATOM 0 HH21 ARG A 378 -36.984 -1.061 3.787 1.00 0.00 H new ATOM 0 HH22 ARG A 378 -37.812 -0.409 5.205 1.00 0.00 H new ATOM 113 N LYS A 379 -35.196 0.440 -3.386 1.00 0.00 N ATOM 114 CA LYS A 379 -33.866 -0.074 -3.672 1.00 0.00 C ATOM 115 C LYS A 379 -32.870 0.517 -2.666 1.00 0.00 C ATOM 116 O LYS A 379 -33.021 1.670 -2.259 1.00 0.00 O ATOM 117 CB LYS A 379 -33.506 0.301 -5.120 1.00 0.00 C ATOM 118 CG LYS A 379 -32.168 -0.290 -5.592 1.00 0.00 C ATOM 119 CD LYS A 379 -31.745 0.244 -6.968 1.00 0.00 C ATOM 120 CE LYS A 379 -32.708 -0.165 -8.090 1.00 0.00 C ATOM 121 NZ LYS A 379 -32.216 0.258 -9.415 1.00 0.00 N ATOM 0 H LYS A 379 -35.565 1.027 -4.134 1.00 0.00 H new ATOM 0 HA LYS A 379 -33.831 -1.159 -3.574 1.00 0.00 H new ATOM 0 HB2 LYS A 379 -34.300 -0.042 -5.784 1.00 0.00 H new ATOM 0 HB3 LYS A 379 -33.465 1.387 -5.206 1.00 0.00 H new ATOM 0 HG2 LYS A 379 -31.393 -0.058 -4.861 1.00 0.00 H new ATOM 0 HG3 LYS A 379 -32.249 -1.376 -5.636 1.00 0.00 H new ATOM 0 HD2 LYS A 379 -31.684 1.332 -6.927 1.00 0.00 H new ATOM 0 HD3 LYS A 379 -30.746 -0.122 -7.203 1.00 0.00 H new ATOM 0 HE2 LYS A 379 -32.840 -1.247 -8.080 1.00 0.00 H new ATOM 0 HE3 LYS A 379 -33.687 0.277 -7.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 379 -32.894 -0.036 -10.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 379 -32.114 1.293 -9.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 379 -31.293 -0.184 -9.600 1.00 0.00 H new ATOM 135 N ARG A 380 -31.857 -0.267 -2.272 1.00 0.00 N ATOM 136 CA ARG A 380 -30.830 0.149 -1.322 1.00 0.00 C ATOM 137 C ARG A 380 -30.176 1.464 -1.749 1.00 0.00 C ATOM 138 O ARG A 380 -30.233 2.436 -1.000 1.00 0.00 O ATOM 139 CB ARG A 380 -29.782 -0.958 -1.137 1.00 0.00 C ATOM 140 CG ARG A 380 -30.365 -2.140 -0.348 1.00 0.00 C ATOM 141 CD ARG A 380 -29.344 -3.271 -0.155 1.00 0.00 C ATOM 142 NE ARG A 380 -28.094 -2.811 0.470 1.00 0.00 N ATOM 143 CZ ARG A 380 -27.923 -2.496 1.766 1.00 0.00 C ATOM 144 NH1 ARG A 380 -28.936 -2.600 2.637 1.00 0.00 N ATOM 145 NH2 ARG A 380 -26.726 -2.073 2.190 1.00 0.00 N ATOM 0 H ARG A 380 -31.731 -1.220 -2.612 1.00 0.00 H new ATOM 0 HA ARG A 380 -31.313 0.323 -0.360 1.00 0.00 H new ATOM 0 HB2 ARG A 380 -29.435 -1.302 -2.111 1.00 0.00 H new ATOM 0 HB3 ARG A 380 -28.914 -0.558 -0.612 1.00 0.00 H new ATOM 0 HG2 ARG A 380 -30.706 -1.791 0.627 1.00 0.00 H new ATOM 0 HG3 ARG A 380 -31.239 -2.528 -0.871 1.00 0.00 H new ATOM 0 HD2 ARG A 380 -29.787 -4.053 0.462 1.00 0.00 H new ATOM 0 HD3 ARG A 380 -29.118 -3.719 -1.123 1.00 0.00 H new ATOM 0 HE ARG A 380 -27.280 -2.723 -0.138 1.00 0.00 H new ATOM 0 HH11 ARG A 380 -29.851 -2.921 2.320 1.00 0.00 H new ATOM 0 HH12 ARG A 380 -28.793 -2.358 3.617 1.00 0.00 H new ATOM 0 HH21 ARG A 380 -25.951 -1.991 1.532 1.00 0.00 H new ATOM 0 HH22 ARG A 380 -26.589 -1.832 3.172 1.00 0.00 H new ATOM 159 N GLN A 381 -29.561 1.487 -2.941 1.00 0.00 N ATOM 160 CA GLN A 381 -28.895 2.642 -3.551 1.00 0.00 C ATOM 161 C GLN A 381 -27.589 3.054 -2.856 1.00 0.00 C ATOM 162 O GLN A 381 -26.631 3.419 -3.541 1.00 0.00 O ATOM 163 CB GLN A 381 -29.861 3.829 -3.704 1.00 0.00 C ATOM 164 CG GLN A 381 -31.051 3.469 -4.603 1.00 0.00 C ATOM 165 CD GLN A 381 -32.172 4.495 -4.484 1.00 0.00 C ATOM 166 OE1 GLN A 381 -32.183 5.493 -5.199 1.00 0.00 O ATOM 167 NE2 GLN A 381 -33.126 4.251 -3.584 1.00 0.00 N ATOM 0 H GLN A 381 -29.514 0.658 -3.533 1.00 0.00 H new ATOM 0 HA GLN A 381 -28.595 2.315 -4.547 1.00 0.00 H new ATOM 0 HB2 GLN A 381 -30.224 4.134 -2.722 1.00 0.00 H new ATOM 0 HB3 GLN A 381 -29.329 4.681 -4.126 1.00 0.00 H new ATOM 0 HG2 GLN A 381 -30.720 3.409 -5.640 1.00 0.00 H new ATOM 0 HG3 GLN A 381 -31.428 2.483 -4.331 1.00 0.00 H new ATOM 0 HE21 GLN A 381 -33.081 3.410 -3.009 1.00 0.00 H new ATOM 0 HE22 GLN A 381 -33.900 4.905 -3.471 1.00 0.00 H new ATOM 176 N ALA A 382 -27.543 3.003 -1.519 1.00 0.00 N ATOM 177 CA ALA A 382 -26.390 3.352 -0.704 1.00 0.00 C ATOM 178 C ALA A 382 -25.151 2.551 -1.112 1.00 0.00 C ATOM 179 O ALA A 382 -25.259 1.490 -1.718 1.00 0.00 O ATOM 180 CB ALA A 382 -26.723 3.119 0.773 1.00 0.00 C ATOM 0 H ALA A 382 -28.343 2.705 -0.961 1.00 0.00 H new ATOM 0 HA ALA A 382 -26.159 4.405 -0.862 1.00 0.00 H new ATOM 0 HB1 ALA A 382 -25.860 3.380 1.386 1.00 0.00 H new ATOM 0 HB2 ALA A 382 -27.572 3.741 1.057 1.00 0.00 H new ATOM 0 HB3 ALA A 382 -26.974 2.070 0.928 1.00 0.00 H new ATOM 186 N TRP A 383 -23.976 3.092 -0.782 1.00 0.00 N ATOM 187 CA TRP A 383 -22.668 2.533 -1.089 1.00 0.00 C ATOM 188 C TRP A 383 -22.506 1.091 -0.609 1.00 0.00 C ATOM 189 O TRP A 383 -22.629 0.823 0.586 1.00 0.00 O ATOM 190 CB TRP A 383 -21.598 3.436 -0.470 1.00 0.00 C ATOM 191 CG TRP A 383 -21.424 4.773 -1.129 1.00 0.00 C ATOM 192 CD1 TRP A 383 -22.281 5.820 -1.072 1.00 0.00 C ATOM 193 CD2 TRP A 383 -20.315 5.223 -1.956 1.00 0.00 C ATOM 194 NE1 TRP A 383 -21.782 6.878 -1.805 1.00 0.00 N ATOM 195 CE2 TRP A 383 -20.568 6.562 -2.376 1.00 0.00 C ATOM 196 CE3 TRP A 383 -19.113 4.632 -2.389 1.00 0.00 C ATOM 197 CZ2 TRP A 383 -19.677 7.272 -3.193 1.00 0.00 C ATOM 198 CZ3 TRP A 383 -18.212 5.333 -3.208 1.00 0.00 C ATOM 199 CH2 TRP A 383 -18.492 6.648 -3.612 1.00 0.00 C ATOM 0 H TRP A 383 -23.913 3.972 -0.270 1.00 0.00 H new ATOM 0 HA TRP A 383 -22.558 2.497 -2.173 1.00 0.00 H new ATOM 0 HB2 TRP A 383 -21.845 3.597 0.579 1.00 0.00 H new ATOM 0 HB3 TRP A 383 -20.644 2.910 -0.496 1.00 0.00 H new ATOM 0 HD1 TRP A 383 -23.217 5.826 -0.533 1.00 0.00 H new ATOM 0 HE1 TRP A 383 -22.251 7.778 -1.910 1.00 0.00 H new ATOM 0 HE3 TRP A 383 -18.879 3.622 -2.086 1.00 0.00 H new ATOM 0 HZ2 TRP A 383 -19.899 8.285 -3.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 383 -17.297 4.857 -3.529 1.00 0.00 H new ATOM 0 HH2 TRP A 383 -17.796 7.179 -4.245 1.00 0.00 H new ATOM 210 N LEU A 384 -22.216 0.181 -1.547 1.00 0.00 N ATOM 211 CA LEU A 384 -21.987 -1.234 -1.311 1.00 0.00 C ATOM 212 C LEU A 384 -20.530 -1.558 -1.660 1.00 0.00 C ATOM 213 O LEU A 384 -19.724 -0.674 -1.957 1.00 0.00 O ATOM 214 CB LEU A 384 -22.931 -2.096 -2.175 1.00 0.00 C ATOM 215 CG LEU A 384 -24.394 -1.634 -2.225 1.00 0.00 C ATOM 216 CD1 LEU A 384 -25.190 -2.580 -3.131 1.00 0.00 C ATOM 217 CD2 LEU A 384 -25.037 -1.610 -0.835 1.00 0.00 C ATOM 0 H LEU A 384 -22.133 0.431 -2.532 1.00 0.00 H new ATOM 0 HA LEU A 384 -22.187 -1.459 -0.263 1.00 0.00 H new ATOM 0 HB2 LEU A 384 -22.542 -2.120 -3.193 1.00 0.00 H new ATOM 0 HB3 LEU A 384 -22.905 -3.119 -1.800 1.00 0.00 H new ATOM 0 HG LEU A 384 -24.410 -0.617 -2.618 1.00 0.00 H new ATOM 0 HD11 LEU A 384 -26.230 -2.257 -3.170 1.00 0.00 H new ATOM 0 HD12 LEU A 384 -24.767 -2.564 -4.135 1.00 0.00 H new ATOM 0 HD13 LEU A 384 -25.140 -3.593 -2.733 1.00 0.00 H new ATOM 0 HD21 LEU A 384 -26.072 -1.277 -0.918 1.00 0.00 H new ATOM 0 HD22 LEU A 384 -25.011 -2.611 -0.405 1.00 0.00 H new ATOM 0 HD23 LEU A 384 -24.486 -0.924 -0.191 1.00 0.00 H new ATOM 229 N TRP A 385 -20.210 -2.854 -1.633 1.00 0.00 N ATOM 230 CA TRP A 385 -18.900 -3.399 -1.942 1.00 0.00 C ATOM 231 C TRP A 385 -18.366 -2.892 -3.286 1.00 0.00 C ATOM 232 O TRP A 385 -17.184 -2.564 -3.373 1.00 0.00 O ATOM 233 CB TRP A 385 -18.975 -4.931 -1.905 1.00 0.00 C ATOM 234 CG TRP A 385 -20.026 -5.551 -2.779 1.00 0.00 C ATOM 235 CD1 TRP A 385 -21.293 -5.834 -2.401 1.00 0.00 C ATOM 236 CD2 TRP A 385 -19.929 -5.969 -4.175 1.00 0.00 C ATOM 237 NE1 TRP A 385 -21.988 -6.391 -3.454 1.00 0.00 N ATOM 238 CE2 TRP A 385 -21.192 -6.495 -4.576 1.00 0.00 C ATOM 239 CE3 TRP A 385 -18.902 -5.953 -5.144 1.00 0.00 C ATOM 240 CZ2 TRP A 385 -21.423 -6.982 -5.870 1.00 0.00 C ATOM 241 CZ3 TRP A 385 -19.124 -6.439 -6.447 1.00 0.00 C ATOM 242 CH2 TRP A 385 -20.381 -6.951 -6.810 1.00 0.00 C ATOM 0 H TRP A 385 -20.888 -3.575 -1.385 1.00 0.00 H new ATOM 0 HA TRP A 385 -18.191 -3.055 -1.189 1.00 0.00 H new ATOM 0 HB2 TRP A 385 -18.004 -5.331 -2.196 1.00 0.00 H new ATOM 0 HB3 TRP A 385 -19.153 -5.243 -0.876 1.00 0.00 H new ATOM 0 HD1 TRP A 385 -21.701 -5.651 -1.418 1.00 0.00 H new ATOM 0 HE1 TRP A 385 -22.963 -6.687 -3.409 1.00 0.00 H new ATOM 0 HE3 TRP A 385 -17.930 -5.562 -4.882 1.00 0.00 H new ATOM 0 HZ2 TRP A 385 -22.391 -7.376 -6.141 1.00 0.00 H new ATOM 0 HZ3 TRP A 385 -18.323 -6.418 -7.171 1.00 0.00 H new ATOM 0 HH2 TRP A 385 -20.545 -7.320 -7.811 1.00 0.00 H new ATOM 253 N GLU A 386 -19.210 -2.830 -4.327 1.00 0.00 N ATOM 254 CA GLU A 386 -18.788 -2.370 -5.645 1.00 0.00 C ATOM 255 C GLU A 386 -18.214 -0.959 -5.548 1.00 0.00 C ATOM 256 O GLU A 386 -17.046 -0.753 -5.870 1.00 0.00 O ATOM 257 CB GLU A 386 -19.937 -2.443 -6.669 1.00 0.00 C ATOM 258 CG GLU A 386 -19.431 -2.097 -8.085 1.00 0.00 C ATOM 259 CD GLU A 386 -20.531 -2.057 -9.143 1.00 0.00 C ATOM 260 OE1 GLU A 386 -21.614 -2.622 -8.887 1.00 0.00 O ATOM 261 OE2 GLU A 386 -20.260 -1.464 -10.212 1.00 0.00 O ATOM 0 H GLU A 386 -20.193 -3.096 -4.274 1.00 0.00 H new ATOM 0 HA GLU A 386 -18.005 -3.037 -6.005 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -20.369 -3.444 -6.667 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -20.730 -1.752 -6.382 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -18.934 -1.128 -8.056 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -18.682 -2.831 -8.382 1.00 0.00 H new ATOM 268 N GLU A 387 -19.032 0.004 -5.112 1.00 0.00 N ATOM 269 CA GLU A 387 -18.640 1.396 -4.989 1.00 0.00 C ATOM 270 C GLU A 387 -17.411 1.573 -4.094 1.00 0.00 C ATOM 271 O GLU A 387 -16.520 2.347 -4.436 1.00 0.00 O ATOM 272 CB GLU A 387 -19.812 2.250 -4.496 1.00 0.00 C ATOM 273 CG GLU A 387 -21.093 2.110 -5.330 1.00 0.00 C ATOM 274 CD GLU A 387 -22.101 1.157 -4.700 1.00 0.00 C ATOM 275 OE1 GLU A 387 -21.688 0.027 -4.364 1.00 0.00 O ATOM 276 OE2 GLU A 387 -23.258 1.587 -4.513 1.00 0.00 O ATOM 0 H GLU A 387 -19.997 -0.173 -4.833 1.00 0.00 H new ATOM 0 HA GLU A 387 -18.359 1.742 -5.984 1.00 0.00 H new ATOM 0 HB2 GLU A 387 -20.034 1.980 -3.464 1.00 0.00 H new ATOM 0 HB3 GLU A 387 -19.507 3.297 -4.493 1.00 0.00 H new ATOM 0 HG2 GLU A 387 -21.552 3.091 -5.451 1.00 0.00 H new ATOM 0 HG3 GLU A 387 -20.836 1.753 -6.327 1.00 0.00 H new ATOM 283 N ASP A 388 -17.350 0.869 -2.957 1.00 0.00 N ATOM 284 CA ASP A 388 -16.216 0.965 -2.041 1.00 0.00 C ATOM 285 C ASP A 388 -14.922 0.480 -2.698 1.00 0.00 C ATOM 286 O ASP A 388 -13.925 1.200 -2.700 1.00 0.00 O ATOM 287 CB ASP A 388 -16.499 0.205 -0.738 1.00 0.00 C ATOM 288 CG ASP A 388 -17.202 1.103 0.270 1.00 0.00 C ATOM 289 OD1 ASP A 388 -16.568 2.099 0.676 1.00 0.00 O ATOM 290 OD2 ASP A 388 -18.370 0.826 0.619 1.00 0.00 O ATOM 0 H ASP A 388 -18.079 0.224 -2.652 1.00 0.00 H new ATOM 0 HA ASP A 388 -16.078 2.017 -1.792 1.00 0.00 H new ATOM 0 HB2 ASP A 388 -17.118 -0.668 -0.948 1.00 0.00 H new ATOM 0 HB3 ASP A 388 -15.564 -0.161 -0.315 1.00 0.00 H new ATOM 295 N LYS A 389 -14.928 -0.733 -3.259 1.00 0.00 N ATOM 296 CA LYS A 389 -13.769 -1.312 -3.932 1.00 0.00 C ATOM 297 C LYS A 389 -13.322 -0.404 -5.079 1.00 0.00 C ATOM 298 O LYS A 389 -12.137 -0.111 -5.224 1.00 0.00 O ATOM 299 CB LYS A 389 -14.136 -2.701 -4.467 1.00 0.00 C ATOM 300 CG LYS A 389 -14.186 -3.737 -3.338 1.00 0.00 C ATOM 301 CD LYS A 389 -14.934 -5.027 -3.710 1.00 0.00 C ATOM 302 CE LYS A 389 -14.466 -5.694 -5.012 1.00 0.00 C ATOM 303 NZ LYS A 389 -15.062 -5.077 -6.214 1.00 0.00 N ATOM 0 H LYS A 389 -15.746 -1.343 -3.257 1.00 0.00 H new ATOM 0 HA LYS A 389 -12.946 -1.405 -3.224 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -15.104 -2.657 -4.966 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -13.406 -3.010 -5.215 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -13.167 -3.991 -3.046 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -14.665 -3.289 -2.468 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -14.825 -5.741 -2.894 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -15.997 -4.801 -3.796 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -13.380 -5.632 -5.077 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -14.724 -6.753 -4.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -15.217 -5.807 -6.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -15.971 -4.638 -5.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -14.418 -4.351 -6.587 1.00 0.00 H new ATOM 317 N ASN A 390 -14.293 0.034 -5.883 1.00 0.00 N ATOM 318 CA ASN A 390 -14.111 0.914 -7.023 1.00 0.00 C ATOM 319 C ASN A 390 -13.394 2.191 -6.586 1.00 0.00 C ATOM 320 O ASN A 390 -12.339 2.518 -7.122 1.00 0.00 O ATOM 321 CB ASN A 390 -15.501 1.182 -7.613 1.00 0.00 C ATOM 322 CG ASN A 390 -15.541 2.161 -8.775 1.00 0.00 C ATOM 323 OD1 ASN A 390 -14.582 2.868 -9.061 1.00 0.00 O ATOM 324 ND2 ASN A 390 -16.691 2.208 -9.438 1.00 0.00 N ATOM 0 H ASN A 390 -15.268 -0.231 -5.745 1.00 0.00 H new ATOM 0 HA ASN A 390 -13.482 0.462 -7.790 1.00 0.00 H new ATOM 0 HB2 ASN A 390 -15.925 0.234 -7.945 1.00 0.00 H new ATOM 0 HB3 ASN A 390 -16.146 1.560 -6.820 1.00 0.00 H new ATOM 0 HD21 ASN A 390 -16.802 2.852 -10.221 1.00 0.00 H new ATOM 0 HD22 ASN A 390 -17.463 1.600 -9.164 1.00 0.00 H new ATOM 331 N LEU A 391 -13.960 2.907 -5.609 1.00 0.00 N ATOM 332 CA LEU A 391 -13.394 4.142 -5.088 1.00 0.00 C ATOM 333 C LEU A 391 -11.994 3.916 -4.519 1.00 0.00 C ATOM 334 O LEU A 391 -11.093 4.705 -4.800 1.00 0.00 O ATOM 335 CB LEU A 391 -14.350 4.733 -4.048 1.00 0.00 C ATOM 336 CG LEU A 391 -13.841 6.024 -3.390 1.00 0.00 C ATOM 337 CD1 LEU A 391 -13.555 7.120 -4.421 1.00 0.00 C ATOM 338 CD2 LEU A 391 -14.903 6.515 -2.402 1.00 0.00 C ATOM 0 H LEU A 391 -14.834 2.637 -5.157 1.00 0.00 H new ATOM 0 HA LEU A 391 -13.280 4.858 -5.902 1.00 0.00 H new ATOM 0 HB2 LEU A 391 -15.309 4.935 -4.525 1.00 0.00 H new ATOM 0 HB3 LEU A 391 -14.530 3.989 -3.272 1.00 0.00 H new ATOM 0 HG LEU A 391 -12.903 5.805 -2.879 1.00 0.00 H new ATOM 0 HD11 LEU A 391 -13.197 8.015 -3.911 1.00 0.00 H new ATOM 0 HD12 LEU A 391 -12.795 6.772 -5.120 1.00 0.00 H new ATOM 0 HD13 LEU A 391 -14.469 7.354 -4.966 1.00 0.00 H new ATOM 0 HD21 LEU A 391 -14.559 7.432 -1.924 1.00 0.00 H new ATOM 0 HD22 LEU A 391 -15.833 6.711 -2.935 1.00 0.00 H new ATOM 0 HD23 LEU A 391 -15.074 5.752 -1.642 1.00 0.00 H new ATOM 350 N ARG A 392 -11.799 2.848 -3.735 1.00 0.00 N ATOM 351 CA ARG A 392 -10.499 2.529 -3.160 1.00 0.00 C ATOM 352 C ARG A 392 -9.473 2.405 -4.284 1.00 0.00 C ATOM 353 O ARG A 392 -8.442 3.072 -4.254 1.00 0.00 O ATOM 354 CB ARG A 392 -10.579 1.256 -2.307 1.00 0.00 C ATOM 355 CG ARG A 392 -9.248 0.979 -1.585 1.00 0.00 C ATOM 356 CD ARG A 392 -9.283 -0.323 -0.777 1.00 0.00 C ATOM 357 NE ARG A 392 -10.413 -0.331 0.164 1.00 0.00 N ATOM 358 CZ ARG A 392 -10.382 -0.441 1.503 1.00 0.00 C ATOM 359 NH1 ARG A 392 -9.247 -0.604 2.195 1.00 0.00 N ATOM 360 NH2 ARG A 392 -11.539 -0.412 2.174 1.00 0.00 N ATOM 0 H ARG A 392 -12.537 2.189 -3.487 1.00 0.00 H new ATOM 0 HA ARG A 392 -10.183 3.331 -2.493 1.00 0.00 H new ATOM 0 HB2 ARG A 392 -11.378 1.358 -1.573 1.00 0.00 H new ATOM 0 HB3 ARG A 392 -10.834 0.407 -2.941 1.00 0.00 H new ATOM 0 HG2 ARG A 392 -8.444 0.927 -2.319 1.00 0.00 H new ATOM 0 HG3 ARG A 392 -9.019 1.811 -0.919 1.00 0.00 H new ATOM 0 HD2 ARG A 392 -9.364 -1.173 -1.454 1.00 0.00 H new ATOM 0 HD3 ARG A 392 -8.348 -0.440 -0.229 1.00 0.00 H new ATOM 0 HE ARG A 392 -11.339 -0.242 -0.253 1.00 0.00 H new ATOM 0 HH11 ARG A 392 -8.353 -0.650 1.705 1.00 0.00 H new ATOM 0 HH12 ARG A 392 -9.276 -0.682 3.212 1.00 0.00 H new ATOM 0 HH21 ARG A 392 -12.419 -0.308 1.669 1.00 0.00 H new ATOM 0 HH22 ARG A 392 -11.541 -0.494 3.191 1.00 0.00 H new ATOM 374 N SER A 393 -9.769 1.568 -5.286 1.00 0.00 N ATOM 375 CA SER A 393 -8.909 1.373 -6.446 1.00 0.00 C ATOM 376 C SER A 393 -8.651 2.723 -7.119 1.00 0.00 C ATOM 377 O SER A 393 -7.516 3.040 -7.464 1.00 0.00 O ATOM 378 CB SER A 393 -9.568 0.384 -7.414 1.00 0.00 C ATOM 379 OG SER A 393 -8.748 0.178 -8.548 1.00 0.00 O ATOM 0 H SER A 393 -10.620 1.006 -5.309 1.00 0.00 H new ATOM 0 HA SER A 393 -7.951 0.956 -6.136 1.00 0.00 H new ATOM 0 HB2 SER A 393 -9.745 -0.565 -6.909 1.00 0.00 H new ATOM 0 HB3 SER A 393 -10.541 0.765 -7.726 1.00 0.00 H new ATOM 0 HG SER A 393 -9.055 0.750 -9.282 1.00 0.00 H new ATOM 385 N GLY A 394 -9.712 3.518 -7.287 1.00 0.00 N ATOM 386 CA GLY A 394 -9.674 4.836 -7.891 1.00 0.00 C ATOM 387 C GLY A 394 -8.635 5.723 -7.216 1.00 0.00 C ATOM 388 O GLY A 394 -7.797 6.311 -7.890 1.00 0.00 O ATOM 0 H GLY A 394 -10.649 3.244 -6.993 1.00 0.00 H new ATOM 0 HA2 GLY A 394 -9.444 4.746 -8.953 1.00 0.00 H new ATOM 0 HA3 GLY A 394 -10.657 5.301 -7.816 1.00 0.00 H new ATOM 392 N VAL A 395 -8.683 5.821 -5.887 1.00 0.00 N ATOM 393 CA VAL A 395 -7.746 6.631 -5.127 1.00 0.00 C ATOM 394 C VAL A 395 -6.335 6.046 -5.213 1.00 0.00 C ATOM 395 O VAL A 395 -5.382 6.781 -5.441 1.00 0.00 O ATOM 396 CB VAL A 395 -8.238 6.782 -3.680 1.00 0.00 C ATOM 397 CG1 VAL A 395 -7.140 7.395 -2.800 1.00 0.00 C ATOM 398 CG2 VAL A 395 -9.491 7.670 -3.681 1.00 0.00 C ATOM 0 H VAL A 395 -9.374 5.339 -5.312 1.00 0.00 H new ATOM 0 HA VAL A 395 -7.695 7.631 -5.558 1.00 0.00 H new ATOM 0 HB VAL A 395 -8.483 5.803 -3.269 1.00 0.00 H new ATOM 0 HG11 VAL A 395 -7.506 7.495 -1.778 1.00 0.00 H new ATOM 0 HG12 VAL A 395 -6.263 6.748 -2.810 1.00 0.00 H new ATOM 0 HG13 VAL A 395 -6.870 8.378 -3.186 1.00 0.00 H new ATOM 0 HG21 VAL A 395 -9.854 7.788 -2.660 1.00 0.00 H new ATOM 0 HG22 VAL A 395 -9.243 8.648 -4.093 1.00 0.00 H new ATOM 0 HG23 VAL A 395 -10.266 7.205 -4.290 1.00 0.00 H new ATOM 408 N ARG A 396 -6.190 4.732 -5.031 1.00 0.00 N ATOM 409 CA ARG A 396 -4.888 4.077 -5.087 1.00 0.00 C ATOM 410 C ARG A 396 -4.218 4.245 -6.461 1.00 0.00 C ATOM 411 O ARG A 396 -2.993 4.316 -6.536 1.00 0.00 O ATOM 412 CB ARG A 396 -5.043 2.592 -4.722 1.00 0.00 C ATOM 413 CG ARG A 396 -5.537 2.355 -3.283 1.00 0.00 C ATOM 414 CD ARG A 396 -4.429 2.469 -2.229 1.00 0.00 C ATOM 415 NE ARG A 396 -4.970 2.311 -0.868 1.00 0.00 N ATOM 416 CZ ARG A 396 -5.298 1.149 -0.274 1.00 0.00 C ATOM 417 NH1 ARG A 396 -5.126 -0.020 -0.905 1.00 0.00 N ATOM 418 NH2 ARG A 396 -5.809 1.169 0.964 1.00 0.00 N ATOM 0 H ARG A 396 -6.967 4.099 -4.842 1.00 0.00 H new ATOM 0 HA ARG A 396 -4.232 4.557 -4.361 1.00 0.00 H new ATOM 0 HB2 ARG A 396 -5.742 2.127 -5.417 1.00 0.00 H new ATOM 0 HB3 ARG A 396 -4.083 2.093 -4.854 1.00 0.00 H new ATOM 0 HG2 ARG A 396 -6.322 3.076 -3.053 1.00 0.00 H new ATOM 0 HG3 ARG A 396 -5.987 1.364 -3.220 1.00 0.00 H new ATOM 0 HD2 ARG A 396 -3.670 1.709 -2.412 1.00 0.00 H new ATOM 0 HD3 ARG A 396 -3.937 3.438 -2.318 1.00 0.00 H new ATOM 0 HE ARG A 396 -5.109 3.163 -0.325 1.00 0.00 H new ATOM 0 HH11 ARG A 396 -4.741 -0.038 -1.850 1.00 0.00 H new ATOM 0 HH12 ARG A 396 -5.380 -0.892 -0.441 1.00 0.00 H new ATOM 0 HH21 ARG A 396 -5.945 2.058 1.445 1.00 0.00 H new ATOM 0 HH22 ARG A 396 -6.062 0.295 1.426 1.00 0.00 H new ATOM 432 N LYS A 397 -5.009 4.292 -7.541 1.00 0.00 N ATOM 433 CA LYS A 397 -4.532 4.406 -8.914 1.00 0.00 C ATOM 434 C LYS A 397 -4.352 5.846 -9.410 1.00 0.00 C ATOM 435 O LYS A 397 -3.347 6.136 -10.057 1.00 0.00 O ATOM 436 CB LYS A 397 -5.494 3.623 -9.824 1.00 0.00 C ATOM 437 CG LYS A 397 -4.994 3.461 -11.266 1.00 0.00 C ATOM 438 CD LYS A 397 -3.781 2.530 -11.391 1.00 0.00 C ATOM 439 CE LYS A 397 -3.434 2.335 -12.871 1.00 0.00 C ATOM 440 NZ LYS A 397 -2.243 1.484 -13.048 1.00 0.00 N ATOM 0 H LYS A 397 -6.026 4.250 -7.475 1.00 0.00 H new ATOM 0 HA LYS A 397 -3.528 3.983 -8.946 1.00 0.00 H new ATOM 0 HB2 LYS A 397 -5.661 2.635 -9.395 1.00 0.00 H new ATOM 0 HB3 LYS A 397 -6.458 4.131 -9.839 1.00 0.00 H new ATOM 0 HG2 LYS A 397 -5.805 3.073 -11.882 1.00 0.00 H new ATOM 0 HG3 LYS A 397 -4.732 4.441 -11.664 1.00 0.00 H new ATOM 0 HD2 LYS A 397 -2.929 2.953 -10.860 1.00 0.00 H new ATOM 0 HD3 LYS A 397 -3.999 1.568 -10.928 1.00 0.00 H new ATOM 0 HE2 LYS A 397 -4.282 1.885 -13.387 1.00 0.00 H new ATOM 0 HE3 LYS A 397 -3.259 3.306 -13.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 397 -2.041 1.376 -14.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 397 -1.428 1.926 -12.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 397 -2.419 0.549 -12.629 1.00 0.00 H new ATOM 454 N TYR A 398 -5.330 6.726 -9.160 1.00 0.00 N ATOM 455 CA TYR A 398 -5.355 8.105 -9.651 1.00 0.00 C ATOM 456 C TYR A 398 -5.136 9.183 -8.587 1.00 0.00 C ATOM 457 O TYR A 398 -4.948 10.343 -8.946 1.00 0.00 O ATOM 458 CB TYR A 398 -6.676 8.328 -10.402 1.00 0.00 C ATOM 459 CG TYR A 398 -7.032 7.181 -11.335 1.00 0.00 C ATOM 460 CD1 TYR A 398 -6.142 6.810 -12.358 1.00 0.00 C ATOM 461 CD2 TYR A 398 -8.238 6.473 -11.171 1.00 0.00 C ATOM 462 CE1 TYR A 398 -6.454 5.737 -13.208 1.00 0.00 C ATOM 463 CE2 TYR A 398 -8.550 5.401 -12.024 1.00 0.00 C ATOM 464 CZ TYR A 398 -7.657 5.031 -13.043 1.00 0.00 C ATOM 465 OH TYR A 398 -7.948 3.988 -13.869 1.00 0.00 O ATOM 0 H TYR A 398 -6.146 6.490 -8.596 1.00 0.00 H new ATOM 0 HA TYR A 398 -4.498 8.218 -10.314 1.00 0.00 H new ATOM 0 HB2 TYR A 398 -7.480 8.463 -9.679 1.00 0.00 H new ATOM 0 HB3 TYR A 398 -6.608 9.250 -10.979 1.00 0.00 H new ATOM 0 HD1 TYR A 398 -5.217 7.351 -12.490 1.00 0.00 H new ATOM 0 HD2 TYR A 398 -8.925 6.755 -10.387 1.00 0.00 H new ATOM 0 HE1 TYR A 398 -5.767 5.454 -13.991 1.00 0.00 H new ATOM 0 HE2 TYR A 398 -9.477 4.861 -11.896 1.00 0.00 H new ATOM 0 HH TYR A 398 -8.551 3.366 -13.411 1.00 0.00 H new ATOM 475 N GLY A 399 -5.152 8.830 -7.297 1.00 0.00 N ATOM 476 CA GLY A 399 -4.940 9.774 -6.208 1.00 0.00 C ATOM 477 C GLY A 399 -6.221 10.519 -5.834 1.00 0.00 C ATOM 478 O GLY A 399 -6.927 11.029 -6.707 1.00 0.00 O ATOM 0 H GLY A 399 -5.314 7.873 -6.983 1.00 0.00 H new ATOM 0 HA2 GLY A 399 -4.563 9.241 -5.335 1.00 0.00 H new ATOM 0 HA3 GLY A 399 -4.174 10.494 -6.497 1.00 0.00 H new ATOM 482 N GLU A 400 -6.514 10.595 -4.529 1.00 0.00 N ATOM 483 CA GLU A 400 -7.684 11.289 -4.014 1.00 0.00 C ATOM 484 C GLU A 400 -7.643 12.753 -4.447 1.00 0.00 C ATOM 485 O GLU A 400 -6.569 13.338 -4.580 1.00 0.00 O ATOM 486 CB GLU A 400 -7.818 11.099 -2.494 1.00 0.00 C ATOM 487 CG GLU A 400 -6.596 11.544 -1.677 1.00 0.00 C ATOM 488 CD GLU A 400 -6.703 11.077 -0.229 1.00 0.00 C ATOM 489 OE1 GLU A 400 -6.843 9.853 -0.028 1.00 0.00 O ATOM 490 OE2 GLU A 400 -6.622 11.925 0.687 1.00 0.00 O ATOM 0 H GLU A 400 -5.937 10.171 -3.803 1.00 0.00 H new ATOM 0 HA GLU A 400 -8.588 10.854 -4.440 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -8.690 11.655 -2.148 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -8.010 10.046 -2.290 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -5.688 11.141 -2.126 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -6.511 12.630 -1.707 1.00 0.00 H new ATOM 497 N GLY A 401 -8.822 13.325 -4.708 1.00 0.00 N ATOM 498 CA GLY A 401 -8.959 14.686 -5.199 1.00 0.00 C ATOM 499 C GLY A 401 -9.302 14.638 -6.687 1.00 0.00 C ATOM 500 O GLY A 401 -10.117 15.430 -7.158 1.00 0.00 O ATOM 0 H GLY A 401 -9.713 12.845 -4.581 1.00 0.00 H new ATOM 0 HA2 GLY A 401 -9.740 15.210 -4.648 1.00 0.00 H new ATOM 0 HA3 GLY A 401 -8.033 15.239 -5.042 1.00 0.00 H new ATOM 504 N ASN A 402 -8.696 13.699 -7.432 1.00 0.00 N ATOM 505 CA ASN A 402 -8.924 13.515 -8.862 1.00 0.00 C ATOM 506 C ASN A 402 -10.218 12.731 -9.093 1.00 0.00 C ATOM 507 O ASN A 402 -10.229 11.690 -9.750 1.00 0.00 O ATOM 508 CB ASN A 402 -7.716 12.819 -9.508 1.00 0.00 C ATOM 509 CG ASN A 402 -6.419 13.581 -9.259 1.00 0.00 C ATOM 510 OD1 ASN A 402 -6.081 14.495 -10.005 1.00 0.00 O ATOM 511 ND2 ASN A 402 -5.692 13.214 -8.204 1.00 0.00 N ATOM 0 H ASN A 402 -8.023 13.038 -7.044 1.00 0.00 H new ATOM 0 HA ASN A 402 -9.037 14.490 -9.336 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -7.625 11.808 -9.111 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -7.882 12.726 -10.581 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -4.820 13.698 -7.992 1.00 0.00 H new ATOM 0 HD22 ASN A 402 -6.008 12.449 -7.608 1.00 0.00 H new ATOM 518 N TRP A 403 -11.322 13.247 -8.545 1.00 0.00 N ATOM 519 CA TRP A 403 -12.649 12.657 -8.635 1.00 0.00 C ATOM 520 C TRP A 403 -13.080 12.510 -10.092 1.00 0.00 C ATOM 521 O TRP A 403 -13.693 11.509 -10.453 1.00 0.00 O ATOM 522 CB TRP A 403 -13.633 13.496 -7.817 1.00 0.00 C ATOM 523 CG TRP A 403 -13.132 13.889 -6.458 1.00 0.00 C ATOM 524 CD1 TRP A 403 -13.042 15.158 -6.001 1.00 0.00 C ATOM 525 CD2 TRP A 403 -12.635 13.042 -5.376 1.00 0.00 C ATOM 526 NE1 TRP A 403 -12.532 15.162 -4.721 1.00 0.00 N ATOM 527 CE2 TRP A 403 -12.263 13.880 -4.286 1.00 0.00 C ATOM 528 CE3 TRP A 403 -12.456 11.651 -5.196 1.00 0.00 C ATOM 529 CZ2 TRP A 403 -11.746 13.373 -3.085 1.00 0.00 C ATOM 530 CZ3 TRP A 403 -11.938 11.129 -3.996 1.00 0.00 C ATOM 531 CH2 TRP A 403 -11.585 11.985 -2.942 1.00 0.00 C ATOM 0 H TRP A 403 -11.310 14.115 -8.010 1.00 0.00 H new ATOM 0 HA TRP A 403 -12.633 11.651 -8.215 1.00 0.00 H new ATOM 0 HB2 TRP A 403 -13.874 14.399 -8.377 1.00 0.00 H new ATOM 0 HB3 TRP A 403 -14.561 12.935 -7.701 1.00 0.00 H new ATOM 0 HD1 TRP A 403 -13.328 16.039 -6.557 1.00 0.00 H new ATOM 0 HE1 TRP A 403 -12.374 16.003 -4.167 1.00 0.00 H new ATOM 0 HE3 TRP A 403 -12.722 10.975 -5.996 1.00 0.00 H new ATOM 0 HZ2 TRP A 403 -11.475 14.041 -2.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 403 -11.811 10.062 -3.886 1.00 0.00 H new ATOM 0 HH2 TRP A 403 -11.190 11.578 -2.023 1.00 0.00 H new ATOM 542 N SER A 404 -12.738 13.501 -10.925 1.00 0.00 N ATOM 543 CA SER A 404 -13.040 13.490 -12.347 1.00 0.00 C ATOM 544 C SER A 404 -12.410 12.250 -12.989 1.00 0.00 C ATOM 545 O SER A 404 -13.091 11.513 -13.696 1.00 0.00 O ATOM 546 CB SER A 404 -12.533 14.785 -12.993 1.00 0.00 C ATOM 547 OG SER A 404 -12.807 14.791 -14.378 1.00 0.00 O ATOM 0 H SER A 404 -12.240 14.337 -10.620 1.00 0.00 H new ATOM 0 HA SER A 404 -14.118 13.442 -12.503 1.00 0.00 H new ATOM 0 HB2 SER A 404 -13.008 15.644 -12.519 1.00 0.00 H new ATOM 0 HB3 SER A 404 -11.460 14.884 -12.829 1.00 0.00 H new ATOM 0 HG SER A 404 -12.478 15.625 -14.773 1.00 0.00 H new ATOM 553 N LYS A 405 -11.118 12.014 -12.730 1.00 0.00 N ATOM 554 CA LYS A 405 -10.404 10.861 -13.261 1.00 0.00 C ATOM 555 C LYS A 405 -11.056 9.573 -12.762 1.00 0.00 C ATOM 556 O LYS A 405 -11.419 8.722 -13.568 1.00 0.00 O ATOM 557 CB LYS A 405 -8.919 10.909 -12.867 1.00 0.00 C ATOM 558 CG LYS A 405 -8.156 12.099 -13.464 1.00 0.00 C ATOM 559 CD LYS A 405 -8.009 11.976 -14.987 1.00 0.00 C ATOM 560 CE LYS A 405 -7.078 13.067 -15.527 1.00 0.00 C ATOM 561 NZ LYS A 405 -6.904 12.955 -16.988 1.00 0.00 N ATOM 0 H LYS A 405 -10.544 12.621 -12.145 1.00 0.00 H new ATOM 0 HA LYS A 405 -10.460 10.884 -14.349 1.00 0.00 H new ATOM 0 HB2 LYS A 405 -8.843 10.949 -11.780 1.00 0.00 H new ATOM 0 HB3 LYS A 405 -8.438 9.984 -13.187 1.00 0.00 H new ATOM 0 HG2 LYS A 405 -8.679 13.024 -13.223 1.00 0.00 H new ATOM 0 HG3 LYS A 405 -7.168 12.163 -13.008 1.00 0.00 H new ATOM 0 HD2 LYS A 405 -7.613 10.993 -15.242 1.00 0.00 H new ATOM 0 HD3 LYS A 405 -8.987 12.058 -15.460 1.00 0.00 H new ATOM 0 HE2 LYS A 405 -7.485 14.048 -15.282 1.00 0.00 H new ATOM 0 HE3 LYS A 405 -6.107 12.993 -15.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 405 -6.269 13.708 -17.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 405 -6.493 12.028 -17.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 405 -7.828 13.050 -17.456 1.00 0.00 H new ATOM 575 N ILE A 406 -11.209 9.437 -11.440 1.00 0.00 N ATOM 576 CA ILE A 406 -11.813 8.269 -10.808 1.00 0.00 C ATOM 577 C ILE A 406 -13.145 7.916 -11.481 1.00 0.00 C ATOM 578 O ILE A 406 -13.331 6.785 -11.927 1.00 0.00 O ATOM 579 CB ILE A 406 -11.940 8.520 -9.290 1.00 0.00 C ATOM 580 CG1 ILE A 406 -10.535 8.544 -8.655 1.00 0.00 C ATOM 581 CG2 ILE A 406 -12.806 7.440 -8.624 1.00 0.00 C ATOM 582 CD1 ILE A 406 -10.495 9.171 -7.258 1.00 0.00 C ATOM 0 H ILE A 406 -10.911 10.149 -10.773 1.00 0.00 H new ATOM 0 HA ILE A 406 -11.174 7.396 -10.940 1.00 0.00 H new ATOM 0 HB ILE A 406 -12.427 9.483 -9.134 1.00 0.00 H new ATOM 0 HG12 ILE A 406 -10.157 7.523 -8.595 1.00 0.00 H new ATOM 0 HG13 ILE A 406 -9.861 9.096 -9.310 1.00 0.00 H new ATOM 0 HG21 ILE A 406 -12.879 7.640 -7.555 1.00 0.00 H new ATOM 0 HG22 ILE A 406 -13.803 7.450 -9.064 1.00 0.00 H new ATOM 0 HG23 ILE A 406 -12.351 6.462 -8.779 1.00 0.00 H new ATOM 0 HD11 ILE A 406 -9.473 9.151 -6.879 1.00 0.00 H new ATOM 0 HD12 ILE A 406 -10.841 10.203 -7.312 1.00 0.00 H new ATOM 0 HD13 ILE A 406 -11.142 8.606 -6.587 1.00 0.00 H new ATOM 594 N LEU A 407 -14.058 8.889 -11.559 1.00 0.00 N ATOM 595 CA LEU A 407 -15.379 8.740 -12.156 1.00 0.00 C ATOM 596 C LEU A 407 -15.316 8.465 -13.663 1.00 0.00 C ATOM 597 O LEU A 407 -16.148 7.728 -14.188 1.00 0.00 O ATOM 598 CB LEU A 407 -16.193 10.005 -11.842 1.00 0.00 C ATOM 599 CG LEU A 407 -17.637 10.001 -12.375 1.00 0.00 C ATOM 600 CD1 LEU A 407 -18.449 8.810 -11.853 1.00 0.00 C ATOM 601 CD2 LEU A 407 -18.328 11.302 -11.950 1.00 0.00 C ATOM 0 H LEU A 407 -13.889 9.827 -11.197 1.00 0.00 H new ATOM 0 HA LEU A 407 -15.868 7.867 -11.724 1.00 0.00 H new ATOM 0 HB2 LEU A 407 -16.222 10.141 -10.761 1.00 0.00 H new ATOM 0 HB3 LEU A 407 -15.671 10.867 -12.258 1.00 0.00 H new ATOM 0 HG LEU A 407 -17.589 9.917 -13.461 1.00 0.00 H new ATOM 0 HD11 LEU A 407 -19.460 8.853 -12.258 1.00 0.00 H new ATOM 0 HD12 LEU A 407 -17.973 7.880 -12.165 1.00 0.00 H new ATOM 0 HD13 LEU A 407 -18.492 8.848 -10.765 1.00 0.00 H new ATOM 0 HD21 LEU A 407 -19.352 11.309 -12.323 1.00 0.00 H new ATOM 0 HD22 LEU A 407 -18.338 11.370 -10.862 1.00 0.00 H new ATOM 0 HD23 LEU A 407 -17.786 12.153 -12.362 1.00 0.00 H new ATOM 613 N LEU A 408 -14.348 9.057 -14.374 1.00 0.00 N ATOM 614 CA LEU A 408 -14.206 8.882 -15.814 1.00 0.00 C ATOM 615 C LEU A 408 -13.756 7.458 -16.134 1.00 0.00 C ATOM 616 O LEU A 408 -14.364 6.784 -16.962 1.00 0.00 O ATOM 617 CB LEU A 408 -13.216 9.923 -16.361 1.00 0.00 C ATOM 618 CG LEU A 408 -12.891 9.776 -17.856 1.00 0.00 C ATOM 619 CD1 LEU A 408 -14.138 9.950 -18.732 1.00 0.00 C ATOM 620 CD2 LEU A 408 -11.845 10.828 -18.242 1.00 0.00 C ATOM 0 H LEU A 408 -13.644 9.670 -13.962 1.00 0.00 H new ATOM 0 HA LEU A 408 -15.170 9.037 -16.298 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -13.624 10.919 -16.188 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -12.288 9.856 -15.793 1.00 0.00 H new ATOM 0 HG LEU A 408 -12.507 8.770 -18.024 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -13.864 9.839 -19.781 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -14.877 9.194 -18.468 1.00 0.00 H new ATOM 0 HD13 LEU A 408 -14.560 10.942 -18.571 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -11.607 10.733 -19.301 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -12.242 11.824 -18.048 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -10.941 10.676 -17.652 1.00 0.00 H new ATOM 632 N HIS A 409 -12.678 7.013 -15.484 1.00 0.00 N ATOM 633 CA HIS A 409 -12.106 5.694 -15.686 1.00 0.00 C ATOM 634 C HIS A 409 -13.053 4.598 -15.204 1.00 0.00 C ATOM 635 O HIS A 409 -13.327 3.660 -15.950 1.00 0.00 O ATOM 636 CB HIS A 409 -10.750 5.607 -14.977 1.00 0.00 C ATOM 637 CG HIS A 409 -9.743 6.612 -15.478 1.00 0.00 C ATOM 638 ND1 HIS A 409 -9.391 6.715 -16.814 1.00 0.00 N ATOM 639 CD2 HIS A 409 -9.001 7.575 -14.837 1.00 0.00 C ATOM 640 CE1 HIS A 409 -8.483 7.702 -16.915 1.00 0.00 C ATOM 641 NE2 HIS A 409 -8.201 8.269 -15.740 1.00 0.00 N ATOM 0 H HIS A 409 -12.176 7.572 -14.794 1.00 0.00 H new ATOM 0 HA HIS A 409 -11.955 5.538 -16.754 1.00 0.00 H new ATOM 0 HB2 HIS A 409 -10.898 5.755 -13.907 1.00 0.00 H new ATOM 0 HB3 HIS A 409 -10.345 4.603 -15.107 1.00 0.00 H new ATOM 0 HD1 HIS A 409 -9.754 6.147 -17.580 1.00 0.00 H new ATOM 0 HD2 HIS A 409 -9.034 7.767 -13.775 1.00 0.00 H new ATOM 0 HE1 HIS A 409 -8.030 8.004 -17.848 1.00 0.00 H new ATOM 649 N TYR A 410 -13.535 4.705 -13.960 1.00 0.00 N ATOM 650 CA TYR A 410 -14.425 3.724 -13.356 1.00 0.00 C ATOM 651 C TYR A 410 -15.827 4.315 -13.190 1.00 0.00 C ATOM 652 O TYR A 410 -15.992 5.328 -12.515 1.00 0.00 O ATOM 653 CB TYR A 410 -13.865 3.295 -11.993 1.00 0.00 C ATOM 654 CG TYR A 410 -12.433 2.785 -11.929 1.00 0.00 C ATOM 655 CD1 TYR A 410 -11.807 2.179 -13.040 1.00 0.00 C ATOM 656 CD2 TYR A 410 -11.716 2.915 -10.723 1.00 0.00 C ATOM 657 CE1 TYR A 410 -10.484 1.714 -12.941 1.00 0.00 C ATOM 658 CE2 TYR A 410 -10.396 2.444 -10.628 1.00 0.00 C ATOM 659 CZ TYR A 410 -9.778 1.845 -11.734 1.00 0.00 C ATOM 660 OH TYR A 410 -8.495 1.392 -11.630 1.00 0.00 O ATOM 0 H TYR A 410 -13.312 5.486 -13.343 1.00 0.00 H new ATOM 0 HA TYR A 410 -14.492 2.852 -14.006 1.00 0.00 H new ATOM 0 HB2 TYR A 410 -13.945 4.147 -11.318 1.00 0.00 H new ATOM 0 HB3 TYR A 410 -14.514 2.513 -11.598 1.00 0.00 H new ATOM 0 HD1 TYR A 410 -12.347 2.072 -13.969 1.00 0.00 H new ATOM 0 HD2 TYR A 410 -12.184 3.379 -9.867 1.00 0.00 H new ATOM 0 HE1 TYR A 410 -10.009 1.255 -13.795 1.00 0.00 H new ATOM 0 HE2 TYR A 410 -9.855 2.544 -9.699 1.00 0.00 H new ATOM 0 HH TYR A 410 -8.080 1.768 -10.826 1.00 0.00 H new ATOM 670 N LYS A 411 -16.837 3.676 -13.794 1.00 0.00 N ATOM 671 CA LYS A 411 -18.225 4.116 -13.701 1.00 0.00 C ATOM 672 C LYS A 411 -18.735 4.013 -12.259 1.00 0.00 C ATOM 673 O LYS A 411 -18.148 3.307 -11.447 1.00 0.00 O ATOM 674 CB LYS A 411 -19.114 3.256 -14.621 1.00 0.00 C ATOM 675 CG LYS A 411 -19.116 1.763 -14.235 1.00 0.00 C ATOM 676 CD LYS A 411 -20.437 1.079 -14.625 1.00 0.00 C ATOM 677 CE LYS A 411 -20.516 -0.365 -14.104 1.00 0.00 C ATOM 678 NZ LYS A 411 -20.601 -0.433 -12.630 1.00 0.00 N ATOM 0 H LYS A 411 -16.709 2.838 -14.361 1.00 0.00 H new ATOM 0 HA LYS A 411 -18.272 5.158 -14.016 1.00 0.00 H new ATOM 0 HB2 LYS A 411 -20.135 3.635 -14.588 1.00 0.00 H new ATOM 0 HB3 LYS A 411 -18.769 3.359 -15.650 1.00 0.00 H new ATOM 0 HG2 LYS A 411 -18.285 1.258 -14.728 1.00 0.00 H new ATOM 0 HG3 LYS A 411 -18.958 1.664 -13.161 1.00 0.00 H new ATOM 0 HD2 LYS A 411 -21.274 1.654 -14.227 1.00 0.00 H new ATOM 0 HD3 LYS A 411 -20.538 1.078 -15.710 1.00 0.00 H new ATOM 0 HE2 LYS A 411 -21.387 -0.857 -14.538 1.00 0.00 H new ATOM 0 HE3 LYS A 411 -19.638 -0.917 -14.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 411 -19.848 -1.051 -12.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 411 -20.488 0.521 -12.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 411 -21.527 -0.816 -12.353 1.00 0.00 H new ATOM 692 N PHE A 412 -19.851 4.681 -11.950 1.00 0.00 N ATOM 693 CA PHE A 412 -20.491 4.626 -10.643 1.00 0.00 C ATOM 694 C PHE A 412 -22.005 4.689 -10.836 1.00 0.00 C ATOM 695 O PHE A 412 -22.496 5.266 -11.805 1.00 0.00 O ATOM 696 CB PHE A 412 -20.040 5.767 -9.724 1.00 0.00 C ATOM 697 CG PHE A 412 -18.719 5.562 -9.006 1.00 0.00 C ATOM 698 CD1 PHE A 412 -17.509 5.859 -9.656 1.00 0.00 C ATOM 699 CD2 PHE A 412 -18.697 5.076 -7.683 1.00 0.00 C ATOM 700 CE1 PHE A 412 -16.285 5.675 -8.993 1.00 0.00 C ATOM 701 CE2 PHE A 412 -17.472 4.893 -7.019 1.00 0.00 C ATOM 702 CZ PHE A 412 -16.265 5.194 -7.672 1.00 0.00 C ATOM 0 H PHE A 412 -20.338 5.282 -12.615 1.00 0.00 H new ATOM 0 HA PHE A 412 -20.199 3.692 -10.162 1.00 0.00 H new ATOM 0 HB2 PHE A 412 -19.970 6.679 -10.317 1.00 0.00 H new ATOM 0 HB3 PHE A 412 -20.815 5.932 -8.976 1.00 0.00 H new ATOM 0 HD1 PHE A 412 -17.521 6.230 -10.670 1.00 0.00 H new ATOM 0 HD2 PHE A 412 -19.623 4.844 -7.179 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -15.358 5.903 -9.498 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -17.458 4.520 -6.005 1.00 0.00 H new ATOM 0 HZ PHE A 412 -15.324 5.056 -7.160 1.00 0.00 H new ATOM 712 N ASN A 413 -22.737 4.094 -9.892 1.00 0.00 N ATOM 713 CA ASN A 413 -24.190 4.045 -9.873 1.00 0.00 C ATOM 714 C ASN A 413 -24.762 5.368 -9.357 1.00 0.00 C ATOM 715 O ASN A 413 -25.269 5.449 -8.239 1.00 0.00 O ATOM 716 CB ASN A 413 -24.680 2.824 -9.072 1.00 0.00 C ATOM 717 CG ASN A 413 -24.136 2.745 -7.645 1.00 0.00 C ATOM 718 OD1 ASN A 413 -23.166 3.414 -7.303 1.00 0.00 O ATOM 719 ND2 ASN A 413 -24.748 1.913 -6.805 1.00 0.00 N ATOM 0 H ASN A 413 -22.314 3.618 -9.095 1.00 0.00 H new ATOM 0 HA ASN A 413 -24.561 3.918 -10.890 1.00 0.00 H new ATOM 0 HB2 ASN A 413 -25.769 2.844 -9.032 1.00 0.00 H new ATOM 0 HB3 ASN A 413 -24.397 1.917 -9.606 1.00 0.00 H new ATOM 0 HD21 ASN A 413 -24.413 1.818 -5.846 1.00 0.00 H new ATOM 0 HD22 ASN A 413 -25.552 1.371 -7.120 1.00 0.00 H new ATOM 726 N ASN A 414 -24.687 6.404 -10.199 1.00 0.00 N ATOM 727 CA ASN A 414 -25.203 7.743 -9.938 1.00 0.00 C ATOM 728 C ASN A 414 -24.567 8.397 -8.708 1.00 0.00 C ATOM 729 O ASN A 414 -25.254 8.691 -7.732 1.00 0.00 O ATOM 730 CB ASN A 414 -26.740 7.730 -9.848 1.00 0.00 C ATOM 731 CG ASN A 414 -27.387 7.113 -11.085 1.00 0.00 C ATOM 732 OD1 ASN A 414 -27.791 5.954 -11.066 1.00 0.00 O ATOM 733 ND2 ASN A 414 -27.492 7.885 -12.167 1.00 0.00 N ATOM 0 H ASN A 414 -24.247 6.325 -11.116 1.00 0.00 H new ATOM 0 HA ASN A 414 -24.918 8.364 -10.787 1.00 0.00 H new ATOM 0 HB2 ASN A 414 -27.045 7.171 -8.964 1.00 0.00 H new ATOM 0 HB3 ASN A 414 -27.103 8.750 -9.721 1.00 0.00 H new ATOM 0 HD21 ASN A 414 -27.920 7.517 -13.017 1.00 0.00 H new ATOM 0 HD22 ASN A 414 -27.145 8.844 -12.145 1.00 0.00 H new ATOM 740 N ARG A 415 -23.254 8.645 -8.773 1.00 0.00 N ATOM 741 CA ARG A 415 -22.475 9.309 -7.730 1.00 0.00 C ATOM 742 C ARG A 415 -21.952 10.630 -8.297 1.00 0.00 C ATOM 743 O ARG A 415 -22.001 10.857 -9.505 1.00 0.00 O ATOM 744 CB ARG A 415 -21.300 8.430 -7.282 1.00 0.00 C ATOM 745 CG ARG A 415 -21.607 7.517 -6.089 1.00 0.00 C ATOM 746 CD ARG A 415 -22.793 6.571 -6.291 1.00 0.00 C ATOM 747 NE ARG A 415 -22.913 5.656 -5.149 1.00 0.00 N ATOM 748 CZ ARG A 415 -24.018 4.982 -4.790 1.00 0.00 C ATOM 749 NH1 ARG A 415 -25.136 5.013 -5.524 1.00 0.00 N ATOM 750 NH2 ARG A 415 -24.010 4.263 -3.670 1.00 0.00 N ATOM 0 H ARG A 415 -22.689 8.379 -9.580 1.00 0.00 H new ATOM 0 HA ARG A 415 -23.106 9.489 -6.860 1.00 0.00 H new ATOM 0 HB2 ARG A 415 -20.983 7.813 -8.123 1.00 0.00 H new ATOM 0 HB3 ARG A 415 -20.459 9.074 -7.024 1.00 0.00 H new ATOM 0 HG2 ARG A 415 -20.721 6.923 -5.867 1.00 0.00 H new ATOM 0 HG3 ARG A 415 -21.801 8.138 -5.215 1.00 0.00 H new ATOM 0 HD2 ARG A 415 -23.712 7.147 -6.403 1.00 0.00 H new ATOM 0 HD3 ARG A 415 -22.660 6.001 -7.211 1.00 0.00 H new ATOM 0 HE ARG A 415 -22.081 5.520 -4.575 1.00 0.00 H new ATOM 0 HH11 ARG A 415 -25.166 5.560 -6.384 1.00 0.00 H new ATOM 0 HH12 ARG A 415 -25.958 4.490 -5.223 1.00 0.00 H new ATOM 0 HH21 ARG A 415 -23.170 4.227 -3.093 1.00 0.00 H new ATOM 0 HH22 ARG A 415 -24.844 3.748 -3.389 1.00 0.00 H new ATOM 764 N THR A 416 -21.448 11.494 -7.412 1.00 0.00 N ATOM 765 CA THR A 416 -20.898 12.798 -7.747 1.00 0.00 C ATOM 766 C THR A 416 -19.552 12.976 -7.051 1.00 0.00 C ATOM 767 O THR A 416 -19.234 12.254 -6.105 1.00 0.00 O ATOM 768 CB THR A 416 -21.864 13.896 -7.274 1.00 0.00 C ATOM 769 OG1 THR A 416 -21.961 13.867 -5.862 1.00 0.00 O ATOM 770 CG2 THR A 416 -23.258 13.743 -7.890 1.00 0.00 C ATOM 0 H THR A 416 -21.413 11.293 -6.413 1.00 0.00 H new ATOM 0 HA THR A 416 -20.763 12.869 -8.826 1.00 0.00 H new ATOM 0 HB THR A 416 -21.462 14.854 -7.604 1.00 0.00 H new ATOM 0 HG1 THR A 416 -22.576 14.569 -5.562 1.00 0.00 H new ATOM 0 HG21 THR A 416 -23.906 14.541 -7.527 1.00 0.00 H new ATOM 0 HG22 THR A 416 -23.184 13.801 -8.976 1.00 0.00 H new ATOM 0 HG23 THR A 416 -23.677 12.778 -7.606 1.00 0.00 H new ATOM 778 N SER A 417 -18.775 13.966 -7.500 1.00 0.00 N ATOM 779 CA SER A 417 -17.493 14.305 -6.901 1.00 0.00 C ATOM 780 C SER A 417 -17.701 14.640 -5.421 1.00 0.00 C ATOM 781 O SER A 417 -16.849 14.332 -4.590 1.00 0.00 O ATOM 782 CB SER A 417 -16.883 15.483 -7.665 1.00 0.00 C ATOM 783 OG SER A 417 -17.843 16.512 -7.812 1.00 0.00 O ATOM 0 H SER A 417 -19.025 14.555 -8.295 1.00 0.00 H new ATOM 0 HA SER A 417 -16.804 13.463 -6.963 1.00 0.00 H new ATOM 0 HB2 SER A 417 -16.011 15.861 -7.131 1.00 0.00 H new ATOM 0 HB3 SER A 417 -16.539 15.153 -8.645 1.00 0.00 H new ATOM 0 HG SER A 417 -17.445 17.263 -8.300 1.00 0.00 H new ATOM 789 N VAL A 418 -18.846 15.256 -5.098 1.00 0.00 N ATOM 790 CA VAL A 418 -19.230 15.617 -3.744 1.00 0.00 C ATOM 791 C VAL A 418 -19.361 14.343 -2.906 1.00 0.00 C ATOM 792 O VAL A 418 -18.743 14.247 -1.848 1.00 0.00 O ATOM 793 CB VAL A 418 -20.529 16.443 -3.756 1.00 0.00 C ATOM 794 CG1 VAL A 418 -20.943 16.832 -2.331 1.00 0.00 C ATOM 795 CG2 VAL A 418 -20.356 17.722 -4.585 1.00 0.00 C ATOM 0 H VAL A 418 -19.542 15.520 -5.795 1.00 0.00 H new ATOM 0 HA VAL A 418 -18.463 16.245 -3.292 1.00 0.00 H new ATOM 0 HB VAL A 418 -21.304 15.821 -4.203 1.00 0.00 H new ATOM 0 HG11 VAL A 418 -21.863 17.415 -2.366 1.00 0.00 H new ATOM 0 HG12 VAL A 418 -21.107 15.930 -1.741 1.00 0.00 H new ATOM 0 HG13 VAL A 418 -20.154 17.427 -1.873 1.00 0.00 H new ATOM 0 HG21 VAL A 418 -21.287 18.289 -4.578 1.00 0.00 H new ATOM 0 HG22 VAL A 418 -19.559 18.329 -4.156 1.00 0.00 H new ATOM 0 HG23 VAL A 418 -20.099 17.459 -5.611 1.00 0.00 H new ATOM 805 N MET A 419 -20.150 13.367 -3.376 1.00 0.00 N ATOM 806 CA MET A 419 -20.335 12.105 -2.666 1.00 0.00 C ATOM 807 C MET A 419 -18.988 11.413 -2.455 1.00 0.00 C ATOM 808 O MET A 419 -18.672 11.007 -1.337 1.00 0.00 O ATOM 809 CB MET A 419 -21.298 11.190 -3.435 1.00 0.00 C ATOM 810 CG MET A 419 -22.746 11.692 -3.394 1.00 0.00 C ATOM 811 SD MET A 419 -23.538 11.570 -1.770 1.00 0.00 S ATOM 812 CE MET A 419 -25.178 12.214 -2.186 1.00 0.00 C ATOM 0 H MET A 419 -20.671 13.433 -4.250 1.00 0.00 H new ATOM 0 HA MET A 419 -20.772 12.317 -1.690 1.00 0.00 H new ATOM 0 HB2 MET A 419 -20.972 11.116 -4.473 1.00 0.00 H new ATOM 0 HB3 MET A 419 -21.253 10.186 -3.014 1.00 0.00 H new ATOM 0 HG2 MET A 419 -22.765 12.733 -3.716 1.00 0.00 H new ATOM 0 HG3 MET A 419 -23.335 11.124 -4.115 1.00 0.00 H new ATOM 0 HE1 MET A 419 -25.806 12.212 -1.295 1.00 0.00 H new ATOM 0 HE2 MET A 419 -25.084 13.233 -2.561 1.00 0.00 H new ATOM 0 HE3 MET A 419 -25.632 11.586 -2.952 1.00 0.00 H new ATOM 822 N LEU A 420 -18.197 11.283 -3.528 1.00 0.00 N ATOM 823 CA LEU A 420 -16.886 10.649 -3.484 1.00 0.00 C ATOM 824 C LEU A 420 -15.989 11.306 -2.432 1.00 0.00 C ATOM 825 O LEU A 420 -15.499 10.625 -1.532 1.00 0.00 O ATOM 826 CB LEU A 420 -16.205 10.697 -4.867 1.00 0.00 C ATOM 827 CG LEU A 420 -16.468 9.452 -5.729 1.00 0.00 C ATOM 828 CD1 LEU A 420 -17.915 9.343 -6.215 1.00 0.00 C ATOM 829 CD2 LEU A 420 -15.539 9.452 -6.948 1.00 0.00 C ATOM 0 H LEU A 420 -18.457 11.620 -4.455 1.00 0.00 H new ATOM 0 HA LEU A 420 -17.035 9.606 -3.205 1.00 0.00 H new ATOM 0 HB2 LEU A 420 -16.554 11.580 -5.403 1.00 0.00 H new ATOM 0 HB3 LEU A 420 -15.130 10.812 -4.729 1.00 0.00 H new ATOM 0 HG LEU A 420 -16.272 8.593 -5.087 1.00 0.00 H new ATOM 0 HD11 LEU A 420 -18.030 8.442 -6.817 1.00 0.00 H new ATOM 0 HD12 LEU A 420 -18.584 9.293 -5.356 1.00 0.00 H new ATOM 0 HD13 LEU A 420 -18.163 10.216 -6.818 1.00 0.00 H new ATOM 0 HD21 LEU A 420 -15.732 8.566 -7.553 1.00 0.00 H new ATOM 0 HD22 LEU A 420 -15.722 10.346 -7.545 1.00 0.00 H new ATOM 0 HD23 LEU A 420 -14.501 9.444 -6.615 1.00 0.00 H new ATOM 841 N LYS A 421 -15.759 12.619 -2.550 1.00 0.00 N ATOM 842 CA LYS A 421 -14.885 13.344 -1.639 1.00 0.00 C ATOM 843 C LYS A 421 -15.353 13.292 -0.190 1.00 0.00 C ATOM 844 O LYS A 421 -14.542 13.049 0.699 1.00 0.00 O ATOM 845 CB LYS A 421 -14.621 14.781 -2.130 1.00 0.00 C ATOM 846 CG LYS A 421 -15.628 15.827 -1.647 1.00 0.00 C ATOM 847 CD LYS A 421 -15.314 17.212 -2.222 1.00 0.00 C ATOM 848 CE LYS A 421 -16.379 18.253 -1.839 1.00 0.00 C ATOM 849 NZ LYS A 421 -16.593 18.346 -0.380 1.00 0.00 N ATOM 0 H LYS A 421 -16.174 13.200 -3.278 1.00 0.00 H new ATOM 0 HA LYS A 421 -13.927 12.823 -1.648 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -13.625 15.082 -1.806 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -14.615 14.781 -3.220 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -16.634 15.529 -1.941 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -15.614 15.872 -0.558 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -14.340 17.541 -1.861 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -15.246 17.146 -3.308 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -16.079 19.229 -2.220 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -17.321 17.997 -2.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -17.231 19.141 -0.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -17.018 17.462 -0.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -15.681 18.501 0.095 1.00 0.00 H new ATOM 863 N ASP A 422 -16.645 13.537 0.056 1.00 0.00 N ATOM 864 CA ASP A 422 -17.193 13.547 1.402 1.00 0.00 C ATOM 865 C ASP A 422 -17.032 12.179 2.056 1.00 0.00 C ATOM 866 O ASP A 422 -16.468 12.068 3.146 1.00 0.00 O ATOM 867 CB ASP A 422 -18.658 13.985 1.361 1.00 0.00 C ATOM 868 CG ASP A 422 -19.211 14.111 2.774 1.00 0.00 C ATOM 869 OD1 ASP A 422 -19.073 15.221 3.333 1.00 0.00 O ATOM 870 OD2 ASP A 422 -19.737 13.093 3.271 1.00 0.00 O ATOM 0 H ASP A 422 -17.331 13.732 -0.673 1.00 0.00 H new ATOM 0 HA ASP A 422 -16.642 14.264 2.010 1.00 0.00 H new ATOM 0 HB2 ASP A 422 -18.745 14.940 0.843 1.00 0.00 H new ATOM 0 HB3 ASP A 422 -19.246 13.261 0.796 1.00 0.00 H new ATOM 875 N ARG A 423 -17.522 11.135 1.381 1.00 0.00 N ATOM 876 CA ARG A 423 -17.441 9.776 1.878 1.00 0.00 C ATOM 877 C ARG A 423 -15.993 9.370 2.141 1.00 0.00 C ATOM 878 O ARG A 423 -15.684 8.860 3.218 1.00 0.00 O ATOM 879 CB ARG A 423 -18.113 8.813 0.906 1.00 0.00 C ATOM 880 CG ARG A 423 -18.147 7.414 1.534 1.00 0.00 C ATOM 881 CD ARG A 423 -19.478 6.758 1.188 1.00 0.00 C ATOM 882 NE ARG A 423 -19.620 5.400 1.735 1.00 0.00 N ATOM 883 CZ ARG A 423 -18.914 4.316 1.372 1.00 0.00 C ATOM 884 NH1 ARG A 423 -17.945 4.407 0.455 1.00 0.00 N ATOM 885 NH2 ARG A 423 -19.187 3.129 1.924 1.00 0.00 N ATOM 0 H ARG A 423 -17.984 11.218 0.476 1.00 0.00 H new ATOM 0 HA ARG A 423 -17.972 9.729 2.829 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -19.125 9.150 0.681 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -17.568 8.789 -0.038 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -17.320 6.811 1.160 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -18.028 7.482 2.615 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -20.290 7.380 1.565 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -19.584 6.718 0.104 1.00 0.00 H new ATOM 0 HE ARG A 423 -20.324 5.268 2.461 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -17.735 5.307 0.023 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -17.416 3.577 0.188 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -19.930 3.048 2.619 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -18.653 2.304 1.650 1.00 0.00 H new ATOM 899 N TRP A 424 -15.104 9.587 1.164 1.00 0.00 N ATOM 900 CA TRP A 424 -13.709 9.225 1.300 1.00 0.00 C ATOM 901 C TRP A 424 -13.054 9.971 2.455 1.00 0.00 C ATOM 902 O TRP A 424 -12.369 9.356 3.267 1.00 0.00 O ATOM 903 CB TRP A 424 -12.967 9.485 -0.008 1.00 0.00 C ATOM 904 CG TRP A 424 -11.595 8.903 -0.016 1.00 0.00 C ATOM 905 CD1 TRP A 424 -10.449 9.609 0.044 1.00 0.00 C ATOM 906 CD2 TRP A 424 -11.204 7.500 -0.078 1.00 0.00 C ATOM 907 NE1 TRP A 424 -9.371 8.749 0.019 1.00 0.00 N ATOM 908 CE2 TRP A 424 -9.783 7.433 -0.053 1.00 0.00 C ATOM 909 CE3 TRP A 424 -11.906 6.276 -0.150 1.00 0.00 C ATOM 910 CZ2 TRP A 424 -9.090 6.214 -0.104 1.00 0.00 C ATOM 911 CZ3 TRP A 424 -11.221 5.048 -0.200 1.00 0.00 C ATOM 912 CH2 TRP A 424 -9.818 5.017 -0.178 1.00 0.00 C ATOM 0 H TRP A 424 -15.340 10.015 0.269 1.00 0.00 H new ATOM 0 HA TRP A 424 -13.654 8.160 1.525 1.00 0.00 H new ATOM 0 HB2 TRP A 424 -13.540 9.066 -0.835 1.00 0.00 H new ATOM 0 HB3 TRP A 424 -12.902 10.560 -0.177 1.00 0.00 H new ATOM 0 HD1 TRP A 424 -10.384 10.685 0.103 1.00 0.00 H new ATOM 0 HE1 TRP A 424 -8.396 9.047 0.050 1.00 0.00 H new ATOM 0 HE3 TRP A 424 -12.986 6.283 -0.167 1.00 0.00 H new ATOM 0 HZ2 TRP A 424 -8.010 6.197 -0.087 1.00 0.00 H new ATOM 0 HZ3 TRP A 424 -11.778 4.124 -0.256 1.00 0.00 H new ATOM 0 HH2 TRP A 424 -9.298 4.071 -0.218 1.00 0.00 H new ATOM 923 N ARG A 425 -13.264 11.289 2.537 1.00 0.00 N ATOM 924 CA ARG A 425 -12.708 12.118 3.594 1.00 0.00 C ATOM 925 C ARG A 425 -13.141 11.575 4.955 1.00 0.00 C ATOM 926 O ARG A 425 -12.307 11.434 5.851 1.00 0.00 O ATOM 927 CB ARG A 425 -13.151 13.576 3.401 1.00 0.00 C ATOM 928 CG ARG A 425 -12.714 14.544 4.513 1.00 0.00 C ATOM 929 CD ARG A 425 -11.194 14.729 4.615 1.00 0.00 C ATOM 930 NE ARG A 425 -10.535 13.591 5.274 1.00 0.00 N ATOM 931 CZ ARG A 425 -9.207 13.462 5.429 1.00 0.00 C ATOM 932 NH1 ARG A 425 -8.378 14.417 4.991 1.00 0.00 N ATOM 933 NH2 ARG A 425 -8.716 12.372 6.032 1.00 0.00 N ATOM 0 H ARG A 425 -13.829 11.807 1.864 1.00 0.00 H new ATOM 0 HA ARG A 425 -11.619 12.091 3.551 1.00 0.00 H new ATOM 0 HB2 ARG A 425 -12.756 13.937 2.451 1.00 0.00 H new ATOM 0 HB3 ARG A 425 -14.238 13.602 3.325 1.00 0.00 H new ATOM 0 HG2 ARG A 425 -13.177 15.515 4.339 1.00 0.00 H new ATOM 0 HG3 ARG A 425 -13.090 14.178 5.468 1.00 0.00 H new ATOM 0 HD2 ARG A 425 -10.778 14.858 3.616 1.00 0.00 H new ATOM 0 HD3 ARG A 425 -10.978 15.642 5.170 1.00 0.00 H new ATOM 0 HE ARG A 425 -11.129 12.847 5.639 1.00 0.00 H new ATOM 0 HH11 ARG A 425 -8.754 15.249 4.536 1.00 0.00 H new ATOM 0 HH12 ARG A 425 -7.371 14.313 5.112 1.00 0.00 H new ATOM 0 HH21 ARG A 425 -9.349 11.647 6.370 1.00 0.00 H new ATOM 0 HH22 ARG A 425 -7.709 12.266 6.154 1.00 0.00 H new ATOM 947 N THR A 426 -14.438 11.276 5.095 1.00 0.00 N ATOM 948 CA THR A 426 -15.028 10.747 6.314 1.00 0.00 C ATOM 949 C THR A 426 -14.377 9.417 6.698 1.00 0.00 C ATOM 950 O THR A 426 -13.840 9.293 7.798 1.00 0.00 O ATOM 951 CB THR A 426 -16.551 10.638 6.146 1.00 0.00 C ATOM 952 OG1 THR A 426 -17.076 11.924 5.895 1.00 0.00 O ATOM 953 CG2 THR A 426 -17.227 10.089 7.405 1.00 0.00 C ATOM 0 H THR A 426 -15.115 11.401 4.343 1.00 0.00 H new ATOM 0 HA THR A 426 -14.838 11.431 7.141 1.00 0.00 H new ATOM 0 HB THR A 426 -16.746 9.955 5.320 1.00 0.00 H new ATOM 0 HG1 THR A 426 -16.946 12.152 4.951 1.00 0.00 H new ATOM 0 HG21 THR A 426 -18.303 10.028 7.243 1.00 0.00 H new ATOM 0 HG22 THR A 426 -16.836 9.095 7.624 1.00 0.00 H new ATOM 0 HG23 THR A 426 -17.024 10.752 8.246 1.00 0.00 H new ATOM 961 N MET A 427 -14.419 8.429 5.801 1.00 0.00 N ATOM 962 CA MET A 427 -13.840 7.117 6.048 1.00 0.00 C ATOM 963 C MET A 427 -12.362 7.231 6.422 1.00 0.00 C ATOM 964 O MET A 427 -11.930 6.682 7.433 1.00 0.00 O ATOM 965 CB MET A 427 -14.008 6.225 4.811 1.00 0.00 C ATOM 966 CG MET A 427 -15.464 5.787 4.617 1.00 0.00 C ATOM 967 SD MET A 427 -15.792 4.821 3.116 1.00 0.00 S ATOM 968 CE MET A 427 -14.770 3.360 3.432 1.00 0.00 C ATOM 0 H MET A 427 -14.857 8.521 4.884 1.00 0.00 H new ATOM 0 HA MET A 427 -14.367 6.664 6.887 1.00 0.00 H new ATOM 0 HB2 MET A 427 -13.670 6.764 3.926 1.00 0.00 H new ATOM 0 HB3 MET A 427 -13.374 5.344 4.910 1.00 0.00 H new ATOM 0 HG2 MET A 427 -15.767 5.197 5.482 1.00 0.00 H new ATOM 0 HG3 MET A 427 -16.094 6.676 4.602 1.00 0.00 H new ATOM 0 HE1 MET A 427 -15.008 2.585 2.703 1.00 0.00 H new ATOM 0 HE2 MET A 427 -13.717 3.627 3.347 1.00 0.00 H new ATOM 0 HE3 MET A 427 -14.970 2.987 4.436 1.00 0.00 H new ATOM 978 N LYS A 428 -11.589 7.942 5.599 1.00 0.00 N ATOM 979 CA LYS A 428 -10.163 8.136 5.780 1.00 0.00 C ATOM 980 C LYS A 428 -9.838 8.767 7.136 1.00 0.00 C ATOM 981 O LYS A 428 -8.974 8.255 7.846 1.00 0.00 O ATOM 982 CB LYS A 428 -9.614 8.922 4.580 1.00 0.00 C ATOM 983 CG LYS A 428 -8.079 8.930 4.488 1.00 0.00 C ATOM 984 CD LYS A 428 -7.659 8.947 3.010 1.00 0.00 C ATOM 985 CE LYS A 428 -6.138 8.990 2.821 1.00 0.00 C ATOM 986 NZ LYS A 428 -5.628 10.374 2.747 1.00 0.00 N ATOM 0 H LYS A 428 -11.954 8.408 4.769 1.00 0.00 H new ATOM 0 HA LYS A 428 -9.658 7.170 5.805 1.00 0.00 H new ATOM 0 HB2 LYS A 428 -10.021 8.496 3.663 1.00 0.00 H new ATOM 0 HB3 LYS A 428 -9.970 9.951 4.639 1.00 0.00 H new ATOM 0 HG2 LYS A 428 -7.677 9.803 5.002 1.00 0.00 H new ATOM 0 HG3 LYS A 428 -7.669 8.051 4.984 1.00 0.00 H new ATOM 0 HD2 LYS A 428 -8.056 8.061 2.515 1.00 0.00 H new ATOM 0 HD3 LYS A 428 -8.105 9.813 2.521 1.00 0.00 H new ATOM 0 HE2 LYS A 428 -5.655 8.470 3.648 1.00 0.00 H new ATOM 0 HE3 LYS A 428 -5.871 8.456 1.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 -4.665 10.368 2.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 -6.248 10.940 2.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 -5.612 10.789 3.700 1.00 0.00 H new ATOM 1000 N LYS A 429 -10.512 9.864 7.521 1.00 0.00 N ATOM 1001 CA LYS A 429 -10.237 10.497 8.810 1.00 0.00 C ATOM 1002 C LYS A 429 -10.626 9.577 9.971 1.00 0.00 C ATOM 1003 O LYS A 429 -9.904 9.507 10.964 1.00 0.00 O ATOM 1004 CB LYS A 429 -10.828 11.913 8.927 1.00 0.00 C ATOM 1005 CG LYS A 429 -12.343 11.986 9.157 1.00 0.00 C ATOM 1006 CD LYS A 429 -12.777 13.454 9.278 1.00 0.00 C ATOM 1007 CE LYS A 429 -14.299 13.630 9.380 1.00 0.00 C ATOM 1008 NZ LYS A 429 -14.882 12.912 10.530 1.00 0.00 N ATOM 0 H LYS A 429 -11.237 10.319 6.966 1.00 0.00 H new ATOM 0 HA LYS A 429 -9.159 10.645 8.872 1.00 0.00 H new ATOM 0 HB2 LYS A 429 -10.329 12.428 9.748 1.00 0.00 H new ATOM 0 HB3 LYS A 429 -10.591 12.462 8.016 1.00 0.00 H new ATOM 0 HG2 LYS A 429 -12.870 11.508 8.331 1.00 0.00 H new ATOM 0 HG3 LYS A 429 -12.610 11.442 10.063 1.00 0.00 H new ATOM 0 HD2 LYS A 429 -12.307 13.893 10.158 1.00 0.00 H new ATOM 0 HD3 LYS A 429 -12.411 14.006 8.412 1.00 0.00 H new ATOM 0 HE2 LYS A 429 -14.533 14.691 9.464 1.00 0.00 H new ATOM 0 HE3 LYS A 429 -14.764 13.273 8.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 -15.902 13.107 10.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 -14.730 11.890 10.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 -14.425 13.233 11.407 1.00 0.00 H new ATOM 1022 N LEU A 430 -11.749 8.858 9.845 1.00 0.00 N ATOM 1023 CA LEU A 430 -12.215 7.928 10.868 1.00 0.00 C ATOM 1024 C LEU A 430 -11.455 6.591 10.833 1.00 0.00 C ATOM 1025 O LEU A 430 -11.811 5.674 11.568 1.00 0.00 O ATOM 1026 CB LEU A 430 -13.731 7.713 10.726 1.00 0.00 C ATOM 1027 CG LEU A 430 -14.576 8.977 10.956 1.00 0.00 C ATOM 1028 CD1 LEU A 430 -16.049 8.637 10.699 1.00 0.00 C ATOM 1029 CD2 LEU A 430 -14.424 9.534 12.376 1.00 0.00 C ATOM 0 H LEU A 430 -12.357 8.909 9.028 1.00 0.00 H new ATOM 0 HA LEU A 430 -12.009 8.371 11.842 1.00 0.00 H new ATOM 0 HB2 LEU A 430 -13.939 7.328 9.728 1.00 0.00 H new ATOM 0 HB3 LEU A 430 -14.045 6.947 11.435 1.00 0.00 H new ATOM 0 HG LEU A 430 -14.224 9.745 10.268 1.00 0.00 H new ATOM 0 HD11 LEU A 430 -16.661 9.525 10.859 1.00 0.00 H new ATOM 0 HD12 LEU A 430 -16.169 8.293 9.672 1.00 0.00 H new ATOM 0 HD13 LEU A 430 -16.366 7.850 11.384 1.00 0.00 H new ATOM 0 HD21 LEU A 430 -15.041 10.426 12.485 1.00 0.00 H new ATOM 0 HD22 LEU A 430 -14.742 8.782 13.098 1.00 0.00 H new ATOM 0 HD23 LEU A 430 -13.380 9.791 12.556 1.00 0.00 H new ATOM 1041 N LYS A 431 -10.407 6.474 10.002 1.00 0.00 N ATOM 1042 CA LYS A 431 -9.567 5.288 9.870 1.00 0.00 C ATOM 1043 C LYS A 431 -10.325 4.053 9.362 1.00 0.00 C ATOM 1044 O LYS A 431 -9.855 2.928 9.527 1.00 0.00 O ATOM 1045 CB LYS A 431 -8.813 5.000 11.182 1.00 0.00 C ATOM 1046 CG LYS A 431 -8.163 6.233 11.835 1.00 0.00 C ATOM 1047 CD LYS A 431 -7.110 6.888 10.930 1.00 0.00 C ATOM 1048 CE LYS A 431 -6.530 8.171 11.541 1.00 0.00 C ATOM 1049 NZ LYS A 431 -5.843 7.928 12.825 1.00 0.00 N ATOM 0 H LYS A 431 -10.117 7.233 9.385 1.00 0.00 H new ATOM 0 HA LYS A 431 -8.833 5.514 9.096 1.00 0.00 H new ATOM 0 HB2 LYS A 431 -9.507 4.553 11.893 1.00 0.00 H new ATOM 0 HB3 LYS A 431 -8.038 4.259 10.985 1.00 0.00 H new ATOM 0 HG2 LYS A 431 -8.936 6.963 12.076 1.00 0.00 H new ATOM 0 HG3 LYS A 431 -7.698 5.939 12.776 1.00 0.00 H new ATOM 0 HD2 LYS A 431 -6.302 6.180 10.745 1.00 0.00 H new ATOM 0 HD3 LYS A 431 -7.558 7.119 9.964 1.00 0.00 H new ATOM 0 HE2 LYS A 431 -5.829 8.619 10.837 1.00 0.00 H new ATOM 0 HE3 LYS A 431 -7.333 8.892 11.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 -5.398 8.809 13.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 -6.534 7.605 13.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 -5.113 7.198 12.696 1.00 0.00 H new ATOM 1063 N LEU A 432 -11.483 4.247 8.720 1.00 0.00 N ATOM 1064 CA LEU A 432 -12.286 3.161 8.172 1.00 0.00 C ATOM 1065 C LEU A 432 -11.658 2.588 6.896 1.00 0.00 C ATOM 1066 O LEU A 432 -12.124 1.565 6.398 1.00 0.00 O ATOM 1067 CB LEU A 432 -13.734 3.615 7.943 1.00 0.00 C ATOM 1068 CG LEU A 432 -14.398 4.192 9.205 1.00 0.00 C ATOM 1069 CD1 LEU A 432 -15.847 4.576 8.892 1.00 0.00 C ATOM 1070 CD2 LEU A 432 -14.383 3.205 10.380 1.00 0.00 C ATOM 0 H LEU A 432 -11.887 5.171 8.568 1.00 0.00 H new ATOM 0 HA LEU A 432 -12.307 2.354 8.904 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -13.751 4.368 7.155 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -14.321 2.768 7.587 1.00 0.00 H new ATOM 0 HG LEU A 432 -13.821 5.068 9.501 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -16.317 4.985 9.787 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -15.862 5.325 8.100 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -16.395 3.692 8.566 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -14.864 3.662 11.245 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -14.922 2.300 10.101 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -13.353 2.952 10.629 1.00 0.00 H new ATOM 1082 N ILE A 433 -10.592 3.216 6.379 1.00 0.00 N ATOM 1083 CA ILE A 433 -9.848 2.755 5.214 1.00 0.00 C ATOM 1084 C ILE A 433 -8.923 1.617 5.680 1.00 0.00 C ATOM 1085 O ILE A 433 -7.703 1.699 5.576 1.00 0.00 O ATOM 1086 CB ILE A 433 -9.123 3.945 4.545 1.00 0.00 C ATOM 1087 CG1 ILE A 433 -8.484 3.514 3.209 1.00 0.00 C ATOM 1088 CG2 ILE A 433 -8.114 4.665 5.462 1.00 0.00 C ATOM 1089 CD1 ILE A 433 -7.710 4.648 2.535 1.00 0.00 C ATOM 0 H ILE A 433 -10.220 4.079 6.775 1.00 0.00 H new ATOM 0 HA ILE A 433 -10.498 2.353 4.437 1.00 0.00 H new ATOM 0 HB ILE A 433 -9.891 4.691 4.338 1.00 0.00 H new ATOM 0 HG12 ILE A 433 -7.811 2.675 3.386 1.00 0.00 H new ATOM 0 HG13 ILE A 433 -9.264 3.160 2.535 1.00 0.00 H new ATOM 0 HG21 ILE A 433 -7.649 5.487 4.917 1.00 0.00 H new ATOM 0 HG22 ILE A 433 -8.633 5.057 6.337 1.00 0.00 H new ATOM 0 HG23 ILE A 433 -7.346 3.961 5.781 1.00 0.00 H new ATOM 0 HD11 ILE A 433 -7.281 4.290 1.599 1.00 0.00 H new ATOM 0 HD12 ILE A 433 -8.386 5.478 2.330 1.00 0.00 H new ATOM 0 HD13 ILE A 433 -6.911 4.985 3.195 1.00 0.00 H new ATOM 1101 N SER A 434 -9.521 0.549 6.221 1.00 0.00 N ATOM 1102 CA SER A 434 -8.825 -0.606 6.761 1.00 0.00 C ATOM 1103 C SER A 434 -9.389 -1.885 6.154 1.00 0.00 C ATOM 1104 O SER A 434 -10.274 -2.517 6.727 1.00 0.00 O ATOM 1105 CB SER A 434 -8.957 -0.608 8.288 1.00 0.00 C ATOM 1106 OG SER A 434 -8.373 0.558 8.835 1.00 0.00 O ATOM 0 H SER A 434 -10.535 0.471 6.293 1.00 0.00 H new ATOM 0 HA SER A 434 -7.767 -0.555 6.505 1.00 0.00 H new ATOM 0 HB2 SER A 434 -10.009 -0.661 8.568 1.00 0.00 H new ATOM 0 HB3 SER A 434 -8.472 -1.493 8.700 1.00 0.00 H new ATOM 0 HG SER A 434 -9.066 1.238 8.972 1.00 0.00 H new ATOM 1112 N SER A 435 -8.860 -2.273 4.992 1.00 0.00 N ATOM 1113 CA SER A 435 -9.238 -3.502 4.298 1.00 0.00 C ATOM 1114 C SER A 435 -8.059 -3.939 3.428 1.00 0.00 C ATOM 1115 O SER A 435 -8.237 -4.436 2.319 1.00 0.00 O ATOM 1116 CB SER A 435 -10.537 -3.342 3.492 1.00 0.00 C ATOM 1117 OG SER A 435 -11.422 -2.424 4.107 1.00 0.00 O ATOM 0 H SER A 435 -8.147 -1.734 4.501 1.00 0.00 H new ATOM 0 HA SER A 435 -9.456 -4.281 5.029 1.00 0.00 H new ATOM 0 HB2 SER A 435 -10.301 -3.001 2.484 1.00 0.00 H new ATOM 0 HB3 SER A 435 -11.027 -4.311 3.394 1.00 0.00 H new ATOM 0 HG SER A 435 -12.294 -2.462 3.662 1.00 0.00 H new ATOM 1123 N ASP A 436 -6.854 -3.726 3.963 1.00 0.00 N ATOM 1124 CA ASP A 436 -5.572 -4.032 3.355 1.00 0.00 C ATOM 1125 C ASP A 436 -4.757 -4.705 4.467 1.00 0.00 C ATOM 1126 O ASP A 436 -3.717 -4.201 4.890 1.00 0.00 O ATOM 1127 CB ASP A 436 -4.950 -2.723 2.833 1.00 0.00 C ATOM 1128 CG ASP A 436 -5.797 -2.038 1.760 1.00 0.00 C ATOM 1129 OD1 ASP A 436 -6.639 -1.189 2.130 1.00 0.00 O ATOM 1130 OD2 ASP A 436 -5.563 -2.303 0.563 1.00 0.00 O ATOM 0 H ASP A 436 -6.749 -3.310 4.888 1.00 0.00 H new ATOM 0 HA ASP A 436 -5.627 -4.698 2.494 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -4.810 -2.037 3.668 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -3.962 -2.935 2.425 1.00 0.00 H new ATOM 1135 N SER A 437 -5.290 -5.834 4.952 1.00 0.00 N ATOM 1136 CA SER A 437 -4.782 -6.653 6.046 1.00 0.00 C ATOM 1137 C SER A 437 -3.307 -7.052 5.932 1.00 0.00 C ATOM 1138 O SER A 437 -2.774 -7.186 4.832 1.00 0.00 O ATOM 1139 CB SER A 437 -5.640 -7.922 6.138 1.00 0.00 C ATOM 1140 OG SER A 437 -7.013 -7.594 6.028 1.00 0.00 O ATOM 0 H SER A 437 -6.148 -6.221 4.558 1.00 0.00 H new ATOM 0 HA SER A 437 -4.847 -6.037 6.943 1.00 0.00 H new ATOM 0 HB2 SER A 437 -5.360 -8.617 5.346 1.00 0.00 H new ATOM 0 HB3 SER A 437 -5.454 -8.427 7.086 1.00 0.00 H new ATOM 0 HG SER A 437 -7.550 -8.411 6.086 1.00 0.00 H new ATOM 1146 N GLU A 438 -2.675 -7.261 7.094 1.00 0.00 N ATOM 1147 CA GLU A 438 -1.289 -7.701 7.211 1.00 0.00 C ATOM 1148 C GLU A 438 -1.230 -9.221 7.028 1.00 0.00 C ATOM 1149 O GLU A 438 -0.291 -9.738 6.422 1.00 0.00 O ATOM 1150 CB GLU A 438 -0.684 -7.238 8.549 1.00 0.00 C ATOM 1151 CG GLU A 438 -1.385 -7.758 9.815 1.00 0.00 C ATOM 1152 CD GLU A 438 -0.729 -7.184 11.068 1.00 0.00 C ATOM 1153 OE1 GLU A 438 -1.172 -6.097 11.497 1.00 0.00 O ATOM 1154 OE2 GLU A 438 0.217 -7.834 11.565 1.00 0.00 O ATOM 0 H GLU A 438 -3.129 -7.124 7.997 1.00 0.00 H new ATOM 0 HA GLU A 438 -0.683 -7.245 6.428 1.00 0.00 H new ATOM 0 HB2 GLU A 438 0.360 -7.549 8.581 1.00 0.00 H new ATOM 0 HB3 GLU A 438 -0.693 -6.148 8.573 1.00 0.00 H new ATOM 0 HG2 GLU A 438 -2.440 -7.483 9.792 1.00 0.00 H new ATOM 0 HG3 GLU A 438 -1.340 -8.847 9.841 1.00 0.00 H new ATOM 1161 N ASP A 439 -2.245 -9.919 7.549 1.00 0.00 N ATOM 1162 CA ASP A 439 -2.426 -11.357 7.484 1.00 0.00 C ATOM 1163 C ASP A 439 -3.213 -11.731 6.225 1.00 0.00 C ATOM 1164 O ASP A 439 -3.977 -10.867 5.734 1.00 0.00 O ATOM 1165 CB ASP A 439 -3.145 -11.824 8.759 1.00 0.00 C ATOM 1166 CG ASP A 439 -4.519 -11.179 8.946 1.00 0.00 C ATOM 1167 OD1 ASP A 439 -4.554 -9.932 9.058 1.00 0.00 O ATOM 1168 OD2 ASP A 439 -5.508 -11.942 9.010 1.00 0.00 O ATOM 1169 OXT ASP A 439 -2.947 -12.836 5.703 1.00 0.00 O ATOM 0 H ASP A 439 -3.002 -9.460 8.055 1.00 0.00 H new ATOM 0 HA ASP A 439 -1.459 -11.857 7.425 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -3.261 -12.907 8.727 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -2.523 -11.595 9.624 1.00 0.00 H new TER 1174 ASP A 439