USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 721 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 365 SER OG : rot 180:sc= 0 USER MOD Single : A 368 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 369 ASN : amide:sc= -0.803 K(o=-0.8,f=-7.7!) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 375 TYR OH : rot 35:sc= 0.0655 USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 380 TYR OH : rot 180:sc= 0 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -5.67! C(o=-5.7!,f=-7.4!) USER MOD Single : A 387 TYR OH : rot 135:sc= -5.71! USER MOD Single : A 389 THR OG1 : rot 170:sc= -1.98! USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 392 LYS NZ :NH3+ -162:sc= -0.0258 (180deg=-0.194) USER MOD Single : A 394 THR OG1 : rot -130:sc= -1.16 USER MOD Single : A 399 ASN : amide:sc= -2.13! C(o=-2.1!,f=-7.4!) USER MOD Single : A 400 SER OG : rot 28:sc= -6.88! USER MOD Single : A 404 CYS SG : rot -77:sc= -3.48 USER MOD Single : A 410 THR OG1 : rot 88:sc= 0.367 USER MOD Single : A 414 THR OG1 : rot -8:sc= 0.892 USER MOD Single : A 419 ASN : amide:sc= -4.28! C(o=-4.3!,f=-12!) USER MOD Single : A 421 LYS NZ :NH3+ 134:sc= -1.91! (180deg=-4.84!) USER MOD Single : A 430 ASN : amide:sc= -0.0408 X(o=-0.041,f=-0.38) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl 170:sc= 0 (180deg=-0.127) USER MOD Single : A 441 TYR OH : rot 99:sc= -3.24! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 451 SER OG : rot 180:sc= 0 USER MOD Single : A 453 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 364 -4.846 -12.749 13.017 1.00 0.00 N ATOM 2 CA GLY A 364 -4.817 -13.600 11.796 1.00 0.00 C ATOM 3 C GLY A 364 -5.290 -12.857 10.563 1.00 0.00 C ATOM 4 O GLY A 364 -4.576 -12.008 10.028 1.00 0.00 O ATOM 0 HA2 GLY A 364 -3.802 -13.961 11.632 1.00 0.00 H new ATOM 0 HA3 GLY A 364 -5.446 -14.477 11.952 1.00 0.00 H new ATOM 10 N SER A 365 -6.498 -13.175 10.109 1.00 0.00 N ATOM 11 CA SER A 365 -7.064 -12.530 8.931 1.00 0.00 C ATOM 12 C SER A 365 -6.850 -11.021 8.983 1.00 0.00 C ATOM 13 O SER A 365 -6.490 -10.471 10.023 1.00 0.00 O ATOM 14 CB SER A 365 -8.558 -12.842 8.819 1.00 0.00 C ATOM 15 OG SER A 365 -8.916 -13.156 7.484 1.00 0.00 O ATOM 0 H SER A 365 -7.103 -13.875 10.539 1.00 0.00 H new ATOM 0 HA SER A 365 -6.553 -12.922 8.052 1.00 0.00 H new ATOM 0 HB2 SER A 365 -8.808 -13.678 9.472 1.00 0.00 H new ATOM 0 HB3 SER A 365 -9.138 -11.985 9.162 1.00 0.00 H new ATOM 0 HG SER A 365 -9.875 -13.353 7.440 1.00 0.00 H new ATOM 21 N LEU A 366 -7.071 -10.359 7.853 1.00 0.00 N ATOM 22 CA LEU A 366 -6.900 -8.914 7.767 1.00 0.00 C ATOM 23 C LEU A 366 -8.184 -8.242 7.294 1.00 0.00 C ATOM 24 O LEU A 366 -9.242 -8.870 7.240 1.00 0.00 O ATOM 25 CB LEU A 366 -5.753 -8.575 6.814 1.00 0.00 C ATOM 26 CG LEU A 366 -5.395 -9.680 5.823 1.00 0.00 C ATOM 27 CD1 LEU A 366 -6.482 -9.827 4.771 1.00 0.00 C ATOM 28 CD2 LEU A 366 -4.057 -9.396 5.166 1.00 0.00 C ATOM 0 H LEU A 366 -7.369 -10.801 6.983 1.00 0.00 H new ATOM 0 HA LEU A 366 -6.661 -8.540 8.762 1.00 0.00 H new ATOM 0 HB2 LEU A 366 -6.017 -7.677 6.255 1.00 0.00 H new ATOM 0 HB3 LEU A 366 -4.868 -8.335 7.404 1.00 0.00 H new ATOM 0 HG LEU A 366 -5.317 -10.618 6.372 1.00 0.00 H new ATOM 0 HD11 LEU A 366 -6.209 -10.619 4.074 1.00 0.00 H new ATOM 0 HD12 LEU A 366 -7.425 -10.079 5.255 1.00 0.00 H new ATOM 0 HD13 LEU A 366 -6.592 -8.888 4.228 1.00 0.00 H new ATOM 0 HD21 LEU A 366 -3.820 -10.195 4.463 1.00 0.00 H new ATOM 0 HD22 LEU A 366 -4.108 -8.447 4.633 1.00 0.00 H new ATOM 0 HD23 LEU A 366 -3.281 -9.342 5.929 1.00 0.00 H new ATOM 40 N ASP A 367 -8.084 -6.964 6.951 1.00 0.00 N ATOM 41 CA ASP A 367 -9.239 -6.208 6.480 1.00 0.00 C ATOM 42 C ASP A 367 -9.777 -6.798 5.183 1.00 0.00 C ATOM 43 O ASP A 367 -9.288 -7.821 4.704 1.00 0.00 O ATOM 44 CB ASP A 367 -8.866 -4.739 6.271 1.00 0.00 C ATOM 45 CG ASP A 367 -8.857 -3.956 7.569 1.00 0.00 C ATOM 46 OD1 ASP A 367 -8.335 -4.480 8.575 1.00 0.00 O ATOM 47 OD2 ASP A 367 -9.370 -2.818 7.579 1.00 0.00 O ATOM 0 H ASP A 367 -7.216 -6.429 6.990 1.00 0.00 H new ATOM 0 HA ASP A 367 -10.018 -6.270 7.240 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -7.882 -4.679 5.807 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -9.573 -4.282 5.579 1.00 0.00 H new ATOM 52 N MET A 368 -10.789 -6.148 4.619 1.00 0.00 N ATOM 53 CA MET A 368 -11.395 -6.615 3.377 1.00 0.00 C ATOM 54 C MET A 368 -10.979 -5.743 2.200 1.00 0.00 C ATOM 55 O MET A 368 -10.664 -6.249 1.122 1.00 0.00 O ATOM 56 CB MET A 368 -12.918 -6.627 3.502 1.00 0.00 C ATOM 57 CG MET A 368 -13.448 -5.684 4.569 1.00 0.00 C ATOM 58 SD MET A 368 -15.219 -5.386 4.414 1.00 0.00 S ATOM 59 CE MET A 368 -15.819 -6.135 5.927 1.00 0.00 C ATOM 0 H MET A 368 -11.206 -5.299 5.000 1.00 0.00 H new ATOM 0 HA MET A 368 -11.042 -7.630 3.193 1.00 0.00 H new ATOM 0 HB2 MET A 368 -13.355 -6.357 2.541 1.00 0.00 H new ATOM 0 HB3 MET A 368 -13.248 -7.641 3.729 1.00 0.00 H new ATOM 0 HG2 MET A 368 -13.238 -6.101 5.554 1.00 0.00 H new ATOM 0 HG3 MET A 368 -12.917 -4.734 4.506 1.00 0.00 H new ATOM 0 HE1 MET A 368 -16.903 -6.032 5.979 1.00 0.00 H new ATOM 0 HE2 MET A 368 -15.554 -7.192 5.940 1.00 0.00 H new ATOM 0 HE3 MET A 368 -15.366 -5.637 6.784 1.00 0.00 H new ATOM 69 N ASN A 369 -10.982 -4.433 2.405 1.00 0.00 N ATOM 70 CA ASN A 369 -10.608 -3.502 1.349 1.00 0.00 C ATOM 71 C ASN A 369 -9.493 -2.569 1.802 1.00 0.00 C ATOM 72 O ASN A 369 -9.732 -1.406 2.132 1.00 0.00 O ATOM 73 CB ASN A 369 -11.827 -2.687 0.928 1.00 0.00 C ATOM 74 CG ASN A 369 -12.521 -3.268 -0.288 1.00 0.00 C ATOM 75 OD1 ASN A 369 -12.617 -2.622 -1.332 1.00 0.00 O ATOM 76 ND2 ASN A 369 -13.012 -4.496 -0.159 1.00 0.00 N ATOM 0 H ASN A 369 -11.238 -3.992 3.289 1.00 0.00 H new ATOM 0 HA ASN A 369 -10.240 -4.079 0.501 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -12.533 -2.640 1.757 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -11.519 -1.664 0.713 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -13.491 -4.939 -0.943 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -12.910 -4.996 0.724 1.00 0.00 H new ATOM 83 N ALA A 370 -8.271 -3.083 1.795 1.00 0.00 N ATOM 84 CA ALA A 370 -7.105 -2.298 2.182 1.00 0.00 C ATOM 85 C ALA A 370 -6.617 -1.446 1.020 1.00 0.00 C ATOM 86 O ALA A 370 -6.541 -0.225 1.119 1.00 0.00 O ATOM 87 CB ALA A 370 -5.983 -3.186 2.684 1.00 0.00 C ATOM 0 H ALA A 370 -8.060 -4.044 1.525 1.00 0.00 H new ATOM 0 HA ALA A 370 -7.409 -1.640 2.996 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -5.129 -2.570 2.964 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -6.325 -3.749 3.553 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -5.687 -3.879 1.896 1.00 0.00 H new ATOM 93 N LYS A 371 -6.295 -2.102 -0.088 1.00 0.00 N ATOM 94 CA LYS A 371 -5.826 -1.401 -1.276 1.00 0.00 C ATOM 95 C LYS A 371 -6.875 -0.392 -1.718 1.00 0.00 C ATOM 96 O LYS A 371 -6.560 0.641 -2.297 1.00 0.00 O ATOM 97 CB LYS A 371 -5.531 -2.395 -2.405 1.00 0.00 C ATOM 98 CG LYS A 371 -6.762 -3.125 -2.922 1.00 0.00 C ATOM 99 CD LYS A 371 -6.921 -4.490 -2.267 1.00 0.00 C ATOM 100 CE LYS A 371 -7.904 -5.366 -3.032 1.00 0.00 C ATOM 101 NZ LYS A 371 -9.030 -5.826 -2.171 1.00 0.00 N ATOM 0 H LYS A 371 -6.350 -3.116 -0.188 1.00 0.00 H new ATOM 0 HA LYS A 371 -4.902 -0.875 -1.037 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.063 -1.861 -3.232 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.808 -3.129 -2.050 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -7.650 -2.523 -2.730 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -6.687 -3.246 -4.003 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -5.952 -4.986 -2.218 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -7.267 -4.364 -1.241 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -8.301 -4.809 -3.881 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -7.379 -6.232 -3.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -9.675 -6.419 -2.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -8.654 -6.379 -1.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -9.547 -5.001 -1.806 1.00 0.00 H new ATOM 115 N ARG A 372 -8.118 -0.709 -1.388 1.00 0.00 N ATOM 116 CA ARG A 372 -9.248 0.162 -1.701 1.00 0.00 C ATOM 117 C ARG A 372 -9.307 1.318 -0.710 1.00 0.00 C ATOM 118 O ARG A 372 -9.248 2.487 -1.096 1.00 0.00 O ATOM 119 CB ARG A 372 -10.568 -0.615 -1.678 1.00 0.00 C ATOM 120 CG ARG A 372 -11.802 0.282 -1.591 1.00 0.00 C ATOM 121 CD ARG A 372 -12.579 0.288 -2.898 1.00 0.00 C ATOM 122 NE ARG A 372 -13.492 1.425 -2.986 1.00 0.00 N ATOM 123 CZ ARG A 372 -13.116 2.646 -3.354 1.00 0.00 C ATOM 124 NH1 ARG A 372 -11.850 2.885 -3.667 1.00 0.00 N ATOM 125 NH2 ARG A 372 -14.005 3.629 -3.411 1.00 0.00 N ATOM 0 H ARG A 372 -8.374 -1.568 -0.901 1.00 0.00 H new ATOM 0 HA ARG A 372 -9.103 0.556 -2.707 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -10.636 -1.227 -2.578 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -10.564 -1.297 -0.828 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -12.448 -0.063 -0.784 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -11.497 1.299 -1.343 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -11.881 0.318 -3.735 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -13.145 -0.639 -2.988 1.00 0.00 H new ATOM 0 HE ARG A 372 -14.473 1.274 -2.752 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -11.163 2.132 -3.626 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -11.563 3.822 -3.949 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -14.980 3.449 -3.172 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -13.713 4.565 -3.694 1.00 0.00 H new ATOM 139 N GLN A 373 -9.411 0.988 0.570 1.00 0.00 N ATOM 140 CA GLN A 373 -9.468 2.005 1.612 1.00 0.00 C ATOM 141 C GLN A 373 -8.256 2.927 1.505 1.00 0.00 C ATOM 142 O GLN A 373 -8.387 4.147 1.469 1.00 0.00 O ATOM 143 CB GLN A 373 -9.538 1.332 2.982 1.00 0.00 C ATOM 144 CG GLN A 373 -9.786 2.298 4.126 1.00 0.00 C ATOM 145 CD GLN A 373 -11.123 2.065 4.802 1.00 0.00 C ATOM 146 OE1 GLN A 373 -12.156 1.952 4.141 1.00 0.00 O ATOM 147 NE2 GLN A 373 -11.111 1.992 6.128 1.00 0.00 N ATOM 0 H GLN A 373 -9.458 0.028 0.911 1.00 0.00 H new ATOM 0 HA GLN A 373 -10.364 2.613 1.485 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -10.332 0.586 2.970 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -8.604 0.800 3.164 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -8.988 2.198 4.862 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -9.746 3.320 3.750 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -10.232 2.091 6.636 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -11.981 1.837 6.638 1.00 0.00 H new ATOM 156 N LEU A 374 -7.089 2.315 1.388 1.00 0.00 N ATOM 157 CA LEU A 374 -5.847 3.045 1.215 1.00 0.00 C ATOM 158 C LEU A 374 -5.964 3.900 -0.043 1.00 0.00 C ATOM 159 O LEU A 374 -5.870 5.127 0.004 1.00 0.00 O ATOM 160 CB LEU A 374 -4.672 2.063 1.099 1.00 0.00 C ATOM 161 CG LEU A 374 -3.275 2.688 1.156 1.00 0.00 C ATOM 162 CD1 LEU A 374 -2.822 3.133 -0.222 1.00 0.00 C ATOM 163 CD2 LEU A 374 -3.246 3.852 2.135 1.00 0.00 C ATOM 0 H LEU A 374 -6.977 1.301 1.410 1.00 0.00 H new ATOM 0 HA LEU A 374 -5.662 3.687 2.076 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -4.755 1.330 1.901 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -4.768 1.519 0.159 1.00 0.00 H new ATOM 0 HG LEU A 374 -2.579 1.927 1.509 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -1.827 3.573 -0.153 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -2.793 2.273 -0.891 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -3.520 3.873 -0.613 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -2.244 4.281 2.160 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -3.959 4.613 1.817 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -3.514 3.497 3.130 1.00 0.00 H new ATOM 175 N TYR A 375 -6.198 3.227 -1.166 1.00 0.00 N ATOM 176 CA TYR A 375 -6.361 3.899 -2.451 1.00 0.00 C ATOM 177 C TYR A 375 -7.235 5.131 -2.288 1.00 0.00 C ATOM 178 O TYR A 375 -7.035 6.152 -2.946 1.00 0.00 O ATOM 179 CB TYR A 375 -6.985 2.947 -3.467 1.00 0.00 C ATOM 180 CG TYR A 375 -5.962 2.167 -4.257 1.00 0.00 C ATOM 181 CD1 TYR A 375 -4.624 2.162 -3.876 1.00 0.00 C ATOM 182 CD2 TYR A 375 -6.331 1.433 -5.377 1.00 0.00 C ATOM 183 CE1 TYR A 375 -3.686 1.448 -4.590 1.00 0.00 C ATOM 184 CE2 TYR A 375 -5.395 0.716 -6.097 1.00 0.00 C ATOM 185 CZ TYR A 375 -4.074 0.726 -5.699 1.00 0.00 C ATOM 186 OH TYR A 375 -3.140 0.013 -6.412 1.00 0.00 O ATOM 0 H TYR A 375 -6.279 2.211 -1.212 1.00 0.00 H new ATOM 0 HA TYR A 375 -5.380 4.207 -2.813 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -7.641 2.250 -2.946 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -7.608 3.518 -4.155 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.316 2.726 -3.008 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -7.365 1.423 -5.690 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -2.651 1.454 -4.282 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -5.696 0.151 -6.967 1.00 0.00 H new ATOM 0 HH TYR A 375 -2.466 -0.347 -5.799 1.00 0.00 H new ATOM 196 N SER A 376 -8.196 5.031 -1.385 1.00 0.00 N ATOM 197 CA SER A 376 -9.091 6.141 -1.104 1.00 0.00 C ATOM 198 C SER A 376 -8.380 7.146 -0.207 1.00 0.00 C ATOM 199 O SER A 376 -8.417 8.353 -0.445 1.00 0.00 O ATOM 200 CB SER A 376 -10.374 5.638 -0.434 1.00 0.00 C ATOM 201 OG SER A 376 -11.015 6.678 0.287 1.00 0.00 O ATOM 0 H SER A 376 -8.377 4.192 -0.834 1.00 0.00 H new ATOM 0 HA SER A 376 -9.367 6.627 -2.040 1.00 0.00 H new ATOM 0 HB2 SER A 376 -11.053 5.244 -1.191 1.00 0.00 H new ATOM 0 HB3 SER A 376 -10.137 4.816 0.241 1.00 0.00 H new ATOM 0 HG SER A 376 -11.832 6.332 0.704 1.00 0.00 H new ATOM 207 N LEU A 377 -7.731 6.624 0.827 1.00 0.00 N ATOM 208 CA LEU A 377 -6.999 7.442 1.777 1.00 0.00 C ATOM 209 C LEU A 377 -5.825 8.141 1.100 1.00 0.00 C ATOM 210 O LEU A 377 -5.788 9.369 1.010 1.00 0.00 O ATOM 211 CB LEU A 377 -6.499 6.568 2.934 1.00 0.00 C ATOM 212 CG LEU A 377 -7.497 6.381 4.079 1.00 0.00 C ATOM 213 CD1 LEU A 377 -8.676 5.541 3.623 1.00 0.00 C ATOM 214 CD2 LEU A 377 -6.825 5.736 5.281 1.00 0.00 C ATOM 0 H LEU A 377 -7.699 5.624 1.027 1.00 0.00 H new ATOM 0 HA LEU A 377 -7.670 8.207 2.167 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -6.232 5.587 2.540 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -5.587 7.009 3.335 1.00 0.00 H new ATOM 0 HG LEU A 377 -7.862 7.364 4.376 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -9.376 5.418 4.449 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -9.178 6.039 2.793 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -8.322 4.563 3.299 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -7.553 5.613 6.082 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -6.430 4.761 4.997 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -6.009 6.371 5.626 1.00 0.00 H new ATOM 226 N ILE A 378 -4.859 7.352 0.636 1.00 0.00 N ATOM 227 CA ILE A 378 -3.674 7.896 -0.016 1.00 0.00 C ATOM 228 C ILE A 378 -3.757 7.795 -1.540 1.00 0.00 C ATOM 229 O ILE A 378 -3.426 8.751 -2.241 1.00 0.00 O ATOM 230 CB ILE A 378 -2.442 7.123 0.475 1.00 0.00 C ATOM 231 CG1 ILE A 378 -2.190 7.421 1.951 1.00 0.00 C ATOM 232 CG2 ILE A 378 -1.231 7.460 -0.359 1.00 0.00 C ATOM 233 CD1 ILE A 378 -1.172 6.501 2.586 1.00 0.00 C ATOM 0 H ILE A 378 -4.875 6.334 0.700 1.00 0.00 H new ATOM 0 HA ILE A 378 -3.602 8.953 0.241 1.00 0.00 H new ATOM 0 HB ILE A 378 -2.633 6.055 0.366 1.00 0.00 H new ATOM 0 HG12 ILE A 378 -1.850 8.452 2.053 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -3.131 7.340 2.496 1.00 0.00 H new ATOM 0 HG21 ILE A 378 -0.370 6.901 0.007 1.00 0.00 H new ATOM 0 HG22 ILE A 378 -1.420 7.195 -1.399 1.00 0.00 H new ATOM 0 HG23 ILE A 378 -1.026 8.528 -0.288 1.00 0.00 H new ATOM 0 HD11 ILE A 378 -1.043 6.770 3.634 1.00 0.00 H new ATOM 0 HD12 ILE A 378 -1.519 5.470 2.516 1.00 0.00 H new ATOM 0 HD13 ILE A 378 -0.219 6.599 2.066 1.00 0.00 H new ATOM 245 N GLY A 379 -4.176 6.630 -2.037 1.00 0.00 N ATOM 246 CA GLY A 379 -4.274 6.406 -3.476 1.00 0.00 C ATOM 247 C GLY A 379 -4.399 7.684 -4.287 1.00 0.00 C ATOM 248 O GLY A 379 -5.219 8.548 -3.978 1.00 0.00 O ATOM 0 H GLY A 379 -4.451 5.831 -1.465 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -3.392 5.859 -3.810 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -5.138 5.772 -3.678 1.00 0.00 H new ATOM 252 N TYR A 380 -3.578 7.796 -5.327 1.00 0.00 N ATOM 253 CA TYR A 380 -3.586 8.967 -6.198 1.00 0.00 C ATOM 254 C TYR A 380 -2.771 8.702 -7.460 1.00 0.00 C ATOM 255 O TYR A 380 -1.654 8.190 -7.392 1.00 0.00 O ATOM 256 CB TYR A 380 -3.024 10.183 -5.460 1.00 0.00 C ATOM 257 CG TYR A 380 -4.011 10.828 -4.513 1.00 0.00 C ATOM 258 CD1 TYR A 380 -5.300 11.135 -4.926 1.00 0.00 C ATOM 259 CD2 TYR A 380 -3.651 11.130 -3.206 1.00 0.00 C ATOM 260 CE1 TYR A 380 -6.205 11.725 -4.064 1.00 0.00 C ATOM 261 CE2 TYR A 380 -4.549 11.721 -2.337 1.00 0.00 C ATOM 262 CZ TYR A 380 -5.824 12.015 -2.771 1.00 0.00 C ATOM 263 OH TYR A 380 -6.721 12.604 -1.909 1.00 0.00 O ATOM 0 H TYR A 380 -2.895 7.085 -5.588 1.00 0.00 H new ATOM 0 HA TYR A 380 -4.617 9.173 -6.485 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -2.140 9.880 -4.899 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.699 10.923 -6.191 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -5.601 10.909 -5.938 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -2.653 10.899 -2.863 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -7.204 11.957 -4.401 1.00 0.00 H new ATOM 0 HE2 TYR A 380 -4.253 11.951 -1.324 1.00 0.00 H new ATOM 0 HH TYR A 380 -6.295 12.740 -1.037 1.00 0.00 H new ATOM 273 N ALA A 381 -3.339 9.048 -8.611 1.00 0.00 N ATOM 274 CA ALA A 381 -2.667 8.843 -9.889 1.00 0.00 C ATOM 275 C ALA A 381 -1.263 9.439 -9.880 1.00 0.00 C ATOM 276 O ALA A 381 -0.405 9.042 -10.668 1.00 0.00 O ATOM 277 CB ALA A 381 -3.479 9.434 -11.031 1.00 0.00 C ATOM 0 H ALA A 381 -4.264 9.472 -8.685 1.00 0.00 H new ATOM 0 HA ALA A 381 -2.580 7.767 -10.043 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -2.956 9.268 -11.973 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -4.457 8.954 -11.069 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -3.607 10.505 -10.871 1.00 0.00 H new ATOM 283 N SER A 382 -1.036 10.399 -8.990 1.00 0.00 N ATOM 284 CA SER A 382 0.264 11.053 -8.887 1.00 0.00 C ATOM 285 C SER A 382 1.176 10.317 -7.910 1.00 0.00 C ATOM 286 O SER A 382 2.400 10.361 -8.037 1.00 0.00 O ATOM 287 CB SER A 382 0.090 12.506 -8.443 1.00 0.00 C ATOM 288 OG SER A 382 -0.597 13.261 -9.425 1.00 0.00 O ATOM 0 H SER A 382 -1.734 10.741 -8.330 1.00 0.00 H new ATOM 0 HA SER A 382 0.730 11.031 -9.872 1.00 0.00 H new ATOM 0 HB2 SER A 382 -0.461 12.539 -7.503 1.00 0.00 H new ATOM 0 HB3 SER A 382 1.067 12.951 -8.255 1.00 0.00 H new ATOM 0 HG SER A 382 -0.697 14.186 -9.116 1.00 0.00 H new ATOM 294 N LEU A 383 0.575 9.647 -6.933 1.00 0.00 N ATOM 295 CA LEU A 383 1.337 8.909 -5.931 1.00 0.00 C ATOM 296 C LEU A 383 1.739 7.533 -6.446 1.00 0.00 C ATOM 297 O LEU A 383 2.586 6.861 -5.858 1.00 0.00 O ATOM 298 CB LEU A 383 0.508 8.758 -4.661 1.00 0.00 C ATOM 299 CG LEU A 383 1.205 9.186 -3.375 1.00 0.00 C ATOM 300 CD1 LEU A 383 0.625 8.435 -2.193 1.00 0.00 C ATOM 301 CD2 LEU A 383 2.706 8.952 -3.476 1.00 0.00 C ATOM 0 H LEU A 383 -0.437 9.599 -6.813 1.00 0.00 H new ATOM 0 HA LEU A 383 2.245 9.471 -5.714 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -0.406 9.342 -4.771 1.00 0.00 H new ATOM 0 HB3 LEU A 383 0.210 7.714 -4.563 1.00 0.00 H new ATOM 0 HG LEU A 383 1.038 10.253 -3.226 1.00 0.00 H new ATOM 0 HD11 LEU A 383 1.130 8.748 -1.279 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.440 8.652 -2.111 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.767 7.364 -2.337 1.00 0.00 H new ATOM 0 HD21 LEU A 383 3.186 9.264 -2.548 1.00 0.00 H new ATOM 0 HD22 LEU A 383 2.898 7.893 -3.646 1.00 0.00 H new ATOM 0 HD23 LEU A 383 3.110 9.532 -4.306 1.00 0.00 H new ATOM 313 N ARG A 384 1.131 7.127 -7.549 1.00 0.00 N ATOM 314 CA ARG A 384 1.418 5.837 -8.161 1.00 0.00 C ATOM 315 C ARG A 384 1.781 4.774 -7.125 1.00 0.00 C ATOM 316 O ARG A 384 2.750 4.036 -7.304 1.00 0.00 O ATOM 317 CB ARG A 384 2.552 5.975 -9.177 1.00 0.00 C ATOM 318 CG ARG A 384 2.292 5.238 -10.481 1.00 0.00 C ATOM 319 CD ARG A 384 2.233 3.734 -10.265 1.00 0.00 C ATOM 320 NE ARG A 384 1.720 3.030 -11.436 1.00 0.00 N ATOM 321 CZ ARG A 384 0.426 2.908 -11.716 1.00 0.00 C ATOM 322 NH1 ARG A 384 -0.481 3.452 -10.915 1.00 0.00 N ATOM 323 NH2 ARG A 384 0.038 2.245 -12.796 1.00 0.00 N ATOM 0 H ARG A 384 0.429 7.677 -8.044 1.00 0.00 H new ATOM 0 HA ARG A 384 0.508 5.511 -8.665 1.00 0.00 H new ATOM 0 HB2 ARG A 384 2.710 7.032 -9.392 1.00 0.00 H new ATOM 0 HB3 ARG A 384 3.474 5.598 -8.734 1.00 0.00 H new ATOM 0 HG2 ARG A 384 1.353 5.582 -10.914 1.00 0.00 H new ATOM 0 HG3 ARG A 384 3.079 5.474 -11.197 1.00 0.00 H new ATOM 0 HD2 ARG A 384 3.230 3.363 -10.028 1.00 0.00 H new ATOM 0 HD3 ARG A 384 1.599 3.516 -9.405 1.00 0.00 H new ATOM 0 HE ARG A 384 2.392 2.608 -12.076 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -0.186 3.964 -10.084 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -1.474 3.358 -11.130 1.00 0.00 H new ATOM 0 HH21 ARG A 384 0.733 1.827 -13.415 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -0.955 2.153 -13.008 1.00 0.00 H new ATOM 337 N LEU A 385 0.992 4.673 -6.058 1.00 0.00 N ATOM 338 CA LEU A 385 1.244 3.665 -5.037 1.00 0.00 C ATOM 339 C LEU A 385 1.076 2.285 -5.659 1.00 0.00 C ATOM 340 O LEU A 385 0.246 2.107 -6.550 1.00 0.00 O ATOM 341 CB LEU A 385 0.299 3.859 -3.844 1.00 0.00 C ATOM 342 CG LEU A 385 -1.129 4.285 -4.196 1.00 0.00 C ATOM 343 CD1 LEU A 385 -1.686 3.438 -5.328 1.00 0.00 C ATOM 344 CD2 LEU A 385 -2.022 4.189 -2.970 1.00 0.00 C ATOM 0 H LEU A 385 0.184 5.269 -5.881 1.00 0.00 H new ATOM 0 HA LEU A 385 2.262 3.764 -4.661 1.00 0.00 H new ATOM 0 HB2 LEU A 385 0.253 2.925 -3.284 1.00 0.00 H new ATOM 0 HB3 LEU A 385 0.730 4.608 -3.180 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.104 5.322 -4.532 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -2.701 3.761 -5.559 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.059 3.554 -6.212 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.698 2.391 -5.027 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.035 4.494 -3.233 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.035 3.161 -2.609 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -1.637 4.843 -2.188 1.00 0.00 H new ATOM 356 N HIS A 386 1.860 1.305 -5.212 1.00 0.00 N ATOM 357 CA HIS A 386 1.764 -0.040 -5.769 1.00 0.00 C ATOM 358 C HIS A 386 2.181 -1.092 -4.756 1.00 0.00 C ATOM 359 O HIS A 386 2.758 -0.781 -3.713 1.00 0.00 O ATOM 360 CB HIS A 386 2.638 -0.170 -7.020 1.00 0.00 C ATOM 361 CG HIS A 386 4.110 -0.262 -6.731 1.00 0.00 C ATOM 362 ND1 HIS A 386 4.717 -1.377 -6.175 1.00 0.00 N ATOM 363 CD2 HIS A 386 5.105 0.635 -6.940 1.00 0.00 C ATOM 364 CE1 HIS A 386 6.014 -1.155 -6.057 1.00 0.00 C ATOM 365 NE2 HIS A 386 6.273 0.055 -6.515 1.00 0.00 N ATOM 0 H HIS A 386 2.558 1.415 -4.477 1.00 0.00 H new ATOM 0 HA HIS A 386 0.720 -0.205 -6.035 1.00 0.00 H new ATOM 0 HB2 HIS A 386 2.331 -1.057 -7.574 1.00 0.00 H new ATOM 0 HB3 HIS A 386 2.458 0.689 -7.667 1.00 0.00 H new ATOM 0 HD2 HIS A 386 4.998 1.623 -7.363 1.00 0.00 H new ATOM 0 HE1 HIS A 386 6.739 -1.847 -5.654 1.00 0.00 H new ATOM 0 HE2 HIS A 386 7.195 0.490 -6.548 1.00 0.00 H new ATOM 374 N TYR A 387 1.892 -2.341 -5.084 1.00 0.00 N ATOM 375 CA TYR A 387 2.238 -3.459 -4.224 1.00 0.00 C ATOM 376 C TYR A 387 3.316 -4.308 -4.877 1.00 0.00 C ATOM 377 O TYR A 387 3.174 -4.741 -6.021 1.00 0.00 O ATOM 378 CB TYR A 387 0.992 -4.291 -3.927 1.00 0.00 C ATOM 379 CG TYR A 387 -0.180 -3.439 -3.508 1.00 0.00 C ATOM 380 CD1 TYR A 387 -0.331 -3.039 -2.188 1.00 0.00 C ATOM 381 CD2 TYR A 387 -1.119 -3.010 -4.437 1.00 0.00 C ATOM 382 CE1 TYR A 387 -1.384 -2.237 -1.803 1.00 0.00 C ATOM 383 CE2 TYR A 387 -2.180 -2.210 -4.059 1.00 0.00 C ATOM 384 CZ TYR A 387 -2.307 -1.827 -2.741 1.00 0.00 C ATOM 385 OH TYR A 387 -3.356 -1.024 -2.363 1.00 0.00 O ATOM 0 H TYR A 387 1.415 -2.606 -5.946 1.00 0.00 H new ATOM 0 HA TYR A 387 2.631 -3.079 -3.281 1.00 0.00 H new ATOM 0 HB2 TYR A 387 0.722 -4.866 -4.813 1.00 0.00 H new ATOM 0 HB3 TYR A 387 1.217 -5.009 -3.138 1.00 0.00 H new ATOM 0 HD1 TYR A 387 0.388 -3.361 -1.450 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -1.018 -3.306 -5.471 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -1.485 -1.932 -0.772 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -2.905 -1.887 -4.791 1.00 0.00 H new ATOM 0 HH TYR A 387 -3.460 -0.295 -3.010 1.00 0.00 H new ATOM 395 N VAL A 388 4.394 -4.537 -4.146 1.00 0.00 N ATOM 396 CA VAL A 388 5.501 -5.328 -4.655 1.00 0.00 C ATOM 397 C VAL A 388 5.528 -6.704 -4.005 1.00 0.00 C ATOM 398 O VAL A 388 5.363 -6.829 -2.794 1.00 0.00 O ATOM 399 CB VAL A 388 6.849 -4.617 -4.425 1.00 0.00 C ATOM 400 CG1 VAL A 388 6.899 -3.977 -3.048 1.00 0.00 C ATOM 401 CG2 VAL A 388 7.997 -5.590 -4.608 1.00 0.00 C ATOM 0 H VAL A 388 4.526 -4.186 -3.197 1.00 0.00 H new ATOM 0 HA VAL A 388 5.350 -5.446 -5.728 1.00 0.00 H new ATOM 0 HB VAL A 388 6.947 -3.823 -5.166 1.00 0.00 H new ATOM 0 HG11 VAL A 388 7.861 -3.482 -2.911 1.00 0.00 H new ATOM 0 HG12 VAL A 388 6.098 -3.244 -2.958 1.00 0.00 H new ATOM 0 HG13 VAL A 388 6.775 -4.745 -2.285 1.00 0.00 H new ATOM 0 HG21 VAL A 388 8.942 -5.073 -4.442 1.00 0.00 H new ATOM 0 HG22 VAL A 388 7.900 -6.406 -3.892 1.00 0.00 H new ATOM 0 HG23 VAL A 388 7.976 -5.991 -5.621 1.00 0.00 H new ATOM 411 N THR A 389 5.733 -7.732 -4.821 1.00 0.00 N ATOM 412 CA THR A 389 5.775 -9.103 -4.329 1.00 0.00 C ATOM 413 C THR A 389 7.201 -9.557 -4.055 1.00 0.00 C ATOM 414 O THR A 389 7.965 -9.830 -4.980 1.00 0.00 O ATOM 415 CB THR A 389 5.138 -10.080 -5.330 1.00 0.00 C ATOM 416 OG1 THR A 389 3.826 -9.652 -5.716 1.00 0.00 O ATOM 417 CG2 THR A 389 5.042 -11.479 -4.733 1.00 0.00 C ATOM 0 H THR A 389 5.873 -7.641 -5.827 1.00 0.00 H new ATOM 0 HA THR A 389 5.207 -9.111 -3.399 1.00 0.00 H new ATOM 0 HB THR A 389 5.780 -10.099 -6.211 1.00 0.00 H new ATOM 0 HG1 THR A 389 3.512 -10.197 -6.467 1.00 0.00 H new ATOM 0 HG21 THR A 389 4.588 -12.154 -5.459 1.00 0.00 H new ATOM 0 HG22 THR A 389 6.040 -11.836 -4.480 1.00 0.00 H new ATOM 0 HG23 THR A 389 4.429 -11.449 -3.832 1.00 0.00 H new ATOM 425 N VAL A 390 7.546 -9.660 -2.779 1.00 0.00 N ATOM 426 CA VAL A 390 8.875 -10.107 -2.387 1.00 0.00 C ATOM 427 C VAL A 390 8.899 -11.620 -2.237 1.00 0.00 C ATOM 428 O VAL A 390 9.912 -12.266 -2.505 1.00 0.00 O ATOM 429 CB VAL A 390 9.345 -9.469 -1.065 1.00 0.00 C ATOM 430 CG1 VAL A 390 10.622 -8.675 -1.284 1.00 0.00 C ATOM 431 CG2 VAL A 390 8.263 -8.585 -0.466 1.00 0.00 C ATOM 0 H VAL A 390 6.926 -9.441 -2.000 1.00 0.00 H new ATOM 0 HA VAL A 390 9.556 -9.792 -3.177 1.00 0.00 H new ATOM 0 HB VAL A 390 9.550 -10.272 -0.357 1.00 0.00 H new ATOM 0 HG11 VAL A 390 10.941 -8.231 -0.341 1.00 0.00 H new ATOM 0 HG12 VAL A 390 11.404 -9.338 -1.655 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.439 -7.886 -2.013 1.00 0.00 H new ATOM 0 HG21 VAL A 390 8.624 -8.149 0.466 1.00 0.00 H new ATOM 0 HG22 VAL A 390 8.015 -7.788 -1.167 1.00 0.00 H new ATOM 0 HG23 VAL A 390 7.374 -9.183 -0.266 1.00 0.00 H new ATOM 441 N LYS A 391 7.772 -12.182 -1.809 1.00 0.00 N ATOM 442 CA LYS A 391 7.665 -13.623 -1.630 1.00 0.00 C ATOM 443 C LYS A 391 6.218 -14.095 -1.764 1.00 0.00 C ATOM 444 O LYS A 391 5.275 -13.322 -1.591 1.00 0.00 O ATOM 445 CB LYS A 391 8.256 -14.041 -0.271 1.00 0.00 C ATOM 446 CG LYS A 391 7.230 -14.469 0.773 1.00 0.00 C ATOM 447 CD LYS A 391 7.865 -15.330 1.852 1.00 0.00 C ATOM 448 CE LYS A 391 8.103 -16.749 1.361 1.00 0.00 C ATOM 449 NZ LYS A 391 9.020 -17.501 2.259 1.00 0.00 N ATOM 0 H LYS A 391 6.924 -11.662 -1.581 1.00 0.00 H new ATOM 0 HA LYS A 391 8.241 -14.104 -2.420 1.00 0.00 H new ATOM 0 HB2 LYS A 391 8.953 -14.863 -0.432 1.00 0.00 H new ATOM 0 HB3 LYS A 391 8.833 -13.208 0.129 1.00 0.00 H new ATOM 0 HG2 LYS A 391 6.781 -13.586 1.227 1.00 0.00 H new ATOM 0 HG3 LYS A 391 6.426 -15.023 0.289 1.00 0.00 H new ATOM 0 HD2 LYS A 391 8.811 -14.887 2.163 1.00 0.00 H new ATOM 0 HD3 LYS A 391 7.219 -15.351 2.730 1.00 0.00 H new ATOM 0 HE2 LYS A 391 7.150 -17.274 1.293 1.00 0.00 H new ATOM 0 HE3 LYS A 391 8.523 -16.719 0.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 9.156 -18.463 1.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 9.938 -17.014 2.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 8.608 -17.552 3.212 1.00 0.00 H new ATOM 463 N LYS A 392 6.064 -15.378 -2.063 1.00 0.00 N ATOM 464 CA LYS A 392 4.755 -15.997 -2.215 1.00 0.00 C ATOM 465 C LYS A 392 4.768 -17.390 -1.597 1.00 0.00 C ATOM 466 O LYS A 392 5.825 -17.895 -1.217 1.00 0.00 O ATOM 467 CB LYS A 392 4.371 -16.085 -3.694 1.00 0.00 C ATOM 468 CG LYS A 392 5.330 -15.354 -4.620 1.00 0.00 C ATOM 469 CD LYS A 392 6.516 -16.227 -4.997 1.00 0.00 C ATOM 470 CE LYS A 392 7.111 -15.811 -6.332 1.00 0.00 C ATOM 471 NZ LYS A 392 6.224 -16.169 -7.472 1.00 0.00 N ATOM 0 H LYS A 392 6.844 -16.019 -2.207 1.00 0.00 H new ATOM 0 HA LYS A 392 4.016 -15.382 -1.701 1.00 0.00 H new ATOM 0 HB2 LYS A 392 4.326 -17.134 -3.987 1.00 0.00 H new ATOM 0 HB3 LYS A 392 3.370 -15.675 -3.825 1.00 0.00 H new ATOM 0 HG2 LYS A 392 4.802 -15.046 -5.523 1.00 0.00 H new ATOM 0 HG3 LYS A 392 5.686 -14.446 -4.133 1.00 0.00 H new ATOM 0 HD2 LYS A 392 7.279 -16.161 -4.221 1.00 0.00 H new ATOM 0 HD3 LYS A 392 6.201 -17.269 -5.047 1.00 0.00 H new ATOM 0 HE2 LYS A 392 7.285 -14.735 -6.332 1.00 0.00 H new ATOM 0 HE3 LYS A 392 8.081 -16.291 -6.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 6.772 -16.156 -8.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 5.832 -17.121 -7.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 5.447 -15.481 -7.537 1.00 0.00 H new ATOM 485 N PRO A 393 3.602 -18.039 -1.493 1.00 0.00 N ATOM 486 CA PRO A 393 3.508 -19.385 -0.925 1.00 0.00 C ATOM 487 C PRO A 393 4.329 -20.387 -1.729 1.00 0.00 C ATOM 488 O PRO A 393 4.245 -20.428 -2.956 1.00 0.00 O ATOM 489 CB PRO A 393 2.013 -19.715 -1.008 1.00 0.00 C ATOM 490 CG PRO A 393 1.460 -18.773 -2.022 1.00 0.00 C ATOM 491 CD PRO A 393 2.295 -17.527 -1.928 1.00 0.00 C ATOM 0 HA PRO A 393 3.898 -19.434 0.091 1.00 0.00 H new ATOM 0 HB2 PRO A 393 1.855 -20.751 -1.306 1.00 0.00 H new ATOM 0 HB3 PRO A 393 1.526 -19.583 -0.042 1.00 0.00 H new ATOM 0 HG2 PRO A 393 1.511 -19.202 -3.023 1.00 0.00 H new ATOM 0 HG3 PRO A 393 0.411 -18.556 -1.822 1.00 0.00 H new ATOM 0 HD2 PRO A 393 2.362 -17.012 -2.886 1.00 0.00 H new ATOM 0 HD3 PRO A 393 1.881 -16.816 -1.213 1.00 0.00 H new ATOM 499 N THR A 394 5.128 -21.188 -1.034 1.00 0.00 N ATOM 500 CA THR A 394 5.969 -22.181 -1.689 1.00 0.00 C ATOM 501 C THR A 394 6.065 -23.457 -0.862 1.00 0.00 C ATOM 502 O THR A 394 5.471 -23.558 0.211 1.00 0.00 O ATOM 503 CB THR A 394 7.389 -21.634 -1.936 1.00 0.00 C ATOM 504 OG1 THR A 394 8.192 -21.711 -0.752 1.00 0.00 O ATOM 505 CG2 THR A 394 7.338 -20.183 -2.390 1.00 0.00 C ATOM 0 H THR A 394 5.211 -21.169 -0.018 1.00 0.00 H new ATOM 0 HA THR A 394 5.501 -22.410 -2.646 1.00 0.00 H new ATOM 0 HB THR A 394 7.835 -22.252 -2.715 1.00 0.00 H new ATOM 0 HG1 THR A 394 8.617 -20.843 -0.588 1.00 0.00 H new ATOM 0 HG21 THR A 394 8.351 -19.819 -2.558 1.00 0.00 H new ATOM 0 HG22 THR A 394 6.768 -20.111 -3.317 1.00 0.00 H new ATOM 0 HG23 THR A 394 6.858 -19.578 -1.621 1.00 0.00 H new ATOM 513 N ALA A 395 6.817 -24.428 -1.368 1.00 0.00 N ATOM 514 CA ALA A 395 6.990 -25.697 -0.675 1.00 0.00 C ATOM 515 C ALA A 395 7.755 -25.505 0.627 1.00 0.00 C ATOM 516 O ALA A 395 7.343 -25.990 1.681 1.00 0.00 O ATOM 517 CB ALA A 395 7.703 -26.708 -1.559 1.00 0.00 C ATOM 0 H ALA A 395 7.316 -24.360 -2.255 1.00 0.00 H new ATOM 0 HA ALA A 395 5.998 -26.084 -0.440 1.00 0.00 H new ATOM 0 HB1 ALA A 395 7.819 -27.647 -1.017 1.00 0.00 H new ATOM 0 HB2 ALA A 395 7.116 -26.880 -2.461 1.00 0.00 H new ATOM 0 HB3 ALA A 395 8.685 -26.323 -1.833 1.00 0.00 H new ATOM 523 N VAL A 396 8.870 -24.793 0.545 1.00 0.00 N ATOM 524 CA VAL A 396 9.697 -24.531 1.711 1.00 0.00 C ATOM 525 C VAL A 396 8.933 -23.727 2.757 1.00 0.00 C ATOM 526 O VAL A 396 9.000 -24.018 3.951 1.00 0.00 O ATOM 527 CB VAL A 396 10.981 -23.774 1.317 1.00 0.00 C ATOM 528 CG1 VAL A 396 11.527 -24.306 0.001 1.00 0.00 C ATOM 529 CG2 VAL A 396 10.726 -22.273 1.224 1.00 0.00 C ATOM 0 H VAL A 396 9.223 -24.386 -0.321 1.00 0.00 H new ATOM 0 HA VAL A 396 9.970 -25.496 2.139 1.00 0.00 H new ATOM 0 HB VAL A 396 11.725 -23.940 2.096 1.00 0.00 H new ATOM 0 HG11 VAL A 396 12.433 -23.761 -0.264 1.00 0.00 H new ATOM 0 HG12 VAL A 396 11.758 -25.366 0.105 1.00 0.00 H new ATOM 0 HG13 VAL A 396 10.782 -24.172 -0.783 1.00 0.00 H new ATOM 0 HG21 VAL A 396 11.648 -21.764 0.945 1.00 0.00 H new ATOM 0 HG22 VAL A 396 9.962 -22.080 0.471 1.00 0.00 H new ATOM 0 HG23 VAL A 396 10.385 -21.901 2.190 1.00 0.00 H new ATOM 539 N ASP A 397 8.210 -22.714 2.295 1.00 0.00 N ATOM 540 CA ASP A 397 7.434 -21.862 3.187 1.00 0.00 C ATOM 541 C ASP A 397 6.233 -21.259 2.464 1.00 0.00 C ATOM 542 O ASP A 397 6.389 -20.488 1.518 1.00 0.00 O ATOM 543 CB ASP A 397 8.313 -20.746 3.754 1.00 0.00 C ATOM 544 CG ASP A 397 8.871 -21.089 5.121 1.00 0.00 C ATOM 545 OD1 ASP A 397 9.855 -21.857 5.186 1.00 0.00 O ATOM 546 OD2 ASP A 397 8.326 -20.589 6.128 1.00 0.00 O ATOM 0 H ASP A 397 8.145 -22.463 1.309 1.00 0.00 H new ATOM 0 HA ASP A 397 7.067 -22.481 4.006 1.00 0.00 H new ATOM 0 HB2 ASP A 397 9.136 -20.551 3.067 1.00 0.00 H new ATOM 0 HB3 ASP A 397 7.730 -19.827 3.822 1.00 0.00 H new ATOM 551 N PRO A 398 5.015 -21.603 2.908 1.00 0.00 N ATOM 552 CA PRO A 398 3.779 -21.096 2.309 1.00 0.00 C ATOM 553 C PRO A 398 3.451 -19.681 2.776 1.00 0.00 C ATOM 554 O PRO A 398 2.350 -19.417 3.260 1.00 0.00 O ATOM 555 CB PRO A 398 2.728 -22.081 2.815 1.00 0.00 C ATOM 556 CG PRO A 398 3.242 -22.520 4.143 1.00 0.00 C ATOM 557 CD PRO A 398 4.747 -22.517 4.035 1.00 0.00 C ATOM 0 HA PRO A 398 3.840 -21.030 1.223 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.750 -21.608 2.904 1.00 0.00 H new ATOM 0 HB3 PRO A 398 2.613 -22.925 2.134 1.00 0.00 H new ATOM 0 HG2 PRO A 398 2.907 -21.846 4.932 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.872 -23.514 4.394 1.00 0.00 H new ATOM 0 HD2 PRO A 398 5.214 -22.166 4.955 1.00 0.00 H new ATOM 0 HD3 PRO A 398 5.137 -23.516 3.841 1.00 0.00 H new ATOM 565 N ASN A 399 4.413 -18.775 2.633 1.00 0.00 N ATOM 566 CA ASN A 399 4.223 -17.391 3.047 1.00 0.00 C ATOM 567 C ASN A 399 4.412 -16.429 1.880 1.00 0.00 C ATOM 568 O ASN A 399 5.102 -16.738 0.908 1.00 0.00 O ATOM 569 CB ASN A 399 5.195 -17.036 4.173 1.00 0.00 C ATOM 570 CG ASN A 399 5.473 -18.211 5.090 1.00 0.00 C ATOM 571 OD1 ASN A 399 4.726 -19.188 5.111 1.00 0.00 O ATOM 572 ND2 ASN A 399 6.555 -18.120 5.854 1.00 0.00 N ATOM 0 H ASN A 399 5.330 -18.975 2.234 1.00 0.00 H new ATOM 0 HA ASN A 399 3.199 -17.291 3.408 1.00 0.00 H new ATOM 0 HB2 ASN A 399 6.133 -16.685 3.742 1.00 0.00 H new ATOM 0 HB3 ASN A 399 4.785 -16.212 4.757 1.00 0.00 H new ATOM 0 HD21 ASN A 399 6.795 -18.880 6.491 1.00 0.00 H new ATOM 0 HD22 ASN A 399 7.146 -17.291 5.804 1.00 0.00 H new ATOM 579 N SER A 400 3.790 -15.261 1.989 1.00 0.00 N ATOM 580 CA SER A 400 3.875 -14.234 0.958 1.00 0.00 C ATOM 581 C SER A 400 4.271 -12.896 1.578 1.00 0.00 C ATOM 582 O SER A 400 3.870 -12.586 2.700 1.00 0.00 O ATOM 583 CB SER A 400 2.517 -14.103 0.266 1.00 0.00 C ATOM 584 OG SER A 400 1.480 -14.492 1.135 1.00 0.00 O ATOM 0 H SER A 400 3.215 -15.000 2.790 1.00 0.00 H new ATOM 0 HA SER A 400 4.633 -14.518 0.228 1.00 0.00 H new ATOM 0 HB2 SER A 400 2.364 -13.072 -0.054 1.00 0.00 H new ATOM 0 HB3 SER A 400 2.499 -14.722 -0.631 1.00 0.00 H new ATOM 0 HG SER A 400 1.752 -14.330 2.062 1.00 0.00 H new ATOM 590 N ILE A 401 5.046 -12.098 0.848 1.00 0.00 N ATOM 591 CA ILE A 401 5.467 -10.794 1.347 1.00 0.00 C ATOM 592 C ILE A 401 5.135 -9.694 0.346 1.00 0.00 C ATOM 593 O ILE A 401 5.234 -9.886 -0.866 1.00 0.00 O ATOM 594 CB ILE A 401 6.975 -10.745 1.672 1.00 0.00 C ATOM 595 CG1 ILE A 401 7.318 -11.729 2.792 1.00 0.00 C ATOM 596 CG2 ILE A 401 7.381 -9.336 2.077 1.00 0.00 C ATOM 597 CD1 ILE A 401 8.735 -12.254 2.720 1.00 0.00 C ATOM 0 H ILE A 401 5.392 -12.330 -0.083 1.00 0.00 H new ATOM 0 HA ILE A 401 4.915 -10.629 2.272 1.00 0.00 H new ATOM 0 HB ILE A 401 7.527 -11.031 0.777 1.00 0.00 H new ATOM 0 HG12 ILE A 401 7.169 -11.239 3.754 1.00 0.00 H new ATOM 0 HG13 ILE A 401 6.625 -12.569 2.752 1.00 0.00 H new ATOM 0 HG21 ILE A 401 8.447 -9.315 2.304 1.00 0.00 H new ATOM 0 HG22 ILE A 401 7.171 -8.647 1.259 1.00 0.00 H new ATOM 0 HG23 ILE A 401 6.817 -9.034 2.959 1.00 0.00 H new ATOM 0 HD11 ILE A 401 8.909 -12.946 3.544 1.00 0.00 H new ATOM 0 HD12 ILE A 401 8.883 -12.773 1.773 1.00 0.00 H new ATOM 0 HD13 ILE A 401 9.435 -11.422 2.791 1.00 0.00 H new ATOM 609 N VAL A 402 4.746 -8.538 0.868 1.00 0.00 N ATOM 610 CA VAL A 402 4.406 -7.402 0.023 1.00 0.00 C ATOM 611 C VAL A 402 4.781 -6.069 0.664 1.00 0.00 C ATOM 612 O VAL A 402 4.692 -5.899 1.880 1.00 0.00 O ATOM 613 CB VAL A 402 2.908 -7.396 -0.342 1.00 0.00 C ATOM 614 CG1 VAL A 402 2.493 -6.052 -0.924 1.00 0.00 C ATOM 615 CG2 VAL A 402 2.592 -8.522 -1.316 1.00 0.00 C ATOM 0 H VAL A 402 4.658 -8.363 1.869 1.00 0.00 H new ATOM 0 HA VAL A 402 4.993 -7.518 -0.888 1.00 0.00 H new ATOM 0 HB VAL A 402 2.336 -7.558 0.572 1.00 0.00 H new ATOM 0 HG11 VAL A 402 1.432 -6.075 -1.173 1.00 0.00 H new ATOM 0 HG12 VAL A 402 2.677 -5.266 -0.192 1.00 0.00 H new ATOM 0 HG13 VAL A 402 3.073 -5.851 -1.825 1.00 0.00 H new ATOM 0 HG21 VAL A 402 1.530 -8.503 -1.563 1.00 0.00 H new ATOM 0 HG22 VAL A 402 3.178 -8.392 -2.226 1.00 0.00 H new ATOM 0 HG23 VAL A 402 2.841 -9.479 -0.858 1.00 0.00 H new ATOM 625 N GLU A 403 5.185 -5.125 -0.180 1.00 0.00 N ATOM 626 CA GLU A 403 5.563 -3.786 0.271 1.00 0.00 C ATOM 627 C GLU A 403 4.887 -2.726 -0.596 1.00 0.00 C ATOM 628 O GLU A 403 5.106 -2.676 -1.805 1.00 0.00 O ATOM 629 CB GLU A 403 7.082 -3.614 0.221 1.00 0.00 C ATOM 630 CG GLU A 403 7.843 -4.928 0.170 1.00 0.00 C ATOM 631 CD GLU A 403 9.300 -4.742 -0.204 1.00 0.00 C ATOM 632 OE1 GLU A 403 10.100 -4.384 0.686 1.00 0.00 O ATOM 633 OE2 GLU A 403 9.642 -4.954 -1.386 1.00 0.00 O ATOM 0 H GLU A 403 5.260 -5.262 -1.188 1.00 0.00 H new ATOM 0 HA GLU A 403 5.232 -3.662 1.302 1.00 0.00 H new ATOM 0 HB2 GLU A 403 7.343 -3.019 -0.654 1.00 0.00 H new ATOM 0 HB3 GLU A 403 7.404 -3.051 1.097 1.00 0.00 H new ATOM 0 HG2 GLU A 403 7.781 -5.418 1.142 1.00 0.00 H new ATOM 0 HG3 GLU A 403 7.368 -5.591 -0.553 1.00 0.00 H new ATOM 640 N CYS A 404 4.041 -1.895 0.006 1.00 0.00 N ATOM 641 CA CYS A 404 3.332 -0.876 -0.756 1.00 0.00 C ATOM 642 C CYS A 404 4.201 0.343 -1.049 1.00 0.00 C ATOM 643 O CYS A 404 4.301 1.253 -0.226 1.00 0.00 O ATOM 644 CB CYS A 404 2.108 -0.416 0.031 1.00 0.00 C ATOM 645 SG CYS A 404 0.891 -1.714 0.345 1.00 0.00 S ATOM 0 H CYS A 404 3.833 -1.907 1.004 1.00 0.00 H new ATOM 0 HA CYS A 404 3.046 -1.326 -1.707 1.00 0.00 H new ATOM 0 HB2 CYS A 404 2.438 -0.006 0.985 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.624 0.394 -0.514 1.00 0.00 H new ATOM 0 HG CYS A 404 0.198 -1.929 -0.734 1.00 0.00 H new ATOM 651 N ARG A 405 4.820 0.367 -2.225 1.00 0.00 N ATOM 652 CA ARG A 405 5.669 1.485 -2.616 1.00 0.00 C ATOM 653 C ARG A 405 4.845 2.577 -3.289 1.00 0.00 C ATOM 654 O ARG A 405 3.617 2.500 -3.341 1.00 0.00 O ATOM 655 CB ARG A 405 6.768 1.015 -3.565 1.00 0.00 C ATOM 656 CG ARG A 405 7.265 -0.390 -3.275 1.00 0.00 C ATOM 657 CD ARG A 405 8.627 -0.639 -3.903 1.00 0.00 C ATOM 658 NE ARG A 405 9.510 0.517 -3.774 1.00 0.00 N ATOM 659 CZ ARG A 405 10.533 0.757 -4.587 1.00 0.00 C ATOM 660 NH1 ARG A 405 10.801 -0.076 -5.584 1.00 0.00 N ATOM 661 NH2 ARG A 405 11.289 1.831 -4.405 1.00 0.00 N ATOM 0 H ARG A 405 4.749 -0.374 -2.922 1.00 0.00 H new ATOM 0 HA ARG A 405 6.126 1.892 -1.714 1.00 0.00 H new ATOM 0 HB2 ARG A 405 6.394 1.055 -4.588 1.00 0.00 H new ATOM 0 HB3 ARG A 405 7.608 1.707 -3.506 1.00 0.00 H new ATOM 0 HG2 ARG A 405 7.327 -0.540 -2.197 1.00 0.00 H new ATOM 0 HG3 ARG A 405 6.548 -1.117 -3.657 1.00 0.00 H new ATOM 0 HD2 ARG A 405 9.091 -1.504 -3.430 1.00 0.00 H new ATOM 0 HD3 ARG A 405 8.500 -0.882 -4.958 1.00 0.00 H new ATOM 0 HE ARG A 405 9.331 1.177 -3.017 1.00 0.00 H new ATOM 0 HH11 ARG A 405 10.221 -0.903 -5.728 1.00 0.00 H new ATOM 0 HH12 ARG A 405 11.587 0.110 -6.207 1.00 0.00 H new ATOM 0 HH21 ARG A 405 11.086 2.474 -3.640 1.00 0.00 H new ATOM 0 HH22 ARG A 405 12.074 2.014 -5.030 1.00 0.00 H new ATOM 675 N VAL A 406 5.526 3.595 -3.801 1.00 0.00 N ATOM 676 CA VAL A 406 4.849 4.701 -4.466 1.00 0.00 C ATOM 677 C VAL A 406 5.724 5.328 -5.547 1.00 0.00 C ATOM 678 O VAL A 406 6.916 5.038 -5.639 1.00 0.00 O ATOM 679 CB VAL A 406 4.421 5.783 -3.455 1.00 0.00 C ATOM 680 CG1 VAL A 406 2.918 5.728 -3.228 1.00 0.00 C ATOM 681 CG2 VAL A 406 5.168 5.616 -2.138 1.00 0.00 C ATOM 0 H VAL A 406 6.542 3.678 -3.769 1.00 0.00 H new ATOM 0 HA VAL A 406 3.959 4.286 -4.939 1.00 0.00 H new ATOM 0 HB VAL A 406 4.675 6.760 -3.867 1.00 0.00 H new ATOM 0 HG11 VAL A 406 2.630 6.498 -2.512 1.00 0.00 H new ATOM 0 HG12 VAL A 406 2.401 5.899 -4.172 1.00 0.00 H new ATOM 0 HG13 VAL A 406 2.645 4.748 -2.837 1.00 0.00 H new ATOM 0 HG21 VAL A 406 4.851 6.390 -1.439 1.00 0.00 H new ATOM 0 HG22 VAL A 406 4.949 4.635 -1.717 1.00 0.00 H new ATOM 0 HG23 VAL A 406 6.240 5.704 -2.314 1.00 0.00 H new ATOM 691 N GLY A 407 5.117 6.178 -6.371 1.00 0.00 N ATOM 692 CA GLY A 407 5.844 6.828 -7.446 1.00 0.00 C ATOM 693 C GLY A 407 7.201 7.349 -7.013 1.00 0.00 C ATOM 694 O GLY A 407 8.177 7.250 -7.756 1.00 0.00 O ATOM 0 H GLY A 407 4.130 6.429 -6.312 1.00 0.00 H new ATOM 0 HA2 GLY A 407 5.977 6.122 -8.266 1.00 0.00 H new ATOM 0 HA3 GLY A 407 5.249 7.656 -7.831 1.00 0.00 H new ATOM 698 N ASP A 408 7.263 7.906 -5.810 1.00 0.00 N ATOM 699 CA ASP A 408 8.508 8.446 -5.281 1.00 0.00 C ATOM 700 C ASP A 408 9.499 7.328 -4.970 1.00 0.00 C ATOM 701 O ASP A 408 10.651 7.585 -4.621 1.00 0.00 O ATOM 702 CB ASP A 408 8.233 9.268 -4.022 1.00 0.00 C ATOM 703 CG ASP A 408 7.192 8.623 -3.127 1.00 0.00 C ATOM 704 OD1 ASP A 408 7.492 7.566 -2.535 1.00 0.00 O ATOM 705 OD2 ASP A 408 6.078 9.177 -3.021 1.00 0.00 O ATOM 0 H ASP A 408 6.464 7.995 -5.182 1.00 0.00 H new ATOM 0 HA ASP A 408 8.948 9.092 -6.040 1.00 0.00 H new ATOM 0 HB2 ASP A 408 9.161 9.394 -3.464 1.00 0.00 H new ATOM 0 HB3 ASP A 408 7.895 10.264 -4.308 1.00 0.00 H new ATOM 710 N GLY A 409 9.041 6.087 -5.096 1.00 0.00 N ATOM 711 CA GLY A 409 9.895 4.947 -4.824 1.00 0.00 C ATOM 712 C GLY A 409 10.053 4.685 -3.340 1.00 0.00 C ATOM 713 O GLY A 409 10.984 3.995 -2.921 1.00 0.00 O ATOM 0 H GLY A 409 8.091 5.851 -5.382 1.00 0.00 H new ATOM 0 HA2 GLY A 409 9.478 4.062 -5.304 1.00 0.00 H new ATOM 0 HA3 GLY A 409 10.876 5.118 -5.267 1.00 0.00 H new ATOM 717 N THR A 410 9.148 5.240 -2.539 1.00 0.00 N ATOM 718 CA THR A 410 9.203 5.062 -1.095 1.00 0.00 C ATOM 719 C THR A 410 8.185 4.036 -0.612 1.00 0.00 C ATOM 720 O THR A 410 7.008 4.093 -0.970 1.00 0.00 O ATOM 721 CB THR A 410 8.963 6.392 -0.358 1.00 0.00 C ATOM 722 OG1 THR A 410 9.789 7.438 -0.887 1.00 0.00 O ATOM 723 CG2 THR A 410 9.260 6.247 1.127 1.00 0.00 C ATOM 0 H THR A 410 8.371 5.814 -2.866 1.00 0.00 H new ATOM 0 HA THR A 410 10.205 4.698 -0.867 1.00 0.00 H new ATOM 0 HB THR A 410 7.914 6.652 -0.503 1.00 0.00 H new ATOM 0 HG1 THR A 410 9.329 7.870 -1.637 1.00 0.00 H new ATOM 0 HG21 THR A 410 9.084 7.199 1.628 1.00 0.00 H new ATOM 0 HG22 THR A 410 8.609 5.485 1.556 1.00 0.00 H new ATOM 0 HG23 THR A 410 10.301 5.953 1.263 1.00 0.00 H new ATOM 731 N VAL A 411 8.643 3.110 0.226 1.00 0.00 N ATOM 732 CA VAL A 411 7.767 2.088 0.781 1.00 0.00 C ATOM 733 C VAL A 411 6.841 2.705 1.821 1.00 0.00 C ATOM 734 O VAL A 411 7.250 2.965 2.953 1.00 0.00 O ATOM 735 CB VAL A 411 8.569 0.944 1.433 1.00 0.00 C ATOM 736 CG1 VAL A 411 7.632 -0.081 2.053 1.00 0.00 C ATOM 737 CG2 VAL A 411 9.488 0.289 0.414 1.00 0.00 C ATOM 0 H VAL A 411 9.613 3.048 0.534 1.00 0.00 H new ATOM 0 HA VAL A 411 7.184 1.674 -0.041 1.00 0.00 H new ATOM 0 HB VAL A 411 9.186 1.364 2.227 1.00 0.00 H new ATOM 0 HG11 VAL A 411 8.217 -0.880 2.508 1.00 0.00 H new ATOM 0 HG12 VAL A 411 7.020 0.400 2.816 1.00 0.00 H new ATOM 0 HG13 VAL A 411 6.987 -0.498 1.280 1.00 0.00 H new ATOM 0 HG21 VAL A 411 10.046 -0.516 0.892 1.00 0.00 H new ATOM 0 HG22 VAL A 411 8.893 -0.118 -0.404 1.00 0.00 H new ATOM 0 HG23 VAL A 411 10.184 1.031 0.022 1.00 0.00 H new ATOM 747 N LEU A 412 5.595 2.955 1.431 1.00 0.00 N ATOM 748 CA LEU A 412 4.628 3.555 2.328 1.00 0.00 C ATOM 749 C LEU A 412 4.002 2.497 3.223 1.00 0.00 C ATOM 750 O LEU A 412 3.622 2.782 4.360 1.00 0.00 O ATOM 751 CB LEU A 412 3.563 4.309 1.517 1.00 0.00 C ATOM 752 CG LEU A 412 2.110 3.889 1.742 1.00 0.00 C ATOM 753 CD1 LEU A 412 1.521 4.606 2.948 1.00 0.00 C ATOM 754 CD2 LEU A 412 1.287 4.187 0.499 1.00 0.00 C ATOM 0 H LEU A 412 5.236 2.749 0.499 1.00 0.00 H new ATOM 0 HA LEU A 412 5.135 4.272 2.974 1.00 0.00 H new ATOM 0 HB2 LEU A 412 3.650 5.371 1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.793 4.190 0.458 1.00 0.00 H new ATOM 0 HG LEU A 412 2.085 2.817 1.938 1.00 0.00 H new ATOM 0 HD11 LEU A 412 0.487 4.292 3.089 1.00 0.00 H new ATOM 0 HD12 LEU A 412 2.100 4.358 3.837 1.00 0.00 H new ATOM 0 HD13 LEU A 412 1.554 5.683 2.783 1.00 0.00 H new ATOM 0 HD21 LEU A 412 0.253 3.885 0.666 1.00 0.00 H new ATOM 0 HD22 LEU A 412 1.323 5.255 0.286 1.00 0.00 H new ATOM 0 HD23 LEU A 412 1.694 3.634 -0.348 1.00 0.00 H new ATOM 766 N GLY A 413 3.906 1.269 2.713 1.00 0.00 N ATOM 767 CA GLY A 413 3.330 0.191 3.492 1.00 0.00 C ATOM 768 C GLY A 413 4.074 -1.116 3.335 1.00 0.00 C ATOM 769 O GLY A 413 4.985 -1.232 2.515 1.00 0.00 O ATOM 0 H GLY A 413 4.216 1.006 1.778 1.00 0.00 H new ATOM 0 HA2 GLY A 413 3.323 0.474 4.544 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.291 0.049 3.193 1.00 0.00 H new ATOM 773 N THR A 414 3.674 -2.102 4.125 1.00 0.00 N ATOM 774 CA THR A 414 4.281 -3.422 4.090 1.00 0.00 C ATOM 775 C THR A 414 3.344 -4.433 4.731 1.00 0.00 C ATOM 776 O THR A 414 2.672 -4.128 5.715 1.00 0.00 O ATOM 777 CB THR A 414 5.636 -3.446 4.822 1.00 0.00 C ATOM 778 OG1 THR A 414 6.587 -2.579 4.191 1.00 0.00 O ATOM 779 CG2 THR A 414 6.212 -4.854 4.849 1.00 0.00 C ATOM 0 H THR A 414 2.921 -2.009 4.807 1.00 0.00 H new ATOM 0 HA THR A 414 4.456 -3.680 3.046 1.00 0.00 H new ATOM 0 HB THR A 414 5.452 -3.100 5.839 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.214 -2.241 3.350 1.00 0.00 H new ATOM 0 HG21 THR A 414 7.169 -4.846 5.371 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.522 -5.520 5.367 1.00 0.00 H new ATOM 0 HG23 THR A 414 6.359 -5.207 3.828 1.00 0.00 H new ATOM 787 N GLY A 415 3.291 -5.634 4.175 1.00 0.00 N ATOM 788 CA GLY A 415 2.417 -6.650 4.723 1.00 0.00 C ATOM 789 C GLY A 415 2.738 -8.035 4.211 1.00 0.00 C ATOM 790 O GLY A 415 3.297 -8.192 3.125 1.00 0.00 O ATOM 0 H GLY A 415 3.833 -5.922 3.360 1.00 0.00 H new ATOM 0 HA2 GLY A 415 2.495 -6.642 5.810 1.00 0.00 H new ATOM 0 HA3 GLY A 415 1.384 -6.406 4.476 1.00 0.00 H new ATOM 794 N VAL A 416 2.383 -9.041 4.997 1.00 0.00 N ATOM 795 CA VAL A 416 2.629 -10.422 4.632 1.00 0.00 C ATOM 796 C VAL A 416 1.387 -11.268 4.892 1.00 0.00 C ATOM 797 O VAL A 416 0.651 -11.026 5.850 1.00 0.00 O ATOM 798 CB VAL A 416 3.834 -10.987 5.426 1.00 0.00 C ATOM 799 CG1 VAL A 416 3.676 -12.475 5.706 1.00 0.00 C ATOM 800 CG2 VAL A 416 5.128 -10.717 4.679 1.00 0.00 C ATOM 0 H VAL A 416 1.920 -8.921 5.898 1.00 0.00 H new ATOM 0 HA VAL A 416 2.864 -10.460 3.568 1.00 0.00 H new ATOM 0 HB VAL A 416 3.868 -10.477 6.389 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.541 -12.834 6.264 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.772 -12.641 6.291 1.00 0.00 H new ATOM 0 HG13 VAL A 416 3.602 -13.017 4.763 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.967 -11.119 5.247 1.00 0.00 H new ATOM 0 HG22 VAL A 416 5.090 -11.196 3.701 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.257 -9.642 4.552 1.00 0.00 H new ATOM 810 N GLY A 417 1.168 -12.272 4.053 1.00 0.00 N ATOM 811 CA GLY A 417 0.027 -13.145 4.236 1.00 0.00 C ATOM 812 C GLY A 417 0.249 -14.482 3.566 1.00 0.00 C ATOM 813 O GLY A 417 1.390 -14.913 3.403 1.00 0.00 O ATOM 0 H GLY A 417 1.758 -12.496 3.252 1.00 0.00 H new ATOM 0 HA2 GLY A 417 -0.153 -13.294 5.301 1.00 0.00 H new ATOM 0 HA3 GLY A 417 -0.865 -12.673 3.825 1.00 0.00 H new ATOM 817 N ARG A 418 -0.830 -15.133 3.164 1.00 0.00 N ATOM 818 CA ARG A 418 -0.717 -16.418 2.487 1.00 0.00 C ATOM 819 C ARG A 418 -0.300 -16.206 1.048 1.00 0.00 C ATOM 820 O ARG A 418 0.544 -16.924 0.513 1.00 0.00 O ATOM 821 CB ARG A 418 -2.027 -17.179 2.502 1.00 0.00 C ATOM 822 CG ARG A 418 -3.225 -16.352 2.069 1.00 0.00 C ATOM 823 CD ARG A 418 -4.533 -16.967 2.541 1.00 0.00 C ATOM 824 NE ARG A 418 -4.989 -18.034 1.653 1.00 0.00 N ATOM 825 CZ ARG A 418 -5.512 -17.818 0.451 1.00 0.00 C ATOM 826 NH1 ARG A 418 -5.634 -16.580 -0.009 1.00 0.00 N ATOM 827 NH2 ARG A 418 -5.911 -18.839 -0.294 1.00 0.00 N ATOM 0 H ARG A 418 -1.785 -14.799 3.292 1.00 0.00 H new ATOM 0 HA ARG A 418 0.032 -17.002 3.022 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -1.940 -18.045 1.846 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -2.204 -17.558 3.509 1.00 0.00 H new ATOM 0 HG2 ARG A 418 -3.133 -15.342 2.468 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -3.234 -16.266 0.982 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -4.404 -17.364 3.548 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -5.298 -16.192 2.599 1.00 0.00 H new ATOM 0 HE ARG A 418 -4.901 -18.998 1.974 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -5.326 -15.792 0.560 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -6.036 -16.416 -0.932 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -5.817 -19.793 0.055 1.00 0.00 H new ATOM 0 HH22 ARG A 418 -6.312 -18.671 -1.217 1.00 0.00 H new ATOM 841 N ASN A 419 -0.898 -15.197 0.436 1.00 0.00 N ATOM 842 CA ASN A 419 -0.605 -14.846 -0.939 1.00 0.00 C ATOM 843 C ASN A 419 -0.376 -13.348 -1.057 1.00 0.00 C ATOM 844 O ASN A 419 -0.673 -12.586 -0.136 1.00 0.00 O ATOM 845 CB ASN A 419 -1.755 -15.270 -1.853 1.00 0.00 C ATOM 846 CG ASN A 419 -1.345 -16.341 -2.842 1.00 0.00 C ATOM 847 OD1 ASN A 419 -0.214 -16.828 -2.815 1.00 0.00 O ATOM 848 ND2 ASN A 419 -2.263 -16.713 -3.725 1.00 0.00 N ATOM 0 H ASN A 419 -1.598 -14.601 0.879 1.00 0.00 H new ATOM 0 HA ASN A 419 0.300 -15.370 -1.247 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -2.581 -15.639 -1.245 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -2.123 -14.400 -2.396 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -2.044 -17.429 -4.418 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -3.188 -16.283 -3.711 1.00 0.00 H new ATOM 855 N ILE A 420 0.147 -12.929 -2.196 1.00 0.00 N ATOM 856 CA ILE A 420 0.411 -11.519 -2.445 1.00 0.00 C ATOM 857 C ILE A 420 -0.804 -10.658 -2.119 1.00 0.00 C ATOM 858 O ILE A 420 -0.681 -9.448 -1.921 1.00 0.00 O ATOM 859 CB ILE A 420 0.818 -11.288 -3.908 1.00 0.00 C ATOM 860 CG1 ILE A 420 2.215 -11.846 -4.143 1.00 0.00 C ATOM 861 CG2 ILE A 420 0.761 -9.808 -4.257 1.00 0.00 C ATOM 862 CD1 ILE A 420 2.219 -13.204 -4.808 1.00 0.00 C ATOM 0 H ILE A 420 0.399 -13.547 -2.968 1.00 0.00 H new ATOM 0 HA ILE A 420 1.233 -11.227 -1.791 1.00 0.00 H new ATOM 0 HB ILE A 420 0.115 -11.809 -4.558 1.00 0.00 H new ATOM 0 HG12 ILE A 420 2.778 -11.146 -4.761 1.00 0.00 H new ATOM 0 HG13 ILE A 420 2.735 -11.917 -3.187 1.00 0.00 H new ATOM 0 HG21 ILE A 420 1.053 -9.668 -5.298 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -0.254 -9.439 -4.112 1.00 0.00 H new ATOM 0 HG23 ILE A 420 1.443 -9.255 -3.611 1.00 0.00 H new ATOM 0 HD11 ILE A 420 3.247 -13.539 -4.944 1.00 0.00 H new ATOM 0 HD12 ILE A 420 1.684 -13.918 -4.181 1.00 0.00 H new ATOM 0 HD13 ILE A 420 1.728 -13.135 -5.779 1.00 0.00 H new ATOM 874 N LYS A 421 -1.971 -11.281 -2.054 1.00 0.00 N ATOM 875 CA LYS A 421 -3.179 -10.557 -1.735 1.00 0.00 C ATOM 876 C LYS A 421 -3.229 -10.247 -0.254 1.00 0.00 C ATOM 877 O LYS A 421 -3.288 -9.090 0.140 1.00 0.00 O ATOM 878 CB LYS A 421 -4.406 -11.352 -2.144 1.00 0.00 C ATOM 879 CG LYS A 421 -5.699 -10.685 -1.738 1.00 0.00 C ATOM 880 CD LYS A 421 -5.600 -9.176 -1.867 1.00 0.00 C ATOM 881 CE LYS A 421 -5.386 -8.765 -3.311 1.00 0.00 C ATOM 882 NZ LYS A 421 -6.653 -8.328 -3.959 1.00 0.00 N ATOM 0 H LYS A 421 -2.101 -12.279 -2.218 1.00 0.00 H new ATOM 0 HA LYS A 421 -3.174 -9.620 -2.292 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.399 -11.492 -3.225 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.357 -12.344 -1.694 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.513 -11.054 -2.362 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.941 -10.950 -0.709 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.511 -8.715 -1.485 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -4.776 -8.809 -1.255 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -4.659 -7.954 -3.353 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -4.964 -9.602 -3.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -6.488 -7.445 -4.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -6.979 -9.065 -4.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -7.378 -8.168 -3.231 1.00 0.00 H new ATOM 896 N ILE A 422 -3.196 -11.282 0.568 1.00 0.00 N ATOM 897 CA ILE A 422 -3.229 -11.087 2.008 1.00 0.00 C ATOM 898 C ILE A 422 -2.098 -10.178 2.432 1.00 0.00 C ATOM 899 O ILE A 422 -2.268 -9.301 3.279 1.00 0.00 O ATOM 900 CB ILE A 422 -3.146 -12.421 2.757 1.00 0.00 C ATOM 901 CG1 ILE A 422 -4.304 -13.326 2.335 1.00 0.00 C ATOM 902 CG2 ILE A 422 -3.160 -12.191 4.260 1.00 0.00 C ATOM 903 CD1 ILE A 422 -5.547 -12.576 1.876 1.00 0.00 C ATOM 0 H ILE A 422 -3.147 -12.256 0.268 1.00 0.00 H new ATOM 0 HA ILE A 422 -4.181 -10.621 2.263 1.00 0.00 H new ATOM 0 HB ILE A 422 -2.207 -12.913 2.501 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -3.967 -13.976 1.528 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -4.571 -13.970 3.173 1.00 0.00 H new ATOM 0 HG21 ILE A 422 -3.100 -13.150 4.775 1.00 0.00 H new ATOM 0 HG22 ILE A 422 -2.307 -11.574 4.542 1.00 0.00 H new ATOM 0 HG23 ILE A 422 -4.083 -11.684 4.542 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -6.320 -13.291 1.595 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -5.913 -11.947 2.687 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -5.299 -11.953 1.017 1.00 0.00 H new ATOM 915 N ALA A 423 -0.949 -10.354 1.802 1.00 0.00 N ATOM 916 CA ALA A 423 0.181 -9.504 2.091 1.00 0.00 C ATOM 917 C ALA A 423 -0.169 -8.099 1.633 1.00 0.00 C ATOM 918 O ALA A 423 -0.113 -7.139 2.401 1.00 0.00 O ATOM 919 CB ALA A 423 1.445 -9.996 1.402 1.00 0.00 C ATOM 0 H ALA A 423 -0.780 -11.070 1.096 1.00 0.00 H new ATOM 0 HA ALA A 423 0.386 -9.518 3.162 1.00 0.00 H new ATOM 0 HB1 ALA A 423 2.274 -9.330 1.644 1.00 0.00 H new ATOM 0 HB2 ALA A 423 1.677 -11.004 1.745 1.00 0.00 H new ATOM 0 HB3 ALA A 423 1.291 -10.006 0.323 1.00 0.00 H new ATOM 925 N GLY A 424 -0.565 -8.005 0.365 1.00 0.00 N ATOM 926 CA GLY A 424 -0.964 -6.732 -0.204 1.00 0.00 C ATOM 927 C GLY A 424 -2.058 -6.074 0.612 1.00 0.00 C ATOM 928 O GLY A 424 -1.978 -4.884 0.918 1.00 0.00 O ATOM 0 H GLY A 424 -0.616 -8.794 -0.280 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -0.100 -6.070 -0.256 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -1.312 -6.883 -1.226 1.00 0.00 H new ATOM 932 N ILE A 425 -3.075 -6.854 0.991 1.00 0.00 N ATOM 933 CA ILE A 425 -4.163 -6.332 1.802 1.00 0.00 C ATOM 934 C ILE A 425 -3.594 -5.724 3.072 1.00 0.00 C ATOM 935 O ILE A 425 -3.717 -4.525 3.319 1.00 0.00 O ATOM 936 CB ILE A 425 -5.167 -7.434 2.202 1.00 0.00 C ATOM 937 CG1 ILE A 425 -5.904 -7.975 0.977 1.00 0.00 C ATOM 938 CG2 ILE A 425 -6.161 -6.900 3.219 1.00 0.00 C ATOM 939 CD1 ILE A 425 -6.168 -9.461 1.045 1.00 0.00 C ATOM 0 H ILE A 425 -3.162 -7.841 0.748 1.00 0.00 H new ATOM 0 HA ILE A 425 -4.687 -5.586 1.205 1.00 0.00 H new ATOM 0 HB ILE A 425 -4.607 -8.254 2.652 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -6.853 -7.449 0.871 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -5.318 -7.758 0.084 1.00 0.00 H new ATOM 0 HG21 ILE A 425 -6.862 -7.689 3.491 1.00 0.00 H new ATOM 0 HG22 ILE A 425 -5.627 -6.566 4.109 1.00 0.00 H new ATOM 0 HG23 ILE A 425 -6.708 -6.061 2.788 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -6.694 -9.779 0.145 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -5.221 -9.996 1.120 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -6.780 -9.682 1.919 1.00 0.00 H new ATOM 951 N ARG A 426 -2.962 -6.582 3.868 1.00 0.00 N ATOM 952 CA ARG A 426 -2.351 -6.178 5.125 1.00 0.00 C ATOM 953 C ARG A 426 -1.432 -4.975 4.940 1.00 0.00 C ATOM 954 O ARG A 426 -1.386 -4.091 5.791 1.00 0.00 O ATOM 955 CB ARG A 426 -1.568 -7.349 5.711 1.00 0.00 C ATOM 956 CG ARG A 426 -1.884 -7.634 7.169 1.00 0.00 C ATOM 957 CD ARG A 426 -0.989 -8.731 7.725 1.00 0.00 C ATOM 958 NE ARG A 426 0.000 -8.204 8.661 1.00 0.00 N ATOM 959 CZ ARG A 426 0.582 -8.933 9.606 1.00 0.00 C ATOM 960 NH1 ARG A 426 0.278 -10.217 9.738 1.00 0.00 N ATOM 961 NH2 ARG A 426 1.469 -8.378 10.420 1.00 0.00 N ATOM 0 H ARG A 426 -2.861 -7.575 3.658 1.00 0.00 H new ATOM 0 HA ARG A 426 -3.145 -5.885 5.811 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -1.776 -8.243 5.123 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -0.502 -7.145 5.614 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -1.755 -6.724 7.756 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -2.929 -7.930 7.266 1.00 0.00 H new ATOM 0 HD2 ARG A 426 -1.602 -9.480 8.227 1.00 0.00 H new ATOM 0 HD3 ARG A 426 -0.479 -9.235 6.904 1.00 0.00 H new ATOM 0 HE ARG A 426 0.258 -7.220 8.585 1.00 0.00 H new ATOM 0 HH11 ARG A 426 -0.404 -10.646 9.113 1.00 0.00 H new ATOM 0 HH12 ARG A 426 0.726 -10.775 10.465 1.00 0.00 H new ATOM 0 HH21 ARG A 426 1.705 -7.391 10.321 1.00 0.00 H new ATOM 0 HH22 ARG A 426 1.916 -8.938 11.146 1.00 0.00 H new ATOM 975 N ALA A 427 -0.700 -4.946 3.830 1.00 0.00 N ATOM 976 CA ALA A 427 0.213 -3.841 3.553 1.00 0.00 C ATOM 977 C ALA A 427 -0.562 -2.560 3.260 1.00 0.00 C ATOM 978 O ALA A 427 -0.460 -1.579 3.989 1.00 0.00 O ATOM 979 CB ALA A 427 1.136 -4.168 2.386 1.00 0.00 C ATOM 0 H ALA A 427 -0.720 -5.670 3.112 1.00 0.00 H new ATOM 0 HA ALA A 427 0.824 -3.688 4.443 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.804 -3.326 2.204 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.725 -5.054 2.625 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.540 -4.358 1.493 1.00 0.00 H new ATOM 985 N ALA A 428 -1.335 -2.585 2.182 1.00 0.00 N ATOM 986 CA ALA A 428 -2.125 -1.425 1.794 1.00 0.00 C ATOM 987 C ALA A 428 -2.757 -0.833 3.036 1.00 0.00 C ATOM 988 O ALA A 428 -2.654 0.365 3.302 1.00 0.00 O ATOM 989 CB ALA A 428 -3.193 -1.798 0.785 1.00 0.00 C ATOM 0 H ALA A 428 -1.431 -3.391 1.564 1.00 0.00 H new ATOM 0 HA ALA A 428 -1.473 -0.691 1.320 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -3.765 -0.910 0.516 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -2.722 -2.211 -0.107 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -3.861 -2.542 1.220 1.00 0.00 H new ATOM 995 N GLU A 429 -3.386 -1.706 3.804 1.00 0.00 N ATOM 996 CA GLU A 429 -4.024 -1.331 5.049 1.00 0.00 C ATOM 997 C GLU A 429 -2.984 -0.782 6.020 1.00 0.00 C ATOM 998 O GLU A 429 -3.108 0.322 6.542 1.00 0.00 O ATOM 999 CB GLU A 429 -4.685 -2.571 5.640 1.00 0.00 C ATOM 1000 CG GLU A 429 -6.114 -2.341 6.103 1.00 0.00 C ATOM 1001 CD GLU A 429 -6.319 -2.701 7.561 1.00 0.00 C ATOM 1002 OE1 GLU A 429 -5.824 -3.766 7.985 1.00 0.00 O ATOM 1003 OE2 GLU A 429 -6.975 -1.918 8.279 1.00 0.00 O ATOM 0 H GLU A 429 -3.467 -2.697 3.579 1.00 0.00 H new ATOM 0 HA GLU A 429 -4.771 -0.558 4.870 1.00 0.00 H new ATOM 0 HB2 GLU A 429 -4.678 -3.366 4.894 1.00 0.00 H new ATOM 0 HB3 GLU A 429 -4.091 -2.921 6.484 1.00 0.00 H new ATOM 0 HG2 GLU A 429 -6.377 -1.294 5.950 1.00 0.00 H new ATOM 0 HG3 GLU A 429 -6.791 -2.933 5.488 1.00 0.00 H new ATOM 1010 N ASN A 430 -1.962 -1.592 6.242 1.00 0.00 N ATOM 1011 CA ASN A 430 -0.875 -1.236 7.149 1.00 0.00 C ATOM 1012 C ASN A 430 -0.442 0.196 6.881 1.00 0.00 C ATOM 1013 O ASN A 430 -0.452 1.042 7.776 1.00 0.00 O ATOM 1014 CB ASN A 430 0.305 -2.188 6.965 1.00 0.00 C ATOM 1015 CG ASN A 430 1.565 -1.691 7.646 1.00 0.00 C ATOM 1016 OD1 ASN A 430 2.324 -0.907 7.076 1.00 0.00 O ATOM 1017 ND2 ASN A 430 1.795 -2.147 8.872 1.00 0.00 N ATOM 0 H ASN A 430 -1.859 -2.508 5.805 1.00 0.00 H new ATOM 0 HA ASN A 430 -1.226 -1.320 8.178 1.00 0.00 H new ATOM 0 HB2 ASN A 430 0.043 -3.168 7.364 1.00 0.00 H new ATOM 0 HB3 ASN A 430 0.499 -2.319 5.900 1.00 0.00 H new ATOM 0 HD21 ASN A 430 2.628 -1.848 9.379 1.00 0.00 H new ATOM 0 HD22 ASN A 430 1.139 -2.796 9.306 1.00 0.00 H new ATOM 1024 N ALA A 431 -0.094 0.465 5.633 1.00 0.00 N ATOM 1025 CA ALA A 431 0.309 1.797 5.222 1.00 0.00 C ATOM 1026 C ALA A 431 -0.861 2.749 5.373 1.00 0.00 C ATOM 1027 O ALA A 431 -0.695 3.934 5.666 1.00 0.00 O ATOM 1028 CB ALA A 431 0.791 1.793 3.782 1.00 0.00 C ATOM 0 H ALA A 431 -0.083 -0.227 4.884 1.00 0.00 H new ATOM 0 HA ALA A 431 1.132 2.126 5.857 1.00 0.00 H new ATOM 0 HB1 ALA A 431 1.088 2.802 3.495 1.00 0.00 H new ATOM 0 HB2 ALA A 431 1.645 1.122 3.686 1.00 0.00 H new ATOM 0 HB3 ALA A 431 -0.013 1.452 3.130 1.00 0.00 H new ATOM 1034 N LEU A 432 -2.048 2.205 5.165 1.00 0.00 N ATOM 1035 CA LEU A 432 -3.277 2.968 5.268 1.00 0.00 C ATOM 1036 C LEU A 432 -3.556 3.362 6.715 1.00 0.00 C ATOM 1037 O LEU A 432 -4.074 4.445 6.983 1.00 0.00 O ATOM 1038 CB LEU A 432 -4.420 2.130 4.707 1.00 0.00 C ATOM 1039 CG LEU A 432 -5.823 2.646 4.980 1.00 0.00 C ATOM 1040 CD1 LEU A 432 -6.810 1.891 4.118 1.00 0.00 C ATOM 1041 CD2 LEU A 432 -6.182 2.499 6.453 1.00 0.00 C ATOM 0 H LEU A 432 -2.185 1.224 4.921 1.00 0.00 H new ATOM 0 HA LEU A 432 -3.181 3.889 4.694 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -4.288 2.048 3.628 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -4.339 1.123 5.115 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.863 3.707 4.733 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -7.818 2.259 4.311 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -6.564 2.041 3.067 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -6.760 0.828 4.354 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -7.191 2.876 6.621 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -6.136 1.447 6.736 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -5.477 3.069 7.058 1.00 0.00 H new ATOM 1053 N ARG A 433 -3.209 2.476 7.645 1.00 0.00 N ATOM 1054 CA ARG A 433 -3.425 2.740 9.065 1.00 0.00 C ATOM 1055 C ARG A 433 -2.727 4.028 9.482 1.00 0.00 C ATOM 1056 O ARG A 433 -3.271 4.829 10.243 1.00 0.00 O ATOM 1057 CB ARG A 433 -2.904 1.581 9.921 1.00 0.00 C ATOM 1058 CG ARG A 433 -3.003 0.220 9.255 1.00 0.00 C ATOM 1059 CD ARG A 433 -4.412 -0.057 8.757 1.00 0.00 C ATOM 1060 NE ARG A 433 -5.278 -0.562 9.818 1.00 0.00 N ATOM 1061 CZ ARG A 433 -5.173 -1.780 10.340 1.00 0.00 C ATOM 1062 NH1 ARG A 433 -4.246 -2.617 9.895 1.00 0.00 N ATOM 1063 NH2 ARG A 433 -5.995 -2.165 11.307 1.00 0.00 N ATOM 0 H ARG A 433 -2.779 1.573 7.443 1.00 0.00 H new ATOM 0 HA ARG A 433 -4.498 2.844 9.224 1.00 0.00 H new ATOM 0 HB2 ARG A 433 -1.862 1.773 10.176 1.00 0.00 H new ATOM 0 HB3 ARG A 433 -3.462 1.556 10.857 1.00 0.00 H new ATOM 0 HG2 ARG A 433 -2.305 0.171 8.419 1.00 0.00 H new ATOM 0 HG3 ARG A 433 -2.708 -0.555 9.963 1.00 0.00 H new ATOM 0 HD2 ARG A 433 -4.838 0.859 8.347 1.00 0.00 H new ATOM 0 HD3 ARG A 433 -4.373 -0.783 7.945 1.00 0.00 H new ATOM 0 HE ARG A 433 -6.005 0.055 10.180 1.00 0.00 H new ATOM 0 HH11 ARG A 433 -3.612 -2.327 9.151 1.00 0.00 H new ATOM 0 HH12 ARG A 433 -4.167 -3.551 10.297 1.00 0.00 H new ATOM 0 HH21 ARG A 433 -6.711 -1.526 11.653 1.00 0.00 H new ATOM 0 HH22 ARG A 433 -5.911 -3.100 11.705 1.00 0.00 H new ATOM 1077 N ASP A 434 -1.515 4.214 8.979 1.00 0.00 N ATOM 1078 CA ASP A 434 -0.723 5.392 9.288 1.00 0.00 C ATOM 1079 C ASP A 434 -1.353 6.654 8.702 1.00 0.00 C ATOM 1080 O ASP A 434 -1.341 6.863 7.490 1.00 0.00 O ATOM 1081 CB ASP A 434 0.699 5.215 8.762 1.00 0.00 C ATOM 1082 CG ASP A 434 1.447 4.109 9.477 1.00 0.00 C ATOM 1083 OD1 ASP A 434 1.536 4.160 10.721 1.00 0.00 O ATOM 1084 OD2 ASP A 434 1.943 3.189 8.792 1.00 0.00 O ATOM 0 H ASP A 434 -1.057 3.556 8.349 1.00 0.00 H new ATOM 0 HA ASP A 434 -0.693 5.508 10.371 1.00 0.00 H new ATOM 0 HB2 ASP A 434 0.664 4.995 7.695 1.00 0.00 H new ATOM 0 HB3 ASP A 434 1.245 6.152 8.876 1.00 0.00 H new ATOM 1089 N LYS A 435 -1.887 7.496 9.579 1.00 0.00 N ATOM 1090 CA LYS A 435 -2.509 8.748 9.156 1.00 0.00 C ATOM 1091 C LYS A 435 -1.450 9.720 8.662 1.00 0.00 C ATOM 1092 O LYS A 435 -1.527 10.215 7.541 1.00 0.00 O ATOM 1093 CB LYS A 435 -3.302 9.376 10.302 1.00 0.00 C ATOM 1094 CG LYS A 435 -4.277 10.449 9.844 1.00 0.00 C ATOM 1095 CD LYS A 435 -5.720 9.994 9.992 1.00 0.00 C ATOM 1096 CE LYS A 435 -6.416 9.902 8.644 1.00 0.00 C ATOM 1097 NZ LYS A 435 -7.835 10.347 8.718 1.00 0.00 N ATOM 0 H LYS A 435 -1.903 7.336 10.586 1.00 0.00 H new ATOM 0 HA LYS A 435 -3.198 8.528 8.341 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -3.853 8.594 10.824 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -2.607 9.810 11.020 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -4.120 11.357 10.426 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -4.079 10.700 8.802 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -5.747 9.022 10.484 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -6.258 10.691 10.634 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -5.881 10.514 7.917 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -6.377 8.874 8.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -8.273 10.269 7.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -8.352 9.747 9.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -7.872 11.337 9.036 1.00 0.00 H new ATOM 1111 N LYS A 436 -0.477 10.003 9.515 1.00 0.00 N ATOM 1112 CA LYS A 436 0.581 10.937 9.174 1.00 0.00 C ATOM 1113 C LYS A 436 0.960 10.792 7.707 1.00 0.00 C ATOM 1114 O LYS A 436 0.937 11.769 6.959 1.00 0.00 O ATOM 1115 CB LYS A 436 1.798 10.695 10.064 1.00 0.00 C ATOM 1116 CG LYS A 436 1.688 11.343 11.434 1.00 0.00 C ATOM 1117 CD LYS A 436 2.122 10.392 12.537 1.00 0.00 C ATOM 1118 CE LYS A 436 2.486 11.143 13.807 1.00 0.00 C ATOM 1119 NZ LYS A 436 3.894 11.623 13.784 1.00 0.00 N ATOM 0 H LYS A 436 -0.400 9.598 10.448 1.00 0.00 H new ATOM 0 HA LYS A 436 0.222 11.953 9.339 1.00 0.00 H new ATOM 0 HB2 LYS A 436 1.938 9.621 10.189 1.00 0.00 H new ATOM 0 HB3 LYS A 436 2.687 11.076 9.561 1.00 0.00 H new ATOM 0 HG2 LYS A 436 2.305 12.241 11.463 1.00 0.00 H new ATOM 0 HG3 LYS A 436 0.659 11.657 11.607 1.00 0.00 H new ATOM 0 HD2 LYS A 436 1.318 9.686 12.748 1.00 0.00 H new ATOM 0 HD3 LYS A 436 2.979 9.808 12.200 1.00 0.00 H new ATOM 0 HE2 LYS A 436 1.815 11.993 13.931 1.00 0.00 H new ATOM 0 HE3 LYS A 436 2.339 10.492 14.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 4.102 12.130 14.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 4.536 10.810 13.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 4.029 12.265 12.977 1.00 0.00 H new ATOM 1133 N MET A 437 1.274 9.575 7.287 1.00 0.00 N ATOM 1134 CA MET A 437 1.614 9.340 5.885 1.00 0.00 C ATOM 1135 C MET A 437 0.413 9.702 5.028 1.00 0.00 C ATOM 1136 O MET A 437 0.542 10.410 4.034 1.00 0.00 O ATOM 1137 CB MET A 437 2.040 7.889 5.614 1.00 0.00 C ATOM 1138 CG MET A 437 2.010 6.984 6.834 1.00 0.00 C ATOM 1139 SD MET A 437 2.843 5.410 6.550 1.00 0.00 S ATOM 1140 CE MET A 437 4.132 5.480 7.791 1.00 0.00 C ATOM 0 H MET A 437 1.301 8.747 7.882 1.00 0.00 H new ATOM 0 HA MET A 437 2.470 9.966 5.634 1.00 0.00 H new ATOM 0 HB2 MET A 437 1.386 7.469 4.850 1.00 0.00 H new ATOM 0 HB3 MET A 437 3.050 7.891 5.204 1.00 0.00 H new ATOM 0 HG2 MET A 437 2.483 7.495 7.673 1.00 0.00 H new ATOM 0 HG3 MET A 437 0.974 6.797 7.118 1.00 0.00 H new ATOM 0 HE1 MET A 437 4.621 4.508 7.863 1.00 0.00 H new ATOM 0 HE2 MET A 437 4.866 6.236 7.511 1.00 0.00 H new ATOM 0 HE3 MET A 437 3.695 5.739 8.755 1.00 0.00 H new ATOM 1150 N LEU A 438 -0.763 9.240 5.443 1.00 0.00 N ATOM 1151 CA LEU A 438 -1.995 9.552 4.730 1.00 0.00 C ATOM 1152 C LEU A 438 -2.038 11.047 4.451 1.00 0.00 C ATOM 1153 O LEU A 438 -2.008 11.493 3.304 1.00 0.00 O ATOM 1154 CB LEU A 438 -3.194 9.168 5.596 1.00 0.00 C ATOM 1155 CG LEU A 438 -4.184 8.199 4.962 1.00 0.00 C ATOM 1156 CD1 LEU A 438 -3.540 6.835 4.767 1.00 0.00 C ATOM 1157 CD2 LEU A 438 -5.427 8.090 5.831 1.00 0.00 C ATOM 0 H LEU A 438 -0.888 8.651 6.266 1.00 0.00 H new ATOM 0 HA LEU A 438 -2.030 8.997 3.793 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -2.824 8.727 6.521 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -3.728 10.078 5.868 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.476 8.578 3.982 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -4.260 6.154 4.313 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -2.672 6.932 4.115 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -3.226 6.440 5.733 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -6.132 7.396 5.373 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -5.149 7.725 6.820 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -5.893 9.071 5.924 1.00 0.00 H new ATOM 1169 N ASP A 439 -2.094 11.807 5.536 1.00 0.00 N ATOM 1170 CA ASP A 439 -2.129 13.262 5.483 1.00 0.00 C ATOM 1171 C ASP A 439 -0.903 13.810 4.769 1.00 0.00 C ATOM 1172 O ASP A 439 -0.895 14.947 4.315 1.00 0.00 O ATOM 1173 CB ASP A 439 -2.193 13.830 6.901 1.00 0.00 C ATOM 1174 CG ASP A 439 -3.273 14.884 7.051 1.00 0.00 C ATOM 1175 OD1 ASP A 439 -3.479 15.658 6.092 1.00 0.00 O ATOM 1176 OD2 ASP A 439 -3.910 14.935 8.124 1.00 0.00 O ATOM 0 H ASP A 439 -2.117 11.429 6.483 1.00 0.00 H new ATOM 0 HA ASP A 439 -3.017 13.563 4.926 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.379 13.020 7.606 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -1.227 14.263 7.160 1.00 0.00 H new ATOM 1181 N PHE A 440 0.128 12.989 4.663 1.00 0.00 N ATOM 1182 CA PHE A 440 1.348 13.399 3.990 1.00 0.00 C ATOM 1183 C PHE A 440 1.151 13.304 2.490 1.00 0.00 C ATOM 1184 O PHE A 440 1.340 14.278 1.763 1.00 0.00 O ATOM 1185 CB PHE A 440 2.526 12.531 4.427 1.00 0.00 C ATOM 1186 CG PHE A 440 3.836 12.947 3.822 1.00 0.00 C ATOM 1187 CD1 PHE A 440 4.220 12.477 2.575 1.00 0.00 C ATOM 1188 CD2 PHE A 440 4.683 13.807 4.499 1.00 0.00 C ATOM 1189 CE1 PHE A 440 5.424 12.858 2.017 1.00 0.00 C ATOM 1190 CE2 PHE A 440 5.890 14.193 3.946 1.00 0.00 C ATOM 1191 CZ PHE A 440 6.261 13.717 2.703 1.00 0.00 C ATOM 0 H PHE A 440 0.145 12.039 5.033 1.00 0.00 H new ATOM 0 HA PHE A 440 1.572 14.431 4.261 1.00 0.00 H new ATOM 0 HB2 PHE A 440 2.609 12.566 5.513 1.00 0.00 H new ATOM 0 HB3 PHE A 440 2.323 11.495 4.157 1.00 0.00 H new ATOM 0 HD1 PHE A 440 3.570 11.805 2.034 1.00 0.00 H new ATOM 0 HD2 PHE A 440 4.398 14.181 5.471 1.00 0.00 H new ATOM 0 HE1 PHE A 440 5.711 12.485 1.045 1.00 0.00 H new ATOM 0 HE2 PHE A 440 6.542 14.865 4.485 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.203 14.016 2.268 1.00 0.00 H new ATOM 1201 N TYR A 441 0.749 12.123 2.037 1.00 0.00 N ATOM 1202 CA TYR A 441 0.498 11.896 0.633 1.00 0.00 C ATOM 1203 C TYR A 441 -0.587 12.834 0.146 1.00 0.00 C ATOM 1204 O TYR A 441 -0.395 13.561 -0.829 1.00 0.00 O ATOM 1205 CB TYR A 441 0.113 10.442 0.400 1.00 0.00 C ATOM 1206 CG TYR A 441 1.294 9.504 0.475 1.00 0.00 C ATOM 1207 CD1 TYR A 441 2.542 9.883 -0.007 1.00 0.00 C ATOM 1208 CD2 TYR A 441 1.161 8.235 1.017 1.00 0.00 C ATOM 1209 CE1 TYR A 441 3.622 9.024 0.052 1.00 0.00 C ATOM 1210 CE2 TYR A 441 2.236 7.369 1.077 1.00 0.00 C ATOM 1211 CZ TYR A 441 3.463 7.768 0.595 1.00 0.00 C ATOM 1212 OH TYR A 441 4.536 6.909 0.655 1.00 0.00 O ATOM 0 H TYR A 441 0.591 11.309 2.631 1.00 0.00 H new ATOM 0 HA TYR A 441 1.406 12.100 0.065 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -0.629 10.144 1.141 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -0.358 10.348 -0.578 1.00 0.00 H new ATOM 0 HD1 TYR A 441 2.669 10.866 -0.435 1.00 0.00 H new ATOM 0 HD2 TYR A 441 0.202 7.918 1.399 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.585 9.335 -0.325 1.00 0.00 H new ATOM 0 HE2 TYR A 441 2.115 6.383 1.500 1.00 0.00 H new ATOM 0 HH TYR A 441 4.925 6.934 1.554 1.00 0.00 H new ATOM 1222 N ALA A 442 -1.714 12.849 0.846 1.00 0.00 N ATOM 1223 CA ALA A 442 -2.790 13.747 0.474 1.00 0.00 C ATOM 1224 C ALA A 442 -2.219 15.155 0.386 1.00 0.00 C ATOM 1225 O ALA A 442 -2.189 15.767 -0.683 1.00 0.00 O ATOM 1226 CB ALA A 442 -3.933 13.697 1.479 1.00 0.00 C ATOM 0 H ALA A 442 -1.902 12.261 1.658 1.00 0.00 H new ATOM 0 HA ALA A 442 -3.201 13.441 -0.488 1.00 0.00 H new ATOM 0 HB1 ALA A 442 -4.721 14.383 1.168 1.00 0.00 H new ATOM 0 HB2 ALA A 442 -4.331 12.684 1.527 1.00 0.00 H new ATOM 0 HB3 ALA A 442 -3.566 13.989 2.463 1.00 0.00 H new ATOM 1232 N LYS A 443 -1.757 15.657 1.529 1.00 0.00 N ATOM 1233 CA LYS A 443 -1.175 16.985 1.600 1.00 0.00 C ATOM 1234 C LYS A 443 -0.237 17.198 0.431 1.00 0.00 C ATOM 1235 O LYS A 443 -0.132 18.300 -0.098 1.00 0.00 O ATOM 1236 CB LYS A 443 -0.402 17.156 2.901 1.00 0.00 C ATOM 1237 CG LYS A 443 -1.280 17.427 4.105 1.00 0.00 C ATOM 1238 CD LYS A 443 -1.605 18.907 4.240 1.00 0.00 C ATOM 1239 CE LYS A 443 -2.633 19.353 3.208 1.00 0.00 C ATOM 1240 NZ LYS A 443 -3.686 20.216 3.811 1.00 0.00 N ATOM 0 H LYS A 443 -1.777 15.158 2.419 1.00 0.00 H new ATOM 0 HA LYS A 443 -1.980 17.719 1.563 1.00 0.00 H new ATOM 0 HB2 LYS A 443 0.183 16.255 3.086 1.00 0.00 H new ATOM 0 HB3 LYS A 443 0.305 17.978 2.787 1.00 0.00 H new ATOM 0 HG2 LYS A 443 -2.205 16.857 4.017 1.00 0.00 H new ATOM 0 HG3 LYS A 443 -0.777 17.081 5.008 1.00 0.00 H new ATOM 0 HD2 LYS A 443 -1.985 19.107 5.242 1.00 0.00 H new ATOM 0 HD3 LYS A 443 -0.693 19.492 4.122 1.00 0.00 H new ATOM 0 HE2 LYS A 443 -2.132 19.897 2.408 1.00 0.00 H new ATOM 0 HE3 LYS A 443 -3.097 18.477 2.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 -4.366 20.498 3.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 -4.182 19.688 4.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 -3.247 21.065 4.221 1.00 0.00 H new ATOM 1254 N GLN A 444 0.420 16.124 0.016 1.00 0.00 N ATOM 1255 CA GLN A 444 1.323 16.188 -1.118 1.00 0.00 C ATOM 1256 C GLN A 444 0.501 16.460 -2.371 1.00 0.00 C ATOM 1257 O GLN A 444 0.745 17.418 -3.102 1.00 0.00 O ATOM 1258 CB GLN A 444 2.095 14.876 -1.256 1.00 0.00 C ATOM 1259 CG GLN A 444 3.490 15.048 -1.828 1.00 0.00 C ATOM 1260 CD GLN A 444 4.159 13.725 -2.140 1.00 0.00 C ATOM 1261 OE1 GLN A 444 3.599 12.882 -2.843 1.00 0.00 O ATOM 1262 NE2 GLN A 444 5.364 13.533 -1.618 1.00 0.00 N ATOM 0 H GLN A 444 0.343 15.203 0.447 1.00 0.00 H new ATOM 0 HA GLN A 444 2.049 16.988 -0.973 1.00 0.00 H new ATOM 0 HB2 GLN A 444 2.169 14.403 -0.277 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.530 14.198 -1.896 1.00 0.00 H new ATOM 0 HG2 GLN A 444 3.435 15.646 -2.737 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.104 15.603 -1.118 1.00 0.00 H new ATOM 0 HE21 GLN A 444 5.791 14.258 -1.041 1.00 0.00 H new ATOM 0 HE22 GLN A 444 5.863 12.661 -1.794 1.00 0.00 H new ATOM 1271 N ARG A 445 -0.473 15.587 -2.602 1.00 0.00 N ATOM 1272 CA ARG A 445 -1.352 15.703 -3.760 1.00 0.00 C ATOM 1273 C ARG A 445 -1.698 17.172 -3.994 1.00 0.00 C ATOM 1274 O ARG A 445 -1.530 17.697 -5.095 1.00 0.00 O ATOM 1275 CB ARG A 445 -2.624 14.879 -3.538 1.00 0.00 C ATOM 1276 CG ARG A 445 -3.836 15.399 -4.292 1.00 0.00 C ATOM 1277 CD ARG A 445 -3.482 15.779 -5.719 1.00 0.00 C ATOM 1278 NE ARG A 445 -4.267 15.025 -6.691 1.00 0.00 N ATOM 1279 CZ ARG A 445 -5.594 15.061 -6.749 1.00 0.00 C ATOM 1280 NH1 ARG A 445 -6.276 15.817 -5.900 1.00 0.00 N ATOM 1281 NH2 ARG A 445 -6.241 14.341 -7.655 1.00 0.00 N ATOM 0 H ARG A 445 -0.674 14.788 -2.000 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.842 15.316 -4.642 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -2.435 13.849 -3.841 1.00 0.00 H new ATOM 0 HB3 ARG A 445 -2.852 14.861 -2.472 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -4.615 14.637 -4.300 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -4.244 16.267 -3.774 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -3.652 16.846 -5.864 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -2.421 15.599 -5.891 1.00 0.00 H new ATOM 0 HE ARG A 445 -3.770 14.439 -7.362 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -5.782 16.372 -5.201 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -7.295 15.844 -5.946 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -5.720 13.758 -8.310 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -7.260 14.370 -7.697 1.00 0.00 H new ATOM 1295 N ALA A 446 -2.152 17.829 -2.936 1.00 0.00 N ATOM 1296 CA ALA A 446 -2.495 19.243 -2.991 1.00 0.00 C ATOM 1297 C ALA A 446 -1.219 20.081 -3.049 1.00 0.00 C ATOM 1298 O ALA A 446 -1.185 21.172 -3.621 1.00 0.00 O ATOM 1299 CB ALA A 446 -3.326 19.626 -1.774 1.00 0.00 C ATOM 0 H ALA A 446 -2.292 17.400 -2.021 1.00 0.00 H new ATOM 0 HA ALA A 446 -3.084 19.435 -3.888 1.00 0.00 H new ATOM 0 HB1 ALA A 446 -3.578 20.685 -1.824 1.00 0.00 H new ATOM 0 HB2 ALA A 446 -4.242 19.036 -1.759 1.00 0.00 H new ATOM 0 HB3 ALA A 446 -2.754 19.431 -0.867 1.00 0.00 H new ATOM 1305 N ALA A 447 -0.178 19.535 -2.439 1.00 0.00 N ATOM 1306 CA ALA A 447 1.133 20.166 -2.376 1.00 0.00 C ATOM 1307 C ALA A 447 2.030 19.668 -3.503 1.00 0.00 C ATOM 1308 O ALA A 447 3.248 19.582 -3.344 1.00 0.00 O ATOM 1309 CB ALA A 447 1.793 19.911 -1.028 1.00 0.00 C ATOM 0 H ALA A 447 -0.219 18.631 -1.968 1.00 0.00 H new ATOM 0 HA ALA A 447 0.992 21.240 -2.495 1.00 0.00 H new ATOM 0 HB1 ALA A 447 2.771 20.392 -1.005 1.00 0.00 H new ATOM 0 HB2 ALA A 447 1.168 20.320 -0.234 1.00 0.00 H new ATOM 0 HB3 ALA A 447 1.913 18.838 -0.879 1.00 0.00 H new ATOM 1315 N ILE A 448 1.423 19.350 -4.642 1.00 0.00 N ATOM 1316 CA ILE A 448 2.174 18.870 -5.796 1.00 0.00 C ATOM 1317 C ILE A 448 2.814 20.034 -6.548 1.00 0.00 C ATOM 1318 O ILE A 448 2.126 20.818 -7.201 1.00 0.00 O ATOM 1319 CB ILE A 448 1.275 18.069 -6.762 1.00 0.00 C ATOM 1320 CG1 ILE A 448 0.933 16.706 -6.162 1.00 0.00 C ATOM 1321 CG2 ILE A 448 1.956 17.898 -8.114 1.00 0.00 C ATOM 1322 CD1 ILE A 448 0.083 15.843 -7.069 1.00 0.00 C ATOM 0 H ILE A 448 0.416 19.416 -4.790 1.00 0.00 H new ATOM 0 HA ILE A 448 2.955 18.210 -5.419 1.00 0.00 H new ATOM 0 HB ILE A 448 0.350 18.626 -6.912 1.00 0.00 H new ATOM 0 HG12 ILE A 448 1.858 16.177 -5.932 1.00 0.00 H new ATOM 0 HG13 ILE A 448 0.408 16.855 -5.218 1.00 0.00 H new ATOM 0 HG21 ILE A 448 1.306 17.331 -8.780 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.154 18.878 -8.548 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.896 17.363 -7.983 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -0.121 14.891 -6.579 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.858 16.352 -7.279 1.00 0.00 H new ATOM 0 HD13 ILE A 448 0.615 15.664 -8.003 1.00 0.00 H new ATOM 1334 N PRO A 449 4.148 20.155 -6.465 1.00 0.00 N ATOM 1335 CA PRO A 449 4.887 21.225 -7.141 1.00 0.00 C ATOM 1336 C PRO A 449 4.860 21.070 -8.657 1.00 0.00 C ATOM 1337 O PRO A 449 4.856 22.057 -9.393 1.00 0.00 O ATOM 1338 CB PRO A 449 6.314 21.065 -6.610 1.00 0.00 C ATOM 1339 CG PRO A 449 6.408 19.640 -6.187 1.00 0.00 C ATOM 1340 CD PRO A 449 5.036 19.255 -5.709 1.00 0.00 C ATOM 0 HA PRO A 449 4.457 22.207 -6.945 1.00 0.00 H new ATOM 0 HB2 PRO A 449 7.050 21.298 -7.379 1.00 0.00 H new ATOM 0 HB3 PRO A 449 6.502 21.739 -5.774 1.00 0.00 H new ATOM 0 HG2 PRO A 449 6.723 19.007 -7.017 1.00 0.00 H new ATOM 0 HG3 PRO A 449 7.146 19.517 -5.394 1.00 0.00 H new ATOM 0 HD2 PRO A 449 4.817 18.207 -5.916 1.00 0.00 H new ATOM 0 HD3 PRO A 449 4.931 19.396 -4.633 1.00 0.00 H new ATOM 1348 N ARG A 450 4.838 19.823 -9.117 1.00 0.00 N ATOM 1349 CA ARG A 450 4.806 19.537 -10.546 1.00 0.00 C ATOM 1350 C ARG A 450 3.884 20.508 -11.274 1.00 0.00 C ATOM 1351 O ARG A 450 4.251 21.079 -12.301 1.00 0.00 O ATOM 1352 CB ARG A 450 4.342 18.099 -10.785 1.00 0.00 C ATOM 1353 CG ARG A 450 5.243 17.054 -10.148 1.00 0.00 C ATOM 1354 CD ARG A 450 6.696 17.259 -10.544 1.00 0.00 C ATOM 1355 NE ARG A 450 7.337 16.011 -10.947 1.00 0.00 N ATOM 1356 CZ ARG A 450 8.647 15.883 -11.128 1.00 0.00 C ATOM 1357 NH1 ARG A 450 9.450 16.919 -10.933 1.00 0.00 N ATOM 1358 NH2 ARG A 450 9.156 14.717 -11.503 1.00 0.00 N ATOM 0 H ARG A 450 4.842 18.995 -8.521 1.00 0.00 H new ATOM 0 HA ARG A 450 5.815 19.658 -10.940 1.00 0.00 H new ATOM 0 HB2 ARG A 450 3.332 17.983 -10.393 1.00 0.00 H new ATOM 0 HB3 ARG A 450 4.291 17.916 -11.858 1.00 0.00 H new ATOM 0 HG2 ARG A 450 5.150 17.103 -9.063 1.00 0.00 H new ATOM 0 HG3 ARG A 450 4.919 16.058 -10.451 1.00 0.00 H new ATOM 0 HD2 ARG A 450 6.750 17.975 -11.364 1.00 0.00 H new ATOM 0 HD3 ARG A 450 7.242 17.692 -9.706 1.00 0.00 H new ATOM 0 HE ARG A 450 6.747 15.193 -11.098 1.00 0.00 H new ATOM 0 HH11 ARG A 450 9.063 17.817 -10.643 1.00 0.00 H new ATOM 0 HH12 ARG A 450 10.455 16.818 -11.073 1.00 0.00 H new ATOM 0 HH21 ARG A 450 8.541 13.917 -11.653 1.00 0.00 H new ATOM 0 HH22 ARG A 450 10.162 14.621 -11.642 1.00 0.00 H new ATOM 1372 N SER A 451 2.684 20.691 -10.733 1.00 0.00 N ATOM 1373 CA SER A 451 1.705 21.592 -11.326 1.00 0.00 C ATOM 1374 C SER A 451 2.227 23.025 -11.350 1.00 0.00 C ATOM 1375 O SER A 451 2.208 23.720 -10.335 1.00 0.00 O ATOM 1376 CB SER A 451 0.389 21.531 -10.550 1.00 0.00 C ATOM 1377 OG SER A 451 -0.408 22.675 -10.803 1.00 0.00 O ATOM 0 H SER A 451 2.366 20.226 -9.883 1.00 0.00 H new ATOM 0 HA SER A 451 1.530 21.271 -12.353 1.00 0.00 H new ATOM 0 HB2 SER A 451 -0.160 20.632 -10.831 1.00 0.00 H new ATOM 0 HB3 SER A 451 0.596 21.458 -9.482 1.00 0.00 H new ATOM 0 HG SER A 451 -1.244 22.610 -10.296 1.00 0.00 H new ATOM 1383 N GLU A 452 2.694 23.461 -12.516 1.00 0.00 N ATOM 1384 CA GLU A 452 3.220 24.811 -12.673 1.00 0.00 C ATOM 1385 C GLU A 452 2.091 25.810 -12.911 1.00 0.00 C ATOM 1386 O GLU A 452 2.248 27.008 -12.675 1.00 0.00 O ATOM 1387 CB GLU A 452 4.215 24.863 -13.833 1.00 0.00 C ATOM 1388 CG GLU A 452 5.547 24.201 -13.524 1.00 0.00 C ATOM 1389 CD GLU A 452 6.726 24.978 -14.076 1.00 0.00 C ATOM 1390 OE1 GLU A 452 6.585 25.579 -15.162 1.00 0.00 O ATOM 1391 OE2 GLU A 452 7.792 24.983 -13.425 1.00 0.00 O ATOM 0 H GLU A 452 2.718 22.898 -13.366 1.00 0.00 H new ATOM 0 HA GLU A 452 3.734 25.083 -11.751 1.00 0.00 H new ATOM 0 HB2 GLU A 452 3.771 24.378 -14.703 1.00 0.00 H new ATOM 0 HB3 GLU A 452 4.391 25.904 -14.103 1.00 0.00 H new ATOM 0 HG2 GLU A 452 5.657 24.100 -12.444 1.00 0.00 H new ATOM 0 HG3 GLU A 452 5.553 23.194 -13.941 1.00 0.00 H new ATOM 1398 N SER A 453 0.954 25.306 -13.379 1.00 0.00 N ATOM 1399 CA SER A 453 -0.203 26.153 -13.650 1.00 0.00 C ATOM 1400 C SER A 453 0.109 27.167 -14.746 1.00 0.00 C ATOM 1401 O SER A 453 1.274 27.211 -15.196 1.00 0.00 O ATOM 1402 CB SER A 453 -0.641 26.878 -12.377 1.00 0.00 C ATOM 1403 OG SER A 453 -2.050 26.845 -12.230 1.00 0.00 O ATOM 1404 OXT SER A 453 -0.813 27.907 -15.146 1.00 0.00 O ATOM 0 H SER A 453 0.809 24.316 -13.579 1.00 0.00 H new ATOM 0 HA SER A 453 -1.017 25.514 -13.993 1.00 0.00 H new ATOM 0 HB2 SER A 453 -0.171 26.413 -11.510 1.00 0.00 H new ATOM 0 HB3 SER A 453 -0.300 27.913 -12.408 1.00 0.00 H new ATOM 0 HG SER A 453 -2.304 27.314 -11.408 1.00 0.00 H new TER 1410 SER A 453