USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=20 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 Set 1.1: A 369 ASN : amide:sc= -0.129 K(o=-0.13,f=-1.1) USER MOD Set 1.2: A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 365 SER OG : rot 180:sc= 0 USER MOD Single : A 368 MET CE :methyl 146:sc= -0.605 (180deg=-2.2!) USER MOD Single : A 373 GLN : amide:sc= -0.147 K(o=-0.15,f=-1.7!) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 380 TYR OH : rot 88:sc= 0.0699 USER MOD Single : A 382 SER OG : rot 180:sc= -0.0364 USER MOD Single : A 386 HIS : no HD1:sc= -5.78! C(o=-5.8!,f=-5.3!) USER MOD Single : A 387 TYR OH : rot 154:sc= -5.02! USER MOD Single : A 389 THR OG1 : rot 148:sc= -2.1 USER MOD Single : A 391 LYS NZ :NH3+ -168:sc= -1.24 (180deg=-1.52) USER MOD Single : A 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 394 THR OG1 : rot -154:sc= -2.01! USER MOD Single : A 399 ASN : amide:sc= -1.49! K(o=-1.5!,f=-0.76) USER MOD Single : A 400 SER OG : rot 4:sc= 0.231 USER MOD Single : A 404 CYS SG : rot -61:sc= -10! USER MOD Single : A 410 THR OG1 : rot 180:sc= 0 USER MOD Single : A 414 THR OG1 : rot -13:sc= 0.933 USER MOD Single : A 419 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -0.142 K(o=-0.14,f=-0.89) USER MOD Single : A 435 LYS NZ :NH3+ -144:sc= 0.139 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 139:sc= -2.35! (180deg=-4.59!) USER MOD Single : A 437 MET CE :methyl 151:sc= -0.417 (180deg=-1.45!) USER MOD Single : A 441 TYR OH : rot 180:sc= 0 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.14 K(o=-0.14,f=-0.85) 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 -10.084 -12.423 7.806 1.00 0.00 N ATOM 2 CA GLY A 364 -8.718 -13.008 7.901 1.00 0.00 C ATOM 3 C GLY A 364 -7.884 -12.362 8.989 1.00 0.00 C ATOM 4 O GLY A 364 -8.372 -12.115 10.092 1.00 0.00 O ATOM 0 HA2 GLY A 364 -8.797 -14.078 8.095 1.00 0.00 H new ATOM 0 HA3 GLY A 364 -8.210 -12.895 6.943 1.00 0.00 H new ATOM 10 N SER A 365 -6.620 -12.089 8.679 1.00 0.00 N ATOM 11 CA SER A 365 -5.715 -11.469 9.639 1.00 0.00 C ATOM 12 C SER A 365 -5.543 -9.983 9.347 1.00 0.00 C ATOM 13 O SER A 365 -5.062 -9.225 10.189 1.00 0.00 O ATOM 14 CB SER A 365 -4.354 -12.166 9.611 1.00 0.00 C ATOM 15 OG SER A 365 -4.472 -13.499 9.143 1.00 0.00 O ATOM 0 H SER A 365 -6.200 -12.288 7.771 1.00 0.00 H new ATOM 0 HA SER A 365 -6.152 -11.576 10.632 1.00 0.00 H new ATOM 0 HB2 SER A 365 -3.671 -11.611 8.968 1.00 0.00 H new ATOM 0 HB3 SER A 365 -3.921 -12.166 10.611 1.00 0.00 H new ATOM 0 HG SER A 365 -3.588 -13.922 9.133 1.00 0.00 H new ATOM 21 N LEU A 366 -5.940 -9.570 8.146 1.00 0.00 N ATOM 22 CA LEU A 366 -5.830 -8.173 7.743 1.00 0.00 C ATOM 23 C LEU A 366 -7.203 -7.519 7.660 1.00 0.00 C ATOM 24 O LEU A 366 -8.194 -8.064 8.145 1.00 0.00 O ATOM 25 CB LEU A 366 -5.118 -8.061 6.392 1.00 0.00 C ATOM 26 CG LEU A 366 -4.882 -9.386 5.669 1.00 0.00 C ATOM 27 CD1 LEU A 366 -6.074 -9.738 4.794 1.00 0.00 C ATOM 28 CD2 LEU A 366 -3.611 -9.318 4.838 1.00 0.00 C ATOM 0 H LEU A 366 -6.340 -10.183 7.436 1.00 0.00 H new ATOM 0 HA LEU A 366 -5.244 -7.651 8.499 1.00 0.00 H new ATOM 0 HB2 LEU A 366 -5.705 -7.411 5.743 1.00 0.00 H new ATOM 0 HB3 LEU A 366 -4.156 -7.573 6.546 1.00 0.00 H new ATOM 0 HG LEU A 366 -4.764 -10.170 6.417 1.00 0.00 H new ATOM 0 HD11 LEU A 366 -5.887 -10.685 4.288 1.00 0.00 H new ATOM 0 HD12 LEU A 366 -6.966 -9.828 5.414 1.00 0.00 H new ATOM 0 HD13 LEU A 366 -6.225 -8.954 4.052 1.00 0.00 H new ATOM 0 HD21 LEU A 366 -3.457 -10.270 4.329 1.00 0.00 H new ATOM 0 HD22 LEU A 366 -3.702 -8.522 4.099 1.00 0.00 H new ATOM 0 HD23 LEU A 366 -2.761 -9.113 5.489 1.00 0.00 H new ATOM 40 N ASP A 367 -7.251 -6.347 7.039 1.00 0.00 N ATOM 41 CA ASP A 367 -8.499 -5.610 6.884 1.00 0.00 C ATOM 42 C ASP A 367 -9.313 -6.165 5.723 1.00 0.00 C ATOM 43 O ASP A 367 -8.997 -7.224 5.182 1.00 0.00 O ATOM 44 CB ASP A 367 -8.213 -4.126 6.654 1.00 0.00 C ATOM 45 CG ASP A 367 -8.154 -3.339 7.949 1.00 0.00 C ATOM 46 OD1 ASP A 367 -8.044 -3.970 9.021 1.00 0.00 O ATOM 47 OD2 ASP A 367 -8.219 -2.093 7.890 1.00 0.00 O ATOM 0 H ASP A 367 -6.437 -5.885 6.633 1.00 0.00 H new ATOM 0 HA ASP A 367 -9.077 -5.724 7.801 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -7.266 -4.019 6.124 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -8.987 -3.705 6.012 1.00 0.00 H new ATOM 52 N MET A 368 -10.363 -5.445 5.344 1.00 0.00 N ATOM 53 CA MET A 368 -11.219 -5.870 4.248 1.00 0.00 C ATOM 54 C MET A 368 -10.934 -5.072 2.980 1.00 0.00 C ATOM 55 O MET A 368 -10.959 -5.618 1.877 1.00 0.00 O ATOM 56 CB MET A 368 -12.691 -5.720 4.638 1.00 0.00 C ATOM 57 CG MET A 368 -12.914 -5.597 6.137 1.00 0.00 C ATOM 58 SD MET A 368 -14.436 -6.395 6.681 1.00 0.00 S ATOM 59 CE MET A 368 -14.241 -8.023 5.959 1.00 0.00 C ATOM 0 H MET A 368 -10.640 -4.566 5.780 1.00 0.00 H new ATOM 0 HA MET A 368 -11.005 -6.919 4.045 1.00 0.00 H new ATOM 0 HB2 MET A 368 -13.101 -4.839 4.145 1.00 0.00 H new ATOM 0 HB3 MET A 368 -13.246 -6.581 4.266 1.00 0.00 H new ATOM 0 HG2 MET A 368 -12.068 -6.039 6.664 1.00 0.00 H new ATOM 0 HG3 MET A 368 -12.944 -4.542 6.411 1.00 0.00 H new ATOM 0 HE1 MET A 368 -14.687 -8.769 6.617 1.00 0.00 H new ATOM 0 HE2 MET A 368 -14.737 -8.053 4.989 1.00 0.00 H new ATOM 0 HE3 MET A 368 -13.180 -8.240 5.831 1.00 0.00 H new ATOM 69 N ASN A 369 -10.669 -3.779 3.137 1.00 0.00 N ATOM 70 CA ASN A 369 -10.388 -2.924 1.994 1.00 0.00 C ATOM 71 C ASN A 369 -9.083 -2.157 2.167 1.00 0.00 C ATOM 72 O ASN A 369 -9.087 -0.970 2.476 1.00 0.00 O ATOM 73 CB ASN A 369 -11.535 -1.937 1.795 1.00 0.00 C ATOM 74 CG ASN A 369 -12.643 -2.501 0.927 1.00 0.00 C ATOM 75 OD1 ASN A 369 -12.399 -2.968 -0.186 1.00 0.00 O ATOM 76 ND2 ASN A 369 -13.871 -2.459 1.432 1.00 0.00 N ATOM 0 H ASN A 369 -10.643 -3.304 4.040 1.00 0.00 H new ATOM 0 HA ASN A 369 -10.288 -3.565 1.118 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -11.944 -1.660 2.767 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -11.150 -1.025 1.340 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -14.657 -2.823 0.893 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -14.028 -2.063 2.359 1.00 0.00 H new ATOM 83 N ALA A 370 -7.977 -2.840 1.948 1.00 0.00 N ATOM 84 CA ALA A 370 -6.685 -2.175 2.066 1.00 0.00 C ATOM 85 C ALA A 370 -6.425 -1.378 0.804 1.00 0.00 C ATOM 86 O ALA A 370 -6.382 -0.157 0.830 1.00 0.00 O ATOM 87 CB ALA A 370 -5.556 -3.157 2.306 1.00 0.00 C ATOM 0 H ALA A 370 -7.939 -3.827 1.694 1.00 0.00 H new ATOM 0 HA ALA A 370 -6.720 -1.513 2.931 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -4.614 -2.615 2.387 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -5.740 -3.705 3.230 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -5.501 -3.858 1.474 1.00 0.00 H new ATOM 93 N LYS A 371 -6.241 -2.080 -0.295 1.00 0.00 N ATOM 94 CA LYS A 371 -5.970 -1.433 -1.579 1.00 0.00 C ATOM 95 C LYS A 371 -7.062 -0.427 -1.901 1.00 0.00 C ATOM 96 O LYS A 371 -6.857 0.521 -2.655 1.00 0.00 O ATOM 97 CB LYS A 371 -5.883 -2.480 -2.690 1.00 0.00 C ATOM 98 CG LYS A 371 -7.218 -3.129 -3.012 1.00 0.00 C ATOM 99 CD LYS A 371 -7.703 -3.999 -1.864 1.00 0.00 C ATOM 100 CE LYS A 371 -8.898 -4.846 -2.274 1.00 0.00 C ATOM 101 NZ LYS A 371 -10.172 -4.079 -2.204 1.00 0.00 N ATOM 0 H LYS A 371 -6.273 -3.099 -0.333 1.00 0.00 H new ATOM 0 HA LYS A 371 -5.016 -0.910 -1.510 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.489 -2.011 -3.591 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -5.173 -3.253 -2.396 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -7.958 -2.357 -3.223 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -7.122 -3.734 -3.914 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.893 -4.648 -1.530 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -7.976 -3.368 -1.018 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -8.751 -5.214 -3.289 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -8.964 -5.719 -1.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -10.962 -4.691 -2.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -10.326 -3.749 -1.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -10.119 -3.260 -2.842 1.00 0.00 H new ATOM 115 N ARG A 372 -8.206 -0.632 -1.276 1.00 0.00 N ATOM 116 CA ARG A 372 -9.336 0.257 -1.449 1.00 0.00 C ATOM 117 C ARG A 372 -9.227 1.417 -0.475 1.00 0.00 C ATOM 118 O ARG A 372 -9.189 2.580 -0.878 1.00 0.00 O ATOM 119 CB ARG A 372 -10.655 -0.496 -1.253 1.00 0.00 C ATOM 120 CG ARG A 372 -11.857 0.410 -1.035 1.00 0.00 C ATOM 121 CD ARG A 372 -12.674 0.557 -2.308 1.00 0.00 C ATOM 122 NE ARG A 372 -13.497 1.763 -2.295 1.00 0.00 N ATOM 123 CZ ARG A 372 -14.699 1.829 -1.730 1.00 0.00 C ATOM 124 NH1 ARG A 372 -15.215 0.763 -1.134 1.00 0.00 N ATOM 125 NH2 ARG A 372 -15.387 2.963 -1.761 1.00 0.00 N ATOM 0 H ARG A 372 -8.376 -1.412 -0.641 1.00 0.00 H new ATOM 0 HA ARG A 372 -9.325 0.648 -2.466 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -10.838 -1.121 -2.127 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -10.557 -1.164 -0.398 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -12.484 0.002 -0.243 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -11.520 1.391 -0.701 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -12.004 0.585 -3.167 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -13.314 -0.317 -2.431 1.00 0.00 H new ATOM 0 HE ARG A 372 -13.129 2.602 -2.744 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -14.690 -0.111 -1.108 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -16.137 0.817 -0.702 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -14.994 3.786 -2.219 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -16.309 3.012 -1.327 1.00 0.00 H new ATOM 139 N GLN A 373 -9.184 1.093 0.808 1.00 0.00 N ATOM 140 CA GLN A 373 -9.086 2.113 1.844 1.00 0.00 C ATOM 141 C GLN A 373 -7.850 2.983 1.637 1.00 0.00 C ATOM 142 O GLN A 373 -7.865 4.176 1.928 1.00 0.00 O ATOM 143 CB GLN A 373 -9.052 1.462 3.223 1.00 0.00 C ATOM 144 CG GLN A 373 -8.918 2.461 4.358 1.00 0.00 C ATOM 145 CD GLN A 373 -9.798 2.124 5.544 1.00 0.00 C ATOM 146 OE1 GLN A 373 -10.306 1.009 5.659 1.00 0.00 O ATOM 147 NE2 GLN A 373 -9.982 3.091 6.435 1.00 0.00 N ATOM 0 H GLN A 373 -9.215 0.135 1.158 1.00 0.00 H new ATOM 0 HA GLN A 373 -9.966 2.753 1.778 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -9.964 0.882 3.365 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -8.218 0.761 3.265 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -7.878 2.498 4.682 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -9.174 3.456 3.993 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -9.541 4.001 6.299 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -10.564 2.924 7.256 1.00 0.00 H new ATOM 156 N LEU A 374 -6.790 2.373 1.122 1.00 0.00 N ATOM 157 CA LEU A 374 -5.547 3.085 0.860 1.00 0.00 C ATOM 158 C LEU A 374 -5.703 3.943 -0.396 1.00 0.00 C ATOM 159 O LEU A 374 -5.648 5.171 -0.324 1.00 0.00 O ATOM 160 CB LEU A 374 -4.392 2.082 0.702 1.00 0.00 C ATOM 161 CG LEU A 374 -2.981 2.641 0.939 1.00 0.00 C ATOM 162 CD1 LEU A 374 -2.315 3.019 -0.370 1.00 0.00 C ATOM 163 CD2 LEU A 374 -3.020 3.836 1.878 1.00 0.00 C ATOM 0 H LEU A 374 -6.767 1.383 0.877 1.00 0.00 H new ATOM 0 HA LEU A 374 -5.316 3.740 1.700 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -4.556 1.257 1.395 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -4.433 1.666 -0.305 1.00 0.00 H new ATOM 0 HG LEU A 374 -2.389 1.854 1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -1.318 3.412 -0.171 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -2.238 2.138 -1.007 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -2.910 3.780 -0.875 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -2.009 4.213 2.029 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -3.638 4.621 1.443 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -3.441 3.532 2.836 1.00 0.00 H new ATOM 175 N TYR A 375 -5.907 3.294 -1.544 1.00 0.00 N ATOM 176 CA TYR A 375 -6.079 4.024 -2.801 1.00 0.00 C ATOM 177 C TYR A 375 -6.994 5.213 -2.582 1.00 0.00 C ATOM 178 O TYR A 375 -6.840 6.270 -3.192 1.00 0.00 O ATOM 179 CB TYR A 375 -6.663 3.118 -3.879 1.00 0.00 C ATOM 180 CG TYR A 375 -6.360 3.560 -5.298 1.00 0.00 C ATOM 181 CD1 TYR A 375 -5.221 4.304 -5.605 1.00 0.00 C ATOM 182 CD2 TYR A 375 -7.221 3.229 -6.337 1.00 0.00 C ATOM 183 CE1 TYR A 375 -4.957 4.701 -6.903 1.00 0.00 C ATOM 184 CE2 TYR A 375 -6.962 3.623 -7.636 1.00 0.00 C ATOM 185 CZ TYR A 375 -5.830 4.357 -7.913 1.00 0.00 C ATOM 186 OH TYR A 375 -5.568 4.751 -9.207 1.00 0.00 O ATOM 0 H TYR A 375 -5.957 2.279 -1.630 1.00 0.00 H new ATOM 0 HA TYR A 375 -5.101 4.372 -3.134 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -6.279 2.108 -3.736 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -7.744 3.069 -3.749 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.534 4.574 -4.816 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -8.110 2.653 -6.125 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -4.071 5.278 -7.124 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.644 3.357 -8.430 1.00 0.00 H new ATOM 0 HH TYR A 375 -6.279 4.427 -9.798 1.00 0.00 H new ATOM 196 N SER A 376 -7.936 5.026 -1.677 1.00 0.00 N ATOM 197 CA SER A 376 -8.880 6.076 -1.327 1.00 0.00 C ATOM 198 C SER A 376 -8.213 7.054 -0.371 1.00 0.00 C ATOM 199 O SER A 376 -8.231 8.268 -0.577 1.00 0.00 O ATOM 200 CB SER A 376 -10.129 5.477 -0.681 1.00 0.00 C ATOM 201 OG SER A 376 -10.930 6.486 -0.089 1.00 0.00 O ATOM 0 H SER A 376 -8.070 4.153 -1.167 1.00 0.00 H new ATOM 0 HA SER A 376 -9.182 6.602 -2.233 1.00 0.00 H new ATOM 0 HB2 SER A 376 -10.710 4.941 -1.432 1.00 0.00 H new ATOM 0 HB3 SER A 376 -9.837 4.749 0.076 1.00 0.00 H new ATOM 0 HG SER A 376 -11.724 6.078 0.316 1.00 0.00 H new ATOM 207 N LEU A 377 -7.624 6.499 0.682 1.00 0.00 N ATOM 208 CA LEU A 377 -6.941 7.282 1.695 1.00 0.00 C ATOM 209 C LEU A 377 -5.875 8.169 1.070 1.00 0.00 C ATOM 210 O LEU A 377 -5.895 9.387 1.242 1.00 0.00 O ATOM 211 CB LEU A 377 -6.307 6.350 2.724 1.00 0.00 C ATOM 212 CG LEU A 377 -7.184 6.032 3.935 1.00 0.00 C ATOM 213 CD1 LEU A 377 -6.801 4.685 4.523 1.00 0.00 C ATOM 214 CD2 LEU A 377 -7.066 7.128 4.982 1.00 0.00 C ATOM 0 H LEU A 377 -7.609 5.494 0.854 1.00 0.00 H new ATOM 0 HA LEU A 377 -7.672 7.924 2.187 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -6.042 5.415 2.230 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -5.378 6.799 3.075 1.00 0.00 H new ATOM 0 HG LEU A 377 -8.223 5.984 3.609 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -7.433 4.471 5.385 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -6.937 3.908 3.771 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -5.757 4.708 4.836 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -7.697 6.884 5.837 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -6.029 7.209 5.308 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -7.387 8.077 4.553 1.00 0.00 H new ATOM 226 N ILE A 378 -4.939 7.557 0.347 1.00 0.00 N ATOM 227 CA ILE A 378 -3.871 8.318 -0.286 1.00 0.00 C ATOM 228 C ILE A 378 -3.993 8.292 -1.806 1.00 0.00 C ATOM 229 O ILE A 378 -3.926 9.334 -2.458 1.00 0.00 O ATOM 230 CB ILE A 378 -2.523 7.688 0.101 1.00 0.00 C ATOM 231 CG1 ILE A 378 -2.290 7.802 1.603 1.00 0.00 C ATOM 232 CG2 ILE A 378 -1.384 8.308 -0.674 1.00 0.00 C ATOM 233 CD1 ILE A 378 -1.225 6.855 2.113 1.00 0.00 C ATOM 0 H ILE A 378 -4.900 6.550 0.188 1.00 0.00 H new ATOM 0 HA ILE A 378 -3.940 9.352 0.052 1.00 0.00 H new ATOM 0 HB ILE A 378 -2.558 6.630 -0.160 1.00 0.00 H new ATOM 0 HG12 ILE A 378 -2.003 8.826 1.843 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -3.225 7.603 2.126 1.00 0.00 H new ATOM 0 HG21 ILE A 378 -0.445 7.841 -0.377 1.00 0.00 H new ATOM 0 HG22 ILE A 378 -1.544 8.155 -1.741 1.00 0.00 H new ATOM 0 HG23 ILE A 378 -1.340 9.377 -0.464 1.00 0.00 H new ATOM 0 HD11 ILE A 378 -1.107 6.986 3.189 1.00 0.00 H new ATOM 0 HD12 ILE A 378 -1.521 5.827 1.902 1.00 0.00 H new ATOM 0 HD13 ILE A 378 -0.279 7.069 1.616 1.00 0.00 H new ATOM 245 N GLY A 379 -4.136 7.087 -2.352 1.00 0.00 N ATOM 246 CA GLY A 379 -4.230 6.902 -3.796 1.00 0.00 C ATOM 247 C GLY A 379 -4.623 8.154 -4.556 1.00 0.00 C ATOM 248 O GLY A 379 -5.718 8.687 -4.373 1.00 0.00 O ATOM 0 H GLY A 379 -4.189 6.222 -1.814 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -3.269 6.550 -4.170 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -4.959 6.119 -4.005 1.00 0.00 H new ATOM 252 N TYR A 380 -3.723 8.615 -5.420 1.00 0.00 N ATOM 253 CA TYR A 380 -3.962 9.803 -6.233 1.00 0.00 C ATOM 254 C TYR A 380 -3.357 9.621 -7.626 1.00 0.00 C ATOM 255 O TYR A 380 -3.098 8.495 -8.053 1.00 0.00 O ATOM 256 CB TYR A 380 -3.377 11.045 -5.551 1.00 0.00 C ATOM 257 CG TYR A 380 -3.978 11.330 -4.194 1.00 0.00 C ATOM 258 CD1 TYR A 380 -5.345 11.220 -3.981 1.00 0.00 C ATOM 259 CD2 TYR A 380 -3.177 11.714 -3.126 1.00 0.00 C ATOM 260 CE1 TYR A 380 -5.899 11.483 -2.742 1.00 0.00 C ATOM 261 CE2 TYR A 380 -3.721 11.978 -1.885 1.00 0.00 C ATOM 262 CZ TYR A 380 -5.082 11.861 -1.698 1.00 0.00 C ATOM 263 OH TYR A 380 -5.629 12.123 -0.462 1.00 0.00 O ATOM 0 H TYR A 380 -2.814 8.179 -5.576 1.00 0.00 H new ATOM 0 HA TYR A 380 -5.038 9.944 -6.337 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -2.300 10.916 -5.442 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -3.531 11.910 -6.196 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -5.987 10.924 -4.797 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -2.111 11.808 -3.269 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -6.965 11.393 -2.593 1.00 0.00 H new ATOM 0 HE2 TYR A 380 -3.084 12.275 -1.065 1.00 0.00 H new ATOM 0 HH TYR A 380 -5.677 11.293 0.057 1.00 0.00 H new ATOM 273 N ALA A 381 -3.137 10.725 -8.335 1.00 0.00 N ATOM 274 CA ALA A 381 -2.569 10.668 -9.677 1.00 0.00 C ATOM 275 C ALA A 381 -1.062 10.430 -9.635 1.00 0.00 C ATOM 276 O ALA A 381 -0.572 9.417 -10.135 1.00 0.00 O ATOM 277 CB ALA A 381 -2.877 11.942 -10.452 1.00 0.00 C ATOM 0 H ALA A 381 -3.343 11.667 -8.003 1.00 0.00 H new ATOM 0 HA ALA A 381 -3.032 9.825 -10.191 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -2.443 11.875 -11.450 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -3.957 12.066 -10.534 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -2.452 12.798 -9.928 1.00 0.00 H new ATOM 283 N SER A 382 -0.330 11.369 -9.042 1.00 0.00 N ATOM 284 CA SER A 382 1.123 11.260 -8.943 1.00 0.00 C ATOM 285 C SER A 382 1.530 10.314 -7.817 1.00 0.00 C ATOM 286 O SER A 382 2.704 9.973 -7.672 1.00 0.00 O ATOM 287 CB SER A 382 1.743 12.640 -8.713 1.00 0.00 C ATOM 288 OG SER A 382 2.741 12.590 -7.708 1.00 0.00 O ATOM 0 H SER A 382 -0.719 12.214 -8.623 1.00 0.00 H new ATOM 0 HA SER A 382 1.493 10.851 -9.883 1.00 0.00 H new ATOM 0 HB2 SER A 382 2.177 13.007 -9.643 1.00 0.00 H new ATOM 0 HB3 SER A 382 0.966 13.347 -8.423 1.00 0.00 H new ATOM 0 HG SER A 382 3.123 13.484 -7.581 1.00 0.00 H new ATOM 294 N LEU A 383 0.554 9.896 -7.021 1.00 0.00 N ATOM 295 CA LEU A 383 0.803 8.992 -5.907 1.00 0.00 C ATOM 296 C LEU A 383 0.690 7.541 -6.349 1.00 0.00 C ATOM 297 O LEU A 383 0.117 6.714 -5.643 1.00 0.00 O ATOM 298 CB LEU A 383 -0.184 9.268 -4.775 1.00 0.00 C ATOM 299 CG LEU A 383 0.170 10.437 -3.849 1.00 0.00 C ATOM 300 CD1 LEU A 383 -0.018 10.025 -2.403 1.00 0.00 C ATOM 301 CD2 LEU A 383 1.598 10.916 -4.075 1.00 0.00 C ATOM 0 H LEU A 383 -0.422 10.171 -7.128 1.00 0.00 H new ATOM 0 HA LEU A 383 1.818 9.165 -5.549 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.164 9.460 -5.212 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -0.276 8.366 -4.171 1.00 0.00 H new ATOM 0 HG LEU A 383 -0.500 11.265 -4.081 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.235 10.861 -1.751 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -1.057 9.738 -2.238 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.632 9.179 -2.178 1.00 0.00 H new ATOM 0 HD21 LEU A 383 1.814 11.745 -3.402 1.00 0.00 H new ATOM 0 HD22 LEU A 383 2.291 10.098 -3.878 1.00 0.00 H new ATOM 0 HD23 LEU A 383 1.712 11.248 -5.107 1.00 0.00 H new ATOM 313 N ARG A 384 1.227 7.253 -7.526 1.00 0.00 N ATOM 314 CA ARG A 384 1.188 5.909 -8.091 1.00 0.00 C ATOM 315 C ARG A 384 1.570 4.839 -7.071 1.00 0.00 C ATOM 316 O ARG A 384 2.697 4.344 -7.079 1.00 0.00 O ATOM 317 CB ARG A 384 2.134 5.819 -9.287 1.00 0.00 C ATOM 318 CG ARG A 384 1.626 4.915 -10.398 1.00 0.00 C ATOM 319 CD ARG A 384 2.099 3.482 -10.207 1.00 0.00 C ATOM 320 NE ARG A 384 2.056 2.721 -11.451 1.00 0.00 N ATOM 321 CZ ARG A 384 2.979 2.811 -12.403 1.00 0.00 C ATOM 322 NH1 ARG A 384 4.016 3.622 -12.246 1.00 0.00 N ATOM 323 NH2 ARG A 384 2.867 2.091 -13.509 1.00 0.00 N ATOM 0 H ARG A 384 1.700 7.939 -8.114 1.00 0.00 H new ATOM 0 HA ARG A 384 0.160 5.723 -8.403 1.00 0.00 H new ATOM 0 HB2 ARG A 384 2.294 6.819 -9.689 1.00 0.00 H new ATOM 0 HB3 ARG A 384 3.103 5.453 -8.947 1.00 0.00 H new ATOM 0 HG2 ARG A 384 0.537 4.940 -10.420 1.00 0.00 H new ATOM 0 HG3 ARG A 384 1.973 5.289 -11.361 1.00 0.00 H new ATOM 0 HD2 ARG A 384 3.118 3.485 -9.819 1.00 0.00 H new ATOM 0 HD3 ARG A 384 1.475 2.991 -9.460 1.00 0.00 H new ATOM 0 HE ARG A 384 1.273 2.084 -11.598 1.00 0.00 H new ATOM 0 HH11 ARG A 384 4.105 4.177 -11.395 1.00 0.00 H new ATOM 0 HH12 ARG A 384 4.724 3.691 -12.977 1.00 0.00 H new ATOM 0 HH21 ARG A 384 2.071 1.465 -13.632 1.00 0.00 H new ATOM 0 HH22 ARG A 384 3.577 2.162 -14.238 1.00 0.00 H new ATOM 337 N LEU A 385 0.624 4.456 -6.219 1.00 0.00 N ATOM 338 CA LEU A 385 0.882 3.414 -5.237 1.00 0.00 C ATOM 339 C LEU A 385 1.000 2.081 -5.965 1.00 0.00 C ATOM 340 O LEU A 385 0.426 1.912 -7.040 1.00 0.00 O ATOM 341 CB LEU A 385 -0.225 3.365 -4.178 1.00 0.00 C ATOM 342 CG LEU A 385 -1.618 3.762 -4.661 1.00 0.00 C ATOM 343 CD1 LEU A 385 -2.056 2.894 -5.829 1.00 0.00 C ATOM 344 CD2 LEU A 385 -2.607 3.654 -3.516 1.00 0.00 C ATOM 0 H LEU A 385 -0.317 4.848 -6.190 1.00 0.00 H new ATOM 0 HA LEU A 385 1.813 3.630 -4.714 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -0.274 2.353 -3.776 1.00 0.00 H new ATOM 0 HB3 LEU A 385 0.055 4.022 -3.354 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.586 4.795 -5.007 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -3.051 3.197 -6.154 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.353 3.012 -6.654 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -2.078 1.850 -5.518 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.600 3.938 -3.865 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.631 2.627 -3.151 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -2.302 4.319 -2.708 1.00 0.00 H new ATOM 356 N HIS A 386 1.747 1.140 -5.404 1.00 0.00 N ATOM 357 CA HIS A 386 1.919 -0.157 -6.053 1.00 0.00 C ATOM 358 C HIS A 386 2.189 -1.262 -5.038 1.00 0.00 C ATOM 359 O HIS A 386 2.524 -0.993 -3.885 1.00 0.00 O ATOM 360 CB HIS A 386 3.064 -0.091 -7.068 1.00 0.00 C ATOM 361 CG HIS A 386 3.584 -1.434 -7.480 1.00 0.00 C ATOM 362 ND1 HIS A 386 4.609 -2.084 -6.822 1.00 0.00 N ATOM 363 CD2 HIS A 386 3.217 -2.252 -8.496 1.00 0.00 C ATOM 364 CE1 HIS A 386 4.850 -3.239 -7.417 1.00 0.00 C ATOM 365 NE2 HIS A 386 4.019 -3.364 -8.434 1.00 0.00 N ATOM 0 H HIS A 386 2.237 1.245 -4.516 1.00 0.00 H new ATOM 0 HA HIS A 386 0.989 -0.395 -6.569 1.00 0.00 H new ATOM 0 HB2 HIS A 386 2.721 0.443 -7.954 1.00 0.00 H new ATOM 0 HB3 HIS A 386 3.882 0.490 -6.642 1.00 0.00 H new ATOM 0 HD2 HIS A 386 2.438 -2.064 -9.220 1.00 0.00 H new ATOM 0 HE1 HIS A 386 5.600 -3.958 -7.121 1.00 0.00 H new ATOM 0 HE2 HIS A 386 3.979 -4.159 -9.072 1.00 0.00 H new ATOM 374 N TYR A 387 2.038 -2.505 -5.483 1.00 0.00 N ATOM 375 CA TYR A 387 2.260 -3.661 -4.624 1.00 0.00 C ATOM 376 C TYR A 387 3.417 -4.509 -5.133 1.00 0.00 C ATOM 377 O TYR A 387 3.392 -5.008 -6.258 1.00 0.00 O ATOM 378 CB TYR A 387 0.989 -4.505 -4.538 1.00 0.00 C ATOM 379 CG TYR A 387 -0.222 -3.703 -4.125 1.00 0.00 C ATOM 380 CD1 TYR A 387 -0.502 -3.479 -2.786 1.00 0.00 C ATOM 381 CD2 TYR A 387 -1.077 -3.158 -5.075 1.00 0.00 C ATOM 382 CE1 TYR A 387 -1.598 -2.735 -2.401 1.00 0.00 C ATOM 383 CE2 TYR A 387 -2.177 -2.413 -4.699 1.00 0.00 C ATOM 384 CZ TYR A 387 -2.434 -2.204 -3.360 1.00 0.00 C ATOM 385 OH TYR A 387 -3.525 -1.459 -2.979 1.00 0.00 O ATOM 0 H TYR A 387 1.762 -2.737 -6.437 1.00 0.00 H new ATOM 0 HA TYR A 387 2.517 -3.298 -3.629 1.00 0.00 H new ATOM 0 HB2 TYR A 387 0.799 -4.967 -5.507 1.00 0.00 H new ATOM 0 HB3 TYR A 387 1.144 -5.314 -3.824 1.00 0.00 H new ATOM 0 HD1 TYR A 387 0.149 -3.894 -2.031 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -0.878 -3.320 -6.124 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -1.800 -2.569 -1.353 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -2.833 -1.996 -5.449 1.00 0.00 H new ATOM 0 HH TYR A 387 -3.761 -0.834 -3.696 1.00 0.00 H new ATOM 395 N VAL A 388 4.432 -4.664 -4.294 1.00 0.00 N ATOM 396 CA VAL A 388 5.606 -5.447 -4.648 1.00 0.00 C ATOM 397 C VAL A 388 5.661 -6.742 -3.847 1.00 0.00 C ATOM 398 O VAL A 388 5.693 -6.717 -2.618 1.00 0.00 O ATOM 399 CB VAL A 388 6.898 -4.648 -4.401 1.00 0.00 C ATOM 400 CG1 VAL A 388 6.846 -3.964 -3.043 1.00 0.00 C ATOM 401 CG2 VAL A 388 8.113 -5.553 -4.507 1.00 0.00 C ATOM 0 H VAL A 388 4.465 -4.256 -3.360 1.00 0.00 H new ATOM 0 HA VAL A 388 5.528 -5.684 -5.709 1.00 0.00 H new ATOM 0 HB VAL A 388 6.983 -3.878 -5.168 1.00 0.00 H new ATOM 0 HG11 VAL A 388 7.767 -3.403 -2.883 1.00 0.00 H new ATOM 0 HG12 VAL A 388 5.996 -3.283 -3.011 1.00 0.00 H new ATOM 0 HG13 VAL A 388 6.738 -4.716 -2.261 1.00 0.00 H new ATOM 0 HG21 VAL A 388 9.017 -4.971 -4.329 1.00 0.00 H new ATOM 0 HG22 VAL A 388 8.041 -6.347 -3.764 1.00 0.00 H new ATOM 0 HG23 VAL A 388 8.154 -5.992 -5.504 1.00 0.00 H new ATOM 411 N THR A 389 5.671 -7.869 -4.549 1.00 0.00 N ATOM 412 CA THR A 389 5.718 -9.172 -3.898 1.00 0.00 C ATOM 413 C THR A 389 7.154 -9.652 -3.710 1.00 0.00 C ATOM 414 O THR A 389 7.886 -9.852 -4.679 1.00 0.00 O ATOM 415 CB THR A 389 4.941 -10.233 -4.699 1.00 0.00 C ATOM 416 OG1 THR A 389 3.607 -9.794 -4.989 1.00 0.00 O ATOM 417 CG2 THR A 389 4.862 -11.541 -3.928 1.00 0.00 C ATOM 0 H THR A 389 5.647 -7.907 -5.568 1.00 0.00 H new ATOM 0 HA THR A 389 5.250 -9.045 -2.922 1.00 0.00 H new ATOM 0 HB THR A 389 5.482 -10.386 -5.633 1.00 0.00 H new ATOM 0 HG1 THR A 389 3.320 -10.165 -5.850 1.00 0.00 H new ATOM 0 HG21 THR A 389 4.309 -12.275 -4.513 1.00 0.00 H new ATOM 0 HG22 THR A 389 5.869 -11.913 -3.738 1.00 0.00 H new ATOM 0 HG23 THR A 389 4.352 -11.374 -2.979 1.00 0.00 H new ATOM 425 N VAL A 390 7.544 -9.840 -2.454 1.00 0.00 N ATOM 426 CA VAL A 390 8.890 -10.306 -2.130 1.00 0.00 C ATOM 427 C VAL A 390 8.928 -11.824 -2.035 1.00 0.00 C ATOM 428 O VAL A 390 9.763 -12.478 -2.661 1.00 0.00 O ATOM 429 CB VAL A 390 9.409 -9.714 -0.801 1.00 0.00 C ATOM 430 CG1 VAL A 390 10.645 -8.864 -1.041 1.00 0.00 C ATOM 431 CG2 VAL A 390 8.330 -8.901 -0.101 1.00 0.00 C ATOM 0 H VAL A 390 6.948 -9.677 -1.642 1.00 0.00 H new ATOM 0 HA VAL A 390 9.537 -9.965 -2.939 1.00 0.00 H new ATOM 0 HB VAL A 390 9.679 -10.544 -0.149 1.00 0.00 H new ATOM 0 HG11 VAL A 390 10.996 -8.456 -0.093 1.00 0.00 H new ATOM 0 HG12 VAL A 390 11.429 -9.479 -1.484 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.399 -8.047 -1.719 1.00 0.00 H new ATOM 0 HG21 VAL A 390 8.726 -8.498 0.831 1.00 0.00 H new ATOM 0 HG22 VAL A 390 8.016 -8.081 -0.747 1.00 0.00 H new ATOM 0 HG23 VAL A 390 7.475 -9.541 0.115 1.00 0.00 H new ATOM 441 N LYS A 391 8.014 -12.379 -1.249 1.00 0.00 N ATOM 442 CA LYS A 391 7.936 -13.822 -1.071 1.00 0.00 C ATOM 443 C LYS A 391 6.535 -14.331 -1.398 1.00 0.00 C ATOM 444 O LYS A 391 5.563 -13.576 -1.368 1.00 0.00 O ATOM 445 CB LYS A 391 8.358 -14.211 0.360 1.00 0.00 C ATOM 446 CG LYS A 391 7.251 -14.794 1.232 1.00 0.00 C ATOM 447 CD LYS A 391 7.819 -15.692 2.321 1.00 0.00 C ATOM 448 CE LYS A 391 8.018 -17.114 1.821 1.00 0.00 C ATOM 449 NZ LYS A 391 8.813 -17.933 2.776 1.00 0.00 N ATOM 0 H LYS A 391 7.316 -11.851 -0.725 1.00 0.00 H new ATOM 0 HA LYS A 391 8.629 -14.297 -1.765 1.00 0.00 H new ATOM 0 HB2 LYS A 391 9.168 -14.937 0.297 1.00 0.00 H new ATOM 0 HB3 LYS A 391 8.760 -13.327 0.855 1.00 0.00 H new ATOM 0 HG2 LYS A 391 6.679 -13.985 1.687 1.00 0.00 H new ATOM 0 HG3 LYS A 391 6.559 -15.364 0.612 1.00 0.00 H new ATOM 0 HD2 LYS A 391 8.771 -15.290 2.666 1.00 0.00 H new ATOM 0 HD3 LYS A 391 7.146 -15.697 3.178 1.00 0.00 H new ATOM 0 HE2 LYS A 391 7.047 -17.582 1.663 1.00 0.00 H new ATOM 0 HE3 LYS A 391 8.522 -17.092 0.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 9.099 -18.821 2.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 9.660 -17.404 3.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 8.236 -18.147 3.614 1.00 0.00 H new ATOM 463 N LYS A 392 6.444 -15.618 -1.710 1.00 0.00 N ATOM 464 CA LYS A 392 5.171 -16.241 -2.045 1.00 0.00 C ATOM 465 C LYS A 392 5.070 -17.623 -1.414 1.00 0.00 C ATOM 466 O LYS A 392 6.052 -18.150 -0.892 1.00 0.00 O ATOM 467 CB LYS A 392 5.015 -16.356 -3.563 1.00 0.00 C ATOM 468 CG LYS A 392 6.274 -16.000 -4.335 1.00 0.00 C ATOM 469 CD LYS A 392 7.338 -17.076 -4.189 1.00 0.00 C ATOM 470 CE LYS A 392 8.726 -16.474 -4.046 1.00 0.00 C ATOM 471 NZ LYS A 392 9.646 -16.934 -5.122 1.00 0.00 N ATOM 0 H LYS A 392 7.242 -16.253 -1.738 1.00 0.00 H new ATOM 0 HA LYS A 392 4.372 -15.613 -1.652 1.00 0.00 H new ATOM 0 HB2 LYS A 392 4.722 -17.376 -3.813 1.00 0.00 H new ATOM 0 HB3 LYS A 392 4.204 -15.703 -3.887 1.00 0.00 H new ATOM 0 HG2 LYS A 392 6.031 -15.868 -5.389 1.00 0.00 H new ATOM 0 HG3 LYS A 392 6.666 -15.048 -3.976 1.00 0.00 H new ATOM 0 HD2 LYS A 392 7.116 -17.692 -3.317 1.00 0.00 H new ATOM 0 HD3 LYS A 392 7.314 -17.733 -5.058 1.00 0.00 H new ATOM 0 HE2 LYS A 392 8.654 -15.387 -4.071 1.00 0.00 H new ATOM 0 HE3 LYS A 392 9.140 -16.744 -3.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 10.582 -16.500 -4.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 9.735 -17.969 -5.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 9.264 -16.654 -6.048 1.00 0.00 H new ATOM 485 N PRO A 393 3.878 -18.232 -1.458 1.00 0.00 N ATOM 486 CA PRO A 393 3.656 -19.564 -0.893 1.00 0.00 C ATOM 487 C PRO A 393 4.521 -20.615 -1.577 1.00 0.00 C ATOM 488 O PRO A 393 4.581 -20.681 -2.804 1.00 0.00 O ATOM 489 CB PRO A 393 2.170 -19.835 -1.165 1.00 0.00 C ATOM 490 CG PRO A 393 1.571 -18.498 -1.439 1.00 0.00 C ATOM 491 CD PRO A 393 2.660 -17.676 -2.064 1.00 0.00 C ATOM 0 HA PRO A 393 3.916 -19.609 0.165 1.00 0.00 H new ATOM 0 HB2 PRO A 393 2.041 -20.505 -2.015 1.00 0.00 H new ATOM 0 HB3 PRO A 393 1.694 -20.311 -0.308 1.00 0.00 H new ATOM 0 HG2 PRO A 393 0.715 -18.584 -2.108 1.00 0.00 H new ATOM 0 HG3 PRO A 393 1.212 -18.036 -0.520 1.00 0.00 H new ATOM 0 HD2 PRO A 393 2.668 -17.774 -3.150 1.00 0.00 H new ATOM 0 HD3 PRO A 393 2.545 -16.615 -1.840 1.00 0.00 H new ATOM 499 N THR A 394 5.192 -21.432 -0.776 1.00 0.00 N ATOM 500 CA THR A 394 6.055 -22.478 -1.306 1.00 0.00 C ATOM 501 C THR A 394 6.028 -23.713 -0.414 1.00 0.00 C ATOM 502 O THR A 394 5.768 -23.618 0.786 1.00 0.00 O ATOM 503 CB THR A 394 7.505 -21.981 -1.447 1.00 0.00 C ATOM 504 OG1 THR A 394 8.203 -22.045 -0.197 1.00 0.00 O ATOM 505 CG2 THR A 394 7.536 -20.542 -1.944 1.00 0.00 C ATOM 0 H THR A 394 5.155 -21.390 0.242 1.00 0.00 H new ATOM 0 HA THR A 394 5.674 -22.743 -2.292 1.00 0.00 H new ATOM 0 HB THR A 394 7.997 -22.634 -2.168 1.00 0.00 H new ATOM 0 HG1 THR A 394 8.924 -21.381 -0.191 1.00 0.00 H new ATOM 0 HG21 THR A 394 8.570 -20.211 -2.036 1.00 0.00 H new ATOM 0 HG22 THR A 394 7.048 -20.482 -2.917 1.00 0.00 H new ATOM 0 HG23 THR A 394 7.012 -19.901 -1.235 1.00 0.00 H new ATOM 513 N ALA A 395 6.295 -24.872 -1.005 1.00 0.00 N ATOM 514 CA ALA A 395 6.298 -26.123 -0.260 1.00 0.00 C ATOM 515 C ALA A 395 6.994 -25.958 1.085 1.00 0.00 C ATOM 516 O ALA A 395 6.474 -26.370 2.121 1.00 0.00 O ATOM 517 CB ALA A 395 6.959 -27.234 -1.062 1.00 0.00 C ATOM 0 H ALA A 395 6.512 -24.970 -1.997 1.00 0.00 H new ATOM 0 HA ALA A 395 5.260 -26.400 -0.078 1.00 0.00 H new ATOM 0 HB1 ALA A 395 6.948 -28.157 -0.483 1.00 0.00 H new ATOM 0 HB2 ALA A 395 6.414 -27.384 -1.994 1.00 0.00 H new ATOM 0 HB3 ALA A 395 7.990 -26.958 -1.285 1.00 0.00 H new ATOM 523 N VAL A 396 8.173 -25.351 1.058 1.00 0.00 N ATOM 524 CA VAL A 396 8.946 -25.127 2.269 1.00 0.00 C ATOM 525 C VAL A 396 8.270 -24.104 3.173 1.00 0.00 C ATOM 526 O VAL A 396 8.267 -24.245 4.396 1.00 0.00 O ATOM 527 CB VAL A 396 10.369 -24.646 1.932 1.00 0.00 C ATOM 528 CG1 VAL A 396 10.935 -25.438 0.766 1.00 0.00 C ATOM 529 CG2 VAL A 396 10.382 -23.154 1.625 1.00 0.00 C ATOM 0 H VAL A 396 8.615 -25.004 0.207 1.00 0.00 H new ATOM 0 HA VAL A 396 9.005 -26.080 2.795 1.00 0.00 H new ATOM 0 HB VAL A 396 11.000 -24.815 2.804 1.00 0.00 H new ATOM 0 HG11 VAL A 396 11.941 -25.085 0.541 1.00 0.00 H new ATOM 0 HG12 VAL A 396 10.971 -26.495 1.028 1.00 0.00 H new ATOM 0 HG13 VAL A 396 10.299 -25.303 -0.109 1.00 0.00 H new ATOM 0 HG21 VAL A 396 11.399 -22.840 1.390 1.00 0.00 H new ATOM 0 HG22 VAL A 396 9.734 -22.952 0.772 1.00 0.00 H new ATOM 0 HG23 VAL A 396 10.023 -22.601 2.493 1.00 0.00 H new ATOM 539 N ASP A 397 7.706 -23.068 2.562 1.00 0.00 N ATOM 540 CA ASP A 397 7.036 -22.015 3.313 1.00 0.00 C ATOM 541 C ASP A 397 5.871 -21.428 2.521 1.00 0.00 C ATOM 542 O ASP A 397 6.070 -20.647 1.590 1.00 0.00 O ATOM 543 CB ASP A 397 8.029 -20.910 3.675 1.00 0.00 C ATOM 544 CG ASP A 397 8.188 -20.745 5.173 1.00 0.00 C ATOM 545 OD1 ASP A 397 7.210 -21.001 5.906 1.00 0.00 O ATOM 546 OD2 ASP A 397 9.291 -20.361 5.614 1.00 0.00 O ATOM 0 H ASP A 397 7.700 -22.936 1.551 1.00 0.00 H new ATOM 0 HA ASP A 397 6.639 -22.456 4.228 1.00 0.00 H new ATOM 0 HB2 ASP A 397 8.999 -21.137 3.232 1.00 0.00 H new ATOM 0 HB3 ASP A 397 7.694 -19.968 3.242 1.00 0.00 H new ATOM 551 N PRO A 398 4.636 -21.799 2.887 1.00 0.00 N ATOM 552 CA PRO A 398 3.423 -21.318 2.222 1.00 0.00 C ATOM 553 C PRO A 398 3.051 -19.898 2.645 1.00 0.00 C ATOM 554 O PRO A 398 1.887 -19.612 2.927 1.00 0.00 O ATOM 555 CB PRO A 398 2.337 -22.309 2.677 1.00 0.00 C ATOM 556 CG PRO A 398 3.037 -23.347 3.499 1.00 0.00 C ATOM 557 CD PRO A 398 4.316 -22.722 3.976 1.00 0.00 C ATOM 0 HA PRO A 398 3.550 -21.273 1.140 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.568 -21.803 3.261 1.00 0.00 H new ATOM 0 HB3 PRO A 398 1.839 -22.762 1.820 1.00 0.00 H new ATOM 0 HG2 PRO A 398 2.419 -23.656 4.342 1.00 0.00 H new ATOM 0 HG3 PRO A 398 3.239 -24.240 2.907 1.00 0.00 H new ATOM 0 HD2 PRO A 398 4.185 -22.202 4.925 1.00 0.00 H new ATOM 0 HD3 PRO A 398 5.101 -23.464 4.124 1.00 0.00 H new ATOM 565 N ASN A 399 4.042 -19.011 2.690 1.00 0.00 N ATOM 566 CA ASN A 399 3.809 -17.625 3.082 1.00 0.00 C ATOM 567 C ASN A 399 4.236 -16.659 1.978 1.00 0.00 C ATOM 568 O ASN A 399 5.049 -17.001 1.119 1.00 0.00 O ATOM 569 CB ASN A 399 4.565 -17.304 4.373 1.00 0.00 C ATOM 570 CG ASN A 399 4.476 -18.426 5.389 1.00 0.00 C ATOM 571 OD1 ASN A 399 3.630 -18.405 6.282 1.00 0.00 O ATOM 572 ND2 ASN A 399 5.354 -19.415 5.257 1.00 0.00 N ATOM 0 H ASN A 399 5.012 -19.227 2.460 1.00 0.00 H new ATOM 0 HA ASN A 399 2.739 -17.501 3.251 1.00 0.00 H new ATOM 0 HB2 ASN A 399 5.612 -17.111 4.139 1.00 0.00 H new ATOM 0 HB3 ASN A 399 4.162 -16.390 4.809 1.00 0.00 H new ATOM 0 HD21 ASN A 399 5.343 -20.197 5.911 1.00 0.00 H new ATOM 0 HD22 ASN A 399 6.039 -19.392 4.501 1.00 0.00 H new ATOM 579 N SER A 400 3.682 -15.450 2.014 1.00 0.00 N ATOM 580 CA SER A 400 4.000 -14.429 1.024 1.00 0.00 C ATOM 581 C SER A 400 4.310 -13.095 1.697 1.00 0.00 C ATOM 582 O SER A 400 3.860 -12.831 2.812 1.00 0.00 O ATOM 583 CB SER A 400 2.834 -14.253 0.048 1.00 0.00 C ATOM 584 OG SER A 400 3.241 -13.548 -1.111 1.00 0.00 O ATOM 0 H SER A 400 3.009 -15.154 2.721 1.00 0.00 H new ATOM 0 HA SER A 400 4.883 -14.757 0.475 1.00 0.00 H new ATOM 0 HB2 SER A 400 2.443 -15.230 -0.236 1.00 0.00 H new ATOM 0 HB3 SER A 400 2.023 -13.715 0.539 1.00 0.00 H new ATOM 0 HG SER A 400 4.204 -13.371 -1.065 1.00 0.00 H new ATOM 590 N ILE A 401 5.067 -12.253 1.003 1.00 0.00 N ATOM 591 CA ILE A 401 5.424 -10.935 1.515 1.00 0.00 C ATOM 592 C ILE A 401 5.191 -9.886 0.438 1.00 0.00 C ATOM 593 O ILE A 401 5.509 -10.110 -0.728 1.00 0.00 O ATOM 594 CB ILE A 401 6.897 -10.867 1.963 1.00 0.00 C ATOM 595 CG1 ILE A 401 7.169 -11.873 3.081 1.00 0.00 C ATOM 596 CG2 ILE A 401 7.244 -9.461 2.422 1.00 0.00 C ATOM 597 CD1 ILE A 401 8.563 -12.458 3.039 1.00 0.00 C ATOM 0 H ILE A 401 5.447 -12.461 0.080 1.00 0.00 H new ATOM 0 HA ILE A 401 4.794 -10.743 2.383 1.00 0.00 H new ATOM 0 HB ILE A 401 7.527 -11.123 1.111 1.00 0.00 H new ATOM 0 HG12 ILE A 401 7.017 -11.385 4.044 1.00 0.00 H new ATOM 0 HG13 ILE A 401 6.442 -12.682 3.016 1.00 0.00 H new ATOM 0 HG21 ILE A 401 8.287 -9.428 2.736 1.00 0.00 H new ATOM 0 HG22 ILE A 401 7.090 -8.762 1.600 1.00 0.00 H new ATOM 0 HG23 ILE A 401 6.604 -9.184 3.260 1.00 0.00 H new ATOM 0 HD11 ILE A 401 8.686 -13.163 3.861 1.00 0.00 H new ATOM 0 HD12 ILE A 401 8.712 -12.975 2.091 1.00 0.00 H new ATOM 0 HD13 ILE A 401 9.297 -11.657 3.135 1.00 0.00 H new ATOM 609 N VAL A 402 4.641 -8.739 0.819 1.00 0.00 N ATOM 610 CA VAL A 402 4.388 -7.679 -0.144 1.00 0.00 C ATOM 611 C VAL A 402 4.556 -6.298 0.475 1.00 0.00 C ATOM 612 O VAL A 402 4.200 -6.071 1.631 1.00 0.00 O ATOM 613 CB VAL A 402 2.977 -7.793 -0.753 1.00 0.00 C ATOM 614 CG1 VAL A 402 2.630 -6.540 -1.544 1.00 0.00 C ATOM 615 CG2 VAL A 402 2.876 -9.030 -1.632 1.00 0.00 C ATOM 0 H VAL A 402 4.365 -8.522 1.777 1.00 0.00 H new ATOM 0 HA VAL A 402 5.129 -7.801 -0.934 1.00 0.00 H new ATOM 0 HB VAL A 402 2.258 -7.890 0.060 1.00 0.00 H new ATOM 0 HG11 VAL A 402 1.630 -6.641 -1.966 1.00 0.00 H new ATOM 0 HG12 VAL A 402 2.660 -5.673 -0.884 1.00 0.00 H new ATOM 0 HG13 VAL A 402 3.352 -6.407 -2.350 1.00 0.00 H new ATOM 0 HG21 VAL A 402 1.873 -9.095 -2.054 1.00 0.00 H new ATOM 0 HG22 VAL A 402 3.606 -8.964 -2.439 1.00 0.00 H new ATOM 0 HG23 VAL A 402 3.076 -9.919 -1.034 1.00 0.00 H new ATOM 625 N GLU A 403 5.081 -5.378 -0.320 1.00 0.00 N ATOM 626 CA GLU A 403 5.282 -4.002 0.115 1.00 0.00 C ATOM 627 C GLU A 403 4.486 -3.065 -0.782 1.00 0.00 C ATOM 628 O GLU A 403 4.466 -3.241 -1.999 1.00 0.00 O ATOM 629 CB GLU A 403 6.767 -3.635 0.078 1.00 0.00 C ATOM 630 CG GLU A 403 7.696 -4.831 0.215 1.00 0.00 C ATOM 631 CD GLU A 403 9.073 -4.569 -0.363 1.00 0.00 C ATOM 632 OE1 GLU A 403 9.788 -3.699 0.177 1.00 0.00 O ATOM 633 OE2 GLU A 403 9.436 -5.234 -1.356 1.00 0.00 O ATOM 0 H GLU A 403 5.378 -5.561 -1.278 1.00 0.00 H new ATOM 0 HA GLU A 403 4.933 -3.902 1.143 1.00 0.00 H new ATOM 0 HB2 GLU A 403 6.983 -3.124 -0.861 1.00 0.00 H new ATOM 0 HB3 GLU A 403 6.978 -2.929 0.881 1.00 0.00 H new ATOM 0 HG2 GLU A 403 7.792 -5.093 1.269 1.00 0.00 H new ATOM 0 HG3 GLU A 403 7.252 -5.690 -0.288 1.00 0.00 H new ATOM 640 N CYS A 404 3.812 -2.083 -0.191 1.00 0.00 N ATOM 641 CA CYS A 404 3.013 -1.164 -0.984 1.00 0.00 C ATOM 642 C CYS A 404 3.748 0.137 -1.262 1.00 0.00 C ATOM 643 O CYS A 404 3.707 1.061 -0.450 1.00 0.00 O ATOM 644 CB CYS A 404 1.735 -0.829 -0.229 1.00 0.00 C ATOM 645 SG CYS A 404 0.450 -2.090 -0.341 1.00 0.00 S ATOM 0 H CYS A 404 3.804 -1.907 0.814 1.00 0.00 H new ATOM 0 HA CYS A 404 2.799 -1.655 -1.934 1.00 0.00 H new ATOM 0 HB2 CYS A 404 1.979 -0.669 0.821 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.338 0.112 -0.611 1.00 0.00 H new ATOM 0 HG CYS A 404 0.103 -2.247 -1.584 1.00 0.00 H new ATOM 651 N ARG A 405 4.437 0.207 -2.391 1.00 0.00 N ATOM 652 CA ARG A 405 5.198 1.394 -2.750 1.00 0.00 C ATOM 653 C ARG A 405 4.333 2.466 -3.407 1.00 0.00 C ATOM 654 O ARG A 405 3.107 2.367 -3.454 1.00 0.00 O ATOM 655 CB ARG A 405 6.346 1.016 -3.690 1.00 0.00 C ATOM 656 CG ARG A 405 6.817 -0.420 -3.532 1.00 0.00 C ATOM 657 CD ARG A 405 8.287 -0.565 -3.892 1.00 0.00 C ATOM 658 NE ARG A 405 8.762 0.543 -4.716 1.00 0.00 N ATOM 659 CZ ARG A 405 8.258 0.843 -5.909 1.00 0.00 C ATOM 660 NH1 ARG A 405 7.269 0.119 -6.413 1.00 0.00 N ATOM 661 NH2 ARG A 405 8.744 1.865 -6.598 1.00 0.00 N ATOM 0 H ARG A 405 4.485 -0.547 -3.076 1.00 0.00 H new ATOM 0 HA ARG A 405 5.593 1.812 -1.824 1.00 0.00 H new ATOM 0 HB2 ARG A 405 6.027 1.173 -4.720 1.00 0.00 H new ATOM 0 HB3 ARG A 405 7.186 1.687 -3.511 1.00 0.00 H new ATOM 0 HG2 ARG A 405 6.659 -0.745 -2.504 1.00 0.00 H new ATOM 0 HG3 ARG A 405 6.219 -1.073 -4.168 1.00 0.00 H new ATOM 0 HD2 ARG A 405 8.880 -0.618 -2.979 1.00 0.00 H new ATOM 0 HD3 ARG A 405 8.439 -1.504 -4.425 1.00 0.00 H new ATOM 0 HE ARG A 405 9.523 1.119 -4.356 1.00 0.00 H new ATOM 0 HH11 ARG A 405 6.894 -0.669 -5.885 1.00 0.00 H new ATOM 0 HH12 ARG A 405 6.883 0.350 -7.328 1.00 0.00 H new ATOM 0 HH21 ARG A 405 9.506 2.423 -6.213 1.00 0.00 H new ATOM 0 HH22 ARG A 405 8.356 2.094 -7.513 1.00 0.00 H new ATOM 675 N VAL A 406 5.015 3.484 -3.914 1.00 0.00 N ATOM 676 CA VAL A 406 4.359 4.601 -4.587 1.00 0.00 C ATOM 677 C VAL A 406 5.282 5.262 -5.603 1.00 0.00 C ATOM 678 O VAL A 406 6.496 5.068 -5.570 1.00 0.00 O ATOM 679 CB VAL A 406 3.852 5.658 -3.586 1.00 0.00 C ATOM 680 CG1 VAL A 406 2.346 5.823 -3.721 1.00 0.00 C ATOM 681 CG2 VAL A 406 4.227 5.285 -2.157 1.00 0.00 C ATOM 0 H VAL A 406 6.031 3.561 -3.872 1.00 0.00 H new ATOM 0 HA VAL A 406 3.500 4.182 -5.111 1.00 0.00 H new ATOM 0 HB VAL A 406 4.332 6.609 -3.817 1.00 0.00 H new ATOM 0 HG11 VAL A 406 1.997 6.572 -3.010 1.00 0.00 H new ATOM 0 HG12 VAL A 406 2.105 6.144 -4.734 1.00 0.00 H new ATOM 0 HG13 VAL A 406 1.856 4.871 -3.516 1.00 0.00 H new ATOM 0 HG21 VAL A 406 3.857 6.048 -1.473 1.00 0.00 H new ATOM 0 HG22 VAL A 406 3.782 4.323 -1.903 1.00 0.00 H new ATOM 0 HG23 VAL A 406 5.311 5.216 -2.072 1.00 0.00 H new ATOM 691 N GLY A 407 4.695 6.033 -6.515 1.00 0.00 N ATOM 692 CA GLY A 407 5.474 6.705 -7.538 1.00 0.00 C ATOM 693 C GLY A 407 6.749 7.326 -6.998 1.00 0.00 C ATOM 694 O GLY A 407 7.756 7.396 -7.700 1.00 0.00 O ATOM 0 H GLY A 407 3.691 6.204 -6.563 1.00 0.00 H new ATOM 0 HA2 GLY A 407 5.727 5.991 -8.322 1.00 0.00 H new ATOM 0 HA3 GLY A 407 4.865 7.482 -7.999 1.00 0.00 H new ATOM 698 N ASP A 408 6.704 7.781 -5.750 1.00 0.00 N ATOM 699 CA ASP A 408 7.865 8.403 -5.122 1.00 0.00 C ATOM 700 C ASP A 408 8.958 7.375 -4.845 1.00 0.00 C ATOM 701 O ASP A 408 10.052 7.723 -4.401 1.00 0.00 O ATOM 702 CB ASP A 408 7.458 9.090 -3.819 1.00 0.00 C ATOM 703 CG ASP A 408 6.986 10.515 -4.039 1.00 0.00 C ATOM 704 OD1 ASP A 408 7.764 11.317 -4.595 1.00 0.00 O ATOM 705 OD2 ASP A 408 5.838 10.826 -3.657 1.00 0.00 O ATOM 0 H ASP A 408 5.878 7.731 -5.154 1.00 0.00 H new ATOM 0 HA ASP A 408 8.261 9.147 -5.813 1.00 0.00 H new ATOM 0 HB2 ASP A 408 6.663 8.517 -3.342 1.00 0.00 H new ATOM 0 HB3 ASP A 408 8.305 9.093 -3.133 1.00 0.00 H new ATOM 710 N GLY A 409 8.656 6.108 -5.106 1.00 0.00 N ATOM 711 CA GLY A 409 9.623 5.054 -4.874 1.00 0.00 C ATOM 712 C GLY A 409 9.860 4.807 -3.398 1.00 0.00 C ATOM 713 O GLY A 409 10.827 4.145 -3.021 1.00 0.00 O ATOM 0 H GLY A 409 7.758 5.793 -5.474 1.00 0.00 H new ATOM 0 HA2 GLY A 409 9.274 4.134 -5.343 1.00 0.00 H new ATOM 0 HA3 GLY A 409 10.566 5.317 -5.352 1.00 0.00 H new ATOM 717 N THR A 410 8.979 5.343 -2.560 1.00 0.00 N ATOM 718 CA THR A 410 9.103 5.178 -1.117 1.00 0.00 C ATOM 719 C THR A 410 8.147 4.117 -0.590 1.00 0.00 C ATOM 720 O THR A 410 6.929 4.252 -0.711 1.00 0.00 O ATOM 721 CB THR A 410 8.832 6.500 -0.374 1.00 0.00 C ATOM 722 OG1 THR A 410 9.235 7.632 -1.154 1.00 0.00 O ATOM 723 CG2 THR A 410 9.575 6.535 0.951 1.00 0.00 C ATOM 0 H THR A 410 8.173 5.894 -2.855 1.00 0.00 H new ATOM 0 HA THR A 410 10.129 4.861 -0.931 1.00 0.00 H new ATOM 0 HB THR A 410 7.757 6.551 -0.198 1.00 0.00 H new ATOM 0 HG1 THR A 410 9.049 8.455 -0.656 1.00 0.00 H new ATOM 0 HG21 THR A 410 9.369 7.477 1.459 1.00 0.00 H new ATOM 0 HG22 THR A 410 9.243 5.706 1.576 1.00 0.00 H new ATOM 0 HG23 THR A 410 10.646 6.447 0.770 1.00 0.00 H new ATOM 731 N VAL A 411 8.701 3.069 0.011 1.00 0.00 N ATOM 732 CA VAL A 411 7.884 2.001 0.569 1.00 0.00 C ATOM 733 C VAL A 411 6.820 2.582 1.490 1.00 0.00 C ATOM 734 O VAL A 411 7.071 2.819 2.672 1.00 0.00 O ATOM 735 CB VAL A 411 8.736 0.988 1.356 1.00 0.00 C ATOM 736 CG1 VAL A 411 7.872 -0.159 1.854 1.00 0.00 C ATOM 737 CG2 VAL A 411 9.882 0.470 0.499 1.00 0.00 C ATOM 0 H VAL A 411 9.706 2.938 0.123 1.00 0.00 H new ATOM 0 HA VAL A 411 7.411 1.481 -0.264 1.00 0.00 H new ATOM 0 HB VAL A 411 9.163 1.495 2.221 1.00 0.00 H new ATOM 0 HG11 VAL A 411 8.490 -0.866 2.408 1.00 0.00 H new ATOM 0 HG12 VAL A 411 7.091 0.231 2.507 1.00 0.00 H new ATOM 0 HG13 VAL A 411 7.415 -0.666 1.004 1.00 0.00 H new ATOM 0 HG21 VAL A 411 10.472 -0.244 1.073 1.00 0.00 H new ATOM 0 HG22 VAL A 411 9.480 -0.021 -0.388 1.00 0.00 H new ATOM 0 HG23 VAL A 411 10.516 1.304 0.196 1.00 0.00 H new ATOM 747 N LEU A 412 5.636 2.822 0.937 1.00 0.00 N ATOM 748 CA LEU A 412 4.539 3.386 1.690 1.00 0.00 C ATOM 749 C LEU A 412 4.021 2.382 2.709 1.00 0.00 C ATOM 750 O LEU A 412 3.730 2.740 3.851 1.00 0.00 O ATOM 751 CB LEU A 412 3.440 3.822 0.714 1.00 0.00 C ATOM 752 CG LEU A 412 2.031 3.927 1.288 1.00 0.00 C ATOM 753 CD1 LEU A 412 1.981 4.932 2.426 1.00 0.00 C ATOM 754 CD2 LEU A 412 1.052 4.329 0.199 1.00 0.00 C ATOM 0 H LEU A 412 5.418 2.630 -0.041 1.00 0.00 H new ATOM 0 HA LEU A 412 4.879 4.259 2.246 1.00 0.00 H new ATOM 0 HB2 LEU A 412 3.714 4.793 0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.420 3.116 -0.116 1.00 0.00 H new ATOM 0 HG LEU A 412 1.750 2.950 1.681 1.00 0.00 H new ATOM 0 HD11 LEU A 412 0.965 4.988 2.818 1.00 0.00 H new ATOM 0 HD12 LEU A 412 2.659 4.617 3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 412 2.283 5.913 2.059 1.00 0.00 H new ATOM 0 HD21 LEU A 412 0.049 4.401 0.620 1.00 0.00 H new ATOM 0 HD22 LEU A 412 1.343 5.295 -0.213 1.00 0.00 H new ATOM 0 HD23 LEU A 412 1.060 3.580 -0.593 1.00 0.00 H new ATOM 766 N GLY A 413 3.923 1.119 2.296 1.00 0.00 N ATOM 767 CA GLY A 413 3.448 0.084 3.198 1.00 0.00 C ATOM 768 C GLY A 413 4.176 -1.233 3.039 1.00 0.00 C ATOM 769 O GLY A 413 4.963 -1.415 2.111 1.00 0.00 O ATOM 0 H GLY A 413 4.163 0.796 1.358 1.00 0.00 H new ATOM 0 HA2 GLY A 413 3.558 0.430 4.226 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.383 -0.075 3.028 1.00 0.00 H new ATOM 773 N THR A 414 3.901 -2.152 3.955 1.00 0.00 N ATOM 774 CA THR A 414 4.516 -3.469 3.931 1.00 0.00 C ATOM 775 C THR A 414 3.715 -4.446 4.784 1.00 0.00 C ATOM 776 O THR A 414 3.336 -4.131 5.912 1.00 0.00 O ATOM 777 CB THR A 414 5.970 -3.426 4.437 1.00 0.00 C ATOM 778 OG1 THR A 414 6.781 -2.574 3.619 1.00 0.00 O ATOM 779 CG2 THR A 414 6.584 -4.817 4.441 1.00 0.00 C ATOM 0 H THR A 414 3.252 -2.006 4.728 1.00 0.00 H new ATOM 0 HA THR A 414 4.521 -3.805 2.894 1.00 0.00 H new ATOM 0 HB THR A 414 5.941 -3.032 5.453 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.303 -2.365 2.789 1.00 0.00 H new ATOM 0 HG21 THR A 414 7.611 -4.760 4.802 1.00 0.00 H new ATOM 0 HG22 THR A 414 6.005 -5.469 5.095 1.00 0.00 H new ATOM 0 HG23 THR A 414 6.577 -5.221 3.428 1.00 0.00 H new ATOM 787 N GLY A 415 3.452 -5.631 4.242 1.00 0.00 N ATOM 788 CA GLY A 415 2.691 -6.620 4.978 1.00 0.00 C ATOM 789 C GLY A 415 2.820 -8.014 4.397 1.00 0.00 C ATOM 790 O GLY A 415 3.031 -8.178 3.195 1.00 0.00 O ATOM 0 H GLY A 415 3.751 -5.922 3.311 1.00 0.00 H new ATOM 0 HA2 GLY A 415 3.026 -6.631 6.015 1.00 0.00 H new ATOM 0 HA3 GLY A 415 1.640 -6.331 4.986 1.00 0.00 H new ATOM 794 N VAL A 416 2.688 -9.018 5.257 1.00 0.00 N ATOM 795 CA VAL A 416 2.785 -10.406 4.838 1.00 0.00 C ATOM 796 C VAL A 416 1.407 -11.062 4.830 1.00 0.00 C ATOM 797 O VAL A 416 0.569 -10.775 5.685 1.00 0.00 O ATOM 798 CB VAL A 416 3.731 -11.194 5.775 1.00 0.00 C ATOM 799 CG1 VAL A 416 3.375 -12.671 5.811 1.00 0.00 C ATOM 800 CG2 VAL A 416 5.176 -11.001 5.351 1.00 0.00 C ATOM 0 H VAL A 416 2.513 -8.892 6.254 1.00 0.00 H new ATOM 0 HA VAL A 416 3.192 -10.424 3.827 1.00 0.00 H new ATOM 0 HB VAL A 416 3.607 -10.801 6.784 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.060 -13.194 6.479 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.354 -12.790 6.172 1.00 0.00 H new ATOM 0 HG13 VAL A 416 3.456 -13.089 4.808 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.829 -11.561 6.020 1.00 0.00 H new ATOM 0 HG22 VAL A 416 5.307 -11.361 4.330 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.431 -9.942 5.398 1.00 0.00 H new ATOM 810 N GLY A 417 1.179 -11.946 3.865 1.00 0.00 N ATOM 811 CA GLY A 417 -0.096 -12.627 3.781 1.00 0.00 C ATOM 812 C GLY A 417 0.025 -14.016 3.188 1.00 0.00 C ATOM 813 O GLY A 417 1.006 -14.326 2.508 1.00 0.00 O ATOM 0 H GLY A 417 1.852 -12.201 3.143 1.00 0.00 H new ATOM 0 HA2 GLY A 417 -0.533 -12.698 4.777 1.00 0.00 H new ATOM 0 HA3 GLY A 417 -0.781 -12.035 3.174 1.00 0.00 H new ATOM 817 N ARG A 418 -0.978 -14.852 3.438 1.00 0.00 N ATOM 818 CA ARG A 418 -0.984 -16.210 2.913 1.00 0.00 C ATOM 819 C ARG A 418 -0.605 -16.191 1.440 1.00 0.00 C ATOM 820 O ARG A 418 0.173 -17.018 0.967 1.00 0.00 O ATOM 821 CB ARG A 418 -2.364 -16.838 3.087 1.00 0.00 C ATOM 822 CG ARG A 418 -3.491 -15.960 2.577 1.00 0.00 C ATOM 823 CD ARG A 418 -4.747 -16.116 3.421 1.00 0.00 C ATOM 824 NE ARG A 418 -5.411 -17.395 3.185 1.00 0.00 N ATOM 825 CZ ARG A 418 -6.707 -17.602 3.399 1.00 0.00 C ATOM 826 NH1 ARG A 418 -7.471 -16.619 3.853 1.00 0.00 N ATOM 827 NH2 ARG A 418 -7.237 -18.793 3.160 1.00 0.00 N ATOM 0 H ARG A 418 -1.795 -14.612 4.000 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.257 -16.806 3.465 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -2.390 -17.793 2.561 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -2.528 -17.051 4.143 1.00 0.00 H new ATOM 0 HG2 ARG A 418 -3.173 -14.917 2.585 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -3.713 -16.217 1.541 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -4.487 -16.032 4.476 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -5.437 -15.303 3.197 1.00 0.00 H new ATOM 0 HE ARG A 418 -4.850 -18.172 2.837 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -7.065 -15.702 4.039 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -8.465 -16.780 4.017 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -6.651 -19.552 2.812 1.00 0.00 H new ATOM 0 HH22 ARG A 418 -8.231 -18.951 3.324 1.00 0.00 H new ATOM 841 N ASN A 419 -1.162 -15.219 0.731 1.00 0.00 N ATOM 842 CA ASN A 419 -0.898 -15.040 -0.688 1.00 0.00 C ATOM 843 C ASN A 419 -0.502 -13.596 -0.951 1.00 0.00 C ATOM 844 O ASN A 419 -0.730 -12.723 -0.115 1.00 0.00 O ATOM 845 CB ASN A 419 -2.134 -15.405 -1.512 1.00 0.00 C ATOM 846 CG ASN A 419 -1.995 -16.750 -2.199 1.00 0.00 C ATOM 847 OD1 ASN A 419 -1.912 -17.788 -1.544 1.00 0.00 O ATOM 848 ND2 ASN A 419 -1.971 -16.737 -3.527 1.00 0.00 N ATOM 0 H ASN A 419 -1.808 -14.534 1.123 1.00 0.00 H new ATOM 0 HA ASN A 419 -0.081 -15.699 -0.984 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -3.009 -15.421 -0.862 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -2.308 -14.633 -2.262 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -1.881 -17.612 -4.044 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -2.043 -15.852 -4.030 1.00 0.00 H new ATOM 855 N ILE A 420 0.091 -13.341 -2.108 1.00 0.00 N ATOM 856 CA ILE A 420 0.507 -11.991 -2.444 1.00 0.00 C ATOM 857 C ILE A 420 -0.589 -10.997 -2.090 1.00 0.00 C ATOM 858 O ILE A 420 -0.340 -9.995 -1.426 1.00 0.00 O ATOM 859 CB ILE A 420 0.864 -11.865 -3.936 1.00 0.00 C ATOM 860 CG1 ILE A 420 2.182 -12.588 -4.212 1.00 0.00 C ATOM 861 CG2 ILE A 420 0.958 -10.403 -4.346 1.00 0.00 C ATOM 862 CD1 ILE A 420 2.004 -13.952 -4.843 1.00 0.00 C ATOM 0 H ILE A 420 0.292 -14.042 -2.821 1.00 0.00 H new ATOM 0 HA ILE A 420 1.401 -11.767 -1.861 1.00 0.00 H new ATOM 0 HB ILE A 420 0.075 -12.328 -4.528 1.00 0.00 H new ATOM 0 HG12 ILE A 420 2.795 -11.970 -4.868 1.00 0.00 H new ATOM 0 HG13 ILE A 420 2.729 -12.699 -3.276 1.00 0.00 H new ATOM 0 HG21 ILE A 420 1.211 -10.337 -5.404 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -0.000 -9.914 -4.171 1.00 0.00 H new ATOM 0 HG23 ILE A 420 1.730 -9.909 -3.757 1.00 0.00 H new ATOM 0 HD11 ILE A 420 2.981 -14.406 -5.010 1.00 0.00 H new ATOM 0 HD12 ILE A 420 1.418 -14.587 -4.178 1.00 0.00 H new ATOM 0 HD13 ILE A 420 1.485 -13.847 -5.796 1.00 0.00 H new ATOM 874 N LYS A 421 -1.803 -11.283 -2.537 1.00 0.00 N ATOM 875 CA LYS A 421 -2.931 -10.409 -2.259 1.00 0.00 C ATOM 876 C LYS A 421 -2.999 -10.084 -0.776 1.00 0.00 C ATOM 877 O LYS A 421 -2.937 -8.922 -0.386 1.00 0.00 O ATOM 878 CB LYS A 421 -4.231 -11.061 -2.719 1.00 0.00 C ATOM 879 CG LYS A 421 -5.474 -10.297 -2.310 1.00 0.00 C ATOM 880 CD LYS A 421 -5.253 -8.799 -2.387 1.00 0.00 C ATOM 881 CE LYS A 421 -4.997 -8.355 -3.814 1.00 0.00 C ATOM 882 NZ LYS A 421 -6.206 -7.748 -4.436 1.00 0.00 N ATOM 0 H LYS A 421 -2.031 -12.109 -3.091 1.00 0.00 H new ATOM 0 HA LYS A 421 -2.793 -9.479 -2.810 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.215 -11.156 -3.805 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.285 -12.070 -2.311 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.305 -10.577 -2.957 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.755 -10.573 -1.294 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.126 -8.279 -1.993 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -4.406 -8.521 -1.759 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -4.181 -7.632 -3.828 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -4.675 -9.211 -4.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -5.987 -7.459 -5.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -6.978 -8.445 -4.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -6.499 -6.916 -3.885 1.00 0.00 H new ATOM 896 N ILE A 422 -3.107 -11.109 0.051 1.00 0.00 N ATOM 897 CA ILE A 422 -3.164 -10.898 1.489 1.00 0.00 C ATOM 898 C ILE A 422 -1.980 -10.063 1.923 1.00 0.00 C ATOM 899 O ILE A 422 -2.112 -9.123 2.706 1.00 0.00 O ATOM 900 CB ILE A 422 -3.175 -12.228 2.253 1.00 0.00 C ATOM 901 CG1 ILE A 422 -4.355 -13.085 1.793 1.00 0.00 C ATOM 902 CG2 ILE A 422 -3.245 -11.981 3.753 1.00 0.00 C ATOM 903 CD1 ILE A 422 -5.536 -12.284 1.272 1.00 0.00 C ATOM 0 H ILE A 422 -3.157 -12.085 -0.242 1.00 0.00 H new ATOM 0 HA ILE A 422 -4.091 -10.374 1.721 1.00 0.00 H new ATOM 0 HB ILE A 422 -2.250 -12.763 2.040 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -4.015 -13.762 1.010 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -4.688 -13.703 2.627 1.00 0.00 H new ATOM 0 HG21 ILE A 422 -3.252 -12.936 4.279 1.00 0.00 H new ATOM 0 HG22 ILE A 422 -2.378 -11.400 4.067 1.00 0.00 H new ATOM 0 HG23 ILE A 422 -4.155 -11.430 3.989 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -6.331 -12.965 0.966 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -5.905 -11.626 2.059 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -5.221 -11.686 0.417 1.00 0.00 H new ATOM 915 N ALA A 423 -0.828 -10.391 1.364 1.00 0.00 N ATOM 916 CA ALA A 423 0.369 -9.636 1.653 1.00 0.00 C ATOM 917 C ALA A 423 0.092 -8.186 1.281 1.00 0.00 C ATOM 918 O ALA A 423 0.121 -7.292 2.128 1.00 0.00 O ATOM 919 CB ALA A 423 1.569 -10.179 0.892 1.00 0.00 C ATOM 0 H ALA A 423 -0.701 -11.167 0.715 1.00 0.00 H new ATOM 0 HA ALA A 423 0.617 -9.718 2.711 1.00 0.00 H new ATOM 0 HB1 ALA A 423 2.452 -9.587 1.134 1.00 0.00 H new ATOM 0 HB2 ALA A 423 1.740 -11.218 1.175 1.00 0.00 H new ATOM 0 HB3 ALA A 423 1.376 -10.122 -0.179 1.00 0.00 H new ATOM 925 N GLY A 424 -0.208 -7.977 0.002 1.00 0.00 N ATOM 926 CA GLY A 424 -0.528 -6.653 -0.489 1.00 0.00 C ATOM 927 C GLY A 424 -1.584 -5.985 0.368 1.00 0.00 C ATOM 928 O GLY A 424 -1.385 -4.872 0.854 1.00 0.00 O ATOM 0 H GLY A 424 -0.234 -8.710 -0.707 1.00 0.00 H new ATOM 0 HA2 GLY A 424 0.373 -6.040 -0.501 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -0.882 -6.721 -1.518 1.00 0.00 H new ATOM 932 N ILE A 425 -2.704 -6.677 0.570 1.00 0.00 N ATOM 933 CA ILE A 425 -3.769 -6.136 1.399 1.00 0.00 C ATOM 934 C ILE A 425 -3.158 -5.605 2.684 1.00 0.00 C ATOM 935 O ILE A 425 -3.170 -4.404 2.954 1.00 0.00 O ATOM 936 CB ILE A 425 -4.818 -7.210 1.761 1.00 0.00 C ATOM 937 CG1 ILE A 425 -5.547 -7.693 0.509 1.00 0.00 C ATOM 938 CG2 ILE A 425 -5.806 -6.665 2.782 1.00 0.00 C ATOM 939 CD1 ILE A 425 -5.902 -9.160 0.549 1.00 0.00 C ATOM 0 H ILE A 425 -2.892 -7.599 0.176 1.00 0.00 H new ATOM 0 HA ILE A 425 -4.270 -5.347 0.838 1.00 0.00 H new ATOM 0 HB ILE A 425 -4.301 -8.062 2.204 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -6.459 -7.110 0.381 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -4.921 -7.502 -0.363 1.00 0.00 H new ATOM 0 HG21 ILE A 425 -6.538 -7.434 3.026 1.00 0.00 H new ATOM 0 HG22 ILE A 425 -5.271 -6.373 3.686 1.00 0.00 H new ATOM 0 HG23 ILE A 425 -6.317 -5.797 2.366 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -6.417 -9.435 -0.371 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -4.992 -9.752 0.646 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -6.553 -9.354 1.401 1.00 0.00 H new ATOM 951 N ARG A 426 -2.616 -6.528 3.466 1.00 0.00 N ATOM 952 CA ARG A 426 -1.978 -6.196 4.730 1.00 0.00 C ATOM 953 C ARG A 426 -1.069 -4.985 4.580 1.00 0.00 C ATOM 954 O ARG A 426 -1.249 -3.983 5.265 1.00 0.00 O ATOM 955 CB ARG A 426 -1.180 -7.391 5.245 1.00 0.00 C ATOM 956 CG ARG A 426 -1.572 -7.823 6.648 1.00 0.00 C ATOM 957 CD ARG A 426 -0.395 -7.736 7.606 1.00 0.00 C ATOM 958 NE ARG A 426 -0.358 -6.456 8.307 1.00 0.00 N ATOM 959 CZ ARG A 426 0.681 -6.041 9.025 1.00 0.00 C ATOM 960 NH1 ARG A 426 1.759 -6.804 9.138 1.00 0.00 N ATOM 961 NH2 ARG A 426 0.641 -4.862 9.632 1.00 0.00 N ATOM 0 H ARG A 426 -2.606 -7.523 3.243 1.00 0.00 H new ATOM 0 HA ARG A 426 -2.757 -5.950 5.451 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -1.317 -8.230 4.563 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -0.119 -7.141 5.233 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -2.385 -7.193 7.010 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -1.948 -8.846 6.623 1.00 0.00 H new ATOM 0 HD2 ARG A 426 -0.457 -8.546 8.332 1.00 0.00 H new ATOM 0 HD3 ARG A 426 0.534 -7.874 7.053 1.00 0.00 H new ATOM 0 HE ARG A 426 -1.174 -5.847 8.242 1.00 0.00 H new ATOM 0 HH11 ARG A 426 1.792 -7.711 8.674 1.00 0.00 H new ATOM 0 HH12 ARG A 426 2.555 -6.484 9.689 1.00 0.00 H new ATOM 0 HH21 ARG A 426 -0.188 -4.273 9.548 1.00 0.00 H new ATOM 0 HH22 ARG A 426 1.439 -4.545 10.183 1.00 0.00 H new ATOM 975 N ALA A 427 -0.095 -5.079 3.683 1.00 0.00 N ATOM 976 CA ALA A 427 0.833 -3.976 3.457 1.00 0.00 C ATOM 977 C ALA A 427 0.071 -2.672 3.254 1.00 0.00 C ATOM 978 O ALA A 427 0.184 -1.744 4.056 1.00 0.00 O ATOM 979 CB ALA A 427 1.728 -4.254 2.258 1.00 0.00 C ATOM 0 H ALA A 427 0.073 -5.901 3.103 1.00 0.00 H new ATOM 0 HA ALA A 427 1.465 -3.880 4.340 1.00 0.00 H new ATOM 0 HB1 ALA A 427 2.410 -3.417 2.111 1.00 0.00 H new ATOM 0 HB2 ALA A 427 2.302 -5.163 2.436 1.00 0.00 H new ATOM 0 HB3 ALA A 427 1.113 -4.382 1.367 1.00 0.00 H new ATOM 985 N ALA A 428 -0.703 -2.608 2.177 1.00 0.00 N ATOM 986 CA ALA A 428 -1.481 -1.417 1.873 1.00 0.00 C ATOM 987 C ALA A 428 -2.112 -0.909 3.149 1.00 0.00 C ATOM 988 O ALA A 428 -2.040 0.275 3.478 1.00 0.00 O ATOM 989 CB ALA A 428 -2.552 -1.715 0.846 1.00 0.00 C ATOM 0 H ALA A 428 -0.807 -3.366 1.502 1.00 0.00 H new ATOM 0 HA ALA A 428 -0.821 -0.657 1.454 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -3.119 -0.807 0.637 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -2.086 -2.071 -0.073 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -3.224 -2.481 1.233 1.00 0.00 H new ATOM 995 N GLU A 429 -2.703 -1.837 3.878 1.00 0.00 N ATOM 996 CA GLU A 429 -3.327 -1.537 5.147 1.00 0.00 C ATOM 997 C GLU A 429 -2.316 -0.857 6.056 1.00 0.00 C ATOM 998 O GLU A 429 -2.531 0.250 6.535 1.00 0.00 O ATOM 999 CB GLU A 429 -3.807 -2.834 5.782 1.00 0.00 C ATOM 1000 CG GLU A 429 -5.181 -2.731 6.417 1.00 0.00 C ATOM 1001 CD GLU A 429 -5.391 -3.763 7.507 1.00 0.00 C ATOM 1002 OE1 GLU A 429 -5.261 -4.969 7.215 1.00 0.00 O ATOM 1003 OE2 GLU A 429 -5.684 -3.364 8.654 1.00 0.00 O ATOM 0 H GLU A 429 -2.762 -2.818 3.605 1.00 0.00 H new ATOM 0 HA GLU A 429 -4.177 -0.871 4.998 1.00 0.00 H new ATOM 0 HB2 GLU A 429 -3.826 -3.615 5.022 1.00 0.00 H new ATOM 0 HB3 GLU A 429 -3.088 -3.144 6.541 1.00 0.00 H new ATOM 0 HG2 GLU A 429 -5.311 -1.733 6.835 1.00 0.00 H new ATOM 0 HG3 GLU A 429 -5.944 -2.857 5.649 1.00 0.00 H new ATOM 1010 N ASN A 430 -1.215 -1.554 6.280 1.00 0.00 N ATOM 1011 CA ASN A 430 -0.148 -1.059 7.142 1.00 0.00 C ATOM 1012 C ASN A 430 0.101 0.407 6.835 1.00 0.00 C ATOM 1013 O ASN A 430 0.034 1.261 7.720 1.00 0.00 O ATOM 1014 CB ASN A 430 1.133 -1.867 6.922 1.00 0.00 C ATOM 1015 CG ASN A 430 2.333 -1.246 7.609 1.00 0.00 C ATOM 1016 OD1 ASN A 430 2.922 -0.288 7.109 1.00 0.00 O ATOM 1017 ND2 ASN A 430 2.702 -1.792 8.762 1.00 0.00 N ATOM 0 H ASN A 430 -1.033 -2.472 5.874 1.00 0.00 H new ATOM 0 HA ASN A 430 -0.448 -1.168 8.184 1.00 0.00 H new ATOM 0 HB2 ASN A 430 0.988 -2.881 7.295 1.00 0.00 H new ATOM 0 HB3 ASN A 430 1.330 -1.946 5.853 1.00 0.00 H new ATOM 0 HD21 ASN A 430 3.503 -1.418 9.270 1.00 0.00 H new ATOM 0 HD22 ASN A 430 2.184 -2.586 9.139 1.00 0.00 H new ATOM 1024 N ALA A 431 0.358 0.690 5.571 1.00 0.00 N ATOM 1025 CA ALA A 431 0.585 2.052 5.123 1.00 0.00 C ATOM 1026 C ALA A 431 -0.671 2.883 5.329 1.00 0.00 C ATOM 1027 O ALA A 431 -0.619 4.103 5.481 1.00 0.00 O ATOM 1028 CB ALA A 431 0.969 2.059 3.659 1.00 0.00 C ATOM 0 H ALA A 431 0.415 -0.011 4.832 1.00 0.00 H new ATOM 0 HA ALA A 431 1.398 2.484 5.707 1.00 0.00 H new ATOM 0 HB1 ALA A 431 1.137 3.085 3.332 1.00 0.00 H new ATOM 0 HB2 ALA A 431 1.881 1.479 3.519 1.00 0.00 H new ATOM 0 HB3 ALA A 431 0.165 1.618 3.070 1.00 0.00 H new ATOM 1034 N LEU A 432 -1.799 2.192 5.310 1.00 0.00 N ATOM 1035 CA LEU A 432 -3.106 2.808 5.472 1.00 0.00 C ATOM 1036 C LEU A 432 -3.420 3.079 6.945 1.00 0.00 C ATOM 1037 O LEU A 432 -4.151 4.015 7.269 1.00 0.00 O ATOM 1038 CB LEU A 432 -4.139 1.875 4.824 1.00 0.00 C ATOM 1039 CG LEU A 432 -5.517 1.749 5.486 1.00 0.00 C ATOM 1040 CD1 LEU A 432 -6.371 0.799 4.668 1.00 0.00 C ATOM 1041 CD2 LEU A 432 -5.421 1.243 6.917 1.00 0.00 C ATOM 0 H LEU A 432 -1.834 1.181 5.181 1.00 0.00 H new ATOM 0 HA LEU A 432 -3.130 3.782 4.983 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -4.292 2.209 3.798 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -3.702 0.878 4.773 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.968 2.741 5.520 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -7.353 0.703 5.131 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -6.483 1.190 3.657 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -5.891 -0.179 4.628 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -6.421 1.170 7.345 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -4.950 0.260 6.924 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -4.823 1.936 7.509 1.00 0.00 H new ATOM 1053 N ARG A 433 -2.871 2.250 7.833 1.00 0.00 N ATOM 1054 CA ARG A 433 -3.102 2.399 9.267 1.00 0.00 C ATOM 1055 C ARG A 433 -2.589 3.741 9.769 1.00 0.00 C ATOM 1056 O ARG A 433 -3.285 4.457 10.489 1.00 0.00 O ATOM 1057 CB ARG A 433 -2.411 1.277 10.051 1.00 0.00 C ATOM 1058 CG ARG A 433 -2.422 -0.073 9.356 1.00 0.00 C ATOM 1059 CD ARG A 433 -3.837 -0.538 9.057 1.00 0.00 C ATOM 1060 NE ARG A 433 -4.406 -1.301 10.164 1.00 0.00 N ATOM 1061 CZ ARG A 433 -5.713 -1.444 10.365 1.00 0.00 C ATOM 1062 NH1 ARG A 433 -6.579 -0.883 9.532 1.00 0.00 N ATOM 1063 NH2 ARG A 433 -6.153 -2.150 11.397 1.00 0.00 N ATOM 0 H ARG A 433 -2.264 1.469 7.583 1.00 0.00 H new ATOM 0 HA ARG A 433 -4.179 2.344 9.427 1.00 0.00 H new ATOM 0 HB2 ARG A 433 -1.377 1.566 10.240 1.00 0.00 H new ATOM 0 HB3 ARG A 433 -2.897 1.176 11.022 1.00 0.00 H new ATOM 0 HG2 ARG A 433 -1.856 -0.009 8.427 1.00 0.00 H new ATOM 0 HG3 ARG A 433 -1.922 -0.810 9.984 1.00 0.00 H new ATOM 0 HD2 ARG A 433 -4.467 0.327 8.851 1.00 0.00 H new ATOM 0 HD3 ARG A 433 -3.834 -1.152 8.157 1.00 0.00 H new ATOM 0 HE ARG A 433 -3.766 -1.749 10.820 1.00 0.00 H new ATOM 0 HH11 ARG A 433 -6.243 -0.341 8.736 1.00 0.00 H new ATOM 0 HH12 ARG A 433 -7.581 -0.994 9.687 1.00 0.00 H new ATOM 0 HH21 ARG A 433 -5.489 -2.584 12.038 1.00 0.00 H new ATOM 0 HH22 ARG A 433 -7.156 -2.259 11.550 1.00 0.00 H new ATOM 1077 N ASP A 434 -1.360 4.065 9.396 1.00 0.00 N ATOM 1078 CA ASP A 434 -0.737 5.309 9.816 1.00 0.00 C ATOM 1079 C ASP A 434 -1.346 6.506 9.098 1.00 0.00 C ATOM 1080 O ASP A 434 -1.079 6.736 7.918 1.00 0.00 O ATOM 1081 CB ASP A 434 0.767 5.255 9.551 1.00 0.00 C ATOM 1082 CG ASP A 434 1.498 4.376 10.547 1.00 0.00 C ATOM 1083 OD1 ASP A 434 0.978 3.288 10.871 1.00 0.00 O ATOM 1084 OD2 ASP A 434 2.590 4.775 11.003 1.00 0.00 O ATOM 0 H ASP A 434 -0.773 3.480 8.801 1.00 0.00 H new ATOM 0 HA ASP A 434 -0.915 5.430 10.885 1.00 0.00 H new ATOM 0 HB2 ASP A 434 0.942 4.880 8.543 1.00 0.00 H new ATOM 0 HB3 ASP A 434 1.177 6.264 9.592 1.00 0.00 H new ATOM 1089 N LYS A 435 -2.150 7.279 9.820 1.00 0.00 N ATOM 1090 CA LYS A 435 -2.772 8.464 9.247 1.00 0.00 C ATOM 1091 C LYS A 435 -1.691 9.437 8.798 1.00 0.00 C ATOM 1092 O LYS A 435 -1.787 10.053 7.745 1.00 0.00 O ATOM 1093 CB LYS A 435 -3.697 9.133 10.268 1.00 0.00 C ATOM 1094 CG LYS A 435 -3.118 9.187 11.674 1.00 0.00 C ATOM 1095 CD LYS A 435 -4.033 8.508 12.681 1.00 0.00 C ATOM 1096 CE LYS A 435 -4.512 7.156 12.177 1.00 0.00 C ATOM 1097 NZ LYS A 435 -4.044 6.041 13.045 1.00 0.00 N ATOM 0 H LYS A 435 -2.385 7.107 10.798 1.00 0.00 H new ATOM 0 HA LYS A 435 -3.372 8.169 8.386 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -3.917 10.148 9.936 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -4.644 8.594 10.295 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -2.141 8.704 11.685 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -2.963 10.226 11.965 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -3.504 8.379 13.625 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -4.892 9.148 12.882 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -5.601 7.150 12.134 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -4.152 7.000 11.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -3.828 5.211 12.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -3.188 6.335 13.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -4.789 5.797 13.729 1.00 0.00 H new ATOM 1111 N LYS A 436 -0.664 9.559 9.622 1.00 0.00 N ATOM 1112 CA LYS A 436 0.443 10.455 9.331 1.00 0.00 C ATOM 1113 C LYS A 436 0.789 10.402 7.847 1.00 0.00 C ATOM 1114 O LYS A 436 0.908 11.437 7.188 1.00 0.00 O ATOM 1115 CB LYS A 436 1.661 10.073 10.171 1.00 0.00 C ATOM 1116 CG LYS A 436 1.658 10.683 11.562 1.00 0.00 C ATOM 1117 CD LYS A 436 3.046 11.147 11.974 1.00 0.00 C ATOM 1118 CE LYS A 436 4.056 10.013 11.912 1.00 0.00 C ATOM 1119 NZ LYS A 436 4.533 9.767 10.522 1.00 0.00 N ATOM 0 H LYS A 436 -0.574 9.048 10.500 1.00 0.00 H new ATOM 0 HA LYS A 436 0.147 11.473 9.583 1.00 0.00 H new ATOM 0 HB2 LYS A 436 1.704 8.987 10.260 1.00 0.00 H new ATOM 0 HB3 LYS A 436 2.565 10.386 9.648 1.00 0.00 H new ATOM 0 HG2 LYS A 436 0.969 11.527 11.588 1.00 0.00 H new ATOM 0 HG3 LYS A 436 1.291 9.950 12.280 1.00 0.00 H new ATOM 0 HD2 LYS A 436 3.368 11.958 11.321 1.00 0.00 H new ATOM 0 HD3 LYS A 436 3.010 11.548 12.987 1.00 0.00 H new ATOM 0 HE2 LYS A 436 4.907 10.250 12.551 1.00 0.00 H new ATOM 0 HE3 LYS A 436 3.604 9.103 12.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 5.557 9.585 10.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 4.039 8.942 10.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 4.337 10.603 9.935 1.00 0.00 H new ATOM 1133 N MET A 437 0.940 9.193 7.322 1.00 0.00 N ATOM 1134 CA MET A 437 1.260 9.015 5.906 1.00 0.00 C ATOM 1135 C MET A 437 0.084 9.457 5.042 1.00 0.00 C ATOM 1136 O MET A 437 0.266 10.107 4.012 1.00 0.00 O ATOM 1137 CB MET A 437 1.628 7.558 5.586 1.00 0.00 C ATOM 1138 CG MET A 437 1.831 6.683 6.812 1.00 0.00 C ATOM 1139 SD MET A 437 2.849 5.235 6.471 1.00 0.00 S ATOM 1140 CE MET A 437 4.378 6.011 5.955 1.00 0.00 C ATOM 0 H MET A 437 0.847 8.324 7.849 1.00 0.00 H new ATOM 0 HA MET A 437 2.128 9.636 5.683 1.00 0.00 H new ATOM 0 HB2 MET A 437 0.841 7.123 4.970 1.00 0.00 H new ATOM 0 HB3 MET A 437 2.541 7.548 4.991 1.00 0.00 H new ATOM 0 HG2 MET A 437 2.298 7.273 7.601 1.00 0.00 H new ATOM 0 HG3 MET A 437 0.860 6.360 7.187 1.00 0.00 H new ATOM 0 HE1 MET A 437 5.217 5.359 6.199 1.00 0.00 H new ATOM 0 HE2 MET A 437 4.353 6.184 4.879 1.00 0.00 H new ATOM 0 HE3 MET A 437 4.496 6.963 6.473 1.00 0.00 H new ATOM 1150 N LEU A 438 -1.125 9.111 5.475 1.00 0.00 N ATOM 1151 CA LEU A 438 -2.334 9.484 4.750 1.00 0.00 C ATOM 1152 C LEU A 438 -2.430 11.003 4.669 1.00 0.00 C ATOM 1153 O LEU A 438 -2.392 11.595 3.591 1.00 0.00 O ATOM 1154 CB LEU A 438 -3.567 8.943 5.485 1.00 0.00 C ATOM 1155 CG LEU A 438 -3.879 7.447 5.324 1.00 0.00 C ATOM 1156 CD1 LEU A 438 -2.748 6.684 4.648 1.00 0.00 C ATOM 1157 CD2 LEU A 438 -4.195 6.828 6.677 1.00 0.00 C ATOM 0 H LEU A 438 -1.293 8.573 6.325 1.00 0.00 H new ATOM 0 HA LEU A 438 -2.293 9.062 3.746 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -3.445 9.150 6.548 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -4.436 9.508 5.148 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.751 7.370 4.674 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -3.021 5.632 4.559 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -2.572 7.098 3.655 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -1.840 6.774 5.245 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -4.414 5.768 6.550 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -3.337 6.944 7.339 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -5.060 7.328 7.113 1.00 0.00 H new ATOM 1169 N ASP A 439 -2.544 11.611 5.842 1.00 0.00 N ATOM 1170 CA ASP A 439 -2.642 13.055 5.984 1.00 0.00 C ATOM 1171 C ASP A 439 -1.460 13.746 5.323 1.00 0.00 C ATOM 1172 O ASP A 439 -1.543 14.907 4.936 1.00 0.00 O ATOM 1173 CB ASP A 439 -2.689 13.421 7.471 1.00 0.00 C ATOM 1174 CG ASP A 439 -3.799 14.403 7.793 1.00 0.00 C ATOM 1175 OD1 ASP A 439 -3.848 15.475 7.153 1.00 0.00 O ATOM 1176 OD2 ASP A 439 -4.619 14.102 8.685 1.00 0.00 O ATOM 0 H ASP A 439 -2.571 11.109 6.730 1.00 0.00 H new ATOM 0 HA ASP A 439 -3.555 13.391 5.493 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.828 12.515 8.061 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -1.732 13.850 7.767 1.00 0.00 H new ATOM 1181 N PHE A 440 -0.363 13.019 5.185 1.00 0.00 N ATOM 1182 CA PHE A 440 0.823 13.571 4.557 1.00 0.00 C ATOM 1183 C PHE A 440 0.595 13.692 3.060 1.00 0.00 C ATOM 1184 O PHE A 440 0.595 14.791 2.507 1.00 0.00 O ATOM 1185 CB PHE A 440 2.044 12.693 4.841 1.00 0.00 C ATOM 1186 CG PHE A 440 3.324 13.248 4.288 1.00 0.00 C ATOM 1187 CD1 PHE A 440 3.732 12.932 3.002 1.00 0.00 C ATOM 1188 CD2 PHE A 440 4.118 14.087 5.053 1.00 0.00 C ATOM 1189 CE1 PHE A 440 4.907 13.445 2.488 1.00 0.00 C ATOM 1190 CE2 PHE A 440 5.296 14.602 4.544 1.00 0.00 C ATOM 1191 CZ PHE A 440 5.691 14.281 3.260 1.00 0.00 C ATOM 0 H PHE A 440 -0.270 12.052 5.497 1.00 0.00 H new ATOM 0 HA PHE A 440 1.015 14.560 4.972 1.00 0.00 H new ATOM 0 HB2 PHE A 440 2.148 12.567 5.919 1.00 0.00 H new ATOM 0 HB3 PHE A 440 1.875 11.702 4.419 1.00 0.00 H new ATOM 0 HD1 PHE A 440 3.125 12.277 2.395 1.00 0.00 H new ATOM 0 HD2 PHE A 440 3.814 14.341 6.057 1.00 0.00 H new ATOM 0 HE1 PHE A 440 5.213 13.193 1.483 1.00 0.00 H new ATOM 0 HE2 PHE A 440 5.907 15.255 5.150 1.00 0.00 H new ATOM 0 HZ PHE A 440 6.610 14.682 2.860 1.00 0.00 H new ATOM 1201 N TYR A 441 0.385 12.553 2.414 1.00 0.00 N ATOM 1202 CA TYR A 441 0.138 12.529 0.986 1.00 0.00 C ATOM 1203 C TYR A 441 -1.029 13.437 0.642 1.00 0.00 C ATOM 1204 O TYR A 441 -0.926 14.291 -0.240 1.00 0.00 O ATOM 1205 CB TYR A 441 -0.145 11.105 0.525 1.00 0.00 C ATOM 1206 CG TYR A 441 1.090 10.238 0.478 1.00 0.00 C ATOM 1207 CD1 TYR A 441 2.278 10.712 -0.064 1.00 0.00 C ATOM 1208 CD2 TYR A 441 1.063 8.945 0.973 1.00 0.00 C ATOM 1209 CE1 TYR A 441 3.408 9.916 -0.110 1.00 0.00 C ATOM 1210 CE2 TYR A 441 2.186 8.142 0.931 1.00 0.00 C ATOM 1211 CZ TYR A 441 3.356 8.631 0.390 1.00 0.00 C ATOM 1212 OH TYR A 441 4.477 7.835 0.345 1.00 0.00 O ATOM 0 H TYR A 441 0.382 11.636 2.860 1.00 0.00 H new ATOM 0 HA TYR A 441 1.027 12.892 0.469 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -0.874 10.651 1.196 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -0.598 11.134 -0.466 1.00 0.00 H new ATOM 0 HD1 TYR A 441 2.320 11.718 -0.456 1.00 0.00 H new ATOM 0 HD2 TYR A 441 0.149 8.558 1.399 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.325 10.298 -0.534 1.00 0.00 H new ATOM 0 HE2 TYR A 441 2.148 7.135 1.320 1.00 0.00 H new ATOM 0 HH TYR A 441 4.273 6.961 0.738 1.00 0.00 H new ATOM 1222 N ALA A 442 -2.136 13.266 1.358 1.00 0.00 N ATOM 1223 CA ALA A 442 -3.305 14.095 1.132 1.00 0.00 C ATOM 1224 C ALA A 442 -2.899 15.557 1.243 1.00 0.00 C ATOM 1225 O ALA A 442 -2.981 16.315 0.275 1.00 0.00 O ATOM 1226 CB ALA A 442 -4.410 13.772 2.126 1.00 0.00 C ATOM 0 H ALA A 442 -2.244 12.566 2.092 1.00 0.00 H new ATOM 0 HA ALA A 442 -3.696 13.895 0.135 1.00 0.00 H new ATOM 0 HB1 ALA A 442 -5.272 14.409 1.931 1.00 0.00 H new ATOM 0 HB2 ALA A 442 -4.700 12.727 2.020 1.00 0.00 H new ATOM 0 HB3 ALA A 442 -4.050 13.948 3.140 1.00 0.00 H new ATOM 1232 N LYS A 443 -2.448 15.938 2.435 1.00 0.00 N ATOM 1233 CA LYS A 443 -2.012 17.301 2.679 1.00 0.00 C ATOM 1234 C LYS A 443 -1.147 17.760 1.523 1.00 0.00 C ATOM 1235 O LYS A 443 -1.275 18.885 1.040 1.00 0.00 O ATOM 1236 CB LYS A 443 -1.212 17.378 3.977 1.00 0.00 C ATOM 1237 CG LYS A 443 -2.065 17.365 5.231 1.00 0.00 C ATOM 1238 CD LYS A 443 -2.445 18.772 5.664 1.00 0.00 C ATOM 1239 CE LYS A 443 -3.504 19.371 4.750 1.00 0.00 C ATOM 1240 NZ LYS A 443 -4.592 20.032 5.520 1.00 0.00 N ATOM 0 H LYS A 443 -2.377 15.320 3.243 1.00 0.00 H new ATOM 0 HA LYS A 443 -2.887 17.945 2.768 1.00 0.00 H new ATOM 0 HB2 LYS A 443 -0.518 16.538 4.014 1.00 0.00 H new ATOM 0 HB3 LYS A 443 -0.612 18.288 3.968 1.00 0.00 H new ATOM 0 HG2 LYS A 443 -2.969 16.783 5.051 1.00 0.00 H new ATOM 0 HG3 LYS A 443 -1.522 16.870 6.036 1.00 0.00 H new ATOM 0 HD2 LYS A 443 -2.817 18.750 6.688 1.00 0.00 H new ATOM 0 HD3 LYS A 443 -1.559 19.407 5.660 1.00 0.00 H new ATOM 0 HE2 LYS A 443 -3.039 20.097 4.083 1.00 0.00 H new ATOM 0 HE3 LYS A 443 -3.928 18.587 4.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 -5.293 20.427 4.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 -5.053 19.334 6.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 -4.192 20.797 6.099 1.00 0.00 H new ATOM 1254 N GLN A 444 -0.280 16.867 1.066 1.00 0.00 N ATOM 1255 CA GLN A 444 0.590 17.166 -0.059 1.00 0.00 C ATOM 1256 C GLN A 444 -0.260 17.555 -1.263 1.00 0.00 C ATOM 1257 O GLN A 444 -0.110 18.637 -1.828 1.00 0.00 O ATOM 1258 CB GLN A 444 1.462 15.953 -0.391 1.00 0.00 C ATOM 1259 CG GLN A 444 2.826 16.319 -0.954 1.00 0.00 C ATOM 1260 CD GLN A 444 3.739 15.118 -1.103 1.00 0.00 C ATOM 1261 OE1 GLN A 444 4.512 14.795 -0.201 1.00 0.00 O ATOM 1262 NE2 GLN A 444 3.653 14.450 -2.248 1.00 0.00 N ATOM 0 H GLN A 444 -0.162 15.932 1.457 1.00 0.00 H new ATOM 0 HA GLN A 444 1.246 17.997 0.201 1.00 0.00 H new ATOM 0 HB2 GLN A 444 1.599 15.357 0.511 1.00 0.00 H new ATOM 0 HB3 GLN A 444 0.937 15.325 -1.111 1.00 0.00 H new ATOM 0 HG2 GLN A 444 2.697 16.795 -1.926 1.00 0.00 H new ATOM 0 HG3 GLN A 444 3.300 17.051 -0.300 1.00 0.00 H new ATOM 0 HE21 GLN A 444 2.998 14.754 -2.968 1.00 0.00 H new ATOM 0 HE22 GLN A 444 4.242 13.633 -2.407 1.00 0.00 H new ATOM 1271 N ARG A 445 -1.153 16.649 -1.643 1.00 0.00 N ATOM 1272 CA ARG A 445 -2.043 16.872 -2.778 1.00 0.00 C ATOM 1273 C ARG A 445 -2.548 18.312 -2.774 1.00 0.00 C ATOM 1274 O ARG A 445 -2.526 18.995 -3.798 1.00 0.00 O ATOM 1275 CB ARG A 445 -3.226 15.903 -2.725 1.00 0.00 C ATOM 1276 CG ARG A 445 -4.423 16.361 -3.540 1.00 0.00 C ATOM 1277 CD ARG A 445 -3.997 16.963 -4.869 1.00 0.00 C ATOM 1278 NE ARG A 445 -4.680 16.338 -5.997 1.00 0.00 N ATOM 1279 CZ ARG A 445 -4.276 15.206 -6.566 1.00 0.00 C ATOM 1280 NH1 ARG A 445 -3.200 14.580 -6.111 1.00 0.00 N ATOM 1281 NH2 ARG A 445 -4.951 14.699 -7.589 1.00 0.00 N ATOM 0 H ARG A 445 -1.281 15.749 -1.180 1.00 0.00 H new ATOM 0 HA ARG A 445 -1.485 16.694 -3.698 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -2.902 14.927 -3.087 1.00 0.00 H new ATOM 0 HB3 ARG A 445 -3.532 15.772 -1.687 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -5.087 15.515 -3.719 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -4.991 17.098 -2.971 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -4.206 18.033 -4.866 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -2.920 16.849 -4.990 1.00 0.00 H new ATOM 0 HE ARG A 445 -5.513 16.794 -6.369 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -2.680 14.966 -5.323 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -2.892 13.712 -6.549 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -5.781 15.177 -7.940 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -4.640 13.831 -8.025 1.00 0.00 H new ATOM 1295 N ALA A 446 -2.989 18.766 -1.607 1.00 0.00 N ATOM 1296 CA ALA A 446 -3.487 20.125 -1.447 1.00 0.00 C ATOM 1297 C ALA A 446 -2.329 21.118 -1.420 1.00 0.00 C ATOM 1298 O ALA A 446 -2.481 22.286 -1.779 1.00 0.00 O ATOM 1299 CB ALA A 446 -4.310 20.237 -0.174 1.00 0.00 C ATOM 0 H ALA A 446 -3.011 18.208 -0.753 1.00 0.00 H new ATOM 0 HA ALA A 446 -4.126 20.363 -2.298 1.00 0.00 H new ATOM 0 HB1 ALA A 446 -4.676 21.258 -0.066 1.00 0.00 H new ATOM 0 HB2 ALA A 446 -5.156 19.552 -0.226 1.00 0.00 H new ATOM 0 HB3 ALA A 446 -3.689 19.982 0.685 1.00 0.00 H new ATOM 1305 N ALA A 447 -1.173 20.629 -0.988 1.00 0.00 N ATOM 1306 CA ALA A 447 0.038 21.439 -0.897 1.00 0.00 C ATOM 1307 C ALA A 447 0.811 21.418 -2.212 1.00 0.00 C ATOM 1308 O ALA A 447 2.039 21.514 -2.218 1.00 0.00 O ATOM 1309 CB ALA A 447 0.927 20.959 0.240 1.00 0.00 C ATOM 0 H ALA A 447 -1.047 19.661 -0.691 1.00 0.00 H new ATOM 0 HA ALA A 447 -0.266 22.466 -0.692 1.00 0.00 H new ATOM 0 HB1 ALA A 447 1.823 21.578 0.288 1.00 0.00 H new ATOM 0 HB2 ALA A 447 0.384 21.033 1.182 1.00 0.00 H new ATOM 0 HB3 ALA A 447 1.212 19.921 0.066 1.00 0.00 H new ATOM 1315 N ILE A 448 0.089 21.296 -3.322 1.00 0.00 N ATOM 1316 CA ILE A 448 0.717 21.269 -4.637 1.00 0.00 C ATOM 1317 C ILE A 448 0.182 22.392 -5.521 1.00 0.00 C ATOM 1318 O ILE A 448 -1.024 22.494 -5.749 1.00 0.00 O ATOM 1319 CB ILE A 448 0.494 19.913 -5.341 1.00 0.00 C ATOM 1320 CG1 ILE A 448 -0.892 19.862 -5.989 1.00 0.00 C ATOM 1321 CG2 ILE A 448 0.661 18.771 -4.352 1.00 0.00 C ATOM 1322 CD1 ILE A 448 -1.295 18.478 -6.448 1.00 0.00 C ATOM 0 H ILE A 448 -0.928 21.215 -3.336 1.00 0.00 H new ATOM 0 HA ILE A 448 1.787 21.412 -4.483 1.00 0.00 H new ATOM 0 HB ILE A 448 1.242 19.805 -6.126 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -1.631 20.229 -5.276 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -0.910 20.539 -6.843 1.00 0.00 H new ATOM 0 HG21 ILE A 448 0.501 17.821 -4.862 1.00 0.00 H new ATOM 0 HG22 ILE A 448 1.668 18.794 -3.936 1.00 0.00 H new ATOM 0 HG23 ILE A 448 -0.066 18.877 -3.547 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -2.287 18.518 -6.897 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.578 18.116 -7.185 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -1.310 17.801 -5.594 1.00 0.00 H new ATOM 1334 N PRO A 449 1.076 23.255 -6.031 1.00 0.00 N ATOM 1335 CA PRO A 449 0.691 24.376 -6.894 1.00 0.00 C ATOM 1336 C PRO A 449 -0.199 23.939 -8.051 1.00 0.00 C ATOM 1337 O PRO A 449 -1.298 24.462 -8.233 1.00 0.00 O ATOM 1338 CB PRO A 449 2.031 24.900 -7.414 1.00 0.00 C ATOM 1339 CG PRO A 449 3.020 24.507 -6.372 1.00 0.00 C ATOM 1340 CD PRO A 449 2.532 23.201 -5.806 1.00 0.00 C ATOM 0 HA PRO A 449 0.107 25.123 -6.356 1.00 0.00 H new ATOM 0 HB2 PRO A 449 2.279 24.462 -8.381 1.00 0.00 H new ATOM 0 HB3 PRO A 449 2.008 25.981 -7.550 1.00 0.00 H new ATOM 0 HG2 PRO A 449 4.016 24.398 -6.801 1.00 0.00 H new ATOM 0 HG3 PRO A 449 3.090 25.267 -5.594 1.00 0.00 H new ATOM 0 HD2 PRO A 449 2.986 22.349 -6.312 1.00 0.00 H new ATOM 0 HD3 PRO A 449 2.772 23.107 -4.747 1.00 0.00 H new ATOM 1348 N ARG A 450 0.283 22.977 -8.830 1.00 0.00 N ATOM 1349 CA ARG A 450 -0.470 22.469 -9.971 1.00 0.00 C ATOM 1350 C ARG A 450 0.060 21.108 -10.410 1.00 0.00 C ATOM 1351 O ARG A 450 0.769 21.000 -11.411 1.00 0.00 O ATOM 1352 CB ARG A 450 -0.398 23.456 -11.137 1.00 0.00 C ATOM 1353 CG ARG A 450 -1.562 24.434 -11.177 1.00 0.00 C ATOM 1354 CD ARG A 450 -2.236 24.440 -12.539 1.00 0.00 C ATOM 1355 NE ARG A 450 -2.966 25.681 -12.783 1.00 0.00 N ATOM 1356 CZ ARG A 450 -3.999 25.776 -13.616 1.00 0.00 C ATOM 1357 NH1 ARG A 450 -4.419 24.708 -14.279 1.00 0.00 N ATOM 1358 NH2 ARG A 450 -4.610 26.940 -13.785 1.00 0.00 N ATOM 0 H ARG A 450 1.191 22.533 -8.692 1.00 0.00 H new ATOM 0 HA ARG A 450 -1.510 22.353 -9.665 1.00 0.00 H new ATOM 0 HB2 ARG A 450 0.535 24.016 -11.071 1.00 0.00 H new ATOM 0 HB3 ARG A 450 -0.370 22.899 -12.073 1.00 0.00 H new ATOM 0 HG2 ARG A 450 -2.290 24.167 -10.411 1.00 0.00 H new ATOM 0 HG3 ARG A 450 -1.205 25.437 -10.942 1.00 0.00 H new ATOM 0 HD2 ARG A 450 -1.484 24.303 -13.316 1.00 0.00 H new ATOM 0 HD3 ARG A 450 -2.923 23.596 -12.607 1.00 0.00 H new ATOM 0 HE ARG A 450 -2.668 26.521 -12.288 1.00 0.00 H new ATOM 0 HH11 ARG A 450 -3.950 23.811 -14.151 1.00 0.00 H new ATOM 0 HH12 ARG A 450 -5.211 24.783 -14.917 1.00 0.00 H new ATOM 0 HH21 ARG A 450 -4.288 27.763 -13.276 1.00 0.00 H new ATOM 0 HH22 ARG A 450 -5.402 27.012 -14.424 1.00 0.00 H new ATOM 1372 N SER A 451 -0.287 20.072 -9.654 1.00 0.00 N ATOM 1373 CA SER A 451 0.153 18.717 -9.966 1.00 0.00 C ATOM 1374 C SER A 451 -1.036 17.822 -10.304 1.00 0.00 C ATOM 1375 O SER A 451 -1.564 17.123 -9.440 1.00 0.00 O ATOM 1376 CB SER A 451 0.931 18.128 -8.789 1.00 0.00 C ATOM 1377 OG SER A 451 2.109 17.475 -9.231 1.00 0.00 O ATOM 0 H SER A 451 -0.871 20.145 -8.821 1.00 0.00 H new ATOM 0 HA SER A 451 0.807 18.766 -10.837 1.00 0.00 H new ATOM 0 HB2 SER A 451 1.192 18.921 -8.089 1.00 0.00 H new ATOM 0 HB3 SER A 451 0.300 17.421 -8.250 1.00 0.00 H new ATOM 0 HG SER A 451 2.589 17.109 -8.459 1.00 0.00 H new ATOM 1383 N GLU A 452 -1.450 17.851 -11.566 1.00 0.00 N ATOM 1384 CA GLU A 452 -2.577 17.043 -12.019 1.00 0.00 C ATOM 1385 C GLU A 452 -2.817 17.235 -13.511 1.00 0.00 C ATOM 1386 O GLU A 452 -3.121 16.282 -14.230 1.00 0.00 O ATOM 1387 CB GLU A 452 -3.840 17.406 -11.237 1.00 0.00 C ATOM 1388 CG GLU A 452 -4.732 16.213 -10.934 1.00 0.00 C ATOM 1389 CD GLU A 452 -6.207 16.554 -11.016 1.00 0.00 C ATOM 1390 OE1 GLU A 452 -6.677 17.358 -10.184 1.00 0.00 O ATOM 1391 OE2 GLU A 452 -6.893 16.015 -11.911 1.00 0.00 O ATOM 0 H GLU A 452 -1.023 18.425 -12.293 1.00 0.00 H new ATOM 0 HA GLU A 452 -2.336 15.995 -11.839 1.00 0.00 H new ATOM 0 HB2 GLU A 452 -3.553 17.882 -10.299 1.00 0.00 H new ATOM 0 HB3 GLU A 452 -4.411 18.141 -11.805 1.00 0.00 H new ATOM 0 HG2 GLU A 452 -4.509 15.409 -11.636 1.00 0.00 H new ATOM 0 HG3 GLU A 452 -4.504 15.837 -9.936 1.00 0.00 H new ATOM 1398 N SER A 453 -2.680 18.474 -13.971 1.00 0.00 N ATOM 1399 CA SER A 453 -2.882 18.793 -15.379 1.00 0.00 C ATOM 1400 C SER A 453 -1.736 19.647 -15.913 1.00 0.00 C ATOM 1401 O SER A 453 -0.823 19.079 -16.547 1.00 0.00 O ATOM 1402 CB SER A 453 -4.212 19.526 -15.570 1.00 0.00 C ATOM 1403 OG SER A 453 -5.300 18.617 -15.567 1.00 0.00 O ATOM 1404 OXT SER A 453 -1.763 20.876 -15.693 1.00 0.00 O ATOM 0 H SER A 453 -2.430 19.274 -13.389 1.00 0.00 H new ATOM 0 HA SER A 453 -2.906 17.858 -15.939 1.00 0.00 H new ATOM 0 HB2 SER A 453 -4.344 20.259 -14.774 1.00 0.00 H new ATOM 0 HB3 SER A 453 -4.196 20.076 -16.511 1.00 0.00 H new ATOM 0 HG SER A 453 -6.138 19.110 -15.689 1.00 0.00 H new TER 1410 SER A 453