USER MOD reduce.3.24.130724 H: found=0, std=0, add=637, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 640 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 454 THR OG1 : rot 180:sc= 1.02 USER MOD Set 1.2: A 476 THR OG1 : rot -58:sc= 1.25 USER MOD Set 2.1: A 466 GLN : amide:sc= 1.01 K(o=1.6,f=-1.7) USER MOD Set 2.2: A 468 HIS : no HD1:sc= 0.558 K(o=1.6,f=-3.7!) USER MOD Set 3.1: A 450 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 455 TYR OH : rot 80:sc= 0.273 USER MOD Set 4.1: A 416 THR OG1 : rot 133:sc= 1.18 USER MOD Set 4.2: A 419 TYR OH : rot 147:sc= 0.899 USER MOD Set 5.1: A 407 THR OG1 : rot 180:sc= 1.04 USER MOD Set 5.2: A 445 THR OG1 : rot -74:sc= 1.24 USER MOD Single : A 395 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 397 SER OG : rot 180:sc= 0.014 USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 400 GLN :FLIP amide:sc= -0.884 F(o=-3.8!,f=-0.88) USER MOD Single : A 404 SER OG : rot 150:sc= 0 USER MOD Single : A 405 GLN : amide:sc= -0.0848 K(o=-0.085,f=-3.7!) USER MOD Single : A 406 THR OG1 : rot -170:sc= -0.685 USER MOD Single : A 409 SER OG : rot 180:sc= 0 USER MOD Single : A 414 GLN : amide:sc= 0.998 K(o=1,f=-1.4!) USER MOD Single : A 417 SER OG : rot 180:sc= 0 USER MOD Single : A 422 SER OG : rot -140:sc= 0.244 USER MOD Single : A 423 CYS SG : rot 140:sc= -2.54! USER MOD Single : A 424 HIS : no HD1:sc= -0.267 X(o=-0.27,f=-0.13) USER MOD Single : A 428 THR OG1 : rot -81:sc= -0.0536 USER MOD Single : A 434 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 440 THR OG1 : rot 180:sc= 0.0204 USER MOD Single : A 441 SER OG : rot 180:sc= -0.0421 USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 SER OG : rot -19:sc= 0.366 USER MOD Single : A 447 THR OG1 : rot 180:sc= 0.0517 USER MOD Single : A 456 ASN : amide:sc= -0.206 K(o=-0.21,f=-4!) USER MOD Single : A 463 LYS NZ :NH3+ 165:sc= 1.17 (180deg=0.903) USER MOD Single : A 465 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 469 LYS NZ :NH3+ -118:sc= -0.989 (180deg=-2.96!) USER MOD Single : A 479 ASN :FLIP amide:sc= -0.197 F(o=-0.84,f=-0.2) USER MOD Single : A 480 SER OG : rot 42:sc= 0.743 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 395 25.795 13.796 -6.754 1.00 7.64 N ATOM 2 CA ASN A 395 24.402 14.099 -6.356 1.00 7.05 C ATOM 3 C ASN A 395 23.550 12.843 -6.400 1.00 6.89 C ATOM 4 O ASN A 395 23.813 11.930 -7.185 1.00 7.24 O ATOM 5 CB ASN A 395 23.793 15.175 -7.256 1.00 7.73 C ATOM 6 CG ASN A 395 24.358 16.553 -6.980 1.00 8.25 C ATOM 7 OD1 ASN A 395 23.854 17.276 -6.123 1.00 8.44 O ATOM 8 ND2 ASN A 395 25.393 16.935 -7.712 1.00 8.76 N ATOM 0 HA ASN A 395 24.423 14.478 -5.334 1.00 7.05 H new ATOM 0 HB2 ASN A 395 23.972 14.915 -8.299 1.00 7.73 H new ATOM 0 HB3 ASN A 395 22.713 15.194 -7.113 1.00 7.73 H new ATOM 0 HD21 ASN A 395 25.801 17.860 -7.575 1.00 8.76 H new ATOM 0 HD22 ASN A 395 25.782 16.305 -8.413 1.00 8.76 H new ATOM 17 N ALA A 396 22.508 12.851 -5.574 1.00 6.67 N ATOM 18 CA ALA A 396 21.692 11.665 -5.244 1.00 6.81 C ATOM 19 C ALA A 396 21.062 11.942 -3.896 1.00 6.05 C ATOM 20 O ALA A 396 19.839 11.962 -3.741 1.00 6.42 O ATOM 21 CB ALA A 396 22.534 10.393 -5.154 1.00 7.55 C ATOM 0 H ALA A 396 22.192 13.697 -5.100 1.00 6.67 H new ATOM 0 HA ALA A 396 20.951 11.499 -6.026 1.00 6.81 H new ATOM 0 HB1 ALA A 396 21.891 9.548 -4.909 1.00 7.55 H new ATOM 0 HB2 ALA A 396 23.023 10.212 -6.111 1.00 7.55 H new ATOM 0 HB3 ALA A 396 23.289 10.511 -4.377 1.00 7.55 H new ATOM 27 N SER A 397 21.940 12.190 -2.930 1.00 5.23 N ATOM 28 CA SER A 397 21.544 12.739 -1.637 1.00 4.72 C ATOM 29 C SER A 397 20.801 14.091 -1.870 1.00 4.61 C ATOM 30 O SER A 397 21.460 15.082 -2.182 1.00 4.53 O ATOM 31 CB SER A 397 22.851 12.998 -0.850 1.00 4.27 C ATOM 32 OG SER A 397 23.678 11.843 -0.864 1.00 4.45 O ATOM 0 H SER A 397 22.941 12.017 -3.020 1.00 5.23 H new ATOM 0 HA SER A 397 20.885 12.061 -1.094 1.00 4.72 H new ATOM 0 HB2 SER A 397 23.386 13.840 -1.289 1.00 4.27 H new ATOM 0 HB3 SER A 397 22.615 13.271 0.179 1.00 4.27 H new ATOM 0 HG SER A 397 24.501 12.024 -0.364 1.00 4.45 H new ATOM 38 N THR A 398 19.444 14.161 -1.744 1.00 5.02 N ATOM 39 CA THR A 398 18.733 15.452 -1.967 1.00 5.32 C ATOM 40 C THR A 398 17.453 15.498 -1.130 1.00 5.50 C ATOM 41 O THR A 398 16.390 15.888 -1.619 1.00 6.31 O ATOM 42 CB THR A 398 18.355 15.659 -3.462 1.00 6.23 C ATOM 43 OG1 THR A 398 17.970 14.404 -4.044 1.00 6.75 O ATOM 44 CG2 THR A 398 19.489 16.282 -4.281 1.00 6.37 C ATOM 0 H THR A 398 18.843 13.374 -1.500 1.00 5.02 H new ATOM 0 HA THR A 398 19.415 16.248 -1.668 1.00 5.32 H new ATOM 0 HB THR A 398 17.520 16.359 -3.486 1.00 6.23 H new ATOM 0 HG1 THR A 398 17.731 14.539 -4.985 1.00 6.75 H new ATOM 0 HG21 THR A 398 19.167 16.402 -5.315 1.00 6.37 H new ATOM 0 HG22 THR A 398 19.745 17.256 -3.865 1.00 6.37 H new ATOM 0 HG23 THR A 398 20.363 15.631 -4.246 1.00 6.37 H new ATOM 52 N GLY A 399 17.550 15.085 0.130 1.00 4.93 N ATOM 53 CA GLY A 399 16.359 14.903 0.947 1.00 5.31 C ATOM 54 C GLY A 399 16.055 13.434 1.045 1.00 4.62 C ATOM 55 O GLY A 399 15.636 12.926 2.082 1.00 4.48 O ATOM 0 H GLY A 399 18.429 14.873 0.601 1.00 4.93 H new ATOM 0 HA2 GLY A 399 16.516 15.322 1.941 1.00 5.31 H new ATOM 0 HA3 GLY A 399 15.515 15.434 0.507 1.00 5.31 H new ATOM 59 N GLN A 400 16.266 12.758 -0.070 1.00 4.32 N ATOM 60 CA GLN A 400 16.217 11.308 -0.114 1.00 3.59 C ATOM 61 C GLN A 400 17.644 10.797 -0.208 1.00 2.81 C ATOM 62 O GLN A 400 18.255 10.850 -1.275 1.00 2.93 O ATOM 63 CB GLN A 400 15.383 10.785 -1.293 1.00 3.81 C ATOM 64 CG GLN A 400 13.929 11.253 -1.305 1.00 4.51 C ATOM 65 CD GLN A 400 13.143 10.881 -0.056 1.00 4.68 C ATOM 66 OE1 GLN A 400 13.518 9.798 0.605 1.00 5.27 O flip ATOM 67 NE2 GLN A 400 12.206 11.577 0.320 1.00 4.54 N flip ATOM 0 H GLN A 400 16.475 13.197 -0.967 1.00 4.32 H new ATOM 0 HA GLN A 400 15.730 10.944 0.790 1.00 3.59 H new ATOM 0 HB2 GLN A 400 15.858 11.097 -2.223 1.00 3.81 H new ATOM 0 HB3 GLN A 400 15.399 9.695 -1.277 1.00 3.81 H new ATOM 0 HG2 GLN A 400 13.909 12.336 -1.424 1.00 4.51 H new ATOM 0 HG3 GLN A 400 13.429 10.827 -2.175 1.00 4.51 H new ATOM 0 HE21 GLN A 400 11.941 12.406 -0.212 1.00 4.54 H new ATOM 0 HE22 GLN A 400 11.692 11.327 1.164 1.00 4.54 H new ATOM 76 N GLU A 401 18.194 10.365 0.911 1.00 2.28 N ATOM 77 CA GLU A 401 19.611 9.963 0.928 1.00 1.62 C ATOM 78 C GLU A 401 19.898 8.601 0.312 1.00 1.37 C ATOM 79 O GLU A 401 20.539 8.523 -0.733 1.00 1.38 O ATOM 80 CB GLU A 401 20.217 10.062 2.340 1.00 1.30 C ATOM 81 CG GLU A 401 21.041 11.319 2.547 1.00 1.92 C ATOM 82 CD GLU A 401 21.737 11.338 3.892 1.00 2.22 C ATOM 83 OE1 GLU A 401 21.312 12.113 4.774 1.00 2.91 O ATOM 84 OE2 GLU A 401 22.704 10.572 4.079 1.00 2.28 O ATOM 0 H GLU A 401 17.708 10.280 1.804 1.00 2.28 H new ATOM 0 HA GLU A 401 20.104 10.686 0.278 1.00 1.62 H new ATOM 0 HB2 GLU A 401 19.414 10.036 3.076 1.00 1.30 H new ATOM 0 HB3 GLU A 401 20.844 9.189 2.522 1.00 1.30 H new ATOM 0 HG2 GLU A 401 21.785 11.397 1.755 1.00 1.92 H new ATOM 0 HG3 GLU A 401 20.394 12.192 2.463 1.00 1.92 H new ATOM 91 N ALA A 402 19.445 7.553 0.931 1.00 1.24 N ATOM 92 CA ALA A 402 19.749 6.207 0.451 1.00 1.04 C ATOM 93 C ALA A 402 18.497 5.446 0.094 1.00 0.82 C ATOM 94 O ALA A 402 18.437 4.214 0.126 1.00 0.79 O ATOM 95 CB ALA A 402 20.595 5.479 1.470 1.00 1.18 C ATOM 0 H ALA A 402 18.864 7.586 1.769 1.00 1.24 H new ATOM 0 HA ALA A 402 20.325 6.285 -0.471 1.00 1.04 H new ATOM 0 HB1 ALA A 402 20.819 4.476 1.107 1.00 1.18 H new ATOM 0 HB2 ALA A 402 21.526 6.024 1.627 1.00 1.18 H new ATOM 0 HB3 ALA A 402 20.051 5.411 2.412 1.00 1.18 H new ATOM 101 N LEU A 403 17.508 6.217 -0.215 1.00 0.75 N ATOM 102 CA LEU A 403 16.149 5.771 -0.215 1.00 0.58 C ATOM 103 C LEU A 403 15.647 5.438 -1.606 1.00 0.57 C ATOM 104 O LEU A 403 16.061 6.045 -2.591 1.00 0.90 O ATOM 105 CB LEU A 403 15.344 6.839 0.494 1.00 0.59 C ATOM 106 CG LEU A 403 15.907 7.133 1.896 1.00 0.79 C ATOM 107 CD1 LEU A 403 15.132 8.233 2.594 1.00 1.70 C ATOM 108 CD2 LEU A 403 15.904 5.871 2.750 1.00 1.52 C ATOM 0 H LEU A 403 17.621 7.195 -0.480 1.00 0.75 H new ATOM 0 HA LEU A 403 16.046 4.826 0.317 1.00 0.58 H new ATOM 0 HB2 LEU A 403 15.348 7.753 -0.100 1.00 0.59 H new ATOM 0 HB3 LEU A 403 14.306 6.518 0.578 1.00 0.59 H new ATOM 0 HG LEU A 403 16.934 7.476 1.768 1.00 0.79 H new ATOM 0 HD11 LEU A 403 15.561 8.410 3.580 1.00 1.70 H new ATOM 0 HD12 LEU A 403 15.188 9.148 2.004 1.00 1.70 H new ATOM 0 HD13 LEU A 403 14.090 7.933 2.700 1.00 1.70 H new ATOM 0 HD21 LEU A 403 16.306 6.099 3.737 1.00 1.52 H new ATOM 0 HD22 LEU A 403 14.883 5.502 2.850 1.00 1.52 H new ATOM 0 HD23 LEU A 403 16.521 5.108 2.275 1.00 1.52 H new ATOM 120 N SER A 404 14.757 4.473 -1.678 1.00 0.30 N ATOM 121 CA SER A 404 14.159 4.085 -2.934 1.00 0.27 C ATOM 122 C SER A 404 12.686 4.461 -2.927 1.00 0.28 C ATOM 123 O SER A 404 12.024 4.380 -1.886 1.00 0.43 O ATOM 124 CB SER A 404 14.336 2.588 -3.153 1.00 0.28 C ATOM 125 OG SER A 404 13.924 2.202 -4.454 1.00 1.04 O ATOM 0 H SER A 404 14.430 3.939 -0.873 1.00 0.30 H new ATOM 0 HA SER A 404 14.651 4.609 -3.754 1.00 0.27 H new ATOM 0 HB2 SER A 404 15.382 2.319 -3.006 1.00 0.28 H new ATOM 0 HB3 SER A 404 13.758 2.039 -2.409 1.00 0.28 H new ATOM 0 HG SER A 404 14.449 1.428 -4.747 1.00 1.04 H new ATOM 131 N GLN A 405 12.183 4.903 -4.069 1.00 0.26 N ATOM 132 CA GLN A 405 10.798 5.322 -4.165 1.00 0.26 C ATOM 133 C GLN A 405 10.018 4.375 -5.060 1.00 0.27 C ATOM 134 O GLN A 405 10.234 4.326 -6.273 1.00 0.43 O ATOM 135 CB GLN A 405 10.671 6.747 -4.707 1.00 0.30 C ATOM 136 CG GLN A 405 11.886 7.636 -4.468 1.00 0.33 C ATOM 137 CD GLN A 405 12.961 7.499 -5.542 1.00 0.58 C ATOM 138 OE1 GLN A 405 13.861 6.669 -5.429 1.00 0.99 O ATOM 139 NE2 GLN A 405 12.880 8.309 -6.595 1.00 0.91 N ATOM 0 H GLN A 405 12.712 4.980 -4.938 1.00 0.26 H new ATOM 0 HA GLN A 405 10.386 5.300 -3.156 1.00 0.26 H new ATOM 0 HB2 GLN A 405 10.481 6.697 -5.779 1.00 0.30 H new ATOM 0 HB3 GLN A 405 9.800 7.217 -4.251 1.00 0.30 H new ATOM 0 HG2 GLN A 405 11.562 8.676 -4.420 1.00 0.33 H new ATOM 0 HG3 GLN A 405 12.319 7.392 -3.498 1.00 0.33 H new ATOM 0 HE21 GLN A 405 12.121 8.987 -6.659 1.00 0.91 H new ATOM 0 HE22 GLN A 405 13.577 8.251 -7.338 1.00 0.91 H new ATOM 148 N THR A 406 9.121 3.621 -4.460 1.00 0.18 N ATOM 149 CA THR A 406 8.268 2.728 -5.205 1.00 0.19 C ATOM 150 C THR A 406 6.920 3.362 -5.428 1.00 0.17 C ATOM 151 O THR A 406 6.055 3.367 -4.555 1.00 0.16 O ATOM 152 CB THR A 406 8.086 1.397 -4.459 1.00 0.21 C ATOM 153 OG1 THR A 406 9.366 0.839 -4.136 1.00 0.27 O ATOM 154 CG2 THR A 406 7.294 0.413 -5.280 1.00 0.29 C ATOM 0 H THR A 406 8.966 3.611 -3.452 1.00 0.18 H new ATOM 0 HA THR A 406 8.743 2.532 -6.166 1.00 0.19 H new ATOM 0 HB THR A 406 7.532 1.598 -3.542 1.00 0.21 H new ATOM 0 HG1 THR A 406 9.250 -0.076 -3.805 1.00 0.27 H new ATOM 0 HG21 THR A 406 7.183 -0.518 -4.724 1.00 0.29 H new ATOM 0 HG22 THR A 406 6.309 0.828 -5.494 1.00 0.29 H new ATOM 0 HG23 THR A 406 7.816 0.217 -6.216 1.00 0.29 H new ATOM 162 N THR A 407 6.767 3.917 -6.595 1.00 0.19 N ATOM 163 CA THR A 407 5.493 4.388 -7.036 1.00 0.19 C ATOM 164 C THR A 407 4.644 3.191 -7.435 1.00 0.19 C ATOM 165 O THR A 407 5.000 2.428 -8.334 1.00 0.26 O ATOM 166 CB THR A 407 5.676 5.351 -8.207 1.00 0.24 C ATOM 167 OG1 THR A 407 6.327 6.545 -7.751 1.00 0.26 O ATOM 168 CG2 THR A 407 4.345 5.694 -8.872 1.00 0.24 C ATOM 0 H THR A 407 7.524 4.054 -7.265 1.00 0.19 H new ATOM 0 HA THR A 407 4.989 4.929 -6.235 1.00 0.19 H new ATOM 0 HB THR A 407 6.296 4.859 -8.956 1.00 0.24 H new ATOM 0 HG1 THR A 407 6.445 7.161 -8.504 1.00 0.26 H new ATOM 0 HG21 THR A 407 4.518 6.381 -9.700 1.00 0.24 H new ATOM 0 HG22 THR A 407 3.881 4.782 -9.248 1.00 0.24 H new ATOM 0 HG23 THR A 407 3.684 6.164 -8.143 1.00 0.24 H new ATOM 176 N ILE A 408 3.544 3.015 -6.736 1.00 0.21 N ATOM 177 CA ILE A 408 2.689 1.856 -6.934 1.00 0.21 C ATOM 178 C ILE A 408 1.249 2.292 -7.007 1.00 0.18 C ATOM 179 O ILE A 408 0.796 3.144 -6.239 1.00 0.16 O ATOM 180 CB ILE A 408 2.891 0.748 -5.843 1.00 0.23 C ATOM 181 CG1 ILE A 408 1.638 -0.119 -5.654 1.00 0.21 C ATOM 182 CG2 ILE A 408 3.271 1.340 -4.507 1.00 0.25 C ATOM 183 CD1 ILE A 408 1.932 -1.517 -5.154 1.00 0.27 C ATOM 0 H ILE A 408 3.216 3.663 -6.020 1.00 0.21 H new ATOM 0 HA ILE A 408 2.978 1.397 -7.880 1.00 0.21 H new ATOM 0 HB ILE A 408 3.704 0.121 -6.209 1.00 0.23 H new ATOM 0 HG12 ILE A 408 0.968 0.375 -4.950 1.00 0.21 H new ATOM 0 HG13 ILE A 408 1.108 -0.187 -6.604 1.00 0.21 H new ATOM 0 HG21 ILE A 408 3.402 0.540 -3.778 1.00 0.25 H new ATOM 0 HG22 ILE A 408 4.203 1.896 -4.607 1.00 0.25 H new ATOM 0 HG23 ILE A 408 2.482 2.013 -4.170 1.00 0.25 H new ATOM 0 HD11 ILE A 408 0.998 -2.068 -5.045 1.00 0.27 H new ATOM 0 HD12 ILE A 408 2.576 -2.031 -5.868 1.00 0.27 H new ATOM 0 HD13 ILE A 408 2.434 -1.460 -4.188 1.00 0.27 H new ATOM 195 N SER A 409 0.556 1.741 -7.973 1.00 0.18 N ATOM 196 CA SER A 409 -0.820 2.082 -8.208 1.00 0.16 C ATOM 197 C SER A 409 -1.723 0.905 -7.909 1.00 0.13 C ATOM 198 O SER A 409 -1.313 -0.253 -7.972 1.00 0.15 O ATOM 199 CB SER A 409 -1.007 2.545 -9.648 1.00 0.21 C ATOM 200 OG SER A 409 -0.472 1.604 -10.566 1.00 0.71 O ATOM 0 H SER A 409 0.932 1.045 -8.616 1.00 0.18 H new ATOM 0 HA SER A 409 -1.093 2.898 -7.539 1.00 0.16 H new ATOM 0 HB2 SER A 409 -2.068 2.691 -9.850 1.00 0.21 H new ATOM 0 HB3 SER A 409 -0.520 3.510 -9.788 1.00 0.21 H new ATOM 0 HG SER A 409 -0.608 1.926 -11.481 1.00 0.71 H new ATOM 206 N TRP A 410 -2.945 1.221 -7.568 1.00 0.16 N ATOM 207 CA TRP A 410 -3.964 0.221 -7.319 1.00 0.17 C ATOM 208 C TRP A 410 -5.252 0.679 -7.910 1.00 0.18 C ATOM 209 O TRP A 410 -5.425 1.856 -8.236 1.00 0.19 O ATOM 210 CB TRP A 410 -4.135 -0.036 -5.825 1.00 0.16 C ATOM 211 CG TRP A 410 -4.340 1.218 -5.024 1.00 0.14 C ATOM 212 CD1 TRP A 410 -5.522 1.837 -4.688 1.00 0.14 C ATOM 213 CD2 TRP A 410 -3.301 2.019 -4.471 1.00 0.13 C ATOM 214 NE1 TRP A 410 -5.260 2.963 -3.946 1.00 0.13 N ATOM 215 CE2 TRP A 410 -3.903 3.094 -3.798 1.00 0.12 C ATOM 216 CE3 TRP A 410 -1.910 1.917 -4.479 1.00 0.14 C ATOM 217 CZ2 TRP A 410 -3.155 4.066 -3.139 1.00 0.14 C ATOM 218 CZ3 TRP A 410 -1.168 2.875 -3.831 1.00 0.15 C ATOM 219 CH2 TRP A 410 -1.791 3.941 -3.164 1.00 0.14 C ATOM 0 H TRP A 410 -3.268 2.182 -7.453 1.00 0.16 H new ATOM 0 HA TRP A 410 -3.655 -0.716 -7.783 1.00 0.17 H new ATOM 0 HB2 TRP A 410 -4.987 -0.699 -5.673 1.00 0.16 H new ATOM 0 HB3 TRP A 410 -3.254 -0.558 -5.450 1.00 0.16 H new ATOM 0 HD1 TRP A 410 -6.506 1.490 -4.966 1.00 0.14 H new ATOM 0 HE1 TRP A 410 -5.961 3.599 -3.566 1.00 0.13 H new ATOM 0 HE3 TRP A 410 -1.423 1.097 -4.987 1.00 0.14 H new ATOM 0 HZ2 TRP A 410 -3.633 4.888 -2.627 1.00 0.14 H new ATOM 0 HZ3 TRP A 410 -0.090 2.807 -3.835 1.00 0.15 H new ATOM 0 HH2 TRP A 410 -1.183 4.678 -2.660 1.00 0.14 H new ATOM 230 N ALA A 411 -6.148 -0.248 -8.066 1.00 0.19 N ATOM 231 CA ALA A 411 -7.380 0.041 -8.686 1.00 0.22 C ATOM 232 C ALA A 411 -8.361 0.596 -7.689 1.00 0.19 C ATOM 233 O ALA A 411 -8.482 0.103 -6.565 1.00 0.19 O ATOM 234 CB ALA A 411 -7.917 -1.181 -9.365 1.00 0.26 C ATOM 0 H ALA A 411 -6.035 -1.216 -7.765 1.00 0.19 H new ATOM 0 HA ALA A 411 -7.220 0.805 -9.447 1.00 0.22 H new ATOM 0 HB1 ALA A 411 -8.869 -0.945 -9.840 1.00 0.26 H new ATOM 0 HB2 ALA A 411 -7.208 -1.518 -10.121 1.00 0.26 H new ATOM 0 HB3 ALA A 411 -8.065 -1.971 -8.629 1.00 0.26 H new ATOM 240 N PRO A 412 -9.052 1.643 -8.116 1.00 0.20 N ATOM 241 CA PRO A 412 -9.993 2.373 -7.296 1.00 0.19 C ATOM 242 C PRO A 412 -10.964 1.449 -6.601 1.00 0.20 C ATOM 243 O PRO A 412 -11.679 0.679 -7.241 1.00 0.23 O ATOM 244 CB PRO A 412 -10.758 3.246 -8.272 1.00 0.24 C ATOM 245 CG PRO A 412 -10.012 3.221 -9.569 1.00 0.26 C ATOM 246 CD PRO A 412 -8.947 2.167 -9.471 1.00 0.23 C ATOM 0 HA PRO A 412 -9.477 2.935 -6.517 1.00 0.19 H new ATOM 0 HB2 PRO A 412 -11.774 2.874 -8.406 1.00 0.24 H new ATOM 0 HB3 PRO A 412 -10.839 4.265 -7.894 1.00 0.24 H new ATOM 0 HG2 PRO A 412 -10.690 3.003 -10.394 1.00 0.26 H new ATOM 0 HG3 PRO A 412 -9.567 4.195 -9.771 1.00 0.26 H new ATOM 0 HD2 PRO A 412 -9.102 1.381 -10.210 1.00 0.23 H new ATOM 0 HD3 PRO A 412 -7.958 2.588 -9.655 1.00 0.23 H new ATOM 254 N PHE A 413 -10.986 1.531 -5.296 1.00 0.21 N ATOM 255 CA PHE A 413 -11.798 0.642 -4.509 1.00 0.30 C ATOM 256 C PHE A 413 -13.140 1.287 -4.139 1.00 0.51 C ATOM 257 O PHE A 413 -14.054 0.608 -3.667 1.00 1.35 O ATOM 258 CB PHE A 413 -10.998 0.200 -3.278 1.00 0.30 C ATOM 259 CG PHE A 413 -11.775 -0.585 -2.274 1.00 0.37 C ATOM 260 CD1 PHE A 413 -12.221 0.036 -1.133 1.00 0.36 C ATOM 261 CD2 PHE A 413 -12.068 -1.922 -2.472 1.00 0.51 C ATOM 262 CE1 PHE A 413 -12.951 -0.654 -0.189 1.00 0.45 C ATOM 263 CE2 PHE A 413 -12.795 -2.629 -1.534 1.00 0.61 C ATOM 264 CZ PHE A 413 -13.240 -1.993 -0.386 1.00 0.57 C ATOM 0 H PHE A 413 -10.448 2.208 -4.755 1.00 0.21 H new ATOM 0 HA PHE A 413 -12.048 -0.243 -5.095 1.00 0.30 H new ATOM 0 HB2 PHE A 413 -10.150 -0.399 -3.609 1.00 0.30 H new ATOM 0 HB3 PHE A 413 -10.591 1.085 -2.790 1.00 0.30 H new ATOM 0 HD1 PHE A 413 -11.996 1.080 -0.973 1.00 0.36 H new ATOM 0 HD2 PHE A 413 -11.725 -2.418 -3.368 1.00 0.51 H new ATOM 0 HE1 PHE A 413 -13.297 -0.151 0.702 1.00 0.45 H new ATOM 0 HE2 PHE A 413 -13.016 -3.674 -1.695 1.00 0.61 H new ATOM 0 HZ PHE A 413 -13.809 -2.540 0.351 1.00 0.57 H new ATOM 274 N GLN A 414 -13.236 2.601 -4.363 1.00 0.54 N ATOM 275 CA GLN A 414 -14.522 3.348 -4.250 1.00 0.53 C ATOM 276 C GLN A 414 -14.759 3.889 -2.877 1.00 0.44 C ATOM 277 O GLN A 414 -14.952 3.184 -1.887 1.00 0.48 O ATOM 278 CB GLN A 414 -15.769 2.563 -4.743 1.00 0.71 C ATOM 279 CG GLN A 414 -17.044 3.391 -4.746 1.00 1.28 C ATOM 280 CD GLN A 414 -17.995 2.992 -3.627 1.00 1.51 C ATOM 281 OE1 GLN A 414 -18.056 1.828 -3.231 1.00 2.11 O ATOM 282 NE2 GLN A 414 -18.725 3.955 -3.090 1.00 1.89 N ATOM 0 H GLN A 414 -12.442 3.184 -4.626 1.00 0.54 H new ATOM 0 HA GLN A 414 -14.393 4.187 -4.934 1.00 0.53 H new ATOM 0 HB2 GLN A 414 -15.582 2.195 -5.752 1.00 0.71 H new ATOM 0 HB3 GLN A 414 -15.914 1.690 -4.107 1.00 0.71 H new ATOM 0 HG2 GLN A 414 -16.790 4.446 -4.645 1.00 1.28 H new ATOM 0 HG3 GLN A 414 -17.547 3.275 -5.706 1.00 1.28 H new ATOM 0 HE21 GLN A 414 -18.650 4.909 -3.443 1.00 1.89 H new ATOM 0 HE22 GLN A 414 -19.363 3.744 -2.323 1.00 1.89 H new ATOM 291 N ASP A 415 -14.734 5.194 -2.906 1.00 0.39 N ATOM 292 CA ASP A 415 -15.020 6.069 -1.804 1.00 0.34 C ATOM 293 C ASP A 415 -14.308 5.696 -0.529 1.00 0.31 C ATOM 294 O ASP A 415 -14.859 5.834 0.564 1.00 0.35 O ATOM 295 CB ASP A 415 -16.515 6.171 -1.523 1.00 0.40 C ATOM 296 CG ASP A 415 -17.254 7.011 -2.543 1.00 0.45 C ATOM 297 OD1 ASP A 415 -17.781 6.448 -3.525 1.00 0.58 O ATOM 298 OD2 ASP A 415 -17.313 8.247 -2.365 1.00 0.59 O ATOM 0 H ASP A 415 -14.498 5.706 -3.756 1.00 0.39 H new ATOM 0 HA ASP A 415 -14.641 7.039 -2.127 1.00 0.34 H new ATOM 0 HB2 ASP A 415 -16.945 5.169 -1.506 1.00 0.40 H new ATOM 0 HB3 ASP A 415 -16.664 6.599 -0.532 1.00 0.40 H new ATOM 303 N THR A 416 -13.088 5.269 -0.657 1.00 0.27 N ATOM 304 CA THR A 416 -12.296 4.911 0.480 1.00 0.23 C ATOM 305 C THR A 416 -11.939 6.159 1.284 1.00 0.24 C ATOM 306 O THR A 416 -11.772 7.242 0.731 1.00 0.25 O ATOM 307 CB THR A 416 -11.032 4.198 0.012 1.00 0.19 C ATOM 308 OG1 THR A 416 -11.377 3.194 -0.949 1.00 0.22 O ATOM 309 CG2 THR A 416 -10.331 3.560 1.184 1.00 0.22 C ATOM 0 H THR A 416 -12.614 5.159 -1.553 1.00 0.27 H new ATOM 0 HA THR A 416 -12.866 4.240 1.123 1.00 0.23 H new ATOM 0 HB THR A 416 -10.362 4.926 -0.446 1.00 0.19 H new ATOM 0 HG1 THR A 416 -10.780 3.263 -1.723 1.00 0.22 H new ATOM 0 HG21 THR A 416 -9.430 3.054 0.837 1.00 0.22 H new ATOM 0 HG22 THR A 416 -10.060 4.328 1.908 1.00 0.22 H new ATOM 0 HG23 THR A 416 -10.996 2.836 1.655 1.00 0.22 H new ATOM 317 N SER A 417 -11.924 6.020 2.600 1.00 0.25 N ATOM 318 CA SER A 417 -11.546 7.109 3.481 1.00 0.28 C ATOM 319 C SER A 417 -10.042 7.307 3.410 1.00 0.27 C ATOM 320 O SER A 417 -9.549 8.438 3.399 1.00 0.33 O ATOM 321 CB SER A 417 -11.978 6.800 4.926 1.00 0.32 C ATOM 322 OG SER A 417 -11.608 7.839 5.821 1.00 1.14 O ATOM 0 H SER A 417 -12.172 5.156 3.083 1.00 0.25 H new ATOM 0 HA SER A 417 -12.047 8.024 3.164 1.00 0.28 H new ATOM 0 HB2 SER A 417 -13.058 6.659 4.960 1.00 0.32 H new ATOM 0 HB3 SER A 417 -11.524 5.863 5.249 1.00 0.32 H new ATOM 0 HG SER A 417 -11.900 7.609 6.728 1.00 1.14 H new ATOM 328 N GLU A 418 -9.327 6.190 3.329 1.00 0.23 N ATOM 329 CA GLU A 418 -7.869 6.189 3.279 1.00 0.25 C ATOM 330 C GLU A 418 -7.328 4.888 2.725 1.00 0.19 C ATOM 331 O GLU A 418 -8.015 3.891 2.688 1.00 0.28 O ATOM 332 CB GLU A 418 -7.312 6.382 4.675 1.00 0.36 C ATOM 333 CG GLU A 418 -7.113 7.815 5.031 1.00 0.84 C ATOM 334 CD GLU A 418 -6.589 8.026 6.429 1.00 0.86 C ATOM 335 OE1 GLU A 418 -5.368 8.236 6.590 1.00 1.31 O ATOM 336 OE2 GLU A 418 -7.394 7.958 7.377 1.00 1.37 O ATOM 0 H GLU A 418 -9.742 5.259 3.296 1.00 0.23 H new ATOM 0 HA GLU A 418 -7.563 7.003 2.622 1.00 0.25 H new ATOM 0 HB2 GLU A 418 -7.989 5.925 5.397 1.00 0.36 H new ATOM 0 HB3 GLU A 418 -6.360 5.858 4.756 1.00 0.36 H new ATOM 0 HG2 GLU A 418 -6.418 8.263 4.321 1.00 0.84 H new ATOM 0 HG3 GLU A 418 -8.061 8.342 4.925 1.00 0.84 H new ATOM 343 N TYR A 419 -6.084 4.900 2.331 1.00 0.17 N ATOM 344 CA TYR A 419 -5.409 3.673 1.930 1.00 0.16 C ATOM 345 C TYR A 419 -4.122 3.558 2.704 1.00 0.19 C ATOM 346 O TYR A 419 -3.255 4.432 2.615 1.00 0.29 O ATOM 347 CB TYR A 419 -5.097 3.608 0.423 1.00 0.16 C ATOM 348 CG TYR A 419 -6.329 3.649 -0.500 1.00 0.14 C ATOM 349 CD1 TYR A 419 -7.031 2.480 -0.859 1.00 0.12 C ATOM 350 CD2 TYR A 419 -6.796 4.854 -1.025 1.00 0.17 C ATOM 351 CE1 TYR A 419 -8.136 2.532 -1.698 1.00 0.12 C ATOM 352 CE2 TYR A 419 -7.894 4.889 -1.858 1.00 0.18 C ATOM 353 CZ TYR A 419 -8.553 3.736 -2.192 1.00 0.14 C ATOM 354 OH TYR A 419 -9.651 3.799 -3.018 1.00 0.19 O ATOM 0 H TYR A 419 -5.508 5.740 2.275 1.00 0.17 H new ATOM 0 HA TYR A 419 -6.087 2.847 2.146 1.00 0.16 H new ATOM 0 HB2 TYR A 419 -4.442 4.441 0.167 1.00 0.16 H new ATOM 0 HB3 TYR A 419 -4.541 2.692 0.222 1.00 0.16 H new ATOM 0 HD1 TYR A 419 -6.703 1.526 -0.474 1.00 0.12 H new ATOM 0 HD2 TYR A 419 -6.289 5.774 -0.775 1.00 0.17 H new ATOM 0 HE1 TYR A 419 -8.663 1.626 -1.959 1.00 0.12 H new ATOM 0 HE2 TYR A 419 -8.238 5.835 -2.251 1.00 0.18 H new ATOM 0 HH TYR A 419 -10.126 4.643 -2.867 1.00 0.19 H new ATOM 364 N ILE A 420 -4.009 2.506 3.484 1.00 0.18 N ATOM 365 CA ILE A 420 -2.803 2.273 4.231 1.00 0.18 C ATOM 366 C ILE A 420 -1.939 1.266 3.516 1.00 0.17 C ATOM 367 O ILE A 420 -2.372 0.152 3.215 1.00 0.21 O ATOM 368 CB ILE A 420 -3.080 1.798 5.665 1.00 0.22 C ATOM 369 CG1 ILE A 420 -3.661 2.956 6.461 1.00 0.32 C ATOM 370 CG2 ILE A 420 -1.792 1.309 6.326 1.00 0.26 C ATOM 371 CD1 ILE A 420 -4.552 2.545 7.597 1.00 0.32 C ATOM 0 H ILE A 420 -4.737 1.803 3.614 1.00 0.18 H new ATOM 0 HA ILE A 420 -2.281 3.227 4.302 1.00 0.18 H new ATOM 0 HB ILE A 420 -3.788 0.969 5.640 1.00 0.22 H new ATOM 0 HG12 ILE A 420 -2.841 3.555 6.857 1.00 0.32 H new ATOM 0 HG13 ILE A 420 -4.227 3.597 5.785 1.00 0.32 H new ATOM 0 HG21 ILE A 420 -2.008 0.976 7.341 1.00 0.26 H new ATOM 0 HG22 ILE A 420 -1.381 0.479 5.752 1.00 0.26 H new ATOM 0 HG23 ILE A 420 -1.067 2.123 6.357 1.00 0.26 H new ATOM 0 HD11 ILE A 420 -4.922 3.433 8.109 1.00 0.32 H new ATOM 0 HD12 ILE A 420 -5.395 1.972 7.210 1.00 0.32 H new ATOM 0 HD13 ILE A 420 -3.987 1.930 8.298 1.00 0.32 H new ATOM 383 N ILE A 421 -0.728 1.672 3.242 1.00 0.15 N ATOM 384 CA ILE A 421 0.228 0.801 2.600 1.00 0.18 C ATOM 385 C ILE A 421 1.150 0.249 3.658 1.00 0.19 C ATOM 386 O ILE A 421 1.916 0.981 4.281 1.00 0.30 O ATOM 387 CB ILE A 421 1.047 1.512 1.504 1.00 0.19 C ATOM 388 CG1 ILE A 421 0.133 2.054 0.411 1.00 0.20 C ATOM 389 CG2 ILE A 421 2.043 0.537 0.894 1.00 0.24 C ATOM 390 CD1 ILE A 421 0.809 3.057 -0.495 1.00 0.32 C ATOM 0 H ILE A 421 -0.376 2.606 3.454 1.00 0.15 H new ATOM 0 HA ILE A 421 -0.322 0.002 2.102 1.00 0.18 H new ATOM 0 HB ILE A 421 1.580 2.347 1.959 1.00 0.19 H new ATOM 0 HG12 ILE A 421 -0.234 1.222 -0.190 1.00 0.20 H new ATOM 0 HG13 ILE A 421 -0.736 2.522 0.873 1.00 0.20 H new ATOM 0 HG21 ILE A 421 2.620 1.043 0.120 1.00 0.24 H new ATOM 0 HG22 ILE A 421 2.717 0.173 1.669 1.00 0.24 H new ATOM 0 HG23 ILE A 421 1.507 -0.304 0.455 1.00 0.24 H new ATOM 0 HD11 ILE A 421 0.101 3.401 -1.249 1.00 0.32 H new ATOM 0 HD12 ILE A 421 1.152 3.907 0.095 1.00 0.32 H new ATOM 0 HD13 ILE A 421 1.662 2.588 -0.985 1.00 0.32 H new ATOM 402 N SER A 422 1.031 -1.033 3.871 1.00 0.14 N ATOM 403 CA SER A 422 1.794 -1.727 4.897 1.00 0.14 C ATOM 404 C SER A 422 2.867 -2.581 4.255 1.00 0.16 C ATOM 405 O SER A 422 2.653 -3.748 3.928 1.00 0.36 O ATOM 406 CB SER A 422 0.905 -2.621 5.747 1.00 0.18 C ATOM 407 OG SER A 422 -0.109 -1.887 6.421 1.00 0.88 O ATOM 0 H SER A 422 0.402 -1.637 3.341 1.00 0.14 H new ATOM 0 HA SER A 422 2.244 -0.969 5.538 1.00 0.14 H new ATOM 0 HB2 SER A 422 0.443 -3.378 5.114 1.00 0.18 H new ATOM 0 HB3 SER A 422 1.517 -3.148 6.479 1.00 0.18 H new ATOM 0 HG SER A 422 -0.220 -2.240 7.328 1.00 0.88 H new ATOM 413 N CYS A 423 4.001 -1.980 4.073 1.00 0.14 N ATOM 414 CA CYS A 423 5.156 -2.657 3.509 1.00 0.12 C ATOM 415 C CYS A 423 5.856 -3.507 4.561 1.00 0.12 C ATOM 416 O CYS A 423 6.612 -2.995 5.383 1.00 0.13 O ATOM 417 CB CYS A 423 6.125 -1.645 2.920 1.00 0.14 C ATOM 418 SG CYS A 423 5.454 -0.698 1.536 1.00 0.95 S ATOM 0 H CYS A 423 4.166 -1.001 4.308 1.00 0.14 H new ATOM 0 HA CYS A 423 4.809 -3.317 2.714 1.00 0.12 H new ATOM 0 HB2 CYS A 423 6.432 -0.953 3.704 1.00 0.14 H new ATOM 0 HB3 CYS A 423 7.022 -2.168 2.587 1.00 0.14 H new ATOM 0 HG CYS A 423 5.838 0.540 1.631 1.00 0.95 H new ATOM 424 N HIS A 424 5.595 -4.806 4.527 1.00 0.13 N ATOM 425 CA HIS A 424 6.187 -5.740 5.486 1.00 0.15 C ATOM 426 C HIS A 424 7.525 -6.244 4.972 1.00 0.15 C ATOM 427 O HIS A 424 7.590 -6.952 3.971 1.00 0.16 O ATOM 428 CB HIS A 424 5.268 -6.937 5.736 1.00 0.18 C ATOM 429 CG HIS A 424 4.067 -6.654 6.584 1.00 0.19 C ATOM 430 ND1 HIS A 424 3.943 -7.097 7.881 1.00 0.24 N ATOM 431 CD2 HIS A 424 2.911 -6.004 6.303 1.00 0.24 C ATOM 432 CE1 HIS A 424 2.770 -6.735 8.359 1.00 0.25 C ATOM 433 NE2 HIS A 424 2.126 -6.069 7.423 1.00 0.25 N ATOM 0 H HIS A 424 4.975 -5.243 3.845 1.00 0.13 H new ATOM 0 HA HIS A 424 6.328 -5.202 6.424 1.00 0.15 H new ATOM 0 HB2 HIS A 424 4.931 -7.322 4.774 1.00 0.18 H new ATOM 0 HB3 HIS A 424 5.849 -7.728 6.210 1.00 0.18 H new ATOM 0 HD2 HIS A 424 2.657 -5.524 5.369 1.00 0.24 H new ATOM 0 HE1 HIS A 424 2.399 -6.948 9.351 1.00 0.25 H new ATOM 0 HE2 HIS A 424 1.193 -5.667 7.517 1.00 0.25 H new ATOM 442 N PRO A 425 8.602 -5.882 5.658 1.00 0.17 N ATOM 443 CA PRO A 425 9.952 -6.279 5.282 1.00 0.17 C ATOM 444 C PRO A 425 10.219 -7.748 5.510 1.00 0.18 C ATOM 445 O PRO A 425 9.865 -8.332 6.535 1.00 0.24 O ATOM 446 CB PRO A 425 10.871 -5.432 6.164 1.00 0.21 C ATOM 447 CG PRO A 425 9.989 -4.585 7.022 1.00 0.32 C ATOM 448 CD PRO A 425 8.577 -5.061 6.863 1.00 0.22 C ATOM 0 HA PRO A 425 10.114 -6.121 4.216 1.00 0.17 H new ATOM 0 HB2 PRO A 425 11.511 -6.067 6.777 1.00 0.21 H new ATOM 0 HB3 PRO A 425 11.527 -4.812 5.554 1.00 0.21 H new ATOM 0 HG2 PRO A 425 10.297 -4.652 8.065 1.00 0.32 H new ATOM 0 HG3 PRO A 425 10.071 -3.537 6.733 1.00 0.32 H new ATOM 0 HD2 PRO A 425 8.253 -5.637 7.729 1.00 0.22 H new ATOM 0 HD3 PRO A 425 7.886 -4.225 6.759 1.00 0.22 H new ATOM 456 N VAL A 426 10.842 -8.323 4.513 1.00 0.15 N ATOM 457 CA VAL A 426 11.256 -9.703 4.520 1.00 0.19 C ATOM 458 C VAL A 426 12.778 -9.752 4.646 1.00 0.20 C ATOM 459 O VAL A 426 13.475 -8.949 4.024 1.00 0.20 O ATOM 460 CB VAL A 426 10.855 -10.380 3.204 1.00 0.20 C ATOM 461 CG1 VAL A 426 11.075 -11.886 3.241 1.00 0.27 C ATOM 462 CG2 VAL A 426 9.428 -10.041 2.810 1.00 0.21 C ATOM 0 H VAL A 426 11.081 -7.832 3.652 1.00 0.15 H new ATOM 0 HA VAL A 426 10.779 -10.220 5.353 1.00 0.19 H new ATOM 0 HB VAL A 426 11.514 -9.979 2.434 1.00 0.20 H new ATOM 0 HG11 VAL A 426 10.777 -12.321 2.287 1.00 0.27 H new ATOM 0 HG12 VAL A 426 12.129 -12.095 3.421 1.00 0.27 H new ATOM 0 HG13 VAL A 426 10.477 -12.322 4.041 1.00 0.27 H new ATOM 0 HG21 VAL A 426 9.181 -10.539 1.873 1.00 0.21 H new ATOM 0 HG22 VAL A 426 8.745 -10.377 3.590 1.00 0.21 H new ATOM 0 HG23 VAL A 426 9.332 -8.963 2.684 1.00 0.21 H new ATOM 472 N GLY A 427 13.285 -10.661 5.455 1.00 0.26 N ATOM 473 CA GLY A 427 14.727 -10.786 5.627 1.00 0.29 C ATOM 474 C GLY A 427 15.212 -10.075 6.872 1.00 0.32 C ATOM 475 O GLY A 427 16.076 -10.573 7.590 1.00 0.38 O ATOM 0 H GLY A 427 12.730 -11.320 6.001 1.00 0.26 H new ATOM 0 HA2 GLY A 427 14.995 -11.841 5.684 1.00 0.29 H new ATOM 0 HA3 GLY A 427 15.234 -10.375 4.754 1.00 0.29 H new ATOM 479 N THR A 428 14.649 -8.910 7.123 1.00 0.31 N ATOM 480 CA THR A 428 14.988 -8.122 8.291 1.00 0.37 C ATOM 481 C THR A 428 13.982 -8.313 9.403 1.00 0.41 C ATOM 482 O THR A 428 12.978 -9.008 9.247 1.00 0.41 O ATOM 483 CB THR A 428 15.010 -6.637 7.957 1.00 0.37 C ATOM 484 OG1 THR A 428 13.953 -6.333 7.034 1.00 0.30 O ATOM 485 CG2 THR A 428 16.350 -6.216 7.378 1.00 0.42 C ATOM 0 H THR A 428 13.943 -8.483 6.523 1.00 0.31 H new ATOM 0 HA THR A 428 15.972 -8.462 8.613 1.00 0.37 H new ATOM 0 HB THR A 428 14.859 -6.078 8.881 1.00 0.37 H new ATOM 0 HG1 THR A 428 14.235 -6.566 6.125 1.00 0.30 H new ATOM 0 HG21 THR A 428 16.330 -5.150 7.151 1.00 0.42 H new ATOM 0 HG22 THR A 428 17.139 -6.418 8.102 1.00 0.42 H new ATOM 0 HG23 THR A 428 16.544 -6.778 6.464 1.00 0.42 H new ATOM 493 N ASP A 429 14.257 -7.676 10.529 1.00 0.48 N ATOM 494 CA ASP A 429 13.303 -7.617 11.615 1.00 0.54 C ATOM 495 C ASP A 429 12.632 -6.261 11.654 1.00 0.49 C ATOM 496 O ASP A 429 12.083 -5.855 12.682 1.00 0.59 O ATOM 497 CB ASP A 429 13.965 -7.875 12.957 1.00 0.69 C ATOM 498 CG ASP A 429 14.572 -9.259 13.069 1.00 1.09 C ATOM 499 OD1 ASP A 429 13.823 -10.219 13.358 1.00 1.06 O ATOM 500 OD2 ASP A 429 15.799 -9.398 12.880 1.00 1.78 O ATOM 0 H ASP A 429 15.136 -7.192 10.712 1.00 0.48 H new ATOM 0 HA ASP A 429 12.562 -8.396 11.434 1.00 0.54 H new ATOM 0 HB2 ASP A 429 14.744 -7.130 13.119 1.00 0.69 H new ATOM 0 HB3 ASP A 429 13.228 -7.744 13.749 1.00 0.69 H new ATOM 505 N GLU A 430 12.687 -5.551 10.542 1.00 0.40 N ATOM 506 CA GLU A 430 12.114 -4.231 10.471 1.00 0.38 C ATOM 507 C GLU A 430 10.613 -4.271 10.521 1.00 0.31 C ATOM 508 O GLU A 430 9.985 -5.317 10.359 1.00 0.33 O ATOM 509 CB GLU A 430 12.570 -3.506 9.215 1.00 0.38 C ATOM 510 CG GLU A 430 14.021 -3.087 9.250 1.00 0.48 C ATOM 511 CD GLU A 430 14.395 -2.351 10.518 1.00 1.58 C ATOM 512 OE1 GLU A 430 14.822 -3.011 11.489 1.00 2.50 O ATOM 513 OE2 GLU A 430 14.264 -1.109 10.554 1.00 1.64 O ATOM 0 H GLU A 430 13.124 -5.872 9.678 1.00 0.40 H new ATOM 0 HA GLU A 430 12.468 -3.684 11.345 1.00 0.38 H new ATOM 0 HB2 GLU A 430 12.408 -4.154 8.353 1.00 0.38 H new ATOM 0 HB3 GLU A 430 11.949 -2.622 9.070 1.00 0.38 H new ATOM 0 HG2 GLU A 430 14.651 -3.971 9.151 1.00 0.48 H new ATOM 0 HG3 GLU A 430 14.230 -2.449 8.391 1.00 0.48 H new ATOM 520 N GLU A 431 10.053 -3.109 10.749 1.00 0.29 N ATOM 521 CA GLU A 431 8.647 -2.974 10.925 1.00 0.26 C ATOM 522 C GLU A 431 7.998 -2.690 9.583 1.00 0.24 C ATOM 523 O GLU A 431 8.644 -2.189 8.659 1.00 0.26 O ATOM 524 CB GLU A 431 8.342 -1.844 11.909 1.00 0.29 C ATOM 525 CG GLU A 431 8.271 -0.491 11.238 1.00 0.63 C ATOM 526 CD GLU A 431 7.814 0.617 12.161 1.00 0.87 C ATOM 527 OE1 GLU A 431 8.641 1.482 12.512 1.00 1.11 O ATOM 528 OE2 GLU A 431 6.636 0.609 12.571 1.00 1.05 O ATOM 0 H GLU A 431 10.571 -2.233 10.816 1.00 0.29 H new ATOM 0 HA GLU A 431 8.245 -3.902 11.332 1.00 0.26 H new ATOM 0 HB2 GLU A 431 7.395 -2.048 12.408 1.00 0.29 H new ATOM 0 HB3 GLU A 431 9.111 -1.822 12.681 1.00 0.29 H new ATOM 0 HG2 GLU A 431 9.254 -0.239 10.840 1.00 0.63 H new ATOM 0 HG3 GLU A 431 7.590 -0.550 10.389 1.00 0.63 H new ATOM 535 N PRO A 432 6.721 -3.021 9.464 1.00 0.23 N ATOM 536 CA PRO A 432 5.955 -2.721 8.276 1.00 0.21 C ATOM 537 C PRO A 432 5.818 -1.225 8.109 1.00 0.20 C ATOM 538 O PRO A 432 5.218 -0.540 8.944 1.00 0.24 O ATOM 539 CB PRO A 432 4.589 -3.377 8.507 1.00 0.24 C ATOM 540 CG PRO A 432 4.563 -3.807 9.946 1.00 0.23 C ATOM 541 CD PRO A 432 5.958 -3.691 10.500 1.00 0.24 C ATOM 0 HA PRO A 432 6.430 -3.094 7.369 1.00 0.21 H new ATOM 0 HB2 PRO A 432 3.781 -2.676 8.296 1.00 0.24 H new ATOM 0 HB3 PRO A 432 4.451 -4.231 7.844 1.00 0.24 H new ATOM 0 HG2 PRO A 432 3.875 -3.183 10.516 1.00 0.23 H new ATOM 0 HG3 PRO A 432 4.206 -4.833 10.029 1.00 0.23 H new ATOM 0 HD2 PRO A 432 5.967 -3.120 11.428 1.00 0.24 H new ATOM 0 HD3 PRO A 432 6.376 -4.672 10.725 1.00 0.24 H new ATOM 549 N LEU A 433 6.379 -0.728 7.026 1.00 0.20 N ATOM 550 CA LEU A 433 6.346 0.684 6.733 1.00 0.20 C ATOM 551 C LEU A 433 4.961 1.059 6.308 1.00 0.20 C ATOM 552 O LEU A 433 4.518 0.733 5.207 1.00 0.30 O ATOM 553 CB LEU A 433 7.330 1.016 5.632 1.00 0.22 C ATOM 554 CG LEU A 433 8.749 1.363 6.089 1.00 0.24 C ATOM 555 CD1 LEU A 433 9.725 1.253 4.932 1.00 0.65 C ATOM 556 CD2 LEU A 433 8.788 2.767 6.666 1.00 0.73 C ATOM 0 H LEU A 433 6.867 -1.291 6.329 1.00 0.20 H new ATOM 0 HA LEU A 433 6.625 1.245 7.625 1.00 0.20 H new ATOM 0 HB2 LEU A 433 7.385 0.166 4.952 1.00 0.22 H new ATOM 0 HB3 LEU A 433 6.937 1.857 5.061 1.00 0.22 H new ATOM 0 HG LEU A 433 9.042 0.653 6.862 1.00 0.24 H new ATOM 0 HD11 LEU A 433 10.728 1.504 5.277 1.00 0.65 H new ATOM 0 HD12 LEU A 433 9.718 0.234 4.546 1.00 0.65 H new ATOM 0 HD13 LEU A 433 9.431 1.943 4.141 1.00 0.65 H new ATOM 0 HD21 LEU A 433 9.803 3.000 6.987 1.00 0.73 H new ATOM 0 HD22 LEU A 433 8.475 3.482 5.905 1.00 0.73 H new ATOM 0 HD23 LEU A 433 8.114 2.828 7.521 1.00 0.73 H new ATOM 568 N GLN A 434 4.282 1.716 7.203 1.00 0.17 N ATOM 569 CA GLN A 434 2.913 2.080 6.986 1.00 0.17 C ATOM 570 C GLN A 434 2.780 3.508 6.539 1.00 0.20 C ATOM 571 O GLN A 434 3.357 4.431 7.115 1.00 0.27 O ATOM 572 CB GLN A 434 2.071 1.847 8.225 1.00 0.18 C ATOM 573 CG GLN A 434 1.484 0.455 8.302 1.00 0.21 C ATOM 574 CD GLN A 434 0.654 0.251 9.565 1.00 0.38 C ATOM 575 OE1 GLN A 434 0.136 1.217 10.122 1.00 1.26 O ATOM 576 NE2 GLN A 434 0.444 -0.993 9.997 1.00 0.74 N ATOM 0 H GLN A 434 4.661 2.014 8.102 1.00 0.17 H new ATOM 0 HA GLN A 434 2.543 1.435 6.189 1.00 0.17 H new ATOM 0 HB2 GLN A 434 2.683 2.024 9.109 1.00 0.18 H new ATOM 0 HB3 GLN A 434 1.261 2.576 8.247 1.00 0.18 H new ATOM 0 HG2 GLN A 434 0.860 0.276 7.426 1.00 0.21 H new ATOM 0 HG3 GLN A 434 2.289 -0.279 8.275 1.00 0.21 H new ATOM 0 HE21 GLN A 434 0.884 -1.780 9.520 1.00 0.74 H new ATOM 0 HE22 GLN A 434 -0.157 -1.158 10.805 1.00 0.74 H new ATOM 585 N PHE A 435 2.007 3.655 5.504 1.00 0.20 N ATOM 586 CA PHE A 435 1.717 4.953 4.917 1.00 0.23 C ATOM 587 C PHE A 435 0.220 5.137 4.742 1.00 0.21 C ATOM 588 O PHE A 435 -0.497 4.184 4.445 1.00 0.24 O ATOM 589 CB PHE A 435 2.422 5.098 3.569 1.00 0.25 C ATOM 590 CG PHE A 435 3.891 5.399 3.673 1.00 0.31 C ATOM 591 CD1 PHE A 435 4.810 4.373 3.824 1.00 0.36 C ATOM 592 CD2 PHE A 435 4.354 6.705 3.630 1.00 0.38 C ATOM 593 CE1 PHE A 435 6.159 4.642 3.928 1.00 0.43 C ATOM 594 CE2 PHE A 435 5.703 6.979 3.734 1.00 0.46 C ATOM 595 CZ PHE A 435 6.608 5.963 3.844 1.00 0.47 C ATOM 0 H PHE A 435 1.550 2.876 5.030 1.00 0.20 H new ATOM 0 HA PHE A 435 2.087 5.724 5.593 1.00 0.23 H new ATOM 0 HB2 PHE A 435 2.290 4.177 3.001 1.00 0.25 H new ATOM 0 HB3 PHE A 435 1.938 5.894 3.002 1.00 0.25 H new ATOM 0 HD1 PHE A 435 4.466 3.350 3.861 1.00 0.36 H new ATOM 0 HD2 PHE A 435 3.652 7.517 3.514 1.00 0.38 H new ATOM 0 HE1 PHE A 435 6.864 3.837 4.073 1.00 0.43 H new ATOM 0 HE2 PHE A 435 6.044 8.004 3.728 1.00 0.46 H new ATOM 0 HZ PHE A 435 7.666 6.179 3.866 1.00 0.47 H new ATOM 605 N ARG A 436 -0.243 6.362 4.940 1.00 0.22 N ATOM 606 CA ARG A 436 -1.654 6.683 4.804 1.00 0.21 C ATOM 607 C ARG A 436 -1.869 7.721 3.703 1.00 0.19 C ATOM 608 O ARG A 436 -1.503 8.886 3.860 1.00 0.27 O ATOM 609 CB ARG A 436 -2.208 7.219 6.127 1.00 0.27 C ATOM 610 CG ARG A 436 -2.366 6.154 7.195 1.00 0.72 C ATOM 611 CD ARG A 436 -2.693 6.738 8.558 1.00 0.74 C ATOM 612 NE ARG A 436 -4.050 7.278 8.617 1.00 1.52 N ATOM 613 CZ ARG A 436 -4.724 7.483 9.748 1.00 2.15 C ATOM 614 NH1 ARG A 436 -4.154 7.232 10.919 1.00 2.32 N ATOM 615 NH2 ARG A 436 -5.972 7.937 9.703 1.00 3.14 N ATOM 0 H ARG A 436 0.344 7.155 5.197 1.00 0.22 H new ATOM 0 HA ARG A 436 -2.184 5.769 4.536 1.00 0.21 H new ATOM 0 HB2 ARG A 436 -1.545 8.000 6.499 1.00 0.27 H new ATOM 0 HB3 ARG A 436 -3.176 7.684 5.944 1.00 0.27 H new ATOM 0 HG2 ARG A 436 -3.156 5.464 6.900 1.00 0.72 H new ATOM 0 HG3 ARG A 436 -1.446 5.574 7.264 1.00 0.72 H new ATOM 0 HD2 ARG A 436 -2.578 5.966 9.319 1.00 0.74 H new ATOM 0 HD3 ARG A 436 -1.979 7.527 8.794 1.00 0.74 H new ATOM 0 HE ARG A 436 -4.510 7.513 7.737 1.00 1.52 H new ATOM 0 HH11 ARG A 436 -3.197 6.881 10.956 1.00 2.32 H new ATOM 0 HH12 ARG A 436 -4.673 7.390 11.783 1.00 2.32 H new ATOM 0 HH21 ARG A 436 -6.413 8.128 8.803 1.00 3.14 H new ATOM 0 HH22 ARG A 436 -6.489 8.094 10.568 1.00 3.14 H new ATOM 629 N VAL A 437 -2.454 7.299 2.592 1.00 0.17 N ATOM 630 CA VAL A 437 -2.797 8.215 1.519 1.00 0.16 C ATOM 631 C VAL A 437 -4.299 8.405 1.462 1.00 0.16 C ATOM 632 O VAL A 437 -5.070 7.580 1.961 1.00 0.17 O ATOM 633 CB VAL A 437 -2.277 7.755 0.131 1.00 0.16 C ATOM 634 CG1 VAL A 437 -0.774 7.547 0.157 1.00 0.20 C ATOM 635 CG2 VAL A 437 -2.987 6.502 -0.354 1.00 0.14 C ATOM 0 H VAL A 437 -2.701 6.326 2.412 1.00 0.17 H new ATOM 0 HA VAL A 437 -2.302 9.159 1.746 1.00 0.16 H new ATOM 0 HB VAL A 437 -2.502 8.551 -0.578 1.00 0.16 H new ATOM 0 HG11 VAL A 437 -0.434 7.225 -0.827 1.00 0.20 H new ATOM 0 HG12 VAL A 437 -0.282 8.483 0.423 1.00 0.20 H new ATOM 0 HG13 VAL A 437 -0.525 6.784 0.894 1.00 0.20 H new ATOM 0 HG21 VAL A 437 -2.593 6.215 -1.329 1.00 0.14 H new ATOM 0 HG22 VAL A 437 -2.823 5.692 0.357 1.00 0.14 H new ATOM 0 HG23 VAL A 437 -4.056 6.699 -0.439 1.00 0.14 H new ATOM 645 N PRO A 438 -4.704 9.533 0.895 1.00 0.17 N ATOM 646 CA PRO A 438 -6.111 9.927 0.757 1.00 0.18 C ATOM 647 C PRO A 438 -6.952 8.820 0.104 1.00 0.16 C ATOM 648 O PRO A 438 -6.498 8.153 -0.823 1.00 0.14 O ATOM 649 CB PRO A 438 -6.011 11.169 -0.163 1.00 0.19 C ATOM 650 CG PRO A 438 -4.663 11.723 0.149 1.00 0.21 C ATOM 651 CD PRO A 438 -3.787 10.539 0.355 1.00 0.19 C ATOM 0 HA PRO A 438 -6.602 10.120 1.711 1.00 0.18 H new ATOM 0 HB2 PRO A 438 -6.100 10.898 -1.215 1.00 0.19 H new ATOM 0 HB3 PRO A 438 -6.801 11.890 0.048 1.00 0.19 H new ATOM 0 HG2 PRO A 438 -4.296 12.346 -0.667 1.00 0.21 H new ATOM 0 HG3 PRO A 438 -4.693 12.350 1.040 1.00 0.21 H new ATOM 0 HD2 PRO A 438 -3.331 10.208 -0.578 1.00 0.19 H new ATOM 0 HD3 PRO A 438 -2.974 10.756 1.048 1.00 0.19 H new ATOM 659 N GLY A 439 -8.177 8.642 0.591 1.00 0.19 N ATOM 660 CA GLY A 439 -9.012 7.534 0.173 1.00 0.20 C ATOM 661 C GLY A 439 -9.498 7.612 -1.262 1.00 0.18 C ATOM 662 O GLY A 439 -10.119 6.674 -1.760 1.00 0.20 O ATOM 0 H GLY A 439 -8.610 9.258 1.279 1.00 0.19 H new ATOM 0 HA2 GLY A 439 -8.454 6.607 0.303 1.00 0.20 H new ATOM 0 HA3 GLY A 439 -9.878 7.480 0.833 1.00 0.20 H new ATOM 666 N THR A 440 -9.264 8.718 -1.925 1.00 0.16 N ATOM 667 CA THR A 440 -9.658 8.834 -3.310 1.00 0.18 C ATOM 668 C THR A 440 -8.471 8.529 -4.240 1.00 0.16 C ATOM 669 O THR A 440 -8.655 8.212 -5.417 1.00 0.19 O ATOM 670 CB THR A 440 -10.199 10.239 -3.592 1.00 0.24 C ATOM 671 OG1 THR A 440 -9.389 11.213 -2.920 1.00 0.27 O ATOM 672 CG2 THR A 440 -11.644 10.368 -3.132 1.00 0.29 C ATOM 0 H THR A 440 -8.808 9.543 -1.535 1.00 0.16 H new ATOM 0 HA THR A 440 -10.446 8.106 -3.504 1.00 0.18 H new ATOM 0 HB THR A 440 -10.164 10.412 -4.668 1.00 0.24 H new ATOM 0 HG1 THR A 440 -9.737 12.111 -3.104 1.00 0.27 H new ATOM 0 HG21 THR A 440 -12.005 11.375 -3.343 1.00 0.29 H new ATOM 0 HG22 THR A 440 -12.261 9.643 -3.663 1.00 0.29 H new ATOM 0 HG23 THR A 440 -11.703 10.179 -2.060 1.00 0.29 H new ATOM 680 N SER A 441 -7.254 8.622 -3.691 1.00 0.13 N ATOM 681 CA SER A 441 -6.026 8.345 -4.424 1.00 0.12 C ATOM 682 C SER A 441 -5.914 6.867 -4.803 1.00 0.11 C ATOM 683 O SER A 441 -6.351 5.992 -4.061 1.00 0.12 O ATOM 684 CB SER A 441 -4.833 8.744 -3.555 1.00 0.13 C ATOM 685 OG SER A 441 -4.861 10.130 -3.254 1.00 0.16 O ATOM 0 H SER A 441 -7.099 8.893 -2.720 1.00 0.13 H new ATOM 0 HA SER A 441 -6.038 8.923 -5.348 1.00 0.12 H new ATOM 0 HB2 SER A 441 -4.844 8.168 -2.630 1.00 0.13 H new ATOM 0 HB3 SER A 441 -3.905 8.500 -4.072 1.00 0.13 H new ATOM 0 HG SER A 441 -4.089 10.359 -2.696 1.00 0.16 H new ATOM 691 N THR A 442 -5.325 6.592 -5.958 1.00 0.10 N ATOM 692 CA THR A 442 -5.163 5.221 -6.407 1.00 0.12 C ATOM 693 C THR A 442 -3.700 4.905 -6.721 1.00 0.13 C ATOM 694 O THR A 442 -3.396 3.898 -7.356 1.00 0.16 O ATOM 695 CB THR A 442 -6.047 4.924 -7.639 1.00 0.13 C ATOM 696 OG1 THR A 442 -5.812 5.904 -8.660 1.00 0.14 O ATOM 697 CG2 THR A 442 -7.526 4.914 -7.257 1.00 0.17 C ATOM 0 H THR A 442 -4.954 7.296 -6.596 1.00 0.10 H new ATOM 0 HA THR A 442 -5.485 4.577 -5.589 1.00 0.12 H new ATOM 0 HB THR A 442 -5.783 3.937 -8.020 1.00 0.13 H new ATOM 0 HG1 THR A 442 -6.375 5.707 -9.438 1.00 0.14 H new ATOM 0 HG21 THR A 442 -8.129 4.703 -8.140 1.00 0.17 H new ATOM 0 HG22 THR A 442 -7.702 4.145 -6.505 1.00 0.17 H new ATOM 0 HG23 THR A 442 -7.804 5.887 -6.852 1.00 0.17 H new ATOM 705 N SER A 443 -2.791 5.767 -6.273 1.00 0.12 N ATOM 706 CA SER A 443 -1.361 5.574 -6.504 1.00 0.15 C ATOM 707 C SER A 443 -0.549 6.378 -5.493 1.00 0.15 C ATOM 708 O SER A 443 -0.970 7.453 -5.063 1.00 0.19 O ATOM 709 CB SER A 443 -0.963 5.999 -7.924 1.00 0.17 C ATOM 710 OG SER A 443 -1.781 5.392 -8.909 1.00 1.08 O ATOM 0 H SER A 443 -3.020 6.610 -5.746 1.00 0.12 H new ATOM 0 HA SER A 443 -1.149 4.511 -6.385 1.00 0.15 H new ATOM 0 HB2 SER A 443 -1.035 7.083 -8.011 1.00 0.17 H new ATOM 0 HB3 SER A 443 0.079 5.733 -8.104 1.00 0.17 H new ATOM 0 HG SER A 443 -2.227 4.608 -8.526 1.00 1.08 H new ATOM 716 N ALA A 444 0.601 5.846 -5.110 1.00 0.14 N ATOM 717 CA ALA A 444 1.504 6.527 -4.185 1.00 0.15 C ATOM 718 C ALA A 444 2.938 6.240 -4.513 1.00 0.16 C ATOM 719 O ALA A 444 3.299 5.143 -4.939 1.00 0.15 O ATOM 720 CB ALA A 444 1.219 6.135 -2.745 1.00 0.16 C ATOM 0 H ALA A 444 0.937 4.936 -5.427 1.00 0.14 H new ATOM 0 HA ALA A 444 1.327 7.597 -4.297 1.00 0.15 H new ATOM 0 HB1 ALA A 444 1.908 6.659 -2.082 1.00 0.16 H new ATOM 0 HB2 ALA A 444 0.194 6.405 -2.490 1.00 0.16 H new ATOM 0 HB3 ALA A 444 1.350 5.059 -2.628 1.00 0.16 H new ATOM 726 N THR A 445 3.737 7.257 -4.328 1.00 0.24 N ATOM 727 CA THR A 445 5.156 7.159 -4.486 1.00 0.25 C ATOM 728 C THR A 445 5.796 6.879 -3.140 1.00 0.26 C ATOM 729 O THR A 445 5.956 7.769 -2.305 1.00 0.33 O ATOM 730 CB THR A 445 5.699 8.452 -5.071 1.00 0.31 C ATOM 731 OG1 THR A 445 5.180 8.629 -6.398 1.00 0.34 O ATOM 732 CG2 THR A 445 7.225 8.438 -5.096 1.00 0.34 C ATOM 0 H THR A 445 3.413 8.186 -4.060 1.00 0.24 H new ATOM 0 HA THR A 445 5.392 6.342 -5.168 1.00 0.25 H new ATOM 0 HB THR A 445 5.381 9.285 -4.443 1.00 0.31 H new ATOM 0 HG1 THR A 445 5.627 8.008 -7.010 1.00 0.34 H new ATOM 0 HG21 THR A 445 7.591 9.374 -5.519 1.00 0.34 H new ATOM 0 HG22 THR A 445 7.605 8.326 -4.080 1.00 0.34 H new ATOM 0 HG23 THR A 445 7.571 7.604 -5.707 1.00 0.34 H new ATOM 740 N LEU A 446 6.128 5.629 -2.942 1.00 0.22 N ATOM 741 CA LEU A 446 6.639 5.163 -1.663 1.00 0.25 C ATOM 742 C LEU A 446 8.097 5.527 -1.447 1.00 0.24 C ATOM 743 O LEU A 446 9.004 4.774 -1.795 1.00 0.23 O ATOM 744 CB LEU A 446 6.408 3.643 -1.521 1.00 0.25 C ATOM 745 CG LEU A 446 5.058 3.246 -0.922 1.00 0.32 C ATOM 746 CD1 LEU A 446 4.845 1.741 -1.015 1.00 0.65 C ATOM 747 CD2 LEU A 446 4.988 3.689 0.520 1.00 0.59 C ATOM 0 H LEU A 446 6.055 4.903 -3.654 1.00 0.22 H new ATOM 0 HA LEU A 446 6.082 5.678 -0.880 1.00 0.25 H new ATOM 0 HB2 LEU A 446 6.501 3.183 -2.505 1.00 0.25 H new ATOM 0 HB3 LEU A 446 7.201 3.227 -0.899 1.00 0.25 H new ATOM 0 HG LEU A 446 4.269 3.739 -1.491 1.00 0.32 H new ATOM 0 HD11 LEU A 446 3.878 1.483 -0.583 1.00 0.65 H new ATOM 0 HD12 LEU A 446 4.868 1.434 -2.061 1.00 0.65 H new ATOM 0 HD13 LEU A 446 5.636 1.227 -0.468 1.00 0.65 H new ATOM 0 HD21 LEU A 446 4.024 3.404 0.942 1.00 0.59 H new ATOM 0 HD22 LEU A 446 5.788 3.212 1.086 1.00 0.59 H new ATOM 0 HD23 LEU A 446 5.101 4.772 0.574 1.00 0.59 H new ATOM 759 N THR A 447 8.294 6.699 -0.861 1.00 0.30 N ATOM 760 CA THR A 447 9.608 7.148 -0.435 1.00 0.30 C ATOM 761 C THR A 447 9.963 6.564 0.927 1.00 0.29 C ATOM 762 O THR A 447 9.279 6.816 1.921 1.00 0.36 O ATOM 763 CB THR A 447 9.666 8.681 -0.326 1.00 0.39 C ATOM 764 OG1 THR A 447 8.375 9.203 0.014 1.00 0.86 O ATOM 765 CG2 THR A 447 10.162 9.324 -1.604 1.00 0.60 C ATOM 0 H THR A 447 7.546 7.365 -0.668 1.00 0.30 H new ATOM 0 HA THR A 447 10.319 6.807 -1.188 1.00 0.30 H new ATOM 0 HB THR A 447 10.377 8.923 0.463 1.00 0.39 H new ATOM 0 HG1 THR A 447 8.425 10.179 0.082 1.00 0.86 H new ATOM 0 HG21 THR A 447 10.186 10.407 -1.481 1.00 0.60 H new ATOM 0 HG22 THR A 447 11.165 8.962 -1.828 1.00 0.60 H new ATOM 0 HG23 THR A 447 9.492 9.067 -2.424 1.00 0.60 H new ATOM 773 N GLY A 448 11.013 5.773 0.973 1.00 0.30 N ATOM 774 CA GLY A 448 11.500 5.287 2.250 1.00 0.38 C ATOM 775 C GLY A 448 12.019 3.868 2.204 1.00 0.30 C ATOM 776 O GLY A 448 12.914 3.512 2.970 1.00 0.38 O ATOM 0 H GLY A 448 11.539 5.456 0.159 1.00 0.30 H new ATOM 0 HA2 GLY A 448 12.296 5.944 2.599 1.00 0.38 H new ATOM 0 HA3 GLY A 448 10.695 5.346 2.982 1.00 0.38 H new ATOM 780 N LEU A 449 11.450 3.054 1.324 1.00 0.28 N ATOM 781 CA LEU A 449 11.845 1.661 1.203 1.00 0.25 C ATOM 782 C LEU A 449 13.349 1.512 0.983 1.00 0.25 C ATOM 783 O LEU A 449 13.924 2.087 0.055 1.00 0.34 O ATOM 784 CB LEU A 449 11.064 0.986 0.078 1.00 0.24 C ATOM 785 CG LEU A 449 9.542 1.007 0.236 1.00 0.21 C ATOM 786 CD1 LEU A 449 8.870 0.470 -1.014 1.00 0.27 C ATOM 787 CD2 LEU A 449 9.120 0.188 1.435 1.00 0.23 C ATOM 0 H LEU A 449 10.710 3.339 0.682 1.00 0.28 H new ATOM 0 HA LEU A 449 11.607 1.166 2.145 1.00 0.25 H new ATOM 0 HB2 LEU A 449 11.322 1.471 -0.863 1.00 0.24 H new ATOM 0 HB3 LEU A 449 11.391 -0.051 0.002 1.00 0.24 H new ATOM 0 HG LEU A 449 9.232 2.041 0.388 1.00 0.21 H new ATOM 0 HD11 LEU A 449 7.788 0.492 -0.884 1.00 0.27 H new ATOM 0 HD12 LEU A 449 9.145 1.088 -1.869 1.00 0.27 H new ATOM 0 HD13 LEU A 449 9.193 -0.556 -1.189 1.00 0.27 H new ATOM 0 HD21 LEU A 449 8.035 0.215 1.530 1.00 0.23 H new ATOM 0 HD22 LEU A 449 9.447 -0.844 1.304 1.00 0.23 H new ATOM 0 HD23 LEU A 449 9.574 0.601 2.336 1.00 0.23 H new ATOM 799 N THR A 450 13.970 0.759 1.878 1.00 0.22 N ATOM 800 CA THR A 450 15.390 0.463 1.819 1.00 0.23 C ATOM 801 C THR A 450 15.671 -0.515 0.698 1.00 0.22 C ATOM 802 O THR A 450 14.869 -1.399 0.392 1.00 0.38 O ATOM 803 CB THR A 450 15.847 -0.115 3.178 1.00 0.27 C ATOM 804 OG1 THR A 450 15.446 0.772 4.233 1.00 0.32 O ATOM 805 CG2 THR A 450 17.351 -0.326 3.248 1.00 0.34 C ATOM 0 H THR A 450 13.495 0.332 2.674 1.00 0.22 H new ATOM 0 HA THR A 450 15.947 1.378 1.618 1.00 0.23 H new ATOM 0 HB THR A 450 15.373 -1.090 3.290 1.00 0.27 H new ATOM 0 HG1 THR A 450 15.734 0.406 5.095 1.00 0.32 H new ATOM 0 HG21 THR A 450 17.616 -0.733 4.224 1.00 0.34 H new ATOM 0 HG22 THR A 450 17.657 -1.023 2.468 1.00 0.34 H new ATOM 0 HG23 THR A 450 17.859 0.627 3.102 1.00 0.34 H new ATOM 813 N ARG A 451 16.823 -0.345 0.100 1.00 0.29 N ATOM 814 CA ARG A 451 17.156 -1.037 -1.120 1.00 0.26 C ATOM 815 C ARG A 451 18.127 -2.155 -0.860 1.00 0.26 C ATOM 816 O ARG A 451 19.137 -1.999 -0.174 1.00 0.30 O ATOM 817 CB ARG A 451 17.662 -0.052 -2.164 1.00 0.31 C ATOM 818 CG ARG A 451 18.814 0.782 -1.676 1.00 0.32 C ATOM 819 CD ARG A 451 19.206 1.834 -2.681 1.00 0.43 C ATOM 820 NE ARG A 451 19.609 1.257 -3.965 1.00 1.32 N ATOM 821 CZ ARG A 451 20.066 1.970 -4.996 1.00 1.75 C ATOM 822 NH1 ARG A 451 20.239 3.283 -4.878 1.00 1.39 N ATOM 823 NH2 ARG A 451 20.376 1.362 -6.135 1.00 2.70 N ATOM 0 H ARG A 451 17.556 0.276 0.444 1.00 0.29 H new ATOM 0 HA ARG A 451 16.255 -1.500 -1.522 1.00 0.26 H new ATOM 0 HB2 ARG A 451 17.969 -0.601 -3.054 1.00 0.31 H new ATOM 0 HB3 ARG A 451 16.845 0.605 -2.461 1.00 0.31 H new ATOM 0 HG2 ARG A 451 18.544 1.261 -0.735 1.00 0.32 H new ATOM 0 HG3 ARG A 451 19.669 0.137 -1.472 1.00 0.32 H new ATOM 0 HD2 ARG A 451 18.368 2.513 -2.838 1.00 0.43 H new ATOM 0 HD3 ARG A 451 20.027 2.428 -2.279 1.00 0.43 H new ATOM 0 HE ARG A 451 19.536 0.246 -4.078 1.00 1.32 H new ATOM 0 HH11 ARG A 451 20.022 3.749 -3.997 1.00 1.39 H new ATOM 0 HH12 ARG A 451 20.589 3.824 -5.669 1.00 1.39 H new ATOM 0 HH21 ARG A 451 20.265 0.352 -6.221 1.00 2.70 H new ATOM 0 HH22 ARG A 451 20.726 1.905 -6.924 1.00 2.70 H new ATOM 837 N GLY A 452 17.773 -3.288 -1.411 1.00 0.28 N ATOM 838 CA GLY A 452 18.428 -4.520 -1.103 1.00 0.34 C ATOM 839 C GLY A 452 17.579 -5.333 -0.157 1.00 0.32 C ATOM 840 O GLY A 452 17.890 -6.482 0.167 1.00 0.41 O ATOM 0 H GLY A 452 17.016 -3.375 -2.090 1.00 0.28 H new ATOM 0 HA2 GLY A 452 18.609 -5.084 -2.018 1.00 0.34 H new ATOM 0 HA3 GLY A 452 19.401 -4.322 -0.653 1.00 0.34 H new ATOM 844 N ALA A 453 16.488 -4.715 0.267 1.00 0.32 N ATOM 845 CA ALA A 453 15.545 -5.323 1.182 1.00 0.31 C ATOM 846 C ALA A 453 14.253 -5.615 0.473 1.00 0.27 C ATOM 847 O ALA A 453 13.916 -5.007 -0.545 1.00 0.35 O ATOM 848 CB ALA A 453 15.304 -4.411 2.375 1.00 0.32 C ATOM 0 H ALA A 453 16.233 -3.770 -0.019 1.00 0.32 H new ATOM 0 HA ALA A 453 15.963 -6.262 1.545 1.00 0.31 H new ATOM 0 HB1 ALA A 453 14.593 -4.881 3.054 1.00 0.32 H new ATOM 0 HB2 ALA A 453 16.245 -4.238 2.897 1.00 0.32 H new ATOM 0 HB3 ALA A 453 14.901 -3.459 2.030 1.00 0.32 H new ATOM 854 N THR A 454 13.557 -6.562 1.024 1.00 0.23 N ATOM 855 CA THR A 454 12.345 -7.057 0.453 1.00 0.21 C ATOM 856 C THR A 454 11.150 -6.580 1.255 1.00 0.17 C ATOM 857 O THR A 454 11.128 -6.705 2.474 1.00 0.19 O ATOM 858 CB THR A 454 12.404 -8.582 0.446 1.00 0.22 C ATOM 859 OG1 THR A 454 13.436 -9.035 -0.427 1.00 0.29 O ATOM 860 CG2 THR A 454 11.080 -9.186 0.004 1.00 0.24 C ATOM 0 H THR A 454 13.821 -7.019 1.897 1.00 0.23 H new ATOM 0 HA THR A 454 12.236 -6.684 -0.566 1.00 0.21 H new ATOM 0 HB THR A 454 12.614 -8.905 1.466 1.00 0.22 H new ATOM 0 HG1 THR A 454 13.463 -10.015 -0.420 1.00 0.29 H new ATOM 0 HG21 THR A 454 11.156 -10.273 0.010 1.00 0.24 H new ATOM 0 HG22 THR A 454 10.291 -8.874 0.688 1.00 0.24 H new ATOM 0 HG23 THR A 454 10.843 -8.845 -1.004 1.00 0.24 H new ATOM 868 N TYR A 455 10.174 -6.011 0.578 1.00 0.16 N ATOM 869 CA TYR A 455 8.972 -5.548 1.241 1.00 0.16 C ATOM 870 C TYR A 455 7.739 -6.167 0.610 1.00 0.13 C ATOM 871 O TYR A 455 7.548 -6.094 -0.604 1.00 0.15 O ATOM 872 CB TYR A 455 8.869 -4.025 1.176 1.00 0.23 C ATOM 873 CG TYR A 455 9.972 -3.297 1.910 1.00 0.22 C ATOM 874 CD1 TYR A 455 9.864 -3.019 3.267 1.00 0.20 C ATOM 875 CD2 TYR A 455 11.114 -2.874 1.243 1.00 0.28 C ATOM 876 CE1 TYR A 455 10.861 -2.338 3.936 1.00 0.22 C ATOM 877 CE2 TYR A 455 12.116 -2.198 1.907 1.00 0.30 C ATOM 878 CZ TYR A 455 11.986 -1.930 3.251 1.00 0.26 C ATOM 879 OH TYR A 455 12.977 -1.241 3.907 1.00 0.29 O ATOM 0 H TYR A 455 10.189 -5.858 -0.430 1.00 0.16 H new ATOM 0 HA TYR A 455 9.029 -5.855 2.285 1.00 0.16 H new ATOM 0 HB2 TYR A 455 8.878 -3.716 0.131 1.00 0.23 H new ATOM 0 HB3 TYR A 455 7.909 -3.719 1.591 1.00 0.23 H new ATOM 0 HD1 TYR A 455 8.986 -3.341 3.807 1.00 0.20 H new ATOM 0 HD2 TYR A 455 11.219 -3.078 0.188 1.00 0.28 H new ATOM 0 HE1 TYR A 455 10.760 -2.126 4.990 1.00 0.22 H new ATOM 0 HE2 TYR A 455 13.000 -1.880 1.374 1.00 0.30 H new ATOM 0 HH TYR A 455 13.538 -1.871 4.406 1.00 0.29 H new ATOM 889 N ASN A 456 6.926 -6.805 1.429 1.00 0.12 N ATOM 890 CA ASN A 456 5.624 -7.260 0.992 1.00 0.12 C ATOM 891 C ASN A 456 4.656 -6.108 1.142 1.00 0.13 C ATOM 892 O ASN A 456 4.223 -5.769 2.246 1.00 0.15 O ATOM 893 CB ASN A 456 5.165 -8.483 1.796 1.00 0.14 C ATOM 894 CG ASN A 456 3.955 -9.172 1.158 1.00 0.17 C ATOM 895 OD1 ASN A 456 3.690 -8.975 -0.025 1.00 0.17 O ATOM 896 ND2 ASN A 456 3.241 -10.019 1.902 1.00 0.20 N ATOM 0 H ASN A 456 7.146 -7.019 2.402 1.00 0.12 H new ATOM 0 HA ASN A 456 5.668 -7.574 -0.051 1.00 0.12 H new ATOM 0 HB2 ASN A 456 5.987 -9.194 1.874 1.00 0.14 H new ATOM 0 HB3 ASN A 456 4.913 -8.175 2.811 1.00 0.14 H new ATOM 0 HD21 ASN A 456 2.454 -10.521 1.490 1.00 0.20 H new ATOM 0 HD22 ASN A 456 3.482 -10.165 2.882 1.00 0.20 H new ATOM 903 N ILE A 457 4.367 -5.493 0.018 1.00 0.13 N ATOM 904 CA ILE A 457 3.618 -4.261 -0.028 1.00 0.14 C ATOM 905 C ILE A 457 2.126 -4.550 -0.012 1.00 0.14 C ATOM 906 O ILE A 457 1.556 -5.014 -1.000 1.00 0.18 O ATOM 907 CB ILE A 457 3.999 -3.449 -1.282 1.00 0.16 C ATOM 908 CG1 ILE A 457 5.471 -3.014 -1.203 1.00 0.19 C ATOM 909 CG2 ILE A 457 3.082 -2.234 -1.444 1.00 0.18 C ATOM 910 CD1 ILE A 457 5.898 -2.063 -2.305 1.00 0.22 C ATOM 0 H ILE A 457 4.649 -5.839 -0.899 1.00 0.13 H new ATOM 0 HA ILE A 457 3.864 -3.669 0.854 1.00 0.14 H new ATOM 0 HB ILE A 457 3.870 -4.084 -2.158 1.00 0.16 H new ATOM 0 HG12 ILE A 457 5.646 -2.537 -0.239 1.00 0.19 H new ATOM 0 HG13 ILE A 457 6.103 -3.901 -1.239 1.00 0.19 H new ATOM 0 HG21 ILE A 457 3.370 -1.677 -2.335 1.00 0.18 H new ATOM 0 HG22 ILE A 457 2.049 -2.568 -1.543 1.00 0.18 H new ATOM 0 HG23 ILE A 457 3.173 -1.591 -0.569 1.00 0.18 H new ATOM 0 HD11 ILE A 457 6.949 -1.805 -2.176 1.00 0.22 H new ATOM 0 HD12 ILE A 457 5.758 -2.542 -3.274 1.00 0.22 H new ATOM 0 HD13 ILE A 457 5.294 -1.157 -2.258 1.00 0.22 H new ATOM 922 N ILE A 458 1.514 -4.290 1.124 1.00 0.16 N ATOM 923 CA ILE A 458 0.110 -4.583 1.330 1.00 0.18 C ATOM 924 C ILE A 458 -0.686 -3.294 1.481 1.00 0.20 C ATOM 925 O ILE A 458 -0.464 -2.525 2.403 1.00 0.29 O ATOM 926 CB ILE A 458 -0.079 -5.475 2.570 1.00 0.22 C ATOM 927 CG1 ILE A 458 0.489 -6.864 2.294 1.00 0.21 C ATOM 928 CG2 ILE A 458 -1.543 -5.567 2.962 1.00 0.29 C ATOM 929 CD1 ILE A 458 0.323 -7.814 3.448 1.00 0.27 C ATOM 0 H ILE A 458 1.975 -3.870 1.931 1.00 0.16 H new ATOM 0 HA ILE A 458 -0.260 -5.120 0.457 1.00 0.18 H new ATOM 0 HB ILE A 458 0.459 -5.026 3.405 1.00 0.22 H new ATOM 0 HG12 ILE A 458 -0.002 -7.282 1.415 1.00 0.21 H new ATOM 0 HG13 ILE A 458 1.549 -6.775 2.055 1.00 0.21 H new ATOM 0 HG21 ILE A 458 -1.645 -6.204 3.841 1.00 0.29 H new ATOM 0 HG22 ILE A 458 -1.922 -4.571 3.190 1.00 0.29 H new ATOM 0 HG23 ILE A 458 -2.114 -5.993 2.137 1.00 0.29 H new ATOM 0 HD11 ILE A 458 0.748 -8.783 3.186 1.00 0.27 H new ATOM 0 HD12 ILE A 458 0.838 -7.417 4.323 1.00 0.27 H new ATOM 0 HD13 ILE A 458 -0.737 -7.932 3.673 1.00 0.27 H new ATOM 941 N VAL A 459 -1.610 -3.065 0.569 1.00 0.17 N ATOM 942 CA VAL A 459 -2.379 -1.838 0.557 1.00 0.18 C ATOM 943 C VAL A 459 -3.799 -2.137 0.988 1.00 0.18 C ATOM 944 O VAL A 459 -4.506 -2.894 0.322 1.00 0.23 O ATOM 945 CB VAL A 459 -2.408 -1.189 -0.844 1.00 0.19 C ATOM 946 CG1 VAL A 459 -2.955 0.225 -0.771 1.00 0.20 C ATOM 947 CG2 VAL A 459 -1.029 -1.203 -1.496 1.00 0.20 C ATOM 0 H VAL A 459 -1.847 -3.718 -0.178 1.00 0.17 H new ATOM 0 HA VAL A 459 -1.902 -1.139 1.244 1.00 0.18 H new ATOM 0 HB VAL A 459 -3.074 -1.784 -1.469 1.00 0.19 H new ATOM 0 HG11 VAL A 459 -2.966 0.663 -1.769 1.00 0.20 H new ATOM 0 HG12 VAL A 459 -3.970 0.203 -0.373 1.00 0.20 H new ATOM 0 HG13 VAL A 459 -2.322 0.827 -0.118 1.00 0.20 H new ATOM 0 HG21 VAL A 459 -1.087 -0.738 -2.480 1.00 0.20 H new ATOM 0 HG22 VAL A 459 -0.327 -0.648 -0.874 1.00 0.20 H new ATOM 0 HG23 VAL A 459 -0.686 -2.232 -1.600 1.00 0.20 H new ATOM 957 N GLU A 460 -4.204 -1.570 2.107 1.00 0.18 N ATOM 958 CA GLU A 460 -5.543 -1.794 2.610 1.00 0.22 C ATOM 959 C GLU A 460 -6.368 -0.524 2.558 1.00 0.21 C ATOM 960 O GLU A 460 -5.877 0.573 2.821 1.00 0.30 O ATOM 961 CB GLU A 460 -5.526 -2.336 4.031 1.00 0.30 C ATOM 962 CG GLU A 460 -4.834 -3.677 4.167 1.00 0.36 C ATOM 963 CD GLU A 460 -5.356 -4.475 5.336 1.00 0.60 C ATOM 964 OE1 GLU A 460 -4.932 -4.214 6.476 1.00 0.79 O ATOM 965 OE2 GLU A 460 -6.192 -5.371 5.117 1.00 0.82 O ATOM 0 H GLU A 460 -3.628 -0.954 2.682 1.00 0.18 H new ATOM 0 HA GLU A 460 -6.002 -2.540 1.962 1.00 0.22 H new ATOM 0 HB2 GLU A 460 -5.029 -1.614 4.679 1.00 0.30 H new ATOM 0 HB3 GLU A 460 -6.552 -2.430 4.386 1.00 0.30 H new ATOM 0 HG2 GLU A 460 -4.971 -4.249 3.249 1.00 0.36 H new ATOM 0 HG3 GLU A 460 -3.762 -3.520 4.287 1.00 0.36 H new ATOM 972 N ALA A 461 -7.628 -0.702 2.225 1.00 0.16 N ATOM 973 CA ALA A 461 -8.567 0.391 2.114 1.00 0.15 C ATOM 974 C ALA A 461 -9.221 0.676 3.435 1.00 0.14 C ATOM 975 O ALA A 461 -9.931 -0.162 3.990 1.00 0.17 O ATOM 976 CB ALA A 461 -9.608 0.071 1.058 1.00 0.16 C ATOM 0 H ALA A 461 -8.032 -1.616 2.022 1.00 0.16 H new ATOM 0 HA ALA A 461 -8.023 1.287 1.814 1.00 0.15 H new ATOM 0 HB1 ALA A 461 -10.313 0.899 0.979 1.00 0.16 H new ATOM 0 HB2 ALA A 461 -9.117 -0.080 0.097 1.00 0.16 H new ATOM 0 HB3 ALA A 461 -10.144 -0.836 1.338 1.00 0.16 H new ATOM 982 N LEU A 462 -8.958 1.865 3.924 1.00 0.16 N ATOM 983 CA LEU A 462 -9.569 2.349 5.127 1.00 0.20 C ATOM 984 C LEU A 462 -10.945 2.895 4.775 1.00 0.22 C ATOM 985 O LEU A 462 -11.070 4.011 4.281 1.00 0.24 O ATOM 986 CB LEU A 462 -8.706 3.442 5.770 1.00 0.25 C ATOM 987 CG LEU A 462 -8.595 3.316 7.289 1.00 0.34 C ATOM 988 CD1 LEU A 462 -7.575 4.267 7.874 1.00 0.85 C ATOM 989 CD2 LEU A 462 -9.939 3.546 7.929 1.00 0.78 C ATOM 0 H LEU A 462 -8.310 2.523 3.492 1.00 0.16 H new ATOM 0 HA LEU A 462 -9.663 1.537 5.848 1.00 0.20 H new ATOM 0 HB2 LEU A 462 -7.707 3.407 5.336 1.00 0.25 H new ATOM 0 HB3 LEU A 462 -9.126 4.417 5.524 1.00 0.25 H new ATOM 0 HG LEU A 462 -8.254 2.303 7.503 1.00 0.34 H new ATOM 0 HD11 LEU A 462 -7.535 4.137 8.956 1.00 0.85 H new ATOM 0 HD12 LEU A 462 -6.594 4.057 7.447 1.00 0.85 H new ATOM 0 HD13 LEU A 462 -7.859 5.293 7.642 1.00 0.85 H new ATOM 0 HD21 LEU A 462 -9.847 3.454 9.011 1.00 0.78 H new ATOM 0 HD22 LEU A 462 -10.295 4.546 7.679 1.00 0.78 H new ATOM 0 HD23 LEU A 462 -10.649 2.805 7.561 1.00 0.78 H new ATOM 1001 N LYS A 463 -11.967 2.098 5.009 1.00 0.23 N ATOM 1002 CA LYS A 463 -13.319 2.457 4.631 1.00 0.30 C ATOM 1003 C LYS A 463 -14.232 2.202 5.810 1.00 0.40 C ATOM 1004 O LYS A 463 -14.312 1.073 6.285 1.00 0.50 O ATOM 1005 CB LYS A 463 -13.765 1.623 3.427 1.00 0.31 C ATOM 1006 CG LYS A 463 -15.167 1.945 2.917 1.00 0.38 C ATOM 1007 CD LYS A 463 -15.189 3.107 1.934 1.00 0.42 C ATOM 1008 CE LYS A 463 -16.611 3.558 1.635 1.00 0.95 C ATOM 1009 NZ LYS A 463 -17.281 4.129 2.836 1.00 1.62 N ATOM 0 H LYS A 463 -11.886 1.189 5.464 1.00 0.23 H new ATOM 0 HA LYS A 463 -13.361 3.510 4.353 1.00 0.30 H new ATOM 0 HB2 LYS A 463 -13.054 1.772 2.615 1.00 0.31 H new ATOM 0 HB3 LYS A 463 -13.724 0.568 3.697 1.00 0.31 H new ATOM 0 HG2 LYS A 463 -15.585 1.061 2.435 1.00 0.38 H new ATOM 0 HG3 LYS A 463 -15.811 2.181 3.764 1.00 0.38 H new ATOM 0 HD2 LYS A 463 -14.620 3.942 2.343 1.00 0.42 H new ATOM 0 HD3 LYS A 463 -14.698 2.810 1.007 1.00 0.42 H new ATOM 0 HE2 LYS A 463 -16.595 4.304 0.840 1.00 0.95 H new ATOM 0 HE3 LYS A 463 -17.190 2.711 1.266 1.00 0.95 H new ATOM 0 HZ1 LYS A 463 -18.133 4.648 2.544 1.00 1.62 H new ATOM 0 HZ2 LYS A 463 -17.549 3.360 3.483 1.00 1.62 H new ATOM 0 HZ3 LYS A 463 -16.629 4.778 3.321 1.00 1.62 H new ATOM 1023 N ASP A 464 -14.935 3.232 6.266 1.00 0.58 N ATOM 1024 CA ASP A 464 -15.711 3.119 7.531 1.00 0.61 C ATOM 1025 C ASP A 464 -14.932 2.399 8.637 1.00 0.51 C ATOM 1026 O ASP A 464 -15.267 1.272 9.010 1.00 0.53 O ATOM 1027 CB ASP A 464 -17.000 2.359 7.321 1.00 0.72 C ATOM 1028 CG ASP A 464 -17.864 2.939 6.215 1.00 1.08 C ATOM 1029 OD1 ASP A 464 -17.706 2.523 5.050 1.00 1.85 O ATOM 1030 OD2 ASP A 464 -18.718 3.808 6.507 1.00 1.15 O ATOM 0 H ASP A 464 -14.995 4.140 5.805 1.00 0.58 H new ATOM 0 HA ASP A 464 -15.913 4.145 7.837 1.00 0.61 H new ATOM 0 HB2 ASP A 464 -16.767 1.321 7.085 1.00 0.72 H new ATOM 0 HB3 ASP A 464 -17.567 2.355 8.252 1.00 0.72 H new ATOM 1035 N GLN A 465 -13.932 3.077 9.167 1.00 0.52 N ATOM 1036 CA GLN A 465 -13.024 2.562 10.198 1.00 0.49 C ATOM 1037 C GLN A 465 -12.260 1.274 9.821 1.00 0.44 C ATOM 1038 O GLN A 465 -11.256 0.954 10.455 1.00 0.66 O ATOM 1039 CB GLN A 465 -13.788 2.332 11.498 1.00 0.56 C ATOM 1040 CG GLN A 465 -14.583 3.545 11.942 1.00 0.67 C ATOM 1041 CD GLN A 465 -15.306 3.319 13.253 1.00 0.78 C ATOM 1042 OE1 GLN A 465 -16.447 2.858 13.276 1.00 1.32 O ATOM 1043 NE2 GLN A 465 -14.648 3.646 14.351 1.00 1.39 N ATOM 0 H GLN A 465 -13.714 4.034 8.889 1.00 0.52 H new ATOM 0 HA GLN A 465 -12.263 3.334 10.313 1.00 0.49 H new ATOM 0 HB2 GLN A 465 -14.465 1.488 11.370 1.00 0.56 H new ATOM 0 HB3 GLN A 465 -13.083 2.059 12.284 1.00 0.56 H new ATOM 0 HG2 GLN A 465 -13.912 4.398 12.044 1.00 0.67 H new ATOM 0 HG3 GLN A 465 -15.309 3.801 11.170 1.00 0.67 H new ATOM 0 HE21 GLN A 465 -13.703 4.025 14.286 1.00 1.39 H new ATOM 0 HE22 GLN A 465 -15.085 3.519 15.264 1.00 1.39 H new ATOM 1052 N GLN A 466 -12.706 0.545 8.809 1.00 0.36 N ATOM 1053 CA GLN A 466 -12.179 -0.794 8.554 1.00 0.36 C ATOM 1054 C GLN A 466 -11.164 -0.813 7.418 1.00 0.28 C ATOM 1055 O GLN A 466 -11.060 0.137 6.646 1.00 0.29 O ATOM 1056 CB GLN A 466 -13.328 -1.743 8.259 1.00 0.54 C ATOM 1057 CG GLN A 466 -13.646 -1.795 6.803 1.00 1.20 C ATOM 1058 CD GLN A 466 -15.063 -2.244 6.520 1.00 1.42 C ATOM 1059 OE1 GLN A 466 -15.331 -3.436 6.376 1.00 1.60 O ATOM 1060 NE2 GLN A 466 -15.974 -1.291 6.424 1.00 2.13 N ATOM 0 H GLN A 466 -13.425 0.851 8.154 1.00 0.36 H new ATOM 0 HA GLN A 466 -11.651 -1.121 9.450 1.00 0.36 H new ATOM 0 HB2 GLN A 466 -13.073 -2.743 8.611 1.00 0.54 H new ATOM 0 HB3 GLN A 466 -14.212 -1.426 8.813 1.00 0.54 H new ATOM 0 HG2 GLN A 466 -13.490 -0.808 6.368 1.00 1.20 H new ATOM 0 HG3 GLN A 466 -12.951 -2.474 6.309 1.00 1.20 H new ATOM 0 HE21 GLN A 466 -15.706 -0.315 6.551 1.00 2.13 H new ATOM 0 HE22 GLN A 466 -16.945 -1.532 6.223 1.00 2.13 H new ATOM 1069 N ARG A 467 -10.417 -1.909 7.334 1.00 0.33 N ATOM 1070 CA ARG A 467 -9.396 -2.074 6.313 1.00 0.30 C ATOM 1071 C ARG A 467 -9.666 -3.306 5.456 1.00 0.33 C ATOM 1072 O ARG A 467 -9.942 -4.389 5.973 1.00 0.51 O ATOM 1073 CB ARG A 467 -8.026 -2.203 6.967 1.00 0.36 C ATOM 1074 CG ARG A 467 -7.591 -0.965 7.728 1.00 0.34 C ATOM 1075 CD ARG A 467 -6.352 -1.252 8.560 1.00 0.43 C ATOM 1076 NE ARG A 467 -5.275 -1.835 7.754 1.00 1.24 N ATOM 1077 CZ ARG A 467 -4.001 -1.452 7.799 1.00 1.67 C ATOM 1078 NH1 ARG A 467 -3.605 -0.523 8.661 1.00 1.51 N ATOM 1079 NH2 ARG A 467 -3.119 -2.027 6.988 1.00 2.58 N ATOM 0 H ARG A 467 -10.504 -2.702 7.969 1.00 0.33 H new ATOM 0 HA ARG A 467 -9.418 -1.194 5.670 1.00 0.30 H new ATOM 0 HB2 ARG A 467 -8.039 -3.052 7.650 1.00 0.36 H new ATOM 0 HB3 ARG A 467 -7.286 -2.424 6.198 1.00 0.36 H new ATOM 0 HG2 ARG A 467 -7.385 -0.156 7.028 1.00 0.34 H new ATOM 0 HG3 ARG A 467 -8.400 -0.628 8.376 1.00 0.34 H new ATOM 0 HD2 ARG A 467 -6.002 -0.328 9.020 1.00 0.43 H new ATOM 0 HD3 ARG A 467 -6.609 -1.934 9.370 1.00 0.43 H new ATOM 0 HE ARG A 467 -5.520 -2.589 7.112 1.00 1.24 H new ATOM 0 HH11 ARG A 467 -4.279 -0.096 9.296 1.00 1.51 H new ATOM 0 HH12 ARG A 467 -2.627 -0.236 8.688 1.00 1.51 H new ATOM 0 HH21 ARG A 467 -3.421 -2.754 6.339 1.00 2.58 H new ATOM 0 HH22 ARG A 467 -2.140 -1.741 7.014 1.00 2.58 H new ATOM 1093 N HIS A 468 -9.592 -3.129 4.148 1.00 0.28 N ATOM 1094 CA HIS A 468 -9.731 -4.238 3.204 1.00 0.32 C ATOM 1095 C HIS A 468 -8.462 -4.376 2.349 1.00 0.24 C ATOM 1096 O HIS A 468 -7.914 -3.365 1.918 1.00 0.27 O ATOM 1097 CB HIS A 468 -10.938 -4.017 2.281 1.00 0.44 C ATOM 1098 CG HIS A 468 -12.255 -4.367 2.901 1.00 0.75 C ATOM 1099 ND1 HIS A 468 -12.950 -5.515 2.588 1.00 1.02 N ATOM 1100 CD2 HIS A 468 -13.014 -3.704 3.803 1.00 1.01 C ATOM 1101 CE1 HIS A 468 -14.079 -5.543 3.271 1.00 1.26 C ATOM 1102 NE2 HIS A 468 -14.139 -4.457 4.015 1.00 1.25 N ATOM 0 H HIS A 468 -9.435 -2.222 3.708 1.00 0.28 H new ATOM 0 HA HIS A 468 -9.883 -5.151 3.780 1.00 0.32 H new ATOM 0 HB2 HIS A 468 -10.960 -2.971 1.974 1.00 0.44 H new ATOM 0 HB3 HIS A 468 -10.804 -4.612 1.378 1.00 0.44 H new ATOM 0 HD2 HIS A 468 -12.778 -2.759 4.269 1.00 1.01 H new ATOM 0 HE1 HIS A 468 -14.826 -6.322 3.228 1.00 1.26 H new ATOM 0 HE2 HIS A 468 -14.902 -4.215 4.648 1.00 1.25 H new ATOM 1111 N LYS A 469 -7.999 -5.607 2.086 1.00 0.27 N ATOM 1112 CA LYS A 469 -6.796 -5.794 1.222 1.00 0.40 C ATOM 1113 C LYS A 469 -7.153 -5.471 -0.214 1.00 0.29 C ATOM 1114 O LYS A 469 -8.065 -6.060 -0.794 1.00 0.37 O ATOM 1115 CB LYS A 469 -6.147 -7.197 1.254 1.00 0.80 C ATOM 1116 CG LYS A 469 -4.911 -7.241 0.380 1.00 0.70 C ATOM 1117 CD LYS A 469 -4.098 -8.519 0.504 1.00 0.70 C ATOM 1118 CE LYS A 469 -3.779 -8.983 1.935 1.00 0.41 C ATOM 1119 NZ LYS A 469 -4.937 -9.647 2.604 1.00 0.84 N ATOM 0 H LYS A 469 -8.414 -6.469 2.440 1.00 0.27 H new ATOM 0 HA LYS A 469 -6.053 -5.114 1.639 1.00 0.40 H new ATOM 0 HB2 LYS A 469 -5.882 -7.456 2.279 1.00 0.80 H new ATOM 0 HB3 LYS A 469 -6.865 -7.942 0.913 1.00 0.80 H new ATOM 0 HG2 LYS A 469 -5.212 -7.116 -0.660 1.00 0.70 H new ATOM 0 HG3 LYS A 469 -4.273 -6.394 0.631 1.00 0.70 H new ATOM 0 HD2 LYS A 469 -4.637 -9.319 -0.004 1.00 0.70 H new ATOM 0 HD3 LYS A 469 -3.157 -8.380 -0.029 1.00 0.70 H new ATOM 0 HE2 LYS A 469 -2.937 -9.674 1.908 1.00 0.41 H new ATOM 0 HE3 LYS A 469 -3.467 -8.124 2.529 1.00 0.41 H new ATOM 0 HZ1 LYS A 469 -5.213 -9.100 3.444 1.00 0.84 H new ATOM 0 HZ2 LYS A 469 -5.739 -9.695 1.943 1.00 0.84 H new ATOM 0 HZ3 LYS A 469 -4.667 -10.609 2.891 1.00 0.84 H new ATOM 1133 N VAL A 470 -6.439 -4.518 -0.767 1.00 0.23 N ATOM 1134 CA VAL A 470 -6.633 -4.103 -2.138 1.00 0.18 C ATOM 1135 C VAL A 470 -5.566 -4.704 -3.009 1.00 0.18 C ATOM 1136 O VAL A 470 -5.846 -5.346 -4.020 1.00 0.29 O ATOM 1137 CB VAL A 470 -6.557 -2.581 -2.241 1.00 0.22 C ATOM 1138 CG1 VAL A 470 -6.913 -2.106 -3.644 1.00 0.61 C ATOM 1139 CG2 VAL A 470 -7.450 -1.964 -1.189 1.00 0.59 C ATOM 0 H VAL A 470 -5.705 -4.007 -0.277 1.00 0.23 H new ATOM 0 HA VAL A 470 -7.614 -4.443 -2.469 1.00 0.18 H new ATOM 0 HB VAL A 470 -5.533 -2.257 -2.056 1.00 0.22 H new ATOM 0 HG11 VAL A 470 -6.850 -1.019 -3.687 1.00 0.61 H new ATOM 0 HG12 VAL A 470 -6.216 -2.538 -4.362 1.00 0.61 H new ATOM 0 HG13 VAL A 470 -7.928 -2.421 -3.888 1.00 0.61 H new ATOM 0 HG21 VAL A 470 -7.398 -0.878 -1.260 1.00 0.59 H new ATOM 0 HG22 VAL A 470 -8.478 -2.289 -1.348 1.00 0.59 H new ATOM 0 HG23 VAL A 470 -7.118 -2.280 -0.200 1.00 0.59 H new ATOM 1149 N ARG A 471 -4.339 -4.498 -2.594 1.00 0.17 N ATOM 1150 CA ARG A 471 -3.208 -4.946 -3.353 1.00 0.19 C ATOM 1151 C ARG A 471 -2.106 -5.432 -2.423 1.00 0.18 C ATOM 1152 O ARG A 471 -1.820 -4.805 -1.409 1.00 0.22 O ATOM 1153 CB ARG A 471 -2.728 -3.805 -4.240 1.00 0.28 C ATOM 1154 CG ARG A 471 -1.535 -4.173 -5.095 1.00 0.77 C ATOM 1155 CD ARG A 471 -1.759 -3.834 -6.558 1.00 0.52 C ATOM 1156 NE ARG A 471 -0.739 -4.444 -7.414 1.00 1.18 N ATOM 1157 CZ ARG A 471 -0.241 -3.887 -8.518 1.00 1.45 C ATOM 1158 NH1 ARG A 471 -0.611 -2.669 -8.888 1.00 1.39 N ATOM 1159 NH2 ARG A 471 0.649 -4.547 -9.248 1.00 2.13 N ATOM 0 H ARG A 471 -4.103 -4.018 -1.726 1.00 0.17 H new ATOM 0 HA ARG A 471 -3.492 -5.787 -3.985 1.00 0.19 H new ATOM 0 HB2 ARG A 471 -3.546 -3.488 -4.887 1.00 0.28 H new ATOM 0 HB3 ARG A 471 -2.468 -2.952 -3.614 1.00 0.28 H new ATOM 0 HG2 ARG A 471 -0.652 -3.647 -4.732 1.00 0.77 H new ATOM 0 HG3 ARG A 471 -1.333 -5.240 -4.997 1.00 0.77 H new ATOM 0 HD2 ARG A 471 -2.746 -4.179 -6.865 1.00 0.52 H new ATOM 0 HD3 ARG A 471 -1.744 -2.752 -6.688 1.00 0.52 H new ATOM 0 HE ARG A 471 -0.384 -5.362 -7.146 1.00 1.18 H new ATOM 0 HH11 ARG A 471 -1.284 -2.148 -8.326 1.00 1.39 H new ATOM 0 HH12 ARG A 471 -0.223 -2.253 -9.735 1.00 1.39 H new ATOM 0 HH21 ARG A 471 0.951 -5.479 -8.964 1.00 2.13 H new ATOM 0 HH22 ARG A 471 1.031 -4.122 -10.093 1.00 2.13 H new ATOM 1173 N GLU A 472 -1.523 -6.565 -2.762 1.00 0.20 N ATOM 1174 CA GLU A 472 -0.429 -7.141 -1.991 1.00 0.18 C ATOM 1175 C GLU A 472 0.613 -7.704 -2.938 1.00 0.18 C ATOM 1176 O GLU A 472 0.270 -8.419 -3.883 1.00 0.21 O ATOM 1177 CB GLU A 472 -0.935 -8.241 -1.049 1.00 0.21 C ATOM 1178 CG GLU A 472 0.107 -9.316 -0.764 1.00 0.21 C ATOM 1179 CD GLU A 472 -0.305 -10.304 0.309 1.00 0.29 C ATOM 1180 OE1 GLU A 472 0.440 -10.473 1.295 1.00 0.62 O ATOM 1181 OE2 GLU A 472 -1.369 -10.944 0.160 1.00 0.65 O ATOM 0 H GLU A 472 -1.791 -7.115 -3.578 1.00 0.20 H new ATOM 0 HA GLU A 472 0.017 -6.356 -1.380 1.00 0.18 H new ATOM 0 HB2 GLU A 472 -1.247 -7.789 -0.108 1.00 0.21 H new ATOM 0 HB3 GLU A 472 -1.818 -8.707 -1.487 1.00 0.21 H new ATOM 0 HG2 GLU A 472 0.314 -9.861 -1.685 1.00 0.21 H new ATOM 0 HG3 GLU A 472 1.038 -8.835 -0.463 1.00 0.21 H new ATOM 1188 N GLU A 473 1.872 -7.379 -2.706 1.00 0.16 N ATOM 1189 CA GLU A 473 2.928 -7.849 -3.583 1.00 0.17 C ATOM 1190 C GLU A 473 4.280 -7.772 -2.930 1.00 0.20 C ATOM 1191 O GLU A 473 4.614 -6.794 -2.268 1.00 0.26 O ATOM 1192 CB GLU A 473 2.922 -7.064 -4.901 1.00 0.23 C ATOM 1193 CG GLU A 473 3.956 -7.539 -5.909 1.00 0.27 C ATOM 1194 CD GLU A 473 3.733 -8.975 -6.331 1.00 1.24 C ATOM 1195 OE1 GLU A 473 4.300 -9.884 -5.686 1.00 2.26 O ATOM 1196 OE2 GLU A 473 3.005 -9.204 -7.317 1.00 1.25 O ATOM 0 H GLU A 473 2.185 -6.799 -1.928 1.00 0.16 H new ATOM 0 HA GLU A 473 2.730 -8.899 -3.796 1.00 0.17 H new ATOM 0 HB2 GLU A 473 1.932 -7.136 -5.350 1.00 0.23 H new ATOM 0 HB3 GLU A 473 3.098 -6.010 -4.685 1.00 0.23 H new ATOM 0 HG2 GLU A 473 3.924 -6.896 -6.788 1.00 0.27 H new ATOM 0 HG3 GLU A 473 4.952 -7.440 -5.478 1.00 0.27 H new ATOM 1203 N VAL A 474 5.063 -8.811 -3.148 1.00 0.24 N ATOM 1204 CA VAL A 474 6.363 -8.887 -2.551 1.00 0.28 C ATOM 1205 C VAL A 474 7.401 -8.314 -3.498 1.00 0.21 C ATOM 1206 O VAL A 474 7.591 -8.813 -4.606 1.00 0.28 O ATOM 1207 CB VAL A 474 6.773 -10.321 -2.191 1.00 0.49 C ATOM 1208 CG1 VAL A 474 7.927 -10.319 -1.202 1.00 0.80 C ATOM 1209 CG2 VAL A 474 5.594 -11.112 -1.647 1.00 1.22 C ATOM 0 H VAL A 474 4.814 -9.608 -3.734 1.00 0.24 H new ATOM 0 HA VAL A 474 6.313 -8.310 -1.628 1.00 0.28 H new ATOM 0 HB VAL A 474 7.108 -10.812 -3.105 1.00 0.49 H new ATOM 0 HG11 VAL A 474 8.201 -11.346 -0.961 1.00 0.80 H new ATOM 0 HG12 VAL A 474 8.783 -9.809 -1.643 1.00 0.80 H new ATOM 0 HG13 VAL A 474 7.625 -9.801 -0.292 1.00 0.80 H new ATOM 0 HG21 VAL A 474 5.917 -12.124 -1.401 1.00 1.22 H new ATOM 0 HG22 VAL A 474 5.212 -10.625 -0.750 1.00 1.22 H new ATOM 0 HG23 VAL A 474 4.807 -11.155 -2.399 1.00 1.22 H new ATOM 1219 N VAL A 475 8.065 -7.273 -3.056 1.00 0.19 N ATOM 1220 CA VAL A 475 9.047 -6.588 -3.882 1.00 0.19 C ATOM 1221 C VAL A 475 10.343 -6.359 -3.158 1.00 0.19 C ATOM 1222 O VAL A 475 10.416 -5.669 -2.141 1.00 0.26 O ATOM 1223 CB VAL A 475 8.539 -5.231 -4.408 1.00 0.22 C ATOM 1224 CG1 VAL A 475 8.315 -5.286 -5.908 1.00 0.41 C ATOM 1225 CG2 VAL A 475 7.265 -4.813 -3.700 1.00 0.32 C ATOM 0 H VAL A 475 7.946 -6.875 -2.124 1.00 0.19 H new ATOM 0 HA VAL A 475 9.216 -7.257 -4.726 1.00 0.19 H new ATOM 0 HB VAL A 475 9.305 -4.485 -4.198 1.00 0.22 H new ATOM 0 HG11 VAL A 475 7.957 -4.318 -6.258 1.00 0.41 H new ATOM 0 HG12 VAL A 475 9.253 -5.528 -6.407 1.00 0.41 H new ATOM 0 HG13 VAL A 475 7.574 -6.052 -6.137 1.00 0.41 H new ATOM 0 HG21 VAL A 475 6.930 -3.852 -4.091 1.00 0.32 H new ATOM 0 HG22 VAL A 475 6.492 -5.563 -3.868 1.00 0.32 H new ATOM 0 HG23 VAL A 475 7.456 -4.723 -2.631 1.00 0.32 H new ATOM 1235 N THR A 476 11.351 -6.979 -3.699 1.00 0.24 N ATOM 1236 CA THR A 476 12.712 -6.697 -3.364 1.00 0.24 C ATOM 1237 C THR A 476 13.125 -5.404 -4.037 1.00 0.26 C ATOM 1238 O THR A 476 13.040 -5.266 -5.258 1.00 0.33 O ATOM 1239 CB THR A 476 13.576 -7.843 -3.860 1.00 0.31 C ATOM 1240 OG1 THR A 476 13.253 -9.043 -3.139 1.00 0.32 O ATOM 1241 CG2 THR A 476 15.061 -7.528 -3.730 1.00 0.38 C ATOM 0 H THR A 476 11.245 -7.711 -4.401 1.00 0.24 H new ATOM 0 HA THR A 476 12.830 -6.591 -2.286 1.00 0.24 H new ATOM 0 HB THR A 476 13.366 -7.989 -4.920 1.00 0.31 H new ATOM 0 HG1 THR A 476 13.382 -8.893 -2.179 1.00 0.32 H new ATOM 0 HG21 THR A 476 15.645 -8.372 -4.095 1.00 0.38 H new ATOM 0 HG22 THR A 476 15.298 -6.641 -4.318 1.00 0.38 H new ATOM 0 HG23 THR A 476 15.304 -7.344 -2.683 1.00 0.38 H new ATOM 1249 N VAL A 477 13.556 -4.463 -3.239 1.00 0.25 N ATOM 1250 CA VAL A 477 13.829 -3.131 -3.710 1.00 0.29 C ATOM 1251 C VAL A 477 15.278 -2.980 -4.158 1.00 0.33 C ATOM 1252 O VAL A 477 16.191 -3.487 -3.514 1.00 0.37 O ATOM 1253 CB VAL A 477 13.496 -2.138 -2.592 1.00 0.28 C ATOM 1254 CG1 VAL A 477 13.929 -0.728 -2.943 1.00 0.35 C ATOM 1255 CG2 VAL A 477 12.008 -2.184 -2.303 1.00 0.31 C ATOM 0 H VAL A 477 13.728 -4.599 -2.243 1.00 0.25 H new ATOM 0 HA VAL A 477 13.208 -2.927 -4.582 1.00 0.29 H new ATOM 0 HB VAL A 477 14.050 -2.429 -1.699 1.00 0.28 H new ATOM 0 HG11 VAL A 477 13.675 -0.055 -2.124 1.00 0.35 H new ATOM 0 HG12 VAL A 477 15.006 -0.709 -3.108 1.00 0.35 H new ATOM 0 HG13 VAL A 477 13.418 -0.405 -3.850 1.00 0.35 H new ATOM 0 HG21 VAL A 477 11.770 -1.478 -1.508 1.00 0.31 H new ATOM 0 HG22 VAL A 477 11.454 -1.917 -3.203 1.00 0.31 H new ATOM 0 HG23 VAL A 477 11.729 -3.190 -1.990 1.00 0.31 H new ATOM 1265 N GLY A 478 15.472 -2.302 -5.282 1.00 0.43 N ATOM 1266 CA GLY A 478 16.808 -2.042 -5.781 1.00 0.53 C ATOM 1267 C GLY A 478 16.979 -2.459 -7.235 1.00 1.15 C ATOM 1268 O GLY A 478 16.802 -1.622 -8.124 1.00 1.69 O ATOM 0 H GLY A 478 14.721 -1.925 -5.861 1.00 0.43 H new ATOM 0 HA2 GLY A 478 17.028 -0.979 -5.683 1.00 0.53 H new ATOM 0 HA3 GLY A 478 17.532 -2.576 -5.166 1.00 0.53 H new ATOM 1272 N ASN A 479 17.271 -3.748 -7.489 1.00 1.80 N ATOM 1273 CA ASN A 479 17.533 -4.244 -8.853 1.00 2.82 C ATOM 1274 C ASN A 479 18.125 -5.639 -8.787 1.00 3.58 C ATOM 1275 O ASN A 479 18.770 -6.088 -9.735 1.00 4.40 O ATOM 1276 CB ASN A 479 18.522 -3.347 -9.638 1.00 3.20 C ATOM 1277 CG ASN A 479 17.929 -2.819 -10.934 1.00 3.99 C ATOM 1278 OD1 ASN A 479 17.091 -3.618 -11.579 1.00 4.47 O flip ATOM 1279 ND2 ASN A 479 18.239 -1.706 -11.363 1.00 4.61 N flip ATOM 0 H ASN A 479 17.331 -4.466 -6.767 1.00 1.80 H new ATOM 0 HA ASN A 479 16.575 -4.239 -9.373 1.00 2.82 H new ATOM 0 HB2 ASN A 479 18.821 -2.507 -9.011 1.00 3.20 H new ATOM 0 HB3 ASN A 479 19.425 -3.916 -9.861 1.00 3.20 H new ATOM 0 HD21 ASN A 479 18.888 -1.119 -10.838 1.00 4.61 H new ATOM 0 HD22 ASN A 479 17.847 -1.371 -12.243 1.00 4.61 H new ATOM 1286 N SER A 480 17.901 -6.335 -7.685 1.00 3.56 N ATOM 1287 CA SER A 480 18.670 -7.535 -7.412 1.00 4.40 C ATOM 1288 C SER A 480 17.827 -8.569 -6.666 1.00 4.81 C ATOM 1289 O SER A 480 17.257 -9.459 -7.331 1.00 4.88 O ATOM 1290 CB SER A 480 19.909 -7.122 -6.613 1.00 4.37 C ATOM 1291 OG SER A 480 19.544 -6.472 -5.405 1.00 4.36 O ATOM 1292 OXT SER A 480 17.714 -8.476 -5.428 1.00 5.40 O ATOM 0 H SER A 480 17.206 -6.095 -6.978 1.00 3.56 H new ATOM 0 HA SER A 480 18.978 -8.011 -8.343 1.00 4.40 H new ATOM 0 HB2 SER A 480 20.511 -8.002 -6.388 1.00 4.37 H new ATOM 0 HB3 SER A 480 20.529 -6.457 -7.215 1.00 4.37 H new ATOM 0 HG SER A 480 18.785 -6.940 -4.998 1.00 4.36 H new TER 1298 SER A 480