USER MOD reduce.3.24.130724 H: found=0, std=0, add=637, rem=0, adj=29 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 -69:sc= 1.28 USER MOD Set 1.2: A 476 THR OG1 : rot 180:sc= 1.05 USER MOD Set 2.1: A 466 GLN : amide:sc= -1.24 X(o=-1.5,f=-1.8) USER MOD Set 2.2: A 468 HIS : no HD1:sc= -0.264 K(o=-1.5,f=-2.9) USER MOD Set 3.1: A 450 THR OG1 : rot 87:sc=0.000612 USER MOD Set 3.2: A 455 TYR OH : rot 70:sc= 0.337 USER MOD Set 4.1: A 422 SER OG : rot -117:sc= 0.324 USER MOD Set 4.2: A 424 HIS : no HE2:sc= -0.178 K(o=0.15,f=-0.49) USER MOD Set 4.3: A 434 GLN :FLIP amide:sc= 0 F(o=-0.86,f=0.15) USER MOD Set 5.1: A 416 THR OG1 : rot 136:sc= 1.47 USER MOD Set 5.2: A 419 TYR OH : rot 146:sc= 0.725 USER MOD Set 6.1: A 407 THR OG1 : rot -73:sc= 1.23 USER MOD Set 6.2: A 445 THR OG1 : rot 180:sc= 1.07 USER MOD Single : A 395 ASN : amide:sc= -0.161 X(o=-0.16,f=-0.028) USER MOD Single : A 397 SER OG : rot 46:sc= 0.211 USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 400 GLN :FLIP amide:sc= -0.124 F(o=-2.9!,f=-0.12) USER MOD Single : A 404 SER OG : rot 58:sc= 1.22 USER MOD Single : A 405 GLN : amide:sc= 0.0591 K(o=0.059,f=-2.1!) USER MOD Single : A 406 THR OG1 : rot -170:sc= -0.641 USER MOD Single : A 409 SER OG : rot 180:sc= 0 USER MOD Single : A 414 GLN :FLIP amide:sc= -0.0148 F(o=-0.95,f=-0.015) USER MOD Single : A 417 SER OG : rot 180:sc= 0 USER MOD Single : A 423 CYS SG : rot -123:sc= -2.09 USER MOD Single : A 428 THR OG1 : rot 180:sc= 0.0326 USER MOD Single : A 440 THR OG1 : rot 180:sc= 0.0138 USER MOD Single : A 441 SER OG : rot -170:sc= -0.22 USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 SER OG : rot -14:sc= 0.569 USER MOD Single : A 447 THR OG1 : rot 180:sc= 0.0631 USER MOD Single : A 456 ASN : amide:sc= -0.87 K(o=-0.87,f=-4.1!) USER MOD Single : A 463 LYS NZ :NH3+ -171:sc= 1.14 (180deg=0.991) USER MOD Single : A 465 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 469 LYS NZ :NH3+ -106:sc= 0.334 (180deg=-0.737) USER MOD Single : A 479 ASN : amide:sc= -0.202 X(o=-0.2,f=-0.21) USER MOD Single : A 480 SER OG : rot 32:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 395 10.949 15.288 1.504 1.00 7.64 N ATOM 2 CA ASN A 395 12.385 15.275 1.150 1.00 7.05 C ATOM 3 C ASN A 395 13.220 15.955 2.234 1.00 6.89 C ATOM 4 O ASN A 395 13.970 16.893 1.971 1.00 7.24 O ATOM 5 CB ASN A 395 12.607 15.948 -0.215 1.00 7.73 C ATOM 6 CG ASN A 395 11.993 17.337 -0.309 1.00 8.25 C ATOM 7 OD1 ASN A 395 10.808 17.482 -0.607 1.00 8.44 O ATOM 8 ND2 ASN A 395 12.793 18.368 -0.082 1.00 8.76 N ATOM 0 HA ASN A 395 12.711 14.237 1.079 1.00 7.05 H new ATOM 0 HB2 ASN A 395 13.678 16.018 -0.408 1.00 7.73 H new ATOM 0 HB3 ASN A 395 12.183 15.317 -0.996 1.00 7.73 H new ATOM 0 HD21 ASN A 395 12.431 19.319 -0.152 1.00 8.76 H new ATOM 0 HD22 ASN A 395 13.771 18.211 0.163 1.00 8.76 H new ATOM 17 N ALA A 396 13.113 15.441 3.448 1.00 6.67 N ATOM 18 CA ALA A 396 13.875 15.959 4.583 1.00 6.81 C ATOM 19 C ALA A 396 14.610 14.782 5.204 1.00 6.05 C ATOM 20 O ALA A 396 14.586 14.592 6.419 1.00 6.42 O ATOM 21 CB ALA A 396 12.977 16.644 5.622 1.00 7.55 C ATOM 0 H ALA A 396 12.501 14.658 3.679 1.00 6.67 H new ATOM 0 HA ALA A 396 14.572 16.722 4.237 1.00 6.81 H new ATOM 0 HB1 ALA A 396 13.589 17.012 6.446 1.00 7.55 H new ATOM 0 HB2 ALA A 396 12.454 17.480 5.157 1.00 7.55 H new ATOM 0 HB3 ALA A 396 12.249 15.927 6.003 1.00 7.55 H new ATOM 27 N SER A 397 15.257 13.976 4.355 1.00 5.23 N ATOM 28 CA SER A 397 15.680 12.649 4.772 1.00 4.72 C ATOM 29 C SER A 397 17.006 12.734 5.586 1.00 4.61 C ATOM 30 O SER A 397 18.054 12.970 4.979 1.00 4.53 O ATOM 31 CB SER A 397 15.885 11.781 3.510 1.00 4.27 C ATOM 32 OG SER A 397 16.583 12.504 2.507 1.00 4.45 O ATOM 0 H SER A 397 15.493 14.220 3.393 1.00 5.23 H new ATOM 0 HA SER A 397 14.918 12.203 5.411 1.00 4.72 H new ATOM 0 HB2 SER A 397 16.442 10.881 3.769 1.00 4.27 H new ATOM 0 HB3 SER A 397 14.918 11.458 3.125 1.00 4.27 H new ATOM 0 HG SER A 397 17.354 12.957 2.907 1.00 4.45 H new ATOM 38 N THR A 398 17.020 12.560 6.938 1.00 5.02 N ATOM 39 CA THR A 398 18.334 12.536 7.644 1.00 5.32 C ATOM 40 C THR A 398 18.451 11.345 8.596 1.00 5.50 C ATOM 41 O THR A 398 19.545 11.027 9.067 1.00 6.31 O ATOM 42 CB THR A 398 18.667 13.853 8.403 1.00 6.23 C ATOM 43 OG1 THR A 398 17.476 14.430 8.961 1.00 6.75 O ATOM 44 CG2 THR A 398 19.376 14.872 7.496 1.00 6.37 C ATOM 0 H THR A 398 16.196 12.442 7.528 1.00 5.02 H new ATOM 0 HA THR A 398 19.071 12.432 6.848 1.00 5.32 H new ATOM 0 HB THR A 398 19.351 13.597 9.212 1.00 6.23 H new ATOM 0 HG1 THR A 398 17.704 15.256 9.436 1.00 6.75 H new ATOM 0 HG21 THR A 398 19.591 15.777 8.064 1.00 6.37 H new ATOM 0 HG22 THR A 398 20.309 14.445 7.128 1.00 6.37 H new ATOM 0 HG23 THR A 398 18.732 15.118 6.652 1.00 6.37 H new ATOM 52 N GLY A 399 17.336 10.676 8.873 1.00 4.93 N ATOM 53 CA GLY A 399 17.403 9.421 9.613 1.00 5.31 C ATOM 54 C GLY A 399 17.421 8.267 8.642 1.00 4.62 C ATOM 55 O GLY A 399 18.276 7.384 8.710 1.00 4.48 O ATOM 0 H GLY A 399 16.398 10.972 8.604 1.00 4.93 H new ATOM 0 HA2 GLY A 399 18.297 9.401 10.236 1.00 5.31 H new ATOM 0 HA3 GLY A 399 16.547 9.334 10.282 1.00 5.31 H new ATOM 59 N GLN A 400 16.471 8.290 7.724 1.00 4.32 N ATOM 60 CA GLN A 400 16.497 7.398 6.576 1.00 3.59 C ATOM 61 C GLN A 400 16.936 8.198 5.375 1.00 2.81 C ATOM 62 O GLN A 400 16.175 8.985 4.853 1.00 2.93 O ATOM 63 CB GLN A 400 15.137 6.742 6.301 1.00 3.81 C ATOM 64 CG GLN A 400 14.611 5.811 7.386 1.00 4.51 C ATOM 65 CD GLN A 400 15.209 4.405 7.353 1.00 4.68 C ATOM 66 OE1 GLN A 400 16.432 4.250 6.859 1.00 5.27 O flip ATOM 67 NE2 GLN A 400 14.555 3.445 7.766 1.00 4.54 N flip ATOM 0 H GLN A 400 15.668 8.919 7.751 1.00 4.32 H new ATOM 0 HA GLN A 400 17.192 6.585 6.787 1.00 3.59 H new ATOM 0 HB2 GLN A 400 14.402 7.531 6.139 1.00 3.81 H new ATOM 0 HB3 GLN A 400 15.210 6.178 5.371 1.00 3.81 H new ATOM 0 HG2 GLN A 400 14.813 6.256 8.360 1.00 4.51 H new ATOM 0 HG3 GLN A 400 13.528 5.735 7.289 1.00 4.51 H new ATOM 0 HE21 GLN A 400 13.618 3.590 8.141 1.00 4.54 H new ATOM 0 HE22 GLN A 400 14.951 2.506 7.733 1.00 4.54 H new ATOM 76 N GLU A 401 18.205 8.120 5.040 1.00 2.28 N ATOM 77 CA GLU A 401 18.677 8.701 3.778 1.00 1.62 C ATOM 78 C GLU A 401 19.089 7.726 2.685 1.00 1.37 C ATOM 79 O GLU A 401 19.673 8.132 1.680 1.00 1.38 O ATOM 80 CB GLU A 401 19.725 9.762 3.993 1.00 1.30 C ATOM 81 CG GLU A 401 20.530 9.568 5.254 1.00 1.92 C ATOM 82 CD GLU A 401 21.390 8.324 5.223 1.00 2.22 C ATOM 83 OE1 GLU A 401 20.985 7.304 5.821 1.00 2.91 O ATOM 84 OE2 GLU A 401 22.468 8.354 4.592 1.00 2.28 O ATOM 0 H GLU A 401 18.926 7.671 5.604 1.00 2.28 H new ATOM 0 HA GLU A 401 17.775 9.166 3.380 1.00 1.62 H new ATOM 0 HB2 GLU A 401 20.401 9.772 3.138 1.00 1.30 H new ATOM 0 HB3 GLU A 401 19.241 10.738 4.027 1.00 1.30 H new ATOM 0 HG2 GLU A 401 21.167 10.439 5.409 1.00 1.92 H new ATOM 0 HG3 GLU A 401 19.852 9.513 6.106 1.00 1.92 H new ATOM 91 N ALA A 402 18.795 6.470 2.854 1.00 1.24 N ATOM 92 CA ALA A 402 19.183 5.469 1.874 1.00 1.04 C ATOM 93 C ALA A 402 17.974 5.046 1.079 1.00 0.82 C ATOM 94 O ALA A 402 17.755 3.871 0.787 1.00 0.79 O ATOM 95 CB ALA A 402 19.854 4.299 2.549 1.00 1.18 C ATOM 0 H ALA A 402 18.287 6.103 3.659 1.00 1.24 H new ATOM 0 HA ALA A 402 19.909 5.897 1.183 1.00 1.04 H new ATOM 0 HB1 ALA A 402 20.137 3.560 1.799 1.00 1.18 H new ATOM 0 HB2 ALA A 402 20.745 4.644 3.074 1.00 1.18 H new ATOM 0 HB3 ALA A 402 19.165 3.847 3.262 1.00 1.18 H new ATOM 101 N LEU A 403 17.195 6.043 0.751 1.00 0.75 N ATOM 102 CA LEU A 403 15.812 5.873 0.422 1.00 0.58 C ATOM 103 C LEU A 403 15.548 5.636 -1.049 1.00 0.57 C ATOM 104 O LEU A 403 16.138 6.268 -1.928 1.00 0.90 O ATOM 105 CB LEU A 403 15.095 7.114 0.903 1.00 0.59 C ATOM 106 CG LEU A 403 15.308 7.405 2.380 1.00 0.79 C ATOM 107 CD1 LEU A 403 14.410 8.550 2.811 1.00 1.70 C ATOM 108 CD2 LEU A 403 15.016 6.156 3.189 1.00 1.52 C ATOM 0 H LEU A 403 17.513 7.011 0.705 1.00 0.75 H new ATOM 0 HA LEU A 403 15.446 4.970 0.911 1.00 0.58 H new ATOM 0 HB2 LEU A 403 15.436 7.970 0.320 1.00 0.59 H new ATOM 0 HB3 LEU A 403 14.027 7.003 0.713 1.00 0.59 H new ATOM 0 HG LEU A 403 16.344 7.697 2.553 1.00 0.79 H new ATOM 0 HD11 LEU A 403 14.566 8.756 3.870 1.00 1.70 H new ATOM 0 HD12 LEU A 403 14.651 9.440 2.229 1.00 1.70 H new ATOM 0 HD13 LEU A 403 13.368 8.278 2.643 1.00 1.70 H new ATOM 0 HD21 LEU A 403 15.169 6.364 4.248 1.00 1.52 H new ATOM 0 HD22 LEU A 403 13.983 5.849 3.025 1.00 1.52 H new ATOM 0 HD23 LEU A 403 15.686 5.355 2.877 1.00 1.52 H new ATOM 120 N SER A 404 14.640 4.715 -1.294 1.00 0.30 N ATOM 121 CA SER A 404 14.125 4.463 -2.617 1.00 0.27 C ATOM 122 C SER A 404 12.653 4.837 -2.634 1.00 0.28 C ATOM 123 O SER A 404 12.004 4.862 -1.581 1.00 0.43 O ATOM 124 CB SER A 404 14.320 2.990 -2.974 1.00 0.28 C ATOM 125 OG SER A 404 13.828 2.695 -4.275 1.00 1.04 O ATOM 0 H SER A 404 14.237 4.117 -0.572 1.00 0.30 H new ATOM 0 HA SER A 404 14.658 5.060 -3.357 1.00 0.27 H new ATOM 0 HB2 SER A 404 15.379 2.740 -2.920 1.00 0.28 H new ATOM 0 HB3 SER A 404 13.807 2.367 -2.241 1.00 0.28 H new ATOM 0 HG SER A 404 14.286 3.258 -4.933 1.00 1.04 H new ATOM 131 N GLN A 405 12.128 5.158 -3.803 1.00 0.26 N ATOM 132 CA GLN A 405 10.724 5.515 -3.907 1.00 0.26 C ATOM 133 C GLN A 405 9.997 4.561 -4.834 1.00 0.27 C ATOM 134 O GLN A 405 10.242 4.540 -6.041 1.00 0.43 O ATOM 135 CB GLN A 405 10.512 6.952 -4.400 1.00 0.30 C ATOM 136 CG GLN A 405 11.671 7.900 -4.157 1.00 0.33 C ATOM 137 CD GLN A 405 12.632 7.961 -5.330 1.00 0.58 C ATOM 138 OE1 GLN A 405 12.807 6.980 -6.052 1.00 0.99 O ATOM 139 NE2 GLN A 405 13.257 9.111 -5.547 1.00 0.91 N ATOM 0 H GLN A 405 12.644 5.179 -4.683 1.00 0.26 H new ATOM 0 HA GLN A 405 10.316 5.443 -2.899 1.00 0.26 H new ATOM 0 HB2 GLN A 405 10.305 6.924 -5.470 1.00 0.30 H new ATOM 0 HB3 GLN A 405 9.625 7.358 -3.914 1.00 0.30 H new ATOM 0 HG2 GLN A 405 11.283 8.899 -3.958 1.00 0.33 H new ATOM 0 HG3 GLN A 405 12.212 7.585 -3.265 1.00 0.33 H new ATOM 0 HE21 GLN A 405 13.091 9.906 -4.930 1.00 0.91 H new ATOM 0 HE22 GLN A 405 13.904 9.200 -6.331 1.00 0.91 H new ATOM 148 N THR A 406 9.107 3.771 -4.265 1.00 0.18 N ATOM 149 CA THR A 406 8.290 2.869 -5.038 1.00 0.19 C ATOM 150 C THR A 406 6.940 3.481 -5.293 1.00 0.17 C ATOM 151 O THR A 406 6.063 3.492 -4.433 1.00 0.16 O ATOM 152 CB THR A 406 8.119 1.525 -4.313 1.00 0.21 C ATOM 153 OG1 THR A 406 9.402 0.940 -4.065 1.00 0.27 O ATOM 154 CG2 THR A 406 7.272 0.570 -5.121 1.00 0.29 C ATOM 0 H THR A 406 8.934 3.739 -3.260 1.00 0.18 H new ATOM 0 HA THR A 406 8.792 2.690 -5.989 1.00 0.19 H new ATOM 0 HB THR A 406 7.612 1.714 -3.367 1.00 0.21 H new ATOM 0 HG1 THR A 406 9.286 0.020 -3.749 1.00 0.27 H new ATOM 0 HG21 THR A 406 7.170 -0.371 -4.581 1.00 0.29 H new ATOM 0 HG22 THR A 406 6.286 1.005 -5.282 1.00 0.29 H new ATOM 0 HG23 THR A 406 7.749 0.386 -6.084 1.00 0.29 H new ATOM 162 N THR A 407 6.807 4.025 -6.470 1.00 0.19 N ATOM 163 CA THR A 407 5.542 4.481 -6.948 1.00 0.19 C ATOM 164 C THR A 407 4.695 3.274 -7.321 1.00 0.19 C ATOM 165 O THR A 407 5.021 2.528 -8.247 1.00 0.26 O ATOM 166 CB THR A 407 5.751 5.395 -8.152 1.00 0.24 C ATOM 167 OG1 THR A 407 6.458 6.577 -7.749 1.00 0.26 O ATOM 168 CG2 THR A 407 4.425 5.770 -8.811 1.00 0.24 C ATOM 0 H THR A 407 7.578 4.163 -7.123 1.00 0.19 H new ATOM 0 HA THR A 407 5.026 5.050 -6.174 1.00 0.19 H new ATOM 0 HB THR A 407 6.343 4.852 -8.889 1.00 0.24 H new ATOM 0 HG1 THR A 407 5.859 7.157 -7.234 1.00 0.26 H new ATOM 0 HG21 THR A 407 4.614 6.421 -9.664 1.00 0.24 H new ATOM 0 HG22 THR A 407 3.919 4.866 -9.150 1.00 0.24 H new ATOM 0 HG23 THR A 407 3.795 6.290 -8.090 1.00 0.24 H new ATOM 176 N ILE A 408 3.629 3.082 -6.578 1.00 0.21 N ATOM 177 CA ILE A 408 2.789 1.907 -6.741 1.00 0.21 C ATOM 178 C ILE A 408 1.355 2.325 -6.940 1.00 0.18 C ATOM 179 O ILE A 408 0.838 3.203 -6.247 1.00 0.16 O ATOM 180 CB ILE A 408 2.923 0.879 -5.565 1.00 0.23 C ATOM 181 CG1 ILE A 408 1.674 -0.001 -5.421 1.00 0.21 C ATOM 182 CG2 ILE A 408 3.200 1.559 -4.236 1.00 0.25 C ATOM 183 CD1 ILE A 408 1.963 -1.389 -4.895 1.00 0.27 C ATOM 0 H ILE A 408 3.318 3.725 -5.850 1.00 0.21 H new ATOM 0 HA ILE A 408 3.140 1.383 -7.630 1.00 0.21 H new ATOM 0 HB ILE A 408 3.774 0.250 -5.825 1.00 0.23 H new ATOM 0 HG12 ILE A 408 0.969 0.492 -4.751 1.00 0.21 H new ATOM 0 HG13 ILE A 408 1.186 -0.085 -6.392 1.00 0.21 H new ATOM 0 HG21 ILE A 408 3.285 0.806 -3.453 1.00 0.25 H new ATOM 0 HG22 ILE A 408 4.132 2.120 -4.302 1.00 0.25 H new ATOM 0 HG23 ILE A 408 2.383 2.240 -3.998 1.00 0.25 H new ATOM 0 HD11 ILE A 408 1.032 -1.951 -4.821 1.00 0.27 H new ATOM 0 HD12 ILE A 408 2.643 -1.902 -5.575 1.00 0.27 H new ATOM 0 HD13 ILE A 408 2.423 -1.316 -3.909 1.00 0.27 H new ATOM 195 N SER A 409 0.740 1.722 -7.927 1.00 0.18 N ATOM 196 CA SER A 409 -0.617 2.039 -8.285 1.00 0.16 C ATOM 197 C SER A 409 -1.525 0.861 -8.024 1.00 0.13 C ATOM 198 O SER A 409 -1.093 -0.291 -8.032 1.00 0.15 O ATOM 199 CB SER A 409 -0.685 2.449 -9.752 1.00 0.21 C ATOM 200 OG SER A 409 0.060 1.560 -10.565 1.00 0.71 O ATOM 0 H SER A 409 1.168 0.998 -8.504 1.00 0.18 H new ATOM 0 HA SER A 409 -0.956 2.872 -7.669 1.00 0.16 H new ATOM 0 HB2 SER A 409 -1.724 2.463 -10.081 1.00 0.21 H new ATOM 0 HB3 SER A 409 -0.300 3.462 -9.868 1.00 0.21 H new ATOM 0 HG SER A 409 -0.001 1.844 -11.501 1.00 0.71 H new ATOM 206 N TRP A 410 -2.776 1.163 -7.781 1.00 0.16 N ATOM 207 CA TRP A 410 -3.782 0.149 -7.549 1.00 0.17 C ATOM 208 C TRP A 410 -5.084 0.617 -8.101 1.00 0.18 C ATOM 209 O TRP A 410 -5.255 1.792 -8.434 1.00 0.19 O ATOM 210 CB TRP A 410 -3.916 -0.164 -6.056 1.00 0.16 C ATOM 211 CG TRP A 410 -4.268 1.043 -5.221 1.00 0.14 C ATOM 212 CD1 TRP A 410 -5.511 1.513 -4.866 1.00 0.14 C ATOM 213 CD2 TRP A 410 -3.324 1.948 -4.652 1.00 0.13 C ATOM 214 NE1 TRP A 410 -5.375 2.646 -4.093 1.00 0.13 N ATOM 215 CE2 TRP A 410 -4.042 2.931 -3.951 1.00 0.12 C ATOM 216 CE3 TRP A 410 -1.932 2.010 -4.669 1.00 0.14 C ATOM 217 CZ2 TRP A 410 -3.406 3.966 -3.270 1.00 0.14 C ATOM 218 CZ3 TRP A 410 -1.303 3.032 -4.002 1.00 0.15 C ATOM 219 CH2 TRP A 410 -2.037 4.001 -3.307 1.00 0.14 C ATOM 0 H TRP A 410 -3.129 2.119 -7.738 1.00 0.16 H new ATOM 0 HA TRP A 410 -3.480 -0.770 -8.052 1.00 0.17 H new ATOM 0 HB2 TRP A 410 -4.682 -0.927 -5.919 1.00 0.16 H new ATOM 0 HB3 TRP A 410 -2.978 -0.586 -5.695 1.00 0.16 H new ATOM 0 HD1 TRP A 410 -6.451 1.063 -5.150 1.00 0.14 H new ATOM 0 HE1 TRP A 410 -6.142 3.185 -3.692 1.00 0.13 H new ATOM 0 HE3 TRP A 410 -1.357 1.265 -5.199 1.00 0.14 H new ATOM 0 HZ2 TRP A 410 -3.971 4.713 -2.733 1.00 0.14 H new ATOM 0 HZ3 TRP A 410 -0.225 3.089 -4.014 1.00 0.15 H new ATOM 0 HH2 TRP A 410 -1.514 4.792 -2.790 1.00 0.14 H new ATOM 230 N ALA A 411 -5.990 -0.305 -8.212 1.00 0.19 N ATOM 231 CA ALA A 411 -7.238 -0.016 -8.799 1.00 0.22 C ATOM 232 C ALA A 411 -8.184 0.544 -7.776 1.00 0.19 C ATOM 233 O ALA A 411 -8.239 0.084 -6.633 1.00 0.19 O ATOM 234 CB ALA A 411 -7.801 -1.244 -9.445 1.00 0.26 C ATOM 0 H ALA A 411 -5.876 -1.268 -7.897 1.00 0.19 H new ATOM 0 HA ALA A 411 -7.099 0.740 -9.572 1.00 0.22 H new ATOM 0 HB1 ALA A 411 -8.765 -1.009 -9.895 1.00 0.26 H new ATOM 0 HB2 ALA A 411 -7.116 -1.596 -10.217 1.00 0.26 H new ATOM 0 HB3 ALA A 411 -7.932 -2.023 -8.694 1.00 0.26 H new ATOM 240 N PRO A 412 -8.915 1.561 -8.198 1.00 0.20 N ATOM 241 CA PRO A 412 -9.849 2.268 -7.360 1.00 0.19 C ATOM 242 C PRO A 412 -10.795 1.328 -6.656 1.00 0.20 C ATOM 243 O PRO A 412 -11.409 0.454 -7.271 1.00 0.23 O ATOM 244 CB PRO A 412 -10.645 3.144 -8.309 1.00 0.24 C ATOM 245 CG PRO A 412 -9.973 3.083 -9.644 1.00 0.26 C ATOM 246 CD PRO A 412 -8.860 2.078 -9.560 1.00 0.23 C ATOM 0 HA PRO A 412 -9.323 2.828 -6.587 1.00 0.19 H new ATOM 0 HB2 PRO A 412 -11.675 2.794 -8.381 1.00 0.24 H new ATOM 0 HB3 PRO A 412 -10.682 4.171 -7.944 1.00 0.24 H new ATOM 0 HG2 PRO A 412 -10.687 2.797 -10.417 1.00 0.26 H new ATOM 0 HG3 PRO A 412 -9.582 4.063 -9.918 1.00 0.26 H new ATOM 0 HD2 PRO A 412 -8.994 1.280 -10.290 1.00 0.23 H new ATOM 0 HD3 PRO A 412 -7.895 2.541 -9.767 1.00 0.23 H new ATOM 254 N PHE A 413 -10.907 1.522 -5.371 1.00 0.21 N ATOM 255 CA PHE A 413 -11.753 0.695 -4.559 1.00 0.30 C ATOM 256 C PHE A 413 -13.162 1.290 -4.473 1.00 0.51 C ATOM 257 O PHE A 413 -14.032 0.881 -5.242 1.00 1.35 O ATOM 258 CB PHE A 413 -11.087 0.488 -3.193 1.00 0.30 C ATOM 259 CG PHE A 413 -11.916 -0.230 -2.178 1.00 0.37 C ATOM 260 CD1 PHE A 413 -12.459 0.471 -1.128 1.00 0.36 C ATOM 261 CD2 PHE A 413 -12.145 -1.590 -2.269 1.00 0.51 C ATOM 262 CE1 PHE A 413 -13.224 -0.163 -0.172 1.00 0.45 C ATOM 263 CE2 PHE A 413 -12.909 -2.240 -1.318 1.00 0.61 C ATOM 264 CZ PHE A 413 -13.451 -1.525 -0.265 1.00 0.57 C ATOM 0 H PHE A 413 -10.416 2.255 -4.860 1.00 0.21 H new ATOM 0 HA PHE A 413 -11.876 -0.289 -5.011 1.00 0.30 H new ATOM 0 HB2 PHE A 413 -10.161 -0.068 -3.340 1.00 0.30 H new ATOM 0 HB3 PHE A 413 -10.813 1.463 -2.790 1.00 0.30 H new ATOM 0 HD1 PHE A 413 -12.284 1.534 -1.051 1.00 0.36 H new ATOM 0 HD2 PHE A 413 -11.723 -2.150 -3.091 1.00 0.51 H new ATOM 0 HE1 PHE A 413 -13.645 0.402 0.647 1.00 0.45 H new ATOM 0 HE2 PHE A 413 -13.082 -3.303 -1.397 1.00 0.61 H new ATOM 0 HZ PHE A 413 -14.049 -2.027 0.481 1.00 0.57 H new ATOM 274 N GLN A 414 -13.378 2.275 -3.584 1.00 0.54 N ATOM 275 CA GLN A 414 -14.684 2.997 -3.508 1.00 0.53 C ATOM 276 C GLN A 414 -14.784 3.837 -2.271 1.00 0.44 C ATOM 277 O GLN A 414 -14.890 3.351 -1.145 1.00 0.48 O ATOM 278 CB GLN A 414 -15.927 2.076 -3.626 1.00 0.71 C ATOM 279 CG GLN A 414 -17.242 2.740 -3.219 1.00 1.28 C ATOM 280 CD GLN A 414 -18.415 1.756 -3.065 1.00 1.51 C ATOM 281 OE1 GLN A 414 -18.158 0.479 -2.739 1.00 2.11 O flip ATOM 282 NE2 GLN A 414 -19.569 2.140 -3.261 1.00 1.89 N flip ATOM 0 H GLN A 414 -12.682 2.595 -2.911 1.00 0.54 H new ATOM 0 HA GLN A 414 -14.692 3.645 -4.385 1.00 0.53 H new ATOM 0 HB2 GLN A 414 -16.012 1.730 -4.656 1.00 0.71 H new ATOM 0 HB3 GLN A 414 -15.771 1.194 -3.005 1.00 0.71 H new ATOM 0 HG2 GLN A 414 -17.095 3.266 -2.276 1.00 1.28 H new ATOM 0 HG3 GLN A 414 -17.505 3.490 -3.965 1.00 1.28 H new ATOM 0 HE21 GLN A 414 -19.748 3.113 -3.508 1.00 1.89 H new ATOM 0 HE22 GLN A 414 -20.346 1.485 -3.176 1.00 1.89 H new ATOM 291 N ASP A 415 -14.755 5.116 -2.559 1.00 0.39 N ATOM 292 CA ASP A 415 -14.917 6.199 -1.606 1.00 0.34 C ATOM 293 C ASP A 415 -14.173 5.981 -0.315 1.00 0.31 C ATOM 294 O ASP A 415 -14.678 6.283 0.768 1.00 0.35 O ATOM 295 CB ASP A 415 -16.379 6.448 -1.274 1.00 0.40 C ATOM 296 CG ASP A 415 -17.158 7.054 -2.422 1.00 0.45 C ATOM 297 OD1 ASP A 415 -18.032 6.363 -2.985 1.00 0.58 O ATOM 298 OD2 ASP A 415 -16.902 8.224 -2.769 1.00 0.59 O ATOM 0 H ASP A 415 -14.611 5.451 -3.511 1.00 0.39 H new ATOM 0 HA ASP A 415 -14.491 7.068 -2.107 1.00 0.34 H new ATOM 0 HB2 ASP A 415 -16.845 5.506 -0.985 1.00 0.40 H new ATOM 0 HB3 ASP A 415 -16.441 7.112 -0.411 1.00 0.40 H new ATOM 303 N THR A 416 -12.976 5.508 -0.432 1.00 0.27 N ATOM 304 CA THR A 416 -12.187 5.151 0.705 1.00 0.23 C ATOM 305 C THR A 416 -11.754 6.395 1.474 1.00 0.24 C ATOM 306 O THR A 416 -11.575 7.462 0.895 1.00 0.25 O ATOM 307 CB THR A 416 -10.971 4.373 0.230 1.00 0.19 C ATOM 308 OG1 THR A 416 -11.367 3.446 -0.791 1.00 0.22 O ATOM 309 CG2 THR A 416 -10.362 3.623 1.383 1.00 0.22 C ATOM 0 H THR A 416 -12.512 5.356 -1.328 1.00 0.27 H new ATOM 0 HA THR A 416 -12.781 4.533 1.379 1.00 0.23 H new ATOM 0 HB THR A 416 -10.234 5.068 -0.173 1.00 0.19 H new ATOM 0 HG1 THR A 416 -10.717 3.469 -1.524 1.00 0.22 H new ATOM 0 HG21 THR A 416 -9.491 3.067 1.036 1.00 0.22 H new ATOM 0 HG22 THR A 416 -10.058 4.329 2.156 1.00 0.22 H new ATOM 0 HG23 THR A 416 -11.095 2.929 1.793 1.00 0.22 H new ATOM 317 N SER A 417 -11.709 6.282 2.790 1.00 0.25 N ATOM 318 CA SER A 417 -11.210 7.355 3.633 1.00 0.28 C ATOM 319 C SER A 417 -9.682 7.423 3.547 1.00 0.27 C ATOM 320 O SER A 417 -9.092 8.504 3.550 1.00 0.33 O ATOM 321 CB SER A 417 -11.647 7.116 5.080 1.00 0.32 C ATOM 322 OG SER A 417 -13.045 6.878 5.154 1.00 1.14 O ATOM 0 H SER A 417 -12.014 5.453 3.300 1.00 0.25 H new ATOM 0 HA SER A 417 -11.621 8.304 3.288 1.00 0.28 H new ATOM 0 HB2 SER A 417 -11.107 6.263 5.491 1.00 0.32 H new ATOM 0 HB3 SER A 417 -11.389 7.982 5.690 1.00 0.32 H new ATOM 0 HG SER A 417 -13.302 6.726 6.087 1.00 1.14 H new ATOM 328 N GLU A 418 -9.060 6.250 3.461 1.00 0.23 N ATOM 329 CA GLU A 418 -7.609 6.121 3.400 1.00 0.25 C ATOM 330 C GLU A 418 -7.192 4.831 2.725 1.00 0.19 C ATOM 331 O GLU A 418 -7.928 3.864 2.706 1.00 0.28 O ATOM 332 CB GLU A 418 -7.050 6.093 4.804 1.00 0.36 C ATOM 333 CG GLU A 418 -6.609 7.420 5.328 1.00 0.84 C ATOM 334 CD GLU A 418 -6.354 7.402 6.819 1.00 0.86 C ATOM 335 OE1 GLU A 418 -5.221 7.088 7.238 1.00 1.31 O ATOM 336 OE2 GLU A 418 -7.293 7.707 7.586 1.00 1.37 O ATOM 0 H GLU A 418 -9.553 5.357 3.432 1.00 0.23 H new ATOM 0 HA GLU A 418 -7.229 6.969 2.830 1.00 0.25 H new ATOM 0 HB2 GLU A 418 -7.808 5.687 5.474 1.00 0.36 H new ATOM 0 HB3 GLU A 418 -6.202 5.408 4.829 1.00 0.36 H new ATOM 0 HG2 GLU A 418 -5.699 7.726 4.811 1.00 0.84 H new ATOM 0 HG3 GLU A 418 -7.370 8.167 5.102 1.00 0.84 H new ATOM 343 N TYR A 419 -5.987 4.806 2.228 1.00 0.17 N ATOM 344 CA TYR A 419 -5.393 3.566 1.743 1.00 0.16 C ATOM 345 C TYR A 419 -4.078 3.367 2.452 1.00 0.19 C ATOM 346 O TYR A 419 -3.110 4.085 2.200 1.00 0.29 O ATOM 347 CB TYR A 419 -5.155 3.546 0.222 1.00 0.16 C ATOM 348 CG TYR A 419 -6.424 3.642 -0.644 1.00 0.14 C ATOM 349 CD1 TYR A 419 -7.212 2.514 -0.941 1.00 0.12 C ATOM 350 CD2 TYR A 419 -6.837 4.862 -1.180 1.00 0.17 C ATOM 351 CE1 TYR A 419 -8.345 2.617 -1.735 1.00 0.12 C ATOM 352 CE2 TYR A 419 -7.965 4.949 -1.966 1.00 0.18 C ATOM 353 CZ TYR A 419 -8.709 3.835 -2.239 1.00 0.14 C ATOM 354 OH TYR A 419 -9.840 3.949 -3.015 1.00 0.19 O ATOM 0 H TYR A 419 -5.386 5.626 2.143 1.00 0.17 H new ATOM 0 HA TYR A 419 -6.099 2.762 1.954 1.00 0.16 H new ATOM 0 HB2 TYR A 419 -4.495 4.374 -0.037 1.00 0.16 H new ATOM 0 HB3 TYR A 419 -4.629 2.627 -0.035 1.00 0.16 H new ATOM 0 HD1 TYR A 419 -6.929 1.550 -0.543 1.00 0.12 H new ATOM 0 HD2 TYR A 419 -6.263 5.753 -0.975 1.00 0.17 H new ATOM 0 HE1 TYR A 419 -8.936 1.740 -1.954 1.00 0.12 H new ATOM 0 HE2 TYR A 419 -8.264 5.905 -2.370 1.00 0.18 H new ATOM 0 HH TYR A 419 -10.263 4.818 -2.852 1.00 0.19 H new ATOM 364 N ILE A 420 -4.057 2.420 3.362 1.00 0.18 N ATOM 365 CA ILE A 420 -2.864 2.150 4.119 1.00 0.18 C ATOM 366 C ILE A 420 -2.041 1.091 3.428 1.00 0.17 C ATOM 367 O ILE A 420 -2.510 -0.019 3.174 1.00 0.21 O ATOM 368 CB ILE A 420 -3.190 1.718 5.555 1.00 0.22 C ATOM 369 CG1 ILE A 420 -3.807 2.900 6.285 1.00 0.32 C ATOM 370 CG2 ILE A 420 -1.930 1.243 6.278 1.00 0.26 C ATOM 371 CD1 ILE A 420 -4.684 2.513 7.437 1.00 0.32 C ATOM 0 H ILE A 420 -4.854 1.826 3.593 1.00 0.18 H new ATOM 0 HA ILE A 420 -2.288 3.074 4.175 1.00 0.18 H new ATOM 0 HB ILE A 420 -3.893 0.885 5.535 1.00 0.22 H new ATOM 0 HG12 ILE A 420 -3.008 3.546 6.650 1.00 0.32 H new ATOM 0 HG13 ILE A 420 -4.392 3.486 5.577 1.00 0.32 H new ATOM 0 HG21 ILE A 420 -2.185 0.942 7.294 1.00 0.26 H new ATOM 0 HG22 ILE A 420 -1.503 0.394 5.744 1.00 0.26 H new ATOM 0 HG23 ILE A 420 -1.202 2.054 6.312 1.00 0.26 H new ATOM 0 HD11 ILE A 420 -5.086 3.411 7.906 1.00 0.32 H new ATOM 0 HD12 ILE A 420 -5.505 1.893 7.077 1.00 0.32 H new ATOM 0 HD13 ILE A 420 -4.100 1.953 8.167 1.00 0.32 H new ATOM 383 N ILE A 421 -0.824 1.451 3.111 1.00 0.15 N ATOM 384 CA ILE A 421 0.071 0.548 2.429 1.00 0.18 C ATOM 385 C ILE A 421 1.070 0.011 3.426 1.00 0.19 C ATOM 386 O ILE A 421 1.944 0.731 3.906 1.00 0.30 O ATOM 387 CB ILE A 421 0.798 1.227 1.257 1.00 0.19 C ATOM 388 CG1 ILE A 421 -0.225 1.724 0.232 1.00 0.20 C ATOM 389 CG2 ILE A 421 1.758 0.232 0.620 1.00 0.24 C ATOM 390 CD1 ILE A 421 0.281 2.818 -0.671 1.00 0.32 C ATOM 0 H ILE A 421 -0.427 2.368 3.315 1.00 0.15 H new ATOM 0 HA ILE A 421 -0.517 -0.266 2.005 1.00 0.18 H new ATOM 0 HB ILE A 421 1.366 2.084 1.619 1.00 0.19 H new ATOM 0 HG12 ILE A 421 -0.545 0.882 -0.382 1.00 0.20 H new ATOM 0 HG13 ILE A 421 -1.106 2.085 0.762 1.00 0.20 H new ATOM 0 HG21 ILE A 421 2.277 0.708 -0.212 1.00 0.24 H new ATOM 0 HG22 ILE A 421 2.486 -0.096 1.361 1.00 0.24 H new ATOM 0 HG23 ILE A 421 1.199 -0.629 0.254 1.00 0.24 H new ATOM 0 HD11 ILE A 421 -0.507 3.110 -1.365 1.00 0.32 H new ATOM 0 HD12 ILE A 421 0.573 3.679 -0.070 1.00 0.32 H new ATOM 0 HD13 ILE A 421 1.143 2.457 -1.232 1.00 0.32 H new ATOM 402 N SER A 422 0.902 -1.247 3.747 1.00 0.14 N ATOM 403 CA SER A 422 1.693 -1.896 4.768 1.00 0.14 C ATOM 404 C SER A 422 2.830 -2.667 4.129 1.00 0.16 C ATOM 405 O SER A 422 2.668 -3.806 3.694 1.00 0.36 O ATOM 406 CB SER A 422 0.836 -2.853 5.581 1.00 0.18 C ATOM 407 OG SER A 422 1.253 -2.913 6.932 1.00 0.88 O ATOM 0 H SER A 422 0.211 -1.854 3.307 1.00 0.14 H new ATOM 0 HA SER A 422 2.095 -1.128 5.429 1.00 0.14 H new ATOM 0 HB2 SER A 422 -0.206 -2.536 5.536 1.00 0.18 H new ATOM 0 HB3 SER A 422 0.885 -3.849 5.141 1.00 0.18 H new ATOM 0 HG SER A 422 1.555 -3.822 7.141 1.00 0.88 H new ATOM 413 N CYS A 423 3.964 -2.024 4.064 1.00 0.14 N ATOM 414 CA CYS A 423 5.168 -2.636 3.535 1.00 0.12 C ATOM 415 C CYS A 423 5.878 -3.454 4.607 1.00 0.12 C ATOM 416 O CYS A 423 6.597 -2.911 5.443 1.00 0.13 O ATOM 417 CB CYS A 423 6.104 -1.572 2.977 1.00 0.14 C ATOM 418 SG CYS A 423 5.455 -0.699 1.535 1.00 0.95 S ATOM 0 H CYS A 423 4.087 -1.060 4.375 1.00 0.14 H new ATOM 0 HA CYS A 423 4.880 -3.308 2.727 1.00 0.12 H new ATOM 0 HB2 CYS A 423 6.319 -0.846 3.761 1.00 0.14 H new ATOM 0 HB3 CYS A 423 7.050 -2.041 2.708 1.00 0.14 H new ATOM 0 HG CYS A 423 6.286 -0.822 0.543 1.00 0.95 H new ATOM 424 N HIS A 424 5.665 -4.759 4.573 1.00 0.13 N ATOM 425 CA HIS A 424 6.281 -5.672 5.535 1.00 0.15 C ATOM 426 C HIS A 424 7.617 -6.180 5.003 1.00 0.15 C ATOM 427 O HIS A 424 7.668 -6.900 4.010 1.00 0.16 O ATOM 428 CB HIS A 424 5.364 -6.861 5.827 1.00 0.18 C ATOM 429 CG HIS A 424 4.170 -6.544 6.680 1.00 0.19 C ATOM 430 ND1 HIS A 424 4.096 -6.859 8.022 1.00 0.24 N ATOM 431 CD2 HIS A 424 2.985 -5.960 6.371 1.00 0.24 C ATOM 432 CE1 HIS A 424 2.921 -6.484 8.498 1.00 0.25 C ATOM 433 NE2 HIS A 424 2.230 -5.934 7.518 1.00 0.25 N ATOM 0 H HIS A 424 5.066 -5.217 3.886 1.00 0.13 H new ATOM 0 HA HIS A 424 6.445 -5.120 6.461 1.00 0.15 H new ATOM 0 HB2 HIS A 424 5.016 -7.274 4.880 1.00 0.18 H new ATOM 0 HB3 HIS A 424 5.948 -7.639 6.319 1.00 0.18 H new ATOM 0 HD1 HIS A 424 4.834 -7.311 8.563 1.00 0.24 H new ATOM 0 HD2 HIS A 424 2.690 -5.585 5.402 1.00 0.24 H new ATOM 0 HE1 HIS A 424 2.584 -6.607 9.517 1.00 0.25 H new ATOM 442 N PRO A 425 8.706 -5.804 5.666 1.00 0.17 N ATOM 443 CA PRO A 425 10.056 -6.192 5.268 1.00 0.17 C ATOM 444 C PRO A 425 10.328 -7.666 5.456 1.00 0.18 C ATOM 445 O PRO A 425 9.982 -8.274 6.472 1.00 0.24 O ATOM 446 CB PRO A 425 10.984 -5.372 6.168 1.00 0.21 C ATOM 447 CG PRO A 425 10.107 -4.502 7.011 1.00 0.32 C ATOM 448 CD PRO A 425 8.693 -4.976 6.866 1.00 0.22 C ATOM 0 HA PRO A 425 10.205 -6.004 4.205 1.00 0.17 H new ATOM 0 HB2 PRO A 425 11.595 -6.025 6.791 1.00 0.21 H new ATOM 0 HB3 PRO A 425 11.668 -4.769 5.571 1.00 0.21 H new ATOM 0 HG2 PRO A 425 10.418 -4.548 8.055 1.00 0.32 H new ATOM 0 HG3 PRO A 425 10.192 -3.461 6.699 1.00 0.32 H new ATOM 0 HD2 PRO A 425 8.374 -5.547 7.738 1.00 0.22 H new ATOM 0 HD3 PRO A 425 8.002 -4.139 6.763 1.00 0.22 H new ATOM 456 N VAL A 426 10.955 -8.214 4.446 1.00 0.15 N ATOM 457 CA VAL A 426 11.367 -9.594 4.425 1.00 0.19 C ATOM 458 C VAL A 426 12.887 -9.646 4.558 1.00 0.20 C ATOM 459 O VAL A 426 13.589 -8.851 3.935 1.00 0.20 O ATOM 460 CB VAL A 426 10.971 -10.243 3.094 1.00 0.20 C ATOM 461 CG1 VAL A 426 11.255 -11.737 3.077 1.00 0.27 C ATOM 462 CG2 VAL A 426 9.525 -9.958 2.733 1.00 0.21 C ATOM 0 H VAL A 426 11.198 -7.702 3.598 1.00 0.15 H new ATOM 0 HA VAL A 426 10.885 -10.129 5.244 1.00 0.19 H new ATOM 0 HB VAL A 426 11.598 -9.785 2.329 1.00 0.20 H new ATOM 0 HG11 VAL A 426 10.958 -12.153 2.114 1.00 0.27 H new ATOM 0 HG12 VAL A 426 12.320 -11.907 3.233 1.00 0.27 H new ATOM 0 HG13 VAL A 426 10.690 -12.224 3.872 1.00 0.27 H new ATOM 0 HG21 VAL A 426 9.286 -10.436 1.783 1.00 0.21 H new ATOM 0 HG22 VAL A 426 8.871 -10.351 3.512 1.00 0.21 H new ATOM 0 HG23 VAL A 426 9.377 -8.882 2.645 1.00 0.21 H new ATOM 472 N GLY A 427 13.385 -10.555 5.368 1.00 0.26 N ATOM 473 CA GLY A 427 14.822 -10.666 5.567 1.00 0.29 C ATOM 474 C GLY A 427 15.259 -10.017 6.862 1.00 0.32 C ATOM 475 O GLY A 427 16.100 -10.550 7.584 1.00 0.38 O ATOM 0 H GLY A 427 12.826 -11.224 5.897 1.00 0.26 H new ATOM 0 HA2 GLY A 427 15.109 -11.718 5.572 1.00 0.29 H new ATOM 0 HA3 GLY A 427 15.342 -10.198 4.731 1.00 0.29 H new ATOM 479 N THR A 428 14.673 -8.872 7.159 1.00 0.31 N ATOM 480 CA THR A 428 14.964 -8.155 8.384 1.00 0.37 C ATOM 481 C THR A 428 13.886 -8.368 9.423 1.00 0.41 C ATOM 482 O THR A 428 12.860 -9.001 9.162 1.00 0.41 O ATOM 483 CB THR A 428 15.056 -6.647 8.148 1.00 0.37 C ATOM 484 OG1 THR A 428 14.124 -6.246 7.134 1.00 0.30 O ATOM 485 CG2 THR A 428 16.464 -6.226 7.762 1.00 0.42 C ATOM 0 H THR A 428 13.985 -8.415 6.560 1.00 0.31 H new ATOM 0 HA THR A 428 15.919 -8.547 8.734 1.00 0.37 H new ATOM 0 HB THR A 428 14.804 -6.148 9.084 1.00 0.37 H new ATOM 0 HG1 THR A 428 14.191 -5.279 6.993 1.00 0.30 H new ATOM 0 HG21 THR A 428 16.491 -5.148 7.602 1.00 0.42 H new ATOM 0 HG22 THR A 428 17.155 -6.492 8.562 1.00 0.42 H new ATOM 0 HG23 THR A 428 16.758 -6.736 6.844 1.00 0.42 H new ATOM 493 N ASP A 429 14.129 -7.823 10.602 1.00 0.48 N ATOM 494 CA ASP A 429 13.128 -7.782 11.643 1.00 0.54 C ATOM 495 C ASP A 429 12.515 -6.400 11.716 1.00 0.49 C ATOM 496 O ASP A 429 12.001 -5.992 12.757 1.00 0.59 O ATOM 497 CB ASP A 429 13.720 -8.127 13.001 1.00 0.69 C ATOM 498 CG ASP A 429 14.477 -9.436 13.002 1.00 1.09 C ATOM 499 OD1 ASP A 429 13.833 -10.500 13.133 1.00 1.06 O ATOM 500 OD2 ASP A 429 15.719 -9.411 12.872 1.00 1.78 O ATOM 0 H ASP A 429 15.021 -7.400 10.860 1.00 0.48 H new ATOM 0 HA ASP A 429 12.367 -8.522 11.395 1.00 0.54 H new ATOM 0 HB2 ASP A 429 14.390 -7.326 13.313 1.00 0.69 H new ATOM 0 HB3 ASP A 429 12.919 -8.177 13.738 1.00 0.69 H new ATOM 505 N GLU A 430 12.598 -5.669 10.618 1.00 0.40 N ATOM 506 CA GLU A 430 12.089 -4.320 10.578 1.00 0.38 C ATOM 507 C GLU A 430 10.592 -4.287 10.570 1.00 0.31 C ATOM 508 O GLU A 430 9.919 -5.279 10.280 1.00 0.33 O ATOM 509 CB GLU A 430 12.627 -3.570 9.375 1.00 0.38 C ATOM 510 CG GLU A 430 14.082 -3.187 9.504 1.00 0.48 C ATOM 511 CD GLU A 430 14.381 -2.420 10.775 1.00 1.58 C ATOM 512 OE1 GLU A 430 14.491 -3.047 11.850 1.00 2.50 O ATOM 513 OE2 GLU A 430 14.507 -1.183 10.708 1.00 1.64 O ATOM 0 H GLU A 430 13.014 -5.992 9.745 1.00 0.40 H new ATOM 0 HA GLU A 430 12.433 -3.827 11.487 1.00 0.38 H new ATOM 0 HB2 GLU A 430 12.500 -4.187 8.486 1.00 0.38 H new ATOM 0 HB3 GLU A 430 12.034 -2.668 9.225 1.00 0.38 H new ATOM 0 HG2 GLU A 430 14.693 -4.089 9.478 1.00 0.48 H new ATOM 0 HG3 GLU A 430 14.370 -2.582 8.645 1.00 0.48 H new ATOM 520 N GLU A 431 10.088 -3.119 10.884 1.00 0.29 N ATOM 521 CA GLU A 431 8.690 -2.927 11.051 1.00 0.26 C ATOM 522 C GLU A 431 8.059 -2.621 9.703 1.00 0.24 C ATOM 523 O GLU A 431 8.719 -2.123 8.789 1.00 0.26 O ATOM 524 CB GLU A 431 8.433 -1.791 12.037 1.00 0.29 C ATOM 525 CG GLU A 431 8.450 -0.432 11.378 1.00 0.63 C ATOM 526 CD GLU A 431 8.155 0.701 12.335 1.00 0.87 C ATOM 527 OE1 GLU A 431 9.104 1.397 12.748 1.00 1.11 O ATOM 528 OE2 GLU A 431 6.969 0.905 12.672 1.00 1.05 O ATOM 0 H GLU A 431 10.648 -2.279 11.029 1.00 0.29 H new ATOM 0 HA GLU A 431 8.242 -3.836 11.453 1.00 0.26 H new ATOM 0 HB2 GLU A 431 7.467 -1.945 12.518 1.00 0.29 H new ATOM 0 HB3 GLU A 431 9.189 -1.819 12.822 1.00 0.29 H new ATOM 0 HG2 GLU A 431 9.427 -0.269 10.923 1.00 0.63 H new ATOM 0 HG3 GLU A 431 7.716 -0.418 10.572 1.00 0.63 H new ATOM 535 N PRO A 432 6.782 -2.937 9.572 1.00 0.23 N ATOM 536 CA PRO A 432 6.031 -2.649 8.370 1.00 0.21 C ATOM 537 C PRO A 432 5.863 -1.159 8.186 1.00 0.20 C ATOM 538 O PRO A 432 5.247 -0.483 9.012 1.00 0.24 O ATOM 539 CB PRO A 432 4.669 -3.315 8.590 1.00 0.24 C ATOM 540 CG PRO A 432 4.617 -3.721 10.032 1.00 0.23 C ATOM 541 CD PRO A 432 6.001 -3.585 10.611 1.00 0.24 C ATOM 0 HA PRO A 432 6.535 -3.018 7.477 1.00 0.21 H new ATOM 0 HB2 PRO A 432 3.858 -2.626 8.352 1.00 0.24 H new ATOM 0 HB3 PRO A 432 4.552 -4.182 7.939 1.00 0.24 H new ATOM 0 HG2 PRO A 432 3.913 -3.093 10.578 1.00 0.23 H new ATOM 0 HG3 PRO A 432 4.266 -4.749 10.125 1.00 0.23 H new ATOM 0 HD2 PRO A 432 5.990 -2.991 11.525 1.00 0.24 H new ATOM 0 HD3 PRO A 432 6.418 -4.558 10.869 1.00 0.24 H new ATOM 549 N LEU A 433 6.423 -0.650 7.109 1.00 0.20 N ATOM 550 CA LEU A 433 6.271 0.741 6.770 1.00 0.20 C ATOM 551 C LEU A 433 4.866 0.978 6.298 1.00 0.20 C ATOM 552 O LEU A 433 4.453 0.474 5.253 1.00 0.30 O ATOM 553 CB LEU A 433 7.235 1.143 5.676 1.00 0.22 C ATOM 554 CG LEU A 433 8.641 1.518 6.136 1.00 0.24 C ATOM 555 CD1 LEU A 433 9.435 0.288 6.528 1.00 0.65 C ATOM 556 CD2 LEU A 433 9.359 2.309 5.058 1.00 0.73 C ATOM 0 H LEU A 433 6.990 -1.186 6.452 1.00 0.20 H new ATOM 0 HA LEU A 433 6.484 1.340 7.656 1.00 0.20 H new ATOM 0 HB2 LEU A 433 7.313 0.320 4.965 1.00 0.22 H new ATOM 0 HB3 LEU A 433 6.811 1.990 5.137 1.00 0.22 H new ATOM 0 HG LEU A 433 8.552 2.148 7.021 1.00 0.24 H new ATOM 0 HD11 LEU A 433 10.432 0.586 6.851 1.00 0.65 H new ATOM 0 HD12 LEU A 433 8.928 -0.227 7.344 1.00 0.65 H new ATOM 0 HD13 LEU A 433 9.516 -0.381 5.671 1.00 0.65 H new ATOM 0 HD21 LEU A 433 10.360 2.568 5.403 1.00 0.73 H new ATOM 0 HD22 LEU A 433 9.432 1.707 4.152 1.00 0.73 H new ATOM 0 HD23 LEU A 433 8.802 3.221 4.844 1.00 0.73 H new ATOM 568 N GLN A 434 4.137 1.719 7.076 1.00 0.17 N ATOM 569 CA GLN A 434 2.758 1.977 6.770 1.00 0.17 C ATOM 570 C GLN A 434 2.567 3.375 6.253 1.00 0.20 C ATOM 571 O GLN A 434 2.816 4.365 6.939 1.00 0.27 O ATOM 572 CB GLN A 434 1.870 1.700 7.968 1.00 0.18 C ATOM 573 CG GLN A 434 1.422 0.254 8.004 1.00 0.21 C ATOM 574 CD GLN A 434 0.638 -0.121 9.245 1.00 0.38 C ATOM 575 OE1 GLN A 434 0.907 0.543 10.355 1.00 1.26 O flip ATOM 576 NE2 GLN A 434 -0.208 -1.013 9.206 1.00 0.74 N flip ATOM 0 H GLN A 434 4.474 2.159 7.932 1.00 0.17 H new ATOM 0 HA GLN A 434 2.459 1.293 5.976 1.00 0.17 H new ATOM 0 HB2 GLN A 434 2.409 1.938 8.885 1.00 0.18 H new ATOM 0 HB3 GLN A 434 0.997 2.352 7.934 1.00 0.18 H new ATOM 0 HG2 GLN A 434 0.809 0.053 7.126 1.00 0.21 H new ATOM 0 HG3 GLN A 434 2.300 -0.389 7.934 1.00 0.21 H new ATOM 0 HE21 GLN A 434 -0.390 -1.505 8.331 1.00 0.74 H new ATOM 0 HE22 GLN A 434 -0.727 -1.260 10.048 1.00 0.74 H new ATOM 585 N PHE A 435 2.130 3.422 5.025 1.00 0.20 N ATOM 586 CA PHE A 435 1.905 4.679 4.336 1.00 0.23 C ATOM 587 C PHE A 435 0.419 4.940 4.203 1.00 0.21 C ATOM 588 O PHE A 435 -0.349 4.056 3.826 1.00 0.24 O ATOM 589 CB PHE A 435 2.573 4.680 2.955 1.00 0.25 C ATOM 590 CG PHE A 435 4.074 4.647 3.006 1.00 0.31 C ATOM 591 CD1 PHE A 435 4.756 3.440 2.935 1.00 0.36 C ATOM 592 CD2 PHE A 435 4.804 5.818 3.121 1.00 0.38 C ATOM 593 CE1 PHE A 435 6.136 3.405 2.977 1.00 0.43 C ATOM 594 CE2 PHE A 435 6.183 5.789 3.166 1.00 0.46 C ATOM 595 CZ PHE A 435 6.851 4.580 3.094 1.00 0.47 C ATOM 0 H PHE A 435 1.918 2.595 4.467 1.00 0.20 H new ATOM 0 HA PHE A 435 2.355 5.477 4.927 1.00 0.23 H new ATOM 0 HB2 PHE A 435 2.219 3.817 2.390 1.00 0.25 H new ATOM 0 HB3 PHE A 435 2.257 5.569 2.410 1.00 0.25 H new ATOM 0 HD1 PHE A 435 4.201 2.518 2.846 1.00 0.36 H new ATOM 0 HD2 PHE A 435 4.288 6.765 3.176 1.00 0.38 H new ATOM 0 HE1 PHE A 435 6.655 2.460 2.918 1.00 0.43 H new ATOM 0 HE2 PHE A 435 6.740 6.710 3.257 1.00 0.46 H new ATOM 0 HZ PHE A 435 7.930 4.555 3.129 1.00 0.47 H new ATOM 605 N ARG A 436 0.024 6.154 4.540 1.00 0.22 N ATOM 606 CA ARG A 436 -1.375 6.542 4.533 1.00 0.21 C ATOM 607 C ARG A 436 -1.631 7.569 3.441 1.00 0.19 C ATOM 608 O ARG A 436 -1.165 8.703 3.533 1.00 0.27 O ATOM 609 CB ARG A 436 -1.753 7.137 5.886 1.00 0.27 C ATOM 610 CG ARG A 436 -1.792 6.118 7.006 1.00 0.72 C ATOM 611 CD ARG A 436 -1.761 6.781 8.373 1.00 0.74 C ATOM 612 NE ARG A 436 -0.557 7.587 8.563 1.00 1.52 N ATOM 613 CZ ARG A 436 0.416 7.294 9.425 1.00 2.15 C ATOM 614 NH1 ARG A 436 0.368 6.174 10.141 1.00 2.32 N ATOM 615 NH2 ARG A 436 1.451 8.115 9.551 1.00 3.14 N ATOM 0 H ARG A 436 0.662 6.897 4.826 1.00 0.22 H new ATOM 0 HA ARG A 436 -1.982 5.657 4.341 1.00 0.21 H new ATOM 0 HB2 ARG A 436 -1.038 7.919 6.142 1.00 0.27 H new ATOM 0 HB3 ARG A 436 -2.730 7.613 5.804 1.00 0.27 H new ATOM 0 HG2 ARG A 436 -2.694 5.513 6.916 1.00 0.72 H new ATOM 0 HG3 ARG A 436 -0.943 5.441 6.911 1.00 0.72 H new ATOM 0 HD2 ARG A 436 -2.642 7.412 8.490 1.00 0.74 H new ATOM 0 HD3 ARG A 436 -1.811 6.016 9.148 1.00 0.74 H new ATOM 0 HE ARG A 436 -0.455 8.430 7.998 1.00 1.52 H new ATOM 0 HH11 ARG A 436 -0.417 5.532 10.032 1.00 2.32 H new ATOM 0 HH12 ARG A 436 1.117 5.957 10.799 1.00 2.32 H new ATOM 0 HH21 ARG A 436 1.499 8.965 8.990 1.00 3.14 H new ATOM 0 HH22 ARG A 436 2.199 7.896 10.209 1.00 3.14 H new ATOM 629 N VAL A 437 -2.355 7.179 2.407 1.00 0.17 N ATOM 630 CA VAL A 437 -2.686 8.094 1.336 1.00 0.16 C ATOM 631 C VAL A 437 -4.177 8.349 1.298 1.00 0.16 C ATOM 632 O VAL A 437 -4.978 7.554 1.800 1.00 0.17 O ATOM 633 CB VAL A 437 -2.210 7.594 -0.048 1.00 0.16 C ATOM 634 CG1 VAL A 437 -0.712 7.355 -0.040 1.00 0.20 C ATOM 635 CG2 VAL A 437 -2.955 6.341 -0.476 1.00 0.14 C ATOM 0 H VAL A 437 -2.723 6.235 2.289 1.00 0.17 H new ATOM 0 HA VAL A 437 -2.156 9.023 1.548 1.00 0.16 H new ATOM 0 HB VAL A 437 -2.434 8.372 -0.778 1.00 0.16 H new ATOM 0 HG11 VAL A 437 -0.394 7.004 -1.022 1.00 0.20 H new ATOM 0 HG12 VAL A 437 -0.196 8.286 0.197 1.00 0.20 H new ATOM 0 HG13 VAL A 437 -0.467 6.604 0.711 1.00 0.20 H new ATOM 0 HG21 VAL A 437 -2.594 6.019 -1.453 1.00 0.14 H new ATOM 0 HG22 VAL A 437 -2.784 5.549 0.253 1.00 0.14 H new ATOM 0 HG23 VAL A 437 -4.022 6.555 -0.536 1.00 0.14 H new ATOM 645 N PRO A 438 -4.535 9.495 0.724 1.00 0.17 N ATOM 646 CA PRO A 438 -5.919 9.953 0.598 1.00 0.18 C ATOM 647 C PRO A 438 -6.821 8.877 -0.011 1.00 0.16 C ATOM 648 O PRO A 438 -6.413 8.152 -0.919 1.00 0.14 O ATOM 649 CB PRO A 438 -5.779 11.168 -0.349 1.00 0.19 C ATOM 650 CG PRO A 438 -4.406 11.670 -0.059 1.00 0.21 C ATOM 651 CD PRO A 438 -3.579 10.453 0.164 1.00 0.19 C ATOM 0 HA PRO A 438 -6.382 10.192 1.555 1.00 0.18 H new ATOM 0 HB2 PRO A 438 -5.889 10.879 -1.394 1.00 0.19 H new ATOM 0 HB3 PRO A 438 -6.536 11.926 -0.146 1.00 0.19 H new ATOM 0 HG2 PRO A 438 -4.020 12.260 -0.890 1.00 0.21 H new ATOM 0 HG3 PRO A 438 -4.401 12.315 0.820 1.00 0.21 H new ATOM 0 HD2 PRO A 438 -3.141 10.088 -0.765 1.00 0.19 H new ATOM 0 HD3 PRO A 438 -2.755 10.647 0.850 1.00 0.19 H new ATOM 659 N GLY A 439 -8.047 8.792 0.489 1.00 0.19 N ATOM 660 CA GLY A 439 -8.934 7.705 0.147 1.00 0.20 C ATOM 661 C GLY A 439 -9.431 7.709 -1.285 1.00 0.18 C ATOM 662 O GLY A 439 -10.116 6.776 -1.703 1.00 0.20 O ATOM 0 H GLY A 439 -8.445 9.472 1.137 1.00 0.19 H new ATOM 0 HA2 GLY A 439 -8.419 6.763 0.334 1.00 0.20 H new ATOM 0 HA3 GLY A 439 -9.795 7.735 0.815 1.00 0.20 H new ATOM 666 N THR A 440 -9.147 8.753 -2.034 1.00 0.16 N ATOM 667 CA THR A 440 -9.527 8.764 -3.429 1.00 0.18 C ATOM 668 C THR A 440 -8.333 8.409 -4.331 1.00 0.16 C ATOM 669 O THR A 440 -8.512 8.017 -5.487 1.00 0.19 O ATOM 670 CB THR A 440 -10.082 10.134 -3.837 1.00 0.24 C ATOM 671 OG1 THR A 440 -9.303 11.180 -3.237 1.00 0.27 O ATOM 672 CG2 THR A 440 -11.535 10.273 -3.425 1.00 0.29 C ATOM 0 H THR A 440 -8.664 9.590 -1.708 1.00 0.16 H new ATOM 0 HA THR A 440 -10.305 8.012 -3.558 1.00 0.18 H new ATOM 0 HB THR A 440 -10.021 10.217 -4.922 1.00 0.24 H new ATOM 0 HG1 THR A 440 -9.664 12.051 -3.505 1.00 0.27 H new ATOM 0 HG21 THR A 440 -11.906 11.253 -3.725 1.00 0.29 H new ATOM 0 HG22 THR A 440 -12.127 9.497 -3.910 1.00 0.29 H new ATOM 0 HG23 THR A 440 -11.618 10.169 -2.343 1.00 0.29 H new ATOM 680 N SER A 441 -7.120 8.558 -3.791 1.00 0.13 N ATOM 681 CA SER A 441 -5.890 8.249 -4.508 1.00 0.12 C ATOM 682 C SER A 441 -5.810 6.775 -4.899 1.00 0.11 C ATOM 683 O SER A 441 -6.234 5.899 -4.151 1.00 0.12 O ATOM 684 CB SER A 441 -4.695 8.609 -3.627 1.00 0.13 C ATOM 685 OG SER A 441 -4.700 9.992 -3.301 1.00 0.16 O ATOM 0 H SER A 441 -6.968 8.898 -2.841 1.00 0.13 H new ATOM 0 HA SER A 441 -5.879 8.834 -5.427 1.00 0.12 H new ATOM 0 HB2 SER A 441 -4.721 8.016 -2.713 1.00 0.13 H new ATOM 0 HB3 SER A 441 -3.769 8.357 -4.144 1.00 0.13 H new ATOM 0 HG SER A 441 -3.851 10.230 -2.874 1.00 0.16 H new ATOM 691 N THR A 442 -5.260 6.507 -6.075 1.00 0.10 N ATOM 692 CA THR A 442 -5.112 5.141 -6.545 1.00 0.12 C ATOM 693 C THR A 442 -3.658 4.838 -6.899 1.00 0.13 C ATOM 694 O THR A 442 -3.359 3.845 -7.562 1.00 0.16 O ATOM 695 CB THR A 442 -6.028 4.860 -7.755 1.00 0.13 C ATOM 696 OG1 THR A 442 -5.822 5.854 -8.769 1.00 0.14 O ATOM 697 CG2 THR A 442 -7.492 4.855 -7.332 1.00 0.17 C ATOM 0 H THR A 442 -4.910 7.217 -6.718 1.00 0.10 H new ATOM 0 HA THR A 442 -5.414 4.482 -5.731 1.00 0.12 H new ATOM 0 HB THR A 442 -5.776 3.878 -8.155 1.00 0.13 H new ATOM 0 HG1 THR A 442 -6.406 5.667 -9.534 1.00 0.14 H new ATOM 0 HG21 THR A 442 -8.121 4.655 -8.200 1.00 0.17 H new ATOM 0 HG22 THR A 442 -7.651 4.080 -6.582 1.00 0.17 H new ATOM 0 HG23 THR A 442 -7.752 5.826 -6.911 1.00 0.17 H new ATOM 705 N SER A 443 -2.752 5.706 -6.457 1.00 0.12 N ATOM 706 CA SER A 443 -1.322 5.529 -6.687 1.00 0.15 C ATOM 707 C SER A 443 -0.536 6.342 -5.667 1.00 0.15 C ATOM 708 O SER A 443 -0.971 7.416 -5.253 1.00 0.19 O ATOM 709 CB SER A 443 -0.929 5.960 -8.107 1.00 0.17 C ATOM 710 OG SER A 443 -1.721 5.311 -9.089 1.00 1.08 O ATOM 0 H SER A 443 -2.987 6.548 -5.932 1.00 0.12 H new ATOM 0 HA SER A 443 -1.087 4.470 -6.577 1.00 0.15 H new ATOM 0 HB2 SER A 443 -1.041 7.040 -8.204 1.00 0.17 H new ATOM 0 HB3 SER A 443 0.123 5.732 -8.279 1.00 0.17 H new ATOM 0 HG SER A 443 -2.203 4.563 -8.678 1.00 1.08 H new ATOM 716 N ALA A 444 0.605 5.819 -5.250 1.00 0.14 N ATOM 717 CA ALA A 444 1.441 6.495 -4.267 1.00 0.15 C ATOM 718 C ALA A 444 2.894 6.208 -4.474 1.00 0.16 C ATOM 719 O ALA A 444 3.301 5.081 -4.755 1.00 0.15 O ATOM 720 CB ALA A 444 1.040 6.101 -2.861 1.00 0.16 C ATOM 0 H ALA A 444 0.976 4.927 -5.577 1.00 0.14 H new ATOM 0 HA ALA A 444 1.286 7.565 -4.402 1.00 0.15 H new ATOM 0 HB1 ALA A 444 1.677 6.617 -2.143 1.00 0.16 H new ATOM 0 HB2 ALA A 444 -0.000 6.378 -2.688 1.00 0.16 H new ATOM 0 HB3 ALA A 444 1.154 5.024 -2.738 1.00 0.16 H new ATOM 726 N THR A 445 3.659 7.259 -4.353 1.00 0.24 N ATOM 727 CA THR A 445 5.083 7.168 -4.371 1.00 0.25 C ATOM 728 C THR A 445 5.605 6.930 -2.978 1.00 0.26 C ATOM 729 O THR A 445 5.564 7.800 -2.108 1.00 0.33 O ATOM 730 CB THR A 445 5.672 8.439 -4.956 1.00 0.31 C ATOM 731 OG1 THR A 445 5.309 8.541 -6.342 1.00 0.34 O ATOM 732 CG2 THR A 445 7.190 8.464 -4.803 1.00 0.34 C ATOM 0 H THR A 445 3.303 8.208 -4.238 1.00 0.24 H new ATOM 0 HA THR A 445 5.381 6.326 -4.996 1.00 0.25 H new ATOM 0 HB THR A 445 5.269 9.292 -4.411 1.00 0.31 H new ATOM 0 HG1 THR A 445 5.688 9.362 -6.720 1.00 0.34 H new ATOM 0 HG21 THR A 445 7.584 9.386 -5.231 1.00 0.34 H new ATOM 0 HG22 THR A 445 7.450 8.415 -3.746 1.00 0.34 H new ATOM 0 HG23 THR A 445 7.622 7.609 -5.323 1.00 0.34 H new ATOM 740 N LEU A 446 6.082 5.730 -2.784 1.00 0.22 N ATOM 741 CA LEU A 446 6.508 5.286 -1.475 1.00 0.25 C ATOM 742 C LEU A 446 7.962 5.623 -1.195 1.00 0.24 C ATOM 743 O LEU A 446 8.875 4.908 -1.607 1.00 0.23 O ATOM 744 CB LEU A 446 6.230 3.774 -1.305 1.00 0.25 C ATOM 745 CG LEU A 446 4.898 3.419 -0.604 1.00 0.32 C ATOM 746 CD1 LEU A 446 3.753 4.239 -1.175 1.00 0.65 C ATOM 747 CD2 LEU A 446 4.601 1.932 -0.759 1.00 0.59 C ATOM 0 H LEU A 446 6.188 5.033 -3.521 1.00 0.22 H new ATOM 0 HA LEU A 446 5.922 5.830 -0.734 1.00 0.25 H new ATOM 0 HB2 LEU A 446 6.238 3.307 -2.290 1.00 0.25 H new ATOM 0 HB3 LEU A 446 7.049 3.333 -0.737 1.00 0.25 H new ATOM 0 HG LEU A 446 4.997 3.654 0.456 1.00 0.32 H new ATOM 0 HD11 LEU A 446 2.826 3.973 -0.667 1.00 0.65 H new ATOM 0 HD12 LEU A 446 3.956 5.300 -1.027 1.00 0.65 H new ATOM 0 HD13 LEU A 446 3.655 4.034 -2.241 1.00 0.65 H new ATOM 0 HD21 LEU A 446 3.661 1.695 -0.261 1.00 0.59 H new ATOM 0 HD22 LEU A 446 4.523 1.685 -1.818 1.00 0.59 H new ATOM 0 HD23 LEU A 446 5.406 1.351 -0.309 1.00 0.59 H new ATOM 759 N THR A 447 8.151 6.724 -0.481 1.00 0.30 N ATOM 760 CA THR A 447 9.468 7.157 -0.048 1.00 0.30 C ATOM 761 C THR A 447 9.823 6.556 1.306 1.00 0.29 C ATOM 762 O THR A 447 9.113 6.755 2.290 1.00 0.36 O ATOM 763 CB THR A 447 9.538 8.683 0.086 1.00 0.39 C ATOM 764 OG1 THR A 447 8.229 9.221 0.321 1.00 0.86 O ATOM 765 CG2 THR A 447 10.153 9.330 -1.134 1.00 0.60 C ATOM 0 H THR A 447 7.394 7.341 -0.187 1.00 0.30 H new ATOM 0 HA THR A 447 10.172 6.818 -0.808 1.00 0.30 H new ATOM 0 HB THR A 447 10.181 8.907 0.938 1.00 0.39 H new ATOM 0 HG1 THR A 447 8.286 10.196 0.407 1.00 0.86 H new ATOM 0 HG21 THR A 447 10.183 10.411 -0.996 1.00 0.60 H new ATOM 0 HG22 THR A 447 11.166 8.954 -1.274 1.00 0.60 H new ATOM 0 HG23 THR A 447 9.554 9.093 -2.013 1.00 0.60 H new ATOM 773 N GLY A 448 10.913 5.823 1.350 1.00 0.30 N ATOM 774 CA GLY A 448 11.429 5.347 2.624 1.00 0.38 C ATOM 775 C GLY A 448 11.929 3.919 2.579 1.00 0.30 C ATOM 776 O GLY A 448 12.740 3.522 3.415 1.00 0.38 O ATOM 0 H GLY A 448 11.457 5.544 0.533 1.00 0.30 H new ATOM 0 HA2 GLY A 448 12.243 5.998 2.943 1.00 0.38 H new ATOM 0 HA3 GLY A 448 10.644 5.425 3.376 1.00 0.38 H new ATOM 780 N LEU A 449 11.437 3.142 1.621 1.00 0.28 N ATOM 781 CA LEU A 449 11.861 1.762 1.455 1.00 0.25 C ATOM 782 C LEU A 449 13.370 1.646 1.325 1.00 0.25 C ATOM 783 O LEU A 449 13.993 2.293 0.475 1.00 0.34 O ATOM 784 CB LEU A 449 11.165 1.140 0.247 1.00 0.24 C ATOM 785 CG LEU A 449 9.640 1.081 0.338 1.00 0.21 C ATOM 786 CD1 LEU A 449 9.050 0.544 -0.950 1.00 0.27 C ATOM 787 CD2 LEU A 449 9.208 0.209 1.496 1.00 0.23 C ATOM 0 H LEU A 449 10.739 3.450 0.944 1.00 0.28 H new ATOM 0 HA LEU A 449 11.572 1.214 2.352 1.00 0.25 H new ATOM 0 HB2 LEU A 449 11.439 1.707 -0.643 1.00 0.24 H new ATOM 0 HB3 LEU A 449 11.545 0.128 0.109 1.00 0.24 H new ATOM 0 HG LEU A 449 9.274 2.095 0.502 1.00 0.21 H new ATOM 0 HD11 LEU A 449 7.964 0.509 -0.866 1.00 0.27 H new ATOM 0 HD12 LEU A 449 9.329 1.196 -1.778 1.00 0.27 H new ATOM 0 HD13 LEU A 449 9.432 -0.460 -1.134 1.00 0.27 H new ATOM 0 HD21 LEU A 449 8.119 0.180 1.543 1.00 0.23 H new ATOM 0 HD22 LEU A 449 9.592 -0.801 1.354 1.00 0.23 H new ATOM 0 HD23 LEU A 449 9.601 0.619 2.426 1.00 0.23 H new ATOM 799 N THR A 450 13.945 0.834 2.202 1.00 0.22 N ATOM 800 CA THR A 450 15.362 0.540 2.176 1.00 0.23 C ATOM 801 C THR A 450 15.672 -0.311 0.969 1.00 0.22 C ATOM 802 O THR A 450 14.889 -1.170 0.560 1.00 0.38 O ATOM 803 CB THR A 450 15.796 -0.165 3.483 1.00 0.27 C ATOM 804 OG1 THR A 450 15.380 0.619 4.611 1.00 0.32 O ATOM 805 CG2 THR A 450 17.303 -0.372 3.543 1.00 0.34 C ATOM 0 H THR A 450 13.437 0.363 2.950 1.00 0.22 H new ATOM 0 HA THR A 450 15.924 1.471 2.104 1.00 0.23 H new ATOM 0 HB THR A 450 15.321 -1.146 3.505 1.00 0.27 H new ATOM 0 HG1 THR A 450 14.463 0.377 4.857 1.00 0.32 H new ATOM 0 HG21 THR A 450 17.565 -0.870 4.477 1.00 0.34 H new ATOM 0 HG22 THR A 450 17.619 -0.989 2.702 1.00 0.34 H new ATOM 0 HG23 THR A 450 17.805 0.594 3.494 1.00 0.34 H new ATOM 813 N ARG A 451 16.820 -0.056 0.410 1.00 0.29 N ATOM 814 CA ARG A 451 17.143 -0.538 -0.902 1.00 0.26 C ATOM 815 C ARG A 451 18.108 -1.690 -0.846 1.00 0.26 C ATOM 816 O ARG A 451 19.130 -1.658 -0.160 1.00 0.30 O ATOM 817 CB ARG A 451 17.649 0.608 -1.759 1.00 0.31 C ATOM 818 CG ARG A 451 18.844 1.309 -1.166 1.00 0.32 C ATOM 819 CD ARG A 451 19.191 2.570 -1.923 1.00 0.43 C ATOM 820 NE ARG A 451 20.379 3.227 -1.381 1.00 1.32 N ATOM 821 CZ ARG A 451 20.782 4.449 -1.727 1.00 1.75 C ATOM 822 NH1 ARG A 451 20.115 5.138 -2.645 1.00 1.39 N ATOM 823 NH2 ARG A 451 21.857 4.981 -1.160 1.00 2.70 N ATOM 0 H ARG A 451 17.559 0.492 0.851 1.00 0.29 H new ATOM 0 HA ARG A 451 16.239 -0.930 -1.369 1.00 0.26 H new ATOM 0 HB2 ARG A 451 17.912 0.227 -2.746 1.00 0.31 H new ATOM 0 HB3 ARG A 451 16.845 1.330 -1.900 1.00 0.31 H new ATOM 0 HG2 ARG A 451 18.640 1.556 -0.124 1.00 0.32 H new ATOM 0 HG3 ARG A 451 19.700 0.635 -1.172 1.00 0.32 H new ATOM 0 HD2 ARG A 451 19.358 2.328 -2.973 1.00 0.43 H new ATOM 0 HD3 ARG A 451 18.347 3.259 -1.885 1.00 0.43 H new ATOM 0 HE ARG A 451 20.935 2.718 -0.694 1.00 1.32 H new ATOM 0 HH11 ARG A 451 19.291 4.732 -3.088 1.00 1.39 H new ATOM 0 HH12 ARG A 451 20.427 6.073 -2.907 1.00 1.39 H new ATOM 0 HH21 ARG A 451 22.377 4.454 -0.458 1.00 2.70 H new ATOM 0 HH22 ARG A 451 22.164 5.917 -1.426 1.00 2.70 H new ATOM 837 N GLY A 452 17.744 -2.707 -1.588 1.00 0.28 N ATOM 838 CA GLY A 452 18.407 -3.967 -1.515 1.00 0.34 C ATOM 839 C GLY A 452 17.749 -4.852 -0.478 1.00 0.32 C ATOM 840 O GLY A 452 18.356 -5.783 0.050 1.00 0.41 O ATOM 0 H GLY A 452 16.976 -2.675 -2.259 1.00 0.28 H new ATOM 0 HA2 GLY A 452 18.380 -4.456 -2.489 1.00 0.34 H new ATOM 0 HA3 GLY A 452 19.457 -3.818 -1.262 1.00 0.34 H new ATOM 844 N ALA A 453 16.494 -4.532 -0.187 1.00 0.32 N ATOM 845 CA ALA A 453 15.695 -5.240 0.800 1.00 0.31 C ATOM 846 C ALA A 453 14.315 -5.485 0.260 1.00 0.27 C ATOM 847 O ALA A 453 13.810 -4.754 -0.597 1.00 0.35 O ATOM 848 CB ALA A 453 15.636 -4.448 2.099 1.00 0.32 C ATOM 0 H ALA A 453 15.998 -3.763 -0.637 1.00 0.32 H new ATOM 0 HA ALA A 453 16.160 -6.203 1.011 1.00 0.31 H new ATOM 0 HB1 ALA A 453 15.035 -4.990 2.829 1.00 0.32 H new ATOM 0 HB2 ALA A 453 16.645 -4.313 2.489 1.00 0.32 H new ATOM 0 HB3 ALA A 453 15.186 -3.473 1.911 1.00 0.32 H new ATOM 854 N THR A 454 13.732 -6.535 0.761 1.00 0.23 N ATOM 855 CA THR A 454 12.474 -7.023 0.287 1.00 0.21 C ATOM 856 C THR A 454 11.323 -6.525 1.150 1.00 0.17 C ATOM 857 O THR A 454 11.399 -6.545 2.378 1.00 0.19 O ATOM 858 CB THR A 454 12.518 -8.545 0.300 1.00 0.22 C ATOM 859 OG1 THR A 454 13.505 -9.022 -0.613 1.00 0.29 O ATOM 860 CG2 THR A 454 11.172 -9.142 -0.080 1.00 0.24 C ATOM 0 H THR A 454 14.127 -7.085 1.524 1.00 0.23 H new ATOM 0 HA THR A 454 12.304 -6.654 -0.724 1.00 0.21 H new ATOM 0 HB THR A 454 12.769 -8.853 1.315 1.00 0.22 H new ATOM 0 HG1 THR A 454 13.216 -8.840 -1.532 1.00 0.29 H new ATOM 0 HG21 THR A 454 11.238 -10.230 -0.061 1.00 0.24 H new ATOM 0 HG22 THR A 454 10.414 -8.812 0.630 1.00 0.24 H new ATOM 0 HG23 THR A 454 10.898 -8.813 -1.082 1.00 0.24 H new ATOM 868 N TYR A 455 10.264 -6.073 0.500 1.00 0.16 N ATOM 869 CA TYR A 455 9.082 -5.594 1.188 1.00 0.16 C ATOM 870 C TYR A 455 7.828 -6.232 0.604 1.00 0.13 C ATOM 871 O TYR A 455 7.603 -6.186 -0.606 1.00 0.15 O ATOM 872 CB TYR A 455 8.980 -4.069 1.076 1.00 0.23 C ATOM 873 CG TYR A 455 10.050 -3.321 1.840 1.00 0.22 C ATOM 874 CD1 TYR A 455 9.935 -3.129 3.211 1.00 0.20 C ATOM 875 CD2 TYR A 455 11.169 -2.799 1.195 1.00 0.28 C ATOM 876 CE1 TYR A 455 10.899 -2.441 3.918 1.00 0.22 C ATOM 877 CE2 TYR A 455 12.138 -2.111 1.901 1.00 0.30 C ATOM 878 CZ TYR A 455 11.998 -1.937 3.261 1.00 0.26 C ATOM 879 OH TYR A 455 12.956 -1.245 3.966 1.00 0.29 O ATOM 0 H TYR A 455 10.201 -6.029 -0.517 1.00 0.16 H new ATOM 0 HA TYR A 455 9.166 -5.871 2.239 1.00 0.16 H new ATOM 0 HB2 TYR A 455 9.036 -3.788 0.024 1.00 0.23 H new ATOM 0 HB3 TYR A 455 8.002 -3.753 1.439 1.00 0.23 H new ATOM 0 HD1 TYR A 455 9.076 -3.525 3.732 1.00 0.20 H new ATOM 0 HD2 TYR A 455 11.281 -2.934 0.129 1.00 0.28 H new ATOM 0 HE1 TYR A 455 10.792 -2.298 4.983 1.00 0.22 H new ATOM 0 HE2 TYR A 455 13.001 -1.712 1.389 1.00 0.30 H new ATOM 0 HH TYR A 455 13.446 -1.864 4.547 1.00 0.29 H new ATOM 889 N ASN A 456 7.028 -6.852 1.461 1.00 0.12 N ATOM 890 CA ASN A 456 5.718 -7.329 1.055 1.00 0.12 C ATOM 891 C ASN A 456 4.744 -6.182 1.165 1.00 0.13 C ATOM 892 O ASN A 456 4.335 -5.786 2.259 1.00 0.15 O ATOM 893 CB ASN A 456 5.248 -8.518 1.905 1.00 0.14 C ATOM 894 CG ASN A 456 4.033 -9.221 1.281 1.00 0.17 C ATOM 895 OD1 ASN A 456 3.778 -9.072 0.086 1.00 0.17 O ATOM 896 ND2 ASN A 456 3.291 -10.021 2.054 1.00 0.20 N ATOM 0 H ASN A 456 7.264 -7.035 2.436 1.00 0.12 H new ATOM 0 HA ASN A 456 5.774 -7.686 0.027 1.00 0.12 H new ATOM 0 HB2 ASN A 456 6.064 -9.232 2.014 1.00 0.14 H new ATOM 0 HB3 ASN A 456 4.992 -8.171 2.906 1.00 0.14 H new ATOM 0 HD21 ASN A 456 2.497 -10.522 1.656 1.00 0.20 H new ATOM 0 HD22 ASN A 456 3.519 -10.131 3.042 1.00 0.20 H new ATOM 903 N ILE A 457 4.417 -5.634 0.018 1.00 0.13 N ATOM 904 CA ILE A 457 3.625 -4.437 -0.072 1.00 0.14 C ATOM 905 C ILE A 457 2.146 -4.779 -0.115 1.00 0.14 C ATOM 906 O ILE A 457 1.661 -5.394 -1.064 1.00 0.18 O ATOM 907 CB ILE A 457 4.022 -3.626 -1.319 1.00 0.16 C ATOM 908 CG1 ILE A 457 5.463 -3.114 -1.178 1.00 0.19 C ATOM 909 CG2 ILE A 457 3.054 -2.464 -1.541 1.00 0.18 C ATOM 910 CD1 ILE A 457 5.890 -2.164 -2.279 1.00 0.22 C ATOM 0 H ILE A 457 4.698 -6.013 -0.886 1.00 0.13 H new ATOM 0 HA ILE A 457 3.814 -3.831 0.814 1.00 0.14 H new ATOM 0 HB ILE A 457 3.968 -4.279 -2.190 1.00 0.16 H new ATOM 0 HG12 ILE A 457 5.566 -2.610 -0.217 1.00 0.19 H new ATOM 0 HG13 ILE A 457 6.141 -3.967 -1.165 1.00 0.19 H new ATOM 0 HG21 ILE A 457 3.354 -1.905 -2.427 1.00 0.18 H new ATOM 0 HG22 ILE A 457 2.045 -2.852 -1.681 1.00 0.18 H new ATOM 0 HG23 ILE A 457 3.072 -1.805 -0.673 1.00 0.18 H new ATOM 0 HD11 ILE A 457 6.919 -1.848 -2.108 1.00 0.22 H new ATOM 0 HD12 ILE A 457 5.821 -2.669 -3.242 1.00 0.22 H new ATOM 0 HD13 ILE A 457 5.237 -1.291 -2.280 1.00 0.22 H new ATOM 922 N ILE A 458 1.445 -4.385 0.926 1.00 0.16 N ATOM 923 CA ILE A 458 0.027 -4.662 1.047 1.00 0.18 C ATOM 924 C ILE A 458 -0.742 -3.359 1.142 1.00 0.20 C ATOM 925 O ILE A 458 -0.328 -2.450 1.842 1.00 0.29 O ATOM 926 CB ILE A 458 -0.265 -5.516 2.291 1.00 0.22 C ATOM 927 CG1 ILE A 458 0.397 -6.879 2.157 1.00 0.21 C ATOM 928 CG2 ILE A 458 -1.757 -5.676 2.505 1.00 0.29 C ATOM 929 CD1 ILE A 458 0.186 -7.753 3.359 1.00 0.27 C ATOM 0 H ILE A 458 1.839 -3.865 1.711 1.00 0.16 H new ATOM 0 HA ILE A 458 -0.288 -5.217 0.163 1.00 0.18 H new ATOM 0 HB ILE A 458 0.148 -5.004 3.160 1.00 0.22 H new ATOM 0 HG12 ILE A 458 0.003 -7.383 1.274 1.00 0.21 H new ATOM 0 HG13 ILE A 458 1.467 -6.743 1.996 1.00 0.21 H new ATOM 0 HG21 ILE A 458 -1.934 -6.285 3.392 1.00 0.29 H new ATOM 0 HG22 ILE A 458 -2.212 -4.695 2.641 1.00 0.29 H new ATOM 0 HG23 ILE A 458 -2.199 -6.164 1.636 1.00 0.29 H new ATOM 0 HD11 ILE A 458 0.682 -8.711 3.204 1.00 0.27 H new ATOM 0 HD12 ILE A 458 0.604 -7.267 4.240 1.00 0.27 H new ATOM 0 HD13 ILE A 458 -0.881 -7.916 3.507 1.00 0.27 H new ATOM 941 N VAL A 459 -1.846 -3.258 0.433 1.00 0.17 N ATOM 942 CA VAL A 459 -2.634 -2.044 0.453 1.00 0.18 C ATOM 943 C VAL A 459 -4.019 -2.340 0.975 1.00 0.18 C ATOM 944 O VAL A 459 -4.745 -3.155 0.403 1.00 0.23 O ATOM 945 CB VAL A 459 -2.738 -1.407 -0.946 1.00 0.19 C ATOM 946 CG1 VAL A 459 -3.326 -0.011 -0.857 1.00 0.20 C ATOM 947 CG2 VAL A 459 -1.381 -1.383 -1.641 1.00 0.20 C ATOM 0 H VAL A 459 -2.217 -3.999 -0.162 1.00 0.17 H new ATOM 0 HA VAL A 459 -2.131 -1.335 1.110 1.00 0.18 H new ATOM 0 HB VAL A 459 -3.408 -2.021 -1.547 1.00 0.19 H new ATOM 0 HG11 VAL A 459 -3.391 0.421 -1.856 1.00 0.20 H new ATOM 0 HG12 VAL A 459 -4.323 -0.063 -0.419 1.00 0.20 H new ATOM 0 HG13 VAL A 459 -2.687 0.614 -0.232 1.00 0.20 H new ATOM 0 HG21 VAL A 459 -1.485 -0.928 -2.626 1.00 0.20 H new ATOM 0 HG22 VAL A 459 -0.677 -0.802 -1.045 1.00 0.20 H new ATOM 0 HG23 VAL A 459 -1.010 -2.402 -1.749 1.00 0.20 H new ATOM 957 N GLU A 460 -4.368 -1.702 2.074 1.00 0.18 N ATOM 958 CA GLU A 460 -5.657 -1.912 2.685 1.00 0.22 C ATOM 959 C GLU A 460 -6.444 -0.615 2.728 1.00 0.21 C ATOM 960 O GLU A 460 -5.945 0.430 3.145 1.00 0.30 O ATOM 961 CB GLU A 460 -5.491 -2.491 4.080 1.00 0.30 C ATOM 962 CG GLU A 460 -4.605 -3.719 4.108 1.00 0.36 C ATOM 963 CD GLU A 460 -4.573 -4.388 5.464 1.00 0.60 C ATOM 964 OE1 GLU A 460 -3.726 -4.013 6.298 1.00 0.79 O ATOM 965 OE2 GLU A 460 -5.389 -5.302 5.699 1.00 0.82 O ATOM 0 H GLU A 460 -3.772 -1.032 2.561 1.00 0.18 H new ATOM 0 HA GLU A 460 -6.217 -2.627 2.082 1.00 0.22 H new ATOM 0 HB2 GLU A 460 -5.069 -1.730 4.736 1.00 0.30 H new ATOM 0 HB3 GLU A 460 -6.472 -2.748 4.480 1.00 0.30 H new ATOM 0 HG2 GLU A 460 -4.958 -4.433 3.364 1.00 0.36 H new ATOM 0 HG3 GLU A 460 -3.591 -3.437 3.823 1.00 0.36 H new ATOM 972 N ALA A 461 -7.679 -0.705 2.293 1.00 0.16 N ATOM 973 CA ALA A 461 -8.547 0.449 2.167 1.00 0.15 C ATOM 974 C ALA A 461 -9.264 0.748 3.462 1.00 0.14 C ATOM 975 O ALA A 461 -10.094 -0.036 3.921 1.00 0.17 O ATOM 976 CB ALA A 461 -9.547 0.222 1.048 1.00 0.16 C ATOM 0 H ALA A 461 -8.115 -1.584 2.014 1.00 0.16 H new ATOM 0 HA ALA A 461 -7.928 1.314 1.927 1.00 0.15 H new ATOM 0 HB1 ALA A 461 -10.197 1.093 0.958 1.00 0.16 H new ATOM 0 HB2 ALA A 461 -9.014 0.068 0.110 1.00 0.16 H new ATOM 0 HB3 ALA A 461 -10.149 -0.658 1.271 1.00 0.16 H new ATOM 982 N LEU A 462 -8.942 1.894 4.031 1.00 0.16 N ATOM 983 CA LEU A 462 -9.564 2.345 5.249 1.00 0.20 C ATOM 984 C LEU A 462 -10.928 2.944 4.915 1.00 0.22 C ATOM 985 O LEU A 462 -11.022 4.056 4.394 1.00 0.24 O ATOM 986 CB LEU A 462 -8.684 3.380 5.964 1.00 0.25 C ATOM 987 CG LEU A 462 -8.779 3.332 7.494 1.00 0.34 C ATOM 988 CD1 LEU A 462 -7.743 4.210 8.156 1.00 0.85 C ATOM 989 CD2 LEU A 462 -10.153 3.745 7.954 1.00 0.78 C ATOM 0 H LEU A 462 -8.241 2.534 3.658 1.00 0.16 H new ATOM 0 HA LEU A 462 -9.690 1.497 5.923 1.00 0.20 H new ATOM 0 HB2 LEU A 462 -7.646 3.224 5.670 1.00 0.25 H new ATOM 0 HB3 LEU A 462 -8.965 4.377 5.624 1.00 0.25 H new ATOM 0 HG LEU A 462 -8.588 2.300 7.790 1.00 0.34 H new ATOM 0 HD11 LEU A 462 -7.849 4.144 9.239 1.00 0.85 H new ATOM 0 HD12 LEU A 462 -6.746 3.877 7.868 1.00 0.85 H new ATOM 0 HD13 LEU A 462 -7.886 5.243 7.840 1.00 0.85 H new ATOM 0 HD21 LEU A 462 -10.200 3.704 9.042 1.00 0.78 H new ATOM 0 HD22 LEU A 462 -10.358 4.762 7.620 1.00 0.78 H new ATOM 0 HD23 LEU A 462 -10.896 3.068 7.533 1.00 0.78 H new ATOM 1001 N LYS A 463 -11.971 2.194 5.206 1.00 0.23 N ATOM 1002 CA LYS A 463 -13.329 2.579 4.887 1.00 0.30 C ATOM 1003 C LYS A 463 -14.148 2.298 6.131 1.00 0.40 C ATOM 1004 O LYS A 463 -14.295 1.136 6.500 1.00 0.50 O ATOM 1005 CB LYS A 463 -13.835 1.729 3.708 1.00 0.31 C ATOM 1006 CG LYS A 463 -15.119 2.203 3.006 1.00 0.38 C ATOM 1007 CD LYS A 463 -14.964 3.504 2.230 1.00 0.42 C ATOM 1008 CE LYS A 463 -16.305 3.962 1.683 1.00 0.95 C ATOM 1009 NZ LYS A 463 -16.867 2.990 0.712 1.00 1.62 N ATOM 0 H LYS A 463 -11.898 1.291 5.675 1.00 0.23 H new ATOM 0 HA LYS A 463 -13.401 3.628 4.599 1.00 0.30 H new ATOM 0 HB2 LYS A 463 -13.041 1.677 2.963 1.00 0.31 H new ATOM 0 HB3 LYS A 463 -14.001 0.714 4.069 1.00 0.31 H new ATOM 0 HG2 LYS A 463 -15.455 1.423 2.322 1.00 0.38 H new ATOM 0 HG3 LYS A 463 -15.902 2.330 3.753 1.00 0.38 H new ATOM 0 HD2 LYS A 463 -14.548 4.274 2.880 1.00 0.42 H new ATOM 0 HD3 LYS A 463 -14.259 3.363 1.410 1.00 0.42 H new ATOM 0 HE2 LYS A 463 -17.006 4.099 2.507 1.00 0.95 H new ATOM 0 HE3 LYS A 463 -16.188 4.932 1.200 1.00 0.95 H new ATOM 0 HZ1 LYS A 463 -17.701 3.405 0.249 1.00 1.62 H new ATOM 0 HZ2 LYS A 463 -16.150 2.762 -0.006 1.00 1.62 H new ATOM 0 HZ3 LYS A 463 -17.145 2.121 1.212 1.00 1.62 H new ATOM 1023 N ASP A 464 -14.598 3.349 6.814 1.00 0.58 N ATOM 1024 CA ASP A 464 -15.415 3.185 8.040 1.00 0.61 C ATOM 1025 C ASP A 464 -14.762 2.287 9.101 1.00 0.51 C ATOM 1026 O ASP A 464 -15.143 1.134 9.297 1.00 0.53 O ATOM 1027 CB ASP A 464 -16.844 2.738 7.771 1.00 0.72 C ATOM 1028 CG ASP A 464 -17.043 1.402 7.067 1.00 1.08 C ATOM 1029 OD1 ASP A 464 -17.245 0.378 7.757 1.00 1.85 O ATOM 1030 OD2 ASP A 464 -17.072 1.382 5.815 1.00 1.15 O ATOM 0 H ASP A 464 -14.419 4.318 6.552 1.00 0.58 H new ATOM 0 HA ASP A 464 -15.464 4.193 8.451 1.00 0.61 H new ATOM 0 HB2 ASP A 464 -17.369 2.696 8.726 1.00 0.72 H new ATOM 0 HB3 ASP A 464 -17.330 3.509 7.173 1.00 0.72 H new ATOM 1035 N GLN A 465 -13.798 2.860 9.802 1.00 0.52 N ATOM 1036 CA GLN A 465 -12.926 2.165 10.757 1.00 0.49 C ATOM 1037 C GLN A 465 -12.136 0.974 10.184 1.00 0.44 C ATOM 1038 O GLN A 465 -11.109 0.595 10.754 1.00 0.66 O ATOM 1039 CB GLN A 465 -13.747 1.677 11.945 1.00 0.56 C ATOM 1040 CG GLN A 465 -14.665 2.742 12.521 1.00 0.67 C ATOM 1041 CD GLN A 465 -15.514 2.220 13.661 1.00 0.78 C ATOM 1042 OE1 GLN A 465 -15.106 1.318 14.391 1.00 1.32 O ATOM 1043 NE2 GLN A 465 -16.703 2.774 13.816 1.00 1.39 N ATOM 0 H GLN A 465 -13.587 3.855 9.725 1.00 0.52 H new ATOM 0 HA GLN A 465 -12.184 2.908 11.048 1.00 0.49 H new ATOM 0 HB2 GLN A 465 -14.346 0.820 11.636 1.00 0.56 H new ATOM 0 HB3 GLN A 465 -13.071 1.329 12.726 1.00 0.56 H new ATOM 0 HG2 GLN A 465 -14.066 3.582 12.873 1.00 0.67 H new ATOM 0 HG3 GLN A 465 -15.315 3.122 11.733 1.00 0.67 H new ATOM 0 HE21 GLN A 465 -17.004 3.520 13.189 1.00 1.39 H new ATOM 0 HE22 GLN A 465 -17.320 2.456 14.563 1.00 1.39 H new ATOM 1052 N GLN A 466 -12.574 0.385 9.081 1.00 0.36 N ATOM 1053 CA GLN A 466 -12.021 -0.898 8.660 1.00 0.36 C ATOM 1054 C GLN A 466 -11.122 -0.787 7.438 1.00 0.28 C ATOM 1055 O GLN A 466 -11.206 0.166 6.676 1.00 0.29 O ATOM 1056 CB GLN A 466 -13.147 -1.884 8.425 1.00 0.54 C ATOM 1057 CG GLN A 466 -13.593 -1.956 7.009 1.00 1.20 C ATOM 1058 CD GLN A 466 -14.764 -2.904 6.810 1.00 1.42 C ATOM 1059 OE1 GLN A 466 -15.600 -2.701 5.934 1.00 1.60 O ATOM 1060 NE2 GLN A 466 -14.830 -3.949 7.620 1.00 2.13 N ATOM 0 H GLN A 466 -13.297 0.764 8.470 1.00 0.36 H new ATOM 0 HA GLN A 466 -11.382 -1.260 9.466 1.00 0.36 H new ATOM 0 HB2 GLN A 466 -12.824 -2.874 8.745 1.00 0.54 H new ATOM 0 HB3 GLN A 466 -13.996 -1.608 9.050 1.00 0.54 H new ATOM 0 HG2 GLN A 466 -13.876 -0.959 6.671 1.00 1.20 H new ATOM 0 HG3 GLN A 466 -12.759 -2.279 6.386 1.00 1.20 H new ATOM 0 HE21 GLN A 466 -14.117 -4.085 8.336 1.00 2.13 H new ATOM 0 HE22 GLN A 466 -15.594 -4.618 7.528 1.00 2.13 H new ATOM 1069 N ARG A 467 -10.250 -1.777 7.270 1.00 0.33 N ATOM 1070 CA ARG A 467 -9.301 -1.790 6.167 1.00 0.30 C ATOM 1071 C ARG A 467 -9.504 -3.031 5.299 1.00 0.33 C ATOM 1072 O ARG A 467 -9.478 -4.158 5.792 1.00 0.51 O ATOM 1073 CB ARG A 467 -7.875 -1.758 6.706 1.00 0.36 C ATOM 1074 CG ARG A 467 -7.616 -0.611 7.666 1.00 0.34 C ATOM 1075 CD ARG A 467 -6.387 -0.886 8.517 1.00 0.43 C ATOM 1076 NE ARG A 467 -6.120 0.181 9.477 1.00 1.24 N ATOM 1077 CZ ARG A 467 -5.086 0.175 10.319 1.00 1.67 C ATOM 1078 NH1 ARG A 467 -4.222 -0.834 10.310 1.00 1.51 N ATOM 1079 NH2 ARG A 467 -4.915 1.177 11.172 1.00 2.58 N ATOM 0 H ARG A 467 -10.183 -2.585 7.889 1.00 0.33 H new ATOM 0 HA ARG A 467 -9.471 -0.906 5.553 1.00 0.30 H new ATOM 0 HB2 ARG A 467 -7.665 -2.700 7.213 1.00 0.36 H new ATOM 0 HB3 ARG A 467 -7.180 -1.685 5.869 1.00 0.36 H new ATOM 0 HG2 ARG A 467 -7.476 0.314 7.106 1.00 0.34 H new ATOM 0 HG3 ARG A 467 -8.484 -0.466 8.309 1.00 0.34 H new ATOM 0 HD2 ARG A 467 -6.523 -1.826 9.052 1.00 0.43 H new ATOM 0 HD3 ARG A 467 -5.520 -1.011 7.868 1.00 0.43 H new ATOM 0 HE ARG A 467 -6.760 0.975 9.505 1.00 1.24 H new ATOM 0 HH11 ARG A 467 -4.348 -1.608 9.657 1.00 1.51 H new ATOM 0 HH12 ARG A 467 -3.432 -0.835 10.956 1.00 1.51 H new ATOM 0 HH21 ARG A 467 -5.575 1.954 11.185 1.00 2.58 H new ATOM 0 HH22 ARG A 467 -4.123 1.170 11.815 1.00 2.58 H new ATOM 1093 N HIS A 468 -9.717 -2.812 4.009 1.00 0.28 N ATOM 1094 CA HIS A 468 -9.946 -3.915 3.066 1.00 0.32 C ATOM 1095 C HIS A 468 -8.679 -4.195 2.239 1.00 0.24 C ATOM 1096 O HIS A 468 -8.136 -3.268 1.645 1.00 0.27 O ATOM 1097 CB HIS A 468 -11.072 -3.579 2.075 1.00 0.44 C ATOM 1098 CG HIS A 468 -12.397 -3.240 2.685 1.00 0.75 C ATOM 1099 ND1 HIS A 468 -13.458 -4.117 2.705 1.00 1.02 N ATOM 1100 CD2 HIS A 468 -12.855 -2.086 3.229 1.00 1.01 C ATOM 1101 CE1 HIS A 468 -14.511 -3.520 3.228 1.00 1.26 C ATOM 1102 NE2 HIS A 468 -14.171 -2.289 3.554 1.00 1.25 N ATOM 0 H HIS A 468 -9.737 -1.885 3.585 1.00 0.28 H new ATOM 0 HA HIS A 468 -10.219 -4.785 3.663 1.00 0.32 H new ATOM 0 HB2 HIS A 468 -10.750 -2.738 1.460 1.00 0.44 H new ATOM 0 HB3 HIS A 468 -11.208 -4.429 1.407 1.00 0.44 H new ATOM 0 HD2 HIS A 468 -12.290 -1.178 3.378 1.00 1.01 H new ATOM 0 HE1 HIS A 468 -15.486 -3.964 3.366 1.00 1.26 H new ATOM 0 HE2 HIS A 468 -14.788 -1.598 3.980 1.00 1.25 H new ATOM 1111 N LYS A 469 -8.201 -5.450 2.208 1.00 0.27 N ATOM 1112 CA LYS A 469 -7.131 -5.838 1.235 1.00 0.40 C ATOM 1113 C LYS A 469 -7.527 -5.398 -0.173 1.00 0.29 C ATOM 1114 O LYS A 469 -8.571 -5.803 -0.686 1.00 0.37 O ATOM 1115 CB LYS A 469 -6.848 -7.357 1.166 1.00 0.80 C ATOM 1116 CG LYS A 469 -5.864 -7.737 0.065 1.00 0.70 C ATOM 1117 CD LYS A 469 -4.414 -7.422 0.414 1.00 0.70 C ATOM 1118 CE LYS A 469 -3.865 -8.362 1.481 1.00 0.41 C ATOM 1119 NZ LYS A 469 -4.103 -9.793 1.151 1.00 0.84 N ATOM 0 H LYS A 469 -8.517 -6.203 2.819 1.00 0.27 H new ATOM 0 HA LYS A 469 -6.230 -5.342 1.596 1.00 0.40 H new ATOM 0 HB2 LYS A 469 -6.455 -7.690 2.126 1.00 0.80 H new ATOM 0 HB3 LYS A 469 -7.786 -7.888 1.004 1.00 0.80 H new ATOM 0 HG2 LYS A 469 -5.957 -8.803 -0.143 1.00 0.70 H new ATOM 0 HG3 LYS A 469 -6.133 -7.209 -0.850 1.00 0.70 H new ATOM 0 HD2 LYS A 469 -3.801 -7.496 -0.484 1.00 0.70 H new ATOM 0 HD3 LYS A 469 -4.341 -6.393 0.766 1.00 0.70 H new ATOM 0 HE2 LYS A 469 -2.795 -8.191 1.596 1.00 0.41 H new ATOM 0 HE3 LYS A 469 -4.330 -8.131 2.439 1.00 0.41 H new ATOM 0 HZ1 LYS A 469 -4.861 -10.168 1.757 1.00 0.84 H new ATOM 0 HZ2 LYS A 469 -4.384 -9.877 0.153 1.00 0.84 H new ATOM 0 HZ3 LYS A 469 -3.231 -10.336 1.312 1.00 0.84 H new ATOM 1133 N VAL A 470 -6.703 -4.566 -0.780 1.00 0.23 N ATOM 1134 CA VAL A 470 -6.908 -4.153 -2.159 1.00 0.18 C ATOM 1135 C VAL A 470 -5.873 -4.803 -3.055 1.00 0.18 C ATOM 1136 O VAL A 470 -6.196 -5.399 -4.084 1.00 0.29 O ATOM 1137 CB VAL A 470 -6.803 -2.630 -2.294 1.00 0.22 C ATOM 1138 CG1 VAL A 470 -7.072 -2.178 -3.722 1.00 0.61 C ATOM 1139 CG2 VAL A 470 -7.753 -1.967 -1.322 1.00 0.59 C ATOM 0 H VAL A 470 -5.879 -4.159 -0.338 1.00 0.23 H new ATOM 0 HA VAL A 470 -7.907 -4.467 -2.460 1.00 0.18 H new ATOM 0 HB VAL A 470 -5.784 -2.329 -2.052 1.00 0.22 H new ATOM 0 HG11 VAL A 470 -6.989 -1.093 -3.782 1.00 0.61 H new ATOM 0 HG12 VAL A 470 -6.343 -2.635 -4.392 1.00 0.61 H new ATOM 0 HG13 VAL A 470 -8.076 -2.482 -4.017 1.00 0.61 H new ATOM 0 HG21 VAL A 470 -7.677 -0.884 -1.420 1.00 0.59 H new ATOM 0 HG22 VAL A 470 -8.774 -2.280 -1.540 1.00 0.59 H new ATOM 0 HG23 VAL A 470 -7.494 -2.258 -0.304 1.00 0.59 H new ATOM 1149 N ARG A 471 -4.625 -4.704 -2.638 1.00 0.17 N ATOM 1150 CA ARG A 471 -3.524 -5.242 -3.403 1.00 0.19 C ATOM 1151 C ARG A 471 -2.425 -5.723 -2.466 1.00 0.18 C ATOM 1152 O ARG A 471 -2.269 -5.196 -1.367 1.00 0.22 O ATOM 1153 CB ARG A 471 -2.982 -4.194 -4.370 1.00 0.28 C ATOM 1154 CG ARG A 471 -1.990 -4.790 -5.350 1.00 0.77 C ATOM 1155 CD ARG A 471 -2.024 -4.122 -6.702 1.00 0.52 C ATOM 1156 NE ARG A 471 -0.969 -4.632 -7.574 1.00 1.18 N ATOM 1157 CZ ARG A 471 -0.533 -4.016 -8.671 1.00 1.45 C ATOM 1158 NH1 ARG A 471 -1.062 -2.863 -9.053 1.00 1.39 N ATOM 1159 NH2 ARG A 471 0.439 -4.560 -9.391 1.00 2.13 N ATOM 0 H ARG A 471 -4.350 -4.252 -1.766 1.00 0.17 H new ATOM 0 HA ARG A 471 -3.883 -6.090 -3.986 1.00 0.19 H new ATOM 0 HB2 ARG A 471 -3.809 -3.744 -4.919 1.00 0.28 H new ATOM 0 HB3 ARG A 471 -2.501 -3.394 -3.807 1.00 0.28 H new ATOM 0 HG2 ARG A 471 -0.985 -4.709 -4.936 1.00 0.77 H new ATOM 0 HG3 ARG A 471 -2.200 -5.853 -5.470 1.00 0.77 H new ATOM 0 HD2 ARG A 471 -2.995 -4.288 -7.168 1.00 0.52 H new ATOM 0 HD3 ARG A 471 -1.909 -3.045 -6.581 1.00 0.52 H new ATOM 0 HE ARG A 471 -0.536 -5.522 -7.325 1.00 1.18 H new ATOM 0 HH11 ARG A 471 -1.811 -2.439 -8.505 1.00 1.39 H new ATOM 0 HH12 ARG A 471 -0.721 -2.399 -9.895 1.00 1.39 H new ATOM 0 HH21 ARG A 471 0.851 -5.448 -9.104 1.00 2.13 H new ATOM 0 HH22 ARG A 471 0.775 -4.090 -10.232 1.00 2.13 H new ATOM 1173 N GLU A 472 -1.690 -6.735 -2.894 1.00 0.20 N ATOM 1174 CA GLU A 472 -0.573 -7.264 -2.124 1.00 0.18 C ATOM 1175 C GLU A 472 0.479 -7.836 -3.057 1.00 0.18 C ATOM 1176 O GLU A 472 0.148 -8.544 -4.012 1.00 0.21 O ATOM 1177 CB GLU A 472 -1.044 -8.335 -1.136 1.00 0.21 C ATOM 1178 CG GLU A 472 0.030 -9.360 -0.801 1.00 0.21 C ATOM 1179 CD GLU A 472 -0.327 -10.238 0.375 1.00 0.29 C ATOM 1180 OE1 GLU A 472 0.581 -10.601 1.151 1.00 0.62 O ATOM 1181 OE2 GLU A 472 -1.519 -10.583 0.521 1.00 0.65 O ATOM 0 H GLU A 472 -1.848 -7.213 -3.781 1.00 0.20 H new ATOM 0 HA GLU A 472 -0.135 -6.446 -1.552 1.00 0.18 H new ATOM 0 HB2 GLU A 472 -1.374 -7.851 -0.217 1.00 0.21 H new ATOM 0 HB3 GLU A 472 -1.909 -8.849 -1.554 1.00 0.21 H new ATOM 0 HG2 GLU A 472 0.207 -9.988 -1.674 1.00 0.21 H new ATOM 0 HG3 GLU A 472 0.964 -8.840 -0.587 1.00 0.21 H new ATOM 1188 N GLU A 473 1.740 -7.524 -2.795 1.00 0.16 N ATOM 1189 CA GLU A 473 2.818 -8.012 -3.634 1.00 0.17 C ATOM 1190 C GLU A 473 4.153 -7.929 -2.945 1.00 0.20 C ATOM 1191 O GLU A 473 4.464 -6.943 -2.284 1.00 0.26 O ATOM 1192 CB GLU A 473 2.855 -7.237 -4.953 1.00 0.23 C ATOM 1193 CG GLU A 473 3.837 -7.800 -5.961 1.00 0.27 C ATOM 1194 CD GLU A 473 3.434 -9.178 -6.443 1.00 1.24 C ATOM 1195 OE1 GLU A 473 3.677 -10.168 -5.718 1.00 2.26 O ATOM 1196 OE2 GLU A 473 2.856 -9.278 -7.544 1.00 1.25 O ATOM 0 H GLU A 473 2.038 -6.940 -2.014 1.00 0.16 H new ATOM 0 HA GLU A 473 2.621 -9.064 -3.838 1.00 0.17 H new ATOM 0 HB2 GLU A 473 1.857 -7.236 -5.392 1.00 0.23 H new ATOM 0 HB3 GLU A 473 3.114 -6.198 -4.747 1.00 0.23 H new ATOM 0 HG2 GLU A 473 3.907 -7.125 -6.814 1.00 0.27 H new ATOM 0 HG3 GLU A 473 4.829 -7.850 -5.511 1.00 0.27 H new ATOM 1203 N VAL A 474 4.951 -8.969 -3.115 1.00 0.24 N ATOM 1204 CA VAL A 474 6.263 -8.976 -2.529 1.00 0.28 C ATOM 1205 C VAL A 474 7.273 -8.436 -3.522 1.00 0.21 C ATOM 1206 O VAL A 474 7.458 -8.997 -4.605 1.00 0.28 O ATOM 1207 CB VAL A 474 6.730 -10.370 -2.080 1.00 0.49 C ATOM 1208 CG1 VAL A 474 7.927 -10.259 -1.149 1.00 0.80 C ATOM 1209 CG2 VAL A 474 5.608 -11.150 -1.422 1.00 1.22 C ATOM 0 H VAL A 474 4.710 -9.805 -3.648 1.00 0.24 H new ATOM 0 HA VAL A 474 6.197 -8.347 -1.641 1.00 0.28 H new ATOM 0 HB VAL A 474 7.033 -10.920 -2.971 1.00 0.49 H new ATOM 0 HG11 VAL A 474 8.243 -11.256 -0.842 1.00 0.80 H new ATOM 0 HG12 VAL A 474 8.747 -9.762 -1.668 1.00 0.80 H new ATOM 0 HG13 VAL A 474 7.651 -9.679 -0.269 1.00 0.80 H new ATOM 0 HG21 VAL A 474 5.976 -12.130 -1.118 1.00 1.22 H new ATOM 0 HG22 VAL A 474 5.253 -10.608 -0.546 1.00 1.22 H new ATOM 0 HG23 VAL A 474 4.788 -11.274 -2.129 1.00 1.22 H new ATOM 1219 N VAL A 475 7.921 -7.356 -3.154 1.00 0.19 N ATOM 1220 CA VAL A 475 8.880 -6.704 -4.025 1.00 0.19 C ATOM 1221 C VAL A 475 10.186 -6.470 -3.325 1.00 0.19 C ATOM 1222 O VAL A 475 10.246 -6.079 -2.164 1.00 0.26 O ATOM 1223 CB VAL A 475 8.384 -5.344 -4.548 1.00 0.22 C ATOM 1224 CG1 VAL A 475 8.549 -5.273 -6.052 1.00 0.41 C ATOM 1225 CG2 VAL A 475 6.939 -5.082 -4.153 1.00 0.32 C ATOM 0 H VAL A 475 7.802 -6.903 -2.248 1.00 0.19 H new ATOM 0 HA VAL A 475 9.010 -7.386 -4.865 1.00 0.19 H new ATOM 0 HB VAL A 475 8.992 -4.566 -4.087 1.00 0.22 H new ATOM 0 HG11 VAL A 475 8.195 -4.307 -6.412 1.00 0.41 H new ATOM 0 HG12 VAL A 475 9.602 -5.392 -6.309 1.00 0.41 H new ATOM 0 HG13 VAL A 475 7.969 -6.069 -6.520 1.00 0.41 H new ATOM 0 HG21 VAL A 475 6.626 -4.113 -4.541 1.00 0.32 H new ATOM 0 HG22 VAL A 475 6.301 -5.862 -4.568 1.00 0.32 H new ATOM 0 HG23 VAL A 475 6.853 -5.083 -3.066 1.00 0.32 H new ATOM 1235 N THR A 476 11.223 -6.727 -4.064 1.00 0.24 N ATOM 1236 CA THR A 476 12.557 -6.453 -3.642 1.00 0.24 C ATOM 1237 C THR A 476 13.023 -5.152 -4.259 1.00 0.26 C ATOM 1238 O THR A 476 13.022 -4.982 -5.478 1.00 0.33 O ATOM 1239 CB THR A 476 13.455 -7.599 -4.079 1.00 0.31 C ATOM 1240 OG1 THR A 476 13.188 -8.759 -3.281 1.00 0.32 O ATOM 1241 CG2 THR A 476 14.933 -7.224 -4.000 1.00 0.38 C ATOM 0 H THR A 476 11.161 -7.141 -4.994 1.00 0.24 H new ATOM 0 HA THR A 476 12.598 -6.358 -2.557 1.00 0.24 H new ATOM 0 HB THR A 476 13.233 -7.820 -5.123 1.00 0.31 H new ATOM 0 HG1 THR A 476 13.769 -9.494 -3.568 1.00 0.32 H new ATOM 0 HG21 THR A 476 15.541 -8.070 -4.321 1.00 0.38 H new ATOM 0 HG22 THR A 476 15.127 -6.371 -4.650 1.00 0.38 H new ATOM 0 HG23 THR A 476 15.188 -6.963 -2.973 1.00 0.38 H new ATOM 1249 N VAL A 477 13.391 -4.238 -3.400 1.00 0.25 N ATOM 1250 CA VAL A 477 13.838 -2.932 -3.814 1.00 0.29 C ATOM 1251 C VAL A 477 15.317 -2.990 -4.172 1.00 0.33 C ATOM 1252 O VAL A 477 16.110 -3.567 -3.442 1.00 0.37 O ATOM 1253 CB VAL A 477 13.583 -1.935 -2.673 1.00 0.28 C ATOM 1254 CG1 VAL A 477 14.186 -0.574 -2.970 1.00 0.35 C ATOM 1255 CG2 VAL A 477 12.091 -1.811 -2.422 1.00 0.31 C ATOM 0 H VAL A 477 13.389 -4.378 -2.390 1.00 0.25 H new ATOM 0 HA VAL A 477 13.288 -2.604 -4.696 1.00 0.29 H new ATOM 0 HB VAL A 477 14.070 -2.317 -1.776 1.00 0.28 H new ATOM 0 HG11 VAL A 477 13.984 0.102 -2.140 1.00 0.35 H new ATOM 0 HG12 VAL A 477 15.263 -0.674 -3.103 1.00 0.35 H new ATOM 0 HG13 VAL A 477 13.744 -0.171 -3.882 1.00 0.35 H new ATOM 0 HG21 VAL A 477 11.916 -1.103 -1.612 1.00 0.31 H new ATOM 0 HG22 VAL A 477 11.598 -1.456 -3.327 1.00 0.31 H new ATOM 0 HG23 VAL A 477 11.686 -2.785 -2.146 1.00 0.31 H new ATOM 1265 N GLY A 478 15.664 -2.425 -5.320 1.00 0.43 N ATOM 1266 CA GLY A 478 17.039 -2.486 -5.804 1.00 0.53 C ATOM 1267 C GLY A 478 17.955 -1.441 -5.163 1.00 1.15 C ATOM 1268 O GLY A 478 18.479 -1.682 -4.082 1.00 1.69 O ATOM 0 H GLY A 478 15.019 -1.923 -5.930 1.00 0.43 H new ATOM 0 HA2 GLY A 478 17.441 -3.480 -5.609 1.00 0.53 H new ATOM 0 HA3 GLY A 478 17.042 -2.347 -6.885 1.00 0.53 H new ATOM 1272 N ASN A 479 18.170 -0.283 -5.799 1.00 1.80 N ATOM 1273 CA ASN A 479 19.008 0.755 -5.197 1.00 2.82 C ATOM 1274 C ASN A 479 18.592 2.089 -5.760 1.00 3.58 C ATOM 1275 O ASN A 479 19.357 3.054 -5.759 1.00 4.40 O ATOM 1276 CB ASN A 479 20.521 0.540 -5.454 1.00 3.20 C ATOM 1277 CG ASN A 479 21.370 1.062 -4.306 1.00 3.99 C ATOM 1278 OD1 ASN A 479 21.614 0.352 -3.331 1.00 4.47 O ATOM 1279 ND2 ASN A 479 21.829 2.299 -4.414 1.00 4.61 N ATOM 0 H ASN A 479 17.783 -0.046 -6.712 1.00 1.80 H new ATOM 0 HA ASN A 479 18.863 0.712 -4.118 1.00 2.82 H new ATOM 0 HB2 ASN A 479 20.718 -0.522 -5.597 1.00 3.20 H new ATOM 0 HB3 ASN A 479 20.808 1.045 -6.377 1.00 3.20 H new ATOM 0 HD21 ASN A 479 22.407 2.695 -3.673 1.00 4.61 H new ATOM 0 HD22 ASN A 479 21.605 2.856 -5.238 1.00 4.61 H new ATOM 1286 N SER A 480 17.363 2.148 -6.235 1.00 3.56 N ATOM 1287 CA SER A 480 16.954 3.268 -7.040 1.00 4.40 C ATOM 1288 C SER A 480 15.435 3.281 -7.180 1.00 4.81 C ATOM 1289 O SER A 480 14.902 2.512 -8.005 1.00 4.88 O ATOM 1290 CB SER A 480 17.671 3.144 -8.388 1.00 4.37 C ATOM 1291 OG SER A 480 17.196 2.037 -9.137 1.00 4.36 O ATOM 1292 OXT SER A 480 14.778 4.038 -6.435 1.00 5.40 O ATOM 0 H SER A 480 16.644 1.442 -6.077 1.00 3.56 H new ATOM 0 HA SER A 480 17.226 4.218 -6.580 1.00 4.40 H new ATOM 0 HB2 SER A 480 17.527 4.060 -8.962 1.00 4.37 H new ATOM 0 HB3 SER A 480 18.743 3.037 -8.221 1.00 4.37 H new ATOM 0 HG SER A 480 16.246 1.894 -8.943 1.00 4.36 H new TER 1298 SER A 480