USER MOD reduce.3.24.130724 H: found=0, std=0, add=672, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 667 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 417 SER OG : rot -75:sc= 1.21 USER MOD Set 1.2: A 418 THR OG1 : rot 180:sc= 0 USER MOD Single : A 416 SER OG : rot 180:sc= -0.415 USER MOD Single : A 425 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 426 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 432 ASN : amide:sc= 0 X(o=0,f=-0.031) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 438 SER OG : rot 180:sc= 0 USER MOD Single : A 440 SER OG : rot 180:sc= 0 USER MOD Single : A 441 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 THR OG1 : rot -30:sc= 0.216 USER MOD Single : A 444 SER OG : rot 74:sc= 0.749 USER MOD Single : A 447 SER OG : rot 13:sc= 0.507 USER MOD Single : A 449 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 452 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 457 THR OG1 : rot 85:sc= 0.0538 USER MOD Single : A 460 LYS NZ :NH3+ 154:sc= -0.0438 (180deg=-0.323) USER MOD Single : A 461 TYR OH : rot 180:sc= -0.119 USER MOD Single : A 464 SER OG : rot 180:sc= 0 USER MOD Single : A 466 SER OG : rot 66:sc= 0.0892 USER MOD Single : A 470 SER OG : rot 180:sc= 0 USER MOD Single : A 471 ASN : amide:sc= -1.11 X(o=-1.1,f=-1) USER MOD Single : A 472 GLN : amide:sc= -0.786 K(o=-0.79,f=-3.9!) USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= -2.43! C(o=-2.4!,f=-3.5!) USER MOD Single : A 479 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 480 SER OG : rot 180:sc= 0 USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 492 HIS : no HD1:sc= -0.222 X(o=-0.22,f=-0.22) USER MOD Single : A 493 HIS : no HD1:sc= -0.0338 X(o=-0.034,f=0) USER MOD Single : A 494 HIS : no HD1:sc=-0.00572 X(o=-0.0057,f=-0.15) USER MOD Single : A 495 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 496 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 497 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 414 -17.208 1.095 -9.469 1.00 24.21 N ATOM 2 CA GLU A 414 -17.694 1.945 -8.388 1.00 72.14 C ATOM 3 C GLU A 414 -16.694 3.056 -8.078 1.00 63.04 C ATOM 4 O GLU A 414 -15.505 2.935 -8.374 1.00 73.14 O ATOM 5 CB GLU A 414 -17.954 1.113 -7.131 1.00 61.33 C ATOM 6 CG GLU A 414 -19.106 1.631 -6.286 1.00 43.05 C ATOM 7 CD GLU A 414 -19.897 0.515 -5.631 1.00 30.22 C ATOM 8 OE1 GLU A 414 -20.836 0.000 -6.272 1.00 72.54 O ATOM 9 OE2 GLU A 414 -19.577 0.158 -4.478 1.00 1.51 O ATOM 0 HA GLU A 414 -18.629 2.401 -8.712 1.00 72.14 H new ATOM 0 HB2 GLU A 414 -18.163 0.084 -7.423 1.00 61.33 H new ATOM 0 HB3 GLU A 414 -17.049 1.094 -6.524 1.00 61.33 H new ATOM 0 HG2 GLU A 414 -18.716 2.296 -5.515 1.00 43.05 H new ATOM 0 HG3 GLU A 414 -19.772 2.225 -6.912 1.00 43.05 H new ATOM 16 N ALA A 415 -17.185 4.136 -7.481 1.00 51.35 N ATOM 17 CA ALA A 415 -16.336 5.267 -7.129 1.00 64.05 C ATOM 18 C ALA A 415 -15.502 4.964 -5.889 1.00 73.41 C ATOM 19 O ALA A 415 -14.648 5.757 -5.494 1.00 13.12 O ATOM 20 CB ALA A 415 -17.181 6.514 -6.907 1.00 24.31 C ATOM 0 H ALA A 415 -18.167 4.252 -7.231 1.00 51.35 H new ATOM 0 HA ALA A 415 -15.653 5.447 -7.959 1.00 64.05 H new ATOM 0 HB1 ALA A 415 -16.533 7.351 -6.645 1.00 24.31 H new ATOM 0 HB2 ALA A 415 -17.727 6.751 -7.820 1.00 24.31 H new ATOM 0 HB3 ALA A 415 -17.888 6.335 -6.097 1.00 24.31 H new ATOM 26 N SER A 416 -15.756 3.809 -5.279 1.00 53.32 N ATOM 27 CA SER A 416 -15.032 3.403 -4.081 1.00 53.35 C ATOM 28 C SER A 416 -13.713 2.729 -4.446 1.00 73.10 C ATOM 29 O SER A 416 -12.786 2.676 -3.638 1.00 0.30 O ATOM 30 CB SER A 416 -15.888 2.454 -3.240 1.00 63.41 C ATOM 31 OG SER A 416 -17.226 2.424 -3.707 1.00 3.25 O ATOM 0 H SER A 416 -16.457 3.139 -5.595 1.00 53.32 H new ATOM 0 HA SER A 416 -14.813 4.297 -3.497 1.00 53.35 H new ATOM 0 HB2 SER A 416 -15.465 1.450 -3.275 1.00 63.41 H new ATOM 0 HB3 SER A 416 -15.871 2.771 -2.197 1.00 63.41 H new ATOM 0 HG SER A 416 -17.752 1.809 -3.154 1.00 3.25 H new ATOM 37 N SER A 417 -13.637 2.215 -5.669 1.00 21.33 N ATOM 38 CA SER A 417 -12.434 1.540 -6.141 1.00 63.12 C ATOM 39 C SER A 417 -11.277 2.525 -6.280 1.00 52.21 C ATOM 40 O SER A 417 -10.109 2.145 -6.201 1.00 42.50 O ATOM 41 CB SER A 417 -12.700 0.856 -7.484 1.00 13.02 C ATOM 42 OG SER A 417 -13.008 1.808 -8.488 1.00 4.52 O ATOM 0 H SER A 417 -14.394 2.253 -6.351 1.00 21.33 H new ATOM 0 HA SER A 417 -12.159 0.785 -5.405 1.00 63.12 H new ATOM 0 HB2 SER A 417 -11.825 0.279 -7.782 1.00 13.02 H new ATOM 0 HB3 SER A 417 -13.526 0.152 -7.380 1.00 13.02 H new ATOM 0 HG SER A 417 -13.919 2.143 -8.353 1.00 4.52 H new ATOM 48 N THR A 418 -11.612 3.795 -6.487 1.00 54.32 N ATOM 49 CA THR A 418 -10.603 4.837 -6.639 1.00 31.44 C ATOM 50 C THR A 418 -10.142 5.356 -5.282 1.00 11.22 C ATOM 51 O THR A 418 -9.069 5.946 -5.165 1.00 45.11 O ATOM 52 CB THR A 418 -11.135 6.016 -7.474 1.00 21.11 C ATOM 53 OG1 THR A 418 -11.851 5.526 -8.613 1.00 41.53 O ATOM 54 CG2 THR A 418 -9.994 6.912 -7.933 1.00 4.11 C ATOM 0 H THR A 418 -12.574 4.127 -6.553 1.00 54.32 H new ATOM 0 HA THR A 418 -9.758 4.386 -7.159 1.00 31.44 H new ATOM 0 HB THR A 418 -11.807 6.602 -6.848 1.00 21.11 H new ATOM 0 HG1 THR A 418 -12.188 6.282 -9.138 1.00 41.53 H new ATOM 0 HG21 THR A 418 -10.394 7.738 -8.521 1.00 4.11 H new ATOM 0 HG22 THR A 418 -9.469 7.307 -7.063 1.00 4.11 H new ATOM 0 HG23 THR A 418 -9.301 6.334 -8.544 1.00 4.11 H new ATOM 62 N ALA A 419 -10.961 5.133 -4.259 1.00 3.41 N ATOM 63 CA ALA A 419 -10.635 5.577 -2.909 1.00 53.14 C ATOM 64 C ALA A 419 -9.322 4.966 -2.432 1.00 41.32 C ATOM 65 O ALA A 419 -8.555 5.605 -1.711 1.00 42.44 O ATOM 66 CB ALA A 419 -11.762 5.225 -1.951 1.00 34.23 C ATOM 0 H ALA A 419 -11.855 4.648 -4.339 1.00 3.41 H new ATOM 0 HA ALA A 419 -10.515 6.660 -2.929 1.00 53.14 H new ATOM 0 HB1 ALA A 419 -11.505 5.562 -0.947 1.00 34.23 H new ATOM 0 HB2 ALA A 419 -12.681 5.715 -2.274 1.00 34.23 H new ATOM 0 HB3 ALA A 419 -11.910 4.145 -1.944 1.00 34.23 H new ATOM 72 N ILE A 420 -9.071 3.726 -2.837 1.00 43.04 N ATOM 73 CA ILE A 420 -7.850 3.029 -2.451 1.00 42.34 C ATOM 74 C ILE A 420 -6.655 3.526 -3.258 1.00 1.14 C ATOM 75 O ILE A 420 -5.506 3.372 -2.843 1.00 31.21 O ATOM 76 CB ILE A 420 -7.986 1.507 -2.641 1.00 74.30 C ATOM 77 CG1 ILE A 420 -9.163 0.973 -1.822 1.00 2.15 C ATOM 78 CG2 ILE A 420 -6.695 0.806 -2.244 1.00 54.21 C ATOM 79 CD1 ILE A 420 -10.479 0.995 -2.568 1.00 44.14 C ATOM 0 H ILE A 420 -9.697 3.183 -3.432 1.00 43.04 H new ATOM 0 HA ILE A 420 -7.686 3.241 -1.395 1.00 42.34 H new ATOM 0 HB ILE A 420 -8.178 1.302 -3.694 1.00 74.30 H new ATOM 0 HG12 ILE A 420 -8.946 -0.050 -1.514 1.00 2.15 H new ATOM 0 HG13 ILE A 420 -9.261 1.566 -0.912 1.00 2.15 H new ATOM 0 HG21 ILE A 420 -6.807 -0.269 -2.384 1.00 54.21 H new ATOM 0 HG22 ILE A 420 -5.877 1.170 -2.866 1.00 54.21 H new ATOM 0 HG23 ILE A 420 -6.475 1.015 -1.197 1.00 54.21 H new ATOM 0 HD11 ILE A 420 -11.268 0.602 -1.926 1.00 44.14 H new ATOM 0 HD12 ILE A 420 -10.719 2.020 -2.852 1.00 44.14 H new ATOM 0 HD13 ILE A 420 -10.400 0.379 -3.464 1.00 44.14 H new ATOM 91 N ARG A 421 -6.933 4.124 -4.412 1.00 14.05 N ATOM 92 CA ARG A 421 -5.882 4.644 -5.276 1.00 1.22 C ATOM 93 C ARG A 421 -4.934 5.549 -4.494 1.00 63.44 C ATOM 94 O ARG A 421 -3.741 5.619 -4.791 1.00 61.22 O ATOM 95 CB ARG A 421 -6.490 5.416 -6.448 1.00 73.21 C ATOM 96 CG ARG A 421 -5.477 5.814 -7.507 1.00 42.34 C ATOM 97 CD ARG A 421 -5.567 7.296 -7.835 1.00 44.42 C ATOM 98 NE ARG A 421 -4.673 7.671 -8.928 1.00 53.10 N ATOM 99 CZ ARG A 421 -4.681 8.866 -9.507 1.00 61.35 C ATOM 100 NH1 ARG A 421 -5.531 9.799 -9.100 1.00 34.42 N ATOM 101 NH2 ARG A 421 -3.838 9.131 -10.496 1.00 4.31 N ATOM 0 H ARG A 421 -7.878 4.260 -4.770 1.00 14.05 H new ATOM 0 HA ARG A 421 -5.314 3.798 -5.663 1.00 1.22 H new ATOM 0 HB2 ARG A 421 -7.265 4.806 -6.911 1.00 73.21 H new ATOM 0 HB3 ARG A 421 -6.976 6.314 -6.067 1.00 73.21 H new ATOM 0 HG2 ARG A 421 -4.472 5.578 -7.157 1.00 42.34 H new ATOM 0 HG3 ARG A 421 -5.646 5.229 -8.411 1.00 42.34 H new ATOM 0 HD2 ARG A 421 -6.593 7.546 -8.104 1.00 44.42 H new ATOM 0 HD3 ARG A 421 -5.319 7.879 -6.948 1.00 44.42 H new ATOM 0 HE ARG A 421 -4.006 6.977 -9.265 1.00 53.10 H new ATOM 0 HH11 ARG A 421 -6.181 9.600 -8.340 1.00 34.42 H new ATOM 0 HH12 ARG A 421 -5.534 10.716 -9.547 1.00 34.42 H new ATOM 0 HH21 ARG A 421 -3.183 8.416 -10.813 1.00 4.31 H new ATOM 0 HH22 ARG A 421 -3.845 10.049 -10.940 1.00 4.31 H new ATOM 115 N ALA A 422 -5.473 6.241 -3.497 1.00 44.00 N ATOM 116 CA ALA A 422 -4.675 7.140 -2.673 1.00 14.21 C ATOM 117 C ALA A 422 -4.080 6.406 -1.475 1.00 72.14 C ATOM 118 O ALA A 422 -3.051 6.812 -0.934 1.00 35.31 O ATOM 119 CB ALA A 422 -5.519 8.317 -2.205 1.00 74.43 C ATOM 0 H ALA A 422 -6.459 6.197 -3.240 1.00 44.00 H new ATOM 0 HA ALA A 422 -3.852 7.515 -3.282 1.00 14.21 H new ATOM 0 HB1 ALA A 422 -4.910 8.980 -1.591 1.00 74.43 H new ATOM 0 HB2 ALA A 422 -5.891 8.865 -3.071 1.00 74.43 H new ATOM 0 HB3 ALA A 422 -6.361 7.950 -1.618 1.00 74.43 H new ATOM 125 N LEU A 423 -4.734 5.323 -1.067 1.00 51.42 N ATOM 126 CA LEU A 423 -4.270 4.532 0.066 1.00 25.13 C ATOM 127 C LEU A 423 -2.850 4.024 -0.168 1.00 52.45 C ATOM 128 O LEU A 423 -1.983 4.151 0.697 1.00 54.43 O ATOM 129 CB LEU A 423 -5.211 3.352 0.310 1.00 75.52 C ATOM 130 CG LEU A 423 -6.082 3.435 1.564 1.00 71.34 C ATOM 131 CD1 LEU A 423 -5.256 3.144 2.807 1.00 21.40 C ATOM 132 CD2 LEU A 423 -6.740 4.803 1.666 1.00 55.00 C ATOM 0 H LEU A 423 -5.587 4.974 -1.504 1.00 51.42 H new ATOM 0 HA LEU A 423 -4.266 5.174 0.947 1.00 25.13 H new ATOM 0 HB2 LEU A 423 -5.865 3.250 -0.556 1.00 75.52 H new ATOM 0 HB3 LEU A 423 -4.613 2.442 0.367 1.00 75.52 H new ATOM 0 HG LEU A 423 -6.866 2.682 1.490 1.00 71.34 H new ATOM 0 HD11 LEU A 423 -5.892 3.208 3.690 1.00 21.40 H new ATOM 0 HD12 LEU A 423 -4.833 2.142 2.736 1.00 21.40 H new ATOM 0 HD13 LEU A 423 -4.450 3.874 2.887 1.00 21.40 H new ATOM 0 HD21 LEU A 423 -7.356 4.844 2.564 1.00 55.00 H new ATOM 0 HD22 LEU A 423 -5.971 5.574 1.718 1.00 55.00 H new ATOM 0 HD23 LEU A 423 -7.365 4.972 0.789 1.00 55.00 H new ATOM 144 N VAL A 424 -2.619 3.451 -1.345 1.00 60.03 N ATOM 145 CA VAL A 424 -1.305 2.928 -1.695 1.00 5.14 C ATOM 146 C VAL A 424 -0.251 4.030 -1.677 1.00 72.51 C ATOM 147 O VAL A 424 0.947 3.759 -1.595 1.00 50.20 O ATOM 148 CB VAL A 424 -1.316 2.266 -3.086 1.00 25.14 C ATOM 149 CG1 VAL A 424 0.057 1.706 -3.422 1.00 64.30 C ATOM 150 CG2 VAL A 424 -2.375 1.176 -3.149 1.00 12.02 C ATOM 0 H VAL A 424 -3.325 3.338 -2.072 1.00 60.03 H new ATOM 0 HA VAL A 424 -1.054 2.177 -0.946 1.00 5.14 H new ATOM 0 HB VAL A 424 -1.564 3.025 -3.828 1.00 25.14 H new ATOM 0 HG11 VAL A 424 0.029 1.242 -4.408 1.00 64.30 H new ATOM 0 HG12 VAL A 424 0.789 2.513 -3.421 1.00 64.30 H new ATOM 0 HG13 VAL A 424 0.338 0.960 -2.678 1.00 64.30 H new ATOM 0 HG21 VAL A 424 -2.369 0.719 -4.139 1.00 12.02 H new ATOM 0 HG22 VAL A 424 -2.160 0.416 -2.397 1.00 12.02 H new ATOM 0 HG23 VAL A 424 -3.356 1.610 -2.956 1.00 12.02 H new ATOM 160 N LYS A 425 -0.706 5.276 -1.754 1.00 65.34 N ATOM 161 CA LYS A 425 0.195 6.422 -1.746 1.00 0.32 C ATOM 162 C LYS A 425 0.633 6.759 -0.324 1.00 52.13 C ATOM 163 O LYS A 425 1.729 7.274 -0.106 1.00 25.31 O ATOM 164 CB LYS A 425 -0.483 7.636 -2.385 1.00 14.43 C ATOM 165 CG LYS A 425 0.254 8.178 -3.597 1.00 2.45 C ATOM 166 CD LYS A 425 1.286 9.220 -3.202 1.00 14.44 C ATOM 167 CE LYS A 425 2.079 9.705 -4.406 1.00 34.32 C ATOM 168 NZ LYS A 425 3.503 9.972 -4.062 1.00 33.34 N ATOM 0 H LYS A 425 -1.695 5.518 -1.823 1.00 65.34 H new ATOM 0 HA LYS A 425 1.079 6.161 -2.328 1.00 0.32 H new ATOM 0 HB2 LYS A 425 -1.496 7.362 -2.679 1.00 14.43 H new ATOM 0 HB3 LYS A 425 -0.570 8.427 -1.640 1.00 14.43 H new ATOM 0 HG2 LYS A 425 0.745 7.359 -4.122 1.00 2.45 H new ATOM 0 HG3 LYS A 425 -0.461 8.618 -4.292 1.00 2.45 H new ATOM 0 HD2 LYS A 425 0.787 10.066 -2.729 1.00 14.44 H new ATOM 0 HD3 LYS A 425 1.967 8.797 -2.463 1.00 14.44 H new ATOM 0 HE2 LYS A 425 2.031 8.957 -5.198 1.00 34.32 H new ATOM 0 HE3 LYS A 425 1.624 10.614 -4.798 1.00 34.32 H new ATOM 0 HZ1 LYS A 425 4.009 10.300 -4.909 1.00 33.34 H new ATOM 0 HZ2 LYS A 425 3.551 10.704 -3.325 1.00 33.34 H new ATOM 0 HZ3 LYS A 425 3.945 9.098 -3.712 1.00 33.34 H new ATOM 182 N LYS A 426 -0.233 6.467 0.641 1.00 25.31 N ATOM 183 CA LYS A 426 0.064 6.735 2.043 1.00 2.40 C ATOM 184 C LYS A 426 1.222 5.870 2.530 1.00 24.01 C ATOM 185 O LYS A 426 1.996 6.281 3.397 1.00 61.44 O ATOM 186 CB LYS A 426 -1.173 6.482 2.905 1.00 35.42 C ATOM 187 CG LYS A 426 -1.482 7.611 3.875 1.00 45.15 C ATOM 188 CD LYS A 426 -2.825 7.411 4.554 1.00 54.13 C ATOM 189 CE LYS A 426 -2.703 6.521 5.781 1.00 32.11 C ATOM 190 NZ LYS A 426 -3.537 7.016 6.911 1.00 1.05 N ATOM 0 H LYS A 426 -1.147 6.044 0.477 1.00 25.31 H new ATOM 0 HA LYS A 426 0.354 7.782 2.133 1.00 2.40 H new ATOM 0 HB2 LYS A 426 -2.034 6.328 2.254 1.00 35.42 H new ATOM 0 HB3 LYS A 426 -1.030 5.560 3.468 1.00 35.42 H new ATOM 0 HG2 LYS A 426 -0.697 7.669 4.629 1.00 45.15 H new ATOM 0 HG3 LYS A 426 -1.481 8.561 3.341 1.00 45.15 H new ATOM 0 HD2 LYS A 426 -3.235 8.378 4.844 1.00 54.13 H new ATOM 0 HD3 LYS A 426 -3.527 6.966 3.849 1.00 54.13 H new ATOM 0 HE2 LYS A 426 -3.005 5.506 5.524 1.00 32.11 H new ATOM 0 HE3 LYS A 426 -1.660 6.474 6.093 1.00 32.11 H new ATOM 0 HZ1 LYS A 426 -3.426 6.382 7.728 1.00 1.05 H new ATOM 0 HZ2 LYS A 426 -3.232 7.975 7.173 1.00 1.05 H new ATOM 0 HZ3 LYS A 426 -4.536 7.037 6.622 1.00 1.05 H new ATOM 204 N LEU A 427 1.337 4.672 1.967 1.00 4.43 N ATOM 205 CA LEU A 427 2.403 3.749 2.343 1.00 54.51 C ATOM 206 C LEU A 427 3.773 4.385 2.134 1.00 52.12 C ATOM 207 O LEU A 427 4.760 3.970 2.742 1.00 63.31 O ATOM 208 CB LEU A 427 2.296 2.458 1.530 1.00 44.22 C ATOM 209 CG LEU A 427 1.176 1.500 1.935 1.00 65.12 C ATOM 210 CD1 LEU A 427 1.207 1.246 3.434 1.00 11.13 C ATOM 211 CD2 LEU A 427 -0.177 2.052 1.513 1.00 61.23 C ATOM 0 H LEU A 427 0.706 4.317 1.249 1.00 4.43 H new ATOM 0 HA LEU A 427 2.291 3.514 3.402 1.00 54.51 H new ATOM 0 HB2 LEU A 427 2.159 2.723 0.482 1.00 44.22 H new ATOM 0 HB3 LEU A 427 3.245 1.927 1.603 1.00 44.22 H new ATOM 0 HG LEU A 427 1.333 0.551 1.423 1.00 65.12 H new ATOM 0 HD11 LEU A 427 0.403 0.562 3.704 1.00 11.13 H new ATOM 0 HD12 LEU A 427 2.165 0.805 3.709 1.00 11.13 H new ATOM 0 HD13 LEU A 427 1.075 2.188 3.966 1.00 11.13 H new ATOM 0 HD21 LEU A 427 -0.962 1.357 1.810 1.00 61.23 H new ATOM 0 HD22 LEU A 427 -0.344 3.015 1.996 1.00 61.23 H new ATOM 0 HD23 LEU A 427 -0.196 2.181 0.431 1.00 61.23 H new ATOM 223 N ILE A 428 3.826 5.395 1.271 1.00 14.12 N ATOM 224 CA ILE A 428 5.074 6.089 0.985 1.00 41.30 C ATOM 225 C ILE A 428 4.992 7.557 1.391 1.00 1.12 C ATOM 226 O ILE A 428 6.014 8.217 1.580 1.00 43.11 O ATOM 227 CB ILE A 428 5.437 6.002 -0.510 1.00 0.32 C ATOM 228 CG1 ILE A 428 5.516 4.539 -0.952 1.00 1.41 C ATOM 229 CG2 ILE A 428 6.755 6.714 -0.777 1.00 52.54 C ATOM 230 CD1 ILE A 428 4.192 3.977 -1.418 1.00 34.30 C ATOM 0 H ILE A 428 3.019 5.750 0.758 1.00 14.12 H new ATOM 0 HA ILE A 428 5.851 5.595 1.569 1.00 41.30 H new ATOM 0 HB ILE A 428 4.656 6.496 -1.089 1.00 0.32 H new ATOM 0 HG12 ILE A 428 6.243 4.450 -1.759 1.00 1.41 H new ATOM 0 HG13 ILE A 428 5.885 3.937 -0.122 1.00 1.41 H new ATOM 0 HG21 ILE A 428 6.998 6.644 -1.837 1.00 52.54 H new ATOM 0 HG22 ILE A 428 6.666 7.763 -0.494 1.00 52.54 H new ATOM 0 HG23 ILE A 428 7.546 6.246 -0.192 1.00 52.54 H new ATOM 0 HD11 ILE A 428 4.323 2.937 -1.716 1.00 34.30 H new ATOM 0 HD12 ILE A 428 3.467 4.033 -0.606 1.00 34.30 H new ATOM 0 HD13 ILE A 428 3.830 4.555 -2.268 1.00 34.30 H new ATOM 242 N ALA A 429 3.771 8.061 1.526 1.00 73.52 N ATOM 243 CA ALA A 429 3.555 9.450 1.914 1.00 63.15 C ATOM 244 C ALA A 429 4.062 9.710 3.328 1.00 31.54 C ATOM 245 O ALA A 429 4.644 10.757 3.607 1.00 52.14 O ATOM 246 CB ALA A 429 2.079 9.804 1.807 1.00 43.31 C ATOM 0 H ALA A 429 2.915 7.528 1.372 1.00 73.52 H new ATOM 0 HA ALA A 429 4.120 10.084 1.231 1.00 63.15 H new ATOM 0 HB1 ALA A 429 1.932 10.844 2.100 1.00 43.31 H new ATOM 0 HB2 ALA A 429 1.745 9.666 0.779 1.00 43.31 H new ATOM 0 HB3 ALA A 429 1.501 9.156 2.466 1.00 43.31 H new ATOM 252 N ALA A 430 3.836 8.748 4.218 1.00 3.34 N ATOM 253 CA ALA A 430 4.272 8.873 5.604 1.00 1.51 C ATOM 254 C ALA A 430 5.427 7.923 5.904 1.00 13.13 C ATOM 255 O ALA A 430 5.428 7.239 6.927 1.00 30.31 O ATOM 256 CB ALA A 430 3.109 8.608 6.549 1.00 41.54 C ATOM 0 H ALA A 430 3.354 7.875 4.004 1.00 3.34 H new ATOM 0 HA ALA A 430 4.625 9.893 5.757 1.00 1.51 H new ATOM 0 HB1 ALA A 430 3.449 8.705 7.580 1.00 41.54 H new ATOM 0 HB2 ALA A 430 2.315 9.330 6.360 1.00 41.54 H new ATOM 0 HB3 ALA A 430 2.730 7.599 6.385 1.00 41.54 H new ATOM 262 N GLU A 431 6.406 7.887 5.006 1.00 20.32 N ATOM 263 CA GLU A 431 7.566 7.019 5.176 1.00 73.32 C ATOM 264 C GLU A 431 8.814 7.657 4.574 1.00 25.43 C ATOM 265 O GLU A 431 8.780 8.792 4.104 1.00 72.12 O ATOM 266 CB GLU A 431 7.310 5.658 4.526 1.00 33.02 C ATOM 267 CG GLU A 431 6.232 4.843 5.222 1.00 71.12 C ATOM 268 CD GLU A 431 6.528 3.356 5.213 1.00 33.52 C ATOM 269 OE1 GLU A 431 6.799 2.811 4.123 1.00 31.30 O ATOM 270 OE2 GLU A 431 6.488 2.738 6.298 1.00 3.11 O ATOM 0 H GLU A 431 6.420 8.448 4.154 1.00 20.32 H new ATOM 0 HA GLU A 431 7.731 6.878 6.244 1.00 73.32 H new ATOM 0 HB2 GLU A 431 7.023 5.810 3.485 1.00 33.02 H new ATOM 0 HB3 GLU A 431 8.239 5.087 4.521 1.00 33.02 H new ATOM 0 HG2 GLU A 431 6.133 5.184 6.253 1.00 71.12 H new ATOM 0 HG3 GLU A 431 5.274 5.022 4.733 1.00 71.12 H new ATOM 277 N ASN A 432 9.918 6.915 4.596 1.00 71.42 N ATOM 278 CA ASN A 432 11.180 7.407 4.053 1.00 14.21 C ATOM 279 C ASN A 432 11.578 6.623 2.807 1.00 2.13 C ATOM 280 O ASN A 432 12.443 5.748 2.845 1.00 43.31 O ATOM 281 CB ASN A 432 12.284 7.309 5.107 1.00 1.31 C ATOM 282 CG ASN A 432 13.543 8.047 4.696 1.00 71.24 C ATOM 283 OD1 ASN A 432 13.503 9.235 4.379 1.00 41.42 O ATOM 284 ND2 ASN A 432 14.669 7.343 4.698 1.00 21.14 N ATOM 0 H ASN A 432 9.964 5.973 4.983 1.00 71.42 H new ATOM 0 HA ASN A 432 11.045 8.452 3.774 1.00 14.21 H new ATOM 0 HB2 ASN A 432 11.919 7.716 6.050 1.00 1.31 H new ATOM 0 HB3 ASN A 432 12.522 6.260 5.283 1.00 1.31 H new ATOM 0 HD21 ASN A 432 15.548 7.786 4.429 1.00 21.14 H new ATOM 0 HD22 ASN A 432 14.655 6.360 4.968 1.00 21.14 H new ATOM 291 N PRO A 433 10.934 6.943 1.675 1.00 3.34 N ATOM 292 CA PRO A 433 11.206 6.282 0.396 1.00 65.52 C ATOM 293 C PRO A 433 12.577 6.645 -0.165 1.00 53.23 C ATOM 294 O PRO A 433 12.963 6.177 -1.236 1.00 44.42 O ATOM 295 CB PRO A 433 10.098 6.809 -0.519 1.00 73.31 C ATOM 296 CG PRO A 433 9.712 8.121 0.071 1.00 13.32 C ATOM 297 CD PRO A 433 9.892 7.977 1.557 1.00 21.53 C ATOM 0 HA PRO A 433 11.217 5.196 0.493 1.00 65.52 H new ATOM 0 HB2 PRO A 433 10.452 6.924 -1.543 1.00 73.31 H new ATOM 0 HB3 PRO A 433 9.251 6.124 -0.550 1.00 73.31 H new ATOM 0 HG2 PRO A 433 10.336 8.924 -0.321 1.00 13.32 H new ATOM 0 HG3 PRO A 433 8.680 8.371 -0.175 1.00 13.32 H new ATOM 0 HD2 PRO A 433 10.203 8.915 2.017 1.00 21.53 H new ATOM 0 HD3 PRO A 433 8.967 7.673 2.046 1.00 21.53 H new ATOM 305 N ALA A 434 13.307 7.482 0.565 1.00 43.31 N ATOM 306 CA ALA A 434 14.635 7.907 0.140 1.00 23.43 C ATOM 307 C ALA A 434 15.520 6.705 -0.179 1.00 15.40 C ATOM 308 O ALA A 434 15.881 6.477 -1.333 1.00 0.23 O ATOM 309 CB ALA A 434 15.282 8.770 1.214 1.00 74.31 C ATOM 0 H ALA A 434 13.001 7.879 1.453 1.00 43.31 H new ATOM 0 HA ALA A 434 14.527 8.498 -0.770 1.00 23.43 H new ATOM 0 HB1 ALA A 434 16.273 9.080 0.883 1.00 74.31 H new ATOM 0 HB2 ALA A 434 14.666 9.652 1.392 1.00 74.31 H new ATOM 0 HB3 ALA A 434 15.370 8.197 2.137 1.00 74.31 H new ATOM 315 N LYS A 435 15.865 5.941 0.851 1.00 11.35 N ATOM 316 CA LYS A 435 16.706 4.763 0.682 1.00 23.12 C ATOM 317 C LYS A 435 15.932 3.634 0.008 1.00 24.42 C ATOM 318 O LYS A 435 16.280 3.173 -1.079 1.00 70.13 O ATOM 319 CB LYS A 435 17.239 4.292 2.037 1.00 61.41 C ATOM 320 CG LYS A 435 18.687 4.676 2.287 1.00 2.54 C ATOM 321 CD LYS A 435 19.220 4.040 3.560 1.00 4.45 C ATOM 322 CE LYS A 435 19.330 5.056 4.687 1.00 1.44 C ATOM 323 NZ LYS A 435 20.627 5.787 4.651 1.00 55.20 N ATOM 0 H LYS A 435 15.575 6.117 1.813 1.00 11.35 H new ATOM 0 HA LYS A 435 17.546 5.036 0.043 1.00 23.12 H new ATOM 0 HB2 LYS A 435 16.618 4.712 2.828 1.00 61.41 H new ATOM 0 HB3 LYS A 435 17.143 3.208 2.099 1.00 61.41 H new ATOM 0 HG2 LYS A 435 19.298 4.365 1.440 1.00 2.54 H new ATOM 0 HG3 LYS A 435 18.770 5.760 2.359 1.00 2.54 H new ATOM 0 HD2 LYS A 435 18.562 3.227 3.865 1.00 4.45 H new ATOM 0 HD3 LYS A 435 20.199 3.602 3.367 1.00 4.45 H new ATOM 0 HE2 LYS A 435 18.509 5.769 4.614 1.00 1.44 H new ATOM 0 HE3 LYS A 435 19.226 4.548 5.646 1.00 1.44 H new ATOM 0 HZ1 LYS A 435 20.663 6.470 5.435 1.00 55.20 H new ATOM 0 HZ2 LYS A 435 21.410 5.109 4.746 1.00 55.20 H new ATOM 0 HZ3 LYS A 435 20.715 6.293 3.747 1.00 55.20 H new ATOM 337 N PRO A 436 14.857 3.177 0.667 1.00 74.40 N ATOM 338 CA PRO A 436 14.011 2.098 0.149 1.00 20.41 C ATOM 339 C PRO A 436 13.202 2.530 -1.070 1.00 10.24 C ATOM 340 O PRO A 436 13.262 3.687 -1.489 1.00 61.33 O ATOM 341 CB PRO A 436 13.080 1.783 1.323 1.00 65.40 C ATOM 342 CG PRO A 436 13.030 3.042 2.116 1.00 42.53 C ATOM 343 CD PRO A 436 14.384 3.679 1.968 1.00 1.11 C ATOM 0 HA PRO A 436 14.600 1.245 -0.188 1.00 20.41 H new ATOM 0 HB2 PRO A 436 12.088 1.495 0.975 1.00 65.40 H new ATOM 0 HB3 PRO A 436 13.462 0.954 1.920 1.00 65.40 H new ATOM 0 HG2 PRO A 436 12.245 3.704 1.749 1.00 42.53 H new ATOM 0 HG3 PRO A 436 12.808 2.835 3.163 1.00 42.53 H new ATOM 0 HD2 PRO A 436 14.320 4.767 1.980 1.00 1.11 H new ATOM 0 HD3 PRO A 436 15.054 3.391 2.778 1.00 1.11 H new ATOM 351 N LEU A 437 12.448 1.594 -1.635 1.00 54.23 N ATOM 352 CA LEU A 437 11.626 1.879 -2.806 1.00 23.30 C ATOM 353 C LEU A 437 10.534 0.826 -2.974 1.00 42.04 C ATOM 354 O LEU A 437 9.405 1.143 -3.347 1.00 63.22 O ATOM 355 CB LEU A 437 12.496 1.932 -4.064 1.00 14.25 C ATOM 356 CG LEU A 437 13.497 0.789 -4.235 1.00 72.24 C ATOM 357 CD1 LEU A 437 12.861 -0.367 -4.991 1.00 65.14 C ATOM 358 CD2 LEU A 437 14.745 1.278 -4.956 1.00 31.12 C ATOM 0 H LEU A 437 12.389 0.632 -1.302 1.00 54.23 H new ATOM 0 HA LEU A 437 11.151 2.849 -2.659 1.00 23.30 H new ATOM 0 HB2 LEU A 437 11.840 1.948 -4.935 1.00 14.25 H new ATOM 0 HB3 LEU A 437 13.046 2.873 -4.062 1.00 14.25 H new ATOM 0 HG LEU A 437 13.788 0.434 -3.246 1.00 72.24 H new ATOM 0 HD11 LEU A 437 13.588 -1.172 -5.104 1.00 65.14 H new ATOM 0 HD12 LEU A 437 11.997 -0.733 -4.436 1.00 65.14 H new ATOM 0 HD13 LEU A 437 12.542 -0.026 -5.976 1.00 65.14 H new ATOM 0 HD21 LEU A 437 15.447 0.452 -5.069 1.00 31.12 H new ATOM 0 HD22 LEU A 437 14.471 1.659 -5.940 1.00 31.12 H new ATOM 0 HD23 LEU A 437 15.212 2.074 -4.376 1.00 31.12 H new ATOM 370 N SER A 438 10.880 -0.427 -2.695 1.00 54.34 N ATOM 371 CA SER A 438 9.929 -1.527 -2.817 1.00 41.50 C ATOM 372 C SER A 438 8.987 -1.565 -1.618 1.00 55.24 C ATOM 373 O SER A 438 9.217 -0.896 -0.611 1.00 10.45 O ATOM 374 CB SER A 438 10.673 -2.859 -2.937 1.00 74.34 C ATOM 375 OG SER A 438 10.080 -3.685 -3.924 1.00 50.25 O ATOM 0 H SER A 438 11.810 -0.706 -2.383 1.00 54.34 H new ATOM 0 HA SER A 438 9.337 -1.366 -3.718 1.00 41.50 H new ATOM 0 HB2 SER A 438 11.717 -2.675 -3.191 1.00 74.34 H new ATOM 0 HB3 SER A 438 10.665 -3.372 -1.975 1.00 74.34 H new ATOM 0 HG SER A 438 10.574 -4.529 -3.984 1.00 50.25 H new ATOM 381 N ASP A 439 7.923 -2.353 -1.736 1.00 13.33 N ATOM 382 CA ASP A 439 6.943 -2.480 -0.662 1.00 44.23 C ATOM 383 C ASP A 439 7.498 -3.323 0.481 1.00 21.44 C ATOM 384 O ASP A 439 7.093 -4.470 0.674 1.00 41.13 O ATOM 385 CB ASP A 439 5.652 -3.104 -1.193 1.00 42.20 C ATOM 386 CG ASP A 439 5.910 -4.324 -2.054 1.00 32.32 C ATOM 387 OD1 ASP A 439 6.965 -4.968 -1.871 1.00 54.22 O ATOM 388 OD2 ASP A 439 5.056 -4.638 -2.909 1.00 41.03 O ATOM 0 H ASP A 439 7.717 -2.913 -2.563 1.00 13.33 H new ATOM 0 HA ASP A 439 6.725 -1.482 -0.281 1.00 44.23 H new ATOM 0 HB2 ASP A 439 5.015 -3.383 -0.354 1.00 42.20 H new ATOM 0 HB3 ASP A 439 5.106 -2.362 -1.775 1.00 42.20 H new ATOM 393 N SER A 440 8.428 -2.748 1.238 1.00 32.11 N ATOM 394 CA SER A 440 9.041 -3.449 2.360 1.00 53.31 C ATOM 395 C SER A 440 9.056 -2.570 3.607 1.00 14.20 C ATOM 396 O SER A 440 8.833 -3.046 4.720 1.00 11.13 O ATOM 397 CB SER A 440 10.467 -3.873 2.005 1.00 20.05 C ATOM 398 OG SER A 440 10.632 -3.987 0.602 1.00 53.13 O ATOM 0 H SER A 440 8.773 -1.799 1.094 1.00 32.11 H new ATOM 0 HA SER A 440 8.446 -4.338 2.570 1.00 53.31 H new ATOM 0 HB2 SER A 440 11.175 -3.144 2.399 1.00 20.05 H new ATOM 0 HB3 SER A 440 10.695 -4.827 2.480 1.00 20.05 H new ATOM 0 HG SER A 440 11.552 -4.257 0.402 1.00 53.13 H new ATOM 404 N LYS A 441 9.320 -1.282 3.413 1.00 45.04 N ATOM 405 CA LYS A 441 9.363 -0.334 4.518 1.00 13.53 C ATOM 406 C LYS A 441 7.956 0.007 4.999 1.00 50.43 C ATOM 407 O LYS A 441 7.757 0.383 6.154 1.00 3.11 O ATOM 408 CB LYS A 441 10.093 0.943 4.095 1.00 55.31 C ATOM 409 CG LYS A 441 11.418 1.152 4.807 1.00 34.32 C ATOM 410 CD LYS A 441 11.447 2.474 5.554 1.00 54.20 C ATOM 411 CE LYS A 441 12.220 2.361 6.859 1.00 62.13 C ATOM 412 NZ LYS A 441 11.370 1.838 7.964 1.00 4.22 N ATOM 0 H LYS A 441 9.508 -0.871 2.498 1.00 45.04 H new ATOM 0 HA LYS A 441 9.906 -0.799 5.341 1.00 13.53 H new ATOM 0 HB2 LYS A 441 10.269 0.911 3.020 1.00 55.31 H new ATOM 0 HB3 LYS A 441 9.448 1.800 4.287 1.00 55.31 H new ATOM 0 HG2 LYS A 441 11.589 0.334 5.507 1.00 34.32 H new ATOM 0 HG3 LYS A 441 12.230 1.126 4.081 1.00 34.32 H new ATOM 0 HD2 LYS A 441 11.903 3.238 4.925 1.00 54.20 H new ATOM 0 HD3 LYS A 441 10.427 2.798 5.761 1.00 54.20 H new ATOM 0 HE2 LYS A 441 13.077 1.703 6.717 1.00 62.13 H new ATOM 0 HE3 LYS A 441 12.612 3.340 7.135 1.00 62.13 H new ATOM 0 HZ1 LYS A 441 11.934 1.776 8.836 1.00 4.22 H new ATOM 0 HZ2 LYS A 441 10.566 2.479 8.117 1.00 4.22 H new ATOM 0 HZ3 LYS A 441 11.016 0.893 7.712 1.00 4.22 H new ATOM 426 N LEU A 442 6.983 -0.126 4.104 1.00 50.03 N ATOM 427 CA LEU A 442 5.593 0.167 4.436 1.00 32.23 C ATOM 428 C LEU A 442 4.896 -1.068 5.000 1.00 12.34 C ATOM 429 O LEU A 442 3.779 -0.985 5.513 1.00 51.43 O ATOM 430 CB LEU A 442 4.847 0.666 3.199 1.00 75.21 C ATOM 431 CG LEU A 442 5.190 -0.029 1.881 1.00 11.21 C ATOM 432 CD1 LEU A 442 6.498 0.507 1.320 1.00 43.30 C ATOM 433 CD2 LEU A 442 5.270 -1.535 2.077 1.00 0.04 C ATOM 0 H LEU A 442 7.131 -0.435 3.143 1.00 50.03 H new ATOM 0 HA LEU A 442 5.584 0.947 5.197 1.00 32.23 H new ATOM 0 HB2 LEU A 442 3.777 0.557 3.376 1.00 75.21 H new ATOM 0 HB3 LEU A 442 5.044 1.732 3.086 1.00 75.21 H new ATOM 0 HG LEU A 442 4.397 0.182 1.164 1.00 11.21 H new ATOM 0 HD11 LEU A 442 6.726 0.001 0.382 1.00 43.30 H new ATOM 0 HD12 LEU A 442 6.405 1.578 1.141 1.00 43.30 H new ATOM 0 HD13 LEU A 442 7.301 0.327 2.034 1.00 43.30 H new ATOM 0 HD21 LEU A 442 5.515 -2.013 1.128 1.00 0.04 H new ATOM 0 HD22 LEU A 442 6.043 -1.766 2.810 1.00 0.04 H new ATOM 0 HD23 LEU A 442 4.309 -1.907 2.433 1.00 0.04 H new ATOM 445 N THR A 443 5.564 -2.213 4.905 1.00 23.14 N ATOM 446 CA THR A 443 5.010 -3.466 5.407 1.00 42.54 C ATOM 447 C THR A 443 5.909 -4.074 6.477 1.00 50.34 C ATOM 448 O THR A 443 5.590 -5.118 7.047 1.00 45.43 O ATOM 449 CB THR A 443 4.817 -4.488 4.272 1.00 60.53 C ATOM 450 OG1 THR A 443 4.031 -5.592 4.735 1.00 40.31 O ATOM 451 CG2 THR A 443 6.159 -4.993 3.763 1.00 13.24 C ATOM 0 H THR A 443 6.490 -2.299 4.485 1.00 23.14 H new ATOM 0 HA THR A 443 4.039 -3.231 5.843 1.00 42.54 H new ATOM 0 HB THR A 443 4.299 -3.992 3.451 1.00 60.53 H new ATOM 0 HG1 THR A 443 4.190 -5.728 5.693 1.00 40.31 H new ATOM 0 HG21 THR A 443 5.996 -5.714 2.962 1.00 13.24 H new ATOM 0 HG22 THR A 443 6.743 -4.155 3.384 1.00 13.24 H new ATOM 0 HG23 THR A 443 6.700 -5.473 4.578 1.00 13.24 H new ATOM 459 N SER A 444 7.032 -3.416 6.745 1.00 60.22 N ATOM 460 CA SER A 444 7.978 -3.895 7.746 1.00 44.01 C ATOM 461 C SER A 444 7.369 -3.833 9.143 1.00 23.13 C ATOM 462 O SER A 444 7.335 -4.832 9.863 1.00 51.33 O ATOM 463 CB SER A 444 9.264 -3.066 7.700 1.00 30.12 C ATOM 464 OG SER A 444 10.280 -3.741 6.979 1.00 50.23 O ATOM 0 H SER A 444 7.309 -2.550 6.283 1.00 60.22 H new ATOM 0 HA SER A 444 8.215 -4.934 7.518 1.00 44.01 H new ATOM 0 HB2 SER A 444 9.062 -2.102 7.234 1.00 30.12 H new ATOM 0 HB3 SER A 444 9.607 -2.864 8.715 1.00 30.12 H new ATOM 0 HG SER A 444 10.082 -3.701 6.020 1.00 50.23 H new ATOM 470 N LEU A 445 6.889 -2.653 9.520 1.00 13.12 N ATOM 471 CA LEU A 445 6.280 -2.458 10.832 1.00 74.51 C ATOM 472 C LEU A 445 5.179 -3.485 11.078 1.00 31.34 C ATOM 473 O LEU A 445 4.918 -3.870 12.219 1.00 2.31 O ATOM 474 CB LEU A 445 5.709 -1.044 10.946 1.00 15.35 C ATOM 475 CG LEU A 445 6.486 -0.078 11.840 1.00 13.23 C ATOM 476 CD1 LEU A 445 6.280 1.357 11.381 1.00 53.22 C ATOM 477 CD2 LEU A 445 6.064 -0.239 13.294 1.00 22.40 C ATOM 0 H LEU A 445 6.910 -1.817 8.936 1.00 13.12 H new ATOM 0 HA LEU A 445 7.053 -2.592 11.588 1.00 74.51 H new ATOM 0 HB2 LEU A 445 5.651 -0.615 9.946 1.00 15.35 H new ATOM 0 HB3 LEU A 445 4.688 -1.115 11.322 1.00 15.35 H new ATOM 0 HG LEU A 445 7.547 -0.315 11.761 1.00 13.23 H new ATOM 0 HD11 LEU A 445 6.841 2.030 12.029 1.00 53.22 H new ATOM 0 HD12 LEU A 445 6.631 1.465 10.355 1.00 53.22 H new ATOM 0 HD13 LEU A 445 5.220 1.606 11.429 1.00 53.22 H new ATOM 0 HD21 LEU A 445 6.628 0.457 13.916 1.00 22.40 H new ATOM 0 HD22 LEU A 445 4.999 -0.029 13.389 1.00 22.40 H new ATOM 0 HD23 LEU A 445 6.263 -1.260 13.620 1.00 22.40 H new ATOM 489 N LEU A 446 4.537 -3.926 10.002 1.00 34.13 N ATOM 490 CA LEU A 446 3.465 -4.911 10.101 1.00 14.52 C ATOM 491 C LEU A 446 4.030 -6.312 10.309 1.00 73.32 C ATOM 492 O LEU A 446 3.453 -7.124 11.033 1.00 12.30 O ATOM 493 CB LEU A 446 2.599 -4.879 8.841 1.00 61.33 C ATOM 494 CG LEU A 446 1.261 -4.150 8.963 1.00 40.31 C ATOM 495 CD1 LEU A 446 0.500 -4.205 7.648 1.00 53.23 C ATOM 496 CD2 LEU A 446 0.429 -4.746 10.088 1.00 20.24 C ATOM 0 H LEU A 446 4.740 -3.617 9.051 1.00 34.13 H new ATOM 0 HA LEU A 446 2.849 -4.657 10.964 1.00 14.52 H new ATOM 0 HB2 LEU A 446 3.173 -4.411 8.042 1.00 61.33 H new ATOM 0 HB3 LEU A 446 2.403 -5.906 8.533 1.00 61.33 H new ATOM 0 HG LEU A 446 1.460 -3.105 9.200 1.00 40.31 H new ATOM 0 HD11 LEU A 446 -0.450 -3.681 7.755 1.00 53.23 H new ATOM 0 HD12 LEU A 446 1.091 -3.729 6.865 1.00 53.23 H new ATOM 0 HD13 LEU A 446 0.312 -5.245 7.379 1.00 53.23 H new ATOM 0 HD21 LEU A 446 -0.520 -4.214 10.160 1.00 20.24 H new ATOM 0 HD22 LEU A 446 0.240 -5.800 9.882 1.00 20.24 H new ATOM 0 HD23 LEU A 446 0.970 -4.652 11.030 1.00 20.24 H new ATOM 508 N SER A 447 5.162 -6.588 9.671 1.00 23.15 N ATOM 509 CA SER A 447 5.806 -7.893 9.785 1.00 74.12 C ATOM 510 C SER A 447 6.506 -8.037 11.132 1.00 35.22 C ATOM 511 O SER A 447 6.881 -9.139 11.533 1.00 54.52 O ATOM 512 CB SER A 447 6.812 -8.088 8.650 1.00 23.22 C ATOM 513 OG SER A 447 6.258 -8.867 7.604 1.00 24.20 O ATOM 0 H SER A 447 5.653 -5.926 9.070 1.00 23.15 H new ATOM 0 HA SER A 447 5.035 -8.660 9.713 1.00 74.12 H new ATOM 0 HB2 SER A 447 7.118 -7.117 8.261 1.00 23.22 H new ATOM 0 HB3 SER A 447 7.708 -8.575 9.034 1.00 23.22 H new ATOM 0 HG SER A 447 5.290 -8.946 7.733 1.00 24.20 H new ATOM 519 N GLU A 448 6.677 -6.917 11.827 1.00 53.05 N ATOM 520 CA GLU A 448 7.332 -6.919 13.130 1.00 73.14 C ATOM 521 C GLU A 448 6.621 -7.863 14.094 1.00 24.24 C ATOM 522 O GLU A 448 7.218 -8.349 15.056 1.00 65.04 O ATOM 523 CB GLU A 448 7.362 -5.505 13.712 1.00 52.13 C ATOM 524 CG GLU A 448 8.359 -4.585 13.027 1.00 74.33 C ATOM 525 CD GLU A 448 9.768 -4.748 13.563 1.00 21.52 C ATOM 526 OE1 GLU A 448 9.956 -4.616 14.790 1.00 55.13 O ATOM 527 OE2 GLU A 448 10.682 -5.011 12.754 1.00 44.13 O ATOM 0 H GLU A 448 6.371 -5.997 11.510 1.00 53.05 H new ATOM 0 HA GLU A 448 8.355 -7.270 12.994 1.00 73.14 H new ATOM 0 HB2 GLU A 448 6.366 -5.069 13.636 1.00 52.13 H new ATOM 0 HB3 GLU A 448 7.604 -5.563 14.773 1.00 52.13 H new ATOM 0 HG2 GLU A 448 8.356 -4.786 11.956 1.00 74.33 H new ATOM 0 HG3 GLU A 448 8.042 -3.550 13.158 1.00 74.33 H new ATOM 534 N GLN A 449 5.344 -8.118 13.831 1.00 3.14 N ATOM 535 CA GLN A 449 4.552 -9.003 14.677 1.00 20.14 C ATOM 536 C GLN A 449 4.209 -10.295 13.942 1.00 24.24 C ATOM 537 O GLN A 449 4.189 -11.372 14.537 1.00 31.45 O ATOM 538 CB GLN A 449 3.268 -8.301 15.125 1.00 65.44 C ATOM 539 CG GLN A 449 3.192 -6.845 14.699 1.00 54.55 C ATOM 540 CD GLN A 449 2.028 -6.110 15.337 1.00 63.41 C ATOM 541 OE1 GLN A 449 1.051 -6.725 15.763 1.00 75.33 O ATOM 542 NE2 GLN A 449 2.129 -4.788 15.407 1.00 73.45 N ATOM 0 H GLN A 449 4.835 -7.725 13.039 1.00 3.14 H new ATOM 0 HA GLN A 449 5.147 -9.253 15.556 1.00 20.14 H new ATOM 0 HB2 GLN A 449 2.410 -8.836 14.717 1.00 65.44 H new ATOM 0 HB3 GLN A 449 3.192 -8.358 16.211 1.00 65.44 H new ATOM 0 HG2 GLN A 449 4.123 -6.344 14.964 1.00 54.55 H new ATOM 0 HG3 GLN A 449 3.100 -6.792 13.614 1.00 54.55 H new ATOM 0 HE21 GLN A 449 2.958 -4.320 15.041 1.00 73.45 H new ATOM 0 HE22 GLN A 449 1.378 -4.241 15.827 1.00 73.45 H new ATOM 551 N GLY A 450 3.941 -10.181 12.645 1.00 13.54 N ATOM 552 CA GLY A 450 3.603 -11.347 11.852 1.00 74.22 C ATOM 553 C GLY A 450 2.774 -10.997 10.631 1.00 1.14 C ATOM 554 O GLY A 450 2.672 -11.789 9.695 1.00 72.42 O ATOM 0 H GLY A 450 3.952 -9.301 12.129 1.00 13.54 H new ATOM 0 HA2 GLY A 450 4.519 -11.845 11.535 1.00 74.22 H new ATOM 0 HA3 GLY A 450 3.052 -12.056 12.470 1.00 74.22 H new ATOM 558 N ILE A 451 2.180 -9.808 10.642 1.00 23.10 N ATOM 559 CA ILE A 451 1.356 -9.357 9.528 1.00 10.02 C ATOM 560 C ILE A 451 2.153 -9.335 8.228 1.00 71.02 C ATOM 561 O ILE A 451 3.372 -9.172 8.239 1.00 44.22 O ATOM 562 CB ILE A 451 0.780 -7.952 9.787 1.00 20.21 C ATOM 563 CG1 ILE A 451 0.155 -7.883 11.182 1.00 73.24 C ATOM 564 CG2 ILE A 451 -0.246 -7.595 8.723 1.00 61.55 C ATOM 565 CD1 ILE A 451 -0.888 -8.950 11.431 1.00 54.04 C ATOM 0 H ILE A 451 2.254 -9.140 11.410 1.00 23.10 H new ATOM 0 HA ILE A 451 0.534 -10.067 9.436 1.00 10.02 H new ATOM 0 HB ILE A 451 1.593 -7.227 9.737 1.00 20.21 H new ATOM 0 HG12 ILE A 451 0.943 -7.976 11.929 1.00 73.24 H new ATOM 0 HG13 ILE A 451 -0.301 -6.902 11.319 1.00 73.24 H new ATOM 0 HG21 ILE A 451 -0.643 -6.599 8.920 1.00 61.55 H new ATOM 0 HG22 ILE A 451 0.228 -7.609 7.741 1.00 61.55 H new ATOM 0 HG23 ILE A 451 -1.059 -8.321 8.743 1.00 61.55 H new ATOM 0 HD11 ILE A 451 -1.288 -8.840 12.439 1.00 54.04 H new ATOM 0 HD12 ILE A 451 -1.696 -8.845 10.707 1.00 54.04 H new ATOM 0 HD13 ILE A 451 -0.433 -9.935 11.327 1.00 54.04 H new ATOM 577 N MET A 452 1.454 -9.500 7.110 1.00 44.11 N ATOM 578 CA MET A 452 2.096 -9.497 5.800 1.00 1.30 C ATOM 579 C MET A 452 1.087 -9.187 4.700 1.00 50.04 C ATOM 580 O MET A 452 0.683 -10.074 3.947 1.00 61.13 O ATOM 581 CB MET A 452 2.763 -10.848 5.532 1.00 15.43 C ATOM 582 CG MET A 452 1.838 -12.035 5.746 1.00 52.53 C ATOM 583 SD MET A 452 1.871 -13.198 4.369 1.00 51.34 S ATOM 584 CE MET A 452 1.738 -14.757 5.240 1.00 51.05 C ATOM 0 H MET A 452 0.444 -9.637 7.084 1.00 44.11 H new ATOM 0 HA MET A 452 2.858 -8.717 5.799 1.00 1.30 H new ATOM 0 HB2 MET A 452 3.131 -10.865 4.506 1.00 15.43 H new ATOM 0 HB3 MET A 452 3.630 -10.951 6.184 1.00 15.43 H new ATOM 0 HG2 MET A 452 2.124 -12.553 6.661 1.00 52.53 H new ATOM 0 HG3 MET A 452 0.819 -11.675 5.889 1.00 52.53 H new ATOM 0 HE1 MET A 452 1.745 -15.577 4.522 1.00 51.05 H new ATOM 0 HE2 MET A 452 2.581 -14.866 5.923 1.00 51.05 H new ATOM 0 HE3 MET A 452 0.807 -14.779 5.807 1.00 51.05 H new ATOM 594 N VAL A 453 0.681 -7.925 4.613 1.00 3.43 N ATOM 595 CA VAL A 453 -0.282 -7.498 3.604 1.00 5.34 C ATOM 596 C VAL A 453 0.229 -6.284 2.836 1.00 34.11 C ATOM 597 O VAL A 453 0.111 -6.216 1.613 1.00 33.05 O ATOM 598 CB VAL A 453 -1.644 -7.157 4.237 1.00 23.11 C ATOM 599 CG1 VAL A 453 -2.463 -8.421 4.453 1.00 15.42 C ATOM 600 CG2 VAL A 453 -1.449 -6.406 5.546 1.00 74.53 C ATOM 0 H VAL A 453 1.004 -7.179 5.229 1.00 3.43 H new ATOM 0 HA VAL A 453 -0.410 -8.332 2.914 1.00 5.34 H new ATOM 0 HB VAL A 453 -2.193 -6.510 3.553 1.00 23.11 H new ATOM 0 HG11 VAL A 453 -3.422 -8.161 4.901 1.00 15.42 H new ATOM 0 HG12 VAL A 453 -2.631 -8.913 3.495 1.00 15.42 H new ATOM 0 HG13 VAL A 453 -1.923 -9.095 5.118 1.00 15.42 H new ATOM 0 HG21 VAL A 453 -2.421 -6.173 5.980 1.00 74.53 H new ATOM 0 HG22 VAL A 453 -0.881 -7.026 6.240 1.00 74.53 H new ATOM 0 HG23 VAL A 453 -0.905 -5.481 5.357 1.00 74.53 H new ATOM 610 N ALA A 454 0.796 -5.327 3.563 1.00 52.42 N ATOM 611 CA ALA A 454 1.327 -4.116 2.950 1.00 52.51 C ATOM 612 C ALA A 454 2.387 -4.447 1.906 1.00 74.23 C ATOM 613 O ALA A 454 2.708 -3.622 1.050 1.00 3.24 O ATOM 614 CB ALA A 454 1.903 -3.195 4.015 1.00 0.34 C ATOM 0 H ALA A 454 0.899 -5.367 4.577 1.00 52.42 H new ATOM 0 HA ALA A 454 0.507 -3.604 2.446 1.00 52.51 H new ATOM 0 HB1 ALA A 454 2.296 -2.294 3.543 1.00 0.34 H new ATOM 0 HB2 ALA A 454 1.120 -2.922 4.722 1.00 0.34 H new ATOM 0 HB3 ALA A 454 2.706 -3.708 4.544 1.00 0.34 H new ATOM 620 N ARG A 455 2.925 -5.660 1.980 1.00 12.33 N ATOM 621 CA ARG A 455 3.950 -6.100 1.041 1.00 2.33 C ATOM 622 C ARG A 455 3.320 -6.619 -0.248 1.00 54.54 C ATOM 623 O ARG A 455 3.709 -6.219 -1.345 1.00 12.41 O ATOM 624 CB ARG A 455 4.816 -7.192 1.673 1.00 72.01 C ATOM 625 CG ARG A 455 6.229 -7.247 1.117 1.00 30.01 C ATOM 626 CD ARG A 455 6.617 -8.663 0.719 1.00 55.40 C ATOM 627 NE ARG A 455 7.500 -8.681 -0.444 1.00 24.45 N ATOM 628 CZ ARG A 455 7.100 -8.389 -1.676 1.00 33.41 C ATOM 629 NH1 ARG A 455 5.837 -8.056 -1.905 1.00 21.03 N ATOM 630 NH2 ARG A 455 7.963 -8.429 -2.683 1.00 21.44 N ATOM 0 H ARG A 455 2.668 -6.356 2.680 1.00 12.33 H new ATOM 0 HA ARG A 455 4.577 -5.242 0.799 1.00 2.33 H new ATOM 0 HB2 ARG A 455 4.864 -7.028 2.749 1.00 72.01 H new ATOM 0 HB3 ARG A 455 4.336 -8.159 1.519 1.00 72.01 H new ATOM 0 HG2 ARG A 455 6.306 -6.590 0.250 1.00 30.01 H new ATOM 0 HG3 ARG A 455 6.930 -6.873 1.863 1.00 30.01 H new ATOM 0 HD2 ARG A 455 7.112 -9.153 1.558 1.00 55.40 H new ATOM 0 HD3 ARG A 455 5.717 -9.238 0.500 1.00 55.40 H new ATOM 0 HE ARG A 455 8.478 -8.932 -0.302 1.00 24.45 H new ATOM 0 HH11 ARG A 455 5.170 -8.024 -1.134 1.00 21.03 H new ATOM 0 HH12 ARG A 455 5.532 -7.832 -2.852 1.00 21.03 H new ATOM 0 HH21 ARG A 455 8.935 -8.684 -2.511 1.00 21.44 H new ATOM 0 HH22 ARG A 455 7.654 -8.204 -3.629 1.00 21.44 H new ATOM 644 N ARG A 456 2.345 -7.510 -0.107 1.00 71.31 N ATOM 645 CA ARG A 456 1.662 -8.084 -1.260 1.00 71.42 C ATOM 646 C ARG A 456 0.556 -7.157 -1.755 1.00 14.31 C ATOM 647 O ARG A 456 0.539 -6.758 -2.919 1.00 63.54 O ATOM 648 CB ARG A 456 1.075 -9.451 -0.903 1.00 53.22 C ATOM 649 CG ARG A 456 0.875 -10.360 -2.104 1.00 61.52 C ATOM 650 CD ARG A 456 -0.541 -10.263 -2.649 1.00 13.42 C ATOM 651 NE ARG A 456 -1.512 -10.909 -1.770 1.00 14.40 N ATOM 652 CZ ARG A 456 -2.742 -11.237 -2.148 1.00 53.42 C ATOM 653 NH1 ARG A 456 -3.150 -10.980 -3.383 1.00 14.22 N ATOM 654 NH2 ARG A 456 -3.568 -11.823 -1.290 1.00 51.45 N ATOM 0 H ARG A 456 2.010 -7.850 0.794 1.00 71.31 H new ATOM 0 HA ARG A 456 2.393 -8.207 -2.059 1.00 71.42 H new ATOM 0 HB2 ARG A 456 1.735 -9.945 -0.190 1.00 53.22 H new ATOM 0 HB3 ARG A 456 0.117 -9.306 -0.404 1.00 53.22 H new ATOM 0 HG2 ARG A 456 1.586 -10.092 -2.886 1.00 61.52 H new ATOM 0 HG3 ARG A 456 1.087 -11.391 -1.820 1.00 61.52 H new ATOM 0 HD2 ARG A 456 -0.809 -9.214 -2.776 1.00 13.42 H new ATOM 0 HD3 ARG A 456 -0.582 -10.725 -3.636 1.00 13.42 H new ATOM 0 HE ARG A 456 -1.230 -11.120 -0.813 1.00 14.40 H new ATOM 0 HH11 ARG A 456 -2.519 -10.529 -4.045 1.00 14.22 H new ATOM 0 HH12 ARG A 456 -4.095 -11.233 -3.671 1.00 14.22 H new ATOM 0 HH21 ARG A 456 -3.258 -12.022 -0.339 1.00 51.45 H new ATOM 0 HH22 ARG A 456 -4.512 -12.074 -1.582 1.00 51.45 H new ATOM 668 N THR A 457 -0.368 -6.816 -0.861 1.00 24.31 N ATOM 669 CA THR A 457 -1.478 -5.938 -1.206 1.00 53.50 C ATOM 670 C THR A 457 -1.001 -4.747 -2.029 1.00 42.20 C ATOM 671 O THR A 457 -1.471 -4.523 -3.145 1.00 43.45 O ATOM 672 CB THR A 457 -2.199 -5.421 0.053 1.00 3.32 C ATOM 673 OG1 THR A 457 -2.741 -6.521 0.793 1.00 2.44 O ATOM 674 CG2 THR A 457 -3.313 -4.455 -0.318 1.00 41.41 C ATOM 0 H THR A 457 -0.369 -7.135 0.108 1.00 24.31 H new ATOM 0 HA THR A 457 -2.176 -6.530 -1.798 1.00 53.50 H new ATOM 0 HB THR A 457 -1.472 -4.891 0.669 1.00 3.32 H new ATOM 0 HG1 THR A 457 -2.053 -6.886 1.388 1.00 2.44 H new ATOM 0 HG21 THR A 457 -3.807 -4.104 0.588 1.00 41.41 H new ATOM 0 HG22 THR A 457 -2.893 -3.605 -0.855 1.00 41.41 H new ATOM 0 HG23 THR A 457 -4.039 -4.963 -0.953 1.00 41.41 H new ATOM 682 N VAL A 458 -0.064 -3.986 -1.472 1.00 53.25 N ATOM 683 CA VAL A 458 0.478 -2.818 -2.157 1.00 53.12 C ATOM 684 C VAL A 458 1.003 -3.185 -3.540 1.00 51.11 C ATOM 685 O VAL A 458 0.839 -2.431 -4.499 1.00 15.51 O ATOM 686 CB VAL A 458 1.614 -2.168 -1.344 1.00 64.33 C ATOM 687 CG1 VAL A 458 2.339 -1.125 -2.180 1.00 62.13 C ATOM 688 CG2 VAL A 458 1.069 -1.554 -0.064 1.00 31.43 C ATOM 0 H VAL A 458 0.335 -4.157 -0.549 1.00 53.25 H new ATOM 0 HA VAL A 458 -0.340 -2.105 -2.261 1.00 53.12 H new ATOM 0 HB VAL A 458 2.331 -2.942 -1.071 1.00 64.33 H new ATOM 0 HG11 VAL A 458 3.138 -0.677 -1.589 1.00 62.13 H new ATOM 0 HG12 VAL A 458 2.764 -1.599 -3.065 1.00 62.13 H new ATOM 0 HG13 VAL A 458 1.635 -0.351 -2.486 1.00 62.13 H new ATOM 0 HG21 VAL A 458 1.885 -1.099 0.498 1.00 31.43 H new ATOM 0 HG22 VAL A 458 0.330 -0.792 -0.312 1.00 31.43 H new ATOM 0 HG23 VAL A 458 0.600 -2.330 0.541 1.00 31.43 H new ATOM 698 N ALA A 459 1.635 -4.351 -3.637 1.00 14.41 N ATOM 699 CA ALA A 459 2.182 -4.820 -4.903 1.00 3.32 C ATOM 700 C ALA A 459 1.072 -5.269 -5.847 1.00 44.33 C ATOM 701 O ALA A 459 1.276 -5.370 -7.057 1.00 74.24 O ATOM 702 CB ALA A 459 3.166 -5.956 -4.665 1.00 3.52 C ATOM 0 H ALA A 459 1.780 -4.987 -2.853 1.00 14.41 H new ATOM 0 HA ALA A 459 2.710 -3.990 -5.372 1.00 3.32 H new ATOM 0 HB1 ALA A 459 3.567 -6.296 -5.620 1.00 3.52 H new ATOM 0 HB2 ALA A 459 3.982 -5.604 -4.034 1.00 3.52 H new ATOM 0 HB3 ALA A 459 2.655 -6.782 -4.171 1.00 3.52 H new ATOM 708 N LYS A 460 -0.102 -5.538 -5.287 1.00 62.42 N ATOM 709 CA LYS A 460 -1.245 -5.977 -6.079 1.00 34.23 C ATOM 710 C LYS A 460 -1.917 -4.793 -6.767 1.00 42.52 C ATOM 711 O LYS A 460 -2.476 -4.929 -7.855 1.00 44.01 O ATOM 712 CB LYS A 460 -2.257 -6.705 -5.191 1.00 71.12 C ATOM 713 CG LYS A 460 -2.283 -8.209 -5.406 1.00 61.02 C ATOM 714 CD LYS A 460 -2.916 -8.571 -6.739 1.00 10.05 C ATOM 715 CE LYS A 460 -1.918 -9.250 -7.665 1.00 14.01 C ATOM 716 NZ LYS A 460 -1.418 -10.533 -7.096 1.00 52.15 N ATOM 0 H LYS A 460 -0.287 -5.460 -4.287 1.00 62.42 H new ATOM 0 HA LYS A 460 -0.883 -6.663 -6.845 1.00 34.23 H new ATOM 0 HB2 LYS A 460 -2.025 -6.500 -4.146 1.00 71.12 H new ATOM 0 HB3 LYS A 460 -3.252 -6.302 -5.382 1.00 71.12 H new ATOM 0 HG2 LYS A 460 -1.267 -8.601 -5.367 1.00 61.02 H new ATOM 0 HG3 LYS A 460 -2.839 -8.683 -4.597 1.00 61.02 H new ATOM 0 HD2 LYS A 460 -3.766 -9.232 -6.571 1.00 10.05 H new ATOM 0 HD3 LYS A 460 -3.302 -7.670 -7.216 1.00 10.05 H new ATOM 0 HE2 LYS A 460 -2.388 -9.439 -8.630 1.00 14.01 H new ATOM 0 HE3 LYS A 460 -1.077 -8.581 -7.846 1.00 14.01 H new ATOM 0 HZ1 LYS A 460 -1.119 -11.162 -7.868 1.00 52.15 H new ATOM 0 HZ2 LYS A 460 -0.609 -10.343 -6.471 1.00 52.15 H new ATOM 0 HZ3 LYS A 460 -2.177 -10.990 -6.551 1.00 52.15 H new ATOM 730 N TYR A 461 -1.857 -3.631 -6.126 1.00 52.30 N ATOM 731 CA TYR A 461 -2.461 -2.422 -6.676 1.00 5.24 C ATOM 732 C TYR A 461 -1.541 -1.776 -7.707 1.00 51.14 C ATOM 733 O TYR A 461 -2.004 -1.160 -8.668 1.00 13.14 O ATOM 734 CB TYR A 461 -2.770 -1.426 -5.557 1.00 33.54 C ATOM 735 CG TYR A 461 -4.124 -1.636 -4.918 1.00 53.03 C ATOM 736 CD1 TYR A 461 -5.271 -1.086 -5.479 1.00 12.21 C ATOM 737 CD2 TYR A 461 -4.258 -2.382 -3.753 1.00 44.23 C ATOM 738 CE1 TYR A 461 -6.511 -1.273 -4.898 1.00 42.01 C ATOM 739 CE2 TYR A 461 -5.493 -2.576 -3.167 1.00 53.21 C ATOM 740 CZ TYR A 461 -6.617 -2.019 -3.743 1.00 11.33 C ATOM 741 OH TYR A 461 -7.849 -2.209 -3.161 1.00 15.44 O ATOM 0 H TYR A 461 -1.397 -3.500 -5.225 1.00 52.30 H new ATOM 0 HA TYR A 461 -3.391 -2.703 -7.170 1.00 5.24 H new ATOM 0 HB2 TYR A 461 -1.999 -1.503 -4.790 1.00 33.54 H new ATOM 0 HB3 TYR A 461 -2.720 -0.414 -5.958 1.00 33.54 H new ATOM 0 HD1 TYR A 461 -5.192 -0.503 -6.384 1.00 12.21 H new ATOM 0 HD2 TYR A 461 -3.381 -2.818 -3.298 1.00 44.23 H new ATOM 0 HE1 TYR A 461 -7.392 -0.837 -5.346 1.00 42.01 H new ATOM 0 HE2 TYR A 461 -5.579 -3.160 -2.263 1.00 53.21 H new ATOM 0 HH TYR A 461 -7.749 -2.758 -2.355 1.00 15.44 H new ATOM 751 N ARG A 462 -0.237 -1.922 -7.502 1.00 45.31 N ATOM 752 CA ARG A 462 0.749 -1.352 -8.412 1.00 73.33 C ATOM 753 C ARG A 462 0.570 -1.907 -9.823 1.00 42.34 C ATOM 754 O ARG A 462 1.018 -1.304 -10.798 1.00 41.13 O ATOM 755 CB ARG A 462 2.165 -1.644 -7.914 1.00 31.03 C ATOM 756 CG ARG A 462 2.621 -3.070 -8.176 1.00 2.11 C ATOM 757 CD ARG A 462 3.690 -3.123 -9.258 1.00 14.33 C ATOM 758 NE ARG A 462 4.608 -4.243 -9.065 1.00 12.42 N ATOM 759 CZ ARG A 462 5.611 -4.228 -8.194 1.00 61.34 C ATOM 760 NH1 ARG A 462 5.824 -3.160 -7.440 1.00 53.53 N ATOM 761 NH2 ARG A 462 6.404 -5.286 -8.077 1.00 42.02 N ATOM 0 H ARG A 462 0.162 -2.431 -6.713 1.00 45.31 H new ATOM 0 HA ARG A 462 0.598 -0.273 -8.441 1.00 73.33 H new ATOM 0 HB2 ARG A 462 2.859 -0.955 -8.395 1.00 31.03 H new ATOM 0 HB3 ARG A 462 2.212 -1.448 -6.843 1.00 31.03 H new ATOM 0 HG2 ARG A 462 3.012 -3.503 -7.255 1.00 2.11 H new ATOM 0 HG3 ARG A 462 1.767 -3.677 -8.477 1.00 2.11 H new ATOM 0 HD2 ARG A 462 3.214 -3.209 -10.235 1.00 14.33 H new ATOM 0 HD3 ARG A 462 4.252 -2.189 -9.258 1.00 14.33 H new ATOM 0 HE ARG A 462 4.471 -5.082 -9.629 1.00 12.42 H new ATOM 0 HH11 ARG A 462 5.217 -2.345 -7.527 1.00 53.53 H new ATOM 0 HH12 ARG A 462 6.595 -3.153 -6.772 1.00 53.53 H new ATOM 0 HH21 ARG A 462 6.243 -6.110 -8.656 1.00 42.02 H new ATOM 0 HH22 ARG A 462 7.174 -5.275 -7.408 1.00 42.02 H new ATOM 775 N GLU A 463 -0.085 -3.059 -9.921 1.00 42.34 N ATOM 776 CA GLU A 463 -0.321 -3.694 -11.213 1.00 22.42 C ATOM 777 C GLU A 463 -1.490 -3.036 -11.938 1.00 72.52 C ATOM 778 O GLU A 463 -1.524 -2.986 -13.167 1.00 64.13 O ATOM 779 CB GLU A 463 -0.597 -5.188 -11.028 1.00 12.24 C ATOM 780 CG GLU A 463 0.462 -5.906 -10.208 1.00 41.40 C ATOM 781 CD GLU A 463 0.222 -7.401 -10.125 1.00 43.23 C ATOM 782 OE1 GLU A 463 -0.893 -7.843 -10.470 1.00 70.42 O ATOM 783 OE2 GLU A 463 1.151 -8.129 -9.715 1.00 42.52 O ATOM 0 H GLU A 463 -0.461 -3.571 -9.123 1.00 42.34 H new ATOM 0 HA GLU A 463 0.576 -3.569 -11.820 1.00 22.42 H new ATOM 0 HB2 GLU A 463 -1.566 -5.313 -10.544 1.00 12.24 H new ATOM 0 HB3 GLU A 463 -0.667 -5.660 -12.008 1.00 12.24 H new ATOM 0 HG2 GLU A 463 1.442 -5.723 -10.648 1.00 41.40 H new ATOM 0 HG3 GLU A 463 0.481 -5.489 -9.201 1.00 41.40 H new ATOM 790 N SER A 464 -2.449 -2.532 -11.167 1.00 22.51 N ATOM 791 CA SER A 464 -3.624 -1.880 -11.735 1.00 63.30 C ATOM 792 C SER A 464 -3.289 -0.467 -12.201 1.00 3.34 C ATOM 793 O SER A 464 -3.418 -0.143 -13.382 1.00 45.22 O ATOM 794 CB SER A 464 -4.756 -1.837 -10.708 1.00 2.30 C ATOM 795 OG SER A 464 -5.960 -2.348 -11.252 1.00 62.23 O ATOM 0 H SER A 464 -2.435 -2.563 -10.148 1.00 22.51 H new ATOM 0 HA SER A 464 -3.949 -2.460 -12.598 1.00 63.30 H new ATOM 0 HB2 SER A 464 -4.476 -2.418 -9.829 1.00 2.30 H new ATOM 0 HB3 SER A 464 -4.911 -0.810 -10.376 1.00 2.30 H new ATOM 0 HG SER A 464 -6.667 -2.311 -10.574 1.00 62.23 H new ATOM 801 N LEU A 465 -2.856 0.371 -11.264 1.00 75.44 N ATOM 802 CA LEU A 465 -2.502 1.751 -11.576 1.00 44.15 C ATOM 803 C LEU A 465 -1.431 1.805 -12.661 1.00 42.34 C ATOM 804 O LEU A 465 -1.543 2.570 -13.620 1.00 51.44 O ATOM 805 CB LEU A 465 -2.008 2.468 -10.319 1.00 71.55 C ATOM 806 CG LEU A 465 -2.838 2.253 -9.054 1.00 25.34 C ATOM 807 CD1 LEU A 465 -1.982 1.648 -7.951 1.00 73.00 C ATOM 808 CD2 LEU A 465 -3.458 3.563 -8.593 1.00 3.00 C ATOM 0 H LEU A 465 -2.742 0.118 -10.282 1.00 75.44 H new ATOM 0 HA LEU A 465 -3.395 2.255 -11.946 1.00 44.15 H new ATOM 0 HB2 LEU A 465 -0.986 2.145 -10.118 1.00 71.55 H new ATOM 0 HB3 LEU A 465 -1.969 3.537 -10.527 1.00 71.55 H new ATOM 0 HG LEU A 465 -3.643 1.556 -9.285 1.00 25.34 H new ATOM 0 HD11 LEU A 465 -2.589 1.502 -7.058 1.00 73.00 H new ATOM 0 HD12 LEU A 465 -1.587 0.688 -8.282 1.00 73.00 H new ATOM 0 HD13 LEU A 465 -1.155 2.321 -7.722 1.00 73.00 H new ATOM 0 HD21 LEU A 465 -4.045 3.390 -7.691 1.00 3.00 H new ATOM 0 HD22 LEU A 465 -2.669 4.284 -8.379 1.00 3.00 H new ATOM 0 HD23 LEU A 465 -4.105 3.955 -9.378 1.00 3.00 H new ATOM 820 N SER A 466 -0.395 0.987 -12.505 1.00 52.35 N ATOM 821 CA SER A 466 0.697 0.944 -13.470 1.00 71.03 C ATOM 822 C SER A 466 1.333 2.321 -13.633 1.00 5.13 C ATOM 823 O SER A 466 1.065 3.030 -14.603 1.00 11.40 O ATOM 824 CB SER A 466 0.190 0.441 -14.823 1.00 2.01 C ATOM 825 OG SER A 466 0.188 -0.975 -14.872 1.00 42.21 O ATOM 0 H SER A 466 -0.289 0.345 -11.719 1.00 52.35 H new ATOM 0 HA SER A 466 1.454 0.256 -13.094 1.00 71.03 H new ATOM 0 HB2 SER A 466 -0.818 0.816 -14.999 1.00 2.01 H new ATOM 0 HB3 SER A 466 0.820 0.835 -15.620 1.00 2.01 H new ATOM 0 HG SER A 466 -0.464 -1.324 -14.229 1.00 42.21 H new ATOM 831 N ILE A 467 2.178 2.692 -12.676 1.00 0.22 N ATOM 832 CA ILE A 467 2.853 3.984 -12.713 1.00 63.45 C ATOM 833 C ILE A 467 3.843 4.052 -13.871 1.00 50.30 C ATOM 834 O ILE A 467 4.491 3.068 -14.226 1.00 45.10 O ATOM 835 CB ILE A 467 3.601 4.266 -11.396 1.00 53.24 C ATOM 836 CG1 ILE A 467 2.811 5.258 -10.540 1.00 2.52 C ATOM 837 CG2 ILE A 467 4.997 4.798 -11.683 1.00 20.33 C ATOM 838 CD1 ILE A 467 2.589 4.788 -9.120 1.00 31.33 C ATOM 0 H ILE A 467 2.411 2.117 -11.867 1.00 0.22 H new ATOM 0 HA ILE A 467 2.081 4.741 -12.852 1.00 63.45 H new ATOM 0 HB ILE A 467 3.697 3.332 -10.842 1.00 53.24 H new ATOM 0 HG12 ILE A 467 3.341 6.210 -10.520 1.00 2.52 H new ATOM 0 HG13 ILE A 467 1.844 5.441 -11.009 1.00 2.52 H new ATOM 0 HG21 ILE A 467 5.513 4.992 -10.743 1.00 20.33 H new ATOM 0 HG22 ILE A 467 5.557 4.060 -12.258 1.00 20.33 H new ATOM 0 HG23 ILE A 467 4.923 5.723 -12.254 1.00 20.33 H new ATOM 0 HD11 ILE A 467 2.023 5.541 -8.572 1.00 31.33 H new ATOM 0 HD12 ILE A 467 2.032 3.851 -9.130 1.00 31.33 H new ATOM 0 HD13 ILE A 467 3.552 4.633 -8.633 1.00 31.33 H new ATOM 850 N PRO A 468 3.966 5.245 -14.475 1.00 31.13 N ATOM 851 CA PRO A 468 4.877 5.471 -15.600 1.00 53.52 C ATOM 852 C PRO A 468 6.341 5.425 -15.179 1.00 22.12 C ATOM 853 O PRO A 468 6.672 5.444 -13.993 1.00 63.05 O ATOM 854 CB PRO A 468 4.503 6.876 -16.081 1.00 2.24 C ATOM 855 CG PRO A 468 3.920 7.544 -14.883 1.00 31.44 C ATOM 856 CD PRO A 468 3.224 6.461 -14.104 1.00 13.10 C ATOM 0 HA PRO A 468 4.778 4.702 -16.366 1.00 53.52 H new ATOM 0 HB2 PRO A 468 5.377 7.414 -16.448 1.00 2.24 H new ATOM 0 HB3 PRO A 468 3.785 6.836 -16.900 1.00 2.24 H new ATOM 0 HG2 PRO A 468 4.697 8.018 -14.284 1.00 31.44 H new ATOM 0 HG3 PRO A 468 3.220 8.327 -15.174 1.00 31.44 H new ATOM 0 HD2 PRO A 468 3.267 6.647 -13.031 1.00 13.10 H new ATOM 0 HD3 PRO A 468 2.170 6.387 -14.372 1.00 13.10 H new ATOM 864 N PRO A 469 7.242 5.363 -16.171 1.00 50.15 N ATOM 865 CA PRO A 469 8.686 5.314 -15.927 1.00 61.25 C ATOM 866 C PRO A 469 9.229 6.632 -15.386 1.00 31.41 C ATOM 867 O PRO A 469 8.521 7.639 -15.353 1.00 65.40 O ATOM 868 CB PRO A 469 9.270 5.024 -17.312 1.00 50.14 C ATOM 869 CG PRO A 469 8.253 5.546 -18.268 1.00 63.24 C ATOM 870 CD PRO A 469 6.919 5.338 -17.608 1.00 32.43 C ATOM 0 HA PRO A 469 8.946 4.570 -15.174 1.00 61.25 H new ATOM 0 HB2 PRO A 469 10.232 5.519 -17.448 1.00 50.14 H new ATOM 0 HB3 PRO A 469 9.437 3.957 -17.456 1.00 50.14 H new ATOM 0 HG2 PRO A 469 8.423 6.602 -18.481 1.00 63.24 H new ATOM 0 HG3 PRO A 469 8.304 5.017 -19.220 1.00 63.24 H new ATOM 0 HD2 PRO A 469 6.212 6.123 -17.875 1.00 32.43 H new ATOM 0 HD3 PRO A 469 6.468 4.390 -17.902 1.00 32.43 H new ATOM 878 N SER A 470 10.489 6.619 -14.962 1.00 35.13 N ATOM 879 CA SER A 470 11.124 7.813 -14.418 1.00 0.23 C ATOM 880 C SER A 470 10.440 8.253 -13.127 1.00 64.04 C ATOM 881 O SER A 470 10.638 9.372 -12.658 1.00 12.44 O ATOM 882 CB SER A 470 11.085 8.949 -15.442 1.00 73.42 C ATOM 883 OG SER A 470 12.380 9.478 -15.666 1.00 41.52 O ATOM 0 H SER A 470 11.090 5.795 -14.985 1.00 35.13 H new ATOM 0 HA SER A 470 12.163 7.571 -14.194 1.00 0.23 H new ATOM 0 HB2 SER A 470 10.671 8.582 -16.381 1.00 73.42 H new ATOM 0 HB3 SER A 470 10.422 9.739 -15.089 1.00 73.42 H new ATOM 0 HG SER A 470 12.328 10.201 -16.325 1.00 41.52 H new ATOM 889 N ASN A 471 9.633 7.363 -12.559 1.00 61.12 N ATOM 890 CA ASN A 471 8.919 7.658 -11.323 1.00 0.20 C ATOM 891 C ASN A 471 8.546 6.373 -10.590 1.00 33.42 C ATOM 892 O ASN A 471 7.613 6.353 -9.787 1.00 52.12 O ATOM 893 CB ASN A 471 7.658 8.472 -11.620 1.00 5.34 C ATOM 894 CG ASN A 471 7.966 9.930 -11.906 1.00 72.10 C ATOM 895 OD1 ASN A 471 7.637 10.447 -12.974 1.00 24.42 O ATOM 896 ND2 ASN A 471 8.599 10.599 -10.950 1.00 53.51 N ATOM 0 H ASN A 471 9.457 6.431 -12.935 1.00 61.12 H new ATOM 0 HA ASN A 471 9.579 8.243 -10.682 1.00 0.20 H new ATOM 0 HB2 ASN A 471 7.141 8.038 -12.476 1.00 5.34 H new ATOM 0 HB3 ASN A 471 6.978 8.407 -10.771 1.00 5.34 H new ATOM 0 HD21 ASN A 471 8.832 11.583 -11.085 1.00 53.51 H new ATOM 0 HD22 ASN A 471 8.852 10.129 -10.081 1.00 53.51 H new ATOM 903 N GLN A 472 9.282 5.303 -10.871 1.00 73.20 N ATOM 904 CA GLN A 472 9.029 4.014 -10.238 1.00 71.44 C ATOM 905 C GLN A 472 10.046 3.739 -9.135 1.00 53.14 C ATOM 906 O GLN A 472 9.790 2.953 -8.224 1.00 2.42 O ATOM 907 CB GLN A 472 9.071 2.893 -11.279 1.00 43.52 C ATOM 908 CG GLN A 472 10.305 2.936 -12.167 1.00 75.32 C ATOM 909 CD GLN A 472 10.721 1.561 -12.653 1.00 0.30 C ATOM 910 OE1 GLN A 472 10.298 0.543 -12.107 1.00 22.33 O ATOM 911 NE2 GLN A 472 11.556 1.526 -13.685 1.00 72.12 N ATOM 0 H GLN A 472 10.058 5.303 -11.533 1.00 73.20 H new ATOM 0 HA GLN A 472 8.036 4.047 -9.790 1.00 71.44 H new ATOM 0 HB2 GLN A 472 9.035 1.931 -10.767 1.00 43.52 H new ATOM 0 HB3 GLN A 472 8.181 2.955 -11.905 1.00 43.52 H new ATOM 0 HG2 GLN A 472 10.108 3.577 -13.026 1.00 75.32 H new ATOM 0 HG3 GLN A 472 11.130 3.387 -11.615 1.00 75.32 H new ATOM 0 HE21 GLN A 472 11.882 2.396 -14.107 1.00 72.12 H new ATOM 0 HE22 GLN A 472 11.872 0.630 -14.055 1.00 72.12 H new ATOM 920 N ARG A 473 11.200 4.391 -9.227 1.00 1.03 N ATOM 921 CA ARG A 473 12.258 4.216 -8.238 1.00 32.21 C ATOM 922 C ARG A 473 12.689 2.754 -8.157 1.00 41.51 C ATOM 923 O ARG A 473 13.040 2.257 -7.086 1.00 55.34 O ATOM 924 CB ARG A 473 11.785 4.696 -6.865 1.00 33.34 C ATOM 925 CG ARG A 473 11.514 6.190 -6.801 1.00 51.44 C ATOM 926 CD ARG A 473 10.290 6.500 -5.954 1.00 65.52 C ATOM 927 NE ARG A 473 10.303 5.773 -4.687 1.00 71.32 N ATOM 928 CZ ARG A 473 9.217 5.551 -3.956 1.00 73.22 C ATOM 929 NH1 ARG A 473 8.037 5.997 -4.364 1.00 54.40 N ATOM 930 NH2 ARG A 473 9.309 4.882 -2.815 1.00 31.35 N ATOM 0 H ARG A 473 11.427 5.045 -9.976 1.00 1.03 H new ATOM 0 HA ARG A 473 13.115 4.813 -8.549 1.00 32.21 H new ATOM 0 HB2 ARG A 473 10.876 4.159 -6.595 1.00 33.34 H new ATOM 0 HB3 ARG A 473 12.539 4.440 -6.121 1.00 33.34 H new ATOM 0 HG2 ARG A 473 12.383 6.701 -6.386 1.00 51.44 H new ATOM 0 HG3 ARG A 473 11.367 6.577 -7.809 1.00 51.44 H new ATOM 0 HD2 ARG A 473 10.247 7.571 -5.757 1.00 65.52 H new ATOM 0 HD3 ARG A 473 9.389 6.242 -6.511 1.00 65.52 H new ATOM 0 HE ARG A 473 11.195 5.416 -4.345 1.00 71.32 H new ATOM 0 HH11 ARG A 473 7.962 6.512 -5.241 1.00 54.40 H new ATOM 0 HH12 ARG A 473 7.204 5.825 -3.801 1.00 54.40 H new ATOM 0 HH21 ARG A 473 10.215 4.537 -2.498 1.00 31.35 H new ATOM 0 HH22 ARG A 473 8.474 4.712 -2.255 1.00 31.35 H new ATOM 944 N LYS A 474 12.662 2.071 -9.296 1.00 14.10 N ATOM 945 CA LYS A 474 13.051 0.667 -9.356 1.00 72.34 C ATOM 946 C LYS A 474 13.769 0.357 -10.666 1.00 10.21 C ATOM 947 O LYS A 474 13.235 -0.341 -11.526 1.00 60.44 O ATOM 948 CB LYS A 474 11.819 -0.231 -9.212 1.00 41.15 C ATOM 949 CG LYS A 474 12.146 -1.714 -9.210 1.00 21.11 C ATOM 950 CD LYS A 474 12.446 -2.216 -7.808 1.00 31.05 C ATOM 951 CE LYS A 474 12.582 -3.731 -7.775 1.00 11.22 C ATOM 952 NZ LYS A 474 13.788 -4.163 -7.017 1.00 25.04 N ATOM 0 H LYS A 474 12.375 2.467 -10.191 1.00 14.10 H new ATOM 0 HA LYS A 474 13.736 0.469 -8.531 1.00 72.34 H new ATOM 0 HB2 LYS A 474 11.303 0.020 -8.285 1.00 41.15 H new ATOM 0 HB3 LYS A 474 11.129 -0.021 -10.029 1.00 41.15 H new ATOM 0 HG2 LYS A 474 11.308 -2.273 -9.626 1.00 21.11 H new ATOM 0 HG3 LYS A 474 13.005 -1.899 -9.855 1.00 21.11 H new ATOM 0 HD2 LYS A 474 13.367 -1.759 -7.446 1.00 31.05 H new ATOM 0 HD3 LYS A 474 11.649 -1.906 -7.131 1.00 31.05 H new ATOM 0 HE2 LYS A 474 11.692 -4.166 -7.320 1.00 11.22 H new ATOM 0 HE3 LYS A 474 12.638 -4.113 -8.794 1.00 11.22 H new ATOM 0 HZ1 LYS A 474 13.845 -5.201 -7.018 1.00 25.04 H new ATOM 0 HZ2 LYS A 474 14.640 -3.769 -7.466 1.00 25.04 H new ATOM 0 HZ3 LYS A 474 13.723 -3.821 -6.037 1.00 25.04 H new ATOM 966 N GLN A 475 14.983 0.879 -10.807 1.00 43.42 N ATOM 967 CA GLN A 475 15.775 0.657 -12.011 1.00 70.31 C ATOM 968 C GLN A 475 16.561 -0.647 -11.912 1.00 43.34 C ATOM 969 O GLN A 475 16.749 -1.347 -12.908 1.00 43.45 O ATOM 970 CB GLN A 475 16.731 1.827 -12.242 1.00 44.41 C ATOM 971 CG GLN A 475 17.967 1.787 -11.357 1.00 13.10 C ATOM 972 CD GLN A 475 19.073 0.927 -11.936 1.00 75.41 C ATOM 973 OE1 GLN A 475 19.617 0.056 -11.258 1.00 31.50 O ATOM 974 NE2 GLN A 475 19.411 1.169 -13.197 1.00 75.42 N ATOM 0 H GLN A 475 15.440 1.458 -10.103 1.00 43.42 H new ATOM 0 HA GLN A 475 15.091 0.585 -12.857 1.00 70.31 H new ATOM 0 HB2 GLN A 475 17.042 1.830 -13.287 1.00 44.41 H new ATOM 0 HB3 GLN A 475 16.198 2.761 -12.065 1.00 44.41 H new ATOM 0 HG2 GLN A 475 18.339 2.801 -11.213 1.00 13.10 H new ATOM 0 HG3 GLN A 475 17.693 1.405 -10.374 1.00 13.10 H new ATOM 0 HE21 GLN A 475 18.933 1.901 -13.722 1.00 75.42 H new ATOM 0 HE22 GLN A 475 20.149 0.622 -13.641 1.00 75.42 H new ATOM 983 N LEU A 476 17.018 -0.966 -10.707 1.00 61.10 N ATOM 984 CA LEU A 476 17.784 -2.186 -10.478 1.00 3.15 C ATOM 985 C LEU A 476 16.916 -3.422 -10.687 1.00 0.15 C ATOM 986 O LEU A 476 15.824 -3.527 -10.129 1.00 32.34 O ATOM 987 CB LEU A 476 18.365 -2.189 -9.062 1.00 53.45 C ATOM 988 CG LEU A 476 19.815 -2.657 -8.932 1.00 33.31 C ATOM 989 CD1 LEU A 476 20.564 -1.802 -7.923 1.00 13.52 C ATOM 990 CD2 LEU A 476 19.868 -4.125 -8.534 1.00 52.30 C ATOM 0 H LEU A 476 16.872 -0.397 -9.873 1.00 61.10 H new ATOM 0 HA LEU A 476 18.601 -2.213 -11.199 1.00 3.15 H new ATOM 0 HB2 LEU A 476 18.293 -1.179 -8.659 1.00 53.45 H new ATOM 0 HB3 LEU A 476 17.741 -2.827 -8.436 1.00 53.45 H new ATOM 0 HG LEU A 476 20.300 -2.546 -9.902 1.00 33.31 H new ATOM 0 HD11 LEU A 476 21.594 -2.150 -7.844 1.00 13.52 H new ATOM 0 HD12 LEU A 476 20.557 -0.762 -8.250 1.00 13.52 H new ATOM 0 HD13 LEU A 476 20.079 -1.879 -6.950 1.00 13.52 H new ATOM 0 HD21 LEU A 476 20.908 -4.441 -8.446 1.00 52.30 H new ATOM 0 HD22 LEU A 476 19.365 -4.261 -7.576 1.00 52.30 H new ATOM 0 HD23 LEU A 476 19.369 -4.726 -9.294 1.00 52.30 H new ATOM 1002 N VAL A 477 17.411 -4.358 -11.491 1.00 12.42 N ATOM 1003 CA VAL A 477 16.682 -5.589 -11.770 1.00 41.24 C ATOM 1004 C VAL A 477 17.477 -6.811 -11.325 1.00 73.20 C ATOM 1005 O VAL A 477 18.707 -6.807 -11.348 1.00 41.30 O ATOM 1006 CB VAL A 477 16.356 -5.721 -13.270 1.00 40.02 C ATOM 1007 CG1 VAL A 477 15.568 -4.513 -13.754 1.00 12.32 C ATOM 1008 CG2 VAL A 477 17.632 -5.893 -14.079 1.00 3.44 C ATOM 0 H VAL A 477 18.314 -4.287 -11.960 1.00 12.42 H new ATOM 0 HA VAL A 477 15.750 -5.540 -11.206 1.00 41.24 H new ATOM 0 HB VAL A 477 15.739 -6.608 -13.413 1.00 40.02 H new ATOM 0 HG11 VAL A 477 15.347 -4.624 -14.816 1.00 12.32 H new ATOM 0 HG12 VAL A 477 14.635 -4.439 -13.195 1.00 12.32 H new ATOM 0 HG13 VAL A 477 16.156 -3.609 -13.599 1.00 12.32 H new ATOM 0 HG21 VAL A 477 17.383 -5.985 -15.136 1.00 3.44 H new ATOM 0 HG22 VAL A 477 18.276 -5.026 -13.932 1.00 3.44 H new ATOM 0 HG23 VAL A 477 18.153 -6.792 -13.750 1.00 3.44 H new ATOM 1018 N ALA A 478 16.765 -7.858 -10.920 1.00 23.12 N ATOM 1019 CA ALA A 478 17.404 -9.089 -10.472 1.00 3.04 C ATOM 1020 C ALA A 478 16.368 -10.166 -10.169 1.00 12.25 C ATOM 1021 O ALA A 478 15.349 -9.899 -9.533 1.00 23.31 O ATOM 1022 CB ALA A 478 18.264 -8.821 -9.246 1.00 2.20 C ATOM 0 H ALA A 478 15.746 -7.878 -10.893 1.00 23.12 H new ATOM 0 HA ALA A 478 18.042 -9.452 -11.277 1.00 3.04 H new ATOM 0 HB1 ALA A 478 18.735 -9.749 -8.922 1.00 2.20 H new ATOM 0 HB2 ALA A 478 19.034 -8.090 -9.494 1.00 2.20 H new ATOM 0 HB3 ALA A 478 17.640 -8.431 -8.442 1.00 2.20 H new ATOM 1028 N ASN A 479 16.635 -11.384 -10.628 1.00 1.03 N ATOM 1029 CA ASN A 479 15.725 -12.502 -10.407 1.00 10.23 C ATOM 1030 C ASN A 479 16.321 -13.502 -9.421 1.00 10.23 C ATOM 1031 O ASN A 479 15.609 -14.079 -8.600 1.00 21.13 O ATOM 1032 CB ASN A 479 15.409 -13.199 -11.731 1.00 65.31 C ATOM 1033 CG ASN A 479 13.934 -13.140 -12.078 1.00 65.35 C ATOM 1034 OD1 ASN A 479 13.111 -13.807 -11.453 1.00 22.52 O ATOM 1035 ND2 ASN A 479 13.595 -12.339 -13.082 1.00 23.00 N ATOM 0 H ASN A 479 17.475 -11.622 -11.156 1.00 1.03 H new ATOM 0 HA ASN A 479 14.801 -12.108 -9.983 1.00 10.23 H new ATOM 0 HB2 ASN A 479 15.986 -12.734 -12.530 1.00 65.31 H new ATOM 0 HB3 ASN A 479 15.725 -14.241 -11.674 1.00 65.31 H new ATOM 0 HD21 ASN A 479 12.618 -12.259 -13.363 1.00 23.00 H new ATOM 0 HD22 ASN A 479 14.312 -11.804 -13.572 1.00 23.00 H new ATOM 1042 N SER A 480 17.633 -13.702 -9.509 1.00 11.42 N ATOM 1043 CA SER A 480 18.324 -14.634 -8.628 1.00 5.41 C ATOM 1044 C SER A 480 18.085 -14.278 -7.163 1.00 71.22 C ATOM 1045 O SER A 480 18.096 -15.148 -6.292 1.00 55.01 O ATOM 1046 CB SER A 480 19.826 -14.632 -8.925 1.00 53.44 C ATOM 1047 OG SER A 480 20.410 -15.885 -8.612 1.00 53.20 O ATOM 0 H SER A 480 18.237 -13.231 -10.182 1.00 11.42 H new ATOM 0 HA SER A 480 17.925 -15.631 -8.812 1.00 5.41 H new ATOM 0 HB2 SER A 480 19.991 -14.403 -9.978 1.00 53.44 H new ATOM 0 HB3 SER A 480 20.313 -13.846 -8.348 1.00 53.44 H new ATOM 0 HG SER A 480 21.369 -15.858 -8.812 1.00 53.20 H new ATOM 1053 N SER A 481 17.867 -12.994 -6.901 1.00 4.50 N ATOM 1054 CA SER A 481 17.628 -12.520 -5.543 1.00 64.13 C ATOM 1055 C SER A 481 16.413 -13.212 -4.933 1.00 51.43 C ATOM 1056 O SER A 481 16.325 -13.380 -3.717 1.00 51.44 O ATOM 1057 CB SER A 481 17.423 -11.004 -5.537 1.00 53.23 C ATOM 1058 OG SER A 481 17.032 -10.547 -4.253 1.00 43.25 O ATOM 0 H SER A 481 17.851 -12.262 -7.612 1.00 4.50 H new ATOM 0 HA SER A 481 18.503 -12.762 -4.940 1.00 64.13 H new ATOM 0 HB2 SER A 481 18.346 -10.508 -5.838 1.00 53.23 H new ATOM 0 HB3 SER A 481 16.663 -10.734 -6.270 1.00 53.23 H new ATOM 0 HG SER A 481 16.909 -9.575 -4.275 1.00 43.25 H new ATOM 1064 N SER A 482 15.476 -13.610 -5.787 1.00 64.35 N ATOM 1065 CA SER A 482 14.262 -14.281 -5.335 1.00 4.43 C ATOM 1066 C SER A 482 13.773 -15.281 -6.376 1.00 61.34 C ATOM 1067 O SER A 482 12.594 -15.296 -6.734 1.00 3.24 O ATOM 1068 CB SER A 482 13.167 -13.254 -5.041 1.00 40.11 C ATOM 1069 OG SER A 482 12.950 -12.407 -6.156 1.00 60.32 O ATOM 0 H SER A 482 15.534 -13.479 -6.797 1.00 64.35 H new ATOM 0 HA SER A 482 14.496 -14.824 -4.419 1.00 4.43 H new ATOM 0 HB2 SER A 482 12.241 -13.768 -4.785 1.00 40.11 H new ATOM 0 HB3 SER A 482 13.449 -12.655 -4.175 1.00 40.11 H new ATOM 0 HG SER A 482 12.245 -11.761 -5.944 1.00 60.32 H new ATOM 1075 N VAL A 483 14.686 -16.116 -6.861 1.00 22.31 N ATOM 1076 CA VAL A 483 14.348 -17.122 -7.862 1.00 50.41 C ATOM 1077 C VAL A 483 14.005 -18.455 -7.207 1.00 74.33 C ATOM 1078 O VAL A 483 14.682 -18.895 -6.278 1.00 55.41 O ATOM 1079 CB VAL A 483 15.504 -17.333 -8.858 1.00 3.14 C ATOM 1080 CG1 VAL A 483 16.720 -17.911 -8.149 1.00 32.10 C ATOM 1081 CG2 VAL A 483 15.064 -18.235 -10.001 1.00 1.24 C ATOM 0 H VAL A 483 15.666 -16.116 -6.577 1.00 22.31 H new ATOM 0 HA VAL A 483 13.477 -16.752 -8.402 1.00 50.41 H new ATOM 0 HB VAL A 483 15.782 -16.366 -9.276 1.00 3.14 H new ATOM 0 HG11 VAL A 483 17.527 -18.053 -8.868 1.00 32.10 H new ATOM 0 HG12 VAL A 483 17.047 -17.224 -7.368 1.00 32.10 H new ATOM 0 HG13 VAL A 483 16.459 -18.870 -7.702 1.00 32.10 H new ATOM 0 HG21 VAL A 483 15.893 -18.373 -10.695 1.00 1.24 H new ATOM 0 HG22 VAL A 483 14.758 -19.203 -9.604 1.00 1.24 H new ATOM 0 HG23 VAL A 483 14.225 -17.776 -10.524 1.00 1.24 H new ATOM 1091 N ASP A 484 12.949 -19.094 -7.700 1.00 22.34 N ATOM 1092 CA ASP A 484 12.516 -20.380 -7.164 1.00 10.00 C ATOM 1093 C ASP A 484 12.324 -20.301 -5.652 1.00 20.30 C ATOM 1094 O ASP A 484 12.986 -21.009 -4.893 1.00 72.11 O ATOM 1095 CB ASP A 484 13.535 -21.468 -7.504 1.00 41.34 C ATOM 1096 CG ASP A 484 13.569 -21.787 -8.986 1.00 51.24 C ATOM 1097 OD1 ASP A 484 14.222 -21.035 -9.740 1.00 53.12 O ATOM 1098 OD2 ASP A 484 12.943 -22.787 -9.392 1.00 34.54 O ATOM 0 H ASP A 484 12.378 -18.743 -8.469 1.00 22.34 H new ATOM 0 HA ASP A 484 11.560 -20.633 -7.622 1.00 10.00 H new ATOM 0 HB2 ASP A 484 14.526 -21.147 -7.182 1.00 41.34 H new ATOM 0 HB3 ASP A 484 13.296 -22.373 -6.946 1.00 41.34 H new ATOM 1103 N LYS A 485 11.413 -19.436 -5.221 1.00 14.20 N ATOM 1104 CA LYS A 485 11.131 -19.263 -3.801 1.00 2.03 C ATOM 1105 C LYS A 485 10.794 -20.600 -3.148 1.00 53.10 C ATOM 1106 O LYS A 485 9.989 -21.372 -3.671 1.00 14.44 O ATOM 1107 CB LYS A 485 9.975 -18.280 -3.604 1.00 43.14 C ATOM 1108 CG LYS A 485 10.399 -16.958 -2.988 1.00 33.35 C ATOM 1109 CD LYS A 485 11.029 -17.158 -1.619 1.00 63.52 C ATOM 1110 CE LYS A 485 10.449 -16.197 -0.592 1.00 64.30 C ATOM 1111 NZ LYS A 485 11.086 -16.362 0.743 1.00 25.04 N ATOM 0 H LYS A 485 10.856 -18.843 -5.836 1.00 14.20 H new ATOM 0 HA LYS A 485 12.025 -18.860 -3.325 1.00 2.03 H new ATOM 0 HB2 LYS A 485 9.504 -18.088 -4.568 1.00 43.14 H new ATOM 0 HB3 LYS A 485 9.220 -18.742 -2.968 1.00 43.14 H new ATOM 0 HG2 LYS A 485 11.109 -16.459 -3.647 1.00 33.35 H new ATOM 0 HG3 LYS A 485 9.533 -16.302 -2.899 1.00 33.35 H new ATOM 0 HD2 LYS A 485 10.868 -18.185 -1.290 1.00 63.52 H new ATOM 0 HD3 LYS A 485 12.107 -17.011 -1.688 1.00 63.52 H new ATOM 0 HE2 LYS A 485 10.586 -15.172 -0.936 1.00 64.30 H new ATOM 0 HE3 LYS A 485 9.375 -16.363 -0.505 1.00 64.30 H new ATOM 0 HZ1 LYS A 485 10.664 -15.690 1.415 1.00 25.04 H new ATOM 0 HZ2 LYS A 485 10.933 -17.333 1.083 1.00 25.04 H new ATOM 0 HZ3 LYS A 485 12.107 -16.179 0.666 1.00 25.04 H new ATOM 1125 N LEU A 486 11.410 -20.865 -2.001 1.00 41.15 N ATOM 1126 CA LEU A 486 11.173 -22.108 -1.275 1.00 43.24 C ATOM 1127 C LEU A 486 10.172 -21.896 -0.146 1.00 13.10 C ATOM 1128 O LEU A 486 10.132 -22.664 0.815 1.00 21.42 O ATOM 1129 CB LEU A 486 12.488 -22.650 -0.711 1.00 71.52 C ATOM 1130 CG LEU A 486 12.570 -24.168 -0.539 1.00 74.55 C ATOM 1131 CD1 LEU A 486 13.357 -24.793 -1.680 1.00 41.24 C ATOM 1132 CD2 LEU A 486 13.197 -24.520 0.801 1.00 0.32 C ATOM 0 H LEU A 486 12.077 -20.236 -1.554 1.00 41.15 H new ATOM 0 HA LEU A 486 10.757 -22.834 -1.973 1.00 43.24 H new ATOM 0 HB2 LEU A 486 13.299 -22.334 -1.367 1.00 71.52 H new ATOM 0 HB3 LEU A 486 12.663 -22.185 0.259 1.00 71.52 H new ATOM 0 HG LEU A 486 11.558 -24.572 -0.560 1.00 74.55 H new ATOM 0 HD11 LEU A 486 13.405 -25.873 -1.540 1.00 41.24 H new ATOM 0 HD12 LEU A 486 12.864 -24.571 -2.626 1.00 41.24 H new ATOM 0 HD13 LEU A 486 14.367 -24.384 -1.692 1.00 41.24 H new ATOM 0 HD21 LEU A 486 13.247 -25.604 0.906 1.00 0.32 H new ATOM 0 HD22 LEU A 486 14.203 -24.104 0.853 1.00 0.32 H new ATOM 0 HD23 LEU A 486 12.591 -24.105 1.606 1.00 0.32 H new ATOM 1144 N ALA A 487 9.362 -20.849 -0.269 1.00 33.45 N ATOM 1145 CA ALA A 487 8.356 -20.538 0.740 1.00 63.13 C ATOM 1146 C ALA A 487 7.239 -21.576 0.739 1.00 60.43 C ATOM 1147 O ALA A 487 6.522 -21.730 1.727 1.00 32.32 O ATOM 1148 CB ALA A 487 7.787 -19.147 0.507 1.00 13.11 C ATOM 0 H ALA A 487 9.383 -20.202 -1.057 1.00 33.45 H new ATOM 0 HA ALA A 487 8.838 -20.562 1.717 1.00 63.13 H new ATOM 0 HB1 ALA A 487 7.037 -18.928 1.268 1.00 13.11 H new ATOM 0 HB2 ALA A 487 8.589 -18.411 0.566 1.00 13.11 H new ATOM 0 HB3 ALA A 487 7.326 -19.103 -0.480 1.00 13.11 H new ATOM 1154 N ALA A 488 7.095 -22.284 -0.376 1.00 64.14 N ATOM 1155 CA ALA A 488 6.066 -23.308 -0.506 1.00 13.44 C ATOM 1156 C ALA A 488 6.387 -24.522 0.360 1.00 51.31 C ATOM 1157 O ALA A 488 5.491 -25.260 0.768 1.00 54.43 O ATOM 1158 CB ALA A 488 5.912 -23.722 -1.962 1.00 12.34 C ATOM 0 H ALA A 488 7.679 -22.167 -1.204 1.00 64.14 H new ATOM 0 HA ALA A 488 5.123 -22.885 -0.159 1.00 13.44 H new ATOM 0 HB1 ALA A 488 5.140 -24.487 -2.043 1.00 12.34 H new ATOM 0 HB2 ALA A 488 5.628 -22.855 -2.559 1.00 12.34 H new ATOM 0 HB3 ALA A 488 6.858 -24.121 -2.329 1.00 12.34 H new ATOM 1164 N ALA A 489 7.671 -24.722 0.637 1.00 1.30 N ATOM 1165 CA ALA A 489 8.110 -25.845 1.455 1.00 40.22 C ATOM 1166 C ALA A 489 7.496 -25.782 2.850 1.00 62.23 C ATOM 1167 O ALA A 489 7.007 -26.785 3.370 1.00 34.11 O ATOM 1168 CB ALA A 489 9.629 -25.871 1.546 1.00 43.12 C ATOM 0 H ALA A 489 8.426 -24.120 0.307 1.00 1.30 H new ATOM 0 HA ALA A 489 7.770 -26.764 0.978 1.00 40.22 H new ATOM 0 HB1 ALA A 489 9.942 -26.715 2.160 1.00 43.12 H new ATOM 0 HB2 ALA A 489 10.052 -25.973 0.546 1.00 43.12 H new ATOM 0 HB3 ALA A 489 9.982 -24.944 1.997 1.00 43.12 H new ATOM 1174 N LEU A 490 7.526 -24.597 3.451 1.00 63.33 N ATOM 1175 CA LEU A 490 6.973 -24.403 4.786 1.00 74.20 C ATOM 1176 C LEU A 490 5.457 -24.242 4.729 1.00 13.02 C ATOM 1177 O LEU A 490 4.752 -24.581 5.679 1.00 11.34 O ATOM 1178 CB LEU A 490 7.603 -23.175 5.447 1.00 33.21 C ATOM 1179 CG LEU A 490 8.206 -23.396 6.835 1.00 10.31 C ATOM 1180 CD1 LEU A 490 7.133 -23.829 7.820 1.00 33.53 C ATOM 1181 CD2 LEU A 490 9.324 -24.427 6.773 1.00 51.32 C ATOM 0 H LEU A 490 7.927 -23.757 3.035 1.00 63.33 H new ATOM 0 HA LEU A 490 7.204 -25.287 5.380 1.00 74.20 H new ATOM 0 HB2 LEU A 490 8.385 -22.794 4.790 1.00 33.21 H new ATOM 0 HB3 LEU A 490 6.843 -22.397 5.522 1.00 33.21 H new ATOM 0 HG LEU A 490 8.628 -22.453 7.181 1.00 10.31 H new ATOM 0 HD11 LEU A 490 7.581 -23.981 8.802 1.00 33.53 H new ATOM 0 HD12 LEU A 490 6.367 -23.056 7.886 1.00 33.53 H new ATOM 0 HD13 LEU A 490 6.680 -24.760 7.479 1.00 33.53 H new ATOM 0 HD21 LEU A 490 9.741 -24.571 7.770 1.00 51.32 H new ATOM 0 HD22 LEU A 490 8.927 -25.373 6.405 1.00 51.32 H new ATOM 0 HD23 LEU A 490 10.106 -24.076 6.100 1.00 51.32 H new ATOM 1193 N GLU A 491 4.964 -23.726 3.608 1.00 75.10 N ATOM 1194 CA GLU A 491 3.531 -23.522 3.428 1.00 35.11 C ATOM 1195 C GLU A 491 2.909 -24.683 2.659 1.00 72.32 C ATOM 1196 O GLU A 491 1.863 -24.534 2.025 1.00 52.43 O ATOM 1197 CB GLU A 491 3.268 -22.208 2.690 1.00 44.42 C ATOM 1198 CG GLU A 491 2.335 -21.268 3.433 1.00 53.43 C ATOM 1199 CD GLU A 491 2.894 -20.830 4.774 1.00 74.52 C ATOM 1200 OE1 GLU A 491 4.058 -21.169 5.072 1.00 75.32 O ATOM 1201 OE2 GLU A 491 2.164 -20.150 5.526 1.00 4.41 O ATOM 0 H GLU A 491 5.534 -23.442 2.812 1.00 75.10 H new ATOM 0 HA GLU A 491 3.071 -23.474 4.415 1.00 35.11 H new ATOM 0 HB2 GLU A 491 4.218 -21.702 2.517 1.00 44.42 H new ATOM 0 HB3 GLU A 491 2.843 -22.430 1.711 1.00 44.42 H new ATOM 0 HG2 GLU A 491 2.146 -20.388 2.818 1.00 53.43 H new ATOM 0 HG3 GLU A 491 1.375 -21.761 3.587 1.00 53.43 H new ATOM 1208 N HIS A 492 3.559 -25.841 2.718 1.00 23.21 N ATOM 1209 CA HIS A 492 3.071 -27.029 2.027 1.00 75.43 C ATOM 1210 C HIS A 492 1.639 -27.350 2.443 1.00 15.53 C ATOM 1211 O HIS A 492 1.202 -26.983 3.535 1.00 1.21 O ATOM 1212 CB HIS A 492 3.979 -28.224 2.317 1.00 2.35 C ATOM 1213 CG HIS A 492 3.627 -29.449 1.531 1.00 65.12 C ATOM 1214 ND1 HIS A 492 3.767 -29.530 0.162 1.00 43.33 N ATOM 1215 CD2 HIS A 492 3.141 -30.647 1.929 1.00 33.34 C ATOM 1216 CE1 HIS A 492 3.381 -30.725 -0.249 1.00 12.24 C ATOM 1217 NE2 HIS A 492 2.996 -31.422 0.805 1.00 71.35 N ATOM 0 H HIS A 492 4.425 -25.982 3.238 1.00 23.21 H new ATOM 0 HA HIS A 492 3.083 -26.826 0.956 1.00 75.43 H new ATOM 0 HB2 HIS A 492 5.011 -27.947 2.100 1.00 2.35 H new ATOM 0 HB3 HIS A 492 3.929 -28.458 3.380 1.00 2.35 H new ATOM 0 HD2 HIS A 492 2.910 -30.940 2.943 1.00 33.34 H new ATOM 0 HE1 HIS A 492 3.380 -31.072 -1.272 1.00 12.24 H new ATOM 0 HE2 HIS A 492 2.648 -32.380 0.787 1.00 71.35 H new ATOM 1225 N HIS A 493 0.912 -28.036 1.567 1.00 74.24 N ATOM 1226 CA HIS A 493 -0.471 -28.406 1.844 1.00 13.14 C ATOM 1227 C HIS A 493 -1.339 -27.165 2.035 1.00 44.15 C ATOM 1228 O HIS A 493 -0.841 -26.038 2.011 1.00 53.33 O ATOM 1229 CB HIS A 493 -0.545 -29.289 3.090 1.00 52.15 C ATOM 1230 CG HIS A 493 -1.537 -30.406 2.974 1.00 33.11 C ATOM 1231 ND1 HIS A 493 -1.328 -31.520 2.190 1.00 73.43 N ATOM 1232 CD2 HIS A 493 -2.750 -30.576 3.552 1.00 52.14 C ATOM 1233 CE1 HIS A 493 -2.369 -32.326 2.288 1.00 33.41 C ATOM 1234 NE2 HIS A 493 -3.247 -31.776 3.109 1.00 63.41 N ATOM 0 H HIS A 493 1.258 -28.347 0.659 1.00 74.24 H new ATOM 0 HA HIS A 493 -0.849 -28.964 0.988 1.00 13.14 H new ATOM 0 HB2 HIS A 493 0.441 -29.709 3.287 1.00 52.15 H new ATOM 0 HB3 HIS A 493 -0.805 -28.670 3.949 1.00 52.15 H new ATOM 0 HD2 HIS A 493 -3.236 -29.894 4.234 1.00 52.14 H new ATOM 0 HE1 HIS A 493 -2.484 -33.274 1.783 1.00 33.41 H new ATOM 0 HE2 HIS A 493 -4.147 -32.178 3.371 1.00 63.41 H new ATOM 1242 N HIS A 494 -2.637 -27.379 2.223 1.00 44.34 N ATOM 1243 CA HIS A 494 -3.573 -26.276 2.417 1.00 64.31 C ATOM 1244 C HIS A 494 -4.939 -26.795 2.855 1.00 71.12 C ATOM 1245 O HIS A 494 -5.141 -28.002 2.996 1.00 64.30 O ATOM 1246 CB HIS A 494 -3.712 -25.465 1.128 1.00 13.11 C ATOM 1247 CG HIS A 494 -3.766 -23.986 1.356 1.00 42.20 C ATOM 1248 ND1 HIS A 494 -4.902 -23.233 1.147 1.00 21.43 N ATOM 1249 CD2 HIS A 494 -2.815 -23.119 1.778 1.00 31.05 C ATOM 1250 CE1 HIS A 494 -4.648 -21.968 1.429 1.00 15.31 C ATOM 1251 NE2 HIS A 494 -3.389 -21.872 1.815 1.00 30.22 N ATOM 0 H HIS A 494 -3.065 -28.305 2.245 1.00 44.34 H new ATOM 0 HA HIS A 494 -3.179 -25.631 3.203 1.00 64.31 H new ATOM 0 HB2 HIS A 494 -2.872 -25.693 0.472 1.00 13.11 H new ATOM 0 HB3 HIS A 494 -4.617 -25.778 0.607 1.00 13.11 H new ATOM 0 HD2 HIS A 494 -1.795 -23.363 2.037 1.00 31.05 H new ATOM 0 HE1 HIS A 494 -5.351 -21.151 1.356 1.00 15.31 H new ATOM 0 HE2 HIS A 494 -2.919 -21.011 2.095 1.00 30.22 H new ATOM 1259 N HIS A 495 -5.874 -25.876 3.070 1.00 74.13 N ATOM 1260 CA HIS A 495 -7.222 -26.241 3.493 1.00 72.14 C ATOM 1261 C HIS A 495 -8.145 -26.400 2.288 1.00 41.51 C ATOM 1262 O HIS A 495 -7.740 -26.167 1.149 1.00 74.51 O ATOM 1263 CB HIS A 495 -7.784 -25.185 4.445 1.00 61.30 C ATOM 1264 CG HIS A 495 -7.153 -25.207 5.803 1.00 20.14 C ATOM 1265 ND1 HIS A 495 -7.492 -26.125 6.776 1.00 60.14 N ATOM 1266 CD2 HIS A 495 -6.198 -24.419 6.349 1.00 41.03 C ATOM 1267 CE1 HIS A 495 -6.774 -25.898 7.861 1.00 24.11 C ATOM 1268 NE2 HIS A 495 -5.980 -24.869 7.628 1.00 51.21 N ATOM 0 H HIS A 495 -5.724 -24.873 2.959 1.00 74.13 H new ATOM 0 HA HIS A 495 -7.167 -27.196 4.015 1.00 72.14 H new ATOM 0 HB2 HIS A 495 -7.643 -24.198 4.004 1.00 61.30 H new ATOM 0 HB3 HIS A 495 -8.858 -25.337 4.550 1.00 61.30 H new ATOM 0 HD2 HIS A 495 -5.700 -23.590 5.868 1.00 41.03 H new ATOM 0 HE1 HIS A 495 -6.827 -26.459 8.782 1.00 24.11 H new ATOM 0 HE2 HIS A 495 -5.313 -24.473 8.290 1.00 51.21 H new ATOM 1276 N HIS A 496 -9.387 -26.796 2.548 1.00 13.20 N ATOM 1277 CA HIS A 496 -10.367 -26.986 1.485 1.00 52.41 C ATOM 1278 C HIS A 496 -11.646 -26.208 1.781 1.00 52.04 C ATOM 1279 O HIS A 496 -11.753 -25.533 2.806 1.00 63.42 O ATOM 1280 CB HIS A 496 -10.688 -28.471 1.317 1.00 64.34 C ATOM 1281 CG HIS A 496 -10.147 -29.060 0.050 1.00 75.10 C ATOM 1282 ND1 HIS A 496 -8.880 -29.591 -0.053 1.00 1.13 N ATOM 1283 CD2 HIS A 496 -10.713 -29.201 -1.172 1.00 31.13 C ATOM 1284 CE1 HIS A 496 -8.688 -30.032 -1.284 1.00 21.03 C ATOM 1285 NE2 HIS A 496 -9.786 -29.808 -1.983 1.00 3.41 N ATOM 0 H HIS A 496 -9.738 -26.991 3.485 1.00 13.20 H new ATOM 0 HA HIS A 496 -9.938 -26.608 0.557 1.00 52.41 H new ATOM 0 HB2 HIS A 496 -10.282 -29.021 2.166 1.00 64.34 H new ATOM 0 HB3 HIS A 496 -11.769 -28.605 1.338 1.00 64.34 H new ATOM 0 HD2 HIS A 496 -11.709 -28.893 -1.456 1.00 31.13 H new ATOM 0 HE1 HIS A 496 -7.786 -30.497 -1.655 1.00 21.03 H new ATOM 0 HE2 HIS A 496 -9.923 -30.047 -2.965 1.00 3.41 H new ATOM 1293 N HIS A 497 -12.616 -26.306 0.876 1.00 4.25 N ATOM 1294 CA HIS A 497 -13.887 -25.611 1.041 1.00 74.34 C ATOM 1295 C HIS A 497 -14.687 -26.207 2.196 1.00 40.31 C ATOM 1296 O HIS A 497 -15.480 -25.515 2.834 1.00 33.13 O ATOM 1297 CB HIS A 497 -14.704 -25.685 -0.251 1.00 21.02 C ATOM 1298 CG HIS A 497 -15.074 -24.344 -0.803 1.00 51.02 C ATOM 1299 ND1 HIS A 497 -16.001 -23.514 -0.207 1.00 25.53 N ATOM 1300 CD2 HIS A 497 -14.637 -23.686 -1.902 1.00 21.10 C ATOM 1301 CE1 HIS A 497 -16.118 -22.406 -0.916 1.00 33.42 C ATOM 1302 NE2 HIS A 497 -15.301 -22.486 -1.950 1.00 61.15 N ATOM 0 H HIS A 497 -12.545 -26.860 0.022 1.00 4.25 H new ATOM 0 HA HIS A 497 -13.675 -24.567 1.270 1.00 74.34 H new ATOM 0 HB2 HIS A 497 -14.133 -26.233 -1.001 1.00 21.02 H new ATOM 0 HB3 HIS A 497 -15.614 -26.255 -0.064 1.00 21.02 H new ATOM 0 HD2 HIS A 497 -13.902 -24.040 -2.610 1.00 21.10 H new ATOM 0 HE1 HIS A 497 -16.771 -21.576 -0.689 1.00 33.42 H new ATOM 0 HE2 HIS A 497 -15.183 -21.772 -2.668 1.00 61.15 H new TER 1310 HIS A 497