USER MOD reduce.3.24.130724 H: found=0, std=0, add=675, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 671 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 NoAdj-H: A 392 HIS HE2 : A 392 HIS NE2 : A 449 ZNZN :(H bumps) USER MOD NoAdj-H: A 398 HIS HE2 : A 398 HIS NE2 : A 449 ZNZN :(H bumps) USER MOD NoAdj-H: A 434 HIS HE2 : A 434 HIS NE2 : A 450 ZNZN :(H bumps) USER MOD NoAdj-H: A 440 HIS HE2 : A 440 HIS NE2 : A 450 ZNZN :(H bumps) USER MOD Set 1.1: A 378 SER OG : rot 47:sc= 2.06 USER MOD Set 1.2: A 404 TYR OH : rot -123:sc= 0.383 USER MOD Set 1.3: A 412 GLN : amide:sc= 1.41 K(o=3.8,f=1.2) USER MOD Set 2.1: A 379 CYS SG : rot 155:sc= -9.37! USER MOD Set 2.2: A 385 CYS SG : rot -120:sc= -13.9! USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 362 THR OG1 : rot 28:sc= 0.248 USER MOD Single : A 364 SER OG : rot 180:sc= 0 USER MOD Single : A 367 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 369 SER OG : rot 180:sc= 0 USER MOD Single : A 372 ASN :FLIP amide:sc=-0.00494 F(o=-1,f=-0.0049) USER MOD Single : A 373 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 375 LYS NZ :NH3+ 170:sc= -0.0312 (180deg=-0.218) USER MOD Single : A 377 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 380 MET CE :methyl -143:sc= -0.254 (180deg=-1.51) USER MOD Single : A 381 TYR OH : rot 180:sc= 0 USER MOD Single : A 384 ASN : amide:sc= 0.968 K(o=0.97,f=0) USER MOD Single : A 386 TYR OH : rot 180:sc= 0 USER MOD Single : A 388 LYS NZ :NH3+ 170:sc= 1.24 (180deg=0.955) USER MOD Single : A 389 ASN : amide:sc= -0.614 K(o=-0.61,f=-3.8!) USER MOD Single : A 394 GLN : amide:sc= -1.14 K(o=-1.1,f=-5!) USER MOD Single : A 395 HIS : no HE2:sc= -6.24! C(o=-6.2!,f=-6.9!) USER MOD Single : A 397 SER OG : rot -97:sc= -2.35! USER MOD Single : A 402 SER OG : rot 180:sc= 0 USER MOD Single : A 408 GLN :FLIP amide:sc=-0.00149 F(o=-2.4,f=-0.0015) USER MOD Single : A 415 THR OG1 : rot -78:sc= 1.04 USER MOD Single : A 421 CYS SG : rot 127:sc= -12.1! USER MOD Single : A 423 TYR OH : rot 180:sc= -0.3 USER MOD Single : A 426 SER OG : rot -30:sc= 0.11 USER MOD Single : A 427 CYS SG : rot 159:sc= -4.1! USER MOD Single : A 428 TYR OH : rot 180:sc= 0 USER MOD Single : A 430 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 431 ASN : amide:sc= -1.43 K(o=-1.4,f=-3.2!) USER MOD Single : A 433 GLN : amide:sc= -0.123 X(o=-0.12,f=-0.087) USER MOD Single : A 435 LYS NZ :NH3+ 169:sc=-0.00969 (180deg=-0.131) USER MOD Single : A 438 TYR OH : rot 180:sc= 0 USER MOD Single : A 441 ASN : amide:sc= -2.62! C(o=-2.6!,f=-7!) USER MOD Single : A 442 THR OG1 : rot 180:sc= 0.0319 USER MOD Single : A 447 ASN : amide:sc= -0.706 K(o=-0.71,f=-4.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 -33.332 17.424 -13.161 1.00 0.00 N ATOM 2 CA GLY A -2 -33.757 16.014 -13.142 1.00 0.00 C ATOM 3 C GLY A -2 -34.056 15.537 -11.729 1.00 0.00 C ATOM 4 O GLY A -2 -33.127 15.321 -10.954 1.00 0.00 O ATOM 0 H1 GLY A -2 -33.137 17.715 -14.140 1.00 0.00 H new ATOM 0 H2 GLY A -2 -34.088 18.020 -12.767 1.00 0.00 H new ATOM 0 H3 GLY A -2 -32.471 17.535 -12.589 1.00 0.00 H new ATOM 0 HA2 GLY A -2 -34.645 15.893 -13.763 1.00 0.00 H new ATOM 0 HA3 GLY A -2 -32.975 15.392 -13.579 1.00 0.00 H new ATOM 10 N SER A -1 -35.328 15.388 -11.417 1.00 0.00 N ATOM 11 CA SER A -1 -35.764 14.991 -10.081 1.00 0.00 C ATOM 12 C SER A -1 -35.476 13.510 -9.849 1.00 0.00 C ATOM 13 O SER A -1 -36.214 12.653 -10.338 1.00 0.00 O ATOM 14 CB SER A -1 -37.262 15.292 -9.909 1.00 0.00 C ATOM 15 OG SER A -1 -37.542 16.667 -10.120 1.00 0.00 O ATOM 0 H SER A -1 -36.092 15.537 -12.077 1.00 0.00 H new ATOM 0 HA SER A -1 -35.209 15.564 -9.339 1.00 0.00 H new ATOM 0 HB2 SER A -1 -37.838 14.690 -10.611 1.00 0.00 H new ATOM 0 HB3 SER A -1 -37.580 15.004 -8.907 1.00 0.00 H new ATOM 0 HG SER A -1 -38.502 16.827 -10.005 1.00 0.00 H new ATOM 21 N LYS A 360 -34.373 13.206 -9.161 1.00 0.00 N ATOM 22 CA LYS A 360 -33.998 11.823 -8.855 1.00 0.00 C ATOM 23 C LYS A 360 -33.793 11.658 -7.359 1.00 0.00 C ATOM 24 O LYS A 360 -33.521 12.629 -6.643 1.00 0.00 O ATOM 25 CB LYS A 360 -32.701 11.444 -9.584 1.00 0.00 C ATOM 26 CG LYS A 360 -32.776 11.534 -11.101 1.00 0.00 C ATOM 27 CD LYS A 360 -31.481 11.088 -11.767 1.00 0.00 C ATOM 28 CE LYS A 360 -31.537 11.249 -13.279 1.00 0.00 C ATOM 29 NZ LYS A 360 -30.281 10.806 -13.930 1.00 0.00 N ATOM 0 H LYS A 360 -33.720 13.903 -8.803 1.00 0.00 H new ATOM 0 HA LYS A 360 -34.803 11.169 -9.190 1.00 0.00 H new ATOM 0 HB2 LYS A 360 -31.900 12.095 -9.234 1.00 0.00 H new ATOM 0 HB3 LYS A 360 -32.428 10.426 -9.307 1.00 0.00 H new ATOM 0 HG2 LYS A 360 -33.599 10.916 -11.460 1.00 0.00 H new ATOM 0 HG3 LYS A 360 -32.998 12.561 -11.392 1.00 0.00 H new ATOM 0 HD2 LYS A 360 -30.649 11.670 -11.370 1.00 0.00 H new ATOM 0 HD3 LYS A 360 -31.286 10.044 -11.520 1.00 0.00 H new ATOM 0 HE2 LYS A 360 -32.373 10.673 -13.674 1.00 0.00 H new ATOM 0 HE3 LYS A 360 -31.725 12.294 -13.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 360 -30.360 10.932 -14.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 360 -29.486 11.373 -13.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 360 -30.115 9.802 -13.716 1.00 0.00 H new ATOM 43 N ALA A 361 -33.934 10.420 -6.879 1.00 0.00 N ATOM 44 CA ALA A 361 -33.705 10.123 -5.476 1.00 0.00 C ATOM 45 C ALA A 361 -32.217 9.941 -5.203 1.00 0.00 C ATOM 46 O ALA A 361 -31.772 8.947 -4.653 1.00 0.00 O ATOM 47 CB ALA A 361 -34.492 8.854 -5.084 1.00 0.00 C ATOM 0 H ALA A 361 -34.205 9.615 -7.444 1.00 0.00 H new ATOM 0 HA ALA A 361 -34.056 10.959 -4.871 1.00 0.00 H new ATOM 0 HB1 ALA A 361 -34.321 8.630 -4.031 1.00 0.00 H new ATOM 0 HB2 ALA A 361 -35.556 9.020 -5.251 1.00 0.00 H new ATOM 0 HB3 ALA A 361 -34.155 8.015 -5.693 1.00 0.00 H new ATOM 53 N THR A 362 -31.432 10.941 -5.607 1.00 0.00 N ATOM 54 CA THR A 362 -30.003 10.925 -5.397 1.00 0.00 C ATOM 55 C THR A 362 -29.683 11.210 -3.946 1.00 0.00 C ATOM 56 O THR A 362 -30.061 12.271 -3.421 1.00 0.00 O ATOM 57 CB THR A 362 -29.311 11.997 -6.298 1.00 0.00 C ATOM 58 OG1 THR A 362 -29.941 13.269 -6.127 1.00 0.00 O ATOM 59 CG2 THR A 362 -29.352 11.577 -7.767 1.00 0.00 C ATOM 0 H THR A 362 -31.776 11.774 -6.084 1.00 0.00 H new ATOM 0 HA THR A 362 -29.629 9.936 -5.661 1.00 0.00 H new ATOM 0 HB THR A 362 -28.267 12.079 -5.995 1.00 0.00 H new ATOM 0 HG1 THR A 362 -30.326 13.325 -5.228 1.00 0.00 H new ATOM 0 HG21 THR A 362 -28.865 12.338 -8.377 1.00 0.00 H new ATOM 0 HG22 THR A 362 -28.832 10.627 -7.888 1.00 0.00 H new ATOM 0 HG23 THR A 362 -30.389 11.466 -8.085 1.00 0.00 H new ATOM 67 N ASP A 363 -29.008 10.265 -3.277 1.00 0.00 N ATOM 68 CA ASP A 363 -28.597 10.443 -1.896 1.00 0.00 C ATOM 69 C ASP A 363 -27.490 11.488 -1.815 1.00 0.00 C ATOM 70 O ASP A 363 -26.346 11.239 -2.251 1.00 0.00 O ATOM 71 CB ASP A 363 -28.134 9.117 -1.280 1.00 0.00 C ATOM 72 CG ASP A 363 -27.667 9.264 0.169 1.00 0.00 C ATOM 73 OD1 ASP A 363 -28.526 9.230 1.071 1.00 0.00 O ATOM 74 OD2 ASP A 363 -26.453 9.401 0.401 1.00 0.00 O ATOM 0 H ASP A 363 -28.738 9.368 -3.681 1.00 0.00 H new ATOM 0 HA ASP A 363 -29.457 10.791 -1.323 1.00 0.00 H new ATOM 0 HB2 ASP A 363 -28.952 8.398 -1.321 1.00 0.00 H new ATOM 0 HB3 ASP A 363 -27.320 8.709 -1.879 1.00 0.00 H new ATOM 79 N SER A 364 -27.805 12.655 -1.283 1.00 0.00 N ATOM 80 CA SER A 364 -26.849 13.750 -1.187 1.00 0.00 C ATOM 81 C SER A 364 -25.960 13.564 0.052 1.00 0.00 C ATOM 82 O SER A 364 -26.432 13.714 1.185 1.00 0.00 O ATOM 83 CB SER A 364 -27.571 15.085 -1.140 1.00 0.00 C ATOM 84 OG SER A 364 -26.662 16.191 -1.217 1.00 0.00 O ATOM 0 H SER A 364 -28.727 12.873 -0.906 1.00 0.00 H new ATOM 0 HA SER A 364 -26.214 13.743 -2.073 1.00 0.00 H new ATOM 0 HB2 SER A 364 -28.282 15.142 -1.965 1.00 0.00 H new ATOM 0 HB3 SER A 364 -28.147 15.153 -0.217 1.00 0.00 H new ATOM 0 HG SER A 364 -27.166 17.031 -1.185 1.00 0.00 H new ATOM 90 N VAL A 365 -24.710 13.214 -0.180 1.00 0.00 N ATOM 91 CA VAL A 365 -23.712 13.077 0.882 1.00 0.00 C ATOM 92 C VAL A 365 -22.514 13.980 0.600 1.00 0.00 C ATOM 93 O VAL A 365 -21.649 13.650 -0.221 1.00 0.00 O ATOM 94 CB VAL A 365 -23.259 11.614 1.077 1.00 0.00 C ATOM 95 CG1 VAL A 365 -22.830 10.978 -0.233 1.00 0.00 C ATOM 96 CG2 VAL A 365 -22.159 11.512 2.146 1.00 0.00 C ATOM 0 H VAL A 365 -24.349 13.014 -1.113 1.00 0.00 H new ATOM 0 HA VAL A 365 -24.183 13.389 1.814 1.00 0.00 H new ATOM 0 HB VAL A 365 -24.120 11.049 1.436 1.00 0.00 H new ATOM 0 HG11 VAL A 365 -22.518 9.949 -0.053 1.00 0.00 H new ATOM 0 HG12 VAL A 365 -23.666 10.987 -0.933 1.00 0.00 H new ATOM 0 HG13 VAL A 365 -21.997 11.541 -0.655 1.00 0.00 H new ATOM 0 HG21 VAL A 365 -21.860 10.470 2.262 1.00 0.00 H new ATOM 0 HG22 VAL A 365 -21.297 12.105 1.839 1.00 0.00 H new ATOM 0 HG23 VAL A 365 -22.539 11.888 3.096 1.00 0.00 H new ATOM 106 N LEU A 366 -22.469 15.116 1.272 1.00 0.00 N ATOM 107 CA LEU A 366 -21.411 16.102 1.057 1.00 0.00 C ATOM 108 C LEU A 366 -20.275 15.890 2.038 1.00 0.00 C ATOM 109 O LEU A 366 -19.234 16.555 1.979 1.00 0.00 O ATOM 110 CB LEU A 366 -21.977 17.523 1.151 1.00 0.00 C ATOM 111 CG LEU A 366 -22.886 17.801 2.365 1.00 0.00 C ATOM 112 CD1 LEU A 366 -22.059 17.920 3.661 1.00 0.00 C ATOM 113 CD2 LEU A 366 -23.716 19.068 2.149 1.00 0.00 C ATOM 0 H LEU A 366 -23.155 15.385 1.977 1.00 0.00 H new ATOM 0 HA LEU A 366 -21.008 15.969 0.053 1.00 0.00 H new ATOM 0 HB2 LEU A 366 -21.144 18.225 1.176 1.00 0.00 H new ATOM 0 HB3 LEU A 366 -22.542 17.730 0.242 1.00 0.00 H new ATOM 0 HG LEU A 366 -23.566 16.956 2.468 1.00 0.00 H new ATOM 0 HD11 LEU A 366 -22.725 18.116 4.501 1.00 0.00 H new ATOM 0 HD12 LEU A 366 -21.520 16.989 3.835 1.00 0.00 H new ATOM 0 HD13 LEU A 366 -21.347 18.739 3.564 1.00 0.00 H new ATOM 0 HD21 LEU A 366 -24.348 19.241 3.020 1.00 0.00 H new ATOM 0 HD22 LEU A 366 -23.050 19.920 2.009 1.00 0.00 H new ATOM 0 HD23 LEU A 366 -24.341 18.947 1.265 1.00 0.00 H new ATOM 125 N GLN A 367 -20.468 14.951 2.956 1.00 0.00 N ATOM 126 CA GLN A 367 -19.480 14.598 3.963 1.00 0.00 C ATOM 127 C GLN A 367 -18.179 14.149 3.303 1.00 0.00 C ATOM 128 O GLN A 367 -18.129 13.062 2.706 1.00 0.00 O ATOM 129 CB GLN A 367 -20.013 13.519 4.885 1.00 0.00 C ATOM 130 CG GLN A 367 -19.090 13.169 6.048 1.00 0.00 C ATOM 131 CD GLN A 367 -19.604 12.012 6.883 1.00 0.00 C ATOM 132 OE1 GLN A 367 -19.272 10.852 6.641 1.00 0.00 O ATOM 133 NE2 GLN A 367 -20.427 12.316 7.876 1.00 0.00 N ATOM 0 H GLN A 367 -21.328 14.407 3.021 1.00 0.00 H new ATOM 0 HA GLN A 367 -19.273 15.484 4.563 1.00 0.00 H new ATOM 0 HB2 GLN A 367 -20.974 13.842 5.285 1.00 0.00 H new ATOM 0 HB3 GLN A 367 -20.198 12.618 4.300 1.00 0.00 H new ATOM 0 HG2 GLN A 367 -18.103 12.919 5.659 1.00 0.00 H new ATOM 0 HG3 GLN A 367 -18.969 14.045 6.685 1.00 0.00 H new ATOM 0 HE21 GLN A 367 -20.681 13.289 8.048 1.00 0.00 H new ATOM 0 HE22 GLN A 367 -20.806 11.577 8.468 1.00 0.00 H new ATOM 142 N GLY A 368 -17.156 14.972 3.396 1.00 0.00 N ATOM 143 CA GLY A 368 -15.874 14.679 2.792 1.00 0.00 C ATOM 144 C GLY A 368 -15.963 14.734 1.273 1.00 0.00 C ATOM 145 O GLY A 368 -15.443 13.849 0.579 1.00 0.00 O ATOM 0 H GLY A 368 -17.190 15.863 3.892 1.00 0.00 H new ATOM 0 HA2 GLY A 368 -15.130 15.395 3.143 1.00 0.00 H new ATOM 0 HA3 GLY A 368 -15.538 13.691 3.105 1.00 0.00 H new ATOM 149 N SER A 369 -16.650 15.760 0.766 1.00 0.00 N ATOM 150 CA SER A 369 -16.796 15.967 -0.679 1.00 0.00 C ATOM 151 C SER A 369 -16.871 17.459 -1.005 1.00 0.00 C ATOM 152 O SER A 369 -17.865 18.115 -0.701 1.00 0.00 O ATOM 153 CB SER A 369 -18.035 15.228 -1.198 1.00 0.00 C ATOM 154 OG SER A 369 -17.950 13.836 -0.926 1.00 0.00 O ATOM 0 H SER A 369 -17.117 16.465 1.337 1.00 0.00 H new ATOM 0 HA SER A 369 -15.919 15.559 -1.181 1.00 0.00 H new ATOM 0 HB2 SER A 369 -18.930 15.639 -0.731 1.00 0.00 H new ATOM 0 HB3 SER A 369 -18.134 15.387 -2.272 1.00 0.00 H new ATOM 0 HG SER A 369 -18.752 13.387 -1.265 1.00 0.00 H new ATOM 160 N GLU A 370 -15.792 17.973 -1.591 1.00 0.00 N ATOM 161 CA GLU A 370 -15.724 19.371 -2.022 1.00 0.00 C ATOM 162 C GLU A 370 -16.200 19.497 -3.463 1.00 0.00 C ATOM 163 O GLU A 370 -16.601 20.580 -3.909 1.00 0.00 O ATOM 164 CB GLU A 370 -14.284 19.921 -1.881 1.00 0.00 C ATOM 165 CG GLU A 370 -13.263 19.336 -2.863 1.00 0.00 C ATOM 166 CD GLU A 370 -12.995 17.846 -2.647 1.00 0.00 C ATOM 167 OE1 GLU A 370 -13.733 17.015 -3.220 1.00 0.00 O ATOM 168 OE2 GLU A 370 -12.075 17.506 -1.880 1.00 0.00 O ATOM 0 H GLU A 370 -14.944 17.438 -1.780 1.00 0.00 H new ATOM 0 HA GLU A 370 -16.378 19.962 -1.380 1.00 0.00 H new ATOM 0 HB2 GLU A 370 -14.311 21.003 -2.011 1.00 0.00 H new ATOM 0 HB3 GLU A 370 -13.937 19.731 -0.865 1.00 0.00 H new ATOM 0 HG2 GLU A 370 -13.621 19.489 -3.881 1.00 0.00 H new ATOM 0 HG3 GLU A 370 -12.325 19.883 -2.769 1.00 0.00 H new ATOM 175 N GLY A 371 -16.134 18.400 -4.206 1.00 0.00 N ATOM 176 CA GLY A 371 -16.527 18.376 -5.590 1.00 0.00 C ATOM 177 C GLY A 371 -16.086 17.099 -6.262 1.00 0.00 C ATOM 178 O GLY A 371 -16.735 16.599 -7.193 1.00 0.00 O ATOM 0 H GLY A 371 -15.803 17.502 -3.854 1.00 0.00 H new ATOM 0 HA2 GLY A 371 -17.610 18.474 -5.665 1.00 0.00 H new ATOM 0 HA3 GLY A 371 -16.093 19.231 -6.109 1.00 0.00 H new ATOM 182 N ASN A 372 -14.951 16.556 -5.782 1.00 0.00 N ATOM 183 CA ASN A 372 -14.446 15.281 -6.251 1.00 0.00 C ATOM 184 C ASN A 372 -15.057 14.143 -5.437 1.00 0.00 C ATOM 185 O ASN A 372 -15.774 14.383 -4.467 1.00 0.00 O ATOM 186 CB ASN A 372 -12.910 15.223 -6.137 1.00 0.00 C ATOM 187 CG ASN A 372 -12.193 16.218 -7.039 1.00 0.00 C ATOM 188 OD1 ASN A 372 -12.782 16.530 -8.187 1.00 0.00 O flip ATOM 189 ND2 ASN A 372 -11.117 16.706 -6.712 1.00 0.00 N flip ATOM 0 H ASN A 372 -14.373 16.995 -5.065 1.00 0.00 H new ATOM 0 HA ASN A 372 -14.725 15.172 -7.299 1.00 0.00 H new ATOM 0 HB2 ASN A 372 -12.624 15.412 -5.102 1.00 0.00 H new ATOM 0 HB3 ASN A 372 -12.574 14.216 -6.382 1.00 0.00 H new ATOM 0 HD21 ASN A 372 -10.689 16.447 -5.823 1.00 0.00 H new ATOM 0 HD22 ASN A 372 -10.650 17.371 -7.329 1.00 0.00 H new ATOM 196 N LYS A 373 -14.768 12.917 -5.850 1.00 0.00 N ATOM 197 CA LYS A 373 -15.127 11.742 -5.072 1.00 0.00 C ATOM 198 C LYS A 373 -13.889 10.857 -4.875 1.00 0.00 C ATOM 199 O LYS A 373 -13.959 9.795 -4.276 1.00 0.00 O ATOM 200 CB LYS A 373 -16.268 10.944 -5.726 1.00 0.00 C ATOM 201 CG LYS A 373 -15.957 10.361 -7.107 1.00 0.00 C ATOM 202 CD LYS A 373 -16.010 11.404 -8.229 1.00 0.00 C ATOM 203 CE LYS A 373 -17.393 12.068 -8.356 1.00 0.00 C ATOM 204 NZ LYS A 373 -17.447 13.024 -9.472 1.00 0.00 N ATOM 0 H LYS A 373 -14.284 12.711 -6.724 1.00 0.00 H new ATOM 0 HA LYS A 373 -15.491 12.078 -4.101 1.00 0.00 H new ATOM 0 HB2 LYS A 373 -16.545 10.127 -5.060 1.00 0.00 H new ATOM 0 HB3 LYS A 373 -17.139 11.594 -5.813 1.00 0.00 H new ATOM 0 HG2 LYS A 373 -14.966 9.907 -7.088 1.00 0.00 H new ATOM 0 HG3 LYS A 373 -16.668 9.564 -7.326 1.00 0.00 H new ATOM 0 HD2 LYS A 373 -15.259 12.171 -8.042 1.00 0.00 H new ATOM 0 HD3 LYS A 373 -15.751 10.928 -9.175 1.00 0.00 H new ATOM 0 HE2 LYS A 373 -18.152 11.299 -8.501 1.00 0.00 H new ATOM 0 HE3 LYS A 373 -17.634 12.583 -7.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 373 -18.396 13.447 -9.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 373 -16.741 13.773 -9.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 373 -17.243 12.529 -10.363 1.00 0.00 H new ATOM 218 N VAL A 374 -12.771 11.327 -5.427 1.00 0.00 N ATOM 219 CA VAL A 374 -11.475 10.669 -5.313 1.00 0.00 C ATOM 220 C VAL A 374 -10.384 11.738 -5.351 1.00 0.00 C ATOM 221 O VAL A 374 -10.666 12.918 -5.555 1.00 0.00 O ATOM 222 CB VAL A 374 -11.218 9.662 -6.467 1.00 0.00 C ATOM 223 CG1 VAL A 374 -12.181 8.490 -6.435 1.00 0.00 C ATOM 224 CG2 VAL A 374 -11.262 10.371 -7.819 1.00 0.00 C ATOM 0 H VAL A 374 -12.742 12.188 -5.973 1.00 0.00 H new ATOM 0 HA VAL A 374 -11.465 10.112 -4.376 1.00 0.00 H new ATOM 0 HB VAL A 374 -10.219 9.252 -6.321 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -11.960 7.815 -7.262 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -12.073 7.956 -5.491 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -13.203 8.856 -6.529 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -11.080 9.649 -8.615 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -12.243 10.826 -7.960 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -10.495 11.145 -7.849 1.00 0.00 H new ATOM 234 N LYS A 375 -9.138 11.311 -5.173 1.00 0.00 N ATOM 235 CA LYS A 375 -7.991 12.206 -5.318 1.00 0.00 C ATOM 236 C LYS A 375 -6.917 11.576 -6.201 1.00 0.00 C ATOM 237 O LYS A 375 -6.982 10.384 -6.544 1.00 0.00 O ATOM 238 CB LYS A 375 -7.417 12.577 -3.937 1.00 0.00 C ATOM 239 CG LYS A 375 -7.236 11.429 -2.942 1.00 0.00 C ATOM 240 CD LYS A 375 -6.139 10.447 -3.352 1.00 0.00 C ATOM 241 CE LYS A 375 -5.878 9.424 -2.261 1.00 0.00 C ATOM 242 NZ LYS A 375 -7.121 8.723 -1.834 1.00 0.00 N ATOM 0 H LYS A 375 -8.895 10.351 -4.928 1.00 0.00 H new ATOM 0 HA LYS A 375 -8.331 13.120 -5.804 1.00 0.00 H new ATOM 0 HB2 LYS A 375 -6.449 13.054 -4.087 1.00 0.00 H new ATOM 0 HB3 LYS A 375 -8.072 13.321 -3.484 1.00 0.00 H new ATOM 0 HG2 LYS A 375 -6.999 11.841 -1.961 1.00 0.00 H new ATOM 0 HG3 LYS A 375 -8.178 10.891 -2.842 1.00 0.00 H new ATOM 0 HD2 LYS A 375 -6.430 9.936 -4.270 1.00 0.00 H new ATOM 0 HD3 LYS A 375 -5.221 10.994 -3.568 1.00 0.00 H new ATOM 0 HE2 LYS A 375 -5.155 8.691 -2.619 1.00 0.00 H new ATOM 0 HE3 LYS A 375 -5.430 9.920 -1.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 375 -6.874 7.923 -1.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 375 -7.732 9.385 -1.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 375 -7.626 8.370 -2.672 1.00 0.00 H new ATOM 256 N ARG A 376 -5.942 12.382 -6.606 1.00 0.00 N ATOM 257 CA ARG A 376 -4.885 11.923 -7.492 1.00 0.00 C ATOM 258 C ARG A 376 -3.855 11.107 -6.741 1.00 0.00 C ATOM 259 O ARG A 376 -3.794 11.105 -5.507 1.00 0.00 O ATOM 260 CB ARG A 376 -4.185 13.090 -8.196 1.00 0.00 C ATOM 261 CG ARG A 376 -5.001 13.737 -9.320 1.00 0.00 C ATOM 262 CD ARG A 376 -6.027 14.738 -8.829 1.00 0.00 C ATOM 263 NE ARG A 376 -5.407 15.843 -8.070 1.00 0.00 N ATOM 264 CZ ARG A 376 -6.039 16.983 -7.755 1.00 0.00 C ATOM 265 NH1 ARG A 376 -7.316 17.163 -8.092 1.00 0.00 N ATOM 266 NH2 ARG A 376 -5.398 17.938 -7.099 1.00 0.00 N ATOM 0 H ARG A 376 -5.864 13.361 -6.332 1.00 0.00 H new ATOM 0 HA ARG A 376 -5.363 11.296 -8.245 1.00 0.00 H new ATOM 0 HB2 ARG A 376 -3.943 13.852 -7.455 1.00 0.00 H new ATOM 0 HB3 ARG A 376 -3.240 12.735 -8.608 1.00 0.00 H new ATOM 0 HG2 ARG A 376 -4.321 14.236 -10.010 1.00 0.00 H new ATOM 0 HG3 ARG A 376 -5.510 12.955 -9.884 1.00 0.00 H new ATOM 0 HD2 ARG A 376 -6.572 15.145 -9.681 1.00 0.00 H new ATOM 0 HD3 ARG A 376 -6.756 14.229 -8.198 1.00 0.00 H new ATOM 0 HE ARG A 376 -4.439 15.732 -7.767 1.00 0.00 H new ATOM 0 HH11 ARG A 376 -7.819 16.431 -8.593 1.00 0.00 H new ATOM 0 HH12 ARG A 376 -7.790 18.033 -7.849 1.00 0.00 H new ATOM 0 HH21 ARG A 376 -4.422 17.807 -6.833 1.00 0.00 H new ATOM 0 HH22 ARG A 376 -5.880 18.805 -6.860 1.00 0.00 H new ATOM 280 N THR A 377 -3.013 10.442 -7.498 1.00 0.00 N ATOM 281 CA THR A 377 -1.914 9.646 -6.958 1.00 0.00 C ATOM 282 C THR A 377 -0.581 10.310 -7.311 1.00 0.00 C ATOM 283 O THR A 377 -0.515 11.179 -8.182 1.00 0.00 O ATOM 284 CB THR A 377 -1.957 8.185 -7.500 1.00 0.00 C ATOM 285 OG1 THR A 377 -0.832 7.440 -7.025 1.00 0.00 O ATOM 286 CG2 THR A 377 -1.986 8.170 -9.022 1.00 0.00 C ATOM 0 H THR A 377 -3.065 10.433 -8.517 1.00 0.00 H new ATOM 0 HA THR A 377 -2.018 9.598 -5.874 1.00 0.00 H new ATOM 0 HB THR A 377 -2.871 7.718 -7.132 1.00 0.00 H new ATOM 0 HG1 THR A 377 -0.875 6.525 -7.373 1.00 0.00 H new ATOM 0 HG21 THR A 377 -2.016 7.139 -9.375 1.00 0.00 H new ATOM 0 HG22 THR A 377 -2.871 8.700 -9.374 1.00 0.00 H new ATOM 0 HG23 THR A 377 -1.092 8.660 -9.408 1.00 0.00 H new ATOM 294 N SER A 378 0.474 9.923 -6.606 1.00 0.00 N ATOM 295 CA SER A 378 1.804 10.518 -6.769 1.00 0.00 C ATOM 296 C SER A 378 2.305 10.397 -8.209 1.00 0.00 C ATOM 297 O SER A 378 2.479 9.285 -8.718 1.00 0.00 O ATOM 298 CB SER A 378 2.789 9.819 -5.815 1.00 0.00 C ATOM 299 OG SER A 378 4.064 10.445 -5.829 1.00 0.00 O ATOM 0 H SER A 378 0.437 9.186 -5.902 1.00 0.00 H new ATOM 0 HA SER A 378 1.736 11.580 -6.531 1.00 0.00 H new ATOM 0 HB2 SER A 378 2.387 9.833 -4.802 1.00 0.00 H new ATOM 0 HB3 SER A 378 2.894 8.773 -6.102 1.00 0.00 H new ATOM 0 HG SER A 378 3.952 11.416 -5.757 1.00 0.00 H new ATOM 305 N CYS A 379 2.510 11.551 -8.869 1.00 0.00 N ATOM 306 CA CYS A 379 3.129 11.594 -10.194 1.00 0.00 C ATOM 307 C CYS A 379 4.437 10.820 -10.158 1.00 0.00 C ATOM 308 O CYS A 379 5.345 11.188 -9.412 1.00 0.00 O ATOM 309 CB CYS A 379 3.364 13.070 -10.610 1.00 0.00 C ATOM 310 SG CYS A 379 3.851 13.347 -12.348 1.00 0.00 S ATOM 0 H CYS A 379 2.253 12.466 -8.499 1.00 0.00 H new ATOM 0 HA CYS A 379 2.472 11.133 -10.932 1.00 0.00 H new ATOM 0 HB2 CYS A 379 2.450 13.631 -10.416 1.00 0.00 H new ATOM 0 HB3 CYS A 379 4.137 13.489 -9.966 1.00 0.00 H new ATOM 0 HG CYS A 379 3.504 14.547 -12.710 1.00 0.00 H new ATOM 315 N MET A 380 4.535 9.743 -10.934 1.00 0.00 N ATOM 316 CA MET A 380 5.664 8.819 -10.835 1.00 0.00 C ATOM 317 C MET A 380 6.988 9.541 -11.094 1.00 0.00 C ATOM 318 O MET A 380 8.051 9.073 -10.677 1.00 0.00 O ATOM 319 CB MET A 380 5.507 7.640 -11.815 1.00 0.00 C ATOM 320 CG MET A 380 5.668 8.021 -13.279 1.00 0.00 C ATOM 321 SD MET A 380 5.549 6.609 -14.387 1.00 0.00 S ATOM 322 CE MET A 380 6.834 5.560 -13.750 1.00 0.00 C ATOM 0 H MET A 380 3.845 9.488 -11.640 1.00 0.00 H new ATOM 0 HA MET A 380 5.674 8.425 -9.819 1.00 0.00 H new ATOM 0 HB2 MET A 380 6.243 6.875 -11.567 1.00 0.00 H new ATOM 0 HB3 MET A 380 4.523 7.193 -11.673 1.00 0.00 H new ATOM 0 HG2 MET A 380 4.904 8.751 -13.545 1.00 0.00 H new ATOM 0 HG3 MET A 380 6.634 8.506 -13.419 1.00 0.00 H new ATOM 0 HE1 MET A 380 7.331 5.051 -14.576 1.00 0.00 H new ATOM 0 HE2 MET A 380 7.561 6.164 -13.206 1.00 0.00 H new ATOM 0 HE3 MET A 380 6.400 4.821 -13.076 1.00 0.00 H new ATOM 332 N TYR A 381 6.921 10.698 -11.771 1.00 0.00 N ATOM 333 CA TYR A 381 8.116 11.535 -11.988 1.00 0.00 C ATOM 334 C TYR A 381 8.013 12.808 -11.152 1.00 0.00 C ATOM 335 O TYR A 381 9.005 13.524 -10.994 1.00 0.00 O ATOM 336 CB TYR A 381 8.236 11.891 -13.460 1.00 0.00 C ATOM 337 CG TYR A 381 8.375 10.690 -14.391 1.00 0.00 C ATOM 338 CD1 TYR A 381 9.526 9.910 -14.391 1.00 0.00 C ATOM 339 CD2 TYR A 381 7.351 10.348 -15.278 1.00 0.00 C ATOM 340 CE1 TYR A 381 9.655 8.815 -15.243 1.00 0.00 C ATOM 341 CE2 TYR A 381 7.477 9.273 -16.119 1.00 0.00 C ATOM 342 CZ TYR A 381 8.616 8.507 -16.105 1.00 0.00 C ATOM 343 OH TYR A 381 8.749 7.423 -16.943 1.00 0.00 O ATOM 0 H TYR A 381 6.063 11.074 -12.174 1.00 0.00 H new ATOM 0 HA TYR A 381 9.003 10.979 -11.684 1.00 0.00 H new ATOM 0 HB2 TYR A 381 7.357 12.464 -13.755 1.00 0.00 H new ATOM 0 HB3 TYR A 381 9.100 12.541 -13.594 1.00 0.00 H new ATOM 0 HD1 TYR A 381 10.334 10.157 -13.719 1.00 0.00 H new ATOM 0 HD2 TYR A 381 6.447 10.939 -15.301 1.00 0.00 H new ATOM 0 HE1 TYR A 381 10.553 8.215 -15.231 1.00 0.00 H new ATOM 0 HE2 TYR A 381 6.674 9.027 -16.798 1.00 0.00 H new ATOM 0 HH TYR A 381 7.940 7.330 -17.489 1.00 0.00 H new ATOM 353 N GLY A 382 6.808 13.108 -10.641 1.00 0.00 N ATOM 354 CA GLY A 382 6.631 14.298 -9.810 1.00 0.00 C ATOM 355 C GLY A 382 6.706 15.546 -10.660 1.00 0.00 C ATOM 356 O GLY A 382 6.130 15.587 -11.751 1.00 0.00 O ATOM 0 H GLY A 382 5.964 12.555 -10.787 1.00 0.00 H new ATOM 0 HA2 GLY A 382 5.669 14.254 -9.300 1.00 0.00 H new ATOM 0 HA3 GLY A 382 7.400 14.329 -9.038 1.00 0.00 H new ATOM 360 N ALA A 383 7.436 16.537 -10.191 1.00 0.00 N ATOM 361 CA ALA A 383 7.608 17.785 -10.925 1.00 0.00 C ATOM 362 C ALA A 383 8.586 17.593 -12.078 1.00 0.00 C ATOM 363 O ALA A 383 8.819 18.512 -12.871 1.00 0.00 O ATOM 364 CB ALA A 383 8.083 18.887 -9.982 1.00 0.00 C ATOM 0 H ALA A 383 7.926 16.506 -9.297 1.00 0.00 H new ATOM 0 HA ALA A 383 6.647 18.084 -11.345 1.00 0.00 H new ATOM 0 HB1 ALA A 383 8.208 19.815 -10.540 1.00 0.00 H new ATOM 0 HB2 ALA A 383 7.345 19.035 -9.194 1.00 0.00 H new ATOM 0 HB3 ALA A 383 9.036 18.600 -9.537 1.00 0.00 H new ATOM 370 N ASN A 384 9.117 16.381 -12.201 1.00 0.00 N ATOM 371 CA ASN A 384 10.121 16.061 -13.208 1.00 0.00 C ATOM 372 C ASN A 384 9.477 15.534 -14.504 1.00 0.00 C ATOM 373 O ASN A 384 10.156 15.392 -15.527 1.00 0.00 O ATOM 374 CB ASN A 384 11.135 15.035 -12.672 1.00 0.00 C ATOM 375 CG ASN A 384 11.797 15.503 -11.382 1.00 0.00 C ATOM 376 OD1 ASN A 384 12.834 16.173 -11.417 1.00 0.00 O ATOM 377 ND2 ASN A 384 11.215 15.135 -10.261 1.00 0.00 N ATOM 0 H ASN A 384 8.863 15.593 -11.605 1.00 0.00 H new ATOM 0 HA ASN A 384 10.647 16.987 -13.440 1.00 0.00 H new ATOM 0 HB2 ASN A 384 10.630 14.085 -12.496 1.00 0.00 H new ATOM 0 HB3 ASN A 384 11.900 14.854 -13.427 1.00 0.00 H new ATOM 0 HD21 ASN A 384 11.620 15.403 -9.364 1.00 0.00 H new ATOM 0 HD22 ASN A 384 10.359 14.581 -10.289 1.00 0.00 H new ATOM 384 N CYS A 385 8.175 15.239 -14.469 1.00 0.00 N ATOM 385 CA CYS A 385 7.466 14.831 -15.665 1.00 0.00 C ATOM 386 C CYS A 385 7.242 16.019 -16.582 1.00 0.00 C ATOM 387 O CYS A 385 6.665 17.025 -16.174 1.00 0.00 O ATOM 388 CB CYS A 385 6.140 14.152 -15.319 1.00 0.00 C ATOM 389 SG CYS A 385 5.118 15.059 -14.105 1.00 0.00 S ATOM 0 H CYS A 385 7.601 15.277 -13.627 1.00 0.00 H new ATOM 0 HA CYS A 385 8.083 14.102 -16.190 1.00 0.00 H new ATOM 0 HB2 CYS A 385 5.563 14.021 -16.235 1.00 0.00 H new ATOM 0 HB3 CYS A 385 6.348 13.156 -14.928 1.00 0.00 H new ATOM 0 HG CYS A 385 4.928 14.315 -13.056 1.00 0.00 H new ATOM 394 N TYR A 386 7.667 15.880 -17.826 1.00 0.00 N ATOM 395 CA TYR A 386 7.613 16.952 -18.793 1.00 0.00 C ATOM 396 C TYR A 386 6.201 17.143 -19.356 1.00 0.00 C ATOM 397 O TYR A 386 5.990 17.870 -20.320 1.00 0.00 O ATOM 398 CB TYR A 386 8.618 16.698 -19.928 1.00 0.00 C ATOM 399 CG TYR A 386 8.379 15.424 -20.711 1.00 0.00 C ATOM 400 CD1 TYR A 386 7.537 15.416 -21.820 1.00 0.00 C ATOM 401 CD2 TYR A 386 9.002 14.227 -20.355 1.00 0.00 C ATOM 402 CE1 TYR A 386 7.323 14.267 -22.543 1.00 0.00 C ATOM 403 CE2 TYR A 386 8.783 13.067 -21.079 1.00 0.00 C ATOM 404 CZ TYR A 386 7.940 13.096 -22.179 1.00 0.00 C ATOM 405 OH TYR A 386 7.729 11.946 -22.905 1.00 0.00 O ATOM 0 H TYR A 386 8.061 15.013 -18.191 1.00 0.00 H new ATOM 0 HA TYR A 386 7.884 17.874 -18.279 1.00 0.00 H new ATOM 0 HB2 TYR A 386 8.589 17.542 -20.617 1.00 0.00 H new ATOM 0 HB3 TYR A 386 9.622 16.666 -19.505 1.00 0.00 H new ATOM 0 HD1 TYR A 386 7.043 16.329 -22.117 1.00 0.00 H new ATOM 0 HD2 TYR A 386 9.665 14.205 -19.502 1.00 0.00 H new ATOM 0 HE1 TYR A 386 6.667 14.285 -23.401 1.00 0.00 H new ATOM 0 HE2 TYR A 386 9.266 12.146 -20.788 1.00 0.00 H new ATOM 0 HH TYR A 386 8.243 11.211 -22.510 1.00 0.00 H new ATOM 415 N ARG A 387 5.244 16.480 -18.724 1.00 0.00 N ATOM 416 CA ARG A 387 3.856 16.595 -19.115 1.00 0.00 C ATOM 417 C ARG A 387 3.155 17.648 -18.258 1.00 0.00 C ATOM 418 O ARG A 387 3.096 17.527 -17.026 1.00 0.00 O ATOM 419 CB ARG A 387 3.143 15.243 -18.999 1.00 0.00 C ATOM 420 CG ARG A 387 3.846 14.125 -19.775 1.00 0.00 C ATOM 421 CD ARG A 387 4.035 14.479 -21.250 1.00 0.00 C ATOM 422 NE ARG A 387 2.762 14.534 -21.967 1.00 0.00 N ATOM 423 CZ ARG A 387 2.634 14.960 -23.220 1.00 0.00 C ATOM 424 NH1 ARG A 387 3.650 15.510 -23.861 1.00 0.00 N ATOM 425 NH2 ARG A 387 1.455 14.870 -23.836 1.00 0.00 N ATOM 0 H ARG A 387 5.409 15.855 -17.935 1.00 0.00 H new ATOM 0 HA ARG A 387 3.815 16.908 -20.158 1.00 0.00 H new ATOM 0 HB2 ARG A 387 3.078 14.962 -17.948 1.00 0.00 H new ATOM 0 HB3 ARG A 387 2.122 15.345 -19.366 1.00 0.00 H new ATOM 0 HG2 ARG A 387 4.818 13.926 -19.323 1.00 0.00 H new ATOM 0 HG3 ARG A 387 3.264 13.207 -19.695 1.00 0.00 H new ATOM 0 HD2 ARG A 387 4.538 15.443 -21.330 1.00 0.00 H new ATOM 0 HD3 ARG A 387 4.684 13.740 -21.720 1.00 0.00 H new ATOM 0 HE ARG A 387 1.922 14.227 -21.477 1.00 0.00 H new ATOM 0 HH11 ARG A 387 4.551 15.614 -23.395 1.00 0.00 H new ATOM 0 HH12 ARG A 387 3.533 15.831 -24.822 1.00 0.00 H new ATOM 0 HH21 ARG A 387 0.652 14.475 -23.346 1.00 0.00 H new ATOM 0 HH22 ARG A 387 1.356 15.196 -24.797 1.00 0.00 H new ATOM 439 N LYS A 388 2.646 18.677 -18.909 1.00 0.00 N ATOM 440 CA LYS A 388 1.978 19.792 -18.242 1.00 0.00 C ATOM 441 C LYS A 388 0.566 19.929 -18.778 1.00 0.00 C ATOM 442 O LYS A 388 -0.155 20.883 -18.455 1.00 0.00 O ATOM 443 CB LYS A 388 2.765 21.100 -18.435 1.00 0.00 C ATOM 444 CG LYS A 388 3.260 21.363 -19.856 1.00 0.00 C ATOM 445 CD LYS A 388 4.524 20.562 -20.152 1.00 0.00 C ATOM 446 CE LYS A 388 4.987 20.781 -21.589 1.00 0.00 C ATOM 447 NZ LYS A 388 6.221 20.011 -21.867 1.00 0.00 N ATOM 0 H LYS A 388 2.682 18.769 -19.924 1.00 0.00 H new ATOM 0 HA LYS A 388 1.935 19.589 -17.172 1.00 0.00 H new ATOM 0 HB2 LYS A 388 2.133 21.933 -18.129 1.00 0.00 H new ATOM 0 HB3 LYS A 388 3.625 21.089 -17.765 1.00 0.00 H new ATOM 0 HG2 LYS A 388 2.481 21.098 -20.571 1.00 0.00 H new ATOM 0 HG3 LYS A 388 3.461 22.427 -19.984 1.00 0.00 H new ATOM 0 HD2 LYS A 388 5.315 20.857 -19.463 1.00 0.00 H new ATOM 0 HD3 LYS A 388 4.334 19.502 -19.985 1.00 0.00 H new ATOM 0 HE2 LYS A 388 4.200 20.477 -22.280 1.00 0.00 H new ATOM 0 HE3 LYS A 388 5.169 21.842 -21.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 6.424 20.037 -22.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 7.017 20.430 -21.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 6.090 19.024 -21.565 1.00 0.00 H new ATOM 461 N ASN A 389 0.175 18.973 -19.628 1.00 0.00 N ATOM 462 CA ASN A 389 -1.171 18.891 -20.150 1.00 0.00 C ATOM 463 C ASN A 389 -2.142 18.634 -18.998 1.00 0.00 C ATOM 464 O ASN A 389 -1.876 17.779 -18.146 1.00 0.00 O ATOM 465 CB ASN A 389 -1.255 17.786 -21.219 1.00 0.00 C ATOM 466 CG ASN A 389 -0.663 16.473 -20.748 1.00 0.00 C ATOM 467 OD1 ASN A 389 0.553 16.266 -20.848 1.00 0.00 O ATOM 468 ND2 ASN A 389 -1.503 15.561 -20.289 1.00 0.00 N ATOM 0 H ASN A 389 0.794 18.237 -19.967 1.00 0.00 H new ATOM 0 HA ASN A 389 -1.445 19.832 -20.627 1.00 0.00 H new ATOM 0 HB2 ASN A 389 -2.298 17.632 -21.495 1.00 0.00 H new ATOM 0 HB3 ASN A 389 -0.732 18.114 -22.117 1.00 0.00 H new ATOM 0 HD21 ASN A 389 -1.155 14.646 -20.001 1.00 0.00 H new ATOM 0 HD22 ASN A 389 -2.499 15.772 -20.223 1.00 0.00 H new ATOM 475 N PRO A 390 -3.297 19.339 -18.981 1.00 0.00 N ATOM 476 CA PRO A 390 -4.237 19.329 -17.851 1.00 0.00 C ATOM 477 C PRO A 390 -4.578 17.917 -17.387 1.00 0.00 C ATOM 478 O PRO A 390 -4.800 17.678 -16.198 1.00 0.00 O ATOM 479 CB PRO A 390 -5.490 20.045 -18.411 1.00 0.00 C ATOM 480 CG PRO A 390 -5.267 20.135 -19.885 1.00 0.00 C ATOM 481 CD PRO A 390 -3.781 20.181 -20.075 1.00 0.00 C ATOM 0 HA PRO A 390 -3.818 19.816 -16.970 1.00 0.00 H new ATOM 0 HB2 PRO A 390 -6.397 19.485 -18.184 1.00 0.00 H new ATOM 0 HB3 PRO A 390 -5.607 21.035 -17.970 1.00 0.00 H new ATOM 0 HG2 PRO A 390 -5.700 19.276 -20.398 1.00 0.00 H new ATOM 0 HG3 PRO A 390 -5.741 21.025 -20.298 1.00 0.00 H new ATOM 0 HD2 PRO A 390 -3.484 19.792 -21.049 1.00 0.00 H new ATOM 0 HD3 PRO A 390 -3.394 21.198 -20.007 1.00 0.00 H new ATOM 489 N VAL A 391 -4.612 16.982 -18.326 1.00 0.00 N ATOM 490 CA VAL A 391 -4.983 15.612 -18.038 1.00 0.00 C ATOM 491 C VAL A 391 -3.953 14.955 -17.122 1.00 0.00 C ATOM 492 O VAL A 391 -4.311 14.150 -16.270 1.00 0.00 O ATOM 493 CB VAL A 391 -5.167 14.774 -19.336 1.00 0.00 C ATOM 494 CG1 VAL A 391 -5.320 13.273 -19.039 1.00 0.00 C ATOM 495 CG2 VAL A 391 -6.392 15.302 -20.110 1.00 0.00 C ATOM 0 H VAL A 391 -4.383 17.155 -19.305 1.00 0.00 H new ATOM 0 HA VAL A 391 -5.945 15.639 -17.525 1.00 0.00 H new ATOM 0 HB VAL A 391 -4.269 14.884 -19.944 1.00 0.00 H new ATOM 0 HG11 VAL A 391 -5.446 12.728 -19.975 1.00 0.00 H new ATOM 0 HG12 VAL A 391 -4.429 12.911 -18.525 1.00 0.00 H new ATOM 0 HG13 VAL A 391 -6.193 13.114 -18.406 1.00 0.00 H new ATOM 0 HG21 VAL A 391 -6.526 14.719 -21.021 1.00 0.00 H new ATOM 0 HG22 VAL A 391 -7.282 15.212 -19.487 1.00 0.00 H new ATOM 0 HG23 VAL A 391 -6.235 16.349 -20.370 1.00 0.00 H new ATOM 505 N HIS A 392 -2.683 15.299 -17.275 1.00 0.00 N ATOM 506 CA HIS A 392 -1.630 14.697 -16.435 1.00 0.00 C ATOM 507 C HIS A 392 -1.931 14.940 -14.956 1.00 0.00 C ATOM 508 O HIS A 392 -1.621 14.096 -14.114 1.00 0.00 O ATOM 509 CB HIS A 392 -0.260 15.266 -16.814 1.00 0.00 C ATOM 510 CG HIS A 392 0.866 14.701 -16.002 1.00 0.00 C ATOM 511 ND1 HIS A 392 1.228 13.369 -15.985 1.00 0.00 N ATOM 512 CD2 HIS A 392 1.717 15.326 -15.147 1.00 0.00 C ATOM 513 CE1 HIS A 392 2.240 13.226 -15.117 1.00 0.00 C ATOM 514 NE2 HIS A 392 2.584 14.385 -14.581 1.00 0.00 N ATOM 0 H HIS A 392 -2.349 15.979 -17.958 1.00 0.00 H new ATOM 0 HA HIS A 392 -1.612 13.621 -16.608 1.00 0.00 H new ATOM 0 HB2 HIS A 392 -0.072 15.068 -17.869 1.00 0.00 H new ATOM 0 HB3 HIS A 392 -0.278 16.349 -16.692 1.00 0.00 H new ATOM 0 HD1 HIS A 392 0.801 12.624 -16.536 1.00 0.00 H new ATOM 0 HD2 HIS A 392 1.723 16.385 -14.937 1.00 0.00 H new ATOM 0 HE1 HIS A 392 2.714 12.284 -14.885 1.00 0.00 H new ATOM 522 N PHE A 393 -2.566 16.069 -14.659 1.00 0.00 N ATOM 523 CA PHE A 393 -2.843 16.468 -13.276 1.00 0.00 C ATOM 524 C PHE A 393 -4.199 15.931 -12.782 1.00 0.00 C ATOM 525 O PHE A 393 -4.471 15.991 -11.593 1.00 0.00 O ATOM 526 CB PHE A 393 -2.820 18.003 -13.173 1.00 0.00 C ATOM 527 CG PHE A 393 -1.557 18.632 -13.674 1.00 0.00 C ATOM 528 CD1 PHE A 393 -0.398 18.598 -12.920 1.00 0.00 C ATOM 529 CD2 PHE A 393 -1.514 19.251 -14.902 1.00 0.00 C ATOM 530 CE1 PHE A 393 0.778 19.162 -13.370 1.00 0.00 C ATOM 531 CE2 PHE A 393 -0.350 19.829 -15.372 1.00 0.00 C ATOM 532 CZ PHE A 393 0.798 19.782 -14.602 1.00 0.00 C ATOM 0 H PHE A 393 -2.902 16.730 -15.359 1.00 0.00 H new ATOM 0 HA PHE A 393 -2.069 16.037 -12.641 1.00 0.00 H new ATOM 0 HB2 PHE A 393 -3.662 18.407 -13.736 1.00 0.00 H new ATOM 0 HB3 PHE A 393 -2.967 18.288 -12.131 1.00 0.00 H new ATOM 0 HD1 PHE A 393 -0.414 18.117 -11.953 1.00 0.00 H new ATOM 0 HD2 PHE A 393 -2.406 19.286 -15.510 1.00 0.00 H new ATOM 0 HE1 PHE A 393 1.672 19.119 -12.765 1.00 0.00 H new ATOM 0 HE2 PHE A 393 -0.337 20.315 -16.336 1.00 0.00 H new ATOM 0 HZ PHE A 393 1.711 20.231 -14.966 1.00 0.00 H new ATOM 542 N GLN A 394 -5.009 15.388 -13.688 1.00 0.00 N ATOM 543 CA GLN A 394 -6.357 14.938 -13.312 1.00 0.00 C ATOM 544 C GLN A 394 -6.318 13.538 -12.688 1.00 0.00 C ATOM 545 O GLN A 394 -7.308 13.096 -12.092 1.00 0.00 O ATOM 546 CB GLN A 394 -7.329 14.993 -14.514 1.00 0.00 C ATOM 547 CG GLN A 394 -7.189 13.853 -15.524 1.00 0.00 C ATOM 548 CD GLN A 394 -8.070 12.642 -15.237 1.00 0.00 C ATOM 549 OE1 GLN A 394 -7.646 11.689 -14.590 1.00 0.00 O ATOM 550 NE2 GLN A 394 -9.304 12.676 -15.710 1.00 0.00 N ATOM 0 H GLN A 394 -4.767 15.249 -14.669 1.00 0.00 H new ATOM 0 HA GLN A 394 -6.736 15.627 -12.557 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -8.350 14.995 -14.134 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -7.181 15.938 -15.036 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -7.428 14.233 -16.517 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -6.148 13.531 -15.548 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -9.623 13.484 -16.244 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -9.937 11.894 -15.541 1.00 0.00 H new ATOM 559 N HIS A 395 -5.192 12.852 -12.810 1.00 0.00 N ATOM 560 CA HIS A 395 -5.033 11.521 -12.202 1.00 0.00 C ATOM 561 C HIS A 395 -3.758 11.426 -11.368 1.00 0.00 C ATOM 562 O HIS A 395 -3.668 10.611 -10.451 1.00 0.00 O ATOM 563 CB HIS A 395 -5.080 10.396 -13.270 1.00 0.00 C ATOM 564 CG HIS A 395 -4.190 10.595 -14.452 1.00 0.00 C ATOM 565 ND1 HIS A 395 -3.189 9.714 -14.797 1.00 0.00 N ATOM 566 CD2 HIS A 395 -4.162 11.571 -15.379 1.00 0.00 C ATOM 567 CE1 HIS A 395 -2.586 10.155 -15.883 1.00 0.00 C ATOM 568 NE2 HIS A 395 -3.154 11.279 -16.258 1.00 0.00 N ATOM 0 H HIS A 395 -4.373 13.184 -13.320 1.00 0.00 H new ATOM 0 HA HIS A 395 -5.878 11.379 -11.529 1.00 0.00 H new ATOM 0 HB2 HIS A 395 -4.814 9.453 -12.792 1.00 0.00 H new ATOM 0 HB3 HIS A 395 -6.107 10.296 -13.623 1.00 0.00 H new ATOM 0 HD1 HIS A 395 -2.953 8.859 -14.294 1.00 0.00 H new ATOM 0 HD2 HIS A 395 -4.816 12.429 -15.421 1.00 0.00 H new ATOM 0 HE1 HIS A 395 -1.760 9.671 -16.383 1.00 0.00 H new ATOM 577 N PHE A 396 -2.770 12.278 -11.661 1.00 0.00 N ATOM 578 CA PHE A 396 -1.545 12.341 -10.858 1.00 0.00 C ATOM 579 C PHE A 396 -1.311 13.765 -10.313 1.00 0.00 C ATOM 580 O PHE A 396 -1.306 14.743 -11.060 1.00 0.00 O ATOM 581 CB PHE A 396 -0.323 11.900 -11.686 1.00 0.00 C ATOM 582 CG PHE A 396 -0.254 10.398 -11.919 1.00 0.00 C ATOM 583 CD1 PHE A 396 -0.996 9.793 -12.913 1.00 0.00 C ATOM 584 CD2 PHE A 396 0.559 9.596 -11.117 1.00 0.00 C ATOM 585 CE1 PHE A 396 -0.938 8.425 -13.120 1.00 0.00 C ATOM 586 CE2 PHE A 396 0.617 8.232 -11.314 1.00 0.00 C ATOM 587 CZ PHE A 396 -0.133 7.645 -12.314 1.00 0.00 C ATOM 0 H PHE A 396 -2.794 12.931 -12.445 1.00 0.00 H new ATOM 0 HA PHE A 396 -1.671 11.659 -10.017 1.00 0.00 H new ATOM 0 HB2 PHE A 396 -0.346 12.408 -12.650 1.00 0.00 H new ATOM 0 HB3 PHE A 396 0.585 12.222 -11.177 1.00 0.00 H new ATOM 0 HD1 PHE A 396 -1.634 10.398 -13.541 1.00 0.00 H new ATOM 0 HD2 PHE A 396 1.149 10.048 -10.334 1.00 0.00 H new ATOM 0 HE1 PHE A 396 -1.520 7.970 -13.908 1.00 0.00 H new ATOM 0 HE2 PHE A 396 1.250 7.623 -10.686 1.00 0.00 H new ATOM 0 HZ PHE A 396 -0.090 6.577 -12.465 1.00 0.00 H new ATOM 597 N SER A 397 -1.116 13.851 -8.995 1.00 0.00 N ATOM 598 CA SER A 397 -0.743 15.084 -8.317 1.00 0.00 C ATOM 599 C SER A 397 0.770 15.269 -8.311 1.00 0.00 C ATOM 600 O SER A 397 1.502 14.315 -8.585 1.00 0.00 O ATOM 601 CB SER A 397 -1.279 15.095 -6.874 1.00 0.00 C ATOM 602 OG SER A 397 -2.686 15.216 -6.850 1.00 0.00 O ATOM 0 H SER A 397 -1.215 13.054 -8.366 1.00 0.00 H new ATOM 0 HA SER A 397 -1.191 15.913 -8.866 1.00 0.00 H new ATOM 0 HB2 SER A 397 -0.982 14.177 -6.367 1.00 0.00 H new ATOM 0 HB3 SER A 397 -0.831 15.923 -6.324 1.00 0.00 H new ATOM 0 HG SER A 397 -2.931 16.153 -6.703 1.00 0.00 H new ATOM 608 N HIS A 398 1.231 16.462 -7.985 1.00 0.00 N ATOM 609 CA HIS A 398 2.642 16.809 -8.058 1.00 0.00 C ATOM 610 C HIS A 398 3.100 17.492 -6.761 1.00 0.00 C ATOM 611 O HIS A 398 2.272 17.977 -6.006 1.00 0.00 O ATOM 612 CB HIS A 398 2.875 17.725 -9.276 1.00 0.00 C ATOM 613 CG HIS A 398 2.616 17.022 -10.561 1.00 0.00 C ATOM 614 ND1 HIS A 398 1.387 16.506 -10.915 1.00 0.00 N ATOM 615 CD2 HIS A 398 3.485 16.632 -11.515 1.00 0.00 C ATOM 616 CE1 HIS A 398 1.559 15.807 -12.033 1.00 0.00 C ATOM 617 NE2 HIS A 398 2.804 15.844 -12.450 1.00 0.00 N ATOM 0 H HIS A 398 0.635 17.224 -7.660 1.00 0.00 H new ATOM 0 HA HIS A 398 3.233 15.901 -8.177 1.00 0.00 H new ATOM 0 HB2 HIS A 398 2.225 18.597 -9.203 1.00 0.00 H new ATOM 0 HB3 HIS A 398 3.902 18.090 -9.263 1.00 0.00 H new ATOM 0 HD1 HIS A 398 0.509 16.636 -10.412 1.00 0.00 H new ATOM 0 HD2 HIS A 398 4.534 16.886 -11.552 1.00 0.00 H new ATOM 0 HE1 HIS A 398 0.769 15.272 -12.538 1.00 0.00 H new ATOM 625 N PRO A 399 4.427 17.488 -6.482 1.00 0.00 N ATOM 626 CA PRO A 399 4.980 18.118 -5.277 1.00 0.00 C ATOM 627 C PRO A 399 4.585 19.594 -5.172 1.00 0.00 C ATOM 628 O PRO A 399 5.185 20.457 -5.811 1.00 0.00 O ATOM 629 CB PRO A 399 6.504 17.971 -5.460 1.00 0.00 C ATOM 630 CG PRO A 399 6.690 17.681 -6.906 1.00 0.00 C ATOM 631 CD PRO A 399 5.480 16.889 -7.305 1.00 0.00 C ATOM 0 HA PRO A 399 4.608 17.657 -4.362 1.00 0.00 H new ATOM 0 HB2 PRO A 399 7.026 18.883 -5.170 1.00 0.00 H new ATOM 0 HB3 PRO A 399 6.900 17.166 -4.841 1.00 0.00 H new ATOM 0 HG2 PRO A 399 6.768 18.601 -7.486 1.00 0.00 H new ATOM 0 HG3 PRO A 399 7.606 17.116 -7.080 1.00 0.00 H new ATOM 0 HD2 PRO A 399 5.266 16.983 -8.370 1.00 0.00 H new ATOM 0 HD3 PRO A 399 5.603 15.826 -7.097 1.00 0.00 H new ATOM 639 N GLY A 400 3.540 19.850 -4.391 1.00 0.00 N ATOM 640 CA GLY A 400 2.983 21.184 -4.264 1.00 0.00 C ATOM 641 C GLY A 400 1.477 21.156 -4.338 1.00 0.00 C ATOM 642 O GLY A 400 0.786 21.967 -3.729 1.00 0.00 O ATOM 0 H GLY A 400 3.062 19.142 -3.834 1.00 0.00 H new ATOM 0 HA2 GLY A 400 3.295 21.622 -3.316 1.00 0.00 H new ATOM 0 HA3 GLY A 400 3.377 21.822 -5.055 1.00 0.00 H new ATOM 646 N ASP A 401 0.970 20.185 -5.087 1.00 0.00 N ATOM 647 CA ASP A 401 -0.461 19.962 -5.237 1.00 0.00 C ATOM 648 C ASP A 401 -1.055 19.513 -3.900 1.00 0.00 C ATOM 649 O ASP A 401 -0.426 18.762 -3.154 1.00 0.00 O ATOM 650 CB ASP A 401 -0.717 18.899 -6.321 1.00 0.00 C ATOM 651 CG ASP A 401 -2.182 18.696 -6.637 1.00 0.00 C ATOM 652 OD1 ASP A 401 -2.836 17.879 -5.949 1.00 0.00 O ATOM 653 OD2 ASP A 401 -2.691 19.308 -7.597 1.00 0.00 O ATOM 0 H ASP A 401 1.545 19.526 -5.611 1.00 0.00 H new ATOM 0 HA ASP A 401 -0.941 20.892 -5.542 1.00 0.00 H new ATOM 0 HB2 ASP A 401 -0.194 19.189 -7.233 1.00 0.00 H new ATOM 0 HB3 ASP A 401 -0.289 17.951 -5.996 1.00 0.00 H new ATOM 658 N SER A 402 -2.264 19.968 -3.618 1.00 0.00 N ATOM 659 CA SER A 402 -2.923 19.724 -2.323 1.00 0.00 C ATOM 660 C SER A 402 -3.212 18.232 -2.099 1.00 0.00 C ATOM 661 O SER A 402 -3.430 17.800 -0.963 1.00 0.00 O ATOM 662 CB SER A 402 -4.223 20.532 -2.247 1.00 0.00 C ATOM 663 OG SER A 402 -4.767 20.536 -0.941 1.00 0.00 O ATOM 0 H SER A 402 -2.824 20.516 -4.270 1.00 0.00 H new ATOM 0 HA SER A 402 -2.243 20.045 -1.534 1.00 0.00 H new ATOM 0 HB2 SER A 402 -4.032 21.557 -2.564 1.00 0.00 H new ATOM 0 HB3 SER A 402 -4.951 20.114 -2.942 1.00 0.00 H new ATOM 0 HG SER A 402 -5.594 21.062 -0.933 1.00 0.00 H new ATOM 669 N ASP A 403 -3.183 17.445 -3.174 1.00 0.00 N ATOM 670 CA ASP A 403 -3.552 16.016 -3.114 1.00 0.00 C ATOM 671 C ASP A 403 -2.327 15.128 -3.262 1.00 0.00 C ATOM 672 O ASP A 403 -2.450 13.905 -3.373 1.00 0.00 O ATOM 673 CB ASP A 403 -4.567 15.678 -4.205 1.00 0.00 C ATOM 674 CG ASP A 403 -5.916 16.323 -3.955 1.00 0.00 C ATOM 675 OD1 ASP A 403 -6.074 17.542 -4.240 1.00 0.00 O ATOM 676 OD2 ASP A 403 -6.841 15.633 -3.468 1.00 0.00 O ATOM 0 H ASP A 403 -2.908 17.766 -4.102 1.00 0.00 H new ATOM 0 HA ASP A 403 -4.000 15.830 -2.138 1.00 0.00 H new ATOM 0 HB2 ASP A 403 -4.183 16.007 -5.170 1.00 0.00 H new ATOM 0 HB3 ASP A 403 -4.689 14.596 -4.262 1.00 0.00 H new ATOM 681 N TYR A 404 -1.141 15.728 -3.263 1.00 0.00 N ATOM 682 CA TYR A 404 0.097 14.969 -3.364 1.00 0.00 C ATOM 683 C TYR A 404 0.555 14.521 -1.989 1.00 0.00 C ATOM 684 O TYR A 404 0.679 15.352 -1.080 1.00 0.00 O ATOM 685 CB TYR A 404 1.202 15.804 -4.028 1.00 0.00 C ATOM 686 CG TYR A 404 2.464 15.006 -4.360 1.00 0.00 C ATOM 687 CD1 TYR A 404 2.584 14.354 -5.581 1.00 0.00 C ATOM 688 CD2 TYR A 404 3.529 14.922 -3.462 1.00 0.00 C ATOM 689 CE1 TYR A 404 3.730 13.644 -5.906 1.00 0.00 C ATOM 690 CE2 TYR A 404 4.682 14.221 -3.766 1.00 0.00 C ATOM 691 CZ TYR A 404 4.769 13.583 -5.002 1.00 0.00 C ATOM 692 OH TYR A 404 5.913 12.886 -5.330 1.00 0.00 O ATOM 0 H TYR A 404 -1.013 16.738 -3.195 1.00 0.00 H new ATOM 0 HA TYR A 404 -0.097 14.093 -3.983 1.00 0.00 H new ATOM 0 HB2 TYR A 404 0.810 16.244 -4.945 1.00 0.00 H new ATOM 0 HB3 TYR A 404 1.468 16.629 -3.367 1.00 0.00 H new ATOM 0 HD1 TYR A 404 1.770 14.401 -6.290 1.00 0.00 H new ATOM 0 HD2 TYR A 404 3.451 15.417 -2.505 1.00 0.00 H new ATOM 0 HE1 TYR A 404 3.808 13.143 -6.860 1.00 0.00 H new ATOM 0 HE2 TYR A 404 5.498 14.169 -3.060 1.00 0.00 H new ATOM 0 HH TYR A 404 6.083 12.198 -4.653 1.00 0.00 H new ATOM 702 N GLY A 405 0.820 13.229 -1.838 1.00 0.00 N ATOM 703 CA GLY A 405 1.240 12.682 -0.562 1.00 0.00 C ATOM 704 C GLY A 405 2.518 11.907 -0.689 1.00 0.00 C ATOM 705 O GLY A 405 3.426 12.049 0.141 1.00 0.00 O ATOM 0 H GLY A 405 0.750 12.542 -2.589 1.00 0.00 H new ATOM 0 HA2 GLY A 405 1.374 13.492 0.155 1.00 0.00 H new ATOM 0 HA3 GLY A 405 0.458 12.033 -0.168 1.00 0.00 H new ATOM 709 N GLY A 406 2.626 11.095 -1.728 1.00 0.00 N ATOM 710 CA GLY A 406 3.792 10.266 -1.931 1.00 0.00 C ATOM 711 C GLY A 406 3.651 8.928 -1.265 1.00 0.00 C ATOM 712 O GLY A 406 4.662 8.281 -0.948 1.00 0.00 O ATOM 0 H GLY A 406 1.910 10.996 -2.448 1.00 0.00 H new ATOM 0 HA2 GLY A 406 3.955 10.124 -2.999 1.00 0.00 H new ATOM 0 HA3 GLY A 406 4.672 10.776 -1.539 1.00 0.00 H new ATOM 716 N VAL A 407 2.415 8.485 -1.072 1.00 0.00 N ATOM 717 CA VAL A 407 2.130 7.207 -0.410 1.00 0.00 C ATOM 718 C VAL A 407 2.481 6.042 -1.341 1.00 0.00 C ATOM 719 O VAL A 407 2.599 4.915 -0.926 1.00 0.00 O ATOM 720 CB VAL A 407 0.636 7.101 0.011 1.00 0.00 C ATOM 721 CG1 VAL A 407 0.264 8.264 0.903 1.00 0.00 C ATOM 722 CG2 VAL A 407 -0.275 7.045 -1.226 1.00 0.00 C ATOM 0 H VAL A 407 1.582 8.995 -1.366 1.00 0.00 H new ATOM 0 HA VAL A 407 2.743 7.158 0.490 1.00 0.00 H new ATOM 0 HB VAL A 407 0.496 6.177 0.571 1.00 0.00 H new ATOM 0 HG11 VAL A 407 -0.784 8.180 1.192 1.00 0.00 H new ATOM 0 HG12 VAL A 407 0.889 8.252 1.796 1.00 0.00 H new ATOM 0 HG13 VAL A 407 0.418 9.199 0.365 1.00 0.00 H new ATOM 0 HG21 VAL A 407 -1.315 6.971 -0.909 1.00 0.00 H new ATOM 0 HG22 VAL A 407 -0.140 7.950 -1.819 1.00 0.00 H new ATOM 0 HG23 VAL A 407 -0.017 6.174 -1.829 1.00 0.00 H new ATOM 732 N GLN A 408 2.630 6.379 -2.609 1.00 0.00 N ATOM 733 CA GLN A 408 3.075 5.415 -3.623 1.00 0.00 C ATOM 734 C GLN A 408 4.573 5.274 -3.575 1.00 0.00 C ATOM 735 O GLN A 408 5.284 6.270 -3.366 1.00 0.00 O ATOM 736 CB GLN A 408 2.653 5.912 -5.016 1.00 0.00 C ATOM 737 CG GLN A 408 2.873 4.892 -6.138 1.00 0.00 C ATOM 738 CD GLN A 408 2.538 5.439 -7.509 1.00 0.00 C ATOM 739 OE1 GLN A 408 2.843 6.701 -7.726 1.00 0.00 O flip ATOM 740 NE2 GLN A 408 2.069 4.706 -8.386 1.00 0.00 N flip ATOM 0 H GLN A 408 2.451 7.315 -2.972 1.00 0.00 H new ATOM 0 HA GLN A 408 2.618 4.446 -3.423 1.00 0.00 H new ATOM 0 HB2 GLN A 408 1.598 6.184 -4.989 1.00 0.00 H new ATOM 0 HB3 GLN A 408 3.210 6.819 -5.250 1.00 0.00 H new ATOM 0 HG2 GLN A 408 3.913 4.567 -6.127 1.00 0.00 H new ATOM 0 HG3 GLN A 408 2.261 4.011 -5.945 1.00 0.00 H new ATOM 0 HE21 GLN A 408 1.847 3.733 -8.173 1.00 0.00 H new ATOM 0 HE22 GLN A 408 1.904 5.073 -9.323 1.00 0.00 H new ATOM 749 N ILE A 409 5.063 4.063 -3.693 1.00 0.00 N ATOM 750 CA ILE A 409 6.521 3.831 -3.785 1.00 0.00 C ATOM 751 C ILE A 409 7.118 4.588 -4.960 1.00 0.00 C ATOM 752 O ILE A 409 8.104 5.315 -4.830 1.00 0.00 O ATOM 753 CB ILE A 409 6.867 2.303 -3.915 1.00 0.00 C ATOM 754 CG1 ILE A 409 6.049 1.662 -5.045 1.00 0.00 C ATOM 755 CG2 ILE A 409 6.661 1.600 -2.583 1.00 0.00 C ATOM 756 CD1 ILE A 409 6.437 0.233 -5.339 1.00 0.00 C ATOM 0 H ILE A 409 4.495 3.216 -3.729 1.00 0.00 H new ATOM 0 HA ILE A 409 6.957 4.202 -2.857 1.00 0.00 H new ATOM 0 HB ILE A 409 7.919 2.194 -4.179 1.00 0.00 H new ATOM 0 HG12 ILE A 409 4.992 1.695 -4.781 1.00 0.00 H new ATOM 0 HG13 ILE A 409 6.170 2.256 -5.951 1.00 0.00 H new ATOM 0 HG21 ILE A 409 6.904 0.543 -2.688 1.00 0.00 H new ATOM 0 HG22 ILE A 409 7.310 2.049 -1.831 1.00 0.00 H new ATOM 0 HG23 ILE A 409 5.621 1.704 -2.274 1.00 0.00 H new ATOM 0 HD11 ILE A 409 5.817 -0.153 -6.148 1.00 0.00 H new ATOM 0 HD12 ILE A 409 7.485 0.194 -5.635 1.00 0.00 H new ATOM 0 HD13 ILE A 409 6.289 -0.375 -4.447 1.00 0.00 H new ATOM 768 N VAL A 410 6.465 4.458 -6.102 1.00 0.00 N ATOM 769 CA VAL A 410 6.939 5.095 -7.342 1.00 0.00 C ATOM 770 C VAL A 410 6.712 6.615 -7.296 1.00 0.00 C ATOM 771 O VAL A 410 5.601 7.084 -7.085 1.00 0.00 O ATOM 772 CB VAL A 410 6.218 4.515 -8.610 1.00 0.00 C ATOM 773 CG1 VAL A 410 6.839 5.069 -9.867 1.00 0.00 C ATOM 774 CG2 VAL A 410 6.282 2.981 -8.577 1.00 0.00 C ATOM 0 H VAL A 410 5.605 3.920 -6.207 1.00 0.00 H new ATOM 0 HA VAL A 410 8.005 4.881 -7.416 1.00 0.00 H new ATOM 0 HB VAL A 410 5.170 4.816 -8.605 1.00 0.00 H new ATOM 0 HG11 VAL A 410 6.328 4.657 -10.737 1.00 0.00 H new ATOM 0 HG12 VAL A 410 6.745 6.155 -9.871 1.00 0.00 H new ATOM 0 HG13 VAL A 410 7.894 4.796 -9.903 1.00 0.00 H new ATOM 0 HG21 VAL A 410 5.782 2.577 -9.457 1.00 0.00 H new ATOM 0 HG22 VAL A 410 7.324 2.660 -8.573 1.00 0.00 H new ATOM 0 HG23 VAL A 410 5.786 2.615 -7.678 1.00 0.00 H new ATOM 784 N GLY A 411 7.801 7.362 -7.482 1.00 0.00 N ATOM 785 CA GLY A 411 7.742 8.818 -7.398 1.00 0.00 C ATOM 786 C GLY A 411 8.703 9.368 -6.379 1.00 0.00 C ATOM 787 O GLY A 411 9.127 10.528 -6.454 1.00 0.00 O ATOM 0 H GLY A 411 8.726 6.985 -7.690 1.00 0.00 H new ATOM 0 HA2 GLY A 411 7.967 9.246 -8.375 1.00 0.00 H new ATOM 0 HA3 GLY A 411 6.728 9.125 -7.141 1.00 0.00 H new ATOM 791 N GLN A 412 9.029 8.528 -5.400 1.00 0.00 N ATOM 792 CA GLN A 412 9.974 8.888 -4.344 1.00 0.00 C ATOM 793 C GLN A 412 11.103 7.860 -4.291 1.00 0.00 C ATOM 794 O GLN A 412 12.273 8.207 -4.355 1.00 0.00 O ATOM 795 CB GLN A 412 9.272 8.985 -2.962 1.00 0.00 C ATOM 796 CG GLN A 412 7.816 8.504 -2.935 1.00 0.00 C ATOM 797 CD GLN A 412 6.861 9.451 -3.650 1.00 0.00 C ATOM 798 OE1 GLN A 412 7.067 10.662 -3.693 1.00 0.00 O ATOM 799 NE2 GLN A 412 5.822 8.885 -4.261 1.00 0.00 N ATOM 0 H GLN A 412 8.649 7.585 -5.315 1.00 0.00 H new ATOM 0 HA GLN A 412 10.386 9.870 -4.576 1.00 0.00 H new ATOM 0 HB2 GLN A 412 9.844 8.402 -2.240 1.00 0.00 H new ATOM 0 HB3 GLN A 412 9.302 10.023 -2.629 1.00 0.00 H new ATOM 0 HG2 GLN A 412 7.756 7.519 -3.398 1.00 0.00 H new ATOM 0 HG3 GLN A 412 7.497 8.389 -1.899 1.00 0.00 H new ATOM 0 HE21 GLN A 412 5.684 7.876 -4.203 1.00 0.00 H new ATOM 0 HE22 GLN A 412 5.164 9.460 -4.787 1.00 0.00 H new ATOM 808 N ASP A 413 10.725 6.583 -4.180 1.00 0.00 N ATOM 809 CA ASP A 413 11.675 5.480 -4.190 1.00 0.00 C ATOM 810 C ASP A 413 10.944 4.154 -4.263 1.00 0.00 C ATOM 811 O ASP A 413 10.050 3.877 -3.445 1.00 0.00 O ATOM 812 CB ASP A 413 12.575 5.496 -2.962 1.00 0.00 C ATOM 813 CG ASP A 413 13.375 4.205 -2.829 1.00 0.00 C ATOM 814 OD1 ASP A 413 14.182 3.897 -3.727 1.00 0.00 O ATOM 815 OD2 ASP A 413 13.188 3.492 -1.822 1.00 0.00 O ATOM 0 H ASP A 413 9.753 6.291 -4.081 1.00 0.00 H new ATOM 0 HA ASP A 413 12.302 5.603 -5.073 1.00 0.00 H new ATOM 0 HB2 ASP A 413 13.259 6.343 -3.024 1.00 0.00 H new ATOM 0 HB3 ASP A 413 11.968 5.641 -2.068 1.00 0.00 H new ATOM 820 N GLU A 414 11.324 3.342 -5.229 1.00 0.00 N ATOM 821 CA GLU A 414 10.627 2.083 -5.529 1.00 0.00 C ATOM 822 C GLU A 414 11.304 0.894 -4.836 1.00 0.00 C ATOM 823 O GLU A 414 10.724 -0.170 -4.739 1.00 0.00 O ATOM 824 CB GLU A 414 10.586 1.841 -7.048 1.00 0.00 C ATOM 825 CG GLU A 414 9.919 2.954 -7.864 1.00 0.00 C ATOM 826 CD GLU A 414 10.707 4.258 -7.866 1.00 0.00 C ATOM 827 OE1 GLU A 414 11.861 4.254 -8.346 1.00 0.00 O ATOM 828 OE2 GLU A 414 10.168 5.284 -7.413 1.00 0.00 O ATOM 0 H GLU A 414 12.124 3.526 -5.835 1.00 0.00 H new ATOM 0 HA GLU A 414 9.609 2.170 -5.150 1.00 0.00 H new ATOM 0 HB2 GLU A 414 11.607 1.710 -7.407 1.00 0.00 H new ATOM 0 HB3 GLU A 414 10.058 0.906 -7.238 1.00 0.00 H new ATOM 0 HG2 GLU A 414 9.791 2.614 -8.892 1.00 0.00 H new ATOM 0 HG3 GLU A 414 8.923 3.141 -7.463 1.00 0.00 H new ATOM 835 N THR A 415 12.536 1.093 -4.352 1.00 0.00 N ATOM 836 CA THR A 415 13.320 -0.009 -3.784 1.00 0.00 C ATOM 837 C THR A 415 12.899 -0.343 -2.348 1.00 0.00 C ATOM 838 O THR A 415 12.500 0.545 -1.593 1.00 0.00 O ATOM 839 CB THR A 415 14.833 0.313 -3.788 1.00 0.00 C ATOM 840 OG1 THR A 415 15.124 1.416 -2.904 1.00 0.00 O ATOM 841 CG2 THR A 415 15.320 0.630 -5.188 1.00 0.00 C ATOM 0 H THR A 415 13.007 1.998 -4.342 1.00 0.00 H new ATOM 0 HA THR A 415 13.123 -0.872 -4.420 1.00 0.00 H new ATOM 0 HB THR A 415 15.360 -0.572 -3.431 1.00 0.00 H new ATOM 0 HG1 THR A 415 14.884 2.259 -3.342 1.00 0.00 H new ATOM 0 HG21 THR A 415 16.387 0.852 -5.161 1.00 0.00 H new ATOM 0 HG22 THR A 415 15.145 -0.228 -5.837 1.00 0.00 H new ATOM 0 HG23 THR A 415 14.779 1.494 -5.574 1.00 0.00 H new ATOM 849 N ASP A 416 12.969 -1.616 -2.008 1.00 0.00 N ATOM 850 CA ASP A 416 12.723 -2.072 -0.642 1.00 0.00 C ATOM 851 C ASP A 416 14.041 -2.121 0.127 1.00 0.00 C ATOM 852 O ASP A 416 14.187 -1.470 1.157 1.00 0.00 O ATOM 853 CB ASP A 416 12.085 -3.452 -0.663 1.00 0.00 C ATOM 854 CG ASP A 416 11.822 -4.013 0.731 1.00 0.00 C ATOM 855 OD1 ASP A 416 10.788 -3.664 1.342 1.00 0.00 O ATOM 856 OD2 ASP A 416 12.634 -4.834 1.213 1.00 0.00 O ATOM 0 H ASP A 416 13.196 -2.364 -2.663 1.00 0.00 H new ATOM 0 HA ASP A 416 12.044 -1.376 -0.149 1.00 0.00 H new ATOM 0 HB2 ASP A 416 11.144 -3.402 -1.211 1.00 0.00 H new ATOM 0 HB3 ASP A 416 12.735 -4.138 -1.207 1.00 0.00 H new ATOM 861 N ASP A 417 14.992 -2.881 -0.396 1.00 0.00 N ATOM 862 CA ASP A 417 16.351 -2.962 0.180 1.00 0.00 C ATOM 863 C ASP A 417 17.396 -2.743 -0.915 1.00 0.00 C ATOM 864 O ASP A 417 18.514 -2.300 -0.661 1.00 0.00 O ATOM 865 CB ASP A 417 16.551 -4.332 0.833 1.00 0.00 C ATOM 866 CG ASP A 417 17.985 -4.560 1.303 1.00 0.00 C ATOM 867 OD1 ASP A 417 18.395 -3.961 2.318 1.00 0.00 O ATOM 868 OD2 ASP A 417 18.695 -5.360 0.653 1.00 0.00 O ATOM 0 H ASP A 417 14.858 -3.460 -1.225 1.00 0.00 H new ATOM 0 HA ASP A 417 16.468 -2.186 0.936 1.00 0.00 H new ATOM 0 HB2 ASP A 417 15.876 -4.426 1.683 1.00 0.00 H new ATOM 0 HB3 ASP A 417 16.278 -5.112 0.122 1.00 0.00 H new ATOM 873 N ARG A 418 17.001 -3.038 -2.148 1.00 0.00 N ATOM 874 CA ARG A 418 17.887 -2.993 -3.304 1.00 0.00 C ATOM 875 C ARG A 418 17.057 -2.760 -4.561 1.00 0.00 C ATOM 876 O ARG A 418 15.818 -2.897 -4.514 1.00 0.00 O ATOM 877 CB ARG A 418 18.670 -4.309 -3.406 1.00 0.00 C ATOM 878 CG ARG A 418 17.791 -5.545 -3.306 1.00 0.00 C ATOM 879 CD ARG A 418 18.590 -6.829 -3.378 1.00 0.00 C ATOM 880 NE ARG A 418 17.737 -7.980 -3.083 1.00 0.00 N ATOM 881 CZ ARG A 418 18.071 -9.241 -3.308 1.00 0.00 C ATOM 882 NH1 ARG A 418 19.271 -9.570 -3.781 1.00 0.00 N ATOM 883 NH2 ARG A 418 17.202 -10.200 -3.043 1.00 0.00 N ATOM 0 H ARG A 418 16.047 -3.318 -2.375 1.00 0.00 H new ATOM 0 HA ARG A 418 18.600 -2.176 -3.195 1.00 0.00 H new ATOM 0 HB2 ARG A 418 19.208 -4.331 -4.354 1.00 0.00 H new ATOM 0 HB3 ARG A 418 19.419 -4.340 -2.614 1.00 0.00 H new ATOM 0 HG2 ARG A 418 17.236 -5.518 -2.368 1.00 0.00 H new ATOM 0 HG3 ARG A 418 17.057 -5.531 -4.112 1.00 0.00 H new ATOM 0 HD2 ARG A 418 19.027 -6.937 -4.371 1.00 0.00 H new ATOM 0 HD3 ARG A 418 19.417 -6.790 -2.669 1.00 0.00 H new ATOM 0 HE ARG A 418 16.820 -7.798 -2.675 1.00 0.00 H new ATOM 0 HH11 ARG A 418 19.958 -8.843 -3.979 1.00 0.00 H new ATOM 0 HH12 ARG A 418 19.503 -10.549 -3.946 1.00 0.00 H new ATOM 0 HH21 ARG A 418 16.283 -9.966 -2.668 1.00 0.00 H new ATOM 0 HH22 ARG A 418 17.450 -11.175 -3.213 1.00 0.00 H new ATOM 897 N PRO A 419 17.676 -2.390 -5.692 1.00 0.00 N ATOM 898 CA PRO A 419 16.962 -2.167 -6.956 1.00 0.00 C ATOM 899 C PRO A 419 16.372 -3.458 -7.533 1.00 0.00 C ATOM 900 O PRO A 419 16.964 -4.533 -7.387 1.00 0.00 O ATOM 901 CB PRO A 419 18.048 -1.608 -7.905 1.00 0.00 C ATOM 902 CG PRO A 419 19.332 -2.094 -7.340 1.00 0.00 C ATOM 903 CD PRO A 419 19.136 -2.160 -5.849 1.00 0.00 C ATOM 0 HA PRO A 419 16.113 -1.498 -6.819 1.00 0.00 H new ATOM 0 HB2 PRO A 419 17.904 -1.965 -8.925 1.00 0.00 H new ATOM 0 HB3 PRO A 419 18.019 -0.519 -7.942 1.00 0.00 H new ATOM 0 HG2 PRO A 419 19.588 -3.074 -7.743 1.00 0.00 H new ATOM 0 HG3 PRO A 419 20.150 -1.420 -7.596 1.00 0.00 H new ATOM 0 HD2 PRO A 419 19.718 -2.967 -5.405 1.00 0.00 H new ATOM 0 HD3 PRO A 419 19.450 -1.236 -5.363 1.00 0.00 H new ATOM 911 N GLU A 420 15.195 -3.351 -8.141 1.00 0.00 N ATOM 912 CA GLU A 420 14.590 -4.476 -8.823 1.00 0.00 C ATOM 913 C GLU A 420 15.405 -4.867 -10.059 1.00 0.00 C ATOM 914 O GLU A 420 16.109 -4.030 -10.617 1.00 0.00 O ATOM 915 CB GLU A 420 13.128 -4.166 -9.213 1.00 0.00 C ATOM 916 CG GLU A 420 12.183 -4.101 -8.019 1.00 0.00 C ATOM 917 CD GLU A 420 10.830 -3.511 -8.364 1.00 0.00 C ATOM 918 OE1 GLU A 420 10.681 -2.279 -8.262 1.00 0.00 O ATOM 919 OE2 GLU A 420 9.916 -4.276 -8.717 1.00 0.00 O ATOM 0 H GLU A 420 14.645 -2.493 -8.172 1.00 0.00 H new ATOM 0 HA GLU A 420 14.586 -5.321 -8.134 1.00 0.00 H new ATOM 0 HB2 GLU A 420 13.096 -3.215 -9.745 1.00 0.00 H new ATOM 0 HB3 GLU A 420 12.775 -4.930 -9.905 1.00 0.00 H new ATOM 0 HG2 GLU A 420 12.044 -5.105 -7.618 1.00 0.00 H new ATOM 0 HG3 GLU A 420 12.643 -3.504 -7.231 1.00 0.00 H new ATOM 926 N CYS A 421 15.342 -6.130 -10.428 1.00 0.00 N ATOM 927 CA CYS A 421 16.057 -6.632 -11.599 1.00 0.00 C ATOM 928 C CYS A 421 15.520 -5.954 -12.869 1.00 0.00 C ATOM 929 O CYS A 421 14.310 -5.775 -13.018 1.00 0.00 O ATOM 930 CB CYS A 421 15.894 -8.147 -11.704 1.00 0.00 C ATOM 931 SG CYS A 421 16.965 -8.950 -12.943 1.00 0.00 S ATOM 0 H CYS A 421 14.800 -6.838 -9.933 1.00 0.00 H new ATOM 0 HA CYS A 421 17.117 -6.400 -11.494 1.00 0.00 H new ATOM 0 HB2 CYS A 421 16.098 -8.588 -10.728 1.00 0.00 H new ATOM 0 HB3 CYS A 421 14.854 -8.370 -11.944 1.00 0.00 H new ATOM 0 HG CYS A 421 17.628 -9.917 -12.382 1.00 0.00 H new ATOM 936 N PRO A 422 16.422 -5.529 -13.783 1.00 0.00 N ATOM 937 CA PRO A 422 16.034 -4.839 -15.031 1.00 0.00 C ATOM 938 C PRO A 422 15.161 -5.716 -15.935 1.00 0.00 C ATOM 939 O PRO A 422 14.565 -5.232 -16.902 1.00 0.00 O ATOM 940 CB PRO A 422 17.377 -4.499 -15.697 1.00 0.00 C ATOM 941 CG PRO A 422 18.359 -5.452 -15.098 1.00 0.00 C ATOM 942 CD PRO A 422 17.889 -5.665 -13.681 1.00 0.00 C ATOM 0 HA PRO A 422 15.423 -3.957 -14.838 1.00 0.00 H new ATOM 0 HB2 PRO A 422 17.322 -4.618 -16.779 1.00 0.00 H new ATOM 0 HB3 PRO A 422 17.663 -3.465 -15.504 1.00 0.00 H new ATOM 0 HG2 PRO A 422 18.383 -6.391 -15.650 1.00 0.00 H new ATOM 0 HG3 PRO A 422 19.369 -5.043 -15.121 1.00 0.00 H new ATOM 0 HD2 PRO A 422 18.176 -6.647 -13.306 1.00 0.00 H new ATOM 0 HD3 PRO A 422 18.315 -4.927 -13.001 1.00 0.00 H new ATOM 950 N TYR A 423 15.106 -7.012 -15.629 1.00 0.00 N ATOM 951 CA TYR A 423 14.279 -7.975 -16.372 1.00 0.00 C ATOM 952 C TYR A 423 13.131 -8.461 -15.479 1.00 0.00 C ATOM 953 O TYR A 423 12.411 -9.409 -15.825 1.00 0.00 O ATOM 954 CB TYR A 423 15.117 -9.183 -16.822 1.00 0.00 C ATOM 955 CG TYR A 423 16.218 -8.890 -17.834 1.00 0.00 C ATOM 956 CD1 TYR A 423 17.321 -8.112 -17.503 1.00 0.00 C ATOM 957 CD2 TYR A 423 16.169 -9.428 -19.125 1.00 0.00 C ATOM 958 CE1 TYR A 423 18.335 -7.871 -18.408 1.00 0.00 C ATOM 959 CE2 TYR A 423 17.179 -9.202 -20.032 1.00 0.00 C ATOM 960 CZ TYR A 423 18.262 -8.425 -19.672 1.00 0.00 C ATOM 961 OH TYR A 423 19.263 -8.197 -20.562 1.00 0.00 O ATOM 0 H TYR A 423 15.632 -7.428 -14.860 1.00 0.00 H new ATOM 0 HA TYR A 423 13.880 -7.477 -17.256 1.00 0.00 H new ATOM 0 HB2 TYR A 423 15.572 -9.634 -15.940 1.00 0.00 H new ATOM 0 HB3 TYR A 423 14.445 -9.927 -17.250 1.00 0.00 H new ATOM 0 HD1 TYR A 423 17.386 -7.685 -16.513 1.00 0.00 H new ATOM 0 HD2 TYR A 423 15.322 -10.032 -19.415 1.00 0.00 H new ATOM 0 HE1 TYR A 423 19.178 -7.255 -18.131 1.00 0.00 H new ATOM 0 HE2 TYR A 423 17.125 -9.631 -21.022 1.00 0.00 H new ATOM 0 HH TYR A 423 19.063 -8.656 -21.404 1.00 0.00 H new ATOM 971 N GLY A 424 12.970 -7.827 -14.321 1.00 0.00 N ATOM 972 CA GLY A 424 12.016 -8.292 -13.321 1.00 0.00 C ATOM 973 C GLY A 424 12.285 -9.725 -12.898 1.00 0.00 C ATOM 974 O GLY A 424 13.423 -10.172 -12.916 1.00 0.00 O ATOM 0 H GLY A 424 13.488 -6.990 -14.053 1.00 0.00 H new ATOM 0 HA2 GLY A 424 12.062 -7.642 -12.447 1.00 0.00 H new ATOM 0 HA3 GLY A 424 11.005 -8.217 -13.722 1.00 0.00 H new ATOM 978 N PRO A 425 11.241 -10.482 -12.509 1.00 0.00 N ATOM 979 CA PRO A 425 11.384 -11.892 -12.157 1.00 0.00 C ATOM 980 C PRO A 425 11.472 -12.788 -13.404 1.00 0.00 C ATOM 981 O PRO A 425 11.624 -14.001 -13.307 1.00 0.00 O ATOM 982 CB PRO A 425 10.130 -12.181 -11.350 1.00 0.00 C ATOM 983 CG PRO A 425 9.100 -11.257 -11.913 1.00 0.00 C ATOM 984 CD PRO A 425 9.849 -10.024 -12.362 1.00 0.00 C ATOM 0 HA PRO A 425 12.302 -12.096 -11.606 1.00 0.00 H new ATOM 0 HB2 PRO A 425 9.825 -13.223 -11.450 1.00 0.00 H new ATOM 0 HB3 PRO A 425 10.290 -11.996 -10.288 1.00 0.00 H new ATOM 0 HG2 PRO A 425 8.575 -11.720 -12.748 1.00 0.00 H new ATOM 0 HG3 PRO A 425 8.349 -11.006 -11.164 1.00 0.00 H new ATOM 0 HD2 PRO A 425 9.455 -9.639 -13.302 1.00 0.00 H new ATOM 0 HD3 PRO A 425 9.769 -9.220 -11.630 1.00 0.00 H new ATOM 992 N SER A 426 11.367 -12.162 -14.581 1.00 0.00 N ATOM 993 CA SER A 426 11.534 -12.869 -15.849 1.00 0.00 C ATOM 994 C SER A 426 13.033 -12.954 -16.185 1.00 0.00 C ATOM 995 O SER A 426 13.442 -13.555 -17.176 1.00 0.00 O ATOM 996 CB SER A 426 10.763 -12.139 -16.958 1.00 0.00 C ATOM 997 OG SER A 426 10.718 -12.896 -18.152 1.00 0.00 O ATOM 0 H SER A 426 11.167 -11.167 -14.679 1.00 0.00 H new ATOM 0 HA SER A 426 11.134 -13.880 -15.767 1.00 0.00 H new ATOM 0 HB2 SER A 426 9.748 -11.933 -16.620 1.00 0.00 H new ATOM 0 HB3 SER A 426 11.235 -11.176 -17.155 1.00 0.00 H new ATOM 0 HG SER A 426 11.526 -13.447 -18.221 1.00 0.00 H new ATOM 1003 N CYS A 427 13.839 -12.342 -15.311 1.00 0.00 N ATOM 1004 CA CYS A 427 15.280 -12.322 -15.448 1.00 0.00 C ATOM 1005 C CYS A 427 15.861 -13.716 -15.706 1.00 0.00 C ATOM 1006 O CYS A 427 15.740 -14.618 -14.878 1.00 0.00 O ATOM 1007 CB CYS A 427 15.884 -11.727 -14.179 1.00 0.00 C ATOM 1008 SG CYS A 427 17.707 -11.706 -14.111 1.00 0.00 S ATOM 0 H CYS A 427 13.498 -11.847 -14.487 1.00 0.00 H new ATOM 0 HA CYS A 427 15.532 -11.711 -16.315 1.00 0.00 H new ATOM 0 HB2 CYS A 427 15.522 -10.705 -14.070 1.00 0.00 H new ATOM 0 HB3 CYS A 427 15.512 -12.290 -13.322 1.00 0.00 H new ATOM 0 HG CYS A 427 18.099 -10.809 -13.256 1.00 0.00 H new ATOM 1013 N TYR A 428 16.480 -13.862 -16.862 1.00 0.00 N ATOM 1014 CA TYR A 428 17.158 -15.105 -17.235 1.00 0.00 C ATOM 1015 C TYR A 428 18.666 -14.905 -17.203 1.00 0.00 C ATOM 1016 O TYR A 428 19.436 -15.753 -17.683 1.00 0.00 O ATOM 1017 CB TYR A 428 16.680 -15.574 -18.622 1.00 0.00 C ATOM 1018 CG TYR A 428 16.526 -14.443 -19.628 1.00 0.00 C ATOM 1019 CD1 TYR A 428 17.575 -14.046 -20.424 1.00 0.00 C ATOM 1020 CD2 TYR A 428 15.301 -13.778 -19.766 1.00 0.00 C ATOM 1021 CE1 TYR A 428 17.445 -13.013 -21.346 1.00 0.00 C ATOM 1022 CE2 TYR A 428 15.159 -12.763 -20.674 1.00 0.00 C ATOM 1023 CZ TYR A 428 16.230 -12.375 -21.465 1.00 0.00 C ATOM 1024 OH TYR A 428 16.069 -11.348 -22.368 1.00 0.00 O ATOM 0 H TYR A 428 16.531 -13.131 -17.571 1.00 0.00 H new ATOM 0 HA TYR A 428 16.907 -15.884 -16.515 1.00 0.00 H new ATOM 0 HB2 TYR A 428 17.389 -16.303 -19.014 1.00 0.00 H new ATOM 0 HB3 TYR A 428 15.724 -16.085 -18.514 1.00 0.00 H new ATOM 0 HD1 TYR A 428 18.526 -14.550 -20.331 1.00 0.00 H new ATOM 0 HD2 TYR A 428 14.462 -14.068 -19.151 1.00 0.00 H new ATOM 0 HE1 TYR A 428 18.283 -12.716 -21.959 1.00 0.00 H new ATOM 0 HE2 TYR A 428 14.208 -12.262 -20.775 1.00 0.00 H new ATOM 0 HH TYR A 428 15.150 -11.012 -22.321 1.00 0.00 H new ATOM 1034 N ARG A 429 19.092 -13.778 -16.634 1.00 0.00 N ATOM 1035 CA ARG A 429 20.512 -13.456 -16.511 1.00 0.00 C ATOM 1036 C ARG A 429 21.129 -14.301 -15.398 1.00 0.00 C ATOM 1037 O ARG A 429 21.064 -13.929 -14.216 1.00 0.00 O ATOM 1038 CB ARG A 429 20.697 -11.962 -16.192 1.00 0.00 C ATOM 1039 CG ARG A 429 20.045 -11.037 -17.219 1.00 0.00 C ATOM 1040 CD ARG A 429 20.701 -11.102 -18.597 1.00 0.00 C ATOM 1041 NE ARG A 429 22.050 -10.535 -18.589 1.00 0.00 N ATOM 1042 CZ ARG A 429 22.489 -9.609 -19.440 1.00 0.00 C ATOM 1043 NH1 ARG A 429 21.690 -9.081 -20.352 1.00 0.00 N ATOM 1044 NH2 ARG A 429 23.755 -9.172 -19.375 1.00 0.00 N ATOM 0 H ARG A 429 18.469 -13.069 -16.249 1.00 0.00 H new ATOM 0 HA ARG A 429 21.009 -13.675 -17.456 1.00 0.00 H new ATOM 0 HB2 ARG A 429 20.277 -11.753 -15.208 1.00 0.00 H new ATOM 0 HB3 ARG A 429 21.763 -11.739 -16.138 1.00 0.00 H new ATOM 0 HG2 ARG A 429 18.991 -11.298 -17.314 1.00 0.00 H new ATOM 0 HG3 ARG A 429 20.088 -10.011 -16.852 1.00 0.00 H new ATOM 0 HD2 ARG A 429 20.746 -12.139 -18.929 1.00 0.00 H new ATOM 0 HD3 ARG A 429 20.085 -10.563 -19.317 1.00 0.00 H new ATOM 0 HE ARG A 429 22.701 -10.873 -17.881 1.00 0.00 H new ATOM 0 HH11 ARG A 429 20.717 -9.382 -20.413 1.00 0.00 H new ATOM 0 HH12 ARG A 429 22.046 -8.373 -20.994 1.00 0.00 H new ATOM 0 HH21 ARG A 429 24.389 -9.549 -18.671 1.00 0.00 H new ATOM 0 HH22 ARG A 429 24.084 -8.463 -20.030 1.00 0.00 H new ATOM 1058 N LYS A 430 21.694 -15.435 -15.771 1.00 0.00 N ATOM 1059 CA LYS A 430 22.245 -16.388 -14.820 1.00 0.00 C ATOM 1060 C LYS A 430 23.625 -15.953 -14.327 1.00 0.00 C ATOM 1061 O LYS A 430 24.652 -16.357 -14.889 1.00 0.00 O ATOM 1062 CB LYS A 430 22.308 -17.798 -15.414 1.00 0.00 C ATOM 1063 CG LYS A 430 20.935 -18.320 -15.879 1.00 0.00 C ATOM 1064 CD LYS A 430 21.014 -19.770 -16.342 1.00 0.00 C ATOM 1065 CE LYS A 430 21.389 -20.715 -15.211 1.00 0.00 C ATOM 1066 NZ LYS A 430 21.481 -22.126 -15.672 1.00 0.00 N ATOM 0 H LYS A 430 21.785 -15.723 -16.745 1.00 0.00 H new ATOM 0 HA LYS A 430 21.572 -16.411 -13.963 1.00 0.00 H new ATOM 0 HB2 LYS A 430 22.996 -17.799 -16.260 1.00 0.00 H new ATOM 0 HB3 LYS A 430 22.717 -18.481 -14.670 1.00 0.00 H new ATOM 0 HG2 LYS A 430 20.218 -18.237 -15.062 1.00 0.00 H new ATOM 0 HG3 LYS A 430 20.565 -17.697 -16.693 1.00 0.00 H new ATOM 0 HD2 LYS A 430 20.053 -20.069 -16.759 1.00 0.00 H new ATOM 0 HD3 LYS A 430 21.749 -19.854 -17.142 1.00 0.00 H new ATOM 0 HE2 LYS A 430 22.345 -20.410 -14.785 1.00 0.00 H new ATOM 0 HE3 LYS A 430 20.647 -20.641 -14.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 430 21.739 -22.737 -14.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 430 20.562 -22.427 -16.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 430 22.207 -22.202 -16.413 1.00 0.00 H new ATOM 1080 N ASN A 431 23.644 -15.078 -13.330 1.00 0.00 N ATOM 1081 CA ASN A 431 24.868 -14.667 -12.664 1.00 0.00 C ATOM 1082 C ASN A 431 24.584 -14.448 -11.191 1.00 0.00 C ATOM 1083 O ASN A 431 23.729 -13.640 -10.844 1.00 0.00 O ATOM 1084 CB ASN A 431 25.427 -13.364 -13.261 1.00 0.00 C ATOM 1085 CG ASN A 431 26.823 -13.047 -12.733 1.00 0.00 C ATOM 1086 OD1 ASN A 431 27.673 -13.935 -12.625 1.00 0.00 O ATOM 1087 ND2 ASN A 431 27.064 -11.804 -12.368 1.00 0.00 N ATOM 0 H ASN A 431 22.804 -14.632 -12.960 1.00 0.00 H new ATOM 0 HA ASN A 431 25.609 -15.454 -12.803 1.00 0.00 H new ATOM 0 HB2 ASN A 431 25.461 -13.448 -14.347 1.00 0.00 H new ATOM 0 HB3 ASN A 431 24.754 -12.539 -13.026 1.00 0.00 H new ATOM 0 HD21 ASN A 431 27.975 -11.553 -11.983 1.00 0.00 H new ATOM 0 HD22 ASN A 431 26.340 -11.093 -12.470 1.00 0.00 H new ATOM 1094 N PRO A 432 25.309 -15.155 -10.298 1.00 0.00 N ATOM 1095 CA PRO A 432 25.046 -15.083 -8.863 1.00 0.00 C ATOM 1096 C PRO A 432 25.178 -13.672 -8.307 1.00 0.00 C ATOM 1097 O PRO A 432 24.368 -13.257 -7.483 1.00 0.00 O ATOM 1098 CB PRO A 432 26.103 -16.029 -8.256 1.00 0.00 C ATOM 1099 CG PRO A 432 27.138 -16.198 -9.316 1.00 0.00 C ATOM 1100 CD PRO A 432 26.428 -16.053 -10.632 1.00 0.00 C ATOM 0 HA PRO A 432 24.022 -15.368 -8.622 1.00 0.00 H new ATOM 0 HB2 PRO A 432 26.535 -15.606 -7.349 1.00 0.00 H new ATOM 0 HB3 PRO A 432 25.662 -16.987 -7.982 1.00 0.00 H new ATOM 0 HG2 PRO A 432 27.923 -15.449 -9.214 1.00 0.00 H new ATOM 0 HG3 PRO A 432 27.617 -17.174 -9.239 1.00 0.00 H new ATOM 0 HD2 PRO A 432 27.076 -15.625 -11.397 1.00 0.00 H new ATOM 0 HD3 PRO A 432 26.078 -17.013 -11.011 1.00 0.00 H new ATOM 1108 N GLN A 433 26.157 -12.898 -8.790 1.00 0.00 N ATOM 1109 CA GLN A 433 26.376 -11.538 -8.289 1.00 0.00 C ATOM 1110 C GLN A 433 25.178 -10.657 -8.643 1.00 0.00 C ATOM 1111 O GLN A 433 24.728 -9.854 -7.818 1.00 0.00 O ATOM 1112 CB GLN A 433 27.663 -10.940 -8.871 1.00 0.00 C ATOM 1113 CG GLN A 433 27.994 -9.547 -8.326 1.00 0.00 C ATOM 1114 CD GLN A 433 28.153 -9.530 -6.805 1.00 0.00 C ATOM 1115 OE1 GLN A 433 29.248 -9.752 -6.279 1.00 0.00 O ATOM 1116 NE2 GLN A 433 27.080 -9.242 -6.099 1.00 0.00 N ATOM 0 H GLN A 433 26.805 -13.188 -9.522 1.00 0.00 H new ATOM 0 HA GLN A 433 26.483 -11.582 -7.205 1.00 0.00 H new ATOM 0 HB2 GLN A 433 28.495 -11.611 -8.657 1.00 0.00 H new ATOM 0 HB3 GLN A 433 27.569 -10.884 -9.956 1.00 0.00 H new ATOM 0 HG2 GLN A 433 28.915 -9.190 -8.787 1.00 0.00 H new ATOM 0 HG3 GLN A 433 27.204 -8.852 -8.612 1.00 0.00 H new ATOM 0 HE21 GLN A 433 26.192 -9.065 -6.569 1.00 0.00 H new ATOM 0 HE22 GLN A 433 27.136 -9.196 -5.082 1.00 0.00 H new ATOM 1125 N HIS A 434 24.658 -10.844 -9.848 1.00 0.00 N ATOM 1126 CA HIS A 434 23.471 -10.121 -10.307 1.00 0.00 C ATOM 1127 C HIS A 434 22.294 -10.374 -9.365 1.00 0.00 C ATOM 1128 O HIS A 434 21.651 -9.446 -8.867 1.00 0.00 O ATOM 1129 CB HIS A 434 23.087 -10.526 -11.748 1.00 0.00 C ATOM 1130 CG HIS A 434 21.713 -10.101 -12.113 1.00 0.00 C ATOM 1131 ND1 HIS A 434 21.288 -8.788 -12.082 1.00 0.00 N ATOM 1132 CD2 HIS A 434 20.608 -10.836 -12.442 1.00 0.00 C ATOM 1133 CE1 HIS A 434 19.998 -8.759 -12.366 1.00 0.00 C ATOM 1134 NE2 HIS A 434 19.526 -9.980 -12.599 1.00 0.00 N ATOM 0 H HIS A 434 25.041 -11.495 -10.534 1.00 0.00 H new ATOM 0 HA HIS A 434 23.710 -9.058 -10.304 1.00 0.00 H new ATOM 0 HB2 HIS A 434 23.798 -10.085 -12.447 1.00 0.00 H new ATOM 0 HB3 HIS A 434 23.168 -11.608 -11.851 1.00 0.00 H new ATOM 0 HD1 HIS A 434 21.871 -7.977 -11.875 1.00 0.00 H new ATOM 0 HD2 HIS A 434 20.581 -11.909 -12.561 1.00 0.00 H new ATOM 0 HE1 HIS A 434 19.403 -7.859 -12.404 1.00 0.00 H new ATOM 1142 N LYS A 435 22.032 -11.648 -9.167 1.00 0.00 N ATOM 1143 CA LYS A 435 20.951 -12.113 -8.300 1.00 0.00 C ATOM 1144 C LYS A 435 21.142 -11.652 -6.852 1.00 0.00 C ATOM 1145 O LYS A 435 20.213 -11.628 -6.051 1.00 0.00 O ATOM 1146 CB LYS A 435 20.896 -13.630 -8.378 1.00 0.00 C ATOM 1147 CG LYS A 435 20.764 -14.141 -9.818 1.00 0.00 C ATOM 1148 CD LYS A 435 21.020 -15.643 -9.948 1.00 0.00 C ATOM 1149 CE LYS A 435 19.959 -16.490 -9.238 1.00 0.00 C ATOM 1150 NZ LYS A 435 18.607 -16.303 -9.824 1.00 0.00 N ATOM 0 H LYS A 435 22.563 -12.402 -9.603 1.00 0.00 H new ATOM 0 HA LYS A 435 20.010 -11.682 -8.642 1.00 0.00 H new ATOM 0 HB2 LYS A 435 21.798 -14.046 -7.930 1.00 0.00 H new ATOM 0 HB3 LYS A 435 20.052 -13.990 -7.790 1.00 0.00 H new ATOM 0 HG2 LYS A 435 19.763 -13.916 -10.187 1.00 0.00 H new ATOM 0 HG3 LYS A 435 21.467 -13.602 -10.454 1.00 0.00 H new ATOM 0 HD2 LYS A 435 21.046 -15.912 -11.004 1.00 0.00 H new ATOM 0 HD3 LYS A 435 22.001 -15.877 -9.535 1.00 0.00 H new ATOM 0 HE2 LYS A 435 20.237 -17.542 -9.298 1.00 0.00 H new ATOM 0 HE3 LYS A 435 19.934 -16.227 -8.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 17.961 -17.024 -9.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 18.251 -15.356 -9.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 18.661 -16.398 -10.858 1.00 0.00 H new ATOM 1164 N ILE A 436 22.372 -11.263 -6.529 1.00 0.00 N ATOM 1165 CA ILE A 436 22.711 -10.768 -5.204 1.00 0.00 C ATOM 1166 C ILE A 436 22.402 -9.282 -5.062 1.00 0.00 C ATOM 1167 O ILE A 436 21.871 -8.852 -4.040 1.00 0.00 O ATOM 1168 CB ILE A 436 24.213 -11.046 -4.891 1.00 0.00 C ATOM 1169 CG1 ILE A 436 24.447 -12.537 -4.620 1.00 0.00 C ATOM 1170 CG2 ILE A 436 24.714 -10.189 -3.725 1.00 0.00 C ATOM 1171 CD1 ILE A 436 25.885 -12.911 -4.370 1.00 0.00 C ATOM 0 H ILE A 436 23.158 -11.283 -7.179 1.00 0.00 H new ATOM 0 HA ILE A 436 22.094 -11.302 -4.482 1.00 0.00 H new ATOM 0 HB ILE A 436 24.791 -10.766 -5.772 1.00 0.00 H new ATOM 0 HG12 ILE A 436 23.853 -12.833 -3.756 1.00 0.00 H new ATOM 0 HG13 ILE A 436 24.079 -13.110 -5.471 1.00 0.00 H new ATOM 0 HG21 ILE A 436 25.764 -10.410 -3.536 1.00 0.00 H new ATOM 0 HG22 ILE A 436 24.605 -9.134 -3.976 1.00 0.00 H new ATOM 0 HG23 ILE A 436 24.130 -10.412 -2.832 1.00 0.00 H new ATOM 0 HD11 ILE A 436 25.956 -13.983 -4.188 1.00 0.00 H new ATOM 0 HD12 ILE A 436 26.486 -12.651 -5.242 1.00 0.00 H new ATOM 0 HD13 ILE A 436 26.256 -12.370 -3.499 1.00 0.00 H new ATOM 1183 N GLU A 437 22.712 -8.503 -6.081 1.00 0.00 N ATOM 1184 CA GLU A 437 22.557 -7.052 -6.026 1.00 0.00 C ATOM 1185 C GLU A 437 21.098 -6.652 -6.246 1.00 0.00 C ATOM 1186 O GLU A 437 20.548 -5.822 -5.519 1.00 0.00 O ATOM 1187 CB GLU A 437 23.422 -6.375 -7.093 1.00 0.00 C ATOM 1188 CG GLU A 437 24.859 -6.884 -7.144 1.00 0.00 C ATOM 1189 CD GLU A 437 25.721 -6.062 -8.108 1.00 0.00 C ATOM 1190 OE1 GLU A 437 25.726 -6.364 -9.321 1.00 0.00 O ATOM 1191 OE2 GLU A 437 26.417 -5.130 -7.648 1.00 0.00 O ATOM 0 H GLU A 437 23.077 -8.850 -6.968 1.00 0.00 H new ATOM 0 HA GLU A 437 22.876 -6.725 -5.036 1.00 0.00 H new ATOM 0 HB2 GLU A 437 22.960 -6.525 -8.069 1.00 0.00 H new ATOM 0 HB3 GLU A 437 23.435 -5.301 -6.908 1.00 0.00 H new ATOM 0 HG2 GLU A 437 25.294 -6.846 -6.145 1.00 0.00 H new ATOM 0 HG3 GLU A 437 24.863 -7.929 -7.454 1.00 0.00 H new ATOM 1198 N TYR A 438 20.485 -7.265 -7.249 1.00 0.00 N ATOM 1199 CA TYR A 438 19.136 -6.909 -7.655 1.00 0.00 C ATOM 1200 C TYR A 438 18.130 -7.851 -7.031 1.00 0.00 C ATOM 1201 O TYR A 438 18.407 -9.039 -6.854 1.00 0.00 O ATOM 1202 CB TYR A 438 19.003 -6.958 -9.192 1.00 0.00 C ATOM 1203 CG TYR A 438 19.890 -5.970 -9.920 1.00 0.00 C ATOM 1204 CD1 TYR A 438 21.240 -6.235 -10.124 1.00 0.00 C ATOM 1205 CD2 TYR A 438 19.372 -4.785 -10.413 1.00 0.00 C ATOM 1206 CE1 TYR A 438 22.041 -5.339 -10.797 1.00 0.00 C ATOM 1207 CE2 TYR A 438 20.169 -3.883 -11.098 1.00 0.00 C ATOM 1208 CZ TYR A 438 21.503 -4.168 -11.285 1.00 0.00 C ATOM 1209 OH TYR A 438 22.312 -3.291 -11.975 1.00 0.00 O ATOM 0 H TYR A 438 20.905 -8.015 -7.798 1.00 0.00 H new ATOM 0 HA TYR A 438 18.936 -5.894 -7.312 1.00 0.00 H new ATOM 0 HB2 TYR A 438 19.241 -7.965 -9.535 1.00 0.00 H new ATOM 0 HB3 TYR A 438 17.965 -6.766 -9.463 1.00 0.00 H new ATOM 0 HD1 TYR A 438 21.665 -7.155 -9.750 1.00 0.00 H new ATOM 0 HD2 TYR A 438 18.327 -4.560 -10.261 1.00 0.00 H new ATOM 0 HE1 TYR A 438 23.089 -5.554 -10.942 1.00 0.00 H new ATOM 0 HE2 TYR A 438 19.748 -2.965 -11.482 1.00 0.00 H new ATOM 0 HH TYR A 438 21.786 -2.513 -12.256 1.00 0.00 H new ATOM 1219 N ARG A 439 16.954 -7.316 -6.697 1.00 0.00 N ATOM 1220 CA ARG A 439 15.879 -8.126 -6.155 1.00 0.00 C ATOM 1221 C ARG A 439 14.966 -8.616 -7.282 1.00 0.00 C ATOM 1222 O ARG A 439 14.364 -7.824 -8.010 1.00 0.00 O ATOM 1223 CB ARG A 439 15.080 -7.341 -5.102 1.00 0.00 C ATOM 1224 CG ARG A 439 14.490 -6.022 -5.584 1.00 0.00 C ATOM 1225 CD ARG A 439 13.800 -5.265 -4.463 1.00 0.00 C ATOM 1226 NE ARG A 439 13.081 -4.083 -4.928 1.00 0.00 N ATOM 1227 CZ ARG A 439 11.880 -3.717 -4.495 1.00 0.00 C ATOM 1228 NH1 ARG A 439 11.256 -4.430 -3.569 1.00 0.00 N ATOM 1229 NH2 ARG A 439 11.310 -2.629 -4.969 1.00 0.00 N ATOM 0 H ARG A 439 16.729 -6.326 -6.795 1.00 0.00 H new ATOM 0 HA ARG A 439 16.315 -8.995 -5.662 1.00 0.00 H new ATOM 0 HB2 ARG A 439 14.269 -7.973 -4.740 1.00 0.00 H new ATOM 0 HB3 ARG A 439 15.731 -7.140 -4.251 1.00 0.00 H new ATOM 0 HG2 ARG A 439 15.282 -5.403 -6.006 1.00 0.00 H new ATOM 0 HG3 ARG A 439 13.776 -6.215 -6.384 1.00 0.00 H new ATOM 0 HD2 ARG A 439 13.102 -5.932 -3.958 1.00 0.00 H new ATOM 0 HD3 ARG A 439 14.543 -4.964 -3.725 1.00 0.00 H new ATOM 0 HE ARG A 439 13.531 -3.499 -5.633 1.00 0.00 H new ATOM 0 HH11 ARG A 439 11.698 -5.265 -3.185 1.00 0.00 H new ATOM 0 HH12 ARG A 439 10.334 -4.144 -3.240 1.00 0.00 H new ATOM 0 HH21 ARG A 439 11.791 -2.065 -5.670 1.00 0.00 H new ATOM 0 HH22 ARG A 439 10.388 -2.350 -4.635 1.00 0.00 H new ATOM 1243 N HIS A 440 14.900 -9.929 -7.427 1.00 0.00 N ATOM 1244 CA HIS A 440 14.001 -10.554 -8.384 1.00 0.00 C ATOM 1245 C HIS A 440 12.695 -10.891 -7.688 1.00 0.00 C ATOM 1246 O HIS A 440 12.460 -12.028 -7.276 1.00 0.00 O ATOM 1247 CB HIS A 440 14.642 -11.804 -9.000 1.00 0.00 C ATOM 1248 CG HIS A 440 15.909 -11.516 -9.762 1.00 0.00 C ATOM 1249 ND1 HIS A 440 17.156 -11.403 -9.191 1.00 0.00 N ATOM 1250 CD2 HIS A 440 16.077 -11.294 -11.082 1.00 0.00 C ATOM 1251 CE1 HIS A 440 18.030 -11.112 -10.165 1.00 0.00 C ATOM 1252 NE2 HIS A 440 17.431 -11.032 -11.339 1.00 0.00 N ATOM 0 H HIS A 440 15.463 -10.588 -6.889 1.00 0.00 H new ATOM 0 HA HIS A 440 13.800 -9.861 -9.201 1.00 0.00 H new ATOM 0 HB2 HIS A 440 14.859 -12.520 -8.207 1.00 0.00 H new ATOM 0 HB3 HIS A 440 13.924 -12.278 -9.670 1.00 0.00 H new ATOM 0 HD1 HIS A 440 17.376 -11.520 -8.202 1.00 0.00 H new ATOM 0 HD2 HIS A 440 15.293 -11.315 -11.824 1.00 0.00 H new ATOM 0 HE1 HIS A 440 19.088 -10.962 -10.009 1.00 0.00 H new ATOM 1260 N ASN A 441 11.865 -9.854 -7.517 1.00 0.00 N ATOM 1261 CA ASN A 441 10.565 -10.008 -6.885 1.00 0.00 C ATOM 1262 C ASN A 441 9.643 -10.855 -7.748 1.00 0.00 C ATOM 1263 O ASN A 441 9.137 -10.394 -8.773 1.00 0.00 O ATOM 1264 CB ASN A 441 9.927 -8.613 -6.624 1.00 0.00 C ATOM 1265 CG ASN A 441 10.772 -7.729 -5.709 1.00 0.00 C ATOM 1266 OD1 ASN A 441 11.975 -7.856 -5.664 1.00 0.00 O ATOM 1267 ND2 ASN A 441 10.099 -6.833 -4.998 1.00 0.00 N ATOM 0 H ASN A 441 12.079 -8.901 -7.811 1.00 0.00 H new ATOM 0 HA ASN A 441 10.704 -10.517 -5.931 1.00 0.00 H new ATOM 0 HB2 ASN A 441 9.780 -8.104 -7.576 1.00 0.00 H new ATOM 0 HB3 ASN A 441 8.941 -8.749 -6.179 1.00 0.00 H new ATOM 0 HD21 ASN A 441 10.597 -6.202 -4.370 1.00 0.00 H new ATOM 0 HD22 ASN A 441 9.084 -6.775 -5.080 1.00 0.00 H new ATOM 1274 N THR A 442 9.428 -12.086 -7.334 1.00 0.00 N ATOM 1275 CA THR A 442 8.658 -13.046 -8.090 1.00 0.00 C ATOM 1276 C THR A 442 7.191 -12.819 -7.842 1.00 0.00 C ATOM 1277 O THR A 442 6.735 -12.846 -6.705 1.00 0.00 O ATOM 1278 CB THR A 442 9.060 -14.509 -7.783 1.00 0.00 C ATOM 1279 OG1 THR A 442 9.351 -14.641 -6.391 1.00 0.00 O ATOM 1280 CG2 THR A 442 10.264 -14.945 -8.614 1.00 0.00 C ATOM 0 H THR A 442 9.788 -12.451 -6.452 1.00 0.00 H new ATOM 0 HA THR A 442 8.875 -12.891 -9.147 1.00 0.00 H new ATOM 0 HB THR A 442 8.224 -15.156 -8.048 1.00 0.00 H new ATOM 0 HG1 THR A 442 9.604 -15.568 -6.196 1.00 0.00 H new ATOM 0 HG21 THR A 442 10.518 -15.977 -8.372 1.00 0.00 H new ATOM 0 HG22 THR A 442 10.021 -14.870 -9.674 1.00 0.00 H new ATOM 0 HG23 THR A 442 11.114 -14.300 -8.390 1.00 0.00 H new ATOM 1288 N LEU A 443 6.471 -12.569 -8.923 1.00 0.00 N ATOM 1289 CA LEU A 443 5.067 -12.195 -8.823 1.00 0.00 C ATOM 1290 C LEU A 443 4.176 -13.430 -8.798 1.00 0.00 C ATOM 1291 O LEU A 443 4.497 -14.449 -9.439 1.00 0.00 O ATOM 1292 CB LEU A 443 4.700 -11.223 -9.958 1.00 0.00 C ATOM 1293 CG LEU A 443 5.208 -11.591 -11.386 1.00 0.00 C ATOM 1294 CD1 LEU A 443 4.415 -12.749 -11.975 1.00 0.00 C ATOM 1295 CD2 LEU A 443 5.153 -10.376 -12.290 1.00 0.00 C ATOM 0 H LEU A 443 6.832 -12.617 -9.876 1.00 0.00 H new ATOM 0 HA LEU A 443 4.899 -11.675 -7.880 1.00 0.00 H new ATOM 0 HB2 LEU A 443 3.614 -11.137 -9.995 1.00 0.00 H new ATOM 0 HB3 LEU A 443 5.089 -10.238 -9.702 1.00 0.00 H new ATOM 0 HG LEU A 443 6.245 -11.916 -11.306 1.00 0.00 H new ATOM 0 HD11 LEU A 443 4.794 -12.980 -12.970 1.00 0.00 H new ATOM 0 HD12 LEU A 443 4.519 -13.625 -11.334 1.00 0.00 H new ATOM 0 HD13 LEU A 443 3.363 -12.472 -12.043 1.00 0.00 H new ATOM 0 HD21 LEU A 443 5.510 -10.646 -13.284 1.00 0.00 H new ATOM 0 HD22 LEU A 443 4.125 -10.019 -12.358 1.00 0.00 H new ATOM 0 HD23 LEU A 443 5.784 -9.588 -11.879 1.00 0.00 H new ATOM 1307 N PRO A 444 3.057 -13.385 -8.053 1.00 0.00 N ATOM 1308 CA PRO A 444 2.160 -14.520 -7.897 1.00 0.00 C ATOM 1309 C PRO A 444 1.398 -14.849 -9.187 1.00 0.00 C ATOM 1310 O PRO A 444 1.091 -16.014 -9.430 1.00 0.00 O ATOM 1311 CB PRO A 444 1.199 -14.059 -6.804 1.00 0.00 C ATOM 1312 CG PRO A 444 1.199 -12.562 -6.906 1.00 0.00 C ATOM 1313 CD PRO A 444 2.595 -12.197 -7.316 1.00 0.00 C ATOM 0 HA PRO A 444 2.698 -15.436 -7.652 1.00 0.00 H new ATOM 0 HB2 PRO A 444 0.200 -14.467 -6.957 1.00 0.00 H new ATOM 0 HB3 PRO A 444 1.531 -14.389 -5.820 1.00 0.00 H new ATOM 0 HG2 PRO A 444 0.470 -12.217 -7.639 1.00 0.00 H new ATOM 0 HG3 PRO A 444 0.935 -12.102 -5.954 1.00 0.00 H new ATOM 0 HD2 PRO A 444 2.609 -11.305 -7.942 1.00 0.00 H new ATOM 0 HD3 PRO A 444 3.226 -11.990 -6.452 1.00 0.00 H new ATOM 1321 N VAL A 445 1.103 -13.801 -9.984 1.00 0.00 N ATOM 1322 CA VAL A 445 0.300 -13.917 -11.232 1.00 0.00 C ATOM 1323 C VAL A 445 -0.894 -14.825 -10.997 1.00 0.00 C ATOM 1324 O VAL A 445 -1.413 -15.504 -11.898 1.00 0.00 O ATOM 1325 CB VAL A 445 1.177 -14.393 -12.437 1.00 0.00 C ATOM 1326 CG1 VAL A 445 1.668 -15.835 -12.312 1.00 0.00 C ATOM 1327 CG2 VAL A 445 0.388 -14.144 -13.756 1.00 0.00 C ATOM 0 H VAL A 445 1.412 -12.849 -9.786 1.00 0.00 H new ATOM 0 HA VAL A 445 -0.076 -12.929 -11.499 1.00 0.00 H new ATOM 0 HB VAL A 445 2.094 -13.804 -12.443 1.00 0.00 H new ATOM 0 HG11 VAL A 445 2.269 -16.092 -13.185 1.00 0.00 H new ATOM 0 HG12 VAL A 445 2.274 -15.936 -11.412 1.00 0.00 H new ATOM 0 HG13 VAL A 445 0.812 -16.507 -12.251 1.00 0.00 H new ATOM 0 HG21 VAL A 445 0.987 -14.471 -14.606 1.00 0.00 H new ATOM 0 HG22 VAL A 445 -0.546 -14.706 -13.733 1.00 0.00 H new ATOM 0 HG23 VAL A 445 0.170 -13.081 -13.854 1.00 0.00 H new ATOM 1337 N ARG A 446 -1.423 -14.794 -9.766 1.00 0.00 N ATOM 1338 CA ARG A 446 -2.583 -15.565 -9.376 1.00 0.00 C ATOM 1339 C ARG A 446 -3.845 -14.751 -9.573 1.00 0.00 C ATOM 1340 O ARG A 446 -3.804 -13.528 -9.625 1.00 0.00 O ATOM 1341 CB ARG A 446 -2.476 -15.974 -7.882 1.00 0.00 C ATOM 1342 CG ARG A 446 -1.429 -17.038 -7.605 1.00 0.00 C ATOM 1343 CD ARG A 446 -1.818 -18.409 -8.153 1.00 0.00 C ATOM 1344 NE ARG A 446 -3.072 -18.886 -7.598 1.00 0.00 N ATOM 1345 CZ ARG A 446 -3.463 -20.172 -7.628 1.00 0.00 C ATOM 1346 NH1 ARG A 446 -2.707 -21.104 -8.199 1.00 0.00 N ATOM 1347 NH2 ARG A 446 -4.628 -20.547 -7.067 1.00 0.00 N ATOM 0 H ARG A 446 -1.043 -14.221 -9.013 1.00 0.00 H new ATOM 0 HA ARG A 446 -2.625 -16.459 -9.999 1.00 0.00 H new ATOM 0 HB2 ARG A 446 -2.245 -15.089 -7.290 1.00 0.00 H new ATOM 0 HB3 ARG A 446 -3.447 -16.338 -7.545 1.00 0.00 H new ATOM 0 HG2 ARG A 446 -0.481 -16.731 -8.046 1.00 0.00 H new ATOM 0 HG3 ARG A 446 -1.270 -17.114 -6.529 1.00 0.00 H new ATOM 0 HD2 ARG A 446 -1.901 -18.354 -9.238 1.00 0.00 H new ATOM 0 HD3 ARG A 446 -1.028 -19.125 -7.929 1.00 0.00 H new ATOM 0 HE ARG A 446 -3.693 -18.206 -7.160 1.00 0.00 H new ATOM 0 HH11 ARG A 446 -1.815 -20.848 -8.623 1.00 0.00 H new ATOM 0 HH12 ARG A 446 -3.018 -22.075 -8.213 1.00 0.00 H new ATOM 0 HH21 ARG A 446 -5.223 -19.853 -6.614 1.00 0.00 H new ATOM 0 HH22 ARG A 446 -4.916 -21.525 -7.095 1.00 0.00 H new ATOM 1361 N ASN A 447 -4.990 -15.440 -9.697 1.00 0.00 N ATOM 1362 CA ASN A 447 -6.292 -14.791 -9.716 1.00 0.00 C ATOM 1363 C ASN A 447 -6.425 -13.792 -10.875 1.00 0.00 C ATOM 1364 O ASN A 447 -7.282 -12.906 -10.830 1.00 0.00 O ATOM 1365 CB ASN A 447 -6.569 -14.082 -8.396 1.00 0.00 C ATOM 1366 CG ASN A 447 -6.539 -15.036 -7.199 1.00 0.00 C ATOM 1367 OD1 ASN A 447 -5.801 -16.028 -7.187 1.00 0.00 O ATOM 1368 ND2 ASN A 447 -7.336 -14.739 -6.173 1.00 0.00 N ATOM 0 H ASN A 447 -5.030 -16.455 -9.786 1.00 0.00 H new ATOM 0 HA ASN A 447 -7.030 -15.580 -9.863 1.00 0.00 H new ATOM 0 HB2 ASN A 447 -5.829 -13.295 -8.248 1.00 0.00 H new ATOM 0 HB3 ASN A 447 -7.544 -13.597 -8.446 1.00 0.00 H new ATOM 0 HD21 ASN A 447 -7.349 -15.338 -5.347 1.00 0.00 H new ATOM 0 HD22 ASN A 447 -7.933 -13.913 -6.214 1.00 0.00 H new ATOM 1375 N VAL A 448 -5.597 -13.967 -11.909 1.00 0.00 N ATOM 1376 CA VAL A 448 -5.641 -13.076 -13.061 1.00 0.00 C ATOM 1377 C VAL A 448 -5.549 -13.895 -14.350 1.00 0.00 C ATOM 1378 O VAL A 448 -6.204 -14.921 -14.481 1.00 0.00 O ATOM 1379 CB VAL A 448 -4.496 -12.041 -13.011 1.00 0.00 C ATOM 1380 CG1 VAL A 448 -3.110 -12.701 -13.066 1.00 0.00 C ATOM 1381 CG2 VAL A 448 -4.641 -11.006 -14.133 1.00 0.00 C ATOM 0 H VAL A 448 -4.899 -14.708 -11.968 1.00 0.00 H new ATOM 0 HA VAL A 448 -6.587 -12.534 -13.039 1.00 0.00 H new ATOM 0 HB VAL A 448 -4.576 -11.531 -12.051 1.00 0.00 H new ATOM 0 HG11 VAL A 448 -2.339 -11.932 -13.028 1.00 0.00 H new ATOM 0 HG12 VAL A 448 -2.993 -13.374 -12.216 1.00 0.00 H new ATOM 0 HG13 VAL A 448 -3.013 -13.267 -13.993 1.00 0.00 H new ATOM 0 HG21 VAL A 448 -3.822 -10.289 -14.075 1.00 0.00 H new ATOM 0 HG22 VAL A 448 -4.614 -11.510 -15.099 1.00 0.00 H new ATOM 0 HG23 VAL A 448 -5.590 -10.482 -14.024 1.00 0.00 H new TER 1391 VAL A 448 HETATM 1392 ZN ZN A 449 3.659 14.815 -13.318 1.00 0.00 ZN HETATM 1393 ZN ZN A 450 18.020 -10.266 -13.181 1.00 0.00 ZN