USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=14 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 389 LYS NZ :NH3+ -175:sc= 0.0297 (180deg=0.0113) USER MOD Set 1.2: A 415 MET CE :methyl 180:sc=-0.00158 (180deg=0) USER MOD Set 2.1: A 382 LYS NZ :NH3+ -113:sc= -0.046 (180deg=-0.648) USER MOD Set 2.2: A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 379 SER OG : rot -30:sc= -5.42! USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS : no HD1:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 391 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 392 TYR OH : rot 180:sc= -0.746 USER MOD Single : A 395 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 LYS NZ :NH3+ -160:sc= -0.0239 (180deg=-0.209) USER MOD Single : A 405 THR OG1 : rot 180:sc= 0 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 80:sc= 0.822 USER MOD Single : A 417 THR OG1 : rot 2:sc= -0.0737 USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 428 THR OG1 : rot -140:sc= -0.625 USER MOD Single : A 431 GLN : amide:sc= -0.0741 X(o=-0.074,f=-0.074) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= -0.0208 X(o=-0.021,f=-0.26) USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN :FLIP amide:sc= -1.23 F(o=-2.3!,f=-1.2) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0265) USER MOD ----------------------------------------------------------------- ATOM 43 N SER A 379 -0.432 16.789 0.809 1.00 0.00 N ATOM 44 CA SER A 379 0.571 15.760 0.576 1.00 0.00 C ATOM 45 C SER A 379 0.440 14.629 1.592 1.00 0.00 C ATOM 46 O SER A 379 0.493 13.451 1.238 1.00 0.00 O ATOM 47 CB SER A 379 1.973 16.364 0.644 1.00 0.00 C ATOM 48 OG SER A 379 2.160 17.086 1.849 1.00 0.00 O ATOM 0 HA SER A 379 0.408 15.347 -0.420 1.00 0.00 H new ATOM 0 HB2 SER A 379 2.718 15.571 0.572 1.00 0.00 H new ATOM 0 HB3 SER A 379 2.129 17.026 -0.208 1.00 0.00 H new ATOM 0 HG SER A 379 1.303 17.461 2.142 1.00 0.00 H new ATOM 54 N ILE A 380 0.273 14.996 2.858 1.00 0.00 N ATOM 55 CA ILE A 380 0.140 14.014 3.927 1.00 0.00 C ATOM 56 C ILE A 380 -1.181 13.259 3.823 1.00 0.00 C ATOM 57 O ILE A 380 -1.217 12.036 3.952 1.00 0.00 O ATOM 58 CB ILE A 380 0.241 14.675 5.317 1.00 0.00 C ATOM 59 CG1 ILE A 380 0.259 13.610 6.416 1.00 0.00 C ATOM 60 CG2 ILE A 380 -0.909 15.647 5.533 1.00 0.00 C ATOM 61 CD1 ILE A 380 1.652 13.221 6.859 1.00 0.00 C ATOM 0 H ILE A 380 0.227 15.966 3.169 1.00 0.00 H new ATOM 0 HA ILE A 380 0.963 13.309 3.811 1.00 0.00 H new ATOM 0 HB ILE A 380 1.175 15.235 5.364 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -0.297 13.979 7.277 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -0.261 12.721 6.058 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -0.820 16.103 6.519 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.877 16.424 4.770 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.856 15.111 5.465 1.00 0.00 H new ATOM 0 HD11 ILE A 380 1.587 12.463 7.639 1.00 0.00 H new ATOM 0 HD12 ILE A 380 2.206 12.821 6.009 1.00 0.00 H new ATOM 0 HD13 ILE A 380 2.168 14.099 7.248 1.00 0.00 H new ATOM 73 N LYS A 381 -2.267 13.994 3.592 1.00 0.00 N ATOM 74 CA LYS A 381 -3.597 13.395 3.474 1.00 0.00 C ATOM 75 C LYS A 381 -3.558 12.114 2.643 1.00 0.00 C ATOM 76 O LYS A 381 -4.010 11.059 3.089 1.00 0.00 O ATOM 77 CB LYS A 381 -4.569 14.392 2.843 1.00 0.00 C ATOM 78 CG LYS A 381 -6.010 13.907 2.821 1.00 0.00 C ATOM 79 CD LYS A 381 -6.855 14.719 1.852 1.00 0.00 C ATOM 80 CE LYS A 381 -8.340 14.499 2.089 1.00 0.00 C ATOM 81 NZ LYS A 381 -9.175 15.186 1.065 1.00 0.00 N ATOM 0 H LYS A 381 -2.253 15.008 3.482 1.00 0.00 H new ATOM 0 HA LYS A 381 -3.939 13.140 4.477 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -4.519 15.332 3.392 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -4.249 14.602 1.822 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -6.037 12.855 2.536 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -6.434 13.977 3.823 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -6.621 15.778 1.962 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -6.604 14.442 0.828 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -8.555 13.431 2.075 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -8.607 14.865 3.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -10.181 15.011 1.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -8.989 16.209 1.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -8.939 14.819 0.121 1.00 0.00 H new ATOM 95 N LYS A 382 -3.009 12.213 1.438 1.00 0.00 N ATOM 96 CA LYS A 382 -2.906 11.062 0.551 1.00 0.00 C ATOM 97 C LYS A 382 -2.011 9.988 1.161 1.00 0.00 C ATOM 98 O LYS A 382 -2.215 8.795 0.933 1.00 0.00 O ATOM 99 CB LYS A 382 -2.360 11.489 -0.813 1.00 0.00 C ATOM 100 CG LYS A 382 -3.444 11.734 -1.851 1.00 0.00 C ATOM 101 CD LYS A 382 -3.166 12.988 -2.666 1.00 0.00 C ATOM 102 CE LYS A 382 -2.621 12.647 -4.043 1.00 0.00 C ATOM 103 NZ LYS A 382 -2.955 13.693 -5.049 1.00 0.00 N ATOM 0 H LYS A 382 -2.629 13.078 1.054 1.00 0.00 H new ATOM 0 HA LYS A 382 -3.904 10.645 0.417 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -1.772 12.399 -0.691 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -1.683 10.719 -1.182 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -3.512 10.874 -2.517 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -4.410 11.829 -1.354 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -4.084 13.567 -2.770 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -2.451 13.617 -2.136 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -1.539 12.531 -3.986 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -3.028 11.689 -4.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -3.617 13.302 -5.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -3.396 14.505 -4.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -2.086 14.003 -5.529 1.00 0.00 H new ATOM 117 N ILE A 383 -1.021 10.418 1.939 1.00 0.00 N ATOM 118 CA ILE A 383 -0.099 9.492 2.580 1.00 0.00 C ATOM 119 C ILE A 383 -0.795 8.726 3.704 1.00 0.00 C ATOM 120 O ILE A 383 -0.529 7.543 3.922 1.00 0.00 O ATOM 121 CB ILE A 383 1.156 10.233 3.116 1.00 0.00 C ATOM 122 CG1 ILE A 383 2.431 9.523 2.651 1.00 0.00 C ATOM 123 CG2 ILE A 383 1.140 10.358 4.636 1.00 0.00 C ATOM 124 CD1 ILE A 383 3.351 10.411 1.840 1.00 0.00 C ATOM 0 H ILE A 383 -0.839 11.401 2.139 1.00 0.00 H new ATOM 0 HA ILE A 383 0.230 8.774 1.829 1.00 0.00 H new ATOM 0 HB ILE A 383 1.140 11.243 2.707 1.00 0.00 H new ATOM 0 HG12 ILE A 383 2.971 9.153 3.523 1.00 0.00 H new ATOM 0 HG13 ILE A 383 2.157 8.654 2.053 1.00 0.00 H new ATOM 0 HG21 ILE A 383 2.036 10.883 4.967 1.00 0.00 H new ATOM 0 HG22 ILE A 383 0.257 10.917 4.946 1.00 0.00 H new ATOM 0 HG23 ILE A 383 1.115 9.364 5.083 1.00 0.00 H new ATOM 0 HD11 ILE A 383 4.234 9.845 1.543 1.00 0.00 H new ATOM 0 HD12 ILE A 383 2.828 10.761 0.950 1.00 0.00 H new ATOM 0 HD13 ILE A 383 3.654 11.267 2.442 1.00 0.00 H new ATOM 136 N ILE A 384 -1.698 9.404 4.407 1.00 0.00 N ATOM 137 CA ILE A 384 -2.439 8.780 5.496 1.00 0.00 C ATOM 138 C ILE A 384 -3.443 7.774 4.946 1.00 0.00 C ATOM 139 O ILE A 384 -3.559 6.657 5.451 1.00 0.00 O ATOM 140 CB ILE A 384 -3.189 9.823 6.349 1.00 0.00 C ATOM 141 CG1 ILE A 384 -2.237 10.934 6.801 1.00 0.00 C ATOM 142 CG2 ILE A 384 -3.838 9.156 7.553 1.00 0.00 C ATOM 143 CD1 ILE A 384 -0.992 10.425 7.497 1.00 0.00 C ATOM 0 H ILE A 384 -1.933 10.383 4.242 1.00 0.00 H new ATOM 0 HA ILE A 384 -1.712 8.272 6.130 1.00 0.00 H new ATOM 0 HB ILE A 384 -3.972 10.270 5.736 1.00 0.00 H new ATOM 0 HG12 ILE A 384 -1.942 11.523 5.932 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -2.770 11.605 7.474 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -4.363 9.906 8.145 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -4.546 8.401 7.213 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -3.070 8.683 8.165 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -0.367 11.269 7.788 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -1.277 9.861 8.385 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -0.435 9.778 6.819 1.00 0.00 H new ATOM 155 N HIS A 385 -4.159 8.177 3.901 1.00 0.00 N ATOM 156 CA HIS A 385 -5.149 7.309 3.275 1.00 0.00 C ATOM 157 C HIS A 385 -4.483 6.065 2.698 1.00 0.00 C ATOM 158 O HIS A 385 -4.888 4.939 2.988 1.00 0.00 O ATOM 159 CB HIS A 385 -5.896 8.063 2.173 1.00 0.00 C ATOM 160 CG HIS A 385 -7.364 7.772 2.140 1.00 0.00 C ATOM 161 ND1 HIS A 385 -8.329 8.748 2.283 1.00 0.00 N ATOM 162 CD2 HIS A 385 -8.034 6.606 1.976 1.00 0.00 C ATOM 163 CE1 HIS A 385 -9.526 8.194 2.211 1.00 0.00 C ATOM 164 NE2 HIS A 385 -9.375 6.896 2.025 1.00 0.00 N ATOM 0 H HIS A 385 -4.072 9.098 3.471 1.00 0.00 H new ATOM 0 HA HIS A 385 -5.864 6.999 4.037 1.00 0.00 H new ATOM 0 HB2 HIS A 385 -5.749 9.134 2.313 1.00 0.00 H new ATOM 0 HB3 HIS A 385 -5.461 7.805 1.208 1.00 0.00 H new ATOM 0 HD2 HIS A 385 -7.595 5.630 1.833 1.00 0.00 H new ATOM 0 HE1 HIS A 385 -10.469 8.715 2.291 1.00 0.00 H new ATOM 0 HE2 HIS A 385 -10.132 6.218 1.933 1.00 0.00 H new ATOM 173 N VAL A 386 -3.454 6.275 1.881 1.00 0.00 N ATOM 174 CA VAL A 386 -2.730 5.168 1.269 1.00 0.00 C ATOM 175 C VAL A 386 -2.127 4.259 2.335 1.00 0.00 C ATOM 176 O VAL A 386 -2.198 3.034 2.230 1.00 0.00 O ATOM 177 CB VAL A 386 -1.609 5.669 0.338 1.00 0.00 C ATOM 178 CG1 VAL A 386 -2.193 6.437 -0.838 1.00 0.00 C ATOM 179 CG2 VAL A 386 -0.620 6.531 1.106 1.00 0.00 C ATOM 0 H VAL A 386 -3.105 7.200 1.629 1.00 0.00 H new ATOM 0 HA VAL A 386 -3.451 4.605 0.676 1.00 0.00 H new ATOM 0 HB VAL A 386 -1.074 4.803 -0.052 1.00 0.00 H new ATOM 0 HG11 VAL A 386 -1.386 6.783 -1.484 1.00 0.00 H new ATOM 0 HG12 VAL A 386 -2.857 5.785 -1.405 1.00 0.00 H new ATOM 0 HG13 VAL A 386 -2.755 7.295 -0.469 1.00 0.00 H new ATOM 0 HG21 VAL A 386 0.164 6.875 0.431 1.00 0.00 H new ATOM 0 HG22 VAL A 386 -1.139 7.392 1.528 1.00 0.00 H new ATOM 0 HG23 VAL A 386 -0.175 5.945 1.910 1.00 0.00 H new ATOM 189 N LEU A 387 -1.538 4.864 3.364 1.00 0.00 N ATOM 190 CA LEU A 387 -0.930 4.101 4.449 1.00 0.00 C ATOM 191 C LEU A 387 -1.955 3.170 5.090 1.00 0.00 C ATOM 192 O LEU A 387 -1.707 1.975 5.256 1.00 0.00 O ATOM 193 CB LEU A 387 -0.348 5.045 5.504 1.00 0.00 C ATOM 194 CG LEU A 387 1.140 5.360 5.339 1.00 0.00 C ATOM 195 CD1 LEU A 387 1.438 6.786 5.777 1.00 0.00 C ATOM 196 CD2 LEU A 387 1.983 4.369 6.129 1.00 0.00 C ATOM 0 H LEU A 387 -1.469 5.876 3.468 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.123 3.498 4.032 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -0.907 5.981 5.481 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -0.504 4.605 6.489 1.00 0.00 H new ATOM 0 HG LEU A 387 1.397 5.267 4.284 1.00 0.00 H new ATOM 0 HD11 LEU A 387 2.501 6.990 5.652 1.00 0.00 H new ATOM 0 HD12 LEU A 387 0.861 7.482 5.168 1.00 0.00 H new ATOM 0 HD13 LEU A 387 1.166 6.909 6.825 1.00 0.00 H new ATOM 0 HD21 LEU A 387 3.039 4.607 6.001 1.00 0.00 H new ATOM 0 HD22 LEU A 387 1.722 4.431 7.186 1.00 0.00 H new ATOM 0 HD23 LEU A 387 1.792 3.359 5.767 1.00 0.00 H new ATOM 208 N GLU A 388 -3.115 3.723 5.438 1.00 0.00 N ATOM 209 CA GLU A 388 -4.181 2.938 6.050 1.00 0.00 C ATOM 210 C GLU A 388 -4.586 1.789 5.134 1.00 0.00 C ATOM 211 O GLU A 388 -4.739 0.649 5.576 1.00 0.00 O ATOM 212 CB GLU A 388 -5.391 3.826 6.351 1.00 0.00 C ATOM 213 CG GLU A 388 -5.592 4.098 7.833 1.00 0.00 C ATOM 214 CD GLU A 388 -6.203 5.461 8.097 1.00 0.00 C ATOM 215 OE1 GLU A 388 -5.485 6.473 7.954 1.00 0.00 O ATOM 216 OE2 GLU A 388 -7.401 5.515 8.447 1.00 0.00 O ATOM 0 H GLU A 388 -3.339 4.709 5.306 1.00 0.00 H new ATOM 0 HA GLU A 388 -3.811 2.523 6.988 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.273 4.775 5.828 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.288 3.352 5.952 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.236 3.327 8.256 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -4.632 4.029 8.345 1.00 0.00 H new ATOM 223 N LYS A 389 -4.750 2.098 3.850 1.00 0.00 N ATOM 224 CA LYS A 389 -5.126 1.090 2.865 1.00 0.00 C ATOM 225 C LYS A 389 -4.125 -0.060 2.873 1.00 0.00 C ATOM 226 O LYS A 389 -4.505 -1.229 2.819 1.00 0.00 O ATOM 227 CB LYS A 389 -5.203 1.714 1.469 1.00 0.00 C ATOM 228 CG LYS A 389 -6.476 1.366 0.716 1.00 0.00 C ATOM 229 CD LYS A 389 -6.675 -0.139 0.617 1.00 0.00 C ATOM 230 CE LYS A 389 -7.930 -0.587 1.352 1.00 0.00 C ATOM 231 NZ LYS A 389 -9.169 -0.133 0.662 1.00 0.00 N ATOM 0 H LYS A 389 -4.629 3.036 3.469 1.00 0.00 H new ATOM 0 HA LYS A 389 -6.109 0.698 3.128 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -5.130 2.798 1.560 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -4.344 1.384 0.885 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -7.332 1.814 1.221 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -6.436 1.795 -0.285 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -6.743 -0.429 -0.431 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -5.807 -0.650 1.033 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -7.936 -1.674 1.431 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -7.915 -0.194 2.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -9.998 -0.384 1.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -9.137 0.898 0.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -9.239 -0.596 -0.267 1.00 0.00 H new ATOM 245 N VAL A 390 -2.843 0.285 2.957 1.00 0.00 N ATOM 246 CA VAL A 390 -1.786 -0.716 2.987 1.00 0.00 C ATOM 247 C VAL A 390 -1.878 -1.548 4.260 1.00 0.00 C ATOM 248 O VAL A 390 -1.664 -2.760 4.240 1.00 0.00 O ATOM 249 CB VAL A 390 -0.392 -0.069 2.902 1.00 0.00 C ATOM 250 CG1 VAL A 390 0.695 -1.133 2.858 1.00 0.00 C ATOM 251 CG2 VAL A 390 -0.301 0.842 1.687 1.00 0.00 C ATOM 0 H VAL A 390 -2.513 1.249 3.005 1.00 0.00 H new ATOM 0 HA VAL A 390 -1.923 -1.359 2.117 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.240 0.534 3.797 1.00 0.00 H new ATOM 0 HG11 VAL A 390 1.672 -0.653 2.798 1.00 0.00 H new ATOM 0 HG12 VAL A 390 0.645 -1.742 3.761 1.00 0.00 H new ATOM 0 HG13 VAL A 390 0.548 -1.767 1.984 1.00 0.00 H new ATOM 0 HG21 VAL A 390 0.691 1.291 1.642 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -0.477 0.260 0.782 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -1.052 1.628 1.765 1.00 0.00 H new ATOM 261 N GLN A 391 -2.208 -0.888 5.369 1.00 0.00 N ATOM 262 CA GLN A 391 -2.341 -1.570 6.650 1.00 0.00 C ATOM 263 C GLN A 391 -3.385 -2.676 6.554 1.00 0.00 C ATOM 264 O GLN A 391 -3.099 -3.845 6.823 1.00 0.00 O ATOM 265 CB GLN A 391 -2.729 -0.576 7.747 1.00 0.00 C ATOM 266 CG GLN A 391 -2.615 -1.145 9.152 1.00 0.00 C ATOM 267 CD GLN A 391 -2.580 -0.066 10.215 1.00 0.00 C ATOM 268 OE1 GLN A 391 -3.005 1.066 9.983 1.00 0.00 O ATOM 269 NE2 GLN A 391 -2.070 -0.411 11.391 1.00 0.00 N ATOM 0 H GLN A 391 -2.387 0.116 5.404 1.00 0.00 H new ATOM 0 HA GLN A 391 -1.379 -2.015 6.906 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -2.093 0.306 7.668 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -3.754 -0.245 7.580 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -3.458 -1.809 9.341 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -1.711 -1.750 9.223 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -1.729 -1.361 11.540 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -2.019 0.274 12.145 1.00 0.00 H new ATOM 278 N TYR A 392 -4.597 -2.302 6.150 1.00 0.00 N ATOM 279 CA TYR A 392 -5.679 -3.269 5.999 1.00 0.00 C ATOM 280 C TYR A 392 -5.256 -4.383 5.048 1.00 0.00 C ATOM 281 O TYR A 392 -5.361 -5.568 5.371 1.00 0.00 O ATOM 282 CB TYR A 392 -6.941 -2.581 5.474 1.00 0.00 C ATOM 283 CG TYR A 392 -7.282 -1.301 6.204 1.00 0.00 C ATOM 284 CD1 TYR A 392 -7.345 -1.266 7.591 1.00 0.00 C ATOM 285 CD2 TYR A 392 -7.545 -0.129 5.504 1.00 0.00 C ATOM 286 CE1 TYR A 392 -7.657 -0.099 8.260 1.00 0.00 C ATOM 287 CE2 TYR A 392 -7.859 1.042 6.167 1.00 0.00 C ATOM 288 CZ TYR A 392 -7.914 1.052 7.546 1.00 0.00 C ATOM 289 OH TYR A 392 -8.226 2.216 8.208 1.00 0.00 O ATOM 0 H TYR A 392 -4.853 -1.341 5.923 1.00 0.00 H new ATOM 0 HA TYR A 392 -5.899 -3.701 6.975 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -6.811 -2.361 4.414 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -7.781 -3.271 5.556 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -7.147 -2.165 8.155 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -7.503 -0.134 4.425 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -7.700 -0.088 9.339 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -8.060 1.945 5.609 1.00 0.00 H new ATOM 0 HH TYR A 392 -8.377 2.932 7.557 1.00 0.00 H new ATOM 299 N LEU A 393 -4.759 -3.989 3.877 1.00 0.00 N ATOM 300 CA LEU A 393 -4.299 -4.948 2.883 1.00 0.00 C ATOM 301 C LEU A 393 -3.235 -5.857 3.486 1.00 0.00 C ATOM 302 O LEU A 393 -3.238 -7.069 3.265 1.00 0.00 O ATOM 303 CB LEU A 393 -3.749 -4.222 1.654 1.00 0.00 C ATOM 304 CG LEU A 393 -4.665 -4.250 0.428 1.00 0.00 C ATOM 305 CD1 LEU A 393 -4.694 -2.889 -0.251 1.00 0.00 C ATOM 306 CD2 LEU A 393 -4.212 -5.329 -0.547 1.00 0.00 C ATOM 0 H LEU A 393 -4.666 -3.013 3.596 1.00 0.00 H new ATOM 0 HA LEU A 393 -5.145 -5.560 2.569 1.00 0.00 H new ATOM 0 HB2 LEU A 393 -3.554 -3.183 1.920 1.00 0.00 H new ATOM 0 HB3 LEU A 393 -2.791 -4.668 1.385 1.00 0.00 H new ATOM 0 HG LEU A 393 -5.677 -4.486 0.757 1.00 0.00 H new ATOM 0 HD11 LEU A 393 -5.351 -2.930 -1.120 1.00 0.00 H new ATOM 0 HD12 LEU A 393 -5.065 -2.141 0.449 1.00 0.00 H new ATOM 0 HD13 LEU A 393 -3.687 -2.620 -0.570 1.00 0.00 H new ATOM 0 HD21 LEU A 393 -4.873 -5.337 -1.414 1.00 0.00 H new ATOM 0 HD22 LEU A 393 -3.192 -5.122 -0.870 1.00 0.00 H new ATOM 0 HD23 LEU A 393 -4.247 -6.301 -0.055 1.00 0.00 H new ATOM 318 N GLU A 394 -2.332 -5.264 4.266 1.00 0.00 N ATOM 319 CA GLU A 394 -1.275 -6.022 4.921 1.00 0.00 C ATOM 320 C GLU A 394 -1.886 -7.136 5.761 1.00 0.00 C ATOM 321 O GLU A 394 -1.442 -8.284 5.711 1.00 0.00 O ATOM 322 CB GLU A 394 -0.424 -5.106 5.803 1.00 0.00 C ATOM 323 CG GLU A 394 0.940 -5.683 6.141 1.00 0.00 C ATOM 324 CD GLU A 394 1.903 -4.636 6.664 1.00 0.00 C ATOM 325 OE1 GLU A 394 1.701 -4.158 7.800 1.00 0.00 O ATOM 326 OE2 GLU A 394 2.861 -4.294 5.938 1.00 0.00 O ATOM 0 H GLU A 394 -2.314 -4.262 4.458 1.00 0.00 H new ATOM 0 HA GLU A 394 -0.632 -6.459 4.157 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -0.290 -4.150 5.297 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -0.963 -4.903 6.728 1.00 0.00 H new ATOM 0 HG2 GLU A 394 0.823 -6.469 6.887 1.00 0.00 H new ATOM 0 HG3 GLU A 394 1.364 -6.149 5.251 1.00 0.00 H new ATOM 333 N GLN A 395 -2.926 -6.790 6.516 1.00 0.00 N ATOM 334 CA GLN A 395 -3.618 -7.765 7.346 1.00 0.00 C ATOM 335 C GLN A 395 -4.158 -8.892 6.473 1.00 0.00 C ATOM 336 O GLN A 395 -3.990 -10.072 6.783 1.00 0.00 O ATOM 337 CB GLN A 395 -4.761 -7.101 8.116 1.00 0.00 C ATOM 338 CG GLN A 395 -4.291 -6.255 9.288 1.00 0.00 C ATOM 339 CD GLN A 395 -5.336 -6.144 10.383 1.00 0.00 C ATOM 340 OE1 GLN A 395 -5.835 -7.152 10.883 1.00 0.00 O ATOM 341 NE2 GLN A 395 -5.672 -4.916 10.759 1.00 0.00 N ATOM 0 H GLN A 395 -3.305 -5.844 6.568 1.00 0.00 H new ATOM 0 HA GLN A 395 -2.912 -8.176 8.067 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -5.333 -6.474 7.432 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -5.438 -7.873 8.483 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -3.381 -6.688 9.702 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -4.036 -5.257 8.932 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -5.232 -4.109 10.317 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -6.370 -4.780 11.490 1.00 0.00 H new ATOM 350 N GLU A 396 -4.791 -8.514 5.363 1.00 0.00 N ATOM 351 CA GLU A 396 -5.337 -9.491 4.428 1.00 0.00 C ATOM 352 C GLU A 396 -4.231 -10.415 3.935 1.00 0.00 C ATOM 353 O GLU A 396 -4.435 -11.618 3.779 1.00 0.00 O ATOM 354 CB GLU A 396 -5.997 -8.788 3.240 1.00 0.00 C ATOM 355 CG GLU A 396 -6.865 -7.606 3.638 1.00 0.00 C ATOM 356 CD GLU A 396 -7.961 -7.322 2.631 1.00 0.00 C ATOM 357 OE1 GLU A 396 -8.774 -8.233 2.365 1.00 0.00 O ATOM 358 OE2 GLU A 396 -8.008 -6.189 2.108 1.00 0.00 O ATOM 0 H GLU A 396 -4.937 -7.542 5.092 1.00 0.00 H new ATOM 0 HA GLU A 396 -6.093 -10.081 4.946 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -5.222 -8.444 2.555 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -6.607 -9.509 2.695 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -7.314 -7.801 4.612 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -6.239 -6.721 3.747 1.00 0.00 H new ATOM 365 N VAL A 397 -3.053 -9.840 3.706 1.00 0.00 N ATOM 366 CA VAL A 397 -1.905 -10.609 3.245 1.00 0.00 C ATOM 367 C VAL A 397 -1.501 -11.639 4.293 1.00 0.00 C ATOM 368 O VAL A 397 -1.225 -12.794 3.970 1.00 0.00 O ATOM 369 CB VAL A 397 -0.697 -9.701 2.942 1.00 0.00 C ATOM 370 CG1 VAL A 397 0.454 -10.512 2.368 1.00 0.00 C ATOM 371 CG2 VAL A 397 -1.094 -8.579 1.994 1.00 0.00 C ATOM 0 H VAL A 397 -2.871 -8.844 3.833 1.00 0.00 H new ATOM 0 HA VAL A 397 -2.202 -11.112 2.325 1.00 0.00 H new ATOM 0 HB VAL A 397 -0.362 -9.253 3.878 1.00 0.00 H new ATOM 0 HG11 VAL A 397 1.297 -9.852 2.161 1.00 0.00 H new ATOM 0 HG12 VAL A 397 0.757 -11.273 3.087 1.00 0.00 H new ATOM 0 HG13 VAL A 397 0.135 -10.993 1.444 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -0.227 -7.949 1.793 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -1.459 -9.005 1.059 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -1.881 -7.978 2.450 1.00 0.00 H new ATOM 381 N GLU A 398 -1.480 -11.212 5.552 1.00 0.00 N ATOM 382 CA GLU A 398 -1.120 -12.098 6.650 1.00 0.00 C ATOM 383 C GLU A 398 -2.090 -13.272 6.729 1.00 0.00 C ATOM 384 O GLU A 398 -1.683 -14.416 6.924 1.00 0.00 O ATOM 385 CB GLU A 398 -1.117 -11.332 7.975 1.00 0.00 C ATOM 386 CG GLU A 398 -0.733 -12.187 9.170 1.00 0.00 C ATOM 387 CD GLU A 398 -0.773 -11.415 10.476 1.00 0.00 C ATOM 388 OE1 GLU A 398 0.243 -10.776 10.818 1.00 0.00 O ATOM 389 OE2 GLU A 398 -1.821 -11.450 11.153 1.00 0.00 O ATOM 0 H GLU A 398 -1.708 -10.259 5.835 1.00 0.00 H new ATOM 0 HA GLU A 398 -0.118 -12.484 6.464 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -0.423 -10.495 7.900 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -2.108 -10.910 8.144 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -1.410 -13.039 9.235 1.00 0.00 H new ATOM 0 HG3 GLU A 398 0.270 -12.587 9.019 1.00 0.00 H new ATOM 396 N GLU A 399 -3.377 -12.978 6.565 1.00 0.00 N ATOM 397 CA GLU A 399 -4.406 -14.011 6.610 1.00 0.00 C ATOM 398 C GLU A 399 -4.539 -14.717 5.260 1.00 0.00 C ATOM 399 O GLU A 399 -5.155 -15.779 5.166 1.00 0.00 O ATOM 400 CB GLU A 399 -5.752 -13.407 7.017 1.00 0.00 C ATOM 401 CG GLU A 399 -6.234 -12.309 6.085 1.00 0.00 C ATOM 402 CD GLU A 399 -7.731 -12.085 6.172 1.00 0.00 C ATOM 403 OE1 GLU A 399 -8.477 -13.083 6.237 1.00 0.00 O ATOM 404 OE2 GLU A 399 -8.156 -10.909 6.175 1.00 0.00 O ATOM 0 H GLU A 399 -3.731 -12.036 6.400 1.00 0.00 H new ATOM 0 HA GLU A 399 -4.106 -14.748 7.355 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -6.501 -14.199 7.050 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -5.669 -13.004 8.027 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -5.717 -11.380 6.326 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -5.968 -12.565 5.060 1.00 0.00 H new ATOM 411 N PHE A 400 -3.955 -14.125 4.217 1.00 0.00 N ATOM 412 CA PHE A 400 -4.008 -14.705 2.876 1.00 0.00 C ATOM 413 C PHE A 400 -3.635 -16.186 2.914 1.00 0.00 C ATOM 414 O PHE A 400 -2.558 -16.552 3.383 1.00 0.00 O ATOM 415 CB PHE A 400 -3.064 -13.946 1.936 1.00 0.00 C ATOM 416 CG PHE A 400 -3.059 -14.468 0.526 1.00 0.00 C ATOM 417 CD1 PHE A 400 -4.037 -14.083 -0.380 1.00 0.00 C ATOM 418 CD2 PHE A 400 -2.073 -15.348 0.105 1.00 0.00 C ATOM 419 CE1 PHE A 400 -4.031 -14.566 -1.671 1.00 0.00 C ATOM 420 CE2 PHE A 400 -2.063 -15.833 -1.188 1.00 0.00 C ATOM 421 CZ PHE A 400 -3.043 -15.442 -2.076 1.00 0.00 C ATOM 0 H PHE A 400 -3.441 -13.246 4.276 1.00 0.00 H new ATOM 0 HA PHE A 400 -5.028 -14.617 2.502 1.00 0.00 H new ATOM 0 HB2 PHE A 400 -3.349 -12.894 1.923 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -2.051 -13.997 2.335 1.00 0.00 H new ATOM 0 HD1 PHE A 400 -4.812 -13.397 -0.070 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -1.304 -15.658 0.797 1.00 0.00 H new ATOM 0 HE1 PHE A 400 -4.799 -14.259 -2.366 1.00 0.00 H new ATOM 0 HE2 PHE A 400 -1.289 -16.517 -1.503 1.00 0.00 H new ATOM 0 HZ PHE A 400 -3.038 -15.821 -3.087 1.00 0.00 H new ATOM 431 N VAL A 401 -4.542 -17.034 2.428 1.00 0.00 N ATOM 432 CA VAL A 401 -4.325 -18.481 2.413 1.00 0.00 C ATOM 433 C VAL A 401 -2.899 -18.834 1.991 1.00 0.00 C ATOM 434 O VAL A 401 -2.242 -19.662 2.623 1.00 0.00 O ATOM 435 CB VAL A 401 -5.322 -19.185 1.470 1.00 0.00 C ATOM 436 CG1 VAL A 401 -5.147 -18.699 0.040 1.00 0.00 C ATOM 437 CG2 VAL A 401 -5.161 -20.698 1.551 1.00 0.00 C ATOM 0 H VAL A 401 -5.438 -16.742 2.038 1.00 0.00 H new ATOM 0 HA VAL A 401 -4.486 -18.831 3.433 1.00 0.00 H new ATOM 0 HB VAL A 401 -6.332 -18.932 1.792 1.00 0.00 H new ATOM 0 HG11 VAL A 401 -5.860 -19.209 -0.607 1.00 0.00 H new ATOM 0 HG12 VAL A 401 -5.322 -17.624 -0.003 1.00 0.00 H new ATOM 0 HG13 VAL A 401 -4.133 -18.915 -0.296 1.00 0.00 H new ATOM 0 HG21 VAL A 401 -5.873 -21.176 0.879 1.00 0.00 H new ATOM 0 HG22 VAL A 401 -4.147 -20.972 1.260 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -5.348 -21.030 2.572 1.00 0.00 H new ATOM 447 N GLY A 402 -2.425 -18.196 0.927 1.00 0.00 N ATOM 448 CA GLY A 402 -1.080 -18.453 0.446 1.00 0.00 C ATOM 449 C GLY A 402 -1.060 -19.031 -0.955 1.00 0.00 C ATOM 450 O GLY A 402 -0.090 -19.679 -1.351 1.00 0.00 O ATOM 0 H GLY A 402 -2.948 -17.505 0.389 1.00 0.00 H new ATOM 0 HA2 GLY A 402 -0.510 -17.524 0.459 1.00 0.00 H new ATOM 0 HA3 GLY A 402 -0.581 -19.143 1.126 1.00 0.00 H new ATOM 454 N LYS A 403 -2.127 -18.796 -1.711 1.00 0.00 N ATOM 455 CA LYS A 403 -2.221 -19.298 -3.076 1.00 0.00 C ATOM 456 C LYS A 403 -3.029 -18.349 -3.953 1.00 0.00 C ATOM 457 O LYS A 403 -4.018 -17.767 -3.506 1.00 0.00 O ATOM 458 CB LYS A 403 -2.856 -20.690 -3.088 1.00 0.00 C ATOM 459 CG LYS A 403 -1.851 -21.820 -2.935 1.00 0.00 C ATOM 460 CD LYS A 403 -1.461 -22.405 -4.283 1.00 0.00 C ATOM 461 CE LYS A 403 -2.240 -23.675 -4.586 1.00 0.00 C ATOM 462 NZ LYS A 403 -1.396 -24.695 -5.267 1.00 0.00 N ATOM 0 H LYS A 403 -2.938 -18.261 -1.401 1.00 0.00 H new ATOM 0 HA LYS A 403 -1.211 -19.364 -3.481 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -3.587 -20.754 -2.282 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -3.400 -20.824 -4.023 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -0.961 -21.450 -2.426 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -2.275 -22.603 -2.306 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -1.643 -21.669 -5.066 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -0.393 -22.621 -4.291 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -2.633 -24.090 -3.658 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -3.097 -23.434 -5.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -1.964 -25.545 -5.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -1.041 -24.309 -6.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -0.592 -24.944 -4.656 1.00 0.00 H new ATOM 476 N LYS A 404 -2.604 -18.198 -5.202 1.00 0.00 N ATOM 477 CA LYS A 404 -3.288 -17.318 -6.143 1.00 0.00 C ATOM 478 C LYS A 404 -4.494 -18.015 -6.768 1.00 0.00 C ATOM 479 O LYS A 404 -4.598 -18.122 -7.990 1.00 0.00 O ATOM 480 CB LYS A 404 -2.321 -16.860 -7.237 1.00 0.00 C ATOM 481 CG LYS A 404 -2.914 -15.820 -8.176 1.00 0.00 C ATOM 482 CD LYS A 404 -1.832 -15.118 -8.981 1.00 0.00 C ATOM 483 CE LYS A 404 -2.356 -14.651 -10.329 1.00 0.00 C ATOM 484 NZ LYS A 404 -2.606 -15.792 -11.253 1.00 0.00 N ATOM 0 H LYS A 404 -1.788 -18.674 -5.587 1.00 0.00 H new ATOM 0 HA LYS A 404 -3.644 -16.446 -5.594 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -1.426 -16.448 -6.770 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -2.007 -17.726 -7.819 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -3.620 -16.300 -8.854 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -3.475 -15.085 -7.599 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -1.456 -14.263 -8.419 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -0.991 -15.795 -9.131 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -3.280 -14.091 -10.185 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -1.637 -13.968 -10.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -2.630 -15.446 -12.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -1.845 -16.494 -11.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -3.518 -16.234 -11.020 1.00 0.00 H new ATOM 498 N THR A 405 -5.403 -18.489 -5.921 1.00 0.00 N ATOM 499 CA THR A 405 -6.602 -19.176 -6.392 1.00 0.00 C ATOM 500 C THR A 405 -7.865 -18.470 -5.903 1.00 0.00 C ATOM 501 O THR A 405 -8.895 -18.488 -6.578 1.00 0.00 O ATOM 502 CB THR A 405 -6.600 -20.629 -5.916 1.00 0.00 C ATOM 503 OG1 THR A 405 -7.824 -21.263 -6.240 1.00 0.00 O ATOM 504 CG2 THR A 405 -6.392 -20.770 -4.424 1.00 0.00 C ATOM 0 H THR A 405 -5.333 -18.410 -4.906 1.00 0.00 H new ATOM 0 HA THR A 405 -6.597 -19.156 -7.482 1.00 0.00 H new ATOM 0 HB THR A 405 -5.762 -21.100 -6.429 1.00 0.00 H new ATOM 0 HG1 THR A 405 -7.803 -22.192 -5.929 1.00 0.00 H new ATOM 0 HG21 THR A 405 -6.401 -21.826 -4.154 1.00 0.00 H new ATOM 0 HG22 THR A 405 -5.432 -20.333 -4.148 1.00 0.00 H new ATOM 0 HG23 THR A 405 -7.192 -20.253 -3.895 1.00 0.00 H new ATOM 512 N ASP A 406 -7.780 -17.851 -4.730 1.00 0.00 N ATOM 513 CA ASP A 406 -8.919 -17.142 -4.158 1.00 0.00 C ATOM 514 C ASP A 406 -8.956 -15.695 -4.640 1.00 0.00 C ATOM 515 O ASP A 406 -7.961 -15.170 -5.137 1.00 0.00 O ATOM 516 CB ASP A 406 -8.854 -17.180 -2.630 1.00 0.00 C ATOM 517 CG ASP A 406 -10.112 -16.636 -1.983 1.00 0.00 C ATOM 518 OD1 ASP A 406 -11.127 -17.364 -1.953 1.00 0.00 O ATOM 519 OD2 ASP A 406 -10.083 -15.482 -1.505 1.00 0.00 O ATOM 0 H ASP A 406 -6.936 -17.826 -4.158 1.00 0.00 H new ATOM 0 HA ASP A 406 -9.830 -17.641 -4.489 1.00 0.00 H new ATOM 0 HB2 ASP A 406 -8.695 -18.207 -2.302 1.00 0.00 H new ATOM 0 HB3 ASP A 406 -7.995 -16.601 -2.291 1.00 0.00 H new ATOM 524 N LYS A 407 -10.112 -15.057 -4.490 1.00 0.00 N ATOM 525 CA LYS A 407 -10.280 -13.670 -4.911 1.00 0.00 C ATOM 526 C LYS A 407 -9.435 -12.726 -4.060 1.00 0.00 C ATOM 527 O LYS A 407 -9.188 -11.582 -4.446 1.00 0.00 O ATOM 528 CB LYS A 407 -11.754 -13.267 -4.829 1.00 0.00 C ATOM 529 CG LYS A 407 -12.698 -14.276 -5.462 1.00 0.00 C ATOM 530 CD LYS A 407 -13.321 -15.189 -4.418 1.00 0.00 C ATOM 531 CE LYS A 407 -14.770 -15.507 -4.749 1.00 0.00 C ATOM 532 NZ LYS A 407 -15.612 -15.602 -3.524 1.00 0.00 N ATOM 0 H LYS A 407 -10.946 -15.478 -4.080 1.00 0.00 H new ATOM 0 HA LYS A 407 -9.942 -13.591 -5.944 1.00 0.00 H new ATOM 0 HB2 LYS A 407 -12.028 -13.133 -3.782 1.00 0.00 H new ATOM 0 HB3 LYS A 407 -11.886 -12.302 -5.319 1.00 0.00 H new ATOM 0 HG2 LYS A 407 -13.485 -13.750 -6.003 1.00 0.00 H new ATOM 0 HG3 LYS A 407 -12.155 -14.875 -6.193 1.00 0.00 H new ATOM 0 HD2 LYS A 407 -12.749 -16.115 -4.355 1.00 0.00 H new ATOM 0 HD3 LYS A 407 -13.266 -14.714 -3.439 1.00 0.00 H new ATOM 0 HE2 LYS A 407 -15.170 -14.734 -5.406 1.00 0.00 H new ATOM 0 HE3 LYS A 407 -14.819 -16.448 -5.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 -16.593 -15.820 -3.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 -15.246 -16.356 -2.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 -15.586 -14.696 -3.014 1.00 0.00 H new ATOM 546 N ALA A 408 -8.993 -13.209 -2.900 1.00 0.00 N ATOM 547 CA ALA A 408 -8.177 -12.403 -1.999 1.00 0.00 C ATOM 548 C ALA A 408 -6.965 -11.818 -2.720 1.00 0.00 C ATOM 549 O ALA A 408 -6.744 -10.608 -2.697 1.00 0.00 O ATOM 550 CB ALA A 408 -7.729 -13.238 -0.809 1.00 0.00 C ATOM 0 H ALA A 408 -9.187 -14.152 -2.564 1.00 0.00 H new ATOM 0 HA ALA A 408 -8.788 -11.573 -1.644 1.00 0.00 H new ATOM 0 HB1 ALA A 408 -7.121 -12.626 -0.143 1.00 0.00 H new ATOM 0 HB2 ALA A 408 -8.604 -13.601 -0.270 1.00 0.00 H new ATOM 0 HB3 ALA A 408 -7.141 -14.086 -1.160 1.00 0.00 H new ATOM 556 N TYR A 409 -6.184 -12.682 -3.358 1.00 0.00 N ATOM 557 CA TYR A 409 -4.996 -12.243 -4.081 1.00 0.00 C ATOM 558 C TYR A 409 -5.360 -11.231 -5.163 1.00 0.00 C ATOM 559 O TYR A 409 -4.626 -10.271 -5.398 1.00 0.00 O ATOM 560 CB TYR A 409 -4.274 -13.438 -4.697 1.00 0.00 C ATOM 561 CG TYR A 409 -2.792 -13.213 -4.893 1.00 0.00 C ATOM 562 CD1 TYR A 409 -1.942 -13.066 -3.804 1.00 0.00 C ATOM 563 CD2 TYR A 409 -2.241 -13.150 -6.168 1.00 0.00 C ATOM 564 CE1 TYR A 409 -0.587 -12.860 -3.977 1.00 0.00 C ATOM 565 CE2 TYR A 409 -0.886 -12.944 -6.350 1.00 0.00 C ATOM 566 CZ TYR A 409 -0.064 -12.800 -5.252 1.00 0.00 C ATOM 567 OH TYR A 409 1.286 -12.595 -5.428 1.00 0.00 O ATOM 0 H TYR A 409 -6.351 -13.688 -3.390 1.00 0.00 H new ATOM 0 HA TYR A 409 -4.327 -11.758 -3.370 1.00 0.00 H new ATOM 0 HB2 TYR A 409 -4.420 -14.309 -4.058 1.00 0.00 H new ATOM 0 HB3 TYR A 409 -4.729 -13.670 -5.660 1.00 0.00 H new ATOM 0 HD1 TYR A 409 -2.348 -13.114 -2.804 1.00 0.00 H new ATOM 0 HD2 TYR A 409 -2.882 -13.264 -7.030 1.00 0.00 H new ATOM 0 HE1 TYR A 409 0.059 -12.747 -3.119 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.473 -12.896 -7.347 1.00 0.00 H new ATOM 0 HH TYR A 409 1.766 -13.438 -5.290 1.00 0.00 H new ATOM 577 N TRP A 410 -6.501 -11.445 -5.814 1.00 0.00 N ATOM 578 CA TRP A 410 -6.956 -10.535 -6.859 1.00 0.00 C ATOM 579 C TRP A 410 -7.117 -9.131 -6.296 1.00 0.00 C ATOM 580 O TRP A 410 -6.410 -8.201 -6.692 1.00 0.00 O ATOM 581 CB TRP A 410 -8.290 -11.010 -7.443 1.00 0.00 C ATOM 582 CG TRP A 410 -8.237 -12.388 -8.026 1.00 0.00 C ATOM 583 CD1 TRP A 410 -7.121 -13.094 -8.373 1.00 0.00 C ATOM 584 CD2 TRP A 410 -9.355 -13.226 -8.332 1.00 0.00 C ATOM 585 NE1 TRP A 410 -7.478 -14.321 -8.877 1.00 0.00 N ATOM 586 CE2 TRP A 410 -8.844 -14.426 -8.861 1.00 0.00 C ATOM 587 CE3 TRP A 410 -10.739 -13.079 -8.207 1.00 0.00 C ATOM 588 CZ2 TRP A 410 -9.671 -15.472 -9.267 1.00 0.00 C ATOM 589 CZ3 TRP A 410 -11.558 -14.117 -8.609 1.00 0.00 C ATOM 590 CH2 TRP A 410 -11.022 -15.301 -9.133 1.00 0.00 C ATOM 0 H TRP A 410 -7.122 -12.234 -5.638 1.00 0.00 H new ATOM 0 HA TRP A 410 -6.208 -10.523 -7.652 1.00 0.00 H new ATOM 0 HB2 TRP A 410 -9.048 -10.986 -6.660 1.00 0.00 H new ATOM 0 HB3 TRP A 410 -8.607 -10.310 -8.216 1.00 0.00 H new ATOM 0 HD1 TRP A 410 -6.106 -12.740 -8.267 1.00 0.00 H new ATOM 0 HE1 TRP A 410 -6.832 -15.037 -9.209 1.00 0.00 H new ATOM 0 HE3 TRP A 410 -11.161 -12.170 -7.803 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 -9.260 -16.385 -9.673 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 -12.629 -14.014 -8.518 1.00 0.00 H new ATOM 0 HH2 TRP A 410 -11.689 -16.094 -9.437 1.00 0.00 H new ATOM 601 N LEU A 411 -8.048 -8.989 -5.356 1.00 0.00 N ATOM 602 CA LEU A 411 -8.299 -7.705 -4.717 1.00 0.00 C ATOM 603 C LEU A 411 -7.033 -7.194 -4.039 1.00 0.00 C ATOM 604 O LEU A 411 -6.804 -5.989 -3.946 1.00 0.00 O ATOM 605 CB LEU A 411 -9.432 -7.833 -3.697 1.00 0.00 C ATOM 606 CG LEU A 411 -9.251 -8.938 -2.656 1.00 0.00 C ATOM 607 CD1 LEU A 411 -8.410 -8.440 -1.490 1.00 0.00 C ATOM 608 CD2 LEU A 411 -10.602 -9.436 -2.168 1.00 0.00 C ATOM 0 H LEU A 411 -8.640 -9.749 -5.021 1.00 0.00 H new ATOM 0 HA LEU A 411 -8.597 -6.988 -5.482 1.00 0.00 H new ATOM 0 HB2 LEU A 411 -9.540 -6.881 -3.177 1.00 0.00 H new ATOM 0 HB3 LEU A 411 -10.364 -8.011 -4.234 1.00 0.00 H new ATOM 0 HG LEU A 411 -8.727 -9.771 -3.125 1.00 0.00 H new ATOM 0 HD11 LEU A 411 -8.292 -9.240 -0.759 1.00 0.00 H new ATOM 0 HD12 LEU A 411 -7.429 -8.133 -1.854 1.00 0.00 H new ATOM 0 HD13 LEU A 411 -8.906 -7.590 -1.021 1.00 0.00 H new ATOM 0 HD21 LEU A 411 -10.454 -10.222 -1.428 1.00 0.00 H new ATOM 0 HD22 LEU A 411 -11.152 -8.611 -1.716 1.00 0.00 H new ATOM 0 HD23 LEU A 411 -11.169 -9.833 -3.010 1.00 0.00 H new ATOM 620 N LEU A 412 -6.206 -8.129 -3.576 1.00 0.00 N ATOM 621 CA LEU A 412 -4.953 -7.788 -2.911 1.00 0.00 C ATOM 622 C LEU A 412 -4.056 -6.966 -3.833 1.00 0.00 C ATOM 623 O LEU A 412 -3.766 -5.799 -3.566 1.00 0.00 O ATOM 624 CB LEU A 412 -4.220 -9.066 -2.487 1.00 0.00 C ATOM 625 CG LEU A 412 -4.629 -9.645 -1.128 1.00 0.00 C ATOM 626 CD1 LEU A 412 -4.159 -11.086 -1.000 1.00 0.00 C ATOM 627 CD2 LEU A 412 -4.064 -8.797 0.000 1.00 0.00 C ATOM 0 H LEU A 412 -6.383 -9.131 -3.650 1.00 0.00 H new ATOM 0 HA LEU A 412 -5.186 -7.192 -2.029 1.00 0.00 H new ATOM 0 HB2 LEU A 412 -4.383 -9.827 -3.250 1.00 0.00 H new ATOM 0 HB3 LEU A 412 -3.150 -8.860 -2.467 1.00 0.00 H new ATOM 0 HG LEU A 412 -5.717 -9.632 -1.059 1.00 0.00 H new ATOM 0 HD11 LEU A 412 -4.458 -11.481 -0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 412 -4.609 -11.687 -1.791 1.00 0.00 H new ATOM 0 HD13 LEU A 412 -3.073 -11.124 -1.088 1.00 0.00 H new ATOM 0 HD21 LEU A 412 -4.363 -9.221 0.959 1.00 0.00 H new ATOM 0 HD22 LEU A 412 -2.976 -8.781 -0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 412 -4.447 -7.780 -0.082 1.00 0.00 H new ATOM 639 N GLU A 413 -3.610 -7.594 -4.919 1.00 0.00 N ATOM 640 CA GLU A 413 -2.732 -6.941 -5.883 1.00 0.00 C ATOM 641 C GLU A 413 -3.396 -5.730 -6.531 1.00 0.00 C ATOM 642 O GLU A 413 -2.848 -4.626 -6.505 1.00 0.00 O ATOM 643 CB GLU A 413 -2.308 -7.937 -6.965 1.00 0.00 C ATOM 644 CG GLU A 413 -1.257 -8.932 -6.499 1.00 0.00 C ATOM 645 CD GLU A 413 -0.259 -9.276 -7.587 1.00 0.00 C ATOM 646 OE1 GLU A 413 -0.654 -9.297 -8.771 1.00 0.00 O ATOM 647 OE2 GLU A 413 0.919 -9.527 -7.254 1.00 0.00 O ATOM 0 H GLU A 413 -3.845 -8.559 -5.153 1.00 0.00 H new ATOM 0 HA GLU A 413 -1.855 -6.589 -5.340 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -3.186 -8.483 -7.308 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -1.920 -7.386 -7.822 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -0.726 -8.519 -5.641 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -1.749 -9.844 -6.161 1.00 0.00 H new ATOM 654 N GLU A 414 -4.570 -5.935 -7.125 1.00 0.00 N ATOM 655 CA GLU A 414 -5.287 -4.849 -7.790 1.00 0.00 C ATOM 656 C GLU A 414 -5.443 -3.637 -6.874 1.00 0.00 C ATOM 657 O GLU A 414 -5.237 -2.498 -7.299 1.00 0.00 O ATOM 658 CB GLU A 414 -6.657 -5.326 -8.279 1.00 0.00 C ATOM 659 CG GLU A 414 -7.665 -5.554 -7.168 1.00 0.00 C ATOM 660 CD GLU A 414 -8.374 -4.280 -6.751 1.00 0.00 C ATOM 661 OE1 GLU A 414 -8.437 -3.341 -7.573 1.00 0.00 O ATOM 662 OE2 GLU A 414 -8.864 -4.220 -5.604 1.00 0.00 O ATOM 0 H GLU A 414 -5.043 -6.838 -7.160 1.00 0.00 H new ATOM 0 HA GLU A 414 -4.694 -4.543 -8.652 1.00 0.00 H new ATOM 0 HB2 GLU A 414 -7.059 -4.590 -8.975 1.00 0.00 H new ATOM 0 HB3 GLU A 414 -6.529 -6.254 -8.836 1.00 0.00 H new ATOM 0 HG2 GLU A 414 -8.404 -6.285 -7.497 1.00 0.00 H new ATOM 0 HG3 GLU A 414 -7.157 -5.982 -6.304 1.00 0.00 H new ATOM 669 N MET A 415 -5.802 -3.881 -5.617 1.00 0.00 N ATOM 670 CA MET A 415 -5.974 -2.799 -4.656 1.00 0.00 C ATOM 671 C MET A 415 -4.646 -2.102 -4.388 1.00 0.00 C ATOM 672 O MET A 415 -4.571 -0.873 -4.368 1.00 0.00 O ATOM 673 CB MET A 415 -6.563 -3.329 -3.346 1.00 0.00 C ATOM 674 CG MET A 415 -6.982 -2.232 -2.381 1.00 0.00 C ATOM 675 SD MET A 415 -7.962 -2.859 -1.003 1.00 0.00 S ATOM 676 CE MET A 415 -9.604 -2.837 -1.717 1.00 0.00 C ATOM 0 H MET A 415 -5.978 -4.813 -5.243 1.00 0.00 H new ATOM 0 HA MET A 415 -6.668 -2.075 -5.083 1.00 0.00 H new ATOM 0 HB2 MET A 415 -7.428 -3.953 -3.572 1.00 0.00 H new ATOM 0 HB3 MET A 415 -5.827 -3.969 -2.859 1.00 0.00 H new ATOM 0 HG2 MET A 415 -6.093 -1.735 -1.993 1.00 0.00 H new ATOM 0 HG3 MET A 415 -7.558 -1.480 -2.920 1.00 0.00 H new ATOM 0 HE1 MET A 415 -10.325 -3.199 -0.984 1.00 0.00 H new ATOM 0 HE2 MET A 415 -9.861 -1.818 -2.006 1.00 0.00 H new ATOM 0 HE3 MET A 415 -9.627 -3.481 -2.596 1.00 0.00 H new ATOM 686 N LEU A 416 -3.597 -2.894 -4.189 1.00 0.00 N ATOM 687 CA LEU A 416 -2.270 -2.348 -3.929 1.00 0.00 C ATOM 688 C LEU A 416 -1.799 -1.497 -5.106 1.00 0.00 C ATOM 689 O LEU A 416 -1.281 -0.395 -4.919 1.00 0.00 O ATOM 690 CB LEU A 416 -1.274 -3.482 -3.662 1.00 0.00 C ATOM 691 CG LEU A 416 -0.773 -3.581 -2.218 1.00 0.00 C ATOM 692 CD1 LEU A 416 -1.923 -3.405 -1.236 1.00 0.00 C ATOM 693 CD2 LEU A 416 -0.074 -4.912 -1.988 1.00 0.00 C ATOM 0 H LEU A 416 -3.640 -3.913 -4.203 1.00 0.00 H new ATOM 0 HA LEU A 416 -2.325 -1.713 -3.045 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -1.743 -4.428 -3.933 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -0.415 -3.352 -4.320 1.00 0.00 H new ATOM 0 HG LEU A 416 -0.054 -2.779 -2.049 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -1.545 -3.479 -0.216 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -2.381 -2.427 -1.383 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -2.667 -4.183 -1.404 1.00 0.00 H new ATOM 0 HD21 LEU A 416 0.276 -4.966 -0.957 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.772 -5.727 -2.177 1.00 0.00 H new ATOM 0 HD23 LEU A 416 0.776 -4.998 -2.665 1.00 0.00 H new ATOM 705 N THR A 417 -1.986 -2.013 -6.316 1.00 0.00 N ATOM 706 CA THR A 417 -1.584 -1.299 -7.522 1.00 0.00 C ATOM 707 C THR A 417 -2.304 0.041 -7.621 1.00 0.00 C ATOM 708 O THR A 417 -1.678 1.079 -7.842 1.00 0.00 O ATOM 709 CB THR A 417 -1.878 -2.144 -8.763 1.00 0.00 C ATOM 710 OG1 THR A 417 -3.186 -2.685 -8.702 1.00 0.00 O ATOM 711 CG2 THR A 417 -0.913 -3.296 -8.946 1.00 0.00 C ATOM 0 H THR A 417 -2.413 -2.923 -6.487 1.00 0.00 H new ATOM 0 HA THR A 417 -0.511 -1.113 -7.466 1.00 0.00 H new ATOM 0 HB THR A 417 -1.770 -1.464 -9.608 1.00 0.00 H new ATOM 0 HG1 THR A 417 -3.632 -2.372 -7.887 1.00 0.00 H new ATOM 0 HG21 THR A 417 -1.178 -3.854 -9.844 1.00 0.00 H new ATOM 0 HG22 THR A 417 0.101 -2.909 -9.046 1.00 0.00 H new ATOM 0 HG23 THR A 417 -0.966 -3.956 -8.080 1.00 0.00 H new ATOM 719 N LYS A 418 -3.624 0.013 -7.455 1.00 0.00 N ATOM 720 CA LYS A 418 -4.427 1.229 -7.524 1.00 0.00 C ATOM 721 C LYS A 418 -3.949 2.256 -6.502 1.00 0.00 C ATOM 722 O LYS A 418 -3.786 3.434 -6.819 1.00 0.00 O ATOM 723 CB LYS A 418 -5.903 0.904 -7.286 1.00 0.00 C ATOM 724 CG LYS A 418 -6.842 2.045 -7.644 1.00 0.00 C ATOM 725 CD LYS A 418 -8.039 2.096 -6.710 1.00 0.00 C ATOM 726 CE LYS A 418 -9.308 2.482 -7.452 1.00 0.00 C ATOM 727 NZ LYS A 418 -10.431 2.774 -6.519 1.00 0.00 N ATOM 0 H LYS A 418 -4.158 -0.836 -7.272 1.00 0.00 H new ATOM 0 HA LYS A 418 -4.312 1.655 -8.521 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -6.172 0.025 -7.872 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -6.045 0.643 -6.237 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -6.302 2.991 -7.596 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -7.186 1.926 -8.671 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -8.174 1.123 -6.237 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -7.849 2.815 -5.913 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -9.114 3.358 -8.071 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -9.596 1.673 -8.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -11.277 3.033 -7.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -10.634 1.931 -5.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -10.167 3.563 -5.894 1.00 0.00 H new ATOM 741 N GLU A 419 -3.722 1.799 -5.274 1.00 0.00 N ATOM 742 CA GLU A 419 -3.260 2.675 -4.204 1.00 0.00 C ATOM 743 C GLU A 419 -1.948 3.353 -4.588 1.00 0.00 C ATOM 744 O GLU A 419 -1.797 4.564 -4.434 1.00 0.00 O ATOM 745 CB GLU A 419 -3.079 1.883 -2.909 1.00 0.00 C ATOM 746 CG GLU A 419 -4.305 1.903 -2.008 1.00 0.00 C ATOM 747 CD GLU A 419 -5.013 0.563 -1.956 1.00 0.00 C ATOM 748 OE1 GLU A 419 -4.541 -0.330 -1.221 1.00 0.00 O ATOM 749 OE2 GLU A 419 -6.041 0.406 -2.651 1.00 0.00 O ATOM 0 H GLU A 419 -3.851 0.826 -4.996 1.00 0.00 H new ATOM 0 HA GLU A 419 -4.015 3.445 -4.046 1.00 0.00 H new ATOM 0 HB2 GLU A 419 -2.836 0.849 -3.156 1.00 0.00 H new ATOM 0 HB3 GLU A 419 -2.228 2.288 -2.361 1.00 0.00 H new ATOM 0 HG2 GLU A 419 -4.006 2.191 -1.000 1.00 0.00 H new ATOM 0 HG3 GLU A 419 -5.000 2.663 -2.364 1.00 0.00 H new ATOM 756 N LEU A 420 -1.004 2.563 -5.089 1.00 0.00 N ATOM 757 CA LEU A 420 0.294 3.090 -5.497 1.00 0.00 C ATOM 758 C LEU A 420 0.129 4.154 -6.578 1.00 0.00 C ATOM 759 O LEU A 420 0.748 5.218 -6.517 1.00 0.00 O ATOM 760 CB LEU A 420 1.192 1.958 -6.004 1.00 0.00 C ATOM 761 CG LEU A 420 2.439 1.695 -5.159 1.00 0.00 C ATOM 762 CD1 LEU A 420 3.104 0.393 -5.577 1.00 0.00 C ATOM 763 CD2 LEU A 420 3.415 2.857 -5.277 1.00 0.00 C ATOM 0 H LEU A 420 -1.113 1.558 -5.222 1.00 0.00 H new ATOM 0 HA LEU A 420 0.764 3.551 -4.628 1.00 0.00 H new ATOM 0 HB2 LEU A 420 0.604 1.042 -6.052 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.504 2.190 -7.022 1.00 0.00 H new ATOM 0 HG LEU A 420 2.136 1.604 -4.116 1.00 0.00 H new ATOM 0 HD11 LEU A 420 3.989 0.224 -4.964 1.00 0.00 H new ATOM 0 HD12 LEU A 420 2.405 -0.432 -5.441 1.00 0.00 H new ATOM 0 HD13 LEU A 420 3.395 0.453 -6.626 1.00 0.00 H new ATOM 0 HD21 LEU A 420 4.297 2.654 -4.670 1.00 0.00 H new ATOM 0 HD22 LEU A 420 3.712 2.979 -6.319 1.00 0.00 H new ATOM 0 HD23 LEU A 420 2.936 3.771 -4.927 1.00 0.00 H new ATOM 775 N LEU A 421 -0.709 3.860 -7.567 1.00 0.00 N ATOM 776 CA LEU A 421 -0.958 4.791 -8.661 1.00 0.00 C ATOM 777 C LEU A 421 -1.488 6.121 -8.135 1.00 0.00 C ATOM 778 O LEU A 421 -1.041 7.190 -8.554 1.00 0.00 O ATOM 779 CB LEU A 421 -1.954 4.190 -9.654 1.00 0.00 C ATOM 780 CG LEU A 421 -1.345 3.240 -10.688 1.00 0.00 C ATOM 781 CD1 LEU A 421 -2.327 2.133 -11.039 1.00 0.00 C ATOM 782 CD2 LEU A 421 -0.931 4.005 -11.936 1.00 0.00 C ATOM 0 H LEU A 421 -1.227 2.984 -7.633 1.00 0.00 H new ATOM 0 HA LEU A 421 -0.012 4.973 -9.171 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -2.720 3.652 -9.096 1.00 0.00 H new ATOM 0 HB3 LEU A 421 -2.454 5.003 -10.180 1.00 0.00 H new ATOM 0 HG LEU A 421 -0.455 2.784 -10.255 1.00 0.00 H new ATOM 0 HD11 LEU A 421 -1.877 1.467 -11.775 1.00 0.00 H new ATOM 0 HD12 LEU A 421 -2.573 1.567 -10.141 1.00 0.00 H new ATOM 0 HD13 LEU A 421 -3.236 2.570 -11.453 1.00 0.00 H new ATOM 0 HD21 LEU A 421 -0.500 3.314 -12.660 1.00 0.00 H new ATOM 0 HD22 LEU A 421 -1.804 4.490 -12.372 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -0.191 4.761 -11.671 1.00 0.00 H new ATOM 794 N GLU A 422 -2.444 6.048 -7.214 1.00 0.00 N ATOM 795 CA GLU A 422 -3.034 7.247 -6.630 1.00 0.00 C ATOM 796 C GLU A 422 -2.066 7.916 -5.658 1.00 0.00 C ATOM 797 O GLU A 422 -2.074 9.135 -5.497 1.00 0.00 O ATOM 798 CB GLU A 422 -4.339 6.901 -5.911 1.00 0.00 C ATOM 799 CG GLU A 422 -5.565 6.975 -6.806 1.00 0.00 C ATOM 800 CD GLU A 422 -6.841 7.224 -6.027 1.00 0.00 C ATOM 801 OE1 GLU A 422 -6.909 8.245 -5.311 1.00 0.00 O ATOM 802 OE2 GLU A 422 -7.771 6.399 -6.133 1.00 0.00 O ATOM 0 H GLU A 422 -2.826 5.172 -6.857 1.00 0.00 H new ATOM 0 HA GLU A 422 -3.247 7.946 -7.439 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -4.261 5.895 -5.498 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -4.472 7.581 -5.070 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -5.429 7.772 -7.537 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -5.660 6.043 -7.364 1.00 0.00 H new ATOM 809 N LEU A 423 -1.231 7.107 -5.010 1.00 0.00 N ATOM 810 CA LEU A 423 -0.257 7.620 -4.054 1.00 0.00 C ATOM 811 C LEU A 423 0.796 8.474 -4.753 1.00 0.00 C ATOM 812 O LEU A 423 1.226 9.500 -4.227 1.00 0.00 O ATOM 813 CB LEU A 423 0.415 6.464 -3.309 1.00 0.00 C ATOM 814 CG LEU A 423 1.552 6.872 -2.368 1.00 0.00 C ATOM 815 CD1 LEU A 423 1.513 6.048 -1.089 1.00 0.00 C ATOM 816 CD2 LEU A 423 2.897 6.719 -3.061 1.00 0.00 C ATOM 0 H LEU A 423 -1.211 6.094 -5.130 1.00 0.00 H new ATOM 0 HA LEU A 423 -0.785 8.247 -3.336 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -0.343 5.936 -2.730 1.00 0.00 H new ATOM 0 HB3 LEU A 423 0.806 5.758 -4.042 1.00 0.00 H new ATOM 0 HG LEU A 423 1.418 7.921 -2.103 1.00 0.00 H new ATOM 0 HD11 LEU A 423 2.329 6.354 -0.434 1.00 0.00 H new ATOM 0 HD12 LEU A 423 0.562 6.208 -0.582 1.00 0.00 H new ATOM 0 HD13 LEU A 423 1.620 4.991 -1.334 1.00 0.00 H new ATOM 0 HD21 LEU A 423 3.694 7.013 -2.378 1.00 0.00 H new ATOM 0 HD22 LEU A 423 3.038 5.679 -3.356 1.00 0.00 H new ATOM 0 HD23 LEU A 423 2.925 7.355 -3.946 1.00 0.00 H new ATOM 828 N ASP A 424 1.209 8.042 -5.940 1.00 0.00 N ATOM 829 CA ASP A 424 2.215 8.765 -6.710 1.00 0.00 C ATOM 830 C ASP A 424 1.764 10.194 -7.009 1.00 0.00 C ATOM 831 O ASP A 424 2.584 11.059 -7.317 1.00 0.00 O ATOM 832 CB ASP A 424 2.510 8.030 -8.019 1.00 0.00 C ATOM 833 CG ASP A 424 3.096 6.651 -7.788 1.00 0.00 C ATOM 834 OD1 ASP A 424 3.699 6.434 -6.716 1.00 0.00 O ATOM 835 OD2 ASP A 424 2.953 5.787 -8.679 1.00 0.00 O ATOM 0 H ASP A 424 0.863 7.195 -6.390 1.00 0.00 H new ATOM 0 HA ASP A 424 3.124 8.812 -6.110 1.00 0.00 H new ATOM 0 HB2 ASP A 424 1.590 7.939 -8.597 1.00 0.00 H new ATOM 0 HB3 ASP A 424 3.204 8.621 -8.616 1.00 0.00 H new ATOM 840 N SER A 425 0.460 10.436 -6.922 1.00 0.00 N ATOM 841 CA SER A 425 -0.090 11.761 -7.190 1.00 0.00 C ATOM 842 C SER A 425 0.253 12.743 -6.072 1.00 0.00 C ATOM 843 O SER A 425 0.216 13.957 -6.270 1.00 0.00 O ATOM 844 CB SER A 425 -1.608 11.679 -7.360 1.00 0.00 C ATOM 845 OG SER A 425 -2.113 12.832 -8.011 1.00 0.00 O ATOM 0 H SER A 425 -0.235 9.734 -6.669 1.00 0.00 H new ATOM 0 HA SER A 425 0.359 12.127 -8.114 1.00 0.00 H new ATOM 0 HB2 SER A 425 -1.865 10.791 -7.937 1.00 0.00 H new ATOM 0 HB3 SER A 425 -2.081 11.573 -6.384 1.00 0.00 H new ATOM 0 HG SER A 425 -3.085 12.753 -8.108 1.00 0.00 H new ATOM 851 N VAL A 426 0.585 12.214 -4.896 1.00 0.00 N ATOM 852 CA VAL A 426 0.932 13.054 -3.753 1.00 0.00 C ATOM 853 C VAL A 426 2.093 13.986 -4.083 1.00 0.00 C ATOM 854 O VAL A 426 3.055 13.587 -4.741 1.00 0.00 O ATOM 855 CB VAL A 426 1.297 12.205 -2.521 1.00 0.00 C ATOM 856 CG1 VAL A 426 2.560 11.395 -2.777 1.00 0.00 C ATOM 857 CG2 VAL A 426 1.464 13.091 -1.295 1.00 0.00 C ATOM 0 H VAL A 426 0.621 11.212 -4.711 1.00 0.00 H new ATOM 0 HA VAL A 426 0.050 13.651 -3.522 1.00 0.00 H new ATOM 0 HB VAL A 426 0.481 11.507 -2.332 1.00 0.00 H new ATOM 0 HG11 VAL A 426 2.798 10.803 -1.893 1.00 0.00 H new ATOM 0 HG12 VAL A 426 2.400 10.731 -3.626 1.00 0.00 H new ATOM 0 HG13 VAL A 426 3.387 12.070 -2.995 1.00 0.00 H new ATOM 0 HG21 VAL A 426 1.722 12.475 -0.433 1.00 0.00 H new ATOM 0 HG22 VAL A 426 2.259 13.815 -1.475 1.00 0.00 H new ATOM 0 HG23 VAL A 426 0.531 13.619 -1.098 1.00 0.00 H new ATOM 867 N GLU A 427 2.000 15.228 -3.618 1.00 0.00 N ATOM 868 CA GLU A 427 3.046 16.214 -3.862 1.00 0.00 C ATOM 869 C GLU A 427 4.329 15.829 -3.132 1.00 0.00 C ATOM 870 O GLU A 427 5.293 15.373 -3.749 1.00 0.00 O ATOM 871 CB GLU A 427 2.586 17.601 -3.409 1.00 0.00 C ATOM 872 CG GLU A 427 1.493 18.194 -4.284 1.00 0.00 C ATOM 873 CD GLU A 427 1.667 19.685 -4.501 1.00 0.00 C ATOM 874 OE1 GLU A 427 2.748 20.094 -4.974 1.00 0.00 O ATOM 875 OE2 GLU A 427 0.721 20.443 -4.197 1.00 0.00 O ATOM 0 H GLU A 427 1.212 15.575 -3.071 1.00 0.00 H new ATOM 0 HA GLU A 427 3.247 16.239 -4.933 1.00 0.00 H new ATOM 0 HB2 GLU A 427 2.224 17.538 -2.383 1.00 0.00 H new ATOM 0 HB3 GLU A 427 3.442 18.275 -3.404 1.00 0.00 H new ATOM 0 HG2 GLU A 427 1.490 17.688 -5.249 1.00 0.00 H new ATOM 0 HG3 GLU A 427 0.523 18.008 -3.824 1.00 0.00 H new ATOM 882 N THR A 428 4.333 16.012 -1.817 1.00 0.00 N ATOM 883 CA THR A 428 5.494 15.683 -0.998 1.00 0.00 C ATOM 884 C THR A 428 6.738 16.414 -1.495 1.00 0.00 C ATOM 885 O THR A 428 7.567 15.839 -2.201 1.00 0.00 O ATOM 886 CB THR A 428 5.736 14.174 -1.008 1.00 0.00 C ATOM 887 OG1 THR A 428 4.514 13.469 -1.142 1.00 0.00 O ATOM 888 CG2 THR A 428 6.422 13.670 0.246 1.00 0.00 C ATOM 0 H THR A 428 3.542 16.388 -1.293 1.00 0.00 H new ATOM 0 HA THR A 428 5.291 16.006 0.023 1.00 0.00 H new ATOM 0 HB THR A 428 6.391 13.993 -1.860 1.00 0.00 H new ATOM 0 HG1 THR A 428 4.527 12.679 -0.563 1.00 0.00 H new ATOM 0 HG21 THR A 428 6.564 12.592 0.175 1.00 0.00 H new ATOM 0 HG22 THR A 428 7.391 14.157 0.351 1.00 0.00 H new ATOM 0 HG23 THR A 428 5.805 13.898 1.115 1.00 0.00 H new ATOM 896 N GLY A 429 6.863 17.683 -1.121 1.00 0.00 N ATOM 897 CA GLY A 429 8.007 18.471 -1.535 1.00 0.00 C ATOM 898 C GLY A 429 8.448 19.458 -0.473 1.00 0.00 C ATOM 899 O GLY A 429 8.039 20.620 -0.488 1.00 0.00 O ATOM 0 H GLY A 429 6.190 18.180 -0.537 1.00 0.00 H new ATOM 0 HA2 GLY A 429 8.836 17.804 -1.773 1.00 0.00 H new ATOM 0 HA3 GLY A 429 7.760 19.012 -2.449 1.00 0.00 H new ATOM 903 N GLY A 430 9.285 18.997 0.449 1.00 0.00 N ATOM 904 CA GLY A 430 9.771 19.860 1.510 1.00 0.00 C ATOM 905 C GLY A 430 9.235 19.464 2.872 1.00 0.00 C ATOM 906 O GLY A 430 9.963 19.495 3.865 1.00 0.00 O ATOM 0 H GLY A 430 9.636 18.040 0.481 1.00 0.00 H new ATOM 0 HA2 GLY A 430 10.860 19.829 1.529 1.00 0.00 H new ATOM 0 HA3 GLY A 430 9.485 20.890 1.296 1.00 0.00 H new ATOM 910 N GLN A 431 7.960 19.093 2.921 1.00 0.00 N ATOM 911 CA GLN A 431 7.329 18.691 4.171 1.00 0.00 C ATOM 912 C GLN A 431 8.019 17.465 4.762 1.00 0.00 C ATOM 913 O GLN A 431 7.970 16.377 4.190 1.00 0.00 O ATOM 914 CB GLN A 431 5.844 18.394 3.945 1.00 0.00 C ATOM 915 CG GLN A 431 4.942 19.595 4.181 1.00 0.00 C ATOM 916 CD GLN A 431 5.363 20.807 3.374 1.00 0.00 C ATOM 917 OE1 GLN A 431 5.854 21.793 3.924 1.00 0.00 O ATOM 918 NE2 GLN A 431 5.169 20.741 2.061 1.00 0.00 N ATOM 0 H GLN A 431 7.344 19.063 2.109 1.00 0.00 H new ATOM 0 HA GLN A 431 7.426 19.515 4.878 1.00 0.00 H new ATOM 0 HB2 GLN A 431 5.704 18.040 2.924 1.00 0.00 H new ATOM 0 HB3 GLN A 431 5.539 17.585 4.608 1.00 0.00 H new ATOM 0 HG2 GLN A 431 3.916 19.330 3.924 1.00 0.00 H new ATOM 0 HG3 GLN A 431 4.950 19.848 5.241 1.00 0.00 H new ATOM 0 HE21 GLN A 431 4.759 19.904 1.648 1.00 0.00 H new ATOM 0 HE22 GLN A 431 5.430 21.528 1.467 1.00 0.00 H new ATOM 927 N ASP A 432 8.662 17.651 5.909 1.00 0.00 N ATOM 928 CA ASP A 432 9.365 16.562 6.578 1.00 0.00 C ATOM 929 C ASP A 432 8.393 15.461 6.990 1.00 0.00 C ATOM 930 O ASP A 432 8.693 14.274 6.858 1.00 0.00 O ATOM 931 CB ASP A 432 10.108 17.087 7.807 1.00 0.00 C ATOM 932 CG ASP A 432 11.154 16.111 8.311 1.00 0.00 C ATOM 933 OD1 ASP A 432 11.809 15.459 7.471 1.00 0.00 O ATOM 934 OD2 ASP A 432 11.317 16.000 9.544 1.00 0.00 O ATOM 0 H ASP A 432 8.711 18.546 6.396 1.00 0.00 H new ATOM 0 HA ASP A 432 10.087 16.143 5.877 1.00 0.00 H new ATOM 0 HB2 ASP A 432 10.588 18.034 7.561 1.00 0.00 H new ATOM 0 HB3 ASP A 432 9.391 17.290 8.603 1.00 0.00 H new ATOM 939 N SER A 433 7.227 15.861 7.487 1.00 0.00 N ATOM 940 CA SER A 433 6.212 14.907 7.917 1.00 0.00 C ATOM 941 C SER A 433 5.787 14.010 6.760 1.00 0.00 C ATOM 942 O SER A 433 5.846 12.783 6.857 1.00 0.00 O ATOM 943 CB SER A 433 4.996 15.642 8.482 1.00 0.00 C ATOM 944 OG SER A 433 5.221 16.048 9.821 1.00 0.00 O ATOM 0 H SER A 433 6.962 16.839 7.602 1.00 0.00 H new ATOM 0 HA SER A 433 6.644 14.282 8.699 1.00 0.00 H new ATOM 0 HB2 SER A 433 4.776 16.514 7.866 1.00 0.00 H new ATOM 0 HB3 SER A 433 4.122 14.992 8.438 1.00 0.00 H new ATOM 0 HG SER A 433 4.429 16.517 10.158 1.00 0.00 H new ATOM 950 N VAL A 434 5.360 14.629 5.664 1.00 0.00 N ATOM 951 CA VAL A 434 4.927 13.887 4.488 1.00 0.00 C ATOM 952 C VAL A 434 6.055 13.017 3.946 1.00 0.00 C ATOM 953 O VAL A 434 5.831 11.881 3.530 1.00 0.00 O ATOM 954 CB VAL A 434 4.437 14.832 3.375 1.00 0.00 C ATOM 955 CG1 VAL A 434 3.864 14.039 2.209 1.00 0.00 C ATOM 956 CG2 VAL A 434 3.408 15.810 3.921 1.00 0.00 C ATOM 0 H VAL A 434 5.305 15.643 5.567 1.00 0.00 H new ATOM 0 HA VAL A 434 4.099 13.251 4.800 1.00 0.00 H new ATOM 0 HB VAL A 434 5.290 15.403 3.009 1.00 0.00 H new ATOM 0 HG11 VAL A 434 3.524 14.726 1.434 1.00 0.00 H new ATOM 0 HG12 VAL A 434 4.634 13.384 1.801 1.00 0.00 H new ATOM 0 HG13 VAL A 434 3.023 13.438 2.556 1.00 0.00 H new ATOM 0 HG21 VAL A 434 3.073 16.470 3.121 1.00 0.00 H new ATOM 0 HG22 VAL A 434 2.556 15.258 4.317 1.00 0.00 H new ATOM 0 HG23 VAL A 434 3.857 16.404 4.717 1.00 0.00 H new ATOM 966 N ARG A 435 7.271 13.557 3.957 1.00 0.00 N ATOM 967 CA ARG A 435 8.433 12.824 3.473 1.00 0.00 C ATOM 968 C ARG A 435 8.605 11.521 4.246 1.00 0.00 C ATOM 969 O ARG A 435 8.781 10.454 3.654 1.00 0.00 O ATOM 970 CB ARG A 435 9.695 13.682 3.599 1.00 0.00 C ATOM 971 CG ARG A 435 10.530 13.726 2.331 1.00 0.00 C ATOM 972 CD ARG A 435 11.310 15.026 2.222 1.00 0.00 C ATOM 973 NE ARG A 435 12.505 14.879 1.396 1.00 0.00 N ATOM 974 CZ ARG A 435 13.163 15.903 0.854 1.00 0.00 C ATOM 975 NH1 ARG A 435 12.745 17.147 1.047 1.00 0.00 N ATOM 976 NH2 ARG A 435 14.242 15.680 0.116 1.00 0.00 N ATOM 0 H ARG A 435 7.475 14.497 4.295 1.00 0.00 H new ATOM 0 HA ARG A 435 8.274 12.585 2.421 1.00 0.00 H new ATOM 0 HB2 ARG A 435 9.408 14.698 3.870 1.00 0.00 H new ATOM 0 HB3 ARG A 435 10.307 13.295 4.414 1.00 0.00 H new ATOM 0 HG2 ARG A 435 11.222 12.884 2.320 1.00 0.00 H new ATOM 0 HG3 ARG A 435 9.881 13.616 1.463 1.00 0.00 H new ATOM 0 HD2 ARG A 435 10.669 15.799 1.798 1.00 0.00 H new ATOM 0 HD3 ARG A 435 11.597 15.361 3.219 1.00 0.00 H new ATOM 0 HE ARG A 435 12.857 13.937 1.224 1.00 0.00 H new ATOM 0 HH11 ARG A 435 11.915 17.324 1.613 1.00 0.00 H new ATOM 0 HH12 ARG A 435 13.253 17.926 0.629 1.00 0.00 H new ATOM 0 HH21 ARG A 435 14.567 14.725 -0.036 1.00 0.00 H new ATOM 0 HH22 ARG A 435 14.747 16.463 -0.299 1.00 0.00 H new ATOM 990 N GLN A 436 8.541 11.613 5.571 1.00 0.00 N ATOM 991 CA GLN A 436 8.678 10.441 6.423 1.00 0.00 C ATOM 992 C GLN A 436 7.550 9.452 6.150 1.00 0.00 C ATOM 993 O GLN A 436 7.781 8.247 6.028 1.00 0.00 O ATOM 994 CB GLN A 436 8.669 10.850 7.898 1.00 0.00 C ATOM 995 CG GLN A 436 9.326 9.833 8.816 1.00 0.00 C ATOM 996 CD GLN A 436 10.033 10.479 9.991 1.00 0.00 C ATOM 997 OE1 GLN A 436 10.831 11.400 9.820 1.00 0.00 O ATOM 998 NE2 GLN A 436 9.743 9.998 11.194 1.00 0.00 N ATOM 0 H GLN A 436 8.395 12.487 6.076 1.00 0.00 H new ATOM 0 HA GLN A 436 9.630 9.961 6.197 1.00 0.00 H new ATOM 0 HB2 GLN A 436 9.181 11.807 8.004 1.00 0.00 H new ATOM 0 HB3 GLN A 436 7.638 11.003 8.218 1.00 0.00 H new ATOM 0 HG2 GLN A 436 8.569 9.142 9.187 1.00 0.00 H new ATOM 0 HG3 GLN A 436 10.043 9.243 8.245 1.00 0.00 H new ATOM 0 HE21 GLN A 436 9.075 9.233 11.290 1.00 0.00 H new ATOM 0 HE22 GLN A 436 10.188 10.393 12.022 1.00 0.00 H new ATOM 1007 N ALA A 437 6.331 9.970 6.048 1.00 0.00 N ATOM 1008 CA ALA A 437 5.165 9.139 5.781 1.00 0.00 C ATOM 1009 C ALA A 437 5.289 8.459 4.423 1.00 0.00 C ATOM 1010 O ALA A 437 5.060 7.257 4.297 1.00 0.00 O ATOM 1011 CB ALA A 437 3.896 9.975 5.840 1.00 0.00 C ATOM 0 H ALA A 437 6.125 10.964 6.147 1.00 0.00 H new ATOM 0 HA ALA A 437 5.111 8.366 6.548 1.00 0.00 H new ATOM 0 HB1 ALA A 437 3.033 9.341 5.638 1.00 0.00 H new ATOM 0 HB2 ALA A 437 3.798 10.418 6.831 1.00 0.00 H new ATOM 0 HB3 ALA A 437 3.947 10.767 5.093 1.00 0.00 H new ATOM 1017 N ARG A 438 5.657 9.238 3.409 1.00 0.00 N ATOM 1018 CA ARG A 438 5.817 8.710 2.058 1.00 0.00 C ATOM 1019 C ARG A 438 6.800 7.543 2.048 1.00 0.00 C ATOM 1020 O ARG A 438 6.463 6.439 1.623 1.00 0.00 O ATOM 1021 CB ARG A 438 6.299 9.804 1.105 1.00 0.00 C ATOM 1022 CG ARG A 438 6.093 9.464 -0.363 1.00 0.00 C ATOM 1023 CD ARG A 438 6.469 10.627 -1.268 1.00 0.00 C ATOM 1024 NE ARG A 438 7.418 10.228 -2.305 1.00 0.00 N ATOM 1025 CZ ARG A 438 7.604 10.898 -3.440 1.00 0.00 C ATOM 1026 NH1 ARG A 438 6.906 11.998 -3.692 1.00 0.00 N ATOM 1027 NH2 ARG A 438 8.489 10.465 -4.326 1.00 0.00 N ATOM 0 H ARG A 438 5.850 10.236 3.498 1.00 0.00 H new ATOM 0 HA ARG A 438 4.845 8.352 1.719 1.00 0.00 H new ATOM 0 HB2 ARG A 438 5.772 10.731 1.332 1.00 0.00 H new ATOM 0 HB3 ARG A 438 7.359 9.988 1.282 1.00 0.00 H new ATOM 0 HG2 ARG A 438 6.694 8.592 -0.622 1.00 0.00 H new ATOM 0 HG3 ARG A 438 5.050 9.194 -0.531 1.00 0.00 H new ATOM 0 HD2 ARG A 438 5.570 11.029 -1.735 1.00 0.00 H new ATOM 0 HD3 ARG A 438 6.902 11.428 -0.669 1.00 0.00 H new ATOM 0 HE ARG A 438 7.971 9.385 -2.150 1.00 0.00 H new ATOM 0 HH11 ARG A 438 6.222 12.335 -3.014 1.00 0.00 H new ATOM 0 HH12 ARG A 438 7.053 12.507 -4.564 1.00 0.00 H new ATOM 0 HH21 ARG A 438 9.027 9.619 -4.138 1.00 0.00 H new ATOM 0 HH22 ARG A 438 8.632 10.978 -5.196 1.00 0.00 H new ATOM 1041 N LYS A 439 8.016 7.795 2.527 1.00 0.00 N ATOM 1042 CA LYS A 439 9.044 6.760 2.579 1.00 0.00 C ATOM 1043 C LYS A 439 8.525 5.526 3.308 1.00 0.00 C ATOM 1044 O LYS A 439 8.658 4.401 2.825 1.00 0.00 O ATOM 1045 CB LYS A 439 10.298 7.291 3.276 1.00 0.00 C ATOM 1046 CG LYS A 439 11.563 6.524 2.920 1.00 0.00 C ATOM 1047 CD LYS A 439 12.361 6.154 4.160 1.00 0.00 C ATOM 1048 CE LYS A 439 13.208 7.320 4.646 1.00 0.00 C ATOM 1049 NZ LYS A 439 13.311 7.351 6.132 1.00 0.00 N ATOM 0 H LYS A 439 8.312 8.704 2.883 1.00 0.00 H new ATOM 0 HA LYS A 439 9.300 6.479 1.557 1.00 0.00 H new ATOM 0 HB2 LYS A 439 10.433 8.340 3.013 1.00 0.00 H new ATOM 0 HB3 LYS A 439 10.149 7.249 4.355 1.00 0.00 H new ATOM 0 HG2 LYS A 439 11.299 5.619 2.373 1.00 0.00 H new ATOM 0 HG3 LYS A 439 12.181 7.128 2.256 1.00 0.00 H new ATOM 0 HD2 LYS A 439 11.680 5.842 4.952 1.00 0.00 H new ATOM 0 HD3 LYS A 439 13.005 5.303 3.939 1.00 0.00 H new ATOM 0 HE2 LYS A 439 14.206 7.248 4.214 1.00 0.00 H new ATOM 0 HE3 LYS A 439 12.775 8.256 4.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 13.896 8.160 6.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 12.361 7.445 6.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 13.748 6.469 6.468 1.00 0.00 H new ATOM 1063 N GLU A 440 7.919 5.750 4.470 1.00 0.00 N ATOM 1064 CA GLU A 440 7.367 4.664 5.267 1.00 0.00 C ATOM 1065 C GLU A 440 6.276 3.935 4.488 1.00 0.00 C ATOM 1066 O GLU A 440 6.267 2.706 4.408 1.00 0.00 O ATOM 1067 CB GLU A 440 6.804 5.210 6.583 1.00 0.00 C ATOM 1068 CG GLU A 440 6.074 4.168 7.419 1.00 0.00 C ATOM 1069 CD GLU A 440 6.743 3.919 8.756 1.00 0.00 C ATOM 1070 OE1 GLU A 440 7.387 4.851 9.282 1.00 0.00 O ATOM 1071 OE2 GLU A 440 6.624 2.789 9.278 1.00 0.00 O ATOM 0 H GLU A 440 7.799 6.676 4.880 1.00 0.00 H new ATOM 0 HA GLU A 440 8.164 3.956 5.493 1.00 0.00 H new ATOM 0 HB2 GLU A 440 7.621 5.627 7.172 1.00 0.00 H new ATOM 0 HB3 GLU A 440 6.120 6.029 6.362 1.00 0.00 H new ATOM 0 HG2 GLU A 440 5.048 4.496 7.586 1.00 0.00 H new ATOM 0 HG3 GLU A 440 6.023 3.232 6.863 1.00 0.00 H new ATOM 1078 N ALA A 441 5.362 4.706 3.907 1.00 0.00 N ATOM 1079 CA ALA A 441 4.270 4.140 3.126 1.00 0.00 C ATOM 1080 C ALA A 441 4.808 3.353 1.938 1.00 0.00 C ATOM 1081 O ALA A 441 4.454 2.192 1.738 1.00 0.00 O ATOM 1082 CB ALA A 441 3.332 5.241 2.654 1.00 0.00 C ATOM 0 H ALA A 441 5.357 5.724 3.963 1.00 0.00 H new ATOM 0 HA ALA A 441 3.711 3.455 3.763 1.00 0.00 H new ATOM 0 HB1 ALA A 441 2.521 4.803 2.072 1.00 0.00 H new ATOM 0 HB2 ALA A 441 2.919 5.762 3.518 1.00 0.00 H new ATOM 0 HB3 ALA A 441 3.883 5.948 2.034 1.00 0.00 H new ATOM 1088 N VAL A 442 5.672 3.992 1.153 1.00 0.00 N ATOM 1089 CA VAL A 442 6.266 3.347 -0.014 1.00 0.00 C ATOM 1090 C VAL A 442 6.920 2.025 0.371 1.00 0.00 C ATOM 1091 O VAL A 442 6.805 1.031 -0.344 1.00 0.00 O ATOM 1092 CB VAL A 442 7.313 4.254 -0.688 1.00 0.00 C ATOM 1093 CG1 VAL A 442 7.832 3.613 -1.968 1.00 0.00 C ATOM 1094 CG2 VAL A 442 6.728 5.629 -0.973 1.00 0.00 C ATOM 0 H VAL A 442 5.976 4.954 1.304 1.00 0.00 H new ATOM 0 HA VAL A 442 5.458 3.159 -0.721 1.00 0.00 H new ATOM 0 HB VAL A 442 8.152 4.377 -0.003 1.00 0.00 H new ATOM 0 HG11 VAL A 442 8.570 4.268 -2.430 1.00 0.00 H new ATOM 0 HG12 VAL A 442 8.294 2.654 -1.733 1.00 0.00 H new ATOM 0 HG13 VAL A 442 7.003 3.457 -2.659 1.00 0.00 H new ATOM 0 HG21 VAL A 442 7.483 6.254 -1.449 1.00 0.00 H new ATOM 0 HG22 VAL A 442 5.869 5.529 -1.637 1.00 0.00 H new ATOM 0 HG23 VAL A 442 6.412 6.091 -0.038 1.00 0.00 H new ATOM 1104 N CYS A 443 7.598 2.020 1.516 1.00 0.00 N ATOM 1105 CA CYS A 443 8.259 0.816 2.002 1.00 0.00 C ATOM 1106 C CYS A 443 7.233 -0.283 2.257 1.00 0.00 C ATOM 1107 O CYS A 443 7.366 -1.399 1.756 1.00 0.00 O ATOM 1108 CB CYS A 443 9.037 1.115 3.284 1.00 0.00 C ATOM 1109 SG CYS A 443 10.254 -0.148 3.721 1.00 0.00 S ATOM 0 H CYS A 443 7.703 2.834 2.121 1.00 0.00 H new ATOM 0 HA CYS A 443 8.959 0.474 1.240 1.00 0.00 H new ATOM 0 HB2 CYS A 443 9.547 2.072 3.172 1.00 0.00 H new ATOM 0 HB3 CYS A 443 8.331 1.224 4.107 1.00 0.00 H new ATOM 0 HG CYS A 443 10.862 0.196 4.818 1.00 0.00 H new ATOM 1115 N LYS A 444 6.204 0.048 3.033 1.00 0.00 N ATOM 1116 CA LYS A 444 5.147 -0.903 3.351 1.00 0.00 C ATOM 1117 C LYS A 444 4.475 -1.407 2.079 1.00 0.00 C ATOM 1118 O LYS A 444 4.288 -2.610 1.901 1.00 0.00 O ATOM 1119 CB LYS A 444 4.107 -0.254 4.268 1.00 0.00 C ATOM 1120 CG LYS A 444 4.552 -0.159 5.720 1.00 0.00 C ATOM 1121 CD LYS A 444 4.640 -1.531 6.367 1.00 0.00 C ATOM 1122 CE LYS A 444 5.834 -1.631 7.302 1.00 0.00 C ATOM 1123 NZ LYS A 444 7.011 -2.253 6.634 1.00 0.00 N ATOM 0 H LYS A 444 6.081 0.969 3.453 1.00 0.00 H new ATOM 0 HA LYS A 444 5.596 -1.752 3.867 1.00 0.00 H new ATOM 0 HB2 LYS A 444 3.883 0.747 3.899 1.00 0.00 H new ATOM 0 HB3 LYS A 444 3.181 -0.827 4.217 1.00 0.00 H new ATOM 0 HG2 LYS A 444 5.524 0.332 5.772 1.00 0.00 H new ATOM 0 HG3 LYS A 444 3.851 0.462 6.277 1.00 0.00 H new ATOM 0 HD2 LYS A 444 3.724 -1.732 6.922 1.00 0.00 H new ATOM 0 HD3 LYS A 444 4.718 -2.295 5.593 1.00 0.00 H new ATOM 0 HE2 LYS A 444 6.102 -0.636 7.657 1.00 0.00 H new ATOM 0 HE3 LYS A 444 5.561 -2.219 8.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 7.804 -2.303 7.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 6.764 -3.212 6.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 7.288 -1.678 5.813 1.00 0.00 H new ATOM 1137 N ILE A 445 4.122 -0.480 1.190 1.00 0.00 N ATOM 1138 CA ILE A 445 3.481 -0.838 -0.071 1.00 0.00 C ATOM 1139 C ILE A 445 4.334 -1.840 -0.839 1.00 0.00 C ATOM 1140 O ILE A 445 3.878 -2.932 -1.176 1.00 0.00 O ATOM 1141 CB ILE A 445 3.231 0.403 -0.953 1.00 0.00 C ATOM 1142 CG1 ILE A 445 2.406 1.441 -0.191 1.00 0.00 C ATOM 1143 CG2 ILE A 445 2.528 0.009 -2.247 1.00 0.00 C ATOM 1144 CD1 ILE A 445 2.716 2.869 -0.587 1.00 0.00 C ATOM 0 H ILE A 445 4.269 0.521 1.320 1.00 0.00 H new ATOM 0 HA ILE A 445 2.519 -1.289 0.172 1.00 0.00 H new ATOM 0 HB ILE A 445 4.195 0.844 -1.207 1.00 0.00 H new ATOM 0 HG12 ILE A 445 1.347 1.247 -0.361 1.00 0.00 H new ATOM 0 HG13 ILE A 445 2.585 1.322 0.878 1.00 0.00 H new ATOM 0 HG21 ILE A 445 2.361 0.898 -2.855 1.00 0.00 H new ATOM 0 HG22 ILE A 445 3.150 -0.696 -2.799 1.00 0.00 H new ATOM 0 HG23 ILE A 445 1.570 -0.457 -2.014 1.00 0.00 H new ATOM 0 HD11 ILE A 445 2.094 3.551 -0.007 1.00 0.00 H new ATOM 0 HD12 ILE A 445 3.767 3.081 -0.391 1.00 0.00 H new ATOM 0 HD13 ILE A 445 2.510 3.005 -1.649 1.00 0.00 H new ATOM 1156 N GLN A 446 5.583 -1.468 -1.095 1.00 0.00 N ATOM 1157 CA GLN A 446 6.506 -2.347 -1.803 1.00 0.00 C ATOM 1158 C GLN A 446 6.736 -3.616 -0.993 1.00 0.00 C ATOM 1159 O GLN A 446 6.937 -4.697 -1.549 1.00 0.00 O ATOM 1160 CB GLN A 446 7.835 -1.634 -2.057 1.00 0.00 C ATOM 1161 CG GLN A 446 7.709 -0.406 -2.944 1.00 0.00 C ATOM 1162 CD GLN A 446 9.013 0.355 -3.074 1.00 0.00 C ATOM 1163 OE1 GLN A 446 9.524 0.847 -1.952 1.00 0.00 O flip ATOM 1164 NE2 GLN A 446 9.554 0.498 -4.169 1.00 0.00 N flip ATOM 0 H GLN A 446 5.979 -0.568 -0.824 1.00 0.00 H new ATOM 0 HA GLN A 446 6.069 -2.614 -2.765 1.00 0.00 H new ATOM 0 HB2 GLN A 446 8.267 -1.338 -1.101 1.00 0.00 H new ATOM 0 HB3 GLN A 446 8.531 -2.335 -2.518 1.00 0.00 H new ATOM 0 HG2 GLN A 446 7.370 -0.711 -3.934 1.00 0.00 H new ATOM 0 HG3 GLN A 446 6.945 0.256 -2.536 1.00 0.00 H new ATOM 0 HE21 GLN A 446 9.125 0.102 -5.005 1.00 0.00 H new ATOM 0 HE22 GLN A 446 10.432 1.012 -4.241 1.00 0.00 H new ATOM 1173 N ALA A 447 6.696 -3.472 0.329 1.00 0.00 N ATOM 1174 CA ALA A 447 6.888 -4.598 1.231 1.00 0.00 C ATOM 1175 C ALA A 447 5.761 -5.614 1.069 1.00 0.00 C ATOM 1176 O ALA A 447 6.007 -6.803 0.862 1.00 0.00 O ATOM 1177 CB ALA A 447 6.963 -4.110 2.671 1.00 0.00 C ATOM 0 H ALA A 447 6.531 -2.582 0.798 1.00 0.00 H new ATOM 0 HA ALA A 447 7.828 -5.089 0.979 1.00 0.00 H new ATOM 0 HB1 ALA A 447 7.107 -4.961 3.337 1.00 0.00 H new ATOM 0 HB2 ALA A 447 7.800 -3.420 2.778 1.00 0.00 H new ATOM 0 HB3 ALA A 447 6.036 -3.599 2.931 1.00 0.00 H new ATOM 1183 N ILE A 448 4.526 -5.134 1.158 1.00 0.00 N ATOM 1184 CA ILE A 448 3.359 -5.995 1.012 1.00 0.00 C ATOM 1185 C ILE A 448 3.301 -6.586 -0.393 1.00 0.00 C ATOM 1186 O ILE A 448 2.852 -7.717 -0.586 1.00 0.00 O ATOM 1187 CB ILE A 448 2.053 -5.224 1.304 1.00 0.00 C ATOM 1188 CG1 ILE A 448 0.844 -6.158 1.218 1.00 0.00 C ATOM 1189 CG2 ILE A 448 1.895 -4.056 0.342 1.00 0.00 C ATOM 1190 CD1 ILE A 448 -0.463 -5.477 1.556 1.00 0.00 C ATOM 0 H ILE A 448 4.307 -4.153 1.331 1.00 0.00 H new ATOM 0 HA ILE A 448 3.454 -6.802 1.738 1.00 0.00 H new ATOM 0 HB ILE A 448 2.109 -4.829 2.318 1.00 0.00 H new ATOM 0 HG12 ILE A 448 0.782 -6.569 0.210 1.00 0.00 H new ATOM 0 HG13 ILE A 448 0.994 -6.998 1.896 1.00 0.00 H new ATOM 0 HG21 ILE A 448 0.969 -3.525 0.563 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.739 -3.376 0.454 1.00 0.00 H new ATOM 0 HG23 ILE A 448 1.863 -4.429 -0.682 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -1.279 -6.195 1.476 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.419 -5.090 2.574 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.634 -4.654 0.862 1.00 0.00 H new ATOM 1202 N LEU A 449 3.767 -5.815 -1.370 1.00 0.00 N ATOM 1203 CA LEU A 449 3.776 -6.260 -2.757 1.00 0.00 C ATOM 1204 C LEU A 449 4.672 -7.484 -2.918 1.00 0.00 C ATOM 1205 O LEU A 449 4.224 -8.541 -3.364 1.00 0.00 O ATOM 1206 CB LEU A 449 4.255 -5.133 -3.676 1.00 0.00 C ATOM 1207 CG LEU A 449 3.145 -4.394 -4.426 1.00 0.00 C ATOM 1208 CD1 LEU A 449 2.679 -3.184 -3.632 1.00 0.00 C ATOM 1209 CD2 LEU A 449 3.623 -3.976 -5.808 1.00 0.00 C ATOM 0 H LEU A 449 4.144 -4.878 -1.226 1.00 0.00 H new ATOM 0 HA LEU A 449 2.758 -6.532 -3.037 1.00 0.00 H new ATOM 0 HB2 LEU A 449 4.813 -4.411 -3.080 1.00 0.00 H new ATOM 0 HB3 LEU A 449 4.950 -5.550 -4.405 1.00 0.00 H new ATOM 0 HG LEU A 449 2.300 -5.072 -4.546 1.00 0.00 H new ATOM 0 HD11 LEU A 449 1.889 -2.671 -4.181 1.00 0.00 H new ATOM 0 HD12 LEU A 449 2.296 -3.509 -2.665 1.00 0.00 H new ATOM 0 HD13 LEU A 449 3.517 -2.504 -3.481 1.00 0.00 H new ATOM 0 HD21 LEU A 449 2.821 -3.452 -6.327 1.00 0.00 H new ATOM 0 HD22 LEU A 449 4.485 -3.316 -5.711 1.00 0.00 H new ATOM 0 HD23 LEU A 449 3.907 -4.861 -6.378 1.00 0.00 H new ATOM 1221 N GLU A 450 5.940 -7.336 -2.545 1.00 0.00 N ATOM 1222 CA GLU A 450 6.894 -8.433 -2.643 1.00 0.00 C ATOM 1223 C GLU A 450 6.482 -9.583 -1.731 1.00 0.00 C ATOM 1224 O GLU A 450 6.737 -10.750 -2.031 1.00 0.00 O ATOM 1225 CB GLU A 450 8.303 -7.952 -2.282 1.00 0.00 C ATOM 1226 CG GLU A 450 8.420 -7.412 -0.867 1.00 0.00 C ATOM 1227 CD GLU A 450 9.755 -7.739 -0.227 1.00 0.00 C ATOM 1228 OE1 GLU A 450 9.920 -8.880 0.253 1.00 0.00 O ATOM 1229 OE2 GLU A 450 10.638 -6.855 -0.209 1.00 0.00 O ATOM 0 H GLU A 450 6.329 -6.469 -2.173 1.00 0.00 H new ATOM 0 HA GLU A 450 6.900 -8.790 -3.673 1.00 0.00 H new ATOM 0 HB2 GLU A 450 9.002 -8.779 -2.405 1.00 0.00 H new ATOM 0 HB3 GLU A 450 8.603 -7.174 -2.984 1.00 0.00 H new ATOM 0 HG2 GLU A 450 8.284 -6.331 -0.882 1.00 0.00 H new ATOM 0 HG3 GLU A 450 7.617 -7.826 -0.257 1.00 0.00 H new ATOM 1236 N LYS A 451 5.836 -9.247 -0.619 1.00 0.00 N ATOM 1237 CA LYS A 451 5.381 -10.251 0.333 1.00 0.00 C ATOM 1238 C LYS A 451 4.367 -11.184 -0.317 1.00 0.00 C ATOM 1239 O LYS A 451 4.473 -12.406 -0.211 1.00 0.00 O ATOM 1240 CB LYS A 451 4.764 -9.577 1.563 1.00 0.00 C ATOM 1241 CG LYS A 451 5.627 -9.678 2.808 1.00 0.00 C ATOM 1242 CD LYS A 451 5.196 -10.833 3.696 1.00 0.00 C ATOM 1243 CE LYS A 451 5.883 -10.782 5.050 1.00 0.00 C ATOM 1244 NZ LYS A 451 7.336 -11.091 4.950 1.00 0.00 N ATOM 0 H LYS A 451 5.616 -8.286 -0.356 1.00 0.00 H new ATOM 0 HA LYS A 451 6.242 -10.840 0.649 1.00 0.00 H new ATOM 0 HB2 LYS A 451 4.585 -8.525 1.339 1.00 0.00 H new ATOM 0 HB3 LYS A 451 3.793 -10.029 1.766 1.00 0.00 H new ATOM 0 HG2 LYS A 451 6.670 -9.810 2.519 1.00 0.00 H new ATOM 0 HG3 LYS A 451 5.568 -8.745 3.369 1.00 0.00 H new ATOM 0 HD2 LYS A 451 4.115 -10.803 3.834 1.00 0.00 H new ATOM 0 HD3 LYS A 451 5.429 -11.778 3.204 1.00 0.00 H new ATOM 0 HE2 LYS A 451 5.752 -9.792 5.486 1.00 0.00 H new ATOM 0 HE3 LYS A 451 5.407 -11.493 5.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 7.767 -11.045 5.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 7.462 -12.046 4.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 7.796 -10.398 4.326 1.00 0.00 H new ATOM 1258 N LEU A 452 3.383 -10.598 -0.995 1.00 0.00 N ATOM 1259 CA LEU A 452 2.350 -11.376 -1.668 1.00 0.00 C ATOM 1260 C LEU A 452 2.930 -12.131 -2.858 1.00 0.00 C ATOM 1261 O LEU A 452 2.604 -13.297 -3.085 1.00 0.00 O ATOM 1262 CB LEU A 452 1.216 -10.460 -2.131 1.00 0.00 C ATOM 1263 CG LEU A 452 0.105 -10.238 -1.104 1.00 0.00 C ATOM 1264 CD1 LEU A 452 -0.532 -8.871 -1.294 1.00 0.00 C ATOM 1265 CD2 LEU A 452 -0.943 -11.337 -1.209 1.00 0.00 C ATOM 0 H LEU A 452 3.281 -9.588 -1.092 1.00 0.00 H new ATOM 0 HA LEU A 452 1.953 -12.103 -0.959 1.00 0.00 H new ATOM 0 HB2 LEU A 452 1.638 -9.492 -2.402 1.00 0.00 H new ATOM 0 HB3 LEU A 452 0.776 -10.880 -3.035 1.00 0.00 H new ATOM 0 HG LEU A 452 0.544 -10.275 -0.107 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -1.320 -8.731 -0.554 1.00 0.00 H new ATOM 0 HD12 LEU A 452 0.225 -8.096 -1.169 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.958 -8.804 -2.295 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -1.727 -11.164 -0.471 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -1.378 -11.331 -2.208 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -0.476 -12.304 -1.022 1.00 0.00 H new ATOM 1277 N GLU A 453 3.791 -11.459 -3.618 1.00 0.00 N ATOM 1278 CA GLU A 453 4.416 -12.068 -4.786 1.00 0.00 C ATOM 1279 C GLU A 453 5.205 -13.314 -4.393 1.00 0.00 C ATOM 1280 O GLU A 453 5.190 -14.320 -5.103 1.00 0.00 O ATOM 1281 CB GLU A 453 5.338 -11.062 -5.478 1.00 0.00 C ATOM 1282 CG GLU A 453 6.006 -11.610 -6.728 1.00 0.00 C ATOM 1283 CD GLU A 453 7.451 -12.004 -6.493 1.00 0.00 C ATOM 1284 OE1 GLU A 453 7.684 -13.047 -5.848 1.00 0.00 O ATOM 1285 OE2 GLU A 453 8.348 -11.269 -6.956 1.00 0.00 O ATOM 0 H GLU A 453 4.071 -10.493 -3.445 1.00 0.00 H new ATOM 0 HA GLU A 453 3.627 -12.363 -5.478 1.00 0.00 H new ATOM 0 HB2 GLU A 453 4.761 -10.176 -5.743 1.00 0.00 H new ATOM 0 HB3 GLU A 453 6.107 -10.743 -4.775 1.00 0.00 H new ATOM 0 HG2 GLU A 453 5.450 -12.478 -7.082 1.00 0.00 H new ATOM 0 HG3 GLU A 453 5.962 -10.860 -7.517 1.00 0.00 H new ATOM 1292 N LYS A 454 5.893 -13.239 -3.258 1.00 0.00 N ATOM 1293 CA LYS A 454 6.688 -14.360 -2.771 1.00 0.00 C ATOM 1294 C LYS A 454 5.802 -15.396 -2.086 1.00 0.00 C ATOM 1295 O LYS A 454 6.087 -16.592 -2.122 1.00 0.00 O ATOM 1296 CB LYS A 454 7.763 -13.867 -1.801 1.00 0.00 C ATOM 1297 CG LYS A 454 8.773 -14.936 -1.417 1.00 0.00 C ATOM 1298 CD LYS A 454 9.859 -15.079 -2.471 1.00 0.00 C ATOM 1299 CE LYS A 454 9.445 -16.044 -3.570 1.00 0.00 C ATOM 1300 NZ LYS A 454 10.614 -16.760 -4.150 1.00 0.00 N ATOM 0 H LYS A 454 5.916 -12.414 -2.659 1.00 0.00 H new ATOM 0 HA LYS A 454 7.172 -14.831 -3.627 1.00 0.00 H new ATOM 0 HB2 LYS A 454 8.290 -13.027 -2.253 1.00 0.00 H new ATOM 0 HB3 LYS A 454 7.281 -13.493 -0.898 1.00 0.00 H new ATOM 0 HG2 LYS A 454 9.226 -14.683 -0.458 1.00 0.00 H new ATOM 0 HG3 LYS A 454 8.263 -15.890 -1.287 1.00 0.00 H new ATOM 0 HD2 LYS A 454 10.077 -14.103 -2.905 1.00 0.00 H new ATOM 0 HD3 LYS A 454 10.778 -15.432 -2.003 1.00 0.00 H new ATOM 0 HE2 LYS A 454 8.738 -16.770 -3.168 1.00 0.00 H new ATOM 0 HE3 LYS A 454 8.927 -15.497 -4.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 10.289 -17.408 -4.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 11.277 -16.070 -4.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 11.093 -17.303 -3.404 1.00 0.00 H new ATOM 1314 N LYS A 455 4.727 -14.926 -1.461 1.00 0.00 N ATOM 1315 CA LYS A 455 3.798 -15.812 -0.766 1.00 0.00 C ATOM 1316 C LYS A 455 2.571 -16.102 -1.626 1.00 0.00 C ATOM 1317 O LYS A 455 1.500 -16.418 -1.109 1.00 0.00 O ATOM 1318 CB LYS A 455 3.365 -15.190 0.562 1.00 0.00 C ATOM 1319 CG LYS A 455 3.138 -16.209 1.666 1.00 0.00 C ATOM 1320 CD LYS A 455 2.056 -15.751 2.632 1.00 0.00 C ATOM 1321 CE LYS A 455 1.305 -16.932 3.227 1.00 0.00 C ATOM 1322 NZ LYS A 455 2.207 -17.829 4.002 1.00 0.00 N ATOM 0 H LYS A 455 4.477 -13.938 -1.421 1.00 0.00 H new ATOM 0 HA LYS A 455 4.313 -16.753 -0.571 1.00 0.00 H new ATOM 0 HB2 LYS A 455 4.125 -14.479 0.886 1.00 0.00 H new ATOM 0 HB3 LYS A 455 2.446 -14.625 0.406 1.00 0.00 H new ATOM 0 HG2 LYS A 455 2.855 -17.166 1.227 1.00 0.00 H new ATOM 0 HG3 LYS A 455 4.068 -16.371 2.210 1.00 0.00 H new ATOM 0 HD2 LYS A 455 2.506 -15.164 3.432 1.00 0.00 H new ATOM 0 HD3 LYS A 455 1.356 -15.097 2.112 1.00 0.00 H new ATOM 0 HE2 LYS A 455 0.510 -16.567 3.877 1.00 0.00 H new ATOM 0 HE3 LYS A 455 0.828 -17.499 2.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 1.645 -18.574 4.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 2.900 -18.264 3.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 2.707 -17.276 4.727 1.00 0.00 H new ATOM 1336 N GLY A 456 2.734 -15.993 -2.941 1.00 0.00 N ATOM 1337 CA GLY A 456 1.629 -16.248 -3.848 1.00 0.00 C ATOM 1338 C GLY A 456 2.021 -16.077 -5.302 1.00 0.00 C ATOM 1339 O GLY A 456 2.510 -14.985 -5.660 1.00 0.00 O ATOM 1340 OXT GLY A 456 1.838 -17.034 -6.084 1.00 0.00 O ATOM 0 H GLY A 456 3.610 -15.733 -3.394 1.00 0.00 H new ATOM 0 HA2 GLY A 456 1.261 -17.262 -3.691 1.00 0.00 H new ATOM 0 HA3 GLY A 456 0.808 -15.571 -3.614 1.00 0.00 H new