USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 615 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 351 TYR OH : rot 180:sc= -1.19 USER MOD Set 1.2: A 363 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 328 THR OG1 : rot 141:sc= 0.632! USER MOD Set 2.2: A 353 ASN : amide:sc= 0 X(o=-0.61,f=-0.81) USER MOD Set 2.3: A 354 TYR OH : rot -9:sc= -1.24! USER MOD Single : A 314 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 315 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 317 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 318 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 321 THR OG1 : rot 180:sc= 0.061 USER MOD Single : A 326 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 330 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 335 SER OG : rot -39:sc= 0.993 USER MOD Single : A 337 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 342 THR OG1 : rot 180:sc= 0 USER MOD Single : A 343 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 344 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 345 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 347 CYS SG : rot 83:sc= 0.961 USER MOD Single : A 348 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 349 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 356 THR OG1 : rot 103:sc= 0.43 USER MOD Single : A 357 TYR OH : rot 180:sc= 0 USER MOD Single : A 360 THR OG1 : rot -66:sc= 0.894 USER MOD Single : A 367 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000895) USER MOD Single : A 368 THR OG1 : rot -97:sc= -0.374 USER MOD Single : A 369 THR OG1 : rot 102:sc= 0.358 USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 375 SER OG : rot 180:sc= 0 USER MOD Single : A 378 HIS :FLIP no HE2:sc= 0.141 F(o=-1.7!,f=0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 309 25.190 18.100 -10.430 1.00 0.00 N ATOM 2 CA ASP A 309 25.802 16.988 -9.648 1.00 0.00 C ATOM 3 C ASP A 309 26.019 15.769 -10.548 1.00 0.00 C ATOM 4 O ASP A 309 25.869 14.640 -10.128 1.00 0.00 O ATOM 5 CB ASP A 309 24.787 16.672 -8.548 1.00 0.00 C ATOM 6 CG ASP A 309 25.443 16.864 -7.179 1.00 0.00 C ATOM 7 OD1 ASP A 309 26.149 17.846 -7.014 1.00 0.00 O ATOM 8 OD2 ASP A 309 25.225 16.028 -6.318 1.00 0.00 O ATOM 0 HA ASP A 309 26.775 17.256 -9.237 1.00 0.00 H new ATOM 0 HB2 ASP A 309 23.918 17.324 -8.642 1.00 0.00 H new ATOM 0 HB3 ASP A 309 24.429 15.648 -8.652 1.00 0.00 H new ATOM 15 N GLU A 310 26.372 15.992 -11.785 1.00 0.00 N ATOM 16 CA GLU A 310 26.600 14.848 -12.714 1.00 0.00 C ATOM 17 C GLU A 310 27.838 14.053 -12.287 1.00 0.00 C ATOM 18 O GLU A 310 27.780 12.848 -12.145 1.00 0.00 O ATOM 19 CB GLU A 310 26.822 15.488 -14.086 1.00 0.00 C ATOM 20 CG GLU A 310 25.678 15.095 -15.022 1.00 0.00 C ATOM 21 CD GLU A 310 26.177 14.058 -16.030 1.00 0.00 C ATOM 22 OE1 GLU A 310 26.854 13.133 -15.613 1.00 0.00 O ATOM 23 OE2 GLU A 310 25.873 14.205 -17.202 1.00 0.00 O ATOM 0 H GLU A 310 26.512 16.917 -12.192 1.00 0.00 H new ATOM 0 HA GLU A 310 25.762 14.150 -12.719 1.00 0.00 H new ATOM 0 HB2 GLU A 310 26.871 16.573 -13.990 1.00 0.00 H new ATOM 0 HB3 GLU A 310 27.775 15.161 -14.502 1.00 0.00 H new ATOM 0 HG2 GLU A 310 24.847 14.688 -14.447 1.00 0.00 H new ATOM 0 HG3 GLU A 310 25.303 15.975 -15.545 1.00 0.00 H new ATOM 30 N PRO A 311 28.924 14.757 -12.099 1.00 0.00 N ATOM 31 CA PRO A 311 30.187 14.102 -11.686 1.00 0.00 C ATOM 32 C PRO A 311 30.130 13.718 -10.205 1.00 0.00 C ATOM 33 O PRO A 311 30.923 12.933 -9.727 1.00 0.00 O ATOM 34 CB PRO A 311 31.244 15.173 -11.935 1.00 0.00 C ATOM 35 CG PRO A 311 30.511 16.474 -11.862 1.00 0.00 C ATOM 36 CD PRO A 311 29.076 16.210 -12.248 1.00 0.00 C ATOM 0 HA PRO A 311 30.390 13.179 -12.229 1.00 0.00 H new ATOM 0 HB2 PRO A 311 32.036 15.125 -11.188 1.00 0.00 H new ATOM 0 HB3 PRO A 311 31.716 15.041 -12.909 1.00 0.00 H new ATOM 0 HG2 PRO A 311 30.567 16.889 -10.856 1.00 0.00 H new ATOM 0 HG3 PRO A 311 30.960 17.205 -12.534 1.00 0.00 H new ATOM 0 HD2 PRO A 311 28.384 16.751 -11.603 1.00 0.00 H new ATOM 0 HD3 PRO A 311 28.874 16.529 -13.270 1.00 0.00 H new ATOM 44 N LEU A 312 29.196 14.267 -9.477 1.00 0.00 N ATOM 45 CA LEU A 312 29.085 13.933 -8.028 1.00 0.00 C ATOM 46 C LEU A 312 28.210 12.690 -7.840 1.00 0.00 C ATOM 47 O LEU A 312 28.204 12.075 -6.793 1.00 0.00 O ATOM 48 CB LEU A 312 28.427 15.156 -7.389 1.00 0.00 C ATOM 49 CG LEU A 312 28.781 15.208 -5.902 1.00 0.00 C ATOM 50 CD1 LEU A 312 30.050 16.040 -5.708 1.00 0.00 C ATOM 51 CD2 LEU A 312 27.628 15.851 -5.127 1.00 0.00 C ATOM 0 H LEU A 312 28.505 14.933 -9.823 1.00 0.00 H new ATOM 0 HA LEU A 312 30.053 13.711 -7.578 1.00 0.00 H new ATOM 0 HB2 LEU A 312 28.765 16.065 -7.886 1.00 0.00 H new ATOM 0 HB3 LEU A 312 27.345 15.107 -7.515 1.00 0.00 H new ATOM 0 HG LEU A 312 28.950 14.196 -5.533 1.00 0.00 H new ATOM 0 HD11 LEU A 312 30.302 16.077 -4.648 1.00 0.00 H new ATOM 0 HD12 LEU A 312 30.872 15.585 -6.261 1.00 0.00 H new ATOM 0 HD13 LEU A 312 29.882 17.052 -6.076 1.00 0.00 H new ATOM 0 HD21 LEU A 312 27.879 15.889 -4.067 1.00 0.00 H new ATOM 0 HD22 LEU A 312 27.461 16.863 -5.497 1.00 0.00 H new ATOM 0 HD23 LEU A 312 26.723 15.260 -5.265 1.00 0.00 H new ATOM 63 N ILE A 313 27.472 12.317 -8.850 1.00 0.00 N ATOM 64 CA ILE A 313 26.598 11.114 -8.733 1.00 0.00 C ATOM 65 C ILE A 313 25.652 11.258 -7.537 1.00 0.00 C ATOM 66 O ILE A 313 24.535 11.717 -7.669 1.00 0.00 O ATOM 67 CB ILE A 313 27.559 9.945 -8.518 1.00 0.00 C ATOM 68 CG1 ILE A 313 28.413 9.747 -9.772 1.00 0.00 C ATOM 69 CG2 ILE A 313 26.760 8.671 -8.241 1.00 0.00 C ATOM 70 CD1 ILE A 313 29.607 8.849 -9.440 1.00 0.00 C ATOM 0 H ILE A 313 27.436 12.793 -9.751 1.00 0.00 H new ATOM 0 HA ILE A 313 25.973 10.972 -9.615 1.00 0.00 H new ATOM 0 HB ILE A 313 28.206 10.161 -7.668 1.00 0.00 H new ATOM 0 HG12 ILE A 313 27.815 9.297 -10.565 1.00 0.00 H new ATOM 0 HG13 ILE A 313 28.761 10.711 -10.144 1.00 0.00 H new ATOM 0 HG21 ILE A 313 27.446 7.838 -8.088 1.00 0.00 H new ATOM 0 HG22 ILE A 313 26.152 8.810 -7.347 1.00 0.00 H new ATOM 0 HG23 ILE A 313 26.112 8.456 -9.091 1.00 0.00 H new ATOM 0 HD11 ILE A 313 30.216 8.708 -10.333 1.00 0.00 H new ATOM 0 HD12 ILE A 313 30.209 9.317 -8.661 1.00 0.00 H new ATOM 0 HD13 ILE A 313 29.248 7.882 -9.089 1.00 0.00 H new ATOM 82 N LYS A 314 26.089 10.866 -6.371 1.00 0.00 N ATOM 83 CA LYS A 314 25.215 10.979 -5.168 1.00 0.00 C ATOM 84 C LYS A 314 23.951 10.136 -5.349 1.00 0.00 C ATOM 85 O LYS A 314 23.662 9.656 -6.427 1.00 0.00 O ATOM 86 CB LYS A 314 24.862 12.462 -5.071 1.00 0.00 C ATOM 87 CG LYS A 314 25.091 12.947 -3.640 1.00 0.00 C ATOM 88 CD LYS A 314 23.879 13.756 -3.175 1.00 0.00 C ATOM 89 CE LYS A 314 24.305 14.714 -2.058 1.00 0.00 C ATOM 90 NZ LYS A 314 24.576 16.018 -2.733 1.00 0.00 N ATOM 0 H LYS A 314 27.014 10.472 -6.199 1.00 0.00 H new ATOM 0 HA LYS A 314 25.709 10.618 -4.265 1.00 0.00 H new ATOM 0 HB2 LYS A 314 25.474 13.039 -5.764 1.00 0.00 H new ATOM 0 HB3 LYS A 314 23.822 12.619 -5.358 1.00 0.00 H new ATOM 0 HG2 LYS A 314 25.249 12.096 -2.977 1.00 0.00 H new ATOM 0 HG3 LYS A 314 25.991 13.560 -3.592 1.00 0.00 H new ATOM 0 HD2 LYS A 314 23.460 14.317 -4.010 1.00 0.00 H new ATOM 0 HD3 LYS A 314 23.097 13.087 -2.817 1.00 0.00 H new ATOM 0 HE2 LYS A 314 23.521 14.816 -1.308 1.00 0.00 H new ATOM 0 HE3 LYS A 314 25.193 14.347 -1.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 314 24.873 16.720 -2.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 314 25.332 15.894 -3.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 314 23.712 16.349 -3.208 1.00 0.00 H new ATOM 104 N LYS A 315 23.195 9.953 -4.301 1.00 0.00 N ATOM 105 CA LYS A 315 21.949 9.142 -4.411 1.00 0.00 C ATOM 106 C LYS A 315 20.870 9.703 -3.481 1.00 0.00 C ATOM 107 O LYS A 315 20.425 9.045 -2.563 1.00 0.00 O ATOM 108 CB LYS A 315 22.353 7.733 -3.972 1.00 0.00 C ATOM 109 CG LYS A 315 22.344 6.799 -5.184 1.00 0.00 C ATOM 110 CD LYS A 315 21.703 5.465 -4.796 1.00 0.00 C ATOM 111 CE LYS A 315 20.459 5.227 -5.654 1.00 0.00 C ATOM 112 NZ LYS A 315 20.876 4.217 -6.666 1.00 0.00 N ATOM 0 H LYS A 315 23.386 10.330 -3.373 1.00 0.00 H new ATOM 0 HA LYS A 315 21.537 9.153 -5.420 1.00 0.00 H new ATOM 0 HB2 LYS A 315 23.345 7.751 -3.521 1.00 0.00 H new ATOM 0 HB3 LYS A 315 21.664 7.366 -3.211 1.00 0.00 H new ATOM 0 HG2 LYS A 315 21.790 7.256 -6.004 1.00 0.00 H new ATOM 0 HG3 LYS A 315 23.362 6.636 -5.538 1.00 0.00 H new ATOM 0 HD2 LYS A 315 22.416 4.652 -4.937 1.00 0.00 H new ATOM 0 HD3 LYS A 315 21.433 5.473 -3.740 1.00 0.00 H new ATOM 0 HE2 LYS A 315 19.628 4.862 -5.051 1.00 0.00 H new ATOM 0 HE3 LYS A 315 20.126 6.149 -6.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 20.074 4.002 -7.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 21.664 4.595 -7.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 21.181 3.348 -6.184 1.00 0.00 H new ATOM 126 N LEU A 316 20.447 10.916 -3.713 1.00 0.00 N ATOM 127 CA LEU A 316 19.398 11.519 -2.840 1.00 0.00 C ATOM 128 C LEU A 316 18.077 10.758 -2.994 1.00 0.00 C ATOM 129 O LEU A 316 17.350 10.561 -2.041 1.00 0.00 O ATOM 130 CB LEU A 316 19.251 12.959 -3.334 1.00 0.00 C ATOM 131 CG LEU A 316 20.004 13.901 -2.394 1.00 0.00 C ATOM 132 CD1 LEU A 316 20.087 15.293 -3.025 1.00 0.00 C ATOM 133 CD2 LEU A 316 19.263 13.991 -1.058 1.00 0.00 C ATOM 0 H LEU A 316 20.781 11.515 -4.468 1.00 0.00 H new ATOM 0 HA LEU A 316 19.665 11.476 -1.784 1.00 0.00 H new ATOM 0 HB2 LEU A 316 19.643 13.049 -4.347 1.00 0.00 H new ATOM 0 HB3 LEU A 316 18.197 13.235 -3.375 1.00 0.00 H new ATOM 0 HG LEU A 316 21.010 13.517 -2.226 1.00 0.00 H new ATOM 0 HD11 LEU A 316 20.624 15.965 -2.355 1.00 0.00 H new ATOM 0 HD12 LEU A 316 20.616 15.230 -3.976 1.00 0.00 H new ATOM 0 HD13 LEU A 316 19.081 15.677 -3.194 1.00 0.00 H new ATOM 0 HD21 LEU A 316 19.800 14.663 -0.388 1.00 0.00 H new ATOM 0 HD22 LEU A 316 18.256 14.374 -1.225 1.00 0.00 H new ATOM 0 HD23 LEU A 316 19.204 13.000 -0.607 1.00 0.00 H new ATOM 145 N LYS A 317 17.761 10.331 -4.186 1.00 0.00 N ATOM 146 CA LYS A 317 16.486 9.584 -4.397 1.00 0.00 C ATOM 147 C LYS A 317 16.773 8.201 -4.985 1.00 0.00 C ATOM 148 O LYS A 317 17.622 8.042 -5.839 1.00 0.00 O ATOM 149 CB LYS A 317 15.688 10.431 -5.388 1.00 0.00 C ATOM 150 CG LYS A 317 14.787 11.403 -4.624 1.00 0.00 C ATOM 151 CD LYS A 317 14.232 12.451 -5.590 1.00 0.00 C ATOM 152 CE LYS A 317 12.705 12.478 -5.493 1.00 0.00 C ATOM 153 NZ LYS A 317 12.259 13.272 -6.672 1.00 0.00 N ATOM 0 H LYS A 317 18.329 10.466 -5.022 1.00 0.00 H new ATOM 0 HA LYS A 317 15.943 9.427 -3.465 1.00 0.00 H new ATOM 0 HB2 LYS A 317 16.366 10.983 -6.039 1.00 0.00 H new ATOM 0 HB3 LYS A 317 15.085 9.788 -6.029 1.00 0.00 H new ATOM 0 HG2 LYS A 317 13.969 10.861 -4.150 1.00 0.00 H new ATOM 0 HG3 LYS A 317 15.351 11.889 -3.828 1.00 0.00 H new ATOM 0 HD2 LYS A 317 14.639 13.433 -5.351 1.00 0.00 H new ATOM 0 HD3 LYS A 317 14.538 12.219 -6.610 1.00 0.00 H new ATOM 0 HE2 LYS A 317 12.290 11.470 -5.516 1.00 0.00 H new ATOM 0 HE3 LYS A 317 12.377 12.937 -4.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 317 11.221 13.335 -6.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 317 12.664 14.228 -6.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 317 12.580 12.807 -7.545 1.00 0.00 H new ATOM 167 N LYS A 318 16.071 7.198 -4.534 1.00 0.00 N ATOM 168 CA LYS A 318 16.304 5.823 -5.065 1.00 0.00 C ATOM 169 C LYS A 318 14.971 5.087 -5.240 1.00 0.00 C ATOM 170 O LYS A 318 14.296 4.789 -4.274 1.00 0.00 O ATOM 171 CB LYS A 318 17.160 5.132 -4.002 1.00 0.00 C ATOM 172 CG LYS A 318 16.617 5.463 -2.610 1.00 0.00 C ATOM 173 CD LYS A 318 16.937 4.318 -1.649 1.00 0.00 C ATOM 174 CE LYS A 318 16.864 4.826 -0.207 1.00 0.00 C ATOM 175 NZ LYS A 318 16.390 3.660 0.589 1.00 0.00 N ATOM 0 H LYS A 318 15.346 7.270 -3.821 1.00 0.00 H new ATOM 0 HA LYS A 318 16.790 5.834 -6.041 1.00 0.00 H new ATOM 0 HB2 LYS A 318 17.152 4.053 -4.159 1.00 0.00 H new ATOM 0 HB3 LYS A 318 18.196 5.459 -4.086 1.00 0.00 H new ATOM 0 HG2 LYS A 318 17.060 6.390 -2.247 1.00 0.00 H new ATOM 0 HG3 LYS A 318 15.540 5.621 -2.657 1.00 0.00 H new ATOM 0 HD2 LYS A 318 16.232 3.500 -1.794 1.00 0.00 H new ATOM 0 HD3 LYS A 318 17.931 3.922 -1.856 1.00 0.00 H new ATOM 0 HE2 LYS A 318 17.838 5.171 0.140 1.00 0.00 H new ATOM 0 HE3 LYS A 318 16.178 5.669 -0.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 318 16.315 3.931 1.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 318 15.458 3.358 0.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 318 17.066 2.876 0.492 1.00 0.00 H new ATOM 189 N PRO A 319 14.637 4.817 -6.473 1.00 0.00 N ATOM 190 CA PRO A 319 13.374 4.104 -6.780 1.00 0.00 C ATOM 191 C PRO A 319 13.511 2.614 -6.455 1.00 0.00 C ATOM 192 O PRO A 319 14.534 2.014 -6.719 1.00 0.00 O ATOM 193 CB PRO A 319 13.201 4.315 -8.281 1.00 0.00 C ATOM 194 CG PRO A 319 14.583 4.549 -8.806 1.00 0.00 C ATOM 195 CD PRO A 319 15.396 5.146 -7.684 1.00 0.00 C ATOM 0 HA PRO A 319 12.525 4.467 -6.201 1.00 0.00 H new ATOM 0 HB2 PRO A 319 12.743 3.444 -8.751 1.00 0.00 H new ATOM 0 HB3 PRO A 319 12.552 5.166 -8.487 1.00 0.00 H new ATOM 0 HG2 PRO A 319 15.028 3.614 -9.147 1.00 0.00 H new ATOM 0 HG3 PRO A 319 14.559 5.222 -9.663 1.00 0.00 H new ATOM 0 HD2 PRO A 319 16.400 4.723 -7.651 1.00 0.00 H new ATOM 0 HD3 PRO A 319 15.508 6.224 -7.803 1.00 0.00 H new ATOM 203 N PRO A 320 12.471 2.066 -5.889 1.00 0.00 N ATOM 204 CA PRO A 320 12.473 0.629 -5.523 1.00 0.00 C ATOM 205 C PRO A 320 12.287 -0.239 -6.769 1.00 0.00 C ATOM 206 O PRO A 320 11.215 -0.301 -7.340 1.00 0.00 O ATOM 207 CB PRO A 320 11.275 0.496 -4.589 1.00 0.00 C ATOM 208 CG PRO A 320 10.359 1.618 -4.965 1.00 0.00 C ATOM 209 CD PRO A 320 11.209 2.725 -5.540 1.00 0.00 C ATOM 0 HA PRO A 320 13.406 0.306 -5.062 1.00 0.00 H new ATOM 0 HB2 PRO A 320 10.785 -0.470 -4.711 1.00 0.00 H new ATOM 0 HB3 PRO A 320 11.579 0.569 -3.545 1.00 0.00 H new ATOM 0 HG2 PRO A 320 9.622 1.283 -5.694 1.00 0.00 H new ATOM 0 HG3 PRO A 320 9.808 1.971 -4.094 1.00 0.00 H new ATOM 0 HD2 PRO A 320 10.739 3.174 -6.415 1.00 0.00 H new ATOM 0 HD3 PRO A 320 11.364 3.525 -4.816 1.00 0.00 H new ATOM 217 N THR A 321 13.319 -0.912 -7.194 1.00 0.00 N ATOM 218 CA THR A 321 13.194 -1.776 -8.402 1.00 0.00 C ATOM 219 C THR A 321 12.013 -2.737 -8.238 1.00 0.00 C ATOM 220 O THR A 321 11.453 -2.869 -7.167 1.00 0.00 O ATOM 221 CB THR A 321 14.509 -2.552 -8.474 1.00 0.00 C ATOM 222 OG1 THR A 321 15.594 -1.663 -8.253 1.00 0.00 O ATOM 223 CG2 THR A 321 14.648 -3.198 -9.852 1.00 0.00 C ATOM 0 H THR A 321 14.242 -0.902 -6.759 1.00 0.00 H new ATOM 0 HA THR A 321 13.014 -1.198 -9.308 1.00 0.00 H new ATOM 0 HB THR A 321 14.515 -3.329 -7.710 1.00 0.00 H new ATOM 0 HG1 THR A 321 16.438 -2.159 -8.297 1.00 0.00 H new ATOM 0 HG21 THR A 321 15.586 -3.751 -9.902 1.00 0.00 H new ATOM 0 HG22 THR A 321 13.815 -3.881 -10.019 1.00 0.00 H new ATOM 0 HG23 THR A 321 14.642 -2.424 -10.619 1.00 0.00 H new ATOM 231 N ASP A 322 11.632 -3.408 -9.289 1.00 0.00 N ATOM 232 CA ASP A 322 10.488 -4.359 -9.190 1.00 0.00 C ATOM 233 C ASP A 322 10.659 -5.262 -7.965 1.00 0.00 C ATOM 234 O ASP A 322 9.713 -5.559 -7.263 1.00 0.00 O ATOM 235 CB ASP A 322 10.547 -5.182 -10.477 1.00 0.00 C ATOM 236 CG ASP A 322 9.291 -6.047 -10.588 1.00 0.00 C ATOM 237 OD1 ASP A 322 8.483 -6.006 -9.674 1.00 0.00 O ATOM 238 OD2 ASP A 322 9.156 -6.736 -11.586 1.00 0.00 O ATOM 0 H ASP A 322 12.062 -3.340 -10.211 1.00 0.00 H new ATOM 0 HA ASP A 322 9.532 -3.848 -9.077 1.00 0.00 H new ATOM 0 HB2 ASP A 322 10.624 -4.521 -11.340 1.00 0.00 H new ATOM 0 HB3 ASP A 322 11.436 -5.812 -10.478 1.00 0.00 H new ATOM 243 N GLU A 323 11.860 -5.700 -7.705 1.00 0.00 N ATOM 244 CA GLU A 323 12.095 -6.581 -6.526 1.00 0.00 C ATOM 245 C GLU A 323 11.432 -5.984 -5.281 1.00 0.00 C ATOM 246 O GLU A 323 10.863 -6.690 -4.471 1.00 0.00 O ATOM 247 CB GLU A 323 13.615 -6.621 -6.360 1.00 0.00 C ATOM 248 CG GLU A 323 14.148 -7.963 -6.864 1.00 0.00 C ATOM 249 CD GLU A 323 15.547 -8.203 -6.291 1.00 0.00 C ATOM 250 OE1 GLU A 323 16.346 -7.282 -6.325 1.00 0.00 O ATOM 251 OE2 GLU A 323 15.794 -9.305 -5.828 1.00 0.00 O ATOM 0 H GLU A 323 12.690 -5.486 -8.258 1.00 0.00 H new ATOM 0 HA GLU A 323 11.674 -7.577 -6.662 1.00 0.00 H new ATOM 0 HB2 GLU A 323 14.074 -5.803 -6.916 1.00 0.00 H new ATOM 0 HB3 GLU A 323 13.881 -6.482 -5.312 1.00 0.00 H new ATOM 0 HG2 GLU A 323 13.477 -8.769 -6.565 1.00 0.00 H new ATOM 0 HG3 GLU A 323 14.184 -7.966 -7.953 1.00 0.00 H new ATOM 258 N GLU A 324 11.494 -4.689 -5.126 1.00 0.00 N ATOM 259 CA GLU A 324 10.863 -4.052 -3.936 1.00 0.00 C ATOM 260 C GLU A 324 9.352 -3.953 -4.140 1.00 0.00 C ATOM 261 O GLU A 324 8.579 -4.062 -3.209 1.00 0.00 O ATOM 262 CB GLU A 324 11.488 -2.660 -3.855 1.00 0.00 C ATOM 263 CG GLU A 324 12.724 -2.708 -2.956 1.00 0.00 C ATOM 264 CD GLU A 324 12.317 -2.415 -1.511 1.00 0.00 C ATOM 265 OE1 GLU A 324 11.211 -2.777 -1.143 1.00 0.00 O ATOM 266 OE2 GLU A 324 13.116 -1.833 -0.797 1.00 0.00 O ATOM 0 H GLU A 324 11.954 -4.046 -5.771 1.00 0.00 H new ATOM 0 HA GLU A 324 11.026 -4.622 -3.021 1.00 0.00 H new ATOM 0 HB2 GLU A 324 11.763 -2.315 -4.852 1.00 0.00 H new ATOM 0 HB3 GLU A 324 10.765 -1.947 -3.459 1.00 0.00 H new ATOM 0 HG2 GLU A 324 13.195 -3.689 -3.020 1.00 0.00 H new ATOM 0 HG3 GLU A 324 13.460 -1.978 -3.293 1.00 0.00 H new ATOM 273 N LEU A 325 8.925 -3.752 -5.356 1.00 0.00 N ATOM 274 CA LEU A 325 7.464 -3.652 -5.625 1.00 0.00 C ATOM 275 C LEU A 325 6.791 -4.994 -5.329 1.00 0.00 C ATOM 276 O LEU A 325 5.930 -5.095 -4.478 1.00 0.00 O ATOM 277 CB LEU A 325 7.361 -3.318 -7.114 1.00 0.00 C ATOM 278 CG LEU A 325 7.553 -1.813 -7.323 1.00 0.00 C ATOM 279 CD1 LEU A 325 6.277 -1.075 -6.914 1.00 0.00 C ATOM 280 CD2 LEU A 325 8.725 -1.315 -6.471 1.00 0.00 C ATOM 0 H LEU A 325 9.525 -3.653 -6.175 1.00 0.00 H new ATOM 0 HA LEU A 325 6.974 -2.901 -5.005 1.00 0.00 H new ATOM 0 HB2 LEU A 325 8.116 -3.871 -7.673 1.00 0.00 H new ATOM 0 HB3 LEU A 325 6.389 -3.627 -7.499 1.00 0.00 H new ATOM 0 HG LEU A 325 7.766 -1.621 -8.375 1.00 0.00 H new ATOM 0 HD11 LEU A 325 6.413 -0.004 -7.062 1.00 0.00 H new ATOM 0 HD12 LEU A 325 5.444 -1.423 -7.524 1.00 0.00 H new ATOM 0 HD13 LEU A 325 6.064 -1.272 -5.863 1.00 0.00 H new ATOM 0 HD21 LEU A 325 8.857 -0.244 -6.624 1.00 0.00 H new ATOM 0 HD22 LEU A 325 8.518 -1.509 -5.419 1.00 0.00 H new ATOM 0 HD23 LEU A 325 9.636 -1.838 -6.764 1.00 0.00 H new ATOM 292 N LYS A 326 7.186 -6.026 -6.022 1.00 0.00 N ATOM 293 CA LYS A 326 6.578 -7.363 -5.781 1.00 0.00 C ATOM 294 C LYS A 326 6.625 -7.699 -4.288 1.00 0.00 C ATOM 295 O LYS A 326 5.646 -8.125 -3.708 1.00 0.00 O ATOM 296 CB LYS A 326 7.439 -8.340 -6.581 1.00 0.00 C ATOM 297 CG LYS A 326 6.765 -9.713 -6.603 1.00 0.00 C ATOM 298 CD LYS A 326 5.830 -9.803 -7.811 1.00 0.00 C ATOM 299 CE LYS A 326 6.198 -11.026 -8.654 1.00 0.00 C ATOM 300 NZ LYS A 326 5.093 -11.997 -8.421 1.00 0.00 N ATOM 0 H LYS A 326 7.905 -6.000 -6.746 1.00 0.00 H new ATOM 0 HA LYS A 326 5.532 -7.404 -6.083 1.00 0.00 H new ATOM 0 HB2 LYS A 326 7.574 -7.973 -7.598 1.00 0.00 H new ATOM 0 HB3 LYS A 326 8.431 -8.417 -6.135 1.00 0.00 H new ATOM 0 HG2 LYS A 326 7.518 -10.499 -6.653 1.00 0.00 H new ATOM 0 HG3 LYS A 326 6.203 -9.869 -5.682 1.00 0.00 H new ATOM 0 HD2 LYS A 326 4.795 -9.876 -7.478 1.00 0.00 H new ATOM 0 HD3 LYS A 326 5.908 -8.897 -8.412 1.00 0.00 H new ATOM 0 HE2 LYS A 326 6.281 -10.768 -9.710 1.00 0.00 H new ATOM 0 HE3 LYS A 326 7.159 -11.441 -8.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 326 5.272 -12.864 -8.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 326 5.042 -12.229 -7.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 326 4.192 -11.577 -8.726 1.00 0.00 H new ATOM 314 N GLU A 327 7.755 -7.509 -3.661 1.00 0.00 N ATOM 315 CA GLU A 327 7.855 -7.818 -2.206 1.00 0.00 C ATOM 316 C GLU A 327 6.730 -7.119 -1.439 1.00 0.00 C ATOM 317 O GLU A 327 5.929 -7.751 -0.781 1.00 0.00 O ATOM 318 CB GLU A 327 9.218 -7.277 -1.773 1.00 0.00 C ATOM 319 CG GLU A 327 10.038 -8.409 -1.153 1.00 0.00 C ATOM 320 CD GLU A 327 10.976 -7.838 -0.088 1.00 0.00 C ATOM 321 OE1 GLU A 327 11.310 -6.668 -0.187 1.00 0.00 O ATOM 322 OE2 GLU A 327 11.343 -8.578 0.809 1.00 0.00 O ATOM 0 H GLU A 327 8.609 -7.155 -4.091 1.00 0.00 H new ATOM 0 HA GLU A 327 7.761 -8.885 -2.005 1.00 0.00 H new ATOM 0 HB2 GLU A 327 9.745 -6.858 -2.630 1.00 0.00 H new ATOM 0 HB3 GLU A 327 9.089 -6.469 -1.053 1.00 0.00 H new ATOM 0 HG2 GLU A 327 9.375 -9.151 -0.708 1.00 0.00 H new ATOM 0 HG3 GLU A 327 10.615 -8.919 -1.925 1.00 0.00 H new ATOM 329 N THR A 328 6.659 -5.817 -1.522 1.00 0.00 N ATOM 330 CA THR A 328 5.581 -5.086 -0.799 1.00 0.00 C ATOM 331 C THR A 328 4.245 -5.810 -0.990 1.00 0.00 C ATOM 332 O THR A 328 3.527 -6.068 -0.044 1.00 0.00 O ATOM 333 CB THR A 328 5.540 -3.698 -1.442 1.00 0.00 C ATOM 334 OG1 THR A 328 6.651 -2.935 -0.988 1.00 0.00 O ATOM 335 CG2 THR A 328 4.241 -2.991 -1.057 1.00 0.00 C ATOM 0 H THR A 328 7.299 -5.231 -2.058 1.00 0.00 H new ATOM 0 HA THR A 328 5.764 -5.027 0.274 1.00 0.00 H new ATOM 0 HB THR A 328 5.586 -3.799 -2.526 1.00 0.00 H new ATOM 0 HG1 THR A 328 7.003 -2.398 -1.728 1.00 0.00 H new ATOM 0 HG21 THR A 328 4.215 -2.003 -1.516 1.00 0.00 H new ATOM 0 HG22 THR A 328 3.391 -3.576 -1.407 1.00 0.00 H new ATOM 0 HG23 THR A 328 4.190 -2.889 0.027 1.00 0.00 H new ATOM 343 N ILE A 329 3.908 -6.147 -2.204 1.00 0.00 N ATOM 344 CA ILE A 329 2.625 -6.861 -2.443 1.00 0.00 C ATOM 345 C ILE A 329 2.631 -8.197 -1.698 1.00 0.00 C ATOM 346 O ILE A 329 1.737 -8.496 -0.933 1.00 0.00 O ATOM 347 CB ILE A 329 2.566 -7.091 -3.951 1.00 0.00 C ATOM 348 CG1 ILE A 329 2.708 -5.751 -4.678 1.00 0.00 C ATOM 349 CG2 ILE A 329 1.225 -7.725 -4.315 1.00 0.00 C ATOM 350 CD1 ILE A 329 3.503 -5.954 -5.969 1.00 0.00 C ATOM 0 H ILE A 329 4.464 -5.959 -3.038 1.00 0.00 H new ATOM 0 HA ILE A 329 1.764 -6.295 -2.089 1.00 0.00 H new ATOM 0 HB ILE A 329 3.377 -7.755 -4.250 1.00 0.00 H new ATOM 0 HG12 ILE A 329 1.723 -5.342 -4.905 1.00 0.00 H new ATOM 0 HG13 ILE A 329 3.213 -5.029 -4.037 1.00 0.00 H new ATOM 0 HG21 ILE A 329 1.181 -7.890 -5.392 1.00 0.00 H new ATOM 0 HG22 ILE A 329 1.121 -8.678 -3.797 1.00 0.00 H new ATOM 0 HG23 ILE A 329 0.415 -7.060 -4.016 1.00 0.00 H new ATOM 0 HD11 ILE A 329 3.605 -5.001 -6.487 1.00 0.00 H new ATOM 0 HD12 ILE A 329 4.492 -6.344 -5.730 1.00 0.00 H new ATOM 0 HD13 ILE A 329 2.979 -6.662 -6.611 1.00 0.00 H new ATOM 362 N LYS A 330 3.637 -9.000 -1.913 1.00 0.00 N ATOM 363 CA LYS A 330 3.703 -10.313 -1.210 1.00 0.00 C ATOM 364 C LYS A 330 3.329 -10.133 0.263 1.00 0.00 C ATOM 365 O LYS A 330 2.820 -11.033 0.900 1.00 0.00 O ATOM 366 CB LYS A 330 5.159 -10.762 -1.345 1.00 0.00 C ATOM 367 CG LYS A 330 5.439 -11.893 -0.353 1.00 0.00 C ATOM 368 CD LYS A 330 6.047 -11.310 0.925 1.00 0.00 C ATOM 369 CE LYS A 330 7.165 -12.229 1.424 1.00 0.00 C ATOM 370 NZ LYS A 330 8.329 -11.328 1.653 1.00 0.00 N ATOM 0 H LYS A 330 4.415 -8.804 -2.544 1.00 0.00 H new ATOM 0 HA LYS A 330 3.013 -11.046 -1.629 1.00 0.00 H new ATOM 0 HB2 LYS A 330 5.353 -11.100 -2.363 1.00 0.00 H new ATOM 0 HB3 LYS A 330 5.828 -9.923 -1.155 1.00 0.00 H new ATOM 0 HG2 LYS A 330 4.516 -12.424 -0.120 1.00 0.00 H new ATOM 0 HG3 LYS A 330 6.122 -12.619 -0.795 1.00 0.00 H new ATOM 0 HD2 LYS A 330 6.441 -10.313 0.731 1.00 0.00 H new ATOM 0 HD3 LYS A 330 5.279 -11.205 1.691 1.00 0.00 H new ATOM 0 HE2 LYS A 330 6.875 -12.741 2.342 1.00 0.00 H new ATOM 0 HE3 LYS A 330 7.400 -12.999 0.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 9.137 -11.885 1.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 8.586 -10.860 0.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 8.078 -10.609 2.361 1.00 0.00 H new ATOM 384 N LYS A 331 3.571 -8.970 0.804 1.00 0.00 N ATOM 385 CA LYS A 331 3.223 -8.727 2.233 1.00 0.00 C ATOM 386 C LYS A 331 1.726 -8.431 2.356 1.00 0.00 C ATOM 387 O LYS A 331 1.107 -8.705 3.364 1.00 0.00 O ATOM 388 CB LYS A 331 4.050 -7.509 2.649 1.00 0.00 C ATOM 389 CG LYS A 331 5.516 -7.915 2.811 1.00 0.00 C ATOM 390 CD LYS A 331 6.107 -7.216 4.037 1.00 0.00 C ATOM 391 CE LYS A 331 7.618 -7.057 3.858 1.00 0.00 C ATOM 392 NZ LYS A 331 8.219 -8.126 4.704 1.00 0.00 N ATOM 0 H LYS A 331 3.994 -8.179 0.319 1.00 0.00 H new ATOM 0 HA LYS A 331 3.436 -9.589 2.865 1.00 0.00 H new ATOM 0 HB2 LYS A 331 3.961 -6.723 1.899 1.00 0.00 H new ATOM 0 HB3 LYS A 331 3.670 -7.101 3.585 1.00 0.00 H new ATOM 0 HG2 LYS A 331 5.595 -8.996 2.923 1.00 0.00 H new ATOM 0 HG3 LYS A 331 6.080 -7.645 1.918 1.00 0.00 H new ATOM 0 HD2 LYS A 331 5.642 -6.239 4.171 1.00 0.00 H new ATOM 0 HD3 LYS A 331 5.896 -7.796 4.936 1.00 0.00 H new ATOM 0 HE2 LYS A 331 7.906 -7.171 2.813 1.00 0.00 H new ATOM 0 HE3 LYS A 331 7.951 -6.069 4.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 9.256 -8.082 4.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 7.933 -7.987 5.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 7.889 -9.056 4.375 1.00 0.00 H new ATOM 406 N LEU A 332 1.139 -7.876 1.329 1.00 0.00 N ATOM 407 CA LEU A 332 -0.318 -7.566 1.379 1.00 0.00 C ATOM 408 C LEU A 332 -1.136 -8.861 1.324 1.00 0.00 C ATOM 409 O LEU A 332 -1.854 -9.192 2.246 1.00 0.00 O ATOM 410 CB LEU A 332 -0.587 -6.711 0.139 1.00 0.00 C ATOM 411 CG LEU A 332 0.267 -5.443 0.192 1.00 0.00 C ATOM 412 CD1 LEU A 332 0.056 -4.632 -1.088 1.00 0.00 C ATOM 413 CD2 LEU A 332 -0.149 -4.600 1.400 1.00 0.00 C ATOM 0 H LEU A 332 1.606 -7.624 0.458 1.00 0.00 H new ATOM 0 HA LEU A 332 -0.598 -7.050 2.298 1.00 0.00 H new ATOM 0 HB2 LEU A 332 -0.357 -7.278 -0.763 1.00 0.00 H new ATOM 0 HB3 LEU A 332 -1.644 -6.448 0.089 1.00 0.00 H new ATOM 0 HG LEU A 332 1.318 -5.717 0.281 1.00 0.00 H new ATOM 0 HD11 LEU A 332 0.664 -3.728 -1.051 1.00 0.00 H new ATOM 0 HD12 LEU A 332 0.348 -5.231 -1.951 1.00 0.00 H new ATOM 0 HD13 LEU A 332 -0.995 -4.358 -1.176 1.00 0.00 H new ATOM 0 HD21 LEU A 332 0.459 -3.696 1.439 1.00 0.00 H new ATOM 0 HD22 LEU A 332 -1.200 -4.327 1.308 1.00 0.00 H new ATOM 0 HD23 LEU A 332 -0.002 -5.176 2.314 1.00 0.00 H new ATOM 425 N LEU A 333 -1.038 -9.592 0.246 1.00 0.00 N ATOM 426 CA LEU A 333 -1.818 -10.860 0.133 1.00 0.00 C ATOM 427 C LEU A 333 -1.505 -11.792 1.309 1.00 0.00 C ATOM 428 O LEU A 333 -2.373 -12.474 1.816 1.00 0.00 O ATOM 429 CB LEU A 333 -1.383 -11.497 -1.192 1.00 0.00 C ATOM 430 CG LEU A 333 0.132 -11.367 -1.368 1.00 0.00 C ATOM 431 CD1 LEU A 333 0.736 -12.750 -1.623 1.00 0.00 C ATOM 432 CD2 LEU A 333 0.424 -10.457 -2.563 1.00 0.00 C ATOM 0 H LEU A 333 -0.454 -9.368 -0.559 1.00 0.00 H new ATOM 0 HA LEU A 333 -2.892 -10.675 0.156 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -1.670 -12.548 -1.210 1.00 0.00 H new ATOM 0 HB3 LEU A 333 -1.896 -11.012 -2.023 1.00 0.00 H new ATOM 0 HG LEU A 333 0.570 -10.940 -0.466 1.00 0.00 H new ATOM 0 HD11 LEU A 333 1.815 -12.658 -1.748 1.00 0.00 H new ATOM 0 HD12 LEU A 333 0.523 -13.402 -0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 333 0.301 -13.176 -2.527 1.00 0.00 H new ATOM 0 HD21 LEU A 333 1.502 -10.361 -2.693 1.00 0.00 H new ATOM 0 HD22 LEU A 333 -0.013 -10.888 -3.464 1.00 0.00 H new ATOM 0 HD23 LEU A 333 -0.009 -9.473 -2.385 1.00 0.00 H new ATOM 444 N ALA A 334 -0.278 -11.827 1.749 1.00 0.00 N ATOM 445 CA ALA A 334 0.076 -12.718 2.891 1.00 0.00 C ATOM 446 C ALA A 334 -0.632 -12.248 4.163 1.00 0.00 C ATOM 447 O ALA A 334 -0.622 -12.918 5.176 1.00 0.00 O ATOM 448 CB ALA A 334 1.591 -12.587 3.042 1.00 0.00 C ATOM 0 H ALA A 334 0.494 -11.279 1.369 1.00 0.00 H new ATOM 0 HA ALA A 334 -0.228 -13.751 2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 334 1.930 -13.215 3.866 1.00 0.00 H new ATOM 0 HB2 ALA A 334 2.077 -12.904 2.119 1.00 0.00 H new ATOM 0 HB3 ALA A 334 1.848 -11.548 3.249 1.00 0.00 H new ATOM 454 N SER A 335 -1.248 -11.098 4.118 1.00 0.00 N ATOM 455 CA SER A 335 -1.956 -10.582 5.324 1.00 0.00 C ATOM 456 C SER A 335 -3.445 -10.399 5.021 1.00 0.00 C ATOM 457 O SER A 335 -4.132 -9.635 5.670 1.00 0.00 O ATOM 458 CB SER A 335 -1.301 -9.235 5.622 1.00 0.00 C ATOM 459 OG SER A 335 -1.698 -8.290 4.636 1.00 0.00 O ATOM 0 H SER A 335 -1.292 -10.493 3.298 1.00 0.00 H new ATOM 0 HA SER A 335 -1.884 -11.265 6.170 1.00 0.00 H new ATOM 0 HB2 SER A 335 -1.592 -8.888 6.613 1.00 0.00 H new ATOM 0 HB3 SER A 335 -0.216 -9.339 5.627 1.00 0.00 H new ATOM 0 HG SER A 335 -1.728 -8.726 3.759 1.00 0.00 H new ATOM 465 N ALA A 336 -3.949 -11.094 4.038 1.00 0.00 N ATOM 466 CA ALA A 336 -5.392 -10.959 3.693 1.00 0.00 C ATOM 467 C ALA A 336 -5.851 -12.161 2.863 1.00 0.00 C ATOM 468 O ALA A 336 -5.100 -13.087 2.624 1.00 0.00 O ATOM 469 CB ALA A 336 -5.483 -9.674 2.869 1.00 0.00 C ATOM 0 H ALA A 336 -3.424 -11.749 3.459 1.00 0.00 H new ATOM 0 HA ALA A 336 -6.027 -10.922 4.578 1.00 0.00 H new ATOM 0 HB1 ALA A 336 -6.519 -9.503 2.575 1.00 0.00 H new ATOM 0 HB2 ALA A 336 -5.132 -8.833 3.467 1.00 0.00 H new ATOM 0 HB3 ALA A 336 -4.863 -9.769 1.977 1.00 0.00 H new ATOM 475 N ASN A 337 -7.078 -12.156 2.421 1.00 0.00 N ATOM 476 CA ASN A 337 -7.583 -13.297 1.607 1.00 0.00 C ATOM 477 C ASN A 337 -7.588 -12.923 0.121 1.00 0.00 C ATOM 478 O ASN A 337 -8.295 -12.031 -0.301 1.00 0.00 O ATOM 479 CB ASN A 337 -9.008 -13.539 2.104 1.00 0.00 C ATOM 480 CG ASN A 337 -8.962 -14.218 3.475 1.00 0.00 C ATOM 481 OD1 ASN A 337 -8.733 -15.408 3.569 1.00 0.00 O ATOM 482 ND2 ASN A 337 -9.170 -13.508 4.549 1.00 0.00 N ATOM 0 H ASN A 337 -7.753 -11.410 2.589 1.00 0.00 H new ATOM 0 HA ASN A 337 -6.960 -14.186 1.709 1.00 0.00 H new ATOM 0 HB2 ASN A 337 -9.546 -12.594 2.172 1.00 0.00 H new ATOM 0 HB3 ASN A 337 -9.551 -14.164 1.395 1.00 0.00 H new ATOM 0 HD21 ASN A 337 -9.140 -13.951 5.467 1.00 0.00 H new ATOM 0 HD22 ASN A 337 -9.362 -12.509 4.471 1.00 0.00 H new ATOM 489 N LEU A 338 -6.799 -13.596 -0.673 1.00 0.00 N ATOM 490 CA LEU A 338 -6.760 -13.274 -2.129 1.00 0.00 C ATOM 491 C LEU A 338 -8.181 -13.086 -2.666 1.00 0.00 C ATOM 492 O LEU A 338 -8.488 -12.098 -3.304 1.00 0.00 O ATOM 493 CB LEU A 338 -6.090 -14.482 -2.794 1.00 0.00 C ATOM 494 CG LEU A 338 -4.771 -14.814 -2.082 1.00 0.00 C ATOM 495 CD1 LEU A 338 -3.908 -15.685 -2.996 1.00 0.00 C ATOM 496 CD2 LEU A 338 -4.015 -13.522 -1.754 1.00 0.00 C ATOM 0 H LEU A 338 -6.182 -14.352 -0.378 1.00 0.00 H new ATOM 0 HA LEU A 338 -6.217 -12.350 -2.330 1.00 0.00 H new ATOM 0 HB2 LEU A 338 -6.758 -15.343 -2.759 1.00 0.00 H new ATOM 0 HB3 LEU A 338 -5.900 -14.269 -3.846 1.00 0.00 H new ATOM 0 HG LEU A 338 -4.988 -15.349 -1.157 1.00 0.00 H new ATOM 0 HD11 LEU A 338 -2.970 -15.923 -2.493 1.00 0.00 H new ATOM 0 HD12 LEU A 338 -4.440 -16.608 -3.227 1.00 0.00 H new ATOM 0 HD13 LEU A 338 -3.698 -15.146 -3.920 1.00 0.00 H new ATOM 0 HD21 LEU A 338 -3.080 -13.766 -1.249 1.00 0.00 H new ATOM 0 HD22 LEU A 338 -3.799 -12.983 -2.676 1.00 0.00 H new ATOM 0 HD23 LEU A 338 -4.627 -12.898 -1.103 1.00 0.00 H new ATOM 508 N GLU A 339 -9.050 -14.027 -2.414 1.00 0.00 N ATOM 509 CA GLU A 339 -10.450 -13.900 -2.910 1.00 0.00 C ATOM 510 C GLU A 339 -11.078 -12.606 -2.389 1.00 0.00 C ATOM 511 O GLU A 339 -12.030 -12.097 -2.945 1.00 0.00 O ATOM 512 CB GLU A 339 -11.183 -15.116 -2.343 1.00 0.00 C ATOM 513 CG GLU A 339 -12.665 -15.040 -2.714 1.00 0.00 C ATOM 514 CD GLU A 339 -12.950 -15.987 -3.881 1.00 0.00 C ATOM 515 OE1 GLU A 339 -12.652 -15.617 -5.004 1.00 0.00 O ATOM 516 OE2 GLU A 339 -13.461 -17.066 -3.630 1.00 0.00 O ATOM 0 H GLU A 339 -8.851 -14.877 -1.887 1.00 0.00 H new ATOM 0 HA GLU A 339 -10.501 -13.864 -3.998 1.00 0.00 H new ATOM 0 HB2 GLU A 339 -10.746 -16.033 -2.737 1.00 0.00 H new ATOM 0 HB3 GLU A 339 -11.070 -15.149 -1.259 1.00 0.00 H new ATOM 0 HG2 GLU A 339 -13.280 -15.309 -1.855 1.00 0.00 H new ATOM 0 HG3 GLU A 339 -12.930 -14.019 -2.988 1.00 0.00 H new ATOM 523 N GLU A 340 -10.550 -12.071 -1.323 1.00 0.00 N ATOM 524 CA GLU A 340 -11.116 -10.810 -0.764 1.00 0.00 C ATOM 525 C GLU A 340 -10.194 -9.629 -1.079 1.00 0.00 C ATOM 526 O GLU A 340 -10.310 -8.568 -0.500 1.00 0.00 O ATOM 527 CB GLU A 340 -11.193 -11.046 0.744 1.00 0.00 C ATOM 528 CG GLU A 340 -12.627 -10.821 1.223 1.00 0.00 C ATOM 529 CD GLU A 340 -12.618 -9.905 2.448 1.00 0.00 C ATOM 530 OE1 GLU A 340 -12.023 -10.285 3.443 1.00 0.00 O ATOM 531 OE2 GLU A 340 -13.204 -8.839 2.370 1.00 0.00 O ATOM 0 H GLU A 340 -9.752 -12.452 -0.815 1.00 0.00 H new ATOM 0 HA GLU A 340 -12.091 -10.571 -1.189 1.00 0.00 H new ATOM 0 HB2 GLU A 340 -10.874 -12.061 0.981 1.00 0.00 H new ATOM 0 HB3 GLU A 340 -10.514 -10.370 1.264 1.00 0.00 H new ATOM 0 HG2 GLU A 340 -13.222 -10.375 0.426 1.00 0.00 H new ATOM 0 HG3 GLU A 340 -13.092 -11.775 1.472 1.00 0.00 H new ATOM 538 N VAL A 341 -9.280 -9.804 -1.995 1.00 0.00 N ATOM 539 CA VAL A 341 -8.355 -8.689 -2.346 1.00 0.00 C ATOM 540 C VAL A 341 -8.755 -8.078 -3.691 1.00 0.00 C ATOM 541 O VAL A 341 -9.040 -8.778 -4.643 1.00 0.00 O ATOM 542 CB VAL A 341 -6.971 -9.332 -2.436 1.00 0.00 C ATOM 543 CG1 VAL A 341 -5.994 -8.350 -3.085 1.00 0.00 C ATOM 544 CG2 VAL A 341 -6.480 -9.683 -1.030 1.00 0.00 C ATOM 0 H VAL A 341 -9.134 -10.670 -2.515 1.00 0.00 H new ATOM 0 HA VAL A 341 -8.380 -7.884 -1.611 1.00 0.00 H new ATOM 0 HB VAL A 341 -7.030 -10.239 -3.038 1.00 0.00 H new ATOM 0 HG11 VAL A 341 -5.007 -8.808 -3.149 1.00 0.00 H new ATOM 0 HG12 VAL A 341 -6.343 -8.098 -4.086 1.00 0.00 H new ATOM 0 HG13 VAL A 341 -5.935 -7.444 -2.482 1.00 0.00 H new ATOM 0 HG21 VAL A 341 -5.493 -10.142 -1.093 1.00 0.00 H new ATOM 0 HG22 VAL A 341 -6.421 -8.776 -0.428 1.00 0.00 H new ATOM 0 HG23 VAL A 341 -7.176 -10.382 -0.566 1.00 0.00 H new ATOM 554 N THR A 342 -8.781 -6.776 -3.776 1.00 0.00 N ATOM 555 CA THR A 342 -9.167 -6.119 -5.057 1.00 0.00 C ATOM 556 C THR A 342 -8.075 -5.141 -5.503 1.00 0.00 C ATOM 557 O THR A 342 -7.302 -4.653 -4.704 1.00 0.00 O ATOM 558 CB THR A 342 -10.464 -5.372 -4.742 1.00 0.00 C ATOM 559 OG1 THR A 342 -10.195 -4.332 -3.812 1.00 0.00 O ATOM 560 CG2 THR A 342 -11.481 -6.345 -4.143 1.00 0.00 C ATOM 0 H THR A 342 -8.552 -6.139 -3.013 1.00 0.00 H new ATOM 0 HA THR A 342 -9.296 -6.837 -5.867 1.00 0.00 H new ATOM 0 HB THR A 342 -10.870 -4.944 -5.658 1.00 0.00 H new ATOM 0 HG1 THR A 342 -11.025 -3.851 -3.610 1.00 0.00 H new ATOM 0 HG21 THR A 342 -12.405 -5.813 -3.918 1.00 0.00 H new ATOM 0 HG22 THR A 342 -11.686 -7.143 -4.857 1.00 0.00 H new ATOM 0 HG23 THR A 342 -11.078 -6.774 -3.226 1.00 0.00 H new ATOM 568 N MET A 343 -8.008 -4.854 -6.775 1.00 0.00 N ATOM 569 CA MET A 343 -6.968 -3.909 -7.275 1.00 0.00 C ATOM 570 C MET A 343 -6.954 -2.638 -6.422 1.00 0.00 C ATOM 571 O MET A 343 -5.939 -1.985 -6.279 1.00 0.00 O ATOM 572 CB MET A 343 -7.385 -3.588 -8.711 1.00 0.00 C ATOM 573 CG MET A 343 -8.612 -2.674 -8.696 1.00 0.00 C ATOM 574 SD MET A 343 -9.491 -2.817 -10.273 1.00 0.00 S ATOM 575 CE MET A 343 -10.778 -1.592 -9.929 1.00 0.00 C ATOM 0 H MET A 343 -8.629 -5.233 -7.490 1.00 0.00 H new ATOM 0 HA MET A 343 -5.965 -4.333 -7.226 1.00 0.00 H new ATOM 0 HB2 MET A 343 -6.564 -3.103 -9.239 1.00 0.00 H new ATOM 0 HB3 MET A 343 -7.611 -4.508 -9.249 1.00 0.00 H new ATOM 0 HG2 MET A 343 -9.272 -2.948 -7.873 1.00 0.00 H new ATOM 0 HG3 MET A 343 -8.307 -1.641 -8.530 1.00 0.00 H new ATOM 0 HE1 MET A 343 -11.446 -1.516 -10.787 1.00 0.00 H new ATOM 0 HE2 MET A 343 -11.347 -1.899 -9.051 1.00 0.00 H new ATOM 0 HE3 MET A 343 -10.317 -0.622 -9.742 1.00 0.00 H new ATOM 585 N LYS A 344 -8.073 -2.283 -5.853 1.00 0.00 N ATOM 586 CA LYS A 344 -8.123 -1.054 -5.009 1.00 0.00 C ATOM 587 C LYS A 344 -7.176 -1.193 -3.814 1.00 0.00 C ATOM 588 O LYS A 344 -6.264 -0.409 -3.638 1.00 0.00 O ATOM 589 CB LYS A 344 -9.573 -0.962 -4.533 1.00 0.00 C ATOM 590 CG LYS A 344 -10.035 0.496 -4.578 1.00 0.00 C ATOM 591 CD LYS A 344 -10.708 0.777 -5.923 1.00 0.00 C ATOM 592 CE LYS A 344 -9.974 1.917 -6.632 1.00 0.00 C ATOM 593 NZ LYS A 344 -10.996 2.540 -7.519 1.00 0.00 N ATOM 0 H LYS A 344 -8.954 -2.790 -5.935 1.00 0.00 H new ATOM 0 HA LYS A 344 -7.814 -0.164 -5.557 1.00 0.00 H new ATOM 0 HB2 LYS A 344 -10.214 -1.577 -5.165 1.00 0.00 H new ATOM 0 HB3 LYS A 344 -9.659 -1.350 -3.518 1.00 0.00 H new ATOM 0 HG2 LYS A 344 -10.731 0.693 -3.763 1.00 0.00 H new ATOM 0 HG3 LYS A 344 -9.184 1.163 -4.439 1.00 0.00 H new ATOM 0 HD2 LYS A 344 -10.695 -0.120 -6.543 1.00 0.00 H new ATOM 0 HD3 LYS A 344 -11.754 1.043 -5.770 1.00 0.00 H new ATOM 0 HE2 LYS A 344 -9.580 2.638 -5.916 1.00 0.00 H new ATOM 0 HE3 LYS A 344 -9.127 1.544 -7.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 344 -10.567 3.332 -8.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 344 -11.348 1.832 -8.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 344 -11.787 2.892 -6.943 1.00 0.00 H new ATOM 607 N GLN A 345 -7.386 -2.184 -2.990 1.00 0.00 N ATOM 608 CA GLN A 345 -6.500 -2.371 -1.806 1.00 0.00 C ATOM 609 C GLN A 345 -5.037 -2.486 -2.249 1.00 0.00 C ATOM 610 O GLN A 345 -4.136 -2.055 -1.558 1.00 0.00 O ATOM 611 CB GLN A 345 -6.973 -3.676 -1.163 1.00 0.00 C ATOM 612 CG GLN A 345 -7.655 -3.371 0.173 1.00 0.00 C ATOM 613 CD GLN A 345 -9.125 -3.787 0.104 1.00 0.00 C ATOM 614 OE1 GLN A 345 -9.921 -3.143 -0.548 1.00 0.00 O ATOM 615 NE2 GLN A 345 -9.520 -4.847 0.754 1.00 0.00 N ATOM 0 H GLN A 345 -8.133 -2.872 -3.086 1.00 0.00 H new ATOM 0 HA GLN A 345 -6.553 -1.532 -1.113 1.00 0.00 H new ATOM 0 HB2 GLN A 345 -7.667 -4.191 -1.828 1.00 0.00 H new ATOM 0 HB3 GLN A 345 -6.126 -4.344 -1.007 1.00 0.00 H new ATOM 0 HG2 GLN A 345 -7.153 -3.905 0.980 1.00 0.00 H new ATOM 0 HG3 GLN A 345 -7.578 -2.307 0.398 1.00 0.00 H new ATOM 0 HE21 GLN A 345 -8.851 -5.388 1.302 1.00 0.00 H new ATOM 0 HE22 GLN A 345 -10.498 -5.135 0.714 1.00 0.00 H new ATOM 624 N ILE A 346 -4.796 -3.061 -3.395 1.00 0.00 N ATOM 625 CA ILE A 346 -3.392 -3.199 -3.879 1.00 0.00 C ATOM 626 C ILE A 346 -2.810 -1.823 -4.209 1.00 0.00 C ATOM 627 O ILE A 346 -1.774 -1.439 -3.705 1.00 0.00 O ATOM 628 CB ILE A 346 -3.490 -4.064 -5.137 1.00 0.00 C ATOM 629 CG1 ILE A 346 -4.028 -5.450 -4.765 1.00 0.00 C ATOM 630 CG2 ILE A 346 -2.105 -4.209 -5.772 1.00 0.00 C ATOM 631 CD1 ILE A 346 -3.306 -5.967 -3.517 1.00 0.00 C ATOM 0 H ILE A 346 -5.509 -3.441 -4.017 1.00 0.00 H new ATOM 0 HA ILE A 346 -2.737 -3.646 -3.131 1.00 0.00 H new ATOM 0 HB ILE A 346 -4.166 -3.590 -5.848 1.00 0.00 H new ATOM 0 HG12 ILE A 346 -5.101 -5.396 -4.580 1.00 0.00 H new ATOM 0 HG13 ILE A 346 -3.882 -6.142 -5.594 1.00 0.00 H new ATOM 0 HG21 ILE A 346 -2.178 -4.826 -6.668 1.00 0.00 H new ATOM 0 HG22 ILE A 346 -1.723 -3.224 -6.040 1.00 0.00 H new ATOM 0 HG23 ILE A 346 -1.426 -4.681 -5.061 1.00 0.00 H new ATOM 0 HD11 ILE A 346 -3.691 -6.953 -3.256 1.00 0.00 H new ATOM 0 HD12 ILE A 346 -2.237 -6.037 -3.718 1.00 0.00 H new ATOM 0 HD13 ILE A 346 -3.475 -5.280 -2.688 1.00 0.00 H new ATOM 643 N CYS A 347 -3.471 -1.075 -5.051 1.00 0.00 N ATOM 644 CA CYS A 347 -2.954 0.277 -5.410 1.00 0.00 C ATOM 645 C CYS A 347 -2.863 1.160 -4.162 1.00 0.00 C ATOM 646 O CYS A 347 -2.006 2.014 -4.055 1.00 0.00 O ATOM 647 CB CYS A 347 -3.979 0.843 -6.393 1.00 0.00 C ATOM 648 SG CYS A 347 -4.076 -0.230 -7.847 1.00 0.00 S ATOM 0 H CYS A 347 -4.345 -1.341 -5.505 1.00 0.00 H new ATOM 0 HA CYS A 347 -1.954 0.235 -5.841 1.00 0.00 H new ATOM 0 HB2 CYS A 347 -4.956 0.915 -5.915 1.00 0.00 H new ATOM 0 HB3 CYS A 347 -3.695 1.852 -6.691 1.00 0.00 H new ATOM 0 HG CYS A 347 -4.861 -1.234 -7.593 1.00 0.00 H new ATOM 654 N LYS A 348 -3.742 0.962 -3.217 1.00 0.00 N ATOM 655 CA LYS A 348 -3.703 1.792 -1.977 1.00 0.00 C ATOM 656 C LYS A 348 -2.455 1.457 -1.155 1.00 0.00 C ATOM 657 O LYS A 348 -1.565 2.269 -1.002 1.00 0.00 O ATOM 658 CB LYS A 348 -4.968 1.415 -1.208 1.00 0.00 C ATOM 659 CG LYS A 348 -6.193 1.995 -1.920 1.00 0.00 C ATOM 660 CD LYS A 348 -7.054 2.759 -0.913 1.00 0.00 C ATOM 661 CE LYS A 348 -8.149 3.528 -1.657 1.00 0.00 C ATOM 662 NZ LYS A 348 -7.878 4.963 -1.363 1.00 0.00 N ATOM 0 H LYS A 348 -4.484 0.263 -3.249 1.00 0.00 H new ATOM 0 HA LYS A 348 -3.662 2.859 -2.196 1.00 0.00 H new ATOM 0 HB2 LYS A 348 -5.054 0.331 -1.139 1.00 0.00 H new ATOM 0 HB3 LYS A 348 -4.913 1.796 -0.188 1.00 0.00 H new ATOM 0 HG2 LYS A 348 -5.878 2.660 -2.724 1.00 0.00 H new ATOM 0 HG3 LYS A 348 -6.774 1.194 -2.378 1.00 0.00 H new ATOM 0 HD2 LYS A 348 -7.502 2.065 -0.201 1.00 0.00 H new ATOM 0 HD3 LYS A 348 -6.435 3.449 -0.340 1.00 0.00 H new ATOM 0 HE2 LYS A 348 -8.112 3.331 -2.728 1.00 0.00 H new ATOM 0 HE3 LYS A 348 -9.141 3.235 -1.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 348 -8.588 5.555 -1.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 348 -7.927 5.122 -0.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 348 -6.930 5.215 -1.708 1.00 0.00 H new ATOM 676 N LYS A 349 -2.386 0.267 -0.625 1.00 0.00 N ATOM 677 CA LYS A 349 -1.196 -0.118 0.188 1.00 0.00 C ATOM 678 C LYS A 349 0.083 0.054 -0.637 1.00 0.00 C ATOM 679 O LYS A 349 1.030 0.682 -0.205 1.00 0.00 O ATOM 680 CB LYS A 349 -1.416 -1.589 0.540 1.00 0.00 C ATOM 681 CG LYS A 349 -2.514 -1.702 1.599 1.00 0.00 C ATOM 682 CD LYS A 349 -1.977 -2.456 2.816 1.00 0.00 C ATOM 683 CE LYS A 349 -2.306 -1.670 4.088 1.00 0.00 C ATOM 684 NZ LYS A 349 -3.610 -2.221 4.553 1.00 0.00 N ATOM 0 H LYS A 349 -3.100 -0.455 -0.719 1.00 0.00 H new ATOM 0 HA LYS A 349 -1.085 0.500 1.079 1.00 0.00 H new ATOM 0 HB2 LYS A 349 -1.697 -2.149 -0.352 1.00 0.00 H new ATOM 0 HB3 LYS A 349 -0.490 -2.027 0.913 1.00 0.00 H new ATOM 0 HG2 LYS A 349 -2.852 -0.709 1.894 1.00 0.00 H new ATOM 0 HG3 LYS A 349 -3.378 -2.224 1.187 1.00 0.00 H new ATOM 0 HD2 LYS A 349 -2.420 -3.451 2.865 1.00 0.00 H new ATOM 0 HD3 LYS A 349 -0.899 -2.591 2.727 1.00 0.00 H new ATOM 0 HE2 LYS A 349 -1.531 -1.799 4.843 1.00 0.00 H new ATOM 0 HE3 LYS A 349 -2.379 -0.602 3.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 349 -3.903 -1.732 5.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 349 -4.330 -2.078 3.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 349 -3.508 -3.238 4.745 1.00 0.00 H new ATOM 698 N VAL A 350 0.120 -0.494 -1.821 1.00 0.00 N ATOM 699 CA VAL A 350 1.342 -0.352 -2.665 1.00 0.00 C ATOM 700 C VAL A 350 1.814 1.104 -2.652 1.00 0.00 C ATOM 701 O VAL A 350 2.956 1.394 -2.359 1.00 0.00 O ATOM 702 CB VAL A 350 0.911 -0.773 -4.070 1.00 0.00 C ATOM 703 CG1 VAL A 350 2.033 -0.467 -5.063 1.00 0.00 C ATOM 704 CG2 VAL A 350 0.619 -2.276 -4.082 1.00 0.00 C ATOM 0 H VAL A 350 -0.639 -1.032 -2.240 1.00 0.00 H new ATOM 0 HA VAL A 350 2.172 -0.960 -2.304 1.00 0.00 H new ATOM 0 HB VAL A 350 0.014 -0.223 -4.355 1.00 0.00 H new ATOM 0 HG11 VAL A 350 1.725 -0.768 -6.064 1.00 0.00 H new ATOM 0 HG12 VAL A 350 2.245 0.602 -5.054 1.00 0.00 H new ATOM 0 HG13 VAL A 350 2.930 -1.017 -4.779 1.00 0.00 H new ATOM 0 HG21 VAL A 350 0.311 -2.579 -5.083 1.00 0.00 H new ATOM 0 HG22 VAL A 350 1.517 -2.823 -3.797 1.00 0.00 H new ATOM 0 HG23 VAL A 350 -0.180 -2.497 -3.374 1.00 0.00 H new ATOM 714 N TYR A 351 0.939 2.025 -2.957 1.00 0.00 N ATOM 715 CA TYR A 351 1.340 3.461 -2.948 1.00 0.00 C ATOM 716 C TYR A 351 1.927 3.819 -1.582 1.00 0.00 C ATOM 717 O TYR A 351 2.944 4.476 -1.484 1.00 0.00 O ATOM 718 CB TYR A 351 0.045 4.240 -3.202 1.00 0.00 C ATOM 719 CG TYR A 351 -0.314 4.204 -4.675 1.00 0.00 C ATOM 720 CD1 TYR A 351 0.482 3.498 -5.592 1.00 0.00 C ATOM 721 CD2 TYR A 351 -1.454 4.884 -5.122 1.00 0.00 C ATOM 722 CE1 TYR A 351 0.134 3.475 -6.948 1.00 0.00 C ATOM 723 CE2 TYR A 351 -1.799 4.859 -6.479 1.00 0.00 C ATOM 724 CZ TYR A 351 -1.006 4.155 -7.391 1.00 0.00 C ATOM 725 OH TYR A 351 -1.349 4.132 -8.729 1.00 0.00 O ATOM 0 H TYR A 351 -0.032 1.846 -3.211 1.00 0.00 H new ATOM 0 HA TYR A 351 2.098 3.690 -3.697 1.00 0.00 H new ATOM 0 HB2 TYR A 351 -0.766 3.812 -2.613 1.00 0.00 H new ATOM 0 HB3 TYR A 351 0.165 5.273 -2.876 1.00 0.00 H new ATOM 0 HD1 TYR A 351 1.362 2.973 -5.251 1.00 0.00 H new ATOM 0 HD2 TYR A 351 -2.068 5.428 -4.419 1.00 0.00 H new ATOM 0 HE1 TYR A 351 0.746 2.932 -7.653 1.00 0.00 H new ATOM 0 HE2 TYR A 351 -2.678 5.384 -6.822 1.00 0.00 H new ATOM 0 HH TYR A 351 -2.168 4.653 -8.866 1.00 0.00 H new ATOM 735 N GLU A 352 1.300 3.380 -0.524 1.00 0.00 N ATOM 736 CA GLU A 352 1.832 3.684 0.833 1.00 0.00 C ATOM 737 C GLU A 352 3.341 3.436 0.859 1.00 0.00 C ATOM 738 O GLU A 352 4.098 4.201 1.424 1.00 0.00 O ATOM 739 CB GLU A 352 1.107 2.717 1.771 1.00 0.00 C ATOM 740 CG GLU A 352 0.345 3.510 2.833 1.00 0.00 C ATOM 741 CD GLU A 352 1.276 4.545 3.464 1.00 0.00 C ATOM 742 OE1 GLU A 352 2.332 4.154 3.936 1.00 0.00 O ATOM 743 OE2 GLU A 352 0.920 5.712 3.465 1.00 0.00 O ATOM 0 H GLU A 352 0.444 2.825 -0.542 1.00 0.00 H new ATOM 0 HA GLU A 352 1.670 4.722 1.125 1.00 0.00 H new ATOM 0 HB2 GLU A 352 0.417 2.092 1.204 1.00 0.00 H new ATOM 0 HB3 GLU A 352 1.825 2.048 2.247 1.00 0.00 H new ATOM 0 HG2 GLU A 352 -0.516 4.006 2.384 1.00 0.00 H new ATOM 0 HG3 GLU A 352 -0.039 2.836 3.599 1.00 0.00 H new ATOM 750 N ASN A 353 3.782 2.370 0.248 1.00 0.00 N ATOM 751 CA ASN A 353 5.241 2.069 0.227 1.00 0.00 C ATOM 752 C ASN A 353 5.920 2.861 -0.894 1.00 0.00 C ATOM 753 O ASN A 353 7.122 3.037 -0.904 1.00 0.00 O ATOM 754 CB ASN A 353 5.330 0.568 -0.047 1.00 0.00 C ATOM 755 CG ASN A 353 5.633 -0.173 1.256 1.00 0.00 C ATOM 756 OD1 ASN A 353 4.771 -0.317 2.101 1.00 0.00 O ATOM 757 ND2 ASN A 353 6.830 -0.653 1.457 1.00 0.00 N ATOM 0 H ASN A 353 3.193 1.694 -0.238 1.00 0.00 H new ATOM 0 HA ASN A 353 5.737 2.342 1.159 1.00 0.00 H new ATOM 0 HB2 ASN A 353 4.393 0.209 -0.472 1.00 0.00 H new ATOM 0 HB3 ASN A 353 6.110 0.368 -0.781 1.00 0.00 H new ATOM 0 HD21 ASN A 353 7.042 -1.149 2.323 1.00 0.00 H new ATOM 0 HD22 ASN A 353 7.553 -0.532 0.748 1.00 0.00 H new ATOM 764 N TYR A 354 5.156 3.340 -1.839 1.00 0.00 N ATOM 765 CA TYR A 354 5.754 4.121 -2.961 1.00 0.00 C ATOM 766 C TYR A 354 4.968 5.417 -3.187 1.00 0.00 C ATOM 767 O TYR A 354 4.560 5.711 -4.293 1.00 0.00 O ATOM 768 CB TYR A 354 5.643 3.206 -4.179 1.00 0.00 C ATOM 769 CG TYR A 354 6.175 1.838 -3.828 1.00 0.00 C ATOM 770 CD1 TYR A 354 7.481 1.699 -3.343 1.00 0.00 C ATOM 771 CD2 TYR A 354 5.363 0.708 -3.988 1.00 0.00 C ATOM 772 CE1 TYR A 354 7.975 0.430 -3.017 1.00 0.00 C ATOM 773 CE2 TYR A 354 5.857 -0.561 -3.661 1.00 0.00 C ATOM 774 CZ TYR A 354 7.163 -0.700 -3.176 1.00 0.00 C ATOM 775 OH TYR A 354 7.649 -1.950 -2.854 1.00 0.00 O ATOM 0 H TYR A 354 4.144 3.224 -1.883 1.00 0.00 H new ATOM 0 HA TYR A 354 6.785 4.410 -2.759 1.00 0.00 H new ATOM 0 HB2 TYR A 354 4.604 3.133 -4.499 1.00 0.00 H new ATOM 0 HB3 TYR A 354 6.205 3.624 -5.014 1.00 0.00 H new ATOM 0 HD1 TYR A 354 8.107 2.570 -3.220 1.00 0.00 H new ATOM 0 HD2 TYR A 354 4.356 0.815 -4.363 1.00 0.00 H new ATOM 0 HE1 TYR A 354 8.982 0.323 -2.643 1.00 0.00 H new ATOM 0 HE2 TYR A 354 5.231 -1.432 -3.783 1.00 0.00 H new ATOM 0 HH TYR A 354 8.610 -1.890 -2.669 1.00 0.00 H new ATOM 785 N PRO A 355 4.782 6.146 -2.120 1.00 0.00 N ATOM 786 CA PRO A 355 4.036 7.425 -2.191 1.00 0.00 C ATOM 787 C PRO A 355 4.900 8.521 -2.826 1.00 0.00 C ATOM 788 O PRO A 355 4.475 9.212 -3.730 1.00 0.00 O ATOM 789 CB PRO A 355 3.741 7.746 -0.729 1.00 0.00 C ATOM 790 CG PRO A 355 4.804 7.039 0.052 1.00 0.00 C ATOM 791 CD PRO A 355 5.245 5.849 -0.762 1.00 0.00 C ATOM 0 HA PRO A 355 3.135 7.361 -2.802 1.00 0.00 H new ATOM 0 HB2 PRO A 355 3.769 8.821 -0.549 1.00 0.00 H new ATOM 0 HB3 PRO A 355 2.747 7.401 -0.443 1.00 0.00 H new ATOM 0 HG2 PRO A 355 5.645 7.705 0.245 1.00 0.00 H new ATOM 0 HG3 PRO A 355 4.420 6.720 1.021 1.00 0.00 H new ATOM 0 HD2 PRO A 355 6.327 5.724 -0.729 1.00 0.00 H new ATOM 0 HD3 PRO A 355 4.806 4.925 -0.385 1.00 0.00 H new ATOM 799 N THR A 356 6.106 8.689 -2.356 1.00 0.00 N ATOM 800 CA THR A 356 6.990 9.745 -2.930 1.00 0.00 C ATOM 801 C THR A 356 7.305 9.442 -4.398 1.00 0.00 C ATOM 802 O THR A 356 7.406 10.335 -5.216 1.00 0.00 O ATOM 803 CB THR A 356 8.266 9.697 -2.089 1.00 0.00 C ATOM 804 OG1 THR A 356 8.540 8.352 -1.724 1.00 0.00 O ATOM 805 CG2 THR A 356 8.082 10.543 -0.829 1.00 0.00 C ATOM 0 H THR A 356 6.518 8.142 -1.600 1.00 0.00 H new ATOM 0 HA THR A 356 6.520 10.728 -2.905 1.00 0.00 H new ATOM 0 HB THR A 356 9.099 10.093 -2.670 1.00 0.00 H new ATOM 0 HG1 THR A 356 9.258 7.999 -2.290 1.00 0.00 H new ATOM 0 HG21 THR A 356 8.992 10.508 -0.231 1.00 0.00 H new ATOM 0 HG22 THR A 356 7.873 11.575 -1.111 1.00 0.00 H new ATOM 0 HG23 THR A 356 7.249 10.150 -0.246 1.00 0.00 H new ATOM 813 N TYR A 357 7.464 8.193 -4.739 1.00 0.00 N ATOM 814 CA TYR A 357 7.775 7.845 -6.157 1.00 0.00 C ATOM 815 C TYR A 357 6.508 7.923 -7.011 1.00 0.00 C ATOM 816 O TYR A 357 5.416 7.663 -6.546 1.00 0.00 O ATOM 817 CB TYR A 357 8.305 6.410 -6.111 1.00 0.00 C ATOM 818 CG TYR A 357 9.287 6.269 -4.973 1.00 0.00 C ATOM 819 CD1 TYR A 357 10.207 7.291 -4.712 1.00 0.00 C ATOM 820 CD2 TYR A 357 9.276 5.117 -4.177 1.00 0.00 C ATOM 821 CE1 TYR A 357 11.116 7.162 -3.655 1.00 0.00 C ATOM 822 CE2 TYR A 357 10.185 4.988 -3.119 1.00 0.00 C ATOM 823 CZ TYR A 357 11.105 6.010 -2.858 1.00 0.00 C ATOM 824 OH TYR A 357 12.000 5.884 -1.815 1.00 0.00 O ATOM 0 H TYR A 357 7.393 7.400 -4.101 1.00 0.00 H new ATOM 0 HA TYR A 357 8.498 8.530 -6.599 1.00 0.00 H new ATOM 0 HB2 TYR A 357 7.479 5.711 -5.981 1.00 0.00 H new ATOM 0 HB3 TYR A 357 8.789 6.160 -7.055 1.00 0.00 H new ATOM 0 HD1 TYR A 357 10.216 8.179 -5.326 1.00 0.00 H new ATOM 0 HD2 TYR A 357 8.567 4.328 -4.379 1.00 0.00 H new ATOM 0 HE1 TYR A 357 11.826 7.951 -3.454 1.00 0.00 H new ATOM 0 HE2 TYR A 357 10.176 4.100 -2.505 1.00 0.00 H new ATOM 0 HH TYR A 357 11.857 5.026 -1.363 1.00 0.00 H new ATOM 834 N ASP A 358 6.646 8.271 -8.261 1.00 0.00 N ATOM 835 CA ASP A 358 5.453 8.358 -9.149 1.00 0.00 C ATOM 836 C ASP A 358 5.263 7.031 -9.883 1.00 0.00 C ATOM 837 O ASP A 358 5.163 6.983 -11.093 1.00 0.00 O ATOM 838 CB ASP A 358 5.771 9.483 -10.136 1.00 0.00 C ATOM 839 CG ASP A 358 4.528 9.798 -10.971 1.00 0.00 C ATOM 840 OD1 ASP A 358 3.574 9.043 -10.886 1.00 0.00 O ATOM 841 OD2 ASP A 358 4.552 10.790 -11.682 1.00 0.00 O ATOM 0 H ASP A 358 7.535 8.499 -8.706 1.00 0.00 H new ATOM 0 HA ASP A 358 4.533 8.557 -8.599 1.00 0.00 H new ATOM 0 HB2 ASP A 358 6.095 10.373 -9.597 1.00 0.00 H new ATOM 0 HB3 ASP A 358 6.594 9.188 -10.787 1.00 0.00 H new ATOM 846 N LEU A 359 5.223 5.952 -9.150 1.00 0.00 N ATOM 847 CA LEU A 359 5.050 4.613 -9.779 1.00 0.00 C ATOM 848 C LEU A 359 4.054 4.682 -10.939 1.00 0.00 C ATOM 849 O LEU A 359 2.870 4.870 -10.746 1.00 0.00 O ATOM 850 CB LEU A 359 4.499 3.730 -8.664 1.00 0.00 C ATOM 851 CG LEU A 359 5.408 2.516 -8.471 1.00 0.00 C ATOM 852 CD1 LEU A 359 5.649 1.838 -9.819 1.00 0.00 C ATOM 853 CD2 LEU A 359 6.746 2.969 -7.881 1.00 0.00 C ATOM 0 H LEU A 359 5.304 5.942 -8.133 1.00 0.00 H new ATOM 0 HA LEU A 359 5.984 4.232 -10.191 1.00 0.00 H new ATOM 0 HB2 LEU A 359 4.433 4.298 -7.736 1.00 0.00 H new ATOM 0 HB3 LEU A 359 3.489 3.404 -8.911 1.00 0.00 H new ATOM 0 HG LEU A 359 4.931 1.810 -7.791 1.00 0.00 H new ATOM 0 HD11 LEU A 359 6.297 0.973 -9.680 1.00 0.00 H new ATOM 0 HD12 LEU A 359 4.697 1.514 -10.239 1.00 0.00 H new ATOM 0 HD13 LEU A 359 6.125 2.543 -10.501 1.00 0.00 H new ATOM 0 HD21 LEU A 359 7.394 2.104 -7.743 1.00 0.00 H new ATOM 0 HD22 LEU A 359 7.223 3.675 -8.561 1.00 0.00 H new ATOM 0 HD23 LEU A 359 6.575 3.451 -6.918 1.00 0.00 H new ATOM 865 N THR A 360 4.529 4.521 -12.142 1.00 0.00 N ATOM 866 CA THR A 360 3.615 4.566 -13.319 1.00 0.00 C ATOM 867 C THR A 360 3.664 3.225 -14.054 1.00 0.00 C ATOM 868 O THR A 360 2.674 2.526 -14.165 1.00 0.00 O ATOM 869 CB THR A 360 4.158 5.687 -14.210 1.00 0.00 C ATOM 870 OG1 THR A 360 5.402 6.145 -13.697 1.00 0.00 O ATOM 871 CG2 THR A 360 3.159 6.844 -14.238 1.00 0.00 C ATOM 0 H THR A 360 5.512 4.360 -12.362 1.00 0.00 H new ATOM 0 HA THR A 360 2.578 4.747 -13.036 1.00 0.00 H new ATOM 0 HB THR A 360 4.303 5.307 -15.221 1.00 0.00 H new ATOM 0 HG1 THR A 360 5.260 6.569 -12.825 1.00 0.00 H new ATOM 0 HG21 THR A 360 3.545 7.642 -14.872 1.00 0.00 H new ATOM 0 HG22 THR A 360 2.207 6.493 -14.636 1.00 0.00 H new ATOM 0 HG23 THR A 360 3.012 7.223 -13.226 1.00 0.00 H new ATOM 879 N GLU A 361 4.814 2.859 -14.547 1.00 0.00 N ATOM 880 CA GLU A 361 4.936 1.559 -15.266 1.00 0.00 C ATOM 881 C GLU A 361 4.770 0.409 -14.273 1.00 0.00 C ATOM 882 O GLU A 361 3.881 -0.411 -14.400 1.00 0.00 O ATOM 883 CB GLU A 361 6.344 1.562 -15.860 1.00 0.00 C ATOM 884 CG GLU A 361 6.454 2.673 -16.907 1.00 0.00 C ATOM 885 CD GLU A 361 7.405 2.231 -18.022 1.00 0.00 C ATOM 886 OE1 GLU A 361 7.781 1.072 -18.028 1.00 0.00 O ATOM 887 OE2 GLU A 361 7.738 3.062 -18.851 1.00 0.00 O ATOM 0 H GLU A 361 5.675 3.403 -14.484 1.00 0.00 H new ATOM 0 HA GLU A 361 4.177 1.433 -16.038 1.00 0.00 H new ATOM 0 HB2 GLU A 361 7.082 1.715 -15.073 1.00 0.00 H new ATOM 0 HB3 GLU A 361 6.560 0.596 -16.316 1.00 0.00 H new ATOM 0 HG2 GLU A 361 5.471 2.896 -17.321 1.00 0.00 H new ATOM 0 HG3 GLU A 361 6.820 3.589 -16.444 1.00 0.00 H new ATOM 894 N ARG A 362 5.610 0.350 -13.276 1.00 0.00 N ATOM 895 CA ARG A 362 5.486 -0.739 -12.268 1.00 0.00 C ATOM 896 C ARG A 362 4.130 -0.632 -11.571 1.00 0.00 C ATOM 897 O ARG A 362 3.563 -1.614 -11.135 1.00 0.00 O ATOM 898 CB ARG A 362 6.626 -0.504 -11.276 1.00 0.00 C ATOM 899 CG ARG A 362 7.801 -1.420 -11.623 1.00 0.00 C ATOM 900 CD ARG A 362 9.115 -0.716 -11.284 1.00 0.00 C ATOM 901 NE ARG A 362 9.617 -0.196 -12.587 1.00 0.00 N ATOM 902 CZ ARG A 362 10.728 0.483 -12.633 1.00 0.00 C ATOM 903 NH1 ARG A 362 11.847 -0.067 -12.243 1.00 0.00 N ATOM 904 NH2 ARG A 362 10.722 1.713 -13.069 1.00 0.00 N ATOM 0 H ARG A 362 6.374 1.007 -13.117 1.00 0.00 H new ATOM 0 HA ARG A 362 5.547 -1.732 -12.713 1.00 0.00 H new ATOM 0 HB2 ARG A 362 6.942 0.539 -11.309 1.00 0.00 H new ATOM 0 HB3 ARG A 362 6.285 -0.702 -10.260 1.00 0.00 H new ATOM 0 HG2 ARG A 362 7.723 -2.355 -11.068 1.00 0.00 H new ATOM 0 HG3 ARG A 362 7.776 -1.676 -12.682 1.00 0.00 H new ATOM 0 HD2 ARG A 362 8.958 0.092 -10.570 1.00 0.00 H new ATOM 0 HD3 ARG A 362 9.828 -1.406 -10.832 1.00 0.00 H new ATOM 0 HE ARG A 362 9.091 -0.372 -13.443 1.00 0.00 H new ATOM 0 HH11 ARG A 362 11.851 -1.028 -11.902 1.00 0.00 H new ATOM 0 HH12 ARG A 362 12.717 0.465 -12.279 1.00 0.00 H new ATOM 0 HH21 ARG A 362 9.848 2.142 -13.373 1.00 0.00 H new ATOM 0 HH22 ARG A 362 11.591 2.245 -13.105 1.00 0.00 H new ATOM 918 N LYS A 363 3.596 0.557 -11.479 1.00 0.00 N ATOM 919 CA LYS A 363 2.269 0.727 -10.828 1.00 0.00 C ATOM 920 C LYS A 363 1.262 -0.206 -11.497 1.00 0.00 C ATOM 921 O LYS A 363 0.664 -1.054 -10.860 1.00 0.00 O ATOM 922 CB LYS A 363 1.893 2.189 -11.067 1.00 0.00 C ATOM 923 CG LYS A 363 0.408 2.394 -10.758 1.00 0.00 C ATOM 924 CD LYS A 363 -0.348 2.676 -12.059 1.00 0.00 C ATOM 925 CE LYS A 363 -1.625 3.461 -11.750 1.00 0.00 C ATOM 926 NZ LYS A 363 -1.222 4.893 -11.828 1.00 0.00 N ATOM 0 H LYS A 363 4.023 1.416 -11.827 1.00 0.00 H new ATOM 0 HA LYS A 363 2.283 0.489 -9.764 1.00 0.00 H new ATOM 0 HB2 LYS A 363 2.499 2.839 -10.436 1.00 0.00 H new ATOM 0 HB3 LYS A 363 2.101 2.464 -12.101 1.00 0.00 H new ATOM 0 HG2 LYS A 363 0.000 1.507 -10.273 1.00 0.00 H new ATOM 0 HG3 LYS A 363 0.281 3.224 -10.063 1.00 0.00 H new ATOM 0 HD2 LYS A 363 0.283 3.243 -12.743 1.00 0.00 H new ATOM 0 HD3 LYS A 363 -0.596 1.739 -12.558 1.00 0.00 H new ATOM 0 HE2 LYS A 363 -2.413 3.232 -12.468 1.00 0.00 H new ATOM 0 HE3 LYS A 363 -2.012 3.213 -10.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 363 -2.045 5.497 -11.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 363 -0.476 5.082 -11.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 363 -0.864 5.101 -12.782 1.00 0.00 H new ATOM 940 N ASP A 364 1.083 -0.072 -12.783 1.00 0.00 N ATOM 941 CA ASP A 364 0.129 -0.969 -13.489 1.00 0.00 C ATOM 942 C ASP A 364 0.544 -2.422 -13.254 1.00 0.00 C ATOM 943 O ASP A 364 -0.281 -3.309 -13.159 1.00 0.00 O ATOM 944 CB ASP A 364 0.247 -0.601 -14.969 1.00 0.00 C ATOM 945 CG ASP A 364 -0.568 0.662 -15.249 1.00 0.00 C ATOM 946 OD1 ASP A 364 -0.030 1.742 -15.071 1.00 0.00 O ATOM 947 OD2 ASP A 364 -1.718 0.528 -15.635 1.00 0.00 O ATOM 0 H ASP A 364 1.554 0.616 -13.371 1.00 0.00 H new ATOM 0 HA ASP A 364 -0.897 -0.859 -13.137 1.00 0.00 H new ATOM 0 HB2 ASP A 364 1.292 -0.437 -15.231 1.00 0.00 H new ATOM 0 HB3 ASP A 364 -0.112 -1.423 -15.588 1.00 0.00 H new ATOM 952 N PHE A 365 1.823 -2.664 -13.144 1.00 0.00 N ATOM 953 CA PHE A 365 2.305 -4.052 -12.896 1.00 0.00 C ATOM 954 C PHE A 365 1.810 -4.521 -11.523 1.00 0.00 C ATOM 955 O PHE A 365 1.428 -5.660 -11.343 1.00 0.00 O ATOM 956 CB PHE A 365 3.838 -3.941 -12.943 1.00 0.00 C ATOM 957 CG PHE A 365 4.477 -4.930 -11.991 1.00 0.00 C ATOM 958 CD1 PHE A 365 4.294 -6.306 -12.178 1.00 0.00 C ATOM 959 CD2 PHE A 365 5.255 -4.467 -10.923 1.00 0.00 C ATOM 960 CE1 PHE A 365 4.888 -7.217 -11.296 1.00 0.00 C ATOM 961 CE2 PHE A 365 5.849 -5.378 -10.042 1.00 0.00 C ATOM 962 CZ PHE A 365 5.666 -6.752 -10.228 1.00 0.00 C ATOM 0 H PHE A 365 2.556 -1.958 -13.216 1.00 0.00 H new ATOM 0 HA PHE A 365 1.940 -4.778 -13.623 1.00 0.00 H new ATOM 0 HB2 PHE A 365 4.190 -4.127 -13.958 1.00 0.00 H new ATOM 0 HB3 PHE A 365 4.142 -2.928 -12.680 1.00 0.00 H new ATOM 0 HD1 PHE A 365 3.695 -6.664 -13.002 1.00 0.00 H new ATOM 0 HD2 PHE A 365 5.397 -3.406 -10.779 1.00 0.00 H new ATOM 0 HE1 PHE A 365 4.746 -8.278 -11.439 1.00 0.00 H new ATOM 0 HE2 PHE A 365 6.449 -5.020 -9.218 1.00 0.00 H new ATOM 0 HZ PHE A 365 6.125 -7.455 -9.548 1.00 0.00 H new ATOM 972 N ILE A 366 1.807 -3.643 -10.555 1.00 0.00 N ATOM 973 CA ILE A 366 1.330 -4.029 -9.197 1.00 0.00 C ATOM 974 C ILE A 366 -0.112 -4.536 -9.278 1.00 0.00 C ATOM 975 O ILE A 366 -0.406 -5.665 -8.935 1.00 0.00 O ATOM 976 CB ILE A 366 1.395 -2.742 -8.376 1.00 0.00 C ATOM 977 CG1 ILE A 366 2.856 -2.338 -8.166 1.00 0.00 C ATOM 978 CG2 ILE A 366 0.727 -2.968 -7.018 1.00 0.00 C ATOM 979 CD1 ILE A 366 3.603 -3.464 -7.448 1.00 0.00 C ATOM 0 H ILE A 366 2.115 -2.675 -10.647 1.00 0.00 H new ATOM 0 HA ILE A 366 1.929 -4.825 -8.756 1.00 0.00 H new ATOM 0 HB ILE A 366 0.874 -1.947 -8.910 1.00 0.00 H new ATOM 0 HG12 ILE A 366 3.328 -2.130 -9.126 1.00 0.00 H new ATOM 0 HG13 ILE A 366 2.909 -1.421 -7.579 1.00 0.00 H new ATOM 0 HG21 ILE A 366 0.773 -2.050 -6.432 1.00 0.00 H new ATOM 0 HG22 ILE A 366 -0.315 -3.251 -7.168 1.00 0.00 H new ATOM 0 HG23 ILE A 366 1.246 -3.765 -6.485 1.00 0.00 H new ATOM 0 HD11 ILE A 366 4.643 -3.174 -7.300 1.00 0.00 H new ATOM 0 HD12 ILE A 366 3.137 -3.651 -6.481 1.00 0.00 H new ATOM 0 HD13 ILE A 366 3.562 -4.371 -8.052 1.00 0.00 H new ATOM 991 N LYS A 367 -1.011 -3.707 -9.732 1.00 0.00 N ATOM 992 CA LYS A 367 -2.435 -4.134 -9.841 1.00 0.00 C ATOM 993 C LYS A 367 -2.530 -5.492 -10.541 1.00 0.00 C ATOM 994 O LYS A 367 -3.276 -6.360 -10.134 1.00 0.00 O ATOM 995 CB LYS A 367 -3.110 -3.046 -10.678 1.00 0.00 C ATOM 996 CG LYS A 367 -4.478 -3.540 -11.153 1.00 0.00 C ATOM 997 CD LYS A 367 -4.458 -3.716 -12.672 1.00 0.00 C ATOM 998 CE LYS A 367 -4.164 -2.369 -13.342 1.00 0.00 C ATOM 999 NZ LYS A 367 -5.485 -1.681 -13.443 1.00 0.00 N ATOM 0 H LYS A 367 -0.821 -2.751 -10.033 1.00 0.00 H new ATOM 0 HA LYS A 367 -2.908 -4.250 -8.866 1.00 0.00 H new ATOM 0 HB2 LYS A 367 -3.225 -2.137 -10.087 1.00 0.00 H new ATOM 0 HB3 LYS A 367 -2.486 -2.792 -11.535 1.00 0.00 H new ATOM 0 HG2 LYS A 367 -4.723 -4.486 -10.670 1.00 0.00 H new ATOM 0 HG3 LYS A 367 -5.252 -2.827 -10.869 1.00 0.00 H new ATOM 0 HD2 LYS A 367 -3.700 -4.447 -12.954 1.00 0.00 H new ATOM 0 HD3 LYS A 367 -5.417 -4.103 -13.016 1.00 0.00 H new ATOM 0 HE2 LYS A 367 -3.459 -1.782 -12.753 1.00 0.00 H new ATOM 0 HE3 LYS A 367 -3.717 -2.509 -14.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 367 -5.362 -0.759 -13.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 367 -6.139 -2.266 -14.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 367 -5.876 -1.538 -12.490 1.00 0.00 H new ATOM 1013 N THR A 368 -1.786 -5.680 -11.596 1.00 0.00 N ATOM 1014 CA THR A 368 -1.838 -6.981 -12.324 1.00 0.00 C ATOM 1015 C THR A 368 -1.142 -8.079 -11.513 1.00 0.00 C ATOM 1016 O THR A 368 -1.438 -9.249 -11.656 1.00 0.00 O ATOM 1017 CB THR A 368 -1.092 -6.731 -13.637 1.00 0.00 C ATOM 1018 OG1 THR A 368 -0.080 -5.756 -13.428 1.00 0.00 O ATOM 1019 CG2 THR A 368 -2.074 -6.232 -14.697 1.00 0.00 C ATOM 0 H THR A 368 -1.144 -4.990 -11.986 1.00 0.00 H new ATOM 0 HA THR A 368 -2.862 -7.315 -12.491 1.00 0.00 H new ATOM 0 HB THR A 368 -0.635 -7.660 -13.978 1.00 0.00 H new ATOM 0 HG1 THR A 368 -0.411 -4.876 -13.706 1.00 0.00 H new ATOM 0 HG21 THR A 368 -1.542 -6.054 -15.631 1.00 0.00 H new ATOM 0 HG22 THR A 368 -2.848 -6.982 -14.858 1.00 0.00 H new ATOM 0 HG23 THR A 368 -2.533 -5.303 -14.359 1.00 0.00 H new ATOM 1027 N THR A 369 -0.220 -7.715 -10.663 1.00 0.00 N ATOM 1028 CA THR A 369 0.489 -8.747 -9.852 1.00 0.00 C ATOM 1029 C THR A 369 -0.509 -9.487 -8.955 1.00 0.00 C ATOM 1030 O THR A 369 -0.521 -10.701 -8.891 1.00 0.00 O ATOM 1031 CB THR A 369 1.534 -7.960 -9.034 1.00 0.00 C ATOM 1032 OG1 THR A 369 2.764 -8.668 -9.048 1.00 0.00 O ATOM 1033 CG2 THR A 369 1.077 -7.773 -7.580 1.00 0.00 C ATOM 0 H THR A 369 0.072 -6.752 -10.495 1.00 0.00 H new ATOM 0 HA THR A 369 0.968 -9.513 -10.462 1.00 0.00 H new ATOM 0 HB THR A 369 1.654 -6.975 -9.486 1.00 0.00 H new ATOM 0 HG1 THR A 369 3.373 -8.253 -9.694 1.00 0.00 H new ATOM 0 HG21 THR A 369 1.834 -7.215 -7.029 1.00 0.00 H new ATOM 0 HG22 THR A 369 0.136 -7.223 -7.562 1.00 0.00 H new ATOM 0 HG23 THR A 369 0.935 -8.749 -7.115 1.00 0.00 H new ATOM 1041 N VAL A 370 -1.349 -8.767 -8.268 1.00 0.00 N ATOM 1042 CA VAL A 370 -2.345 -9.430 -7.383 1.00 0.00 C ATOM 1043 C VAL A 370 -3.450 -10.068 -8.230 1.00 0.00 C ATOM 1044 O VAL A 370 -3.706 -11.252 -8.142 1.00 0.00 O ATOM 1045 CB VAL A 370 -2.908 -8.310 -6.512 1.00 0.00 C ATOM 1046 CG1 VAL A 370 -3.959 -8.883 -5.560 1.00 0.00 C ATOM 1047 CG2 VAL A 370 -1.773 -7.680 -5.700 1.00 0.00 C ATOM 0 H VAL A 370 -1.389 -7.748 -8.281 1.00 0.00 H new ATOM 0 HA VAL A 370 -1.906 -10.225 -6.781 1.00 0.00 H new ATOM 0 HB VAL A 370 -3.368 -7.552 -7.145 1.00 0.00 H new ATOM 0 HG11 VAL A 370 -4.361 -8.083 -4.938 1.00 0.00 H new ATOM 0 HG12 VAL A 370 -4.766 -9.334 -6.138 1.00 0.00 H new ATOM 0 HG13 VAL A 370 -3.500 -9.641 -4.925 1.00 0.00 H new ATOM 0 HG21 VAL A 370 -2.172 -6.880 -5.077 1.00 0.00 H new ATOM 0 HG22 VAL A 370 -1.314 -8.439 -5.066 1.00 0.00 H new ATOM 0 HG23 VAL A 370 -1.023 -7.272 -6.378 1.00 0.00 H new ATOM 1057 N LYS A 371 -4.100 -9.296 -9.056 1.00 0.00 N ATOM 1058 CA LYS A 371 -5.179 -9.865 -9.911 1.00 0.00 C ATOM 1059 C LYS A 371 -4.682 -11.144 -10.590 1.00 0.00 C ATOM 1060 O LYS A 371 -5.426 -12.085 -10.791 1.00 0.00 O ATOM 1061 CB LYS A 371 -5.474 -8.783 -10.951 1.00 0.00 C ATOM 1062 CG LYS A 371 -6.928 -8.901 -11.413 1.00 0.00 C ATOM 1063 CD LYS A 371 -7.113 -8.127 -12.719 1.00 0.00 C ATOM 1064 CE LYS A 371 -7.733 -6.760 -12.419 1.00 0.00 C ATOM 1065 NZ LYS A 371 -9.199 -6.958 -12.588 1.00 0.00 N ATOM 0 H LYS A 371 -3.931 -8.297 -9.176 1.00 0.00 H new ATOM 0 HA LYS A 371 -6.069 -10.129 -9.340 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.296 -7.796 -10.525 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.801 -8.889 -11.802 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -7.190 -9.949 -11.559 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -7.597 -8.508 -10.647 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.152 -8.001 -13.218 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -7.754 -8.688 -13.399 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -7.493 -6.431 -11.408 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -7.356 -5.997 -13.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -9.694 -6.063 -12.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -9.398 -7.265 -13.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -9.530 -7.685 -11.922 1.00 0.00 H new ATOM 1079 N GLU A 372 -3.422 -11.189 -10.933 1.00 0.00 N ATOM 1080 CA GLU A 372 -2.874 -12.410 -11.588 1.00 0.00 C ATOM 1081 C GLU A 372 -2.808 -13.549 -10.571 1.00 0.00 C ATOM 1082 O GLU A 372 -3.094 -14.689 -10.879 1.00 0.00 O ATOM 1083 CB GLU A 372 -1.470 -12.020 -12.052 1.00 0.00 C ATOM 1084 CG GLU A 372 -0.703 -13.277 -12.469 1.00 0.00 C ATOM 1085 CD GLU A 372 0.091 -12.992 -13.745 1.00 0.00 C ATOM 1086 OE1 GLU A 372 -0.528 -12.669 -14.746 1.00 0.00 O ATOM 1087 OE2 GLU A 372 1.305 -13.101 -13.699 1.00 0.00 O ATOM 0 H GLU A 372 -2.751 -10.435 -10.788 1.00 0.00 H new ATOM 0 HA GLU A 372 -3.490 -12.752 -12.420 1.00 0.00 H new ATOM 0 HB2 GLU A 372 -1.532 -11.325 -12.889 1.00 0.00 H new ATOM 0 HB3 GLU A 372 -0.940 -11.507 -11.250 1.00 0.00 H new ATOM 0 HG2 GLU A 372 -0.029 -13.586 -11.670 1.00 0.00 H new ATOM 0 HG3 GLU A 372 -1.397 -14.100 -12.637 1.00 0.00 H new ATOM 1094 N LEU A 373 -2.450 -13.242 -9.356 1.00 0.00 N ATOM 1095 CA LEU A 373 -2.383 -14.297 -8.311 1.00 0.00 C ATOM 1096 C LEU A 373 -3.809 -14.656 -7.884 1.00 0.00 C ATOM 1097 O LEU A 373 -4.058 -15.702 -7.320 1.00 0.00 O ATOM 1098 CB LEU A 373 -1.579 -13.658 -7.165 1.00 0.00 C ATOM 1099 CG LEU A 373 -2.165 -14.049 -5.803 1.00 0.00 C ATOM 1100 CD1 LEU A 373 -1.119 -13.817 -4.712 1.00 0.00 C ATOM 1101 CD2 LEU A 373 -3.399 -13.189 -5.521 1.00 0.00 C ATOM 0 H LEU A 373 -2.201 -12.304 -9.042 1.00 0.00 H new ATOM 0 HA LEU A 373 -1.912 -15.222 -8.644 1.00 0.00 H new ATOM 0 HB2 LEU A 373 -0.538 -13.977 -7.223 1.00 0.00 H new ATOM 0 HB3 LEU A 373 -1.586 -12.573 -7.271 1.00 0.00 H new ATOM 0 HG LEU A 373 -2.447 -15.102 -5.813 1.00 0.00 H new ATOM 0 HD11 LEU A 373 -1.535 -14.095 -3.744 1.00 0.00 H new ATOM 0 HD12 LEU A 373 -0.239 -14.426 -4.917 1.00 0.00 H new ATOM 0 HD13 LEU A 373 -0.836 -12.764 -4.697 1.00 0.00 H new ATOM 0 HD21 LEU A 373 -3.820 -13.463 -4.554 1.00 0.00 H new ATOM 0 HD22 LEU A 373 -3.114 -12.137 -5.508 1.00 0.00 H new ATOM 0 HD23 LEU A 373 -4.143 -13.354 -6.300 1.00 0.00 H new ATOM 1113 N ILE A 374 -4.746 -13.791 -8.160 1.00 0.00 N ATOM 1114 CA ILE A 374 -6.155 -14.075 -7.782 1.00 0.00 C ATOM 1115 C ILE A 374 -6.728 -15.158 -8.697 1.00 0.00 C ATOM 1116 O ILE A 374 -7.535 -15.969 -8.289 1.00 0.00 O ATOM 1117 CB ILE A 374 -6.895 -12.753 -7.982 1.00 0.00 C ATOM 1118 CG1 ILE A 374 -6.485 -11.768 -6.884 1.00 0.00 C ATOM 1119 CG2 ILE A 374 -8.404 -12.996 -7.909 1.00 0.00 C ATOM 1120 CD1 ILE A 374 -7.306 -10.483 -7.016 1.00 0.00 C ATOM 0 H ILE A 374 -4.594 -12.899 -8.632 1.00 0.00 H new ATOM 0 HA ILE A 374 -6.248 -14.437 -6.758 1.00 0.00 H new ATOM 0 HB ILE A 374 -6.640 -12.339 -8.957 1.00 0.00 H new ATOM 0 HG12 ILE A 374 -6.645 -12.214 -5.903 1.00 0.00 H new ATOM 0 HG13 ILE A 374 -5.422 -11.542 -6.962 1.00 0.00 H new ATOM 0 HG21 ILE A 374 -8.932 -12.053 -8.052 1.00 0.00 H new ATOM 0 HG22 ILE A 374 -8.698 -13.698 -8.690 1.00 0.00 H new ATOM 0 HG23 ILE A 374 -8.659 -13.411 -6.934 1.00 0.00 H new ATOM 0 HD11 ILE A 374 -7.013 -9.782 -6.234 1.00 0.00 H new ATOM 0 HD12 ILE A 374 -7.124 -10.034 -7.992 1.00 0.00 H new ATOM 0 HD13 ILE A 374 -8.366 -10.717 -6.916 1.00 0.00 H new ATOM 1132 N SER A 375 -6.311 -15.178 -9.934 1.00 0.00 N ATOM 1133 CA SER A 375 -6.826 -16.209 -10.880 1.00 0.00 C ATOM 1134 C SER A 375 -5.844 -17.381 -10.968 1.00 0.00 C ATOM 1135 O SER A 375 -6.236 -18.524 -11.097 1.00 0.00 O ATOM 1136 CB SER A 375 -6.929 -15.495 -12.226 1.00 0.00 C ATOM 1137 OG SER A 375 -8.166 -14.796 -12.294 1.00 0.00 O ATOM 0 H SER A 375 -5.636 -14.525 -10.331 1.00 0.00 H new ATOM 0 HA SER A 375 -7.784 -16.620 -10.563 1.00 0.00 H new ATOM 0 HB2 SER A 375 -6.098 -14.800 -12.346 1.00 0.00 H new ATOM 0 HB3 SER A 375 -6.861 -16.217 -13.040 1.00 0.00 H new ATOM 0 HG SER A 375 -8.234 -14.335 -13.156 1.00 0.00 H new ATOM 1143 N LEU A 376 -4.569 -17.106 -10.898 1.00 0.00 N ATOM 1144 CA LEU A 376 -3.564 -18.204 -10.977 1.00 0.00 C ATOM 1145 C LEU A 376 -3.227 -18.712 -9.572 1.00 0.00 C ATOM 1146 O LEU A 376 -2.868 -19.858 -9.386 1.00 0.00 O ATOM 1147 CB LEU A 376 -2.332 -17.571 -11.626 1.00 0.00 C ATOM 1148 CG LEU A 376 -1.996 -18.316 -12.919 1.00 0.00 C ATOM 1149 CD1 LEU A 376 -0.828 -17.619 -13.622 1.00 0.00 C ATOM 1150 CD2 LEU A 376 -1.602 -19.757 -12.588 1.00 0.00 C ATOM 0 H LEU A 376 -4.181 -16.169 -10.790 1.00 0.00 H new ATOM 0 HA LEU A 376 -3.930 -19.058 -11.547 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -2.520 -16.519 -11.839 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -1.486 -17.611 -10.940 1.00 0.00 H new ATOM 0 HG LEU A 376 -2.867 -18.317 -13.574 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -0.589 -18.150 -14.543 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -1.106 -16.591 -13.857 1.00 0.00 H new ATOM 0 HD13 LEU A 376 0.043 -17.619 -12.967 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -1.362 -20.289 -13.509 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -0.731 -19.755 -11.933 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -2.432 -20.255 -12.087 1.00 0.00 H new ATOM 1162 N GLU A 377 -3.341 -17.868 -8.582 1.00 0.00 N ATOM 1163 CA GLU A 377 -3.028 -18.304 -7.191 1.00 0.00 C ATOM 1164 C GLU A 377 -4.251 -18.116 -6.289 1.00 0.00 C ATOM 1165 O GLU A 377 -4.129 -17.892 -5.101 1.00 0.00 O ATOM 1166 CB GLU A 377 -1.883 -17.396 -6.740 1.00 0.00 C ATOM 1167 CG GLU A 377 -0.595 -18.215 -6.632 1.00 0.00 C ATOM 1168 CD GLU A 377 -0.299 -18.511 -5.160 1.00 0.00 C ATOM 1169 OE1 GLU A 377 0.030 -17.579 -4.443 1.00 0.00 O ATOM 1170 OE2 GLU A 377 -0.406 -19.663 -4.775 1.00 0.00 O ATOM 0 H GLU A 377 -3.637 -16.896 -8.676 1.00 0.00 H new ATOM 0 HA GLU A 377 -2.756 -19.358 -7.140 1.00 0.00 H new ATOM 0 HB2 GLU A 377 -1.750 -16.581 -7.451 1.00 0.00 H new ATOM 0 HB3 GLU A 377 -2.121 -16.944 -5.777 1.00 0.00 H new ATOM 0 HG2 GLU A 377 -0.697 -19.147 -7.188 1.00 0.00 H new ATOM 0 HG3 GLU A 377 0.235 -17.667 -7.078 1.00 0.00 H new ATOM 1177 N HIS A 378 -5.429 -18.206 -6.842 1.00 0.00 N ATOM 1178 CA HIS A 378 -6.657 -18.031 -6.014 1.00 0.00 C ATOM 1179 C HIS A 378 -6.507 -18.782 -4.687 1.00 0.00 C ATOM 1180 O HIS A 378 -7.102 -18.349 -3.713 1.00 0.00 O ATOM 1181 CB HIS A 378 -7.788 -18.635 -6.847 1.00 0.00 C ATOM 1182 CG HIS A 378 -7.362 -19.979 -7.371 1.00 0.00 C ATOM 1183 ND1 HIS A 378 -6.627 -20.343 -8.472 1.00 0.00 N flip ATOM 1184 CD2 HIS A 378 -7.700 -21.162 -6.732 1.00 0.00 C flip ATOM 1185 CE1 HIS A 378 -6.508 -21.730 -8.517 1.00 0.00 C flip ATOM 1186 NE2 HIS A 378 -7.173 -22.173 -7.446 1.00 0.00 N flip ATOM 1187 OXT HIS A 378 -5.802 -19.778 -4.667 1.00 0.00 O ATOM 0 H HIS A 378 -5.595 -18.393 -7.831 1.00 0.00 H new ATOM 0 HA HIS A 378 -6.846 -16.986 -5.770 1.00 0.00 H new ATOM 0 HB2 HIS A 378 -8.687 -18.738 -6.239 1.00 0.00 H new ATOM 0 HB3 HIS A 378 -8.038 -17.972 -7.676 1.00 0.00 H new ATOM 0 HD1 HIS A 378 -6.229 -19.696 -9.153 1.00 0.00 H new ATOM 0 HD2 HIS A 378 -8.281 -21.255 -5.826 1.00 0.00 H new ATOM 0 HE1 HIS A 378 -5.990 -22.320 -9.258 1.00 0.00 H new TER 1195 HIS A 378