USER MOD reduce.3.24.130724 H: found=0, std=0, add=616, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 609 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 396 CYS SG : rot -130:sc= -1.94! USER MOD Set 1.2: A 398 HIS : no HE2:sc= -2.48 K(o=-14,f=-15) USER MOD Set 1.3: A 416 CYS SG : rot 111:sc= -2.29! USER MOD Set 1.4: A 419 CYS SG : rot 177:sc= -7.66! USER MOD Set 2.1: A 381 CYS SG : rot -158:sc= -4.19! USER MOD Set 2.2: A 384 CYS SG : rot -112:sc= -6.95! USER MOD Set 2.3: A 387 ASN : amide:sc= -0.017 K(o=-21,f=-25) USER MOD Set 2.4: A 401 CYS SG : rot -103:sc= -5.77! USER MOD Set 2.5: A 404 CYS SG : rot 70:sc= -4.33! USER MOD Set 3.1: A 374 MET CE :methyl -146:sc= -1.33 (180deg=-3.68!) USER MOD Set 3.2: A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 356 SER OG : rot 180:sc= 0 USER MOD Single : A 358 GLN :FLIP amide:sc= 0 F(o=-0.7,f=0) USER MOD Single : A 360 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 362 LYS NZ :NH3+ -129:sc= 0.45 (180deg=-0.662!) USER MOD Single : A 364 THR OG1 : rot 180:sc= 0 USER MOD Single : A 365 GLN : amide:sc= -0.514! C(o=-0.51!,f=-2.5!) USER MOD Single : A 367 GLN : amide:sc= 1.07 K(o=1.1,f=-0.014) USER MOD Single : A 368 TYR OH : rot 180:sc= 0 USER MOD Single : A 371 TYR OH : rot 180:sc= 0 USER MOD Single : A 372 CYS SG : rot 180:sc= 0 USER MOD Single : A 377 THR OG1 : rot -74:sc= 1.24 USER MOD Single : A 379 GLN : amide:sc= 0.86 K(o=0.86,f=-1.5) USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 389 LYS NZ :NH3+ -130:sc= -0.265 (180deg=-1.54!) USER MOD Single : A 392 LYS NZ :NH3+ 160:sc= 1.24 (180deg=1.21) USER MOD Single : A 400 MET CE :methyl 170:sc= -2.48 (180deg=-2.64) USER MOD Single : A 402 THR OG1 : rot 117:sc= 0.898 USER MOD Single : A 403 SER OG : rot 170:sc= 0 USER MOD Single : A 406 THR OG1 : rot 74:sc= 1.24 USER MOD Single : A 407 SER OG : rot 86:sc= 1.25 USER MOD Single : A 409 GLN : amide:sc= -0.0767 X(o=-0.077,f=0) USER MOD Single : A 411 SER OG : rot -33:sc= 0.325 USER MOD Single : A 414 GLN : amide:sc= 0 X(o=0,f=-0.083) USER MOD Single : A 421 CYS SG : rot 180:sc= 0.0407 USER MOD Single : A 424 LYS NZ :NH3+ -171:sc= -0.0026 (180deg=-0.112) USER MOD Single : A 426 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 355 22.510 12.750 10.571 1.00 0.00 N ATOM 2 CA GLY A 355 22.626 13.212 9.193 1.00 0.00 C ATOM 3 C GLY A 355 22.302 14.675 9.078 1.00 0.00 C ATOM 4 O GLY A 355 23.166 15.491 8.745 1.00 0.00 O ATOM 0 HA2 GLY A 355 23.638 13.032 8.831 1.00 0.00 H new ATOM 0 HA3 GLY A 355 21.953 12.637 8.557 1.00 0.00 H new ATOM 10 N SER A 356 21.075 15.022 9.361 1.00 0.00 N ATOM 11 CA SER A 356 20.650 16.389 9.280 1.00 0.00 C ATOM 12 C SER A 356 20.387 16.937 10.681 1.00 0.00 C ATOM 13 O SER A 356 19.506 16.438 11.389 1.00 0.00 O ATOM 14 CB SER A 356 19.378 16.452 8.447 1.00 0.00 C ATOM 15 OG SER A 356 19.562 15.786 7.207 1.00 0.00 O ATOM 0 H SER A 356 20.348 14.368 9.652 1.00 0.00 H new ATOM 0 HA SER A 356 21.428 16.994 8.814 1.00 0.00 H new ATOM 0 HB2 SER A 356 18.555 15.993 8.994 1.00 0.00 H new ATOM 0 HB3 SER A 356 19.103 17.492 8.271 1.00 0.00 H new ATOM 0 HG SER A 356 18.735 15.834 6.684 1.00 0.00 H new ATOM 21 N LEU A 357 21.153 17.935 11.097 1.00 0.00 N ATOM 22 CA LEU A 357 20.940 18.560 12.406 1.00 0.00 C ATOM 23 C LEU A 357 19.679 19.411 12.339 1.00 0.00 C ATOM 24 O LEU A 357 18.951 19.595 13.331 1.00 0.00 O ATOM 25 CB LEU A 357 22.148 19.419 12.808 1.00 0.00 C ATOM 26 CG LEU A 357 22.078 20.091 14.187 1.00 0.00 C ATOM 27 CD1 LEU A 357 21.994 19.049 15.296 1.00 0.00 C ATOM 28 CD2 LEU A 357 23.272 21.008 14.396 1.00 0.00 C ATOM 0 H LEU A 357 21.923 18.331 10.557 1.00 0.00 H new ATOM 0 HA LEU A 357 20.824 17.784 13.163 1.00 0.00 H new ATOM 0 HB2 LEU A 357 23.039 18.791 12.778 1.00 0.00 H new ATOM 0 HB3 LEU A 357 22.280 20.196 12.055 1.00 0.00 H new ATOM 0 HG LEU A 357 21.172 20.696 14.225 1.00 0.00 H new ATOM 0 HD11 LEU A 357 21.945 19.550 16.263 1.00 0.00 H new ATOM 0 HD12 LEU A 357 21.100 18.441 15.157 1.00 0.00 H new ATOM 0 HD13 LEU A 357 22.876 18.410 15.262 1.00 0.00 H new ATOM 0 HD21 LEU A 357 23.205 21.475 15.379 1.00 0.00 H new ATOM 0 HD22 LEU A 357 24.192 20.427 14.333 1.00 0.00 H new ATOM 0 HD23 LEU A 357 23.277 21.780 13.627 1.00 0.00 H new ATOM 40 N GLN A 358 19.433 19.916 11.165 1.00 0.00 N ATOM 41 CA GLN A 358 18.253 20.651 10.863 1.00 0.00 C ATOM 42 C GLN A 358 17.794 20.210 9.491 1.00 0.00 C ATOM 43 O GLN A 358 18.627 19.779 8.681 1.00 0.00 O ATOM 44 CB GLN A 358 18.509 22.174 10.897 1.00 0.00 C ATOM 45 CG GLN A 358 19.529 22.665 9.887 1.00 0.00 C ATOM 46 CD GLN A 358 19.771 24.168 9.924 1.00 0.00 C ATOM 47 OE1 GLN A 358 18.771 24.939 10.260 1.00 0.00 O flip ATOM 48 NE2 GLN A 358 20.871 24.631 9.618 1.00 0.00 N flip ATOM 0 H GLN A 358 20.070 19.822 10.374 1.00 0.00 H new ATOM 0 HA GLN A 358 17.485 20.454 11.610 1.00 0.00 H new ATOM 0 HB2 GLN A 358 17.566 22.692 10.723 1.00 0.00 H new ATOM 0 HB3 GLN A 358 18.844 22.451 11.897 1.00 0.00 H new ATOM 0 HG2 GLN A 358 20.474 22.152 10.063 1.00 0.00 H new ATOM 0 HG3 GLN A 358 19.197 22.386 8.887 1.00 0.00 H new ATOM 0 HE21 GLN A 358 21.634 24.005 9.360 1.00 0.00 H new ATOM 0 HE22 GLN A 358 21.019 25.640 9.623 1.00 0.00 H new ATOM 57 N ASP A 359 16.497 20.252 9.271 1.00 0.00 N ATOM 58 CA ASP A 359 15.859 19.926 7.980 1.00 0.00 C ATOM 59 C ASP A 359 16.157 18.501 7.538 1.00 0.00 C ATOM 60 O ASP A 359 17.066 18.263 6.716 1.00 0.00 O ATOM 61 CB ASP A 359 16.275 20.891 6.846 1.00 0.00 C ATOM 62 CG ASP A 359 16.076 22.343 7.170 1.00 0.00 C ATOM 63 OD1 ASP A 359 14.923 22.828 7.154 1.00 0.00 O ATOM 64 OD2 ASP A 359 17.075 23.040 7.440 1.00 0.00 O ATOM 0 H ASP A 359 15.827 20.518 9.992 1.00 0.00 H new ATOM 0 HA ASP A 359 14.789 20.035 8.158 1.00 0.00 H new ATOM 0 HB2 ASP A 359 17.326 20.724 6.609 1.00 0.00 H new ATOM 0 HB3 ASP A 359 15.704 20.649 5.950 1.00 0.00 H new ATOM 69 N HIS A 360 15.448 17.548 8.087 1.00 0.00 N ATOM 70 CA HIS A 360 15.634 16.176 7.685 1.00 0.00 C ATOM 71 C HIS A 360 14.786 15.927 6.461 1.00 0.00 C ATOM 72 O HIS A 360 13.609 15.586 6.550 1.00 0.00 O ATOM 73 CB HIS A 360 15.290 15.184 8.813 1.00 0.00 C ATOM 74 CG HIS A 360 15.561 13.744 8.463 1.00 0.00 C ATOM 75 ND1 HIS A 360 14.577 12.821 8.167 1.00 0.00 N ATOM 76 CD2 HIS A 360 16.735 13.078 8.371 1.00 0.00 C ATOM 77 CE1 HIS A 360 15.172 11.651 7.912 1.00 0.00 C ATOM 78 NE2 HIS A 360 16.487 11.755 8.024 1.00 0.00 N ATOM 0 H HIS A 360 14.742 17.694 8.808 1.00 0.00 H new ATOM 0 HA HIS A 360 16.687 16.011 7.455 1.00 0.00 H new ATOM 0 HB2 HIS A 360 15.864 15.446 9.702 1.00 0.00 H new ATOM 0 HB3 HIS A 360 14.237 15.293 9.071 1.00 0.00 H new ATOM 0 HD2 HIS A 360 17.712 13.507 8.541 1.00 0.00 H new ATOM 0 HE1 HIS A 360 14.650 10.743 7.650 1.00 0.00 H new ATOM 0 HE2 HIS A 360 17.176 11.016 7.884 1.00 0.00 H new ATOM 86 N ILE A 361 15.361 16.180 5.338 1.00 0.00 N ATOM 87 CA ILE A 361 14.692 16.038 4.084 1.00 0.00 C ATOM 88 C ILE A 361 15.409 15.025 3.247 1.00 0.00 C ATOM 89 O ILE A 361 16.428 14.461 3.669 1.00 0.00 O ATOM 90 CB ILE A 361 14.644 17.382 3.310 1.00 0.00 C ATOM 91 CG1 ILE A 361 16.065 17.948 3.124 1.00 0.00 C ATOM 92 CG2 ILE A 361 13.750 18.377 4.030 1.00 0.00 C ATOM 93 CD1 ILE A 361 16.130 19.203 2.292 1.00 0.00 C ATOM 0 H ILE A 361 16.327 16.498 5.259 1.00 0.00 H new ATOM 0 HA ILE A 361 13.670 15.716 4.285 1.00 0.00 H new ATOM 0 HB ILE A 361 14.221 17.201 2.322 1.00 0.00 H new ATOM 0 HG12 ILE A 361 16.492 18.154 4.105 1.00 0.00 H new ATOM 0 HG13 ILE A 361 16.689 17.185 2.659 1.00 0.00 H new ATOM 0 HG21 ILE A 361 13.727 19.314 3.474 1.00 0.00 H new ATOM 0 HG22 ILE A 361 12.740 17.973 4.102 1.00 0.00 H new ATOM 0 HG23 ILE A 361 14.140 18.559 5.031 1.00 0.00 H new ATOM 0 HD11 ILE A 361 17.166 19.533 2.212 1.00 0.00 H new ATOM 0 HD12 ILE A 361 15.736 19.000 1.296 1.00 0.00 H new ATOM 0 HD13 ILE A 361 15.536 19.985 2.765 1.00 0.00 H new ATOM 105 N LYS A 362 14.897 14.793 2.089 1.00 0.00 N ATOM 106 CA LYS A 362 15.522 13.914 1.151 1.00 0.00 C ATOM 107 C LYS A 362 16.525 14.706 0.303 1.00 0.00 C ATOM 108 O LYS A 362 16.968 15.803 0.685 1.00 0.00 O ATOM 109 CB LYS A 362 14.456 13.268 0.263 1.00 0.00 C ATOM 110 CG LYS A 362 13.634 14.260 -0.535 1.00 0.00 C ATOM 111 CD LYS A 362 12.636 13.551 -1.399 1.00 0.00 C ATOM 112 CE LYS A 362 11.789 14.530 -2.170 1.00 0.00 C ATOM 113 NZ LYS A 362 10.829 13.834 -3.027 1.00 0.00 N ATOM 0 H LYS A 362 14.026 15.209 1.759 1.00 0.00 H new ATOM 0 HA LYS A 362 16.056 13.125 1.681 1.00 0.00 H new ATOM 0 HB2 LYS A 362 14.942 12.577 -0.426 1.00 0.00 H new ATOM 0 HB3 LYS A 362 13.787 12.677 0.888 1.00 0.00 H new ATOM 0 HG2 LYS A 362 13.117 14.939 0.143 1.00 0.00 H new ATOM 0 HG3 LYS A 362 14.292 14.868 -1.156 1.00 0.00 H new ATOM 0 HD2 LYS A 362 13.156 12.891 -2.093 1.00 0.00 H new ATOM 0 HD3 LYS A 362 11.997 12.922 -0.779 1.00 0.00 H new ATOM 0 HE2 LYS A 362 11.257 15.181 -1.476 1.00 0.00 H new ATOM 0 HE3 LYS A 362 12.429 15.169 -2.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 362 10.895 14.206 -3.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 362 11.042 12.816 -3.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 362 9.866 13.984 -2.663 1.00 0.00 H new ATOM 127 N VAL A 363 16.882 14.157 -0.816 1.00 0.00 N ATOM 128 CA VAL A 363 17.799 14.793 -1.720 1.00 0.00 C ATOM 129 C VAL A 363 17.138 15.960 -2.459 1.00 0.00 C ATOM 130 O VAL A 363 15.962 15.891 -2.852 1.00 0.00 O ATOM 131 CB VAL A 363 18.385 13.787 -2.724 1.00 0.00 C ATOM 132 CG1 VAL A 363 19.301 12.810 -2.011 1.00 0.00 C ATOM 133 CG2 VAL A 363 17.281 13.026 -3.453 1.00 0.00 C ATOM 0 H VAL A 363 16.545 13.248 -1.134 1.00 0.00 H new ATOM 0 HA VAL A 363 18.617 15.191 -1.119 1.00 0.00 H new ATOM 0 HB VAL A 363 18.959 14.346 -3.463 1.00 0.00 H new ATOM 0 HG11 VAL A 363 19.710 12.102 -2.732 1.00 0.00 H new ATOM 0 HG12 VAL A 363 20.116 13.356 -1.536 1.00 0.00 H new ATOM 0 HG13 VAL A 363 18.736 12.269 -1.252 1.00 0.00 H new ATOM 0 HG21 VAL A 363 17.727 12.322 -4.156 1.00 0.00 H new ATOM 0 HG22 VAL A 363 16.676 12.481 -2.729 1.00 0.00 H new ATOM 0 HG23 VAL A 363 16.651 13.731 -3.996 1.00 0.00 H new ATOM 143 N THR A 364 17.880 17.015 -2.622 1.00 0.00 N ATOM 144 CA THR A 364 17.401 18.195 -3.265 1.00 0.00 C ATOM 145 C THR A 364 17.624 18.134 -4.788 1.00 0.00 C ATOM 146 O THR A 364 16.674 18.000 -5.541 1.00 0.00 O ATOM 147 CB THR A 364 18.068 19.439 -2.650 1.00 0.00 C ATOM 148 OG1 THR A 364 17.891 19.400 -1.217 1.00 0.00 O ATOM 149 CG2 THR A 364 17.444 20.711 -3.188 1.00 0.00 C ATOM 0 H THR A 364 18.848 17.078 -2.306 1.00 0.00 H new ATOM 0 HA THR A 364 16.325 18.264 -3.102 1.00 0.00 H new ATOM 0 HB THR A 364 19.127 19.434 -2.910 1.00 0.00 H new ATOM 0 HG1 THR A 364 18.313 20.187 -0.814 1.00 0.00 H new ATOM 0 HG21 THR A 364 17.933 21.575 -2.738 1.00 0.00 H new ATOM 0 HG22 THR A 364 17.568 20.747 -4.270 1.00 0.00 H new ATOM 0 HG23 THR A 364 16.382 20.727 -2.943 1.00 0.00 H new ATOM 157 N GLN A 365 18.866 18.177 -5.239 1.00 0.00 N ATOM 158 CA GLN A 365 19.115 18.175 -6.680 1.00 0.00 C ATOM 159 C GLN A 365 19.166 16.770 -7.264 1.00 0.00 C ATOM 160 O GLN A 365 19.122 16.590 -8.476 1.00 0.00 O ATOM 161 CB GLN A 365 20.337 19.018 -7.111 1.00 0.00 C ATOM 162 CG GLN A 365 21.679 18.622 -6.511 1.00 0.00 C ATOM 163 CD GLN A 365 21.806 18.953 -5.040 1.00 0.00 C ATOM 164 OE1 GLN A 365 21.232 19.920 -4.551 1.00 0.00 O ATOM 165 NE2 GLN A 365 22.481 18.133 -4.329 1.00 0.00 N ATOM 0 H GLN A 365 19.700 18.213 -4.652 1.00 0.00 H new ATOM 0 HA GLN A 365 18.247 18.675 -7.109 1.00 0.00 H new ATOM 0 HB2 GLN A 365 20.420 18.968 -8.197 1.00 0.00 H new ATOM 0 HB3 GLN A 365 20.142 20.059 -6.854 1.00 0.00 H new ATOM 0 HG2 GLN A 365 21.827 17.551 -6.648 1.00 0.00 H new ATOM 0 HG3 GLN A 365 22.475 19.126 -7.058 1.00 0.00 H new ATOM 0 HE21 GLN A 365 22.946 17.339 -4.769 1.00 0.00 H new ATOM 0 HE22 GLN A 365 22.555 18.273 -3.321 1.00 0.00 H new ATOM 174 N GLU A 366 19.240 15.775 -6.407 1.00 0.00 N ATOM 175 CA GLU A 366 19.195 14.375 -6.846 1.00 0.00 C ATOM 176 C GLU A 366 17.734 13.889 -6.862 1.00 0.00 C ATOM 177 O GLU A 366 17.472 12.693 -6.777 1.00 0.00 O ATOM 178 CB GLU A 366 20.004 13.429 -5.916 1.00 0.00 C ATOM 179 CG GLU A 366 21.498 13.701 -5.746 1.00 0.00 C ATOM 180 CD GLU A 366 21.821 15.003 -5.070 1.00 0.00 C ATOM 181 OE1 GLU A 366 21.183 15.344 -4.040 1.00 0.00 O ATOM 182 OE2 GLU A 366 22.703 15.722 -5.570 1.00 0.00 O ATOM 0 H GLU A 366 19.332 15.898 -5.399 1.00 0.00 H new ATOM 0 HA GLU A 366 19.640 14.342 -7.840 1.00 0.00 H new ATOM 0 HB2 GLU A 366 19.544 13.457 -4.928 1.00 0.00 H new ATOM 0 HB3 GLU A 366 19.890 12.412 -6.292 1.00 0.00 H new ATOM 0 HG2 GLU A 366 21.939 12.888 -5.170 1.00 0.00 H new ATOM 0 HG3 GLU A 366 21.971 13.689 -6.728 1.00 0.00 H new ATOM 189 N GLN A 367 16.788 14.816 -7.034 1.00 0.00 N ATOM 190 CA GLN A 367 15.329 14.528 -6.998 1.00 0.00 C ATOM 191 C GLN A 367 14.820 13.762 -8.248 1.00 0.00 C ATOM 192 O GLN A 367 13.659 13.873 -8.642 1.00 0.00 O ATOM 193 CB GLN A 367 14.527 15.819 -6.774 1.00 0.00 C ATOM 194 CG GLN A 367 14.699 16.889 -7.842 1.00 0.00 C ATOM 195 CD GLN A 367 13.882 18.128 -7.531 1.00 0.00 C ATOM 196 OE1 GLN A 367 12.725 18.239 -7.926 1.00 0.00 O ATOM 197 NE2 GLN A 367 14.449 19.044 -6.797 1.00 0.00 N ATOM 0 H GLN A 367 17.002 15.799 -7.204 1.00 0.00 H new ATOM 0 HA GLN A 367 15.167 13.860 -6.152 1.00 0.00 H new ATOM 0 HB2 GLN A 367 13.470 15.563 -6.708 1.00 0.00 H new ATOM 0 HB3 GLN A 367 14.813 16.242 -5.811 1.00 0.00 H new ATOM 0 HG2 GLN A 367 15.752 17.158 -7.921 1.00 0.00 H new ATOM 0 HG3 GLN A 367 14.399 16.488 -8.810 1.00 0.00 H new ATOM 0 HE21 GLN A 367 15.412 18.923 -6.484 1.00 0.00 H new ATOM 0 HE22 GLN A 367 13.929 19.882 -6.536 1.00 0.00 H new ATOM 206 N TYR A 368 15.676 12.946 -8.807 1.00 0.00 N ATOM 207 CA TYR A 368 15.375 12.114 -9.965 1.00 0.00 C ATOM 208 C TYR A 368 15.042 10.713 -9.474 1.00 0.00 C ATOM 209 O TYR A 368 15.036 9.745 -10.217 1.00 0.00 O ATOM 210 CB TYR A 368 16.550 12.116 -10.935 1.00 0.00 C ATOM 211 CG TYR A 368 16.927 13.513 -11.350 1.00 0.00 C ATOM 212 CD1 TYR A 368 16.037 14.307 -12.058 1.00 0.00 C ATOM 213 CD2 TYR A 368 18.157 14.048 -11.015 1.00 0.00 C ATOM 214 CE1 TYR A 368 16.364 15.596 -12.416 1.00 0.00 C ATOM 215 CE2 TYR A 368 18.494 15.332 -11.375 1.00 0.00 C ATOM 216 CZ TYR A 368 17.594 16.101 -12.071 1.00 0.00 C ATOM 217 OH TYR A 368 17.924 17.395 -12.414 1.00 0.00 O ATOM 0 H TYR A 368 16.631 12.832 -8.467 1.00 0.00 H new ATOM 0 HA TYR A 368 14.517 12.508 -10.509 1.00 0.00 H new ATOM 0 HB2 TYR A 368 17.408 11.631 -10.469 1.00 0.00 H new ATOM 0 HB3 TYR A 368 16.294 11.531 -11.818 1.00 0.00 H new ATOM 0 HD1 TYR A 368 15.072 13.908 -12.333 1.00 0.00 H new ATOM 0 HD2 TYR A 368 18.865 13.448 -10.462 1.00 0.00 H new ATOM 0 HE1 TYR A 368 15.659 16.205 -12.963 1.00 0.00 H new ATOM 0 HE2 TYR A 368 19.461 15.733 -11.112 1.00 0.00 H new ATOM 0 HH TYR A 368 18.828 17.597 -12.095 1.00 0.00 H new ATOM 227 N GLU A 369 14.719 10.679 -8.191 1.00 0.00 N ATOM 228 CA GLU A 369 14.348 9.515 -7.381 1.00 0.00 C ATOM 229 C GLU A 369 13.248 8.678 -8.049 1.00 0.00 C ATOM 230 O GLU A 369 13.156 7.466 -7.859 1.00 0.00 O ATOM 231 CB GLU A 369 13.840 10.079 -6.045 1.00 0.00 C ATOM 232 CG GLU A 369 12.702 11.088 -6.249 1.00 0.00 C ATOM 233 CD GLU A 369 12.335 11.878 -5.037 1.00 0.00 C ATOM 234 OE1 GLU A 369 11.605 11.367 -4.168 1.00 0.00 O ATOM 235 OE2 GLU A 369 12.689 13.060 -4.967 1.00 0.00 O ATOM 0 H GLU A 369 14.707 11.535 -7.636 1.00 0.00 H new ATOM 0 HA GLU A 369 15.203 8.851 -7.254 1.00 0.00 H new ATOM 0 HB2 GLU A 369 13.492 9.261 -5.414 1.00 0.00 H new ATOM 0 HB3 GLU A 369 14.663 10.561 -5.517 1.00 0.00 H new ATOM 0 HG2 GLU A 369 12.987 11.779 -7.042 1.00 0.00 H new ATOM 0 HG3 GLU A 369 11.819 10.552 -6.596 1.00 0.00 H new ATOM 242 N LEU A 370 12.468 9.329 -8.876 1.00 0.00 N ATOM 243 CA LEU A 370 11.355 8.718 -9.534 1.00 0.00 C ATOM 244 C LEU A 370 11.770 8.065 -10.858 1.00 0.00 C ATOM 245 O LEU A 370 10.951 7.870 -11.750 1.00 0.00 O ATOM 246 CB LEU A 370 10.183 9.719 -9.726 1.00 0.00 C ATOM 247 CG LEU A 370 10.348 10.909 -10.712 1.00 0.00 C ATOM 248 CD1 LEU A 370 9.054 11.672 -10.791 1.00 0.00 C ATOM 249 CD2 LEU A 370 11.465 11.862 -10.311 1.00 0.00 C ATOM 0 H LEU A 370 12.596 10.313 -9.110 1.00 0.00 H new ATOM 0 HA LEU A 370 10.992 7.922 -8.884 1.00 0.00 H new ATOM 0 HB2 LEU A 370 9.313 9.146 -10.048 1.00 0.00 H new ATOM 0 HB3 LEU A 370 9.946 10.136 -8.747 1.00 0.00 H new ATOM 0 HG LEU A 370 10.615 10.487 -11.681 1.00 0.00 H new ATOM 0 HD11 LEU A 370 9.166 12.508 -11.482 1.00 0.00 H new ATOM 0 HD12 LEU A 370 8.263 11.011 -11.146 1.00 0.00 H new ATOM 0 HD13 LEU A 370 8.794 12.051 -9.803 1.00 0.00 H new ATOM 0 HD21 LEU A 370 11.531 12.672 -11.038 1.00 0.00 H new ATOM 0 HD22 LEU A 370 11.254 12.276 -9.325 1.00 0.00 H new ATOM 0 HD23 LEU A 370 12.411 11.322 -10.283 1.00 0.00 H new ATOM 261 N TYR A 371 13.048 7.725 -10.973 1.00 0.00 N ATOM 262 CA TYR A 371 13.568 6.988 -12.124 1.00 0.00 C ATOM 263 C TYR A 371 12.991 5.567 -12.101 1.00 0.00 C ATOM 264 O TYR A 371 12.816 4.923 -13.131 1.00 0.00 O ATOM 265 CB TYR A 371 15.119 6.944 -12.094 1.00 0.00 C ATOM 266 CG TYR A 371 15.713 6.159 -10.929 1.00 0.00 C ATOM 267 CD1 TYR A 371 15.880 6.739 -9.679 1.00 0.00 C ATOM 268 CD2 TYR A 371 16.086 4.830 -11.085 1.00 0.00 C ATOM 269 CE1 TYR A 371 16.394 6.021 -8.622 1.00 0.00 C ATOM 270 CE2 TYR A 371 16.603 4.110 -10.036 1.00 0.00 C ATOM 271 CZ TYR A 371 16.753 4.708 -8.807 1.00 0.00 C ATOM 272 OH TYR A 371 17.261 3.983 -7.754 1.00 0.00 O ATOM 0 H TYR A 371 13.755 7.951 -10.273 1.00 0.00 H new ATOM 0 HA TYR A 371 13.269 7.492 -13.043 1.00 0.00 H new ATOM 0 HB2 TYR A 371 15.474 6.507 -13.027 1.00 0.00 H new ATOM 0 HB3 TYR A 371 15.497 7.966 -12.056 1.00 0.00 H new ATOM 0 HD1 TYR A 371 15.602 7.772 -9.533 1.00 0.00 H new ATOM 0 HD2 TYR A 371 15.967 4.355 -12.048 1.00 0.00 H new ATOM 0 HE1 TYR A 371 16.514 6.487 -7.655 1.00 0.00 H new ATOM 0 HE2 TYR A 371 16.891 3.078 -10.176 1.00 0.00 H new ATOM 0 HH TYR A 371 17.463 3.072 -8.052 1.00 0.00 H new ATOM 282 N CYS A 372 12.704 5.105 -10.901 1.00 0.00 N ATOM 283 CA CYS A 372 12.114 3.825 -10.679 1.00 0.00 C ATOM 284 C CYS A 372 10.630 4.043 -10.521 1.00 0.00 C ATOM 285 O CYS A 372 10.190 4.696 -9.562 1.00 0.00 O ATOM 286 CB CYS A 372 12.708 3.185 -9.415 1.00 0.00 C ATOM 287 SG CYS A 372 12.089 1.529 -9.035 1.00 0.00 S ATOM 0 H CYS A 372 12.883 5.628 -10.044 1.00 0.00 H new ATOM 0 HA CYS A 372 12.312 3.151 -11.512 1.00 0.00 H new ATOM 0 HB2 CYS A 372 13.791 3.135 -9.526 1.00 0.00 H new ATOM 0 HB3 CYS A 372 12.504 3.837 -8.565 1.00 0.00 H new ATOM 0 HG CYS A 372 12.660 1.090 -7.953 1.00 0.00 H new ATOM 293 N GLU A 373 9.867 3.559 -11.463 1.00 0.00 N ATOM 294 CA GLU A 373 8.447 3.768 -11.456 1.00 0.00 C ATOM 295 C GLU A 373 7.711 2.444 -11.363 1.00 0.00 C ATOM 296 O GLU A 373 7.314 1.874 -12.385 1.00 0.00 O ATOM 297 CB GLU A 373 8.015 4.529 -12.708 1.00 0.00 C ATOM 298 CG GLU A 373 8.705 5.869 -12.886 1.00 0.00 C ATOM 299 CD GLU A 373 8.379 6.516 -14.197 1.00 0.00 C ATOM 300 OE1 GLU A 373 9.079 6.267 -15.189 1.00 0.00 O ATOM 301 OE2 GLU A 373 7.413 7.296 -14.273 1.00 0.00 O ATOM 0 H GLU A 373 10.211 3.012 -12.252 1.00 0.00 H new ATOM 0 HA GLU A 373 8.193 4.365 -10.580 1.00 0.00 H new ATOM 0 HB2 GLU A 373 8.214 3.911 -13.583 1.00 0.00 H new ATOM 0 HB3 GLU A 373 6.938 4.689 -12.669 1.00 0.00 H new ATOM 0 HG2 GLU A 373 8.412 6.535 -12.074 1.00 0.00 H new ATOM 0 HG3 GLU A 373 9.784 5.731 -12.812 1.00 0.00 H new ATOM 308 N MET A 374 7.630 1.920 -10.148 1.00 0.00 N ATOM 309 CA MET A 374 6.881 0.702 -9.836 1.00 0.00 C ATOM 310 C MET A 374 6.950 0.434 -8.353 1.00 0.00 C ATOM 311 O MET A 374 7.881 -0.212 -7.870 1.00 0.00 O ATOM 312 CB MET A 374 7.386 -0.540 -10.598 1.00 0.00 C ATOM 313 CG MET A 374 6.632 -1.860 -10.310 1.00 0.00 C ATOM 314 SD MET A 374 5.003 -2.061 -11.128 1.00 0.00 S ATOM 315 CE MET A 374 3.986 -0.768 -10.408 1.00 0.00 C ATOM 0 H MET A 374 8.089 2.333 -9.336 1.00 0.00 H new ATOM 0 HA MET A 374 5.854 0.877 -10.156 1.00 0.00 H new ATOM 0 HB2 MET A 374 7.327 -0.336 -11.667 1.00 0.00 H new ATOM 0 HB3 MET A 374 8.439 -0.686 -10.359 1.00 0.00 H new ATOM 0 HG2 MET A 374 7.270 -2.691 -10.610 1.00 0.00 H new ATOM 0 HG3 MET A 374 6.486 -1.943 -9.233 1.00 0.00 H new ATOM 0 HE1 MET A 374 2.957 -1.118 -10.325 1.00 0.00 H new ATOM 0 HE2 MET A 374 4.365 -0.516 -9.418 1.00 0.00 H new ATOM 0 HE3 MET A 374 4.018 0.116 -11.044 1.00 0.00 H new ATOM 325 N GLY A 375 5.995 0.935 -7.630 1.00 0.00 N ATOM 326 CA GLY A 375 5.978 0.756 -6.200 1.00 0.00 C ATOM 327 C GLY A 375 5.375 -0.574 -5.802 1.00 0.00 C ATOM 328 O GLY A 375 4.359 -0.630 -5.122 1.00 0.00 O ATOM 0 H GLY A 375 5.213 1.473 -8.003 1.00 0.00 H new ATOM 0 HA2 GLY A 375 6.995 0.823 -5.814 1.00 0.00 H new ATOM 0 HA3 GLY A 375 5.409 1.564 -5.740 1.00 0.00 H new ATOM 332 N SER A 376 5.992 -1.632 -6.250 1.00 0.00 N ATOM 333 CA SER A 376 5.563 -2.965 -5.966 1.00 0.00 C ATOM 334 C SER A 376 6.752 -3.756 -5.442 1.00 0.00 C ATOM 335 O SER A 376 7.772 -3.893 -6.125 1.00 0.00 O ATOM 336 CB SER A 376 4.990 -3.601 -7.234 1.00 0.00 C ATOM 337 OG SER A 376 3.950 -2.787 -7.768 1.00 0.00 O ATOM 0 H SER A 376 6.826 -1.586 -6.836 1.00 0.00 H new ATOM 0 HA SER A 376 4.779 -2.962 -5.209 1.00 0.00 H new ATOM 0 HB2 SER A 376 5.780 -3.727 -7.975 1.00 0.00 H new ATOM 0 HB3 SER A 376 4.604 -4.595 -7.008 1.00 0.00 H new ATOM 0 HG SER A 376 3.593 -3.204 -8.580 1.00 0.00 H new ATOM 343 N THR A 377 6.639 -4.219 -4.234 1.00 0.00 N ATOM 344 CA THR A 377 7.690 -4.941 -3.586 1.00 0.00 C ATOM 345 C THR A 377 7.733 -6.405 -4.069 1.00 0.00 C ATOM 346 O THR A 377 6.874 -7.206 -3.698 1.00 0.00 O ATOM 347 CB THR A 377 7.432 -4.909 -2.069 1.00 0.00 C ATOM 348 OG1 THR A 377 7.168 -3.556 -1.672 1.00 0.00 O ATOM 349 CG2 THR A 377 8.632 -5.423 -1.300 1.00 0.00 C ATOM 0 H THR A 377 5.802 -4.104 -3.663 1.00 0.00 H new ATOM 0 HA THR A 377 8.647 -4.477 -3.826 1.00 0.00 H new ATOM 0 HB THR A 377 6.579 -5.550 -1.848 1.00 0.00 H new ATOM 0 HG1 THR A 377 8.005 -3.046 -1.673 1.00 0.00 H new ATOM 0 HG21 THR A 377 8.421 -5.389 -0.231 1.00 0.00 H new ATOM 0 HG22 THR A 377 8.841 -6.451 -1.596 1.00 0.00 H new ATOM 0 HG23 THR A 377 9.499 -4.799 -1.519 1.00 0.00 H new ATOM 357 N PHE A 378 8.708 -6.749 -4.921 1.00 0.00 N ATOM 358 CA PHE A 378 8.846 -8.148 -5.373 1.00 0.00 C ATOM 359 C PHE A 378 9.717 -8.900 -4.369 1.00 0.00 C ATOM 360 O PHE A 378 9.920 -10.093 -4.461 1.00 0.00 O ATOM 361 CB PHE A 378 9.458 -8.250 -6.803 1.00 0.00 C ATOM 362 CG PHE A 378 10.978 -8.246 -6.886 1.00 0.00 C ATOM 363 CD1 PHE A 378 11.707 -7.070 -6.811 1.00 0.00 C ATOM 364 CD2 PHE A 378 11.666 -9.450 -7.052 1.00 0.00 C ATOM 365 CE1 PHE A 378 13.092 -7.094 -6.894 1.00 0.00 C ATOM 366 CE2 PHE A 378 13.041 -9.483 -7.133 1.00 0.00 C ATOM 367 CZ PHE A 378 13.759 -8.303 -7.055 1.00 0.00 C ATOM 0 H PHE A 378 9.397 -6.102 -5.305 1.00 0.00 H new ATOM 0 HA PHE A 378 7.852 -8.593 -5.426 1.00 0.00 H new ATOM 0 HB2 PHE A 378 9.092 -9.166 -7.268 1.00 0.00 H new ATOM 0 HB3 PHE A 378 9.080 -7.418 -7.397 1.00 0.00 H new ATOM 0 HD1 PHE A 378 11.194 -6.128 -6.687 1.00 0.00 H new ATOM 0 HD2 PHE A 378 11.109 -10.373 -7.118 1.00 0.00 H new ATOM 0 HE1 PHE A 378 13.652 -6.173 -6.833 1.00 0.00 H new ATOM 0 HE2 PHE A 378 13.555 -10.425 -7.257 1.00 0.00 H new ATOM 0 HZ PHE A 378 14.837 -8.321 -7.119 1.00 0.00 H new ATOM 377 N GLN A 379 10.221 -8.150 -3.421 1.00 0.00 N ATOM 378 CA GLN A 379 11.092 -8.624 -2.358 1.00 0.00 C ATOM 379 C GLN A 379 10.374 -9.616 -1.418 1.00 0.00 C ATOM 380 O GLN A 379 11.009 -10.474 -0.827 1.00 0.00 O ATOM 381 CB GLN A 379 11.608 -7.383 -1.596 1.00 0.00 C ATOM 382 CG GLN A 379 12.294 -7.630 -0.265 1.00 0.00 C ATOM 383 CD GLN A 379 12.706 -6.330 0.419 1.00 0.00 C ATOM 384 OE1 GLN A 379 13.044 -5.342 -0.239 1.00 0.00 O ATOM 385 NE2 GLN A 379 12.578 -6.287 1.714 1.00 0.00 N ATOM 0 H GLN A 379 10.032 -7.150 -3.361 1.00 0.00 H new ATOM 0 HA GLN A 379 11.927 -9.181 -2.782 1.00 0.00 H new ATOM 0 HB2 GLN A 379 12.306 -6.853 -2.244 1.00 0.00 H new ATOM 0 HB3 GLN A 379 10.764 -6.716 -1.424 1.00 0.00 H new ATOM 0 HG2 GLN A 379 11.624 -8.187 0.390 1.00 0.00 H new ATOM 0 HG3 GLN A 379 13.176 -8.252 -0.422 1.00 0.00 H new ATOM 0 HE21 GLN A 379 12.297 -7.123 2.227 1.00 0.00 H new ATOM 0 HE22 GLN A 379 12.759 -5.418 2.216 1.00 0.00 H new ATOM 394 N LEU A 380 9.056 -9.544 -1.374 1.00 0.00 N ATOM 395 CA LEU A 380 8.252 -10.310 -0.419 1.00 0.00 C ATOM 396 C LEU A 380 8.039 -11.771 -0.833 1.00 0.00 C ATOM 397 O LEU A 380 7.947 -12.093 -2.022 1.00 0.00 O ATOM 398 CB LEU A 380 6.901 -9.633 -0.233 1.00 0.00 C ATOM 399 CG LEU A 380 6.952 -8.175 0.212 1.00 0.00 C ATOM 400 CD1 LEU A 380 5.562 -7.586 0.242 1.00 0.00 C ATOM 401 CD2 LEU A 380 7.624 -8.040 1.576 1.00 0.00 C ATOM 0 H LEU A 380 8.505 -8.954 -1.997 1.00 0.00 H new ATOM 0 HA LEU A 380 8.810 -10.327 0.517 1.00 0.00 H new ATOM 0 HB2 LEU A 380 6.354 -9.688 -1.174 1.00 0.00 H new ATOM 0 HB3 LEU A 380 6.329 -10.199 0.502 1.00 0.00 H new ATOM 0 HG LEU A 380 7.550 -7.620 -0.511 1.00 0.00 H new ATOM 0 HD11 LEU A 380 5.615 -6.545 0.561 1.00 0.00 H new ATOM 0 HD12 LEU A 380 5.123 -7.638 -0.754 1.00 0.00 H new ATOM 0 HD13 LEU A 380 4.943 -8.149 0.941 1.00 0.00 H new ATOM 0 HD21 LEU A 380 7.647 -6.990 1.868 1.00 0.00 H new ATOM 0 HD22 LEU A 380 7.063 -8.611 2.316 1.00 0.00 H new ATOM 0 HD23 LEU A 380 8.643 -8.423 1.519 1.00 0.00 H new ATOM 413 N CYS A 381 7.955 -12.626 0.162 1.00 0.00 N ATOM 414 CA CYS A 381 7.677 -14.043 0.025 1.00 0.00 C ATOM 415 C CYS A 381 6.209 -14.214 -0.321 1.00 0.00 C ATOM 416 O CYS A 381 5.354 -13.833 0.455 1.00 0.00 O ATOM 417 CB CYS A 381 8.007 -14.731 1.377 1.00 0.00 C ATOM 418 SG CYS A 381 7.483 -16.505 1.601 1.00 0.00 S ATOM 0 H CYS A 381 8.084 -12.342 1.133 1.00 0.00 H new ATOM 0 HA CYS A 381 8.279 -14.494 -0.764 1.00 0.00 H new ATOM 0 HB2 CYS A 381 9.086 -14.679 1.524 1.00 0.00 H new ATOM 0 HB3 CYS A 381 7.548 -14.143 2.172 1.00 0.00 H new ATOM 0 HG CYS A 381 7.405 -16.778 2.870 1.00 0.00 H new ATOM 423 N LYS A 382 5.922 -14.813 -1.467 1.00 0.00 N ATOM 424 CA LYS A 382 4.534 -14.967 -1.939 1.00 0.00 C ATOM 425 C LYS A 382 3.677 -15.859 -1.020 1.00 0.00 C ATOM 426 O LYS A 382 2.454 -15.856 -1.110 1.00 0.00 O ATOM 427 CB LYS A 382 4.490 -15.526 -3.365 1.00 0.00 C ATOM 428 CG LYS A 382 5.127 -14.658 -4.438 1.00 0.00 C ATOM 429 CD LYS A 382 4.882 -15.275 -5.808 1.00 0.00 C ATOM 430 CE LYS A 382 5.426 -14.421 -6.945 1.00 0.00 C ATOM 431 NZ LYS A 382 6.907 -14.371 -6.981 1.00 0.00 N ATOM 0 H LYS A 382 6.624 -15.204 -2.095 1.00 0.00 H new ATOM 0 HA LYS A 382 4.108 -13.964 -1.922 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.985 -16.497 -3.369 1.00 0.00 H new ATOM 0 HB3 LYS A 382 3.448 -15.698 -3.635 1.00 0.00 H new ATOM 0 HG2 LYS A 382 4.709 -13.652 -4.401 1.00 0.00 H new ATOM 0 HG3 LYS A 382 6.198 -14.565 -4.256 1.00 0.00 H new ATOM 0 HD2 LYS A 382 5.346 -16.261 -5.846 1.00 0.00 H new ATOM 0 HD3 LYS A 382 3.811 -15.421 -5.950 1.00 0.00 H new ATOM 0 HE2 LYS A 382 5.059 -14.814 -7.893 1.00 0.00 H new ATOM 0 HE3 LYS A 382 5.037 -13.407 -6.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 7.215 -13.775 -7.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 7.263 -13.970 -6.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 7.284 -15.333 -7.103 1.00 0.00 H new ATOM 445 N ILE A 383 4.317 -16.609 -0.145 1.00 0.00 N ATOM 446 CA ILE A 383 3.601 -17.523 0.733 1.00 0.00 C ATOM 447 C ILE A 383 2.994 -16.765 1.917 1.00 0.00 C ATOM 448 O ILE A 383 1.859 -17.006 2.308 1.00 0.00 O ATOM 449 CB ILE A 383 4.544 -18.626 1.288 1.00 0.00 C ATOM 450 CG1 ILE A 383 5.339 -19.262 0.158 1.00 0.00 C ATOM 451 CG2 ILE A 383 3.741 -19.703 2.013 1.00 0.00 C ATOM 452 CD1 ILE A 383 6.343 -20.296 0.615 1.00 0.00 C ATOM 0 H ILE A 383 5.329 -16.606 -0.020 1.00 0.00 H new ATOM 0 HA ILE A 383 2.812 -17.987 0.141 1.00 0.00 H new ATOM 0 HB ILE A 383 5.232 -18.160 1.993 1.00 0.00 H new ATOM 0 HG12 ILE A 383 4.646 -19.729 -0.542 1.00 0.00 H new ATOM 0 HG13 ILE A 383 5.864 -18.478 -0.388 1.00 0.00 H new ATOM 0 HG21 ILE A 383 4.418 -20.467 2.395 1.00 0.00 H new ATOM 0 HG22 ILE A 383 3.196 -19.254 2.843 1.00 0.00 H new ATOM 0 HG23 ILE A 383 3.034 -20.159 1.319 1.00 0.00 H new ATOM 0 HD11 ILE A 383 6.868 -20.701 -0.250 1.00 0.00 H new ATOM 0 HD12 ILE A 383 7.062 -19.832 1.290 1.00 0.00 H new ATOM 0 HD13 ILE A 383 5.825 -21.102 1.135 1.00 0.00 H new ATOM 464 N CYS A 384 3.742 -15.828 2.454 1.00 0.00 N ATOM 465 CA CYS A 384 3.328 -15.134 3.659 1.00 0.00 C ATOM 466 C CYS A 384 3.083 -13.637 3.449 1.00 0.00 C ATOM 467 O CYS A 384 2.402 -12.995 4.258 1.00 0.00 O ATOM 468 CB CYS A 384 4.374 -15.394 4.747 1.00 0.00 C ATOM 469 SG CYS A 384 6.108 -15.472 4.096 1.00 0.00 S ATOM 0 H CYS A 384 4.641 -15.527 2.078 1.00 0.00 H new ATOM 0 HA CYS A 384 2.360 -15.529 3.967 1.00 0.00 H new ATOM 0 HB2 CYS A 384 4.311 -14.606 5.498 1.00 0.00 H new ATOM 0 HB3 CYS A 384 4.140 -16.333 5.249 1.00 0.00 H new ATOM 0 HG CYS A 384 6.561 -16.685 4.213 1.00 0.00 H new ATOM 474 N ALA A 385 3.673 -13.082 2.385 1.00 0.00 N ATOM 475 CA ALA A 385 3.574 -11.654 1.987 1.00 0.00 C ATOM 476 C ALA A 385 4.333 -10.707 2.930 1.00 0.00 C ATOM 477 O ALA A 385 4.937 -9.751 2.499 1.00 0.00 O ATOM 478 CB ALA A 385 2.123 -11.207 1.788 1.00 0.00 C ATOM 0 H ALA A 385 4.256 -13.625 1.748 1.00 0.00 H new ATOM 0 HA ALA A 385 4.072 -11.586 1.020 1.00 0.00 H new ATOM 0 HB1 ALA A 385 2.102 -10.156 1.498 1.00 0.00 H new ATOM 0 HB2 ALA A 385 1.661 -11.809 1.005 1.00 0.00 H new ATOM 0 HB3 ALA A 385 1.571 -11.337 2.719 1.00 0.00 H new ATOM 484 N GLU A 386 4.309 -11.006 4.197 1.00 0.00 N ATOM 485 CA GLU A 386 4.953 -10.194 5.210 1.00 0.00 C ATOM 486 C GLU A 386 6.457 -10.382 5.231 1.00 0.00 C ATOM 487 O GLU A 386 7.210 -9.426 5.427 1.00 0.00 O ATOM 488 CB GLU A 386 4.355 -10.512 6.569 1.00 0.00 C ATOM 489 CG GLU A 386 2.955 -9.965 6.749 1.00 0.00 C ATOM 490 CD GLU A 386 2.944 -8.456 6.841 1.00 0.00 C ATOM 491 OE1 GLU A 386 2.883 -7.764 5.790 1.00 0.00 O ATOM 492 OE2 GLU A 386 2.997 -7.930 7.965 1.00 0.00 O ATOM 0 H GLU A 386 3.837 -11.830 4.569 1.00 0.00 H new ATOM 0 HA GLU A 386 4.773 -9.147 4.964 1.00 0.00 H new ATOM 0 HB2 GLU A 386 4.336 -11.593 6.706 1.00 0.00 H new ATOM 0 HB3 GLU A 386 5.000 -10.104 7.347 1.00 0.00 H new ATOM 0 HG2 GLU A 386 2.332 -10.282 5.913 1.00 0.00 H new ATOM 0 HG3 GLU A 386 2.514 -10.387 7.653 1.00 0.00 H new ATOM 499 N ASN A 387 6.896 -11.590 5.019 1.00 0.00 N ATOM 500 CA ASN A 387 8.315 -11.883 5.051 1.00 0.00 C ATOM 501 C ASN A 387 8.899 -11.729 3.685 1.00 0.00 C ATOM 502 O ASN A 387 8.170 -11.766 2.694 1.00 0.00 O ATOM 503 CB ASN A 387 8.591 -13.279 5.600 1.00 0.00 C ATOM 504 CG ASN A 387 8.334 -13.399 7.088 1.00 0.00 C ATOM 505 OD1 ASN A 387 8.480 -12.430 7.846 1.00 0.00 O ATOM 506 ND2 ASN A 387 7.961 -14.571 7.524 1.00 0.00 N ATOM 0 H ASN A 387 6.298 -12.393 4.822 1.00 0.00 H new ATOM 0 HA ASN A 387 8.791 -11.170 5.725 1.00 0.00 H new ATOM 0 HB2 ASN A 387 7.967 -14.000 5.071 1.00 0.00 H new ATOM 0 HB3 ASN A 387 9.628 -13.544 5.395 1.00 0.00 H new ATOM 0 HD21 ASN A 387 7.780 -14.711 8.518 1.00 0.00 H new ATOM 0 HD22 ASN A 387 7.851 -15.347 6.871 1.00 0.00 H new ATOM 513 N ASP A 388 10.194 -11.581 3.619 1.00 0.00 N ATOM 514 CA ASP A 388 10.886 -11.345 2.361 1.00 0.00 C ATOM 515 C ASP A 388 11.343 -12.658 1.799 1.00 0.00 C ATOM 516 O ASP A 388 11.316 -13.662 2.481 1.00 0.00 O ATOM 517 CB ASP A 388 12.131 -10.470 2.571 1.00 0.00 C ATOM 518 CG ASP A 388 11.871 -9.209 3.343 1.00 0.00 C ATOM 519 OD1 ASP A 388 11.180 -8.312 2.847 1.00 0.00 O ATOM 520 OD2 ASP A 388 12.357 -9.088 4.484 1.00 0.00 O ATOM 0 H ASP A 388 10.809 -11.619 4.432 1.00 0.00 H new ATOM 0 HA ASP A 388 10.196 -10.840 1.685 1.00 0.00 H new ATOM 0 HB2 ASP A 388 12.888 -11.054 3.094 1.00 0.00 H new ATOM 0 HB3 ASP A 388 12.546 -10.208 1.598 1.00 0.00 H new ATOM 525 N LYS A 389 11.742 -12.671 0.565 1.00 0.00 N ATOM 526 CA LYS A 389 12.311 -13.858 -0.008 1.00 0.00 C ATOM 527 C LYS A 389 13.750 -13.954 0.414 1.00 0.00 C ATOM 528 O LYS A 389 14.632 -13.312 -0.139 1.00 0.00 O ATOM 529 CB LYS A 389 12.091 -13.935 -1.523 1.00 0.00 C ATOM 530 CG LYS A 389 10.616 -14.102 -1.837 1.00 0.00 C ATOM 531 CD LYS A 389 10.244 -14.175 -3.314 1.00 0.00 C ATOM 532 CE LYS A 389 10.571 -12.917 -4.093 1.00 0.00 C ATOM 533 NZ LYS A 389 11.981 -12.831 -4.540 1.00 0.00 N ATOM 0 H LYS A 389 11.685 -11.873 -0.068 1.00 0.00 H new ATOM 0 HA LYS A 389 11.795 -14.739 0.373 1.00 0.00 H new ATOM 0 HB2 LYS A 389 12.470 -13.030 -1.998 1.00 0.00 H new ATOM 0 HB3 LYS A 389 12.654 -14.772 -1.936 1.00 0.00 H new ATOM 0 HG2 LYS A 389 10.263 -15.011 -1.350 1.00 0.00 H new ATOM 0 HG3 LYS A 389 10.074 -13.269 -1.388 1.00 0.00 H new ATOM 0 HD2 LYS A 389 10.765 -15.018 -3.768 1.00 0.00 H new ATOM 0 HD3 LYS A 389 9.176 -14.377 -3.400 1.00 0.00 H new ATOM 0 HE2 LYS A 389 9.921 -12.864 -4.966 1.00 0.00 H new ATOM 0 HE3 LYS A 389 10.344 -12.050 -3.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 12.373 -11.905 -4.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 12.536 -13.585 -4.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 12.025 -12.943 -5.573 1.00 0.00 H new ATOM 547 N ASP A 390 13.932 -14.715 1.451 1.00 0.00 N ATOM 548 CA ASP A 390 15.186 -14.847 2.159 1.00 0.00 C ATOM 549 C ASP A 390 16.009 -16.022 1.630 1.00 0.00 C ATOM 550 O ASP A 390 17.244 -15.999 1.676 1.00 0.00 O ATOM 551 CB ASP A 390 14.857 -15.054 3.654 1.00 0.00 C ATOM 552 CG ASP A 390 16.054 -15.030 4.585 1.00 0.00 C ATOM 553 OD1 ASP A 390 16.443 -13.931 5.048 1.00 0.00 O ATOM 554 OD2 ASP A 390 16.588 -16.097 4.921 1.00 0.00 O ATOM 0 H ASP A 390 13.187 -15.287 1.849 1.00 0.00 H new ATOM 0 HA ASP A 390 15.786 -13.949 2.013 1.00 0.00 H new ATOM 0 HB2 ASP A 390 14.157 -14.279 3.967 1.00 0.00 H new ATOM 0 HB3 ASP A 390 14.346 -16.010 3.769 1.00 0.00 H new ATOM 559 N VAL A 391 15.346 -17.022 1.083 1.00 0.00 N ATOM 560 CA VAL A 391 16.027 -18.232 0.668 1.00 0.00 C ATOM 561 C VAL A 391 15.574 -18.698 -0.736 1.00 0.00 C ATOM 562 O VAL A 391 14.396 -18.589 -1.112 1.00 0.00 O ATOM 563 CB VAL A 391 15.808 -19.364 1.716 1.00 0.00 C ATOM 564 CG1 VAL A 391 14.364 -19.828 1.767 1.00 0.00 C ATOM 565 CG2 VAL A 391 16.743 -20.524 1.490 1.00 0.00 C ATOM 0 H VAL A 391 14.340 -17.021 0.916 1.00 0.00 H new ATOM 0 HA VAL A 391 17.091 -18.005 0.607 1.00 0.00 H new ATOM 0 HB VAL A 391 16.043 -18.933 2.689 1.00 0.00 H new ATOM 0 HG11 VAL A 391 14.262 -20.617 2.512 1.00 0.00 H new ATOM 0 HG12 VAL A 391 13.722 -18.990 2.036 1.00 0.00 H new ATOM 0 HG13 VAL A 391 14.070 -20.211 0.790 1.00 0.00 H new ATOM 0 HG21 VAL A 391 16.558 -21.292 2.241 1.00 0.00 H new ATOM 0 HG22 VAL A 391 16.573 -20.940 0.497 1.00 0.00 H new ATOM 0 HG23 VAL A 391 17.774 -20.180 1.568 1.00 0.00 H new ATOM 575 N LYS A 392 16.527 -19.142 -1.503 1.00 0.00 N ATOM 576 CA LYS A 392 16.318 -19.675 -2.813 1.00 0.00 C ATOM 577 C LYS A 392 16.585 -21.175 -2.764 1.00 0.00 C ATOM 578 O LYS A 392 17.671 -21.607 -2.383 1.00 0.00 O ATOM 579 CB LYS A 392 17.250 -18.961 -3.813 1.00 0.00 C ATOM 580 CG LYS A 392 17.180 -19.446 -5.258 1.00 0.00 C ATOM 581 CD LYS A 392 17.915 -18.469 -6.175 1.00 0.00 C ATOM 582 CE LYS A 392 17.879 -18.891 -7.638 1.00 0.00 C ATOM 583 NZ LYS A 392 18.794 -20.010 -7.932 1.00 0.00 N ATOM 0 H LYS A 392 17.507 -19.142 -1.220 1.00 0.00 H new ATOM 0 HA LYS A 392 15.293 -19.511 -3.145 1.00 0.00 H new ATOM 0 HB2 LYS A 392 17.019 -17.896 -3.797 1.00 0.00 H new ATOM 0 HB3 LYS A 392 18.277 -19.070 -3.464 1.00 0.00 H new ATOM 0 HG2 LYS A 392 17.625 -20.438 -5.339 1.00 0.00 H new ATOM 0 HG3 LYS A 392 16.139 -19.537 -5.570 1.00 0.00 H new ATOM 0 HD2 LYS A 392 17.469 -17.479 -6.076 1.00 0.00 H new ATOM 0 HD3 LYS A 392 18.952 -18.385 -5.851 1.00 0.00 H new ATOM 0 HE2 LYS A 392 16.862 -19.180 -7.903 1.00 0.00 H new ATOM 0 HE3 LYS A 392 18.142 -18.038 -8.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 18.501 -20.475 -8.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 19.763 -19.648 -8.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 18.764 -20.697 -7.152 1.00 0.00 H new ATOM 597 N ILE A 393 15.595 -21.944 -3.089 1.00 0.00 N ATOM 598 CA ILE A 393 15.669 -23.389 -3.054 1.00 0.00 C ATOM 599 C ILE A 393 16.357 -23.911 -4.297 1.00 0.00 C ATOM 600 O ILE A 393 15.894 -23.678 -5.409 1.00 0.00 O ATOM 601 CB ILE A 393 14.242 -24.032 -2.955 1.00 0.00 C ATOM 602 CG1 ILE A 393 13.602 -23.784 -1.586 1.00 0.00 C ATOM 603 CG2 ILE A 393 14.268 -25.525 -3.253 1.00 0.00 C ATOM 604 CD1 ILE A 393 13.198 -22.364 -1.306 1.00 0.00 C ATOM 0 H ILE A 393 14.689 -21.588 -3.394 1.00 0.00 H new ATOM 0 HA ILE A 393 16.242 -23.665 -2.169 1.00 0.00 H new ATOM 0 HB ILE A 393 13.633 -23.543 -3.715 1.00 0.00 H new ATOM 0 HG12 ILE A 393 12.720 -24.418 -1.497 1.00 0.00 H new ATOM 0 HG13 ILE A 393 14.303 -24.102 -0.814 1.00 0.00 H new ATOM 0 HG21 ILE A 393 13.259 -25.930 -3.173 1.00 0.00 H new ATOM 0 HG22 ILE A 393 14.645 -25.688 -4.262 1.00 0.00 H new ATOM 0 HG23 ILE A 393 14.918 -26.028 -2.537 1.00 0.00 H new ATOM 0 HD11 ILE A 393 12.756 -22.301 -0.311 1.00 0.00 H new ATOM 0 HD12 ILE A 393 14.076 -21.720 -1.355 1.00 0.00 H new ATOM 0 HD13 ILE A 393 12.468 -22.040 -2.048 1.00 0.00 H new ATOM 616 N GLU A 394 17.425 -24.612 -4.104 1.00 0.00 N ATOM 617 CA GLU A 394 18.187 -25.187 -5.181 1.00 0.00 C ATOM 618 C GLU A 394 17.918 -26.682 -5.246 1.00 0.00 C ATOM 619 O GLU A 394 17.705 -27.308 -4.213 1.00 0.00 O ATOM 620 CB GLU A 394 19.676 -24.913 -4.971 1.00 0.00 C ATOM 621 CG GLU A 394 20.038 -23.448 -5.103 1.00 0.00 C ATOM 622 CD GLU A 394 19.780 -22.940 -6.495 1.00 0.00 C ATOM 623 OE1 GLU A 394 20.653 -23.097 -7.359 1.00 0.00 O ATOM 624 OE2 GLU A 394 18.702 -22.374 -6.766 1.00 0.00 O ATOM 0 H GLU A 394 17.806 -24.809 -3.179 1.00 0.00 H new ATOM 0 HA GLU A 394 17.887 -24.734 -6.126 1.00 0.00 H new ATOM 0 HB2 GLU A 394 19.967 -25.265 -3.981 1.00 0.00 H new ATOM 0 HB3 GLU A 394 20.251 -25.489 -5.696 1.00 0.00 H new ATOM 0 HG2 GLU A 394 19.459 -22.863 -4.388 1.00 0.00 H new ATOM 0 HG3 GLU A 394 21.090 -23.308 -4.852 1.00 0.00 H new ATOM 631 N PRO A 395 17.921 -27.287 -6.443 1.00 0.00 N ATOM 632 CA PRO A 395 18.205 -26.601 -7.704 1.00 0.00 C ATOM 633 C PRO A 395 16.937 -26.081 -8.391 1.00 0.00 C ATOM 634 O PRO A 395 16.991 -25.588 -9.513 1.00 0.00 O ATOM 635 CB PRO A 395 18.828 -27.720 -8.530 1.00 0.00 C ATOM 636 CG PRO A 395 18.111 -28.961 -8.090 1.00 0.00 C ATOM 637 CD PRO A 395 17.662 -28.724 -6.664 1.00 0.00 C ATOM 0 HA PRO A 395 18.831 -25.718 -7.573 1.00 0.00 H new ATOM 0 HB2 PRO A 395 18.697 -27.544 -9.598 1.00 0.00 H new ATOM 0 HB3 PRO A 395 19.900 -27.797 -8.349 1.00 0.00 H new ATOM 0 HG2 PRO A 395 17.257 -29.163 -8.736 1.00 0.00 H new ATOM 0 HG3 PRO A 395 18.768 -29.829 -8.149 1.00 0.00 H new ATOM 0 HD2 PRO A 395 16.607 -28.964 -6.532 1.00 0.00 H new ATOM 0 HD3 PRO A 395 18.220 -29.343 -5.962 1.00 0.00 H new ATOM 645 N CYS A 396 15.813 -26.178 -7.694 1.00 0.00 N ATOM 646 CA CYS A 396 14.512 -25.782 -8.217 1.00 0.00 C ATOM 647 C CYS A 396 14.500 -24.291 -8.667 1.00 0.00 C ATOM 648 O CYS A 396 13.835 -23.931 -9.637 1.00 0.00 O ATOM 649 CB CYS A 396 13.448 -26.052 -7.137 1.00 0.00 C ATOM 650 SG CYS A 396 11.686 -25.885 -7.660 1.00 0.00 S ATOM 0 H CYS A 396 15.778 -26.537 -6.740 1.00 0.00 H new ATOM 0 HA CYS A 396 14.288 -26.370 -9.107 1.00 0.00 H new ATOM 0 HB2 CYS A 396 13.597 -27.062 -6.756 1.00 0.00 H new ATOM 0 HB3 CYS A 396 13.624 -25.369 -6.306 1.00 0.00 H new ATOM 0 HG CYS A 396 11.054 -25.121 -6.819 1.00 0.00 H new ATOM 655 N GLY A 397 15.240 -23.449 -7.955 1.00 0.00 N ATOM 656 CA GLY A 397 15.335 -22.047 -8.298 1.00 0.00 C ATOM 657 C GLY A 397 14.137 -21.275 -7.814 1.00 0.00 C ATOM 658 O GLY A 397 13.656 -20.383 -8.488 1.00 0.00 O ATOM 0 H GLY A 397 15.782 -23.720 -7.135 1.00 0.00 H new ATOM 0 HA2 GLY A 397 16.241 -21.626 -7.861 1.00 0.00 H new ATOM 0 HA3 GLY A 397 15.424 -21.942 -9.379 1.00 0.00 H new ATOM 662 N HIS A 398 13.648 -21.622 -6.644 1.00 0.00 N ATOM 663 CA HIS A 398 12.448 -20.981 -6.117 1.00 0.00 C ATOM 664 C HIS A 398 12.749 -20.030 -4.992 1.00 0.00 C ATOM 665 O HIS A 398 13.554 -20.331 -4.113 1.00 0.00 O ATOM 666 CB HIS A 398 11.355 -22.001 -5.751 1.00 0.00 C ATOM 667 CG HIS A 398 10.645 -22.546 -6.958 1.00 0.00 C ATOM 668 ND1 HIS A 398 9.473 -23.282 -6.919 1.00 0.00 N ATOM 669 CD2 HIS A 398 10.940 -22.393 -8.268 1.00 0.00 C ATOM 670 CE1 HIS A 398 9.120 -23.532 -8.205 1.00 0.00 C ATOM 671 NE2 HIS A 398 9.975 -23.022 -9.038 1.00 0.00 N ATOM 0 H HIS A 398 14.053 -22.337 -6.039 1.00 0.00 H new ATOM 0 HA HIS A 398 12.043 -20.373 -6.926 1.00 0.00 H new ATOM 0 HB2 HIS A 398 11.803 -22.825 -5.195 1.00 0.00 H new ATOM 0 HB3 HIS A 398 10.629 -21.528 -5.090 1.00 0.00 H new ATOM 0 HD1 HIS A 398 8.971 -23.580 -6.083 1.00 0.00 H new ATOM 0 HD2 HIS A 398 11.797 -21.862 -8.655 1.00 0.00 H new ATOM 0 HE1 HIS A 398 8.240 -24.085 -8.498 1.00 0.00 H new ATOM 679 N LEU A 399 12.097 -18.899 -5.032 1.00 0.00 N ATOM 680 CA LEU A 399 12.332 -17.806 -4.101 1.00 0.00 C ATOM 681 C LEU A 399 11.227 -17.752 -3.038 1.00 0.00 C ATOM 682 O LEU A 399 10.038 -17.649 -3.377 1.00 0.00 O ATOM 683 CB LEU A 399 12.350 -16.435 -4.842 1.00 0.00 C ATOM 684 CG LEU A 399 13.270 -16.225 -6.071 1.00 0.00 C ATOM 685 CD1 LEU A 399 14.685 -16.672 -5.829 1.00 0.00 C ATOM 686 CD2 LEU A 399 12.691 -16.824 -7.339 1.00 0.00 C ATOM 0 H LEU A 399 11.373 -18.699 -5.722 1.00 0.00 H new ATOM 0 HA LEU A 399 13.299 -17.988 -3.632 1.00 0.00 H new ATOM 0 HB2 LEU A 399 11.329 -16.228 -5.163 1.00 0.00 H new ATOM 0 HB3 LEU A 399 12.613 -15.674 -4.107 1.00 0.00 H new ATOM 0 HG LEU A 399 13.315 -15.147 -6.225 1.00 0.00 H new ATOM 0 HD11 LEU A 399 15.280 -16.499 -6.726 1.00 0.00 H new ATOM 0 HD12 LEU A 399 15.108 -16.107 -4.999 1.00 0.00 H new ATOM 0 HD13 LEU A 399 14.694 -17.735 -5.587 1.00 0.00 H new ATOM 0 HD21 LEU A 399 13.375 -16.649 -8.169 1.00 0.00 H new ATOM 0 HD22 LEU A 399 12.551 -17.897 -7.204 1.00 0.00 H new ATOM 0 HD23 LEU A 399 11.730 -16.358 -7.556 1.00 0.00 H new ATOM 698 N MET A 400 11.612 -17.782 -1.767 1.00 0.00 N ATOM 699 CA MET A 400 10.664 -17.706 -0.647 1.00 0.00 C ATOM 700 C MET A 400 11.429 -17.393 0.628 1.00 0.00 C ATOM 701 O MET A 400 12.613 -17.099 0.565 1.00 0.00 O ATOM 702 CB MET A 400 9.889 -19.017 -0.515 1.00 0.00 C ATOM 703 CG MET A 400 10.746 -20.216 -0.177 1.00 0.00 C ATOM 704 SD MET A 400 9.882 -21.773 -0.429 1.00 0.00 S ATOM 705 CE MET A 400 9.642 -21.722 -2.207 1.00 0.00 C ATOM 0 H MET A 400 12.587 -17.859 -1.478 1.00 0.00 H new ATOM 0 HA MET A 400 9.940 -16.912 -0.831 1.00 0.00 H new ATOM 0 HB2 MET A 400 9.129 -18.900 0.257 1.00 0.00 H new ATOM 0 HB3 MET A 400 9.366 -19.212 -1.451 1.00 0.00 H new ATOM 0 HG2 MET A 400 11.646 -20.200 -0.792 1.00 0.00 H new ATOM 0 HG3 MET A 400 11.068 -20.147 0.862 1.00 0.00 H new ATOM 0 HE1 MET A 400 9.280 -22.690 -2.553 1.00 0.00 H new ATOM 0 HE2 MET A 400 8.911 -20.952 -2.454 1.00 0.00 H new ATOM 0 HE3 MET A 400 10.589 -21.493 -2.696 1.00 0.00 H new ATOM 715 N CYS A 401 10.782 -17.413 1.762 1.00 0.00 N ATOM 716 CA CYS A 401 11.486 -17.149 2.999 1.00 0.00 C ATOM 717 C CYS A 401 11.777 -18.407 3.750 1.00 0.00 C ATOM 718 O CYS A 401 11.014 -19.382 3.673 1.00 0.00 O ATOM 719 CB CYS A 401 10.742 -16.141 3.885 1.00 0.00 C ATOM 720 SG CYS A 401 8.993 -16.550 4.230 1.00 0.00 S ATOM 0 H CYS A 401 9.785 -17.605 1.861 1.00 0.00 H new ATOM 0 HA CYS A 401 12.439 -16.698 2.722 1.00 0.00 H new ATOM 0 HB2 CYS A 401 11.272 -16.054 4.833 1.00 0.00 H new ATOM 0 HB3 CYS A 401 10.782 -15.162 3.407 1.00 0.00 H new ATOM 0 HG CYS A 401 8.220 -15.808 3.494 1.00 0.00 H new ATOM 725 N THR A 402 12.881 -18.377 4.470 1.00 0.00 N ATOM 726 CA THR A 402 13.322 -19.442 5.314 1.00 0.00 C ATOM 727 C THR A 402 12.233 -19.775 6.352 1.00 0.00 C ATOM 728 O THR A 402 12.080 -20.920 6.741 1.00 0.00 O ATOM 729 CB THR A 402 14.634 -19.010 5.994 1.00 0.00 C ATOM 730 OG1 THR A 402 15.519 -18.530 4.968 1.00 0.00 O ATOM 731 CG2 THR A 402 15.297 -20.176 6.706 1.00 0.00 C ATOM 0 H THR A 402 13.511 -17.575 4.475 1.00 0.00 H new ATOM 0 HA THR A 402 13.504 -20.344 4.730 1.00 0.00 H new ATOM 0 HB THR A 402 14.418 -18.240 6.734 1.00 0.00 H new ATOM 0 HG1 THR A 402 15.716 -17.583 5.123 1.00 0.00 H new ATOM 0 HG21 THR A 402 16.221 -19.838 7.176 1.00 0.00 H new ATOM 0 HG22 THR A 402 14.624 -20.567 7.469 1.00 0.00 H new ATOM 0 HG23 THR A 402 15.523 -20.962 5.985 1.00 0.00 H new ATOM 739 N SER A 403 11.455 -18.762 6.737 1.00 0.00 N ATOM 740 CA SER A 403 10.335 -18.925 7.636 1.00 0.00 C ATOM 741 C SER A 403 9.374 -19.996 7.088 1.00 0.00 C ATOM 742 O SER A 403 9.142 -21.008 7.742 1.00 0.00 O ATOM 743 CB SER A 403 9.613 -17.573 7.826 1.00 0.00 C ATOM 744 OG SER A 403 8.529 -17.666 8.752 1.00 0.00 O ATOM 0 H SER A 403 11.594 -17.801 6.425 1.00 0.00 H new ATOM 0 HA SER A 403 10.696 -19.258 8.609 1.00 0.00 H new ATOM 0 HB2 SER A 403 10.327 -16.828 8.178 1.00 0.00 H new ATOM 0 HB3 SER A 403 9.238 -17.225 6.864 1.00 0.00 H new ATOM 0 HG SER A 403 8.204 -16.767 8.966 1.00 0.00 H new ATOM 750 N CYS A 404 8.885 -19.801 5.864 1.00 0.00 N ATOM 751 CA CYS A 404 7.980 -20.758 5.243 1.00 0.00 C ATOM 752 C CYS A 404 8.732 -22.067 4.962 1.00 0.00 C ATOM 753 O CYS A 404 8.296 -23.141 5.333 1.00 0.00 O ATOM 754 CB CYS A 404 7.463 -20.190 3.914 1.00 0.00 C ATOM 755 SG CYS A 404 6.790 -18.470 3.987 1.00 0.00 S ATOM 0 H CYS A 404 9.102 -18.989 5.286 1.00 0.00 H new ATOM 0 HA CYS A 404 7.143 -20.947 5.915 1.00 0.00 H new ATOM 0 HB2 CYS A 404 8.277 -20.212 3.189 1.00 0.00 H new ATOM 0 HB3 CYS A 404 6.682 -20.850 3.537 1.00 0.00 H new ATOM 0 HG CYS A 404 7.763 -17.632 4.190 1.00 0.00 H new ATOM 760 N LEU A 405 9.901 -21.918 4.376 1.00 0.00 N ATOM 761 CA LEU A 405 10.751 -23.012 3.914 1.00 0.00 C ATOM 762 C LEU A 405 11.098 -24.027 5.035 1.00 0.00 C ATOM 763 O LEU A 405 11.070 -25.246 4.814 1.00 0.00 O ATOM 764 CB LEU A 405 11.995 -22.357 3.251 1.00 0.00 C ATOM 765 CG LEU A 405 13.134 -23.211 2.657 1.00 0.00 C ATOM 766 CD1 LEU A 405 14.094 -23.672 3.726 1.00 0.00 C ATOM 767 CD2 LEU A 405 12.597 -24.381 1.845 1.00 0.00 C ATOM 0 H LEU A 405 10.307 -20.999 4.198 1.00 0.00 H new ATOM 0 HA LEU A 405 10.224 -23.627 3.184 1.00 0.00 H new ATOM 0 HB2 LEU A 405 11.627 -21.718 2.449 1.00 0.00 H new ATOM 0 HB3 LEU A 405 12.445 -21.704 3.998 1.00 0.00 H new ATOM 0 HG LEU A 405 13.691 -22.573 1.971 1.00 0.00 H new ATOM 0 HD11 LEU A 405 14.884 -24.271 3.272 1.00 0.00 H new ATOM 0 HD12 LEU A 405 14.534 -22.805 4.218 1.00 0.00 H new ATOM 0 HD13 LEU A 405 13.559 -24.274 4.461 1.00 0.00 H new ATOM 0 HD21 LEU A 405 13.430 -24.958 1.444 1.00 0.00 H new ATOM 0 HD22 LEU A 405 11.989 -25.020 2.485 1.00 0.00 H new ATOM 0 HD23 LEU A 405 11.987 -24.004 1.024 1.00 0.00 H new ATOM 779 N THR A 406 11.405 -23.546 6.214 1.00 0.00 N ATOM 780 CA THR A 406 11.758 -24.430 7.315 1.00 0.00 C ATOM 781 C THR A 406 10.498 -25.065 7.865 1.00 0.00 C ATOM 782 O THR A 406 10.450 -26.266 8.118 1.00 0.00 O ATOM 783 CB THR A 406 12.465 -23.676 8.439 1.00 0.00 C ATOM 784 OG1 THR A 406 13.491 -22.843 7.879 1.00 0.00 O ATOM 785 CG2 THR A 406 13.106 -24.643 9.413 1.00 0.00 C ATOM 0 H THR A 406 11.420 -22.552 6.443 1.00 0.00 H new ATOM 0 HA THR A 406 12.440 -25.190 6.933 1.00 0.00 H new ATOM 0 HB THR A 406 11.727 -23.073 8.967 1.00 0.00 H new ATOM 0 HG1 THR A 406 13.080 -22.073 7.434 1.00 0.00 H new ATOM 0 HG21 THR A 406 13.604 -24.085 10.206 1.00 0.00 H new ATOM 0 HG22 THR A 406 12.339 -25.284 9.848 1.00 0.00 H new ATOM 0 HG23 THR A 406 13.837 -25.258 8.888 1.00 0.00 H new ATOM 793 N SER A 407 9.471 -24.243 7.989 1.00 0.00 N ATOM 794 CA SER A 407 8.191 -24.614 8.488 1.00 0.00 C ATOM 795 C SER A 407 7.549 -25.714 7.648 1.00 0.00 C ATOM 796 O SER A 407 6.936 -26.650 8.172 1.00 0.00 O ATOM 797 CB SER A 407 7.346 -23.375 8.476 1.00 0.00 C ATOM 798 OG SER A 407 7.756 -22.452 9.482 1.00 0.00 O ATOM 0 H SER A 407 9.526 -23.258 7.729 1.00 0.00 H new ATOM 0 HA SER A 407 8.285 -25.019 9.495 1.00 0.00 H new ATOM 0 HB2 SER A 407 7.410 -22.900 7.497 1.00 0.00 H new ATOM 0 HB3 SER A 407 6.301 -23.644 8.632 1.00 0.00 H new ATOM 0 HG SER A 407 8.480 -21.890 9.135 1.00 0.00 H new ATOM 804 N TRP A 408 7.690 -25.590 6.363 1.00 0.00 N ATOM 805 CA TRP A 408 7.214 -26.561 5.440 1.00 0.00 C ATOM 806 C TRP A 408 7.946 -27.883 5.642 1.00 0.00 C ATOM 807 O TRP A 408 7.324 -28.934 5.707 1.00 0.00 O ATOM 808 CB TRP A 408 7.369 -26.012 4.032 1.00 0.00 C ATOM 809 CG TRP A 408 7.046 -26.981 2.946 1.00 0.00 C ATOM 810 CD1 TRP A 408 7.883 -27.382 1.962 1.00 0.00 C ATOM 811 CD2 TRP A 408 5.821 -27.699 2.749 1.00 0.00 C ATOM 812 NE1 TRP A 408 7.257 -28.277 1.148 1.00 0.00 N ATOM 813 CE2 TRP A 408 5.994 -28.499 1.610 1.00 0.00 C ATOM 814 CE3 TRP A 408 4.597 -27.738 3.421 1.00 0.00 C ATOM 815 CZ2 TRP A 408 4.995 -29.329 1.124 1.00 0.00 C ATOM 816 CZ3 TRP A 408 3.607 -28.563 2.941 1.00 0.00 C ATOM 817 CH2 TRP A 408 3.813 -29.350 1.804 1.00 0.00 C ATOM 0 H TRP A 408 8.149 -24.793 5.923 1.00 0.00 H new ATOM 0 HA TRP A 408 6.156 -26.765 5.607 1.00 0.00 H new ATOM 0 HB2 TRP A 408 6.726 -25.139 3.924 1.00 0.00 H new ATOM 0 HB3 TRP A 408 8.396 -25.670 3.901 1.00 0.00 H new ATOM 0 HD1 TRP A 408 8.901 -27.042 1.839 1.00 0.00 H new ATOM 0 HE1 TRP A 408 7.669 -28.713 0.323 1.00 0.00 H new ATOM 0 HE3 TRP A 408 4.431 -27.132 4.300 1.00 0.00 H new ATOM 0 HZ2 TRP A 408 5.147 -29.934 0.243 1.00 0.00 H new ATOM 0 HZ3 TRP A 408 2.656 -28.604 3.450 1.00 0.00 H new ATOM 0 HH2 TRP A 408 3.016 -29.990 1.456 1.00 0.00 H new ATOM 828 N GLN A 409 9.252 -27.811 5.822 1.00 0.00 N ATOM 829 CA GLN A 409 10.049 -29.003 6.063 1.00 0.00 C ATOM 830 C GLN A 409 9.757 -29.604 7.434 1.00 0.00 C ATOM 831 O GLN A 409 9.891 -30.800 7.629 1.00 0.00 O ATOM 832 CB GLN A 409 11.529 -28.744 5.851 1.00 0.00 C ATOM 833 CG GLN A 409 11.884 -28.461 4.401 1.00 0.00 C ATOM 834 CD GLN A 409 13.348 -28.183 4.218 1.00 0.00 C ATOM 835 OE1 GLN A 409 14.146 -29.096 3.991 1.00 0.00 O ATOM 836 NE2 GLN A 409 13.713 -26.936 4.293 1.00 0.00 N ATOM 0 H GLN A 409 9.784 -26.941 5.806 1.00 0.00 H new ATOM 0 HA GLN A 409 9.755 -29.747 5.323 1.00 0.00 H new ATOM 0 HB2 GLN A 409 11.835 -27.897 6.465 1.00 0.00 H new ATOM 0 HB3 GLN A 409 12.096 -29.609 6.195 1.00 0.00 H new ATOM 0 HG2 GLN A 409 11.599 -29.314 3.786 1.00 0.00 H new ATOM 0 HG3 GLN A 409 11.307 -27.606 4.048 1.00 0.00 H new ATOM 0 HE21 GLN A 409 13.020 -26.212 4.483 1.00 0.00 H new ATOM 0 HE22 GLN A 409 14.692 -26.682 4.162 1.00 0.00 H new ATOM 845 N GLU A 410 9.311 -28.774 8.361 1.00 0.00 N ATOM 846 CA GLU A 410 8.872 -29.227 9.682 1.00 0.00 C ATOM 847 C GLU A 410 7.576 -30.057 9.582 1.00 0.00 C ATOM 848 O GLU A 410 7.216 -30.788 10.501 1.00 0.00 O ATOM 849 CB GLU A 410 8.680 -28.033 10.617 1.00 0.00 C ATOM 850 CG GLU A 410 9.955 -27.403 11.110 1.00 0.00 C ATOM 851 CD GLU A 410 9.677 -26.281 12.056 1.00 0.00 C ATOM 852 OE1 GLU A 410 9.190 -26.536 13.163 1.00 0.00 O ATOM 853 OE2 GLU A 410 9.901 -25.119 11.703 1.00 0.00 O ATOM 0 H GLU A 410 9.241 -27.766 8.225 1.00 0.00 H new ATOM 0 HA GLU A 410 9.648 -29.871 10.096 1.00 0.00 H new ATOM 0 HB2 GLU A 410 8.094 -27.274 10.098 1.00 0.00 H new ATOM 0 HB3 GLU A 410 8.094 -28.355 11.478 1.00 0.00 H new ATOM 0 HG2 GLU A 410 10.567 -28.156 11.606 1.00 0.00 H new ATOM 0 HG3 GLU A 410 10.531 -27.032 10.262 1.00 0.00 H new ATOM 860 N SER A 411 6.916 -29.947 8.451 1.00 0.00 N ATOM 861 CA SER A 411 5.702 -30.671 8.153 1.00 0.00 C ATOM 862 C SER A 411 6.028 -31.721 7.066 1.00 0.00 C ATOM 863 O SER A 411 5.133 -32.295 6.443 1.00 0.00 O ATOM 864 CB SER A 411 4.638 -29.658 7.644 1.00 0.00 C ATOM 865 OG SER A 411 3.364 -30.262 7.409 1.00 0.00 O ATOM 0 H SER A 411 7.218 -29.335 7.693 1.00 0.00 H new ATOM 0 HA SER A 411 5.309 -31.178 9.035 1.00 0.00 H new ATOM 0 HB2 SER A 411 4.526 -28.858 8.376 1.00 0.00 H new ATOM 0 HB3 SER A 411 4.993 -29.199 6.721 1.00 0.00 H new ATOM 0 HG SER A 411 3.491 -31.182 7.096 1.00 0.00 H new ATOM 871 N GLU A 412 7.331 -31.982 6.895 1.00 0.00 N ATOM 872 CA GLU A 412 7.874 -32.811 5.820 1.00 0.00 C ATOM 873 C GLU A 412 7.788 -32.067 4.522 1.00 0.00 C ATOM 874 O GLU A 412 6.764 -32.084 3.820 1.00 0.00 O ATOM 875 CB GLU A 412 7.268 -34.222 5.713 1.00 0.00 C ATOM 876 CG GLU A 412 7.663 -35.149 6.840 1.00 0.00 C ATOM 877 CD GLU A 412 9.160 -35.306 6.948 1.00 0.00 C ATOM 878 OE1 GLU A 412 9.773 -35.957 6.070 1.00 0.00 O ATOM 879 OE2 GLU A 412 9.763 -34.763 7.900 1.00 0.00 O ATOM 0 H GLU A 412 8.050 -31.612 7.517 1.00 0.00 H new ATOM 0 HA GLU A 412 8.917 -32.997 6.074 1.00 0.00 H new ATOM 0 HB2 GLU A 412 6.181 -34.139 5.689 1.00 0.00 H new ATOM 0 HB3 GLU A 412 7.574 -34.667 4.766 1.00 0.00 H new ATOM 0 HG2 GLU A 412 7.271 -34.763 7.781 1.00 0.00 H new ATOM 0 HG3 GLU A 412 7.207 -36.126 6.682 1.00 0.00 H new ATOM 886 N GLY A 413 8.849 -31.395 4.220 1.00 0.00 N ATOM 887 CA GLY A 413 8.879 -30.544 3.080 1.00 0.00 C ATOM 888 C GLY A 413 9.452 -31.231 1.910 1.00 0.00 C ATOM 889 O GLY A 413 10.606 -30.993 1.546 1.00 0.00 O ATOM 0 H GLY A 413 9.717 -31.421 4.755 1.00 0.00 H new ATOM 0 HA2 GLY A 413 7.868 -30.209 2.848 1.00 0.00 H new ATOM 0 HA3 GLY A 413 9.466 -29.654 3.304 1.00 0.00 H new ATOM 893 N GLN A 414 8.673 -32.097 1.319 1.00 0.00 N ATOM 894 CA GLN A 414 9.110 -32.835 0.173 1.00 0.00 C ATOM 895 C GLN A 414 8.893 -31.988 -1.073 1.00 0.00 C ATOM 896 O GLN A 414 7.811 -32.011 -1.694 1.00 0.00 O ATOM 897 CB GLN A 414 8.386 -34.175 0.095 1.00 0.00 C ATOM 898 CG GLN A 414 8.804 -35.059 -1.064 1.00 0.00 C ATOM 899 CD GLN A 414 8.012 -36.341 -1.104 1.00 0.00 C ATOM 900 OE1 GLN A 414 6.957 -36.406 -1.725 1.00 0.00 O ATOM 901 NE2 GLN A 414 8.491 -37.356 -0.455 1.00 0.00 N ATOM 0 H GLN A 414 7.721 -32.308 1.620 1.00 0.00 H new ATOM 0 HA GLN A 414 10.174 -33.058 0.253 1.00 0.00 H new ATOM 0 HB2 GLN A 414 8.554 -34.717 1.026 1.00 0.00 H new ATOM 0 HB3 GLN A 414 7.314 -33.989 0.023 1.00 0.00 H new ATOM 0 HG2 GLN A 414 8.668 -34.519 -2.001 1.00 0.00 H new ATOM 0 HG3 GLN A 414 9.866 -35.290 -0.980 1.00 0.00 H new ATOM 0 HE21 GLN A 414 9.372 -37.268 0.052 1.00 0.00 H new ATOM 0 HE22 GLN A 414 7.987 -38.243 -0.451 1.00 0.00 H new ATOM 910 N GLY A 415 9.887 -31.175 -1.357 1.00 0.00 N ATOM 911 CA GLY A 415 9.846 -30.276 -2.466 1.00 0.00 C ATOM 912 C GLY A 415 9.375 -28.917 -2.013 1.00 0.00 C ATOM 913 O GLY A 415 8.884 -28.806 -0.903 1.00 0.00 O ATOM 0 H GLY A 415 10.749 -31.127 -0.814 1.00 0.00 H new ATOM 0 HA2 GLY A 415 10.836 -30.195 -2.916 1.00 0.00 H new ATOM 0 HA3 GLY A 415 9.177 -30.664 -3.234 1.00 0.00 H new ATOM 917 N CYS A 416 9.558 -27.878 -2.846 1.00 0.00 N ATOM 918 CA CYS A 416 9.098 -26.510 -2.514 1.00 0.00 C ATOM 919 C CYS A 416 7.620 -26.529 -2.082 1.00 0.00 C ATOM 920 O CYS A 416 6.842 -27.292 -2.623 1.00 0.00 O ATOM 921 CB CYS A 416 9.135 -25.606 -3.753 1.00 0.00 C ATOM 922 SG CYS A 416 10.666 -25.576 -4.762 1.00 0.00 S ATOM 0 H CYS A 416 10.019 -27.955 -3.752 1.00 0.00 H new ATOM 0 HA CYS A 416 9.755 -26.145 -1.724 1.00 0.00 H new ATOM 0 HB2 CYS A 416 8.313 -25.902 -4.405 1.00 0.00 H new ATOM 0 HB3 CYS A 416 8.932 -24.586 -3.427 1.00 0.00 H new ATOM 0 HG CYS A 416 10.439 -26.139 -5.911 1.00 0.00 H new ATOM 927 N PRO A 417 7.207 -25.644 -1.176 1.00 0.00 N ATOM 928 CA PRO A 417 5.791 -25.543 -0.762 1.00 0.00 C ATOM 929 C PRO A 417 4.870 -25.123 -1.936 1.00 0.00 C ATOM 930 O PRO A 417 3.649 -25.178 -1.837 1.00 0.00 O ATOM 931 CB PRO A 417 5.791 -24.472 0.338 1.00 0.00 C ATOM 932 CG PRO A 417 7.108 -23.775 0.227 1.00 0.00 C ATOM 933 CD PRO A 417 8.072 -24.724 -0.426 1.00 0.00 C ATOM 0 HA PRO A 417 5.404 -26.503 -0.420 1.00 0.00 H new ATOM 0 HB2 PRO A 417 4.966 -23.773 0.203 1.00 0.00 H new ATOM 0 HB3 PRO A 417 5.669 -24.923 1.323 1.00 0.00 H new ATOM 0 HG2 PRO A 417 7.010 -22.863 -0.362 1.00 0.00 H new ATOM 0 HG3 PRO A 417 7.469 -23.480 1.212 1.00 0.00 H new ATOM 0 HD2 PRO A 417 8.764 -24.200 -1.085 1.00 0.00 H new ATOM 0 HD3 PRO A 417 8.674 -25.254 0.313 1.00 0.00 H new ATOM 941 N PHE A 418 5.490 -24.686 -3.031 1.00 0.00 N ATOM 942 CA PHE A 418 4.783 -24.325 -4.252 1.00 0.00 C ATOM 943 C PHE A 418 4.674 -25.521 -5.211 1.00 0.00 C ATOM 944 O PHE A 418 3.623 -26.102 -5.379 1.00 0.00 O ATOM 945 CB PHE A 418 5.500 -23.193 -5.003 1.00 0.00 C ATOM 946 CG PHE A 418 5.459 -21.830 -4.384 1.00 0.00 C ATOM 947 CD1 PHE A 418 6.353 -21.467 -3.401 1.00 0.00 C ATOM 948 CD2 PHE A 418 4.549 -20.888 -4.834 1.00 0.00 C ATOM 949 CE1 PHE A 418 6.338 -20.202 -2.877 1.00 0.00 C ATOM 950 CE2 PHE A 418 4.537 -19.614 -4.311 1.00 0.00 C ATOM 951 CZ PHE A 418 5.435 -19.275 -3.333 1.00 0.00 C ATOM 0 H PHE A 418 6.502 -24.573 -3.093 1.00 0.00 H new ATOM 0 HA PHE A 418 3.790 -23.999 -3.943 1.00 0.00 H new ATOM 0 HB2 PHE A 418 6.545 -23.477 -5.126 1.00 0.00 H new ATOM 0 HB3 PHE A 418 5.069 -23.124 -6.002 1.00 0.00 H new ATOM 0 HD1 PHE A 418 7.073 -22.187 -3.040 1.00 0.00 H new ATOM 0 HD2 PHE A 418 3.841 -21.156 -5.604 1.00 0.00 H new ATOM 0 HE1 PHE A 418 7.040 -19.933 -2.102 1.00 0.00 H new ATOM 0 HE2 PHE A 418 3.824 -18.886 -4.670 1.00 0.00 H new ATOM 0 HZ PHE A 418 5.432 -18.277 -2.921 1.00 0.00 H new ATOM 961 N CYS A 419 5.797 -25.879 -5.819 1.00 0.00 N ATOM 962 CA CYS A 419 5.835 -26.887 -6.871 1.00 0.00 C ATOM 963 C CYS A 419 5.972 -28.295 -6.324 1.00 0.00 C ATOM 964 O CYS A 419 5.506 -29.254 -6.933 1.00 0.00 O ATOM 965 CB CYS A 419 7.034 -26.569 -7.780 1.00 0.00 C ATOM 966 SG CYS A 419 8.642 -26.299 -6.859 1.00 0.00 S ATOM 0 H CYS A 419 6.708 -25.479 -5.597 1.00 0.00 H new ATOM 0 HA CYS A 419 4.893 -26.854 -7.419 1.00 0.00 H new ATOM 0 HB2 CYS A 419 7.166 -27.387 -8.488 1.00 0.00 H new ATOM 0 HB3 CYS A 419 6.807 -25.676 -8.363 1.00 0.00 H new ATOM 0 HG CYS A 419 9.603 -26.105 -7.712 1.00 0.00 H new ATOM 971 N ARG A 420 6.583 -28.381 -5.156 1.00 0.00 N ATOM 972 CA ARG A 420 6.996 -29.629 -4.531 1.00 0.00 C ATOM 973 C ARG A 420 8.121 -30.309 -5.292 1.00 0.00 C ATOM 974 O ARG A 420 8.395 -31.494 -5.111 1.00 0.00 O ATOM 975 CB ARG A 420 5.844 -30.565 -4.178 1.00 0.00 C ATOM 976 CG ARG A 420 4.952 -30.001 -3.081 1.00 0.00 C ATOM 977 CD ARG A 420 4.049 -31.059 -2.502 1.00 0.00 C ATOM 978 NE ARG A 420 4.824 -32.168 -1.937 1.00 0.00 N ATOM 979 CZ ARG A 420 4.357 -33.083 -1.087 1.00 0.00 C ATOM 980 NH1 ARG A 420 3.126 -32.989 -0.588 1.00 0.00 N ATOM 981 NH2 ARG A 420 5.125 -34.081 -0.727 1.00 0.00 N ATOM 0 H ARG A 420 6.814 -27.559 -4.597 1.00 0.00 H new ATOM 0 HA ARG A 420 7.409 -29.347 -3.563 1.00 0.00 H new ATOM 0 HB2 ARG A 420 5.245 -30.751 -5.069 1.00 0.00 H new ATOM 0 HB3 ARG A 420 6.246 -31.526 -3.857 1.00 0.00 H new ATOM 0 HG2 ARG A 420 5.571 -29.577 -2.290 1.00 0.00 H new ATOM 0 HG3 ARG A 420 4.349 -29.188 -3.484 1.00 0.00 H new ATOM 0 HD2 ARG A 420 3.420 -30.620 -1.727 1.00 0.00 H new ATOM 0 HD3 ARG A 420 3.383 -31.436 -3.278 1.00 0.00 H new ATOM 0 HE ARG A 420 5.802 -32.246 -2.217 1.00 0.00 H new ATOM 0 HH11 ARG A 420 2.526 -32.209 -0.855 1.00 0.00 H new ATOM 0 HH12 ARG A 420 2.783 -33.697 0.061 1.00 0.00 H new ATOM 0 HH21 ARG A 420 6.073 -34.154 -1.096 1.00 0.00 H new ATOM 0 HH22 ARG A 420 4.775 -34.785 -0.077 1.00 0.00 H new ATOM 995 N CYS A 421 8.832 -29.513 -6.072 1.00 0.00 N ATOM 996 CA CYS A 421 9.986 -29.981 -6.778 1.00 0.00 C ATOM 997 C CYS A 421 11.219 -29.821 -5.877 1.00 0.00 C ATOM 998 O CYS A 421 11.190 -29.038 -4.909 1.00 0.00 O ATOM 999 CB CYS A 421 10.154 -29.220 -8.102 1.00 0.00 C ATOM 1000 SG CYS A 421 11.502 -29.811 -9.209 1.00 0.00 S ATOM 0 H CYS A 421 8.617 -28.528 -6.226 1.00 0.00 H new ATOM 0 HA CYS A 421 9.865 -31.035 -7.026 1.00 0.00 H new ATOM 0 HB2 CYS A 421 9.213 -29.271 -8.649 1.00 0.00 H new ATOM 0 HB3 CYS A 421 10.333 -28.169 -7.874 1.00 0.00 H new ATOM 0 HG CYS A 421 11.529 -29.084 -10.286 1.00 0.00 H new ATOM 1005 N GLU A 422 12.276 -30.473 -6.295 1.00 0.00 N ATOM 1006 CA GLU A 422 13.550 -30.701 -5.587 1.00 0.00 C ATOM 1007 C GLU A 422 14.085 -29.579 -4.682 1.00 0.00 C ATOM 1008 O GLU A 422 14.316 -28.439 -5.117 1.00 0.00 O ATOM 1009 CB GLU A 422 14.616 -31.049 -6.606 1.00 0.00 C ATOM 1010 CG GLU A 422 14.344 -32.328 -7.365 1.00 0.00 C ATOM 1011 CD GLU A 422 15.388 -32.598 -8.400 1.00 0.00 C ATOM 1012 OE1 GLU A 422 16.456 -33.132 -8.055 1.00 0.00 O ATOM 1013 OE2 GLU A 422 15.161 -32.282 -9.584 1.00 0.00 O ATOM 0 H GLU A 422 12.286 -30.903 -7.220 1.00 0.00 H new ATOM 0 HA GLU A 422 13.318 -31.508 -4.892 1.00 0.00 H new ATOM 0 HB2 GLU A 422 14.706 -30.228 -7.317 1.00 0.00 H new ATOM 0 HB3 GLU A 422 15.576 -31.137 -6.097 1.00 0.00 H new ATOM 0 HG2 GLU A 422 14.303 -33.163 -6.665 1.00 0.00 H new ATOM 0 HG3 GLU A 422 13.367 -32.265 -7.844 1.00 0.00 H new ATOM 1020 N ILE A 423 14.314 -29.955 -3.434 1.00 0.00 N ATOM 1021 CA ILE A 423 15.013 -29.146 -2.457 1.00 0.00 C ATOM 1022 C ILE A 423 16.292 -29.901 -2.117 1.00 0.00 C ATOM 1023 O ILE A 423 16.264 -30.882 -1.357 1.00 0.00 O ATOM 1024 CB ILE A 423 14.221 -28.928 -1.117 1.00 0.00 C ATOM 1025 CG1 ILE A 423 12.866 -28.260 -1.355 1.00 0.00 C ATOM 1026 CG2 ILE A 423 15.053 -28.095 -0.122 1.00 0.00 C ATOM 1027 CD1 ILE A 423 12.067 -28.025 -0.080 1.00 0.00 C ATOM 0 H ILE A 423 14.009 -30.856 -3.066 1.00 0.00 H new ATOM 0 HA ILE A 423 15.172 -28.158 -2.890 1.00 0.00 H new ATOM 0 HB ILE A 423 14.036 -29.914 -0.691 1.00 0.00 H new ATOM 0 HG12 ILE A 423 13.025 -27.305 -1.855 1.00 0.00 H new ATOM 0 HG13 ILE A 423 12.279 -28.880 -2.032 1.00 0.00 H new ATOM 0 HG21 ILE A 423 14.487 -27.956 0.799 1.00 0.00 H new ATOM 0 HG22 ILE A 423 15.984 -28.617 0.100 1.00 0.00 H new ATOM 0 HG23 ILE A 423 15.278 -27.123 -0.560 1.00 0.00 H new ATOM 0 HD11 ILE A 423 11.119 -27.548 -0.328 1.00 0.00 H new ATOM 0 HD12 ILE A 423 11.876 -28.979 0.411 1.00 0.00 H new ATOM 0 HD13 ILE A 423 12.634 -27.379 0.591 1.00 0.00 H new ATOM 1039 N LYS A 424 17.368 -29.524 -2.730 1.00 0.00 N ATOM 1040 CA LYS A 424 18.645 -30.155 -2.478 1.00 0.00 C ATOM 1041 C LYS A 424 19.412 -29.302 -1.506 1.00 0.00 C ATOM 1042 O LYS A 424 19.931 -29.780 -0.501 1.00 0.00 O ATOM 1043 CB LYS A 424 19.444 -30.291 -3.777 1.00 0.00 C ATOM 1044 CG LYS A 424 20.786 -30.998 -3.605 1.00 0.00 C ATOM 1045 CD LYS A 424 21.599 -31.017 -4.894 1.00 0.00 C ATOM 1046 CE LYS A 424 20.894 -31.761 -6.028 1.00 0.00 C ATOM 1047 NZ LYS A 424 20.620 -33.166 -5.680 1.00 0.00 N ATOM 0 H LYS A 424 17.397 -28.773 -3.420 1.00 0.00 H new ATOM 0 HA LYS A 424 18.482 -31.152 -2.068 1.00 0.00 H new ATOM 0 HB2 LYS A 424 18.846 -30.840 -4.505 1.00 0.00 H new ATOM 0 HB3 LYS A 424 19.618 -29.298 -4.191 1.00 0.00 H new ATOM 0 HG2 LYS A 424 21.359 -30.499 -2.824 1.00 0.00 H new ATOM 0 HG3 LYS A 424 20.615 -32.021 -3.271 1.00 0.00 H new ATOM 0 HD2 LYS A 424 21.799 -29.992 -5.207 1.00 0.00 H new ATOM 0 HD3 LYS A 424 22.564 -31.486 -4.703 1.00 0.00 H new ATOM 0 HE2 LYS A 424 19.957 -31.257 -6.265 1.00 0.00 H new ATOM 0 HE3 LYS A 424 21.512 -31.724 -6.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 424 20.283 -33.673 -6.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 424 21.492 -33.614 -5.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 424 19.892 -33.204 -4.939 1.00 0.00 H new ATOM 1061 N GLY A 425 19.439 -28.033 -1.791 1.00 0.00 N ATOM 1062 CA GLY A 425 20.140 -27.108 -0.974 1.00 0.00 C ATOM 1063 C GLY A 425 19.438 -25.795 -0.976 1.00 0.00 C ATOM 1064 O GLY A 425 18.496 -25.599 -1.751 1.00 0.00 O ATOM 0 H GLY A 425 18.973 -27.618 -2.598 1.00 0.00 H new ATOM 0 HA2 GLY A 425 20.211 -27.490 0.044 1.00 0.00 H new ATOM 0 HA3 GLY A 425 21.159 -26.986 -1.341 1.00 0.00 H new ATOM 1068 N THR A 426 19.864 -24.910 -0.146 1.00 0.00 N ATOM 1069 CA THR A 426 19.256 -23.625 -0.044 1.00 0.00 C ATOM 1070 C THR A 426 20.298 -22.522 -0.179 1.00 0.00 C ATOM 1071 O THR A 426 21.371 -22.615 0.391 1.00 0.00 O ATOM 1072 CB THR A 426 18.475 -23.516 1.285 1.00 0.00 C ATOM 1073 OG1 THR A 426 19.248 -24.090 2.362 1.00 0.00 O ATOM 1074 CG2 THR A 426 17.126 -24.226 1.187 1.00 0.00 C ATOM 0 H THR A 426 20.650 -25.055 0.488 1.00 0.00 H new ATOM 0 HA THR A 426 18.548 -23.500 -0.863 1.00 0.00 H new ATOM 0 HB THR A 426 18.297 -22.460 1.487 1.00 0.00 H new ATOM 0 HG1 THR A 426 18.746 -24.015 3.201 1.00 0.00 H new ATOM 0 HG21 THR A 426 16.597 -24.134 2.135 1.00 0.00 H new ATOM 0 HG22 THR A 426 16.532 -23.771 0.394 1.00 0.00 H new ATOM 0 HG23 THR A 426 17.285 -25.280 0.961 1.00 0.00 H new ATOM 1082 N GLU A 427 19.980 -21.506 -0.930 1.00 0.00 N ATOM 1083 CA GLU A 427 20.881 -20.400 -1.188 1.00 0.00 C ATOM 1084 C GLU A 427 20.238 -19.143 -0.607 1.00 0.00 C ATOM 1085 O GLU A 427 19.057 -18.936 -0.782 1.00 0.00 O ATOM 1086 CB GLU A 427 21.034 -20.236 -2.719 1.00 0.00 C ATOM 1087 CG GLU A 427 21.969 -19.119 -3.184 1.00 0.00 C ATOM 1088 CD GLU A 427 23.435 -19.459 -3.055 1.00 0.00 C ATOM 1089 OE1 GLU A 427 23.992 -19.366 -1.957 1.00 0.00 O ATOM 1090 OE2 GLU A 427 24.065 -19.812 -4.078 1.00 0.00 O ATOM 0 H GLU A 427 19.075 -21.414 -1.391 1.00 0.00 H new ATOM 0 HA GLU A 427 21.860 -20.573 -0.741 1.00 0.00 H new ATOM 0 HB2 GLU A 427 21.394 -21.179 -3.131 1.00 0.00 H new ATOM 0 HB3 GLU A 427 20.047 -20.058 -3.146 1.00 0.00 H new ATOM 0 HG2 GLU A 427 21.750 -18.885 -4.226 1.00 0.00 H new ATOM 0 HG3 GLU A 427 21.762 -18.219 -2.605 1.00 0.00 H new ATOM 1097 N PRO A 428 20.968 -18.340 0.153 1.00 0.00 N ATOM 1098 CA PRO A 428 20.436 -17.090 0.693 1.00 0.00 C ATOM 1099 C PRO A 428 20.224 -16.050 -0.414 1.00 0.00 C ATOM 1100 O PRO A 428 21.066 -15.895 -1.306 1.00 0.00 O ATOM 1101 CB PRO A 428 21.517 -16.626 1.672 1.00 0.00 C ATOM 1102 CG PRO A 428 22.774 -17.296 1.219 1.00 0.00 C ATOM 1103 CD PRO A 428 22.361 -18.583 0.559 1.00 0.00 C ATOM 0 HA PRO A 428 19.462 -17.222 1.165 1.00 0.00 H new ATOM 0 HB2 PRO A 428 21.622 -15.541 1.657 1.00 0.00 H new ATOM 0 HB3 PRO A 428 21.268 -16.908 2.695 1.00 0.00 H new ATOM 0 HG2 PRO A 428 23.322 -16.662 0.522 1.00 0.00 H new ATOM 0 HG3 PRO A 428 23.436 -17.488 2.063 1.00 0.00 H new ATOM 0 HD2 PRO A 428 22.993 -18.813 -0.299 1.00 0.00 H new ATOM 0 HD3 PRO A 428 22.436 -19.426 1.246 1.00 0.00 H new ATOM 1111 N ILE A 429 19.107 -15.370 -0.377 1.00 0.00 N ATOM 1112 CA ILE A 429 18.802 -14.370 -1.376 1.00 0.00 C ATOM 1113 C ILE A 429 19.291 -13.010 -0.900 1.00 0.00 C ATOM 1114 O ILE A 429 19.195 -12.681 0.288 1.00 0.00 O ATOM 1115 CB ILE A 429 17.276 -14.306 -1.690 1.00 0.00 C ATOM 1116 CG1 ILE A 429 16.768 -15.670 -2.137 1.00 0.00 C ATOM 1117 CG2 ILE A 429 16.987 -13.286 -2.784 1.00 0.00 C ATOM 1118 CD1 ILE A 429 15.283 -15.704 -2.436 1.00 0.00 C ATOM 0 H ILE A 429 18.388 -15.489 0.337 1.00 0.00 H new ATOM 0 HA ILE A 429 19.314 -14.649 -2.297 1.00 0.00 H new ATOM 0 HB ILE A 429 16.763 -14.005 -0.777 1.00 0.00 H new ATOM 0 HG12 ILE A 429 17.315 -15.976 -3.028 1.00 0.00 H new ATOM 0 HG13 ILE A 429 16.989 -16.402 -1.360 1.00 0.00 H new ATOM 0 HG21 ILE A 429 15.916 -13.261 -2.984 1.00 0.00 H new ATOM 0 HG22 ILE A 429 17.319 -12.300 -2.459 1.00 0.00 H new ATOM 0 HG23 ILE A 429 17.519 -13.566 -3.693 1.00 0.00 H new ATOM 0 HD11 ILE A 429 14.998 -16.709 -2.748 1.00 0.00 H new ATOM 0 HD12 ILE A 429 14.725 -15.430 -1.541 1.00 0.00 H new ATOM 0 HD13 ILE A 429 15.056 -14.998 -3.235 1.00 0.00 H new ATOM 1130 N VAL A 430 19.815 -12.233 -1.816 1.00 0.00 N ATOM 1131 CA VAL A 430 20.340 -10.932 -1.527 1.00 0.00 C ATOM 1132 C VAL A 430 19.646 -9.959 -2.450 1.00 0.00 C ATOM 1133 O VAL A 430 19.887 -9.938 -3.663 1.00 0.00 O ATOM 1134 CB VAL A 430 21.884 -10.839 -1.727 1.00 0.00 C ATOM 1135 CG1 VAL A 430 22.402 -9.464 -1.314 1.00 0.00 C ATOM 1136 CG2 VAL A 430 22.614 -11.931 -0.950 1.00 0.00 C ATOM 0 H VAL A 430 19.887 -12.497 -2.799 1.00 0.00 H new ATOM 0 HA VAL A 430 20.157 -10.704 -0.477 1.00 0.00 H new ATOM 0 HB VAL A 430 22.085 -10.986 -2.788 1.00 0.00 H new ATOM 0 HG11 VAL A 430 23.481 -9.422 -1.462 1.00 0.00 H new ATOM 0 HG12 VAL A 430 21.922 -8.697 -1.922 1.00 0.00 H new ATOM 0 HG13 VAL A 430 22.173 -9.290 -0.263 1.00 0.00 H new ATOM 0 HG21 VAL A 430 23.688 -11.837 -1.112 1.00 0.00 H new ATOM 0 HG22 VAL A 430 22.397 -11.828 0.113 1.00 0.00 H new ATOM 0 HG23 VAL A 430 22.279 -12.909 -1.296 1.00 0.00 H new ATOM 1146 N VAL A 431 18.751 -9.227 -1.895 1.00 0.00 N ATOM 1147 CA VAL A 431 17.956 -8.276 -2.618 1.00 0.00 C ATOM 1148 C VAL A 431 18.087 -6.918 -1.988 1.00 0.00 C ATOM 1149 O VAL A 431 18.226 -6.805 -0.768 1.00 0.00 O ATOM 1150 CB VAL A 431 16.460 -8.706 -2.686 1.00 0.00 C ATOM 1151 CG1 VAL A 431 16.233 -9.658 -3.848 1.00 0.00 C ATOM 1152 CG2 VAL A 431 16.058 -9.407 -1.391 1.00 0.00 C ATOM 0 H VAL A 431 18.537 -9.266 -0.898 1.00 0.00 H new ATOM 0 HA VAL A 431 18.327 -8.235 -3.642 1.00 0.00 H new ATOM 0 HB VAL A 431 15.855 -7.810 -2.827 1.00 0.00 H new ATOM 0 HG11 VAL A 431 15.183 -9.948 -3.881 1.00 0.00 H new ATOM 0 HG12 VAL A 431 16.502 -9.164 -4.781 1.00 0.00 H new ATOM 0 HG13 VAL A 431 16.851 -10.546 -3.717 1.00 0.00 H new ATOM 0 HG21 VAL A 431 15.011 -9.704 -1.448 1.00 0.00 H new ATOM 0 HG22 VAL A 431 16.679 -10.292 -1.248 1.00 0.00 H new ATOM 0 HG23 VAL A 431 16.197 -8.727 -0.551 1.00 0.00 H new ATOM 1162 N ASP A 432 18.095 -5.910 -2.809 1.00 0.00 N ATOM 1163 CA ASP A 432 18.213 -4.555 -2.341 1.00 0.00 C ATOM 1164 C ASP A 432 16.857 -3.944 -2.162 1.00 0.00 C ATOM 1165 O ASP A 432 15.960 -4.153 -2.982 1.00 0.00 O ATOM 1166 CB ASP A 432 19.053 -3.680 -3.286 1.00 0.00 C ATOM 1167 CG ASP A 432 20.537 -3.940 -3.201 1.00 0.00 C ATOM 1168 OD1 ASP A 432 21.057 -4.822 -3.950 1.00 0.00 O ATOM 1169 OD2 ASP A 432 21.229 -3.241 -2.413 1.00 0.00 O ATOM 0 H ASP A 432 18.020 -6.001 -3.822 1.00 0.00 H new ATOM 0 HA ASP A 432 18.729 -4.596 -1.382 1.00 0.00 H new ATOM 0 HB2 ASP A 432 18.723 -3.848 -4.311 1.00 0.00 H new ATOM 0 HB3 ASP A 432 18.864 -2.631 -3.058 1.00 0.00 H new ATOM 1174 N PRO A 433 16.665 -3.210 -1.077 1.00 0.00 N ATOM 1175 CA PRO A 433 15.420 -2.532 -0.822 1.00 0.00 C ATOM 1176 C PRO A 433 15.227 -1.318 -1.749 1.00 0.00 C ATOM 1177 O PRO A 433 15.829 -0.251 -1.545 1.00 0.00 O ATOM 1178 CB PRO A 433 15.532 -2.092 0.645 1.00 0.00 C ATOM 1179 CG PRO A 433 16.993 -2.020 0.922 1.00 0.00 C ATOM 1180 CD PRO A 433 17.648 -3.014 0.011 1.00 0.00 C ATOM 0 HA PRO A 433 14.559 -3.173 -1.009 1.00 0.00 H new ATOM 0 HB2 PRO A 433 15.053 -1.126 0.804 1.00 0.00 H new ATOM 0 HB3 PRO A 433 15.040 -2.804 1.308 1.00 0.00 H new ATOM 0 HG2 PRO A 433 17.374 -1.015 0.738 1.00 0.00 H new ATOM 0 HG3 PRO A 433 17.202 -2.254 1.966 1.00 0.00 H new ATOM 0 HD2 PRO A 433 18.597 -2.639 -0.372 1.00 0.00 H new ATOM 0 HD3 PRO A 433 17.861 -3.949 0.529 1.00 0.00 H new ATOM 1188 N PHE A 434 14.475 -1.514 -2.810 1.00 0.00 N ATOM 1189 CA PHE A 434 14.139 -0.425 -3.712 1.00 0.00 C ATOM 1190 C PHE A 434 12.820 0.167 -3.237 1.00 0.00 C ATOM 1191 O PHE A 434 12.750 1.336 -2.817 1.00 0.00 O ATOM 1192 CB PHE A 434 14.024 -0.930 -5.156 1.00 0.00 C ATOM 1193 CG PHE A 434 15.246 -1.671 -5.648 1.00 0.00 C ATOM 1194 CD1 PHE A 434 16.453 -1.013 -5.826 1.00 0.00 C ATOM 1195 CD2 PHE A 434 15.177 -3.024 -5.944 1.00 0.00 C ATOM 1196 CE1 PHE A 434 17.568 -1.691 -6.286 1.00 0.00 C ATOM 1197 CE2 PHE A 434 16.288 -3.706 -6.404 1.00 0.00 C ATOM 1198 CZ PHE A 434 17.484 -3.038 -6.575 1.00 0.00 C ATOM 0 H PHE A 434 14.082 -2.418 -3.073 1.00 0.00 H new ATOM 0 HA PHE A 434 14.921 0.334 -3.703 1.00 0.00 H new ATOM 0 HB2 PHE A 434 13.158 -1.588 -5.232 1.00 0.00 H new ATOM 0 HB3 PHE A 434 13.838 -0.081 -5.813 1.00 0.00 H new ATOM 0 HD1 PHE A 434 16.524 0.041 -5.603 1.00 0.00 H new ATOM 0 HD2 PHE A 434 14.244 -3.552 -5.814 1.00 0.00 H new ATOM 0 HE1 PHE A 434 18.503 -1.167 -6.419 1.00 0.00 H new ATOM 0 HE2 PHE A 434 16.220 -4.760 -6.629 1.00 0.00 H new ATOM 0 HZ PHE A 434 18.353 -3.569 -6.935 1.00 0.00 H new ATOM 1208 N ASP A 435 11.792 -0.646 -3.283 1.00 0.00 N ATOM 1209 CA ASP A 435 10.505 -0.326 -2.688 1.00 0.00 C ATOM 1210 C ASP A 435 10.174 -1.433 -1.724 1.00 0.00 C ATOM 1211 O ASP A 435 9.544 -2.421 -2.094 1.00 0.00 O ATOM 1212 CB ASP A 435 9.377 -0.150 -3.726 1.00 0.00 C ATOM 1213 CG ASP A 435 9.492 1.130 -4.518 1.00 0.00 C ATOM 1214 OD1 ASP A 435 8.936 2.165 -4.085 1.00 0.00 O ATOM 1215 OD2 ASP A 435 10.140 1.139 -5.587 1.00 0.00 O ATOM 0 H ASP A 435 11.820 -1.559 -3.738 1.00 0.00 H new ATOM 0 HA ASP A 435 10.580 0.637 -2.183 1.00 0.00 H new ATOM 0 HB2 ASP A 435 9.388 -0.997 -4.412 1.00 0.00 H new ATOM 0 HB3 ASP A 435 8.415 -0.168 -3.214 1.00 0.00 H new ATOM 1220 N PRO A 436 10.682 -1.339 -0.490 1.00 0.00 N ATOM 1221 CA PRO A 436 10.570 -2.398 0.494 1.00 0.00 C ATOM 1222 C PRO A 436 9.459 -2.178 1.524 1.00 0.00 C ATOM 1223 O PRO A 436 8.662 -1.240 1.421 1.00 0.00 O ATOM 1224 CB PRO A 436 11.919 -2.272 1.183 1.00 0.00 C ATOM 1225 CG PRO A 436 12.142 -0.787 1.261 1.00 0.00 C ATOM 1226 CD PRO A 436 11.435 -0.188 0.062 1.00 0.00 C ATOM 0 HA PRO A 436 10.329 -3.361 0.044 1.00 0.00 H new ATOM 0 HB2 PRO A 436 11.907 -2.728 2.173 1.00 0.00 H new ATOM 0 HB3 PRO A 436 12.707 -2.766 0.614 1.00 0.00 H new ATOM 0 HG2 PRO A 436 11.742 -0.382 2.191 1.00 0.00 H new ATOM 0 HG3 PRO A 436 13.206 -0.552 1.242 1.00 0.00 H new ATOM 0 HD2 PRO A 436 10.772 0.627 0.350 1.00 0.00 H new ATOM 0 HD3 PRO A 436 12.142 0.217 -0.662 1.00 0.00 H new ATOM 1234 N ARG A 437 9.440 -3.070 2.505 1.00 0.00 N ATOM 1235 CA ARG A 437 8.566 -3.036 3.673 1.00 0.00 C ATOM 1236 C ARG A 437 8.974 -4.146 4.612 1.00 0.00 C ATOM 1237 O ARG A 437 10.064 -4.725 4.433 1.00 0.00 O ATOM 1238 CB ARG A 437 7.056 -3.126 3.344 1.00 0.00 C ATOM 1239 CG ARG A 437 6.626 -4.315 2.497 1.00 0.00 C ATOM 1240 CD ARG A 437 5.104 -4.363 2.344 1.00 0.00 C ATOM 1241 NE ARG A 437 4.413 -4.844 3.564 1.00 0.00 N ATOM 1242 CZ ARG A 437 3.211 -4.417 4.006 1.00 0.00 C ATOM 1243 NH1 ARG A 437 2.648 -3.326 3.486 1.00 0.00 N ATOM 1244 NH2 ARG A 437 2.591 -5.071 4.994 1.00 0.00 N ATOM 0 H ARG A 437 10.064 -3.877 2.509 1.00 0.00 H new ATOM 0 HA ARG A 437 8.693 -2.060 4.141 1.00 0.00 H new ATOM 0 HB2 ARG A 437 6.501 -3.154 4.282 1.00 0.00 H new ATOM 0 HB3 ARG A 437 6.762 -2.212 2.827 1.00 0.00 H new ATOM 0 HG2 ARG A 437 7.091 -4.252 1.513 1.00 0.00 H new ATOM 0 HG3 ARG A 437 6.977 -5.239 2.957 1.00 0.00 H new ATOM 0 HD2 ARG A 437 4.738 -3.367 2.095 1.00 0.00 H new ATOM 0 HD3 ARG A 437 4.849 -5.015 1.508 1.00 0.00 H new ATOM 0 HE ARG A 437 4.886 -5.559 4.117 1.00 0.00 H new ATOM 0 HH11 ARG A 437 3.126 -2.808 2.749 1.00 0.00 H new ATOM 0 HH12 ARG A 437 1.740 -3.010 3.825 1.00 0.00 H new ATOM 0 HH21 ARG A 437 3.026 -5.892 5.414 1.00 0.00 H new ATOM 0 HH22 ARG A 437 1.683 -4.748 5.328 1.00 0.00 H new TER 1258 ARG A 437 HETATM 1259 ZN ZN A 500 7.295 -16.776 3.493 1.00 0.00 ZN HETATM 1260 ZN ZN A 600 10.349 -25.720 -6.528 1.00 0.00 ZN