USER MOD reduce.3.24.130724 H: found=0, std=0, add=668, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 669 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 109 HIS : no HD1:sc= -0.917 K(o=-6.4,f=-8.7) USER MOD Set 1.2: A 111 GLN : amide:sc= -5.47! C(o=-6.4!,f=-10!) USER MOD Set 2.1: A 21 CYS SG : rot 90:sc= 0.501 USER MOD Set 2.2: A 51 TYR OH : rot 63:sc= 1.2 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= -0.481 USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= -0.0447 K(o=-0.045,f=-0.91) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.257 K(o=-0.26,f=-3.7!) USER MOD Single : A 41 GLN : amide:sc= -0.904 K(o=-0.9,f=-3.2!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 HIS :FLIP no HD1:sc= 0 F(o=-0.78,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 176:sc= 0.01 (180deg=0.0084) USER MOD Single : A 65 ASN : amide:sc= -0.237 K(o=-0.24,f=-0.9) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.108 USER MOD Single : A 99 ASN : amide:sc= -0.118 K(o=-0.12,f=-1.3) USER MOD Single : A 100 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.12) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS :FLIP no HD1:sc= -0.078 F(o=-0.7,f=-0.078) USER MOD Single : A 108 ASN : amide:sc= -2.19 K(o=-2.2,f=-5.3!) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 TYR OH : rot 5:sc= 0.0353 USER MOD Single : A 117 MET CE :methyl 172:sc= -0.0155 (180deg=-0.0238) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0365 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 140 N VAL A 13 -59.639 -3.734 6.435 1.00 0.00 N ATOM 141 CA VAL A 13 -59.397 -2.331 6.729 1.00 0.00 C ATOM 142 C VAL A 13 -59.903 -2.015 8.137 1.00 0.00 C ATOM 143 O VAL A 13 -60.894 -2.588 8.588 1.00 0.00 O ATOM 144 CB VAL A 13 -60.038 -1.454 5.652 1.00 0.00 C ATOM 145 CG1 VAL A 13 -60.260 -0.030 6.166 1.00 0.00 C ATOM 146 CG2 VAL A 13 -59.196 -1.451 4.374 1.00 0.00 C ATOM 0 HA VAL A 13 -58.329 -2.115 6.712 1.00 0.00 H new ATOM 0 HB VAL A 13 -61.012 -1.879 5.410 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -60.717 0.573 5.381 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -60.919 -0.055 7.034 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -59.303 0.408 6.449 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -59.674 -0.820 3.625 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -58.202 -1.063 4.594 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -59.112 -2.468 3.991 1.00 0.00 H new ATOM 156 N GLU A 14 -59.201 -1.103 8.793 1.00 0.00 N ATOM 157 CA GLU A 14 -59.567 -0.703 10.141 1.00 0.00 C ATOM 158 C GLU A 14 -59.963 0.774 10.168 1.00 0.00 C ATOM 159 O GLU A 14 -59.252 1.621 9.629 1.00 0.00 O ATOM 160 CB GLU A 14 -58.428 -0.984 11.124 1.00 0.00 C ATOM 161 CG GLU A 14 -58.186 -2.487 11.269 1.00 0.00 C ATOM 162 CD GLU A 14 -57.619 -2.821 12.650 1.00 0.00 C ATOM 163 OE1 GLU A 14 -58.006 -2.118 13.608 1.00 0.00 O ATOM 164 OE2 GLU A 14 -56.810 -3.773 12.716 1.00 0.00 O ATOM 0 H GLU A 14 -58.380 -0.629 8.416 1.00 0.00 H new ATOM 0 HA GLU A 14 -60.427 -1.295 10.454 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -57.516 -0.497 10.778 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -58.669 -0.555 12.097 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -59.121 -3.026 11.116 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -57.494 -2.824 10.497 1.00 0.00 H new ATOM 171 N ILE A 15 -61.096 1.039 10.801 1.00 0.00 N ATOM 172 CA ILE A 15 -61.595 2.400 10.905 1.00 0.00 C ATOM 173 C ILE A 15 -60.870 3.119 12.044 1.00 0.00 C ATOM 174 O ILE A 15 -60.417 2.483 12.995 1.00 0.00 O ATOM 175 CB ILE A 15 -63.119 2.402 11.047 1.00 0.00 C ATOM 176 CG1 ILE A 15 -63.766 1.458 10.031 1.00 0.00 C ATOM 177 CG2 ILE A 15 -63.676 3.824 10.944 1.00 0.00 C ATOM 178 CD1 ILE A 15 -63.497 1.925 8.599 1.00 0.00 C ATOM 0 H ILE A 15 -61.683 0.334 11.247 1.00 0.00 H new ATOM 0 HA ILE A 15 -61.382 2.955 9.991 1.00 0.00 H new ATOM 0 HB ILE A 15 -63.371 2.028 12.039 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -63.377 0.449 10.167 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -64.841 1.411 10.206 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -64.761 3.798 11.048 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -63.250 4.440 11.736 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -63.414 4.248 9.974 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -63.968 1.237 7.897 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -63.909 2.924 8.459 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -62.422 1.947 8.419 1.00 0.00 H new ATOM 190 N GLY A 16 -60.783 4.434 11.911 1.00 0.00 N ATOM 191 CA GLY A 16 -60.121 5.246 12.917 1.00 0.00 C ATOM 192 C GLY A 16 -58.629 5.392 12.610 1.00 0.00 C ATOM 193 O GLY A 16 -58.005 6.377 13.000 1.00 0.00 O ATOM 0 H GLY A 16 -61.160 4.958 11.121 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -60.586 6.231 12.957 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -60.251 4.792 13.899 1.00 0.00 H new ATOM 197 N GLU A 17 -58.102 4.396 11.913 1.00 0.00 N ATOM 198 CA GLU A 17 -56.695 4.401 11.549 1.00 0.00 C ATOM 199 C GLU A 17 -56.488 5.167 10.241 1.00 0.00 C ATOM 200 O GLU A 17 -57.443 5.421 9.508 1.00 0.00 O ATOM 201 CB GLU A 17 -56.152 2.975 11.440 1.00 0.00 C ATOM 202 CG GLU A 17 -55.662 2.470 12.799 1.00 0.00 C ATOM 203 CD GLU A 17 -56.490 1.272 13.270 1.00 0.00 C ATOM 204 OE1 GLU A 17 -57.522 1.519 13.930 1.00 0.00 O ATOM 205 OE2 GLU A 17 -56.071 0.136 12.959 1.00 0.00 O ATOM 0 H GLU A 17 -58.623 3.581 11.591 1.00 0.00 H new ATOM 0 HA GLU A 17 -56.138 4.908 12.337 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -56.931 2.313 11.061 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -55.333 2.948 10.721 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -54.612 2.186 12.728 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -55.726 3.272 13.534 1.00 0.00 H new ATOM 212 N THR A 18 -55.235 5.514 9.988 1.00 0.00 N ATOM 213 CA THR A 18 -54.890 6.247 8.781 1.00 0.00 C ATOM 214 C THR A 18 -54.172 5.330 7.788 1.00 0.00 C ATOM 215 O THR A 18 -53.346 4.508 8.181 1.00 0.00 O ATOM 216 CB THR A 18 -54.063 7.467 9.188 1.00 0.00 C ATOM 217 OG1 THR A 18 -54.822 8.069 10.233 1.00 0.00 O ATOM 218 CG2 THR A 18 -54.020 8.537 8.096 1.00 0.00 C ATOM 0 H THR A 18 -54.446 5.301 10.598 1.00 0.00 H new ATOM 0 HA THR A 18 -55.782 6.600 8.264 1.00 0.00 H new ATOM 0 HB THR A 18 -53.047 7.152 9.428 1.00 0.00 H new ATOM 0 HG1 THR A 18 -54.356 8.868 10.557 1.00 0.00 H new ATOM 0 HG21 THR A 18 -53.420 9.381 8.437 1.00 0.00 H new ATOM 0 HG22 THR A 18 -53.576 8.118 7.193 1.00 0.00 H new ATOM 0 HG23 THR A 18 -55.033 8.876 7.879 1.00 0.00 H new ATOM 226 N TYR A 19 -54.514 5.503 6.519 1.00 0.00 N ATOM 227 CA TYR A 19 -53.912 4.702 5.467 1.00 0.00 C ATOM 228 C TYR A 19 -53.462 5.581 4.298 1.00 0.00 C ATOM 229 O TYR A 19 -53.907 6.720 4.165 1.00 0.00 O ATOM 230 CB TYR A 19 -55.009 3.752 4.981 1.00 0.00 C ATOM 231 CG TYR A 19 -55.434 2.710 6.018 1.00 0.00 C ATOM 232 CD1 TYR A 19 -56.048 3.111 7.187 1.00 0.00 C ATOM 233 CD2 TYR A 19 -55.202 1.370 5.785 1.00 0.00 C ATOM 234 CE1 TYR A 19 -56.448 2.131 8.163 1.00 0.00 C ATOM 235 CE2 TYR A 19 -55.602 0.390 6.761 1.00 0.00 C ATOM 236 CZ TYR A 19 -56.205 0.818 7.902 1.00 0.00 C ATOM 237 OH TYR A 19 -56.583 -0.108 8.824 1.00 0.00 O ATOM 0 H TYR A 19 -55.200 6.186 6.196 1.00 0.00 H new ATOM 0 HA TYR A 19 -53.035 4.173 5.841 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -55.881 4.338 4.692 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -54.659 3.237 4.086 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -56.228 4.160 7.370 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -54.720 1.056 4.871 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -56.930 2.431 9.082 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -55.427 -0.662 6.591 1.00 0.00 H new ATOM 0 HH TYR A 19 -56.348 -1.004 8.503 1.00 0.00 H new ATOM 247 N LEU A 20 -52.583 5.019 3.481 1.00 0.00 N ATOM 248 CA LEU A 20 -52.068 5.737 2.328 1.00 0.00 C ATOM 249 C LEU A 20 -53.021 5.549 1.146 1.00 0.00 C ATOM 250 O LEU A 20 -53.193 4.435 0.654 1.00 0.00 O ATOM 251 CB LEU A 20 -50.629 5.311 2.031 1.00 0.00 C ATOM 252 CG LEU A 20 -49.643 5.419 3.196 1.00 0.00 C ATOM 253 CD1 LEU A 20 -49.531 6.864 3.687 1.00 0.00 C ATOM 254 CD2 LEU A 20 -50.019 4.458 4.325 1.00 0.00 C ATOM 0 H LEU A 20 -52.215 4.075 3.595 1.00 0.00 H new ATOM 0 HA LEU A 20 -52.024 6.806 2.535 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -50.641 4.277 1.686 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -50.254 5.918 1.207 1.00 0.00 H new ATOM 0 HG LEU A 20 -48.657 5.123 2.837 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -48.824 6.913 4.515 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -49.181 7.499 2.873 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -50.508 7.211 4.023 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -49.302 4.556 5.140 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -51.018 4.698 4.690 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -50.006 3.434 3.951 1.00 0.00 H new ATOM 266 N CYS A 21 -53.616 6.655 0.725 1.00 0.00 N ATOM 267 CA CYS A 21 -54.548 6.626 -0.389 1.00 0.00 C ATOM 268 C CYS A 21 -53.817 7.118 -1.640 1.00 0.00 C ATOM 269 O CYS A 21 -53.191 8.177 -1.621 1.00 0.00 O ATOM 270 CB CYS A 21 -55.803 7.452 -0.099 1.00 0.00 C ATOM 271 SG CYS A 21 -57.120 7.031 -1.298 1.00 0.00 S ATOM 0 H CYS A 21 -53.471 7.577 1.136 1.00 0.00 H new ATOM 0 HA CYS A 21 -54.894 5.605 -0.550 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -56.149 7.259 0.916 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -55.571 8.515 -0.160 1.00 0.00 H new ATOM 0 HG CYS A 21 -57.835 6.051 -0.831 1.00 0.00 H new ATOM 277 N ARG A 22 -53.920 6.326 -2.697 1.00 0.00 N ATOM 278 CA ARG A 22 -53.277 6.668 -3.954 1.00 0.00 C ATOM 279 C ARG A 22 -53.719 8.058 -4.416 1.00 0.00 C ATOM 280 O ARG A 22 -54.775 8.543 -4.013 1.00 0.00 O ATOM 281 CB ARG A 22 -53.614 5.646 -5.041 1.00 0.00 C ATOM 282 CG ARG A 22 -52.379 5.311 -5.880 1.00 0.00 C ATOM 283 CD ARG A 22 -52.261 3.802 -6.104 1.00 0.00 C ATOM 284 NE ARG A 22 -52.286 3.502 -7.553 1.00 0.00 N ATOM 285 CZ ARG A 22 -51.837 2.360 -8.092 1.00 0.00 C ATOM 286 NH1 ARG A 22 -51.326 1.404 -7.305 1.00 0.00 N ATOM 287 NH2 ARG A 22 -51.899 2.175 -9.418 1.00 0.00 N ATOM 0 H ARG A 22 -54.439 5.448 -2.709 1.00 0.00 H new ATOM 0 HA ARG A 22 -52.200 6.662 -3.787 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -54.004 4.737 -4.583 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -54.400 6.041 -5.685 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -52.439 5.821 -6.841 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -51.484 5.679 -5.379 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -51.335 3.432 -5.664 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -53.081 3.286 -5.603 1.00 0.00 H new ATOM 0 HE ARG A 22 -52.669 4.209 -8.181 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -51.279 1.545 -6.296 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -50.984 0.535 -7.715 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -52.288 2.903 -10.017 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -51.557 1.306 -9.828 1.00 0.00 H new ATOM 376 N TRP A 28 -48.743 8.900 -3.009 1.00 0.00 N ATOM 377 CA TRP A 28 -49.699 8.435 -2.018 1.00 0.00 C ATOM 378 C TRP A 28 -49.841 9.523 -0.952 1.00 0.00 C ATOM 379 O TRP A 28 -48.876 10.216 -0.634 1.00 0.00 O ATOM 380 CB TRP A 28 -49.275 7.083 -1.440 1.00 0.00 C ATOM 381 CG TRP A 28 -49.418 5.916 -2.419 1.00 0.00 C ATOM 382 CD1 TRP A 28 -48.832 5.766 -3.615 1.00 0.00 C ATOM 383 CD2 TRP A 28 -50.225 4.734 -2.235 1.00 0.00 C ATOM 384 NE1 TRP A 28 -49.201 4.578 -4.213 1.00 0.00 N ATOM 385 CE2 TRP A 28 -50.075 3.931 -3.347 1.00 0.00 C ATOM 386 CE3 TRP A 28 -51.054 4.355 -1.165 1.00 0.00 C ATOM 387 CZ2 TRP A 28 -50.724 2.699 -3.497 1.00 0.00 C ATOM 388 CZ3 TRP A 28 -51.696 3.122 -1.329 1.00 0.00 C ATOM 389 CH2 TRP A 28 -51.555 2.302 -2.443 1.00 0.00 C ATOM 0 HA TRP A 28 -50.675 8.264 -2.473 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -48.236 7.147 -1.116 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -49.873 6.875 -0.553 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -48.156 6.484 -4.055 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -48.890 4.238 -5.123 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -51.185 4.967 -0.285 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -50.591 2.089 -4.378 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -52.346 2.784 -0.535 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -52.085 1.362 -2.495 1.00 0.00 H new ATOM 400 N HIS A 29 -51.053 9.639 -0.428 1.00 0.00 N ATOM 401 CA HIS A 29 -51.334 10.631 0.596 1.00 0.00 C ATOM 402 C HIS A 29 -52.166 9.995 1.711 1.00 0.00 C ATOM 403 O HIS A 29 -53.189 9.366 1.445 1.00 0.00 O ATOM 404 CB HIS A 29 -52.002 11.866 -0.013 1.00 0.00 C ATOM 405 CG HIS A 29 -51.164 13.119 0.067 1.00 0.00 C ATOM 406 ND1 HIS A 29 -51.122 13.923 1.193 1.00 0.00 N ATOM 407 CD2 HIS A 29 -50.336 13.698 -0.850 1.00 0.00 C ATOM 408 CE1 HIS A 29 -50.304 14.937 0.952 1.00 0.00 C ATOM 409 NE2 HIS A 29 -49.818 14.796 -0.314 1.00 0.00 N ATOM 0 H HIS A 29 -51.851 9.062 -0.694 1.00 0.00 H new ATOM 0 HA HIS A 29 -50.400 10.977 1.039 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -52.234 11.663 -1.058 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -52.950 12.042 0.496 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -50.136 13.326 -1.844 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -50.064 15.736 1.638 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -49.164 15.430 -0.773 1.00 0.00 H new ATOM 417 N SER A 30 -51.696 10.182 2.936 1.00 0.00 N ATOM 418 CA SER A 30 -52.385 9.634 4.092 1.00 0.00 C ATOM 419 C SER A 30 -53.858 10.044 4.067 1.00 0.00 C ATOM 420 O SER A 30 -54.218 11.044 3.446 1.00 0.00 O ATOM 421 CB SER A 30 -51.727 10.097 5.394 1.00 0.00 C ATOM 422 OG SER A 30 -51.387 11.480 5.358 1.00 0.00 O ATOM 0 H SER A 30 -50.847 10.705 3.153 1.00 0.00 H new ATOM 0 HA SER A 30 -52.317 8.547 4.048 1.00 0.00 H new ATOM 0 HB2 SER A 30 -52.404 9.912 6.228 1.00 0.00 H new ATOM 0 HB3 SER A 30 -50.828 9.507 5.576 1.00 0.00 H new ATOM 0 HG SER A 30 -50.971 11.737 6.207 1.00 0.00 H new ATOM 428 N ALA A 31 -54.672 9.252 4.749 1.00 0.00 N ATOM 429 CA ALA A 31 -56.099 9.520 4.813 1.00 0.00 C ATOM 430 C ALA A 31 -56.723 8.675 5.925 1.00 0.00 C ATOM 431 O ALA A 31 -56.633 7.449 5.903 1.00 0.00 O ATOM 432 CB ALA A 31 -56.731 9.246 3.447 1.00 0.00 C ATOM 0 H ALA A 31 -54.370 8.424 5.263 1.00 0.00 H new ATOM 0 HA ALA A 31 -56.283 10.567 5.053 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -57.801 9.447 3.494 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -56.273 9.892 2.698 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -56.569 8.203 3.174 1.00 0.00 H new ATOM 438 N GLU A 32 -57.343 9.365 6.871 1.00 0.00 N ATOM 439 CA GLU A 32 -57.982 8.693 7.990 1.00 0.00 C ATOM 440 C GLU A 32 -59.266 8.000 7.529 1.00 0.00 C ATOM 441 O GLU A 32 -60.069 8.588 6.807 1.00 0.00 O ATOM 442 CB GLU A 32 -58.267 9.674 9.129 1.00 0.00 C ATOM 443 CG GLU A 32 -59.345 10.683 8.727 1.00 0.00 C ATOM 444 CD GLU A 32 -59.861 11.449 9.947 1.00 0.00 C ATOM 445 OE1 GLU A 32 -59.930 10.819 11.024 1.00 0.00 O ATOM 446 OE2 GLU A 32 -60.176 12.646 9.773 1.00 0.00 O ATOM 0 H GLU A 32 -57.417 10.382 6.886 1.00 0.00 H new ATOM 0 HA GLU A 32 -57.299 7.934 8.371 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -58.589 9.125 10.014 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -57.352 10.202 9.397 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -58.938 11.384 7.998 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -60.172 10.164 8.243 1.00 0.00 H new ATOM 453 N VAL A 33 -59.420 6.758 7.966 1.00 0.00 N ATOM 454 CA VAL A 33 -60.592 5.979 7.608 1.00 0.00 C ATOM 455 C VAL A 33 -61.758 6.371 8.518 1.00 0.00 C ATOM 456 O VAL A 33 -61.772 6.027 9.699 1.00 0.00 O ATOM 457 CB VAL A 33 -60.265 4.485 7.666 1.00 0.00 C ATOM 458 CG1 VAL A 33 -61.412 3.650 7.091 1.00 0.00 C ATOM 459 CG2 VAL A 33 -58.951 4.183 6.944 1.00 0.00 C ATOM 0 H VAL A 33 -58.752 6.273 8.565 1.00 0.00 H new ATOM 0 HA VAL A 33 -60.894 6.193 6.583 1.00 0.00 H new ATOM 0 HB VAL A 33 -60.142 4.209 8.713 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -61.154 2.592 7.144 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -62.319 3.832 7.668 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -61.581 3.931 6.051 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -58.742 3.115 7.000 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -59.033 4.482 5.899 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -58.140 4.737 7.417 1.00 0.00 H new ATOM 469 N ILE A 34 -62.708 7.086 7.933 1.00 0.00 N ATOM 470 CA ILE A 34 -63.875 7.529 8.676 1.00 0.00 C ATOM 471 C ILE A 34 -64.750 6.320 9.013 1.00 0.00 C ATOM 472 O ILE A 34 -64.998 6.035 10.183 1.00 0.00 O ATOM 473 CB ILE A 34 -64.614 8.628 7.909 1.00 0.00 C ATOM 474 CG1 ILE A 34 -63.652 9.736 7.476 1.00 0.00 C ATOM 475 CG2 ILE A 34 -65.787 9.174 8.726 1.00 0.00 C ATOM 476 CD1 ILE A 34 -63.597 10.853 8.520 1.00 0.00 C ATOM 0 H ILE A 34 -62.693 7.369 6.953 1.00 0.00 H new ATOM 0 HA ILE A 34 -63.575 7.979 9.622 1.00 0.00 H new ATOM 0 HB ILE A 34 -65.030 8.190 7.002 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -62.655 9.320 7.330 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -63.970 10.145 6.517 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -66.295 9.953 8.158 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -66.487 8.367 8.941 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -65.416 9.591 9.662 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -62.906 11.628 8.188 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -64.591 11.283 8.646 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -63.255 10.445 9.471 1.00 0.00 H new ATOM 488 N GLN A 35 -65.194 5.641 7.965 1.00 0.00 N ATOM 489 CA GLN A 35 -66.035 4.469 8.134 1.00 0.00 C ATOM 490 C GLN A 35 -65.835 3.499 6.968 1.00 0.00 C ATOM 491 O GLN A 35 -64.943 3.690 6.143 1.00 0.00 O ATOM 492 CB GLN A 35 -67.507 4.865 8.272 1.00 0.00 C ATOM 493 CG GLN A 35 -67.926 4.917 9.742 1.00 0.00 C ATOM 494 CD GLN A 35 -68.222 3.514 10.277 1.00 0.00 C ATOM 495 OE1 GLN A 35 -68.789 2.671 9.602 1.00 0.00 O ATOM 496 NE2 GLN A 35 -67.807 3.312 11.525 1.00 0.00 N ATOM 0 H GLN A 35 -64.987 5.881 6.995 1.00 0.00 H new ATOM 0 HA GLN A 35 -65.741 3.965 9.055 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -67.670 5.838 7.809 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -68.131 4.149 7.737 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -67.134 5.376 10.334 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -68.810 5.545 9.850 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -67.338 4.061 12.034 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -67.957 2.408 11.972 1.00 0.00 H new ATOM 505 N SER A 36 -66.681 2.479 6.937 1.00 0.00 N ATOM 506 CA SER A 36 -66.608 1.479 5.885 1.00 0.00 C ATOM 507 C SER A 36 -68.014 1.148 5.380 1.00 0.00 C ATOM 508 O SER A 36 -68.968 1.132 6.155 1.00 0.00 O ATOM 509 CB SER A 36 -65.909 0.210 6.379 1.00 0.00 C ATOM 510 OG SER A 36 -66.433 -0.236 7.627 1.00 0.00 O ATOM 0 H SER A 36 -67.420 2.324 7.623 1.00 0.00 H new ATOM 0 HA SER A 36 -66.020 1.889 5.063 1.00 0.00 H new ATOM 0 HB2 SER A 36 -66.022 -0.579 5.636 1.00 0.00 H new ATOM 0 HB3 SER A 36 -64.841 0.401 6.482 1.00 0.00 H new ATOM 0 HG SER A 36 -65.963 -1.049 7.908 1.00 0.00 H new ATOM 516 N ARG A 37 -68.096 0.892 4.082 1.00 0.00 N ATOM 517 CA ARG A 37 -69.369 0.563 3.464 1.00 0.00 C ATOM 518 C ARG A 37 -69.156 -0.383 2.280 1.00 0.00 C ATOM 519 O ARG A 37 -68.087 -0.390 1.672 1.00 0.00 O ATOM 520 CB ARG A 37 -70.088 1.823 2.978 1.00 0.00 C ATOM 521 CG ARG A 37 -69.360 2.444 1.785 1.00 0.00 C ATOM 522 CD ARG A 37 -70.197 3.557 1.150 1.00 0.00 C ATOM 523 NE ARG A 37 -70.209 3.404 -0.322 1.00 0.00 N ATOM 524 CZ ARG A 37 -70.947 4.157 -1.149 1.00 0.00 C ATOM 525 NH1 ARG A 37 -71.737 5.119 -0.653 1.00 0.00 N ATOM 526 NH2 ARG A 37 -70.895 3.948 -2.471 1.00 0.00 N ATOM 0 H ARG A 37 -67.302 0.906 3.442 1.00 0.00 H new ATOM 0 HA ARG A 37 -69.986 0.074 4.218 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -71.111 1.576 2.696 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -70.148 2.548 3.790 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -68.400 2.846 2.109 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -69.149 1.674 1.043 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -71.216 3.522 1.536 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -69.787 4.530 1.419 1.00 0.00 H new ATOM 0 HE ARG A 37 -69.619 2.680 -0.733 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -71.776 5.278 0.354 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -72.299 5.692 -1.282 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -70.294 3.216 -2.848 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -71.457 4.521 -3.100 1.00 0.00 H new ATOM 540 N VAL A 38 -70.190 -1.158 1.989 1.00 0.00 N ATOM 541 CA VAL A 38 -70.129 -2.105 0.889 1.00 0.00 C ATOM 542 C VAL A 38 -71.268 -1.817 -0.091 1.00 0.00 C ATOM 543 O VAL A 38 -72.366 -1.445 0.321 1.00 0.00 O ATOM 544 CB VAL A 38 -70.153 -3.537 1.429 1.00 0.00 C ATOM 545 CG1 VAL A 38 -70.701 -4.509 0.382 1.00 0.00 C ATOM 546 CG2 VAL A 38 -68.763 -3.967 1.903 1.00 0.00 C ATOM 0 H VAL A 38 -71.075 -1.150 2.496 1.00 0.00 H new ATOM 0 HA VAL A 38 -69.193 -1.994 0.341 1.00 0.00 H new ATOM 0 HB VAL A 38 -70.822 -3.560 2.289 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -70.707 -5.519 0.791 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -71.717 -4.220 0.114 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -70.070 -4.481 -0.506 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -68.808 -4.988 2.282 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -68.063 -3.920 1.069 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -68.427 -3.300 2.697 1.00 0.00 H new ATOM 556 N ASN A 39 -70.968 -1.999 -1.368 1.00 0.00 N ATOM 557 CA ASN A 39 -71.953 -1.762 -2.410 1.00 0.00 C ATOM 558 C ASN A 39 -72.573 -3.096 -2.831 1.00 0.00 C ATOM 559 O ASN A 39 -71.857 -4.043 -3.155 1.00 0.00 O ATOM 560 CB ASN A 39 -71.308 -1.130 -3.644 1.00 0.00 C ATOM 561 CG ASN A 39 -71.219 0.391 -3.498 1.00 0.00 C ATOM 562 OD1 ASN A 39 -71.457 0.954 -2.442 1.00 0.00 O ATOM 563 ND2 ASN A 39 -70.863 1.022 -4.613 1.00 0.00 N ATOM 0 H ASN A 39 -70.056 -2.308 -1.705 1.00 0.00 H new ATOM 0 HA ASN A 39 -72.709 -1.085 -2.012 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -70.310 -1.544 -3.790 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -71.890 -1.380 -4.531 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -70.775 2.038 -4.618 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -70.678 0.490 -5.463 1.00 0.00 H new ATOM 570 N ASP A 40 -73.897 -3.129 -2.813 1.00 0.00 N ATOM 571 CA ASP A 40 -74.622 -4.331 -3.189 1.00 0.00 C ATOM 572 C ASP A 40 -74.913 -4.296 -4.691 1.00 0.00 C ATOM 573 O ASP A 40 -74.710 -5.288 -5.390 1.00 0.00 O ATOM 574 CB ASP A 40 -75.958 -4.423 -2.450 1.00 0.00 C ATOM 575 CG ASP A 40 -76.214 -5.754 -1.740 1.00 0.00 C ATOM 576 OD1 ASP A 40 -75.764 -6.784 -2.286 1.00 0.00 O ATOM 577 OD2 ASP A 40 -76.854 -5.711 -0.668 1.00 0.00 O ATOM 0 H ASP A 40 -74.487 -2.342 -2.544 1.00 0.00 H new ATOM 0 HA ASP A 40 -74.007 -5.192 -2.928 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -76.005 -3.621 -1.714 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -76.763 -4.248 -3.163 1.00 0.00 H new ATOM 582 N GLN A 41 -75.385 -3.144 -5.143 1.00 0.00 N ATOM 583 CA GLN A 41 -75.707 -2.967 -6.549 1.00 0.00 C ATOM 584 C GLN A 41 -74.462 -3.188 -7.411 1.00 0.00 C ATOM 585 O GLN A 41 -74.520 -3.878 -8.427 1.00 0.00 O ATOM 586 CB GLN A 41 -76.312 -1.585 -6.804 1.00 0.00 C ATOM 587 CG GLN A 41 -77.705 -1.472 -6.180 1.00 0.00 C ATOM 588 CD GLN A 41 -78.700 -2.391 -6.892 1.00 0.00 C ATOM 589 OE1 GLN A 41 -78.370 -3.100 -7.828 1.00 0.00 O ATOM 590 NE2 GLN A 41 -79.933 -2.339 -6.397 1.00 0.00 N ATOM 0 H GLN A 41 -75.552 -2.324 -4.561 1.00 0.00 H new ATOM 0 HA GLN A 41 -76.454 -3.711 -6.826 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -75.660 -0.817 -6.389 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -76.375 -1.404 -7.877 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -77.656 -1.732 -5.123 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -78.051 -0.440 -6.239 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -80.142 -1.723 -5.611 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -80.670 -2.915 -6.803 1.00 0.00 H new ATOM 599 N GLU A 42 -73.365 -2.588 -6.973 1.00 0.00 N ATOM 600 CA GLU A 42 -72.108 -2.710 -7.691 1.00 0.00 C ATOM 601 C GLU A 42 -71.381 -3.991 -7.274 1.00 0.00 C ATOM 602 O GLU A 42 -70.832 -4.699 -8.117 1.00 0.00 O ATOM 603 CB GLU A 42 -71.225 -1.481 -7.465 1.00 0.00 C ATOM 604 CG GLU A 42 -71.562 -0.374 -8.466 1.00 0.00 C ATOM 605 CD GLU A 42 -70.974 -0.683 -9.844 1.00 0.00 C ATOM 606 OE1 GLU A 42 -69.728 -0.690 -9.942 1.00 0.00 O ATOM 607 OE2 GLU A 42 -71.784 -0.906 -10.770 1.00 0.00 O ATOM 0 H GLU A 42 -73.321 -2.016 -6.130 1.00 0.00 H new ATOM 0 HA GLU A 42 -72.326 -2.769 -8.757 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -71.362 -1.112 -6.449 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -70.176 -1.759 -7.564 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -72.644 -0.267 -8.544 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -71.172 0.578 -8.106 1.00 0.00 H new ATOM 614 N GLY A 43 -71.401 -4.249 -5.975 1.00 0.00 N ATOM 615 CA GLY A 43 -70.751 -5.431 -5.437 1.00 0.00 C ATOM 616 C GLY A 43 -69.267 -5.169 -5.173 1.00 0.00 C ATOM 617 O GLY A 43 -68.409 -5.934 -5.611 1.00 0.00 O ATOM 0 H GLY A 43 -71.857 -3.659 -5.279 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -71.241 -5.730 -4.511 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -70.859 -6.260 -6.137 1.00 0.00 H new ATOM 621 N ARG A 44 -69.009 -4.083 -4.458 1.00 0.00 N ATOM 622 CA ARG A 44 -67.643 -3.710 -4.130 1.00 0.00 C ATOM 623 C ARG A 44 -67.586 -3.069 -2.742 1.00 0.00 C ATOM 624 O ARG A 44 -68.621 -2.847 -2.114 1.00 0.00 O ATOM 625 CB ARG A 44 -67.077 -2.731 -5.160 1.00 0.00 C ATOM 626 CG ARG A 44 -67.234 -3.278 -6.581 1.00 0.00 C ATOM 627 CD ARG A 44 -66.269 -2.584 -7.545 1.00 0.00 C ATOM 628 NE ARG A 44 -66.856 -1.312 -8.021 1.00 0.00 N ATOM 629 CZ ARG A 44 -66.139 -0.285 -8.496 1.00 0.00 C ATOM 630 NH1 ARG A 44 -64.804 -0.374 -8.562 1.00 0.00 N ATOM 631 NH2 ARG A 44 -66.757 0.831 -8.906 1.00 0.00 N ATOM 0 H ARG A 44 -69.723 -3.450 -4.097 1.00 0.00 H new ATOM 0 HA ARG A 44 -67.040 -4.618 -4.139 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -67.590 -1.773 -5.077 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -66.023 -2.547 -4.952 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -67.047 -4.352 -6.584 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -68.260 -3.132 -6.920 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -65.319 -2.391 -7.046 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -66.057 -3.236 -8.393 1.00 0.00 H new ATOM 0 HE ARG A 44 -67.870 -1.211 -7.985 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -64.334 -1.224 -8.251 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -64.258 0.408 -8.924 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -67.774 0.899 -8.856 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -66.211 1.613 -9.268 1.00 0.00 H new ATOM 645 N GLU A 45 -66.368 -2.789 -2.304 1.00 0.00 N ATOM 646 CA GLU A 45 -66.163 -2.178 -1.002 1.00 0.00 C ATOM 647 C GLU A 45 -65.706 -0.726 -1.163 1.00 0.00 C ATOM 648 O GLU A 45 -65.069 -0.379 -2.156 1.00 0.00 O ATOM 649 CB GLU A 45 -65.159 -2.980 -0.171 1.00 0.00 C ATOM 650 CG GLU A 45 -65.605 -4.436 -0.027 1.00 0.00 C ATOM 651 CD GLU A 45 -64.424 -5.392 -0.204 1.00 0.00 C ATOM 652 OE1 GLU A 45 -63.625 -5.141 -1.132 1.00 0.00 O ATOM 653 OE2 GLU A 45 -64.347 -6.352 0.593 1.00 0.00 O ATOM 0 H GLU A 45 -65.513 -2.974 -2.828 1.00 0.00 H new ATOM 0 HA GLU A 45 -67.113 -2.183 -0.467 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -64.178 -2.942 -0.644 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -65.055 -2.528 0.816 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -66.055 -4.587 0.954 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -66.373 -4.660 -0.768 1.00 0.00 H new ATOM 660 N GLU A 46 -66.049 0.082 -0.170 1.00 0.00 N ATOM 661 CA GLU A 46 -65.682 1.488 -0.190 1.00 0.00 C ATOM 662 C GLU A 46 -65.462 1.998 1.236 1.00 0.00 C ATOM 663 O GLU A 46 -66.278 1.748 2.122 1.00 0.00 O ATOM 664 CB GLU A 46 -66.742 2.321 -0.913 1.00 0.00 C ATOM 665 CG GLU A 46 -66.277 2.697 -2.321 1.00 0.00 C ATOM 666 CD GLU A 46 -67.022 1.883 -3.380 1.00 0.00 C ATOM 667 OE1 GLU A 46 -66.896 0.640 -3.334 1.00 0.00 O ATOM 668 OE2 GLU A 46 -67.702 2.522 -4.212 1.00 0.00 O ATOM 0 H GLU A 46 -66.577 -0.210 0.653 1.00 0.00 H new ATOM 0 HA GLU A 46 -64.748 1.593 -0.741 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -67.674 1.759 -0.972 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -66.951 3.225 -0.342 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -66.444 3.761 -2.491 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -65.205 2.524 -2.412 1.00 0.00 H new ATOM 675 N PHE A 47 -64.355 2.704 1.413 1.00 0.00 N ATOM 676 CA PHE A 47 -64.017 3.252 2.716 1.00 0.00 C ATOM 677 C PHE A 47 -63.879 4.774 2.651 1.00 0.00 C ATOM 678 O PHE A 47 -63.086 5.297 1.869 1.00 0.00 O ATOM 679 CB PHE A 47 -62.671 2.646 3.120 1.00 0.00 C ATOM 680 CG PHE A 47 -62.728 1.147 3.417 1.00 0.00 C ATOM 681 CD1 PHE A 47 -63.053 0.713 4.665 1.00 0.00 C ATOM 682 CD2 PHE A 47 -62.453 0.248 2.435 1.00 0.00 C ATOM 683 CE1 PHE A 47 -63.106 -0.679 4.941 1.00 0.00 C ATOM 684 CE2 PHE A 47 -62.506 -1.144 2.711 1.00 0.00 C ATOM 685 CZ PHE A 47 -62.831 -1.578 3.958 1.00 0.00 C ATOM 0 H PHE A 47 -63.680 2.909 0.676 1.00 0.00 H new ATOM 0 HA PHE A 47 -64.802 3.016 3.435 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -61.951 2.820 2.320 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -62.300 3.167 4.003 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -63.271 1.427 5.446 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -62.194 0.593 1.445 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -63.365 -1.024 5.931 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -62.288 -1.858 1.930 1.00 0.00 H new ATOM 0 HZ PHE A 47 -62.871 -2.637 4.168 1.00 0.00 H new ATOM 695 N TYR A 48 -64.662 5.443 3.484 1.00 0.00 N ATOM 696 CA TYR A 48 -64.638 6.895 3.531 1.00 0.00 C ATOM 697 C TYR A 48 -63.379 7.399 4.241 1.00 0.00 C ATOM 698 O TYR A 48 -63.357 7.516 5.465 1.00 0.00 O ATOM 699 CB TYR A 48 -65.867 7.312 4.342 1.00 0.00 C ATOM 700 CG TYR A 48 -66.316 8.753 4.094 1.00 0.00 C ATOM 701 CD1 TYR A 48 -66.414 9.233 2.803 1.00 0.00 C ATOM 702 CD2 TYR A 48 -66.624 9.573 5.160 1.00 0.00 C ATOM 703 CE1 TYR A 48 -66.838 10.590 2.570 1.00 0.00 C ATOM 704 CE2 TYR A 48 -67.047 10.930 4.927 1.00 0.00 C ATOM 705 CZ TYR A 48 -67.133 11.371 3.643 1.00 0.00 C ATOM 706 OH TYR A 48 -67.533 12.652 3.423 1.00 0.00 O ATOM 0 H TYR A 48 -65.317 5.006 4.132 1.00 0.00 H new ATOM 0 HA TYR A 48 -64.641 7.312 2.524 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -66.691 6.639 4.105 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -65.649 7.188 5.403 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -66.173 8.591 1.968 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -66.548 9.197 6.170 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -66.920 10.978 1.565 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -67.290 11.582 5.753 1.00 0.00 H new ATOM 0 HH TYR A 48 -67.711 13.091 4.281 1.00 0.00 H new ATOM 716 N VAL A 49 -62.362 7.684 3.441 1.00 0.00 N ATOM 717 CA VAL A 49 -61.103 8.173 3.977 1.00 0.00 C ATOM 718 C VAL A 49 -61.075 9.700 3.890 1.00 0.00 C ATOM 719 O VAL A 49 -61.634 10.283 2.962 1.00 0.00 O ATOM 720 CB VAL A 49 -59.932 7.511 3.248 1.00 0.00 C ATOM 721 CG1 VAL A 49 -60.098 5.991 3.210 1.00 0.00 C ATOM 722 CG2 VAL A 49 -59.772 8.081 1.837 1.00 0.00 C ATOM 0 H VAL A 49 -62.384 7.586 2.426 1.00 0.00 H new ATOM 0 HA VAL A 49 -61.006 7.906 5.029 1.00 0.00 H new ATOM 0 HB VAL A 49 -59.022 7.734 3.805 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -59.252 5.546 2.686 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -60.139 5.604 4.228 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -61.021 5.739 2.688 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -58.933 7.594 1.341 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -60.684 7.903 1.267 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -59.585 9.153 1.897 1.00 0.00 H new ATOM 732 N HIS A 50 -60.418 10.305 4.869 1.00 0.00 N ATOM 733 CA HIS A 50 -60.310 11.753 4.915 1.00 0.00 C ATOM 734 C HIS A 50 -58.844 12.164 4.764 1.00 0.00 C ATOM 735 O HIS A 50 -57.997 11.755 5.557 1.00 0.00 O ATOM 736 CB HIS A 50 -60.953 12.306 6.189 1.00 0.00 C ATOM 737 CG HIS A 50 -60.723 13.783 6.401 1.00 0.00 C ATOM 738 ND1 HIS A 50 -59.643 14.456 6.893 1.00 0.00 N flip ATOM 739 CD2 HIS A 50 -61.674 14.741 6.095 1.00 0.00 C flip ATOM 740 CE1 HIS A 50 -59.919 15.754 6.886 1.00 0.00 C flip ATOM 741 NE2 HIS A 50 -61.177 15.933 6.392 1.00 0.00 N flip ATOM 0 H HIS A 50 -59.955 9.818 5.637 1.00 0.00 H new ATOM 0 HA HIS A 50 -60.861 12.189 4.081 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -62.026 12.117 6.154 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -60.561 11.761 7.048 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -62.654 14.550 5.684 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -59.256 16.540 7.217 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -61.652 16.827 6.272 1.00 0.00 H new ATOM 749 N TYR A 51 -58.590 12.967 3.742 1.00 0.00 N ATOM 750 CA TYR A 51 -57.241 13.437 3.477 1.00 0.00 C ATOM 751 C TYR A 51 -56.842 14.539 4.460 1.00 0.00 C ATOM 752 O TYR A 51 -57.238 15.692 4.299 1.00 0.00 O ATOM 753 CB TYR A 51 -57.267 14.017 2.062 1.00 0.00 C ATOM 754 CG TYR A 51 -57.350 12.961 0.958 1.00 0.00 C ATOM 755 CD1 TYR A 51 -56.244 12.195 0.650 1.00 0.00 C ATOM 756 CD2 TYR A 51 -58.532 12.774 0.270 1.00 0.00 C ATOM 757 CE1 TYR A 51 -56.323 11.202 -0.390 1.00 0.00 C ATOM 758 CE2 TYR A 51 -58.611 11.781 -0.769 1.00 0.00 C ATOM 759 CZ TYR A 51 -57.503 11.043 -1.048 1.00 0.00 C ATOM 760 OH TYR A 51 -57.577 10.105 -2.029 1.00 0.00 O ATOM 0 H TYR A 51 -59.296 13.304 3.087 1.00 0.00 H new ATOM 0 HA TYR A 51 -56.523 12.623 3.582 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -58.120 14.690 1.972 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -56.370 14.617 1.910 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -55.319 12.340 1.189 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -59.398 13.373 0.511 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -55.465 10.597 -0.642 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -59.530 11.625 -1.315 1.00 0.00 H new ATOM 0 HH TYR A 51 -57.429 9.216 -1.644 1.00 0.00 H new ATOM 770 N VAL A 52 -56.062 14.145 5.456 1.00 0.00 N ATOM 771 CA VAL A 52 -55.605 15.085 6.466 1.00 0.00 C ATOM 772 C VAL A 52 -54.444 15.907 5.902 1.00 0.00 C ATOM 773 O VAL A 52 -53.324 15.831 6.404 1.00 0.00 O ATOM 774 CB VAL A 52 -55.240 14.338 7.750 1.00 0.00 C ATOM 775 CG1 VAL A 52 -56.420 13.504 8.253 1.00 0.00 C ATOM 776 CG2 VAL A 52 -54.000 13.466 7.544 1.00 0.00 C ATOM 0 H VAL A 52 -55.735 13.188 5.585 1.00 0.00 H new ATOM 0 HA VAL A 52 -56.401 15.782 6.727 1.00 0.00 H new ATOM 0 HB VAL A 52 -55.004 15.079 8.513 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -56.134 12.983 9.167 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -57.267 14.159 8.458 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -56.701 12.775 7.493 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -53.762 12.946 8.472 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -54.195 12.736 6.759 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -53.158 14.094 7.254 1.00 0.00 H new ATOM 906 N GLU A 60 -63.907 11.466 0.572 1.00 0.00 N ATOM 907 CA GLU A 60 -64.645 10.604 -0.336 1.00 0.00 C ATOM 908 C GLU A 60 -64.285 9.138 -0.088 1.00 0.00 C ATOM 909 O GLU A 60 -63.267 8.843 0.537 1.00 0.00 O ATOM 910 CB GLU A 60 -64.385 10.994 -1.793 1.00 0.00 C ATOM 911 CG GLU A 60 -62.923 10.751 -2.173 1.00 0.00 C ATOM 912 CD GLU A 60 -62.480 11.706 -3.284 1.00 0.00 C ATOM 913 OE1 GLU A 60 -62.996 12.844 -3.293 1.00 0.00 O ATOM 914 OE2 GLU A 60 -61.635 11.276 -4.098 1.00 0.00 O ATOM 0 HA GLU A 60 -65.710 10.733 -0.143 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -65.036 10.417 -2.449 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -64.633 12.045 -1.942 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -62.288 10.887 -1.297 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -62.796 9.720 -2.502 1.00 0.00 H new ATOM 921 N TRP A 61 -65.139 8.259 -0.590 1.00 0.00 N ATOM 922 CA TRP A 61 -64.924 6.831 -0.430 1.00 0.00 C ATOM 923 C TRP A 61 -63.790 6.416 -1.370 1.00 0.00 C ATOM 924 O TRP A 61 -63.589 7.032 -2.415 1.00 0.00 O ATOM 925 CB TRP A 61 -66.217 6.051 -0.672 1.00 0.00 C ATOM 926 CG TRP A 61 -67.429 6.606 0.079 1.00 0.00 C ATOM 927 CD1 TRP A 61 -68.216 7.633 -0.270 1.00 0.00 C ATOM 928 CD2 TRP A 61 -67.963 6.121 1.329 1.00 0.00 C ATOM 929 NE1 TRP A 61 -69.215 7.844 0.659 1.00 0.00 N ATOM 930 CE2 TRP A 61 -69.055 6.895 1.662 1.00 0.00 C ATOM 931 CE3 TRP A 61 -67.537 5.062 2.150 1.00 0.00 C ATOM 932 CZ2 TRP A 61 -69.813 6.693 2.822 1.00 0.00 C ATOM 933 CZ3 TRP A 61 -68.304 4.873 3.306 1.00 0.00 C ATOM 934 CH2 TRP A 61 -69.407 5.644 3.656 1.00 0.00 C ATOM 0 H TRP A 61 -65.982 8.508 -1.108 1.00 0.00 H new ATOM 0 HA TRP A 61 -64.631 6.597 0.594 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -66.434 6.050 -1.740 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -66.064 5.013 -0.377 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -68.085 8.222 -1.166 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -69.937 8.563 0.617 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -66.685 4.443 1.908 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -70.665 7.313 3.061 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -68.019 4.072 3.972 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -69.948 5.435 4.567 1.00 0.00 H new ATOM 945 N VAL A 62 -63.080 5.374 -0.965 1.00 0.00 N ATOM 946 CA VAL A 62 -61.972 4.869 -1.758 1.00 0.00 C ATOM 947 C VAL A 62 -62.079 3.346 -1.865 1.00 0.00 C ATOM 948 O VAL A 62 -63.009 2.747 -1.329 1.00 0.00 O ATOM 949 CB VAL A 62 -60.644 5.334 -1.157 1.00 0.00 C ATOM 950 CG1 VAL A 62 -60.681 6.829 -0.835 1.00 0.00 C ATOM 951 CG2 VAL A 62 -60.286 4.514 0.084 1.00 0.00 C ATOM 0 H VAL A 62 -63.250 4.865 -0.098 1.00 0.00 H new ATOM 0 HA VAL A 62 -62.013 5.270 -2.771 1.00 0.00 H new ATOM 0 HB VAL A 62 -59.865 5.171 -1.902 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -59.725 7.133 -0.409 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -60.867 7.393 -1.749 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -61.477 7.027 -0.117 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -59.338 4.865 0.491 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -61.068 4.629 0.834 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -60.197 3.462 -0.188 1.00 0.00 H new ATOM 961 N ASP A 63 -61.113 2.765 -2.561 1.00 0.00 N ATOM 962 CA ASP A 63 -61.087 1.324 -2.745 1.00 0.00 C ATOM 963 C ASP A 63 -59.891 0.739 -1.992 1.00 0.00 C ATOM 964 O ASP A 63 -58.869 1.405 -1.830 1.00 0.00 O ATOM 965 CB ASP A 63 -60.939 0.960 -4.224 1.00 0.00 C ATOM 966 CG ASP A 63 -62.203 1.146 -5.066 1.00 0.00 C ATOM 967 OD1 ASP A 63 -63.221 0.516 -4.707 1.00 0.00 O ATOM 968 OD2 ASP A 63 -62.123 1.913 -6.049 1.00 0.00 O ATOM 0 H ASP A 63 -60.343 3.266 -3.004 1.00 0.00 H new ATOM 0 HA ASP A 63 -62.025 0.919 -2.366 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -60.142 1.567 -4.654 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -60.622 -0.080 -4.297 1.00 0.00 H new ATOM 973 N LYS A 64 -60.057 -0.499 -1.552 1.00 0.00 N ATOM 974 CA LYS A 64 -59.003 -1.181 -0.820 1.00 0.00 C ATOM 975 C LYS A 64 -57.688 -1.057 -1.593 1.00 0.00 C ATOM 976 O LYS A 64 -56.665 -0.674 -1.028 1.00 0.00 O ATOM 977 CB LYS A 64 -59.407 -2.626 -0.522 1.00 0.00 C ATOM 978 CG LYS A 64 -60.545 -2.678 0.499 1.00 0.00 C ATOM 979 CD LYS A 64 -60.579 -4.030 1.215 1.00 0.00 C ATOM 980 CE LYS A 64 -60.321 -3.863 2.714 1.00 0.00 C ATOM 981 NZ LYS A 64 -60.902 -4.996 3.469 1.00 0.00 N ATOM 0 H LYS A 64 -60.906 -1.048 -1.688 1.00 0.00 H new ATOM 0 HA LYS A 64 -58.848 -0.711 0.151 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -59.718 -3.118 -1.444 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -58.547 -3.177 -0.141 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -60.420 -1.879 1.230 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -61.497 -2.504 -0.003 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -61.548 -4.504 1.060 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -59.828 -4.693 0.785 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -59.249 -3.806 2.900 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -60.755 -2.926 3.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -60.660 -4.903 4.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -61.936 -4.992 3.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -60.518 -5.891 3.102 1.00 0.00 H new ATOM 995 N ASN A 65 -57.759 -1.389 -2.874 1.00 0.00 N ATOM 996 CA ASN A 65 -56.587 -1.319 -3.731 1.00 0.00 C ATOM 997 C ASN A 65 -55.998 0.092 -3.668 1.00 0.00 C ATOM 998 O ASN A 65 -54.790 0.257 -3.503 1.00 0.00 O ATOM 999 CB ASN A 65 -56.951 -1.615 -5.187 1.00 0.00 C ATOM 1000 CG ASN A 65 -56.325 -2.932 -5.651 1.00 0.00 C ATOM 1001 OD1 ASN A 65 -55.241 -3.313 -5.242 1.00 0.00 O ATOM 1002 ND2 ASN A 65 -57.067 -3.605 -6.526 1.00 0.00 N ATOM 0 H ASN A 65 -58.609 -1.707 -3.339 1.00 0.00 H new ATOM 0 HA ASN A 65 -55.869 -2.060 -3.381 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -58.035 -1.666 -5.292 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -56.608 -0.800 -5.824 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -56.737 -4.497 -6.896 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -57.966 -3.230 -6.827 1.00 0.00 H new ATOM 1009 N ARG A 66 -56.878 1.072 -3.804 1.00 0.00 N ATOM 1010 CA ARG A 66 -56.460 2.464 -3.765 1.00 0.00 C ATOM 1011 C ARG A 66 -55.712 2.757 -2.463 1.00 0.00 C ATOM 1012 O ARG A 66 -54.908 3.685 -2.401 1.00 0.00 O ATOM 1013 CB ARG A 66 -57.663 3.403 -3.876 1.00 0.00 C ATOM 1014 CG ARG A 66 -58.206 3.431 -5.306 1.00 0.00 C ATOM 1015 CD ARG A 66 -59.319 4.471 -5.450 1.00 0.00 C ATOM 1016 NE ARG A 66 -60.104 4.207 -6.677 1.00 0.00 N ATOM 1017 CZ ARG A 66 -59.689 4.514 -7.914 1.00 0.00 C ATOM 1018 NH1 ARG A 66 -58.497 5.097 -8.096 1.00 0.00 N ATOM 1019 NH2 ARG A 66 -60.468 4.237 -8.969 1.00 0.00 N ATOM 0 H ARG A 66 -57.879 0.931 -3.941 1.00 0.00 H new ATOM 0 HA ARG A 66 -55.799 2.636 -4.615 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -58.447 3.078 -3.192 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -57.373 4.409 -3.574 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -57.398 3.659 -6.001 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -58.588 2.446 -5.573 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -59.972 4.440 -4.577 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -58.889 5.472 -5.492 1.00 0.00 H new ATOM 0 HE ARG A 66 -61.017 3.764 -6.575 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -57.904 5.308 -7.293 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -58.182 5.330 -9.038 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -61.376 3.793 -8.830 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -60.153 4.470 -9.911 1.00 0.00 H new ATOM 1033 N LEU A 67 -56.003 1.948 -1.455 1.00 0.00 N ATOM 1034 CA LEU A 67 -55.368 2.108 -0.158 1.00 0.00 C ATOM 1035 C LEU A 67 -54.108 1.242 -0.102 1.00 0.00 C ATOM 1036 O LEU A 67 -53.832 0.480 -1.027 1.00 0.00 O ATOM 1037 CB LEU A 67 -56.364 1.819 0.966 1.00 0.00 C ATOM 1038 CG LEU A 67 -57.578 2.747 1.041 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -58.787 2.022 1.636 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -57.243 4.028 1.809 1.00 0.00 C ATOM 0 H LEU A 67 -56.671 1.179 -1.510 1.00 0.00 H new ATOM 0 HA LEU A 67 -55.052 3.141 -0.013 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -56.721 0.795 0.854 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -55.833 1.870 1.917 1.00 0.00 H new ATOM 0 HG LEU A 67 -57.846 3.041 0.026 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -59.636 2.704 1.678 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -59.041 1.165 1.012 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -58.547 1.679 2.643 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -58.123 4.670 1.847 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -56.934 3.774 2.823 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -56.433 4.554 1.304 1.00 0.00 H new ATOM 1052 N ALA A 68 -53.377 1.388 0.994 1.00 0.00 N ATOM 1053 CA ALA A 68 -52.153 0.628 1.183 1.00 0.00 C ATOM 1054 C ALA A 68 -52.389 -0.457 2.235 1.00 0.00 C ATOM 1055 O ALA A 68 -52.469 -0.165 3.427 1.00 0.00 O ATOM 1056 CB ALA A 68 -51.017 1.578 1.571 1.00 0.00 C ATOM 0 H ALA A 68 -53.609 2.021 1.760 1.00 0.00 H new ATOM 0 HA ALA A 68 -51.862 0.132 0.257 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -50.099 1.008 1.713 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -50.870 2.312 0.779 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -51.272 2.091 2.498 1.00 0.00 H new ATOM 1062 N LEU A 69 -52.494 -1.688 1.755 1.00 0.00 N ATOM 1063 CA LEU A 69 -52.720 -2.819 2.639 1.00 0.00 C ATOM 1064 C LEU A 69 -51.493 -3.733 2.614 1.00 0.00 C ATOM 1065 O LEU A 69 -51.315 -4.513 1.680 1.00 0.00 O ATOM 1066 CB LEU A 69 -54.025 -3.531 2.276 1.00 0.00 C ATOM 1067 CG LEU A 69 -55.271 -2.647 2.197 1.00 0.00 C ATOM 1068 CD1 LEU A 69 -56.335 -3.278 1.296 1.00 0.00 C ATOM 1069 CD2 LEU A 69 -55.814 -2.339 3.594 1.00 0.00 C ATOM 0 H LEU A 69 -52.427 -1.927 0.766 1.00 0.00 H new ATOM 0 HA LEU A 69 -52.845 -2.480 3.667 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -53.891 -4.023 1.313 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -54.205 -4.314 3.012 1.00 0.00 H new ATOM 0 HG LEU A 69 -54.987 -1.697 1.744 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -57.210 -2.629 1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -55.932 -3.405 0.291 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -56.621 -4.250 1.697 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -56.700 -1.709 3.509 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -56.078 -3.270 4.095 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -55.052 -1.818 4.174 1.00 0.00 H new ATOM 1464 N ARG A 94 -50.396 -20.410 30.795 1.00 0.00 N ATOM 1465 CA ARG A 94 -50.623 -21.078 32.066 1.00 0.00 C ATOM 1466 C ARG A 94 -50.915 -22.563 31.840 1.00 0.00 C ATOM 1467 O ARG A 94 -51.357 -22.955 30.761 1.00 0.00 O ATOM 1468 CB ARG A 94 -51.793 -20.444 32.820 1.00 0.00 C ATOM 1469 CG ARG A 94 -53.097 -20.593 32.034 1.00 0.00 C ATOM 1470 CD ARG A 94 -54.301 -20.186 32.886 1.00 0.00 C ATOM 1471 NE ARG A 94 -55.226 -19.350 32.089 1.00 0.00 N ATOM 1472 CZ ARG A 94 -56.301 -18.730 32.594 1.00 0.00 C ATOM 1473 NH1 ARG A 94 -56.594 -18.848 33.896 1.00 0.00 N ATOM 1474 NH2 ARG A 94 -57.085 -17.991 31.796 1.00 0.00 N ATOM 0 HA ARG A 94 -49.719 -20.969 32.664 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -51.898 -20.914 33.798 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -51.588 -19.388 32.995 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -53.057 -19.976 31.136 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -53.212 -21.626 31.706 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -54.819 -21.075 33.246 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -53.965 -19.635 33.765 1.00 0.00 H new ATOM 0 HE ARG A 94 -55.033 -19.239 31.094 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -55.998 -19.410 34.504 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -57.413 -18.376 34.279 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -56.863 -17.901 30.805 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -57.903 -17.519 32.180 1.00 0.00 H new ATOM 1488 N LYS A 95 -50.656 -23.348 32.875 1.00 0.00 N ATOM 1489 CA LYS A 95 -50.886 -24.781 32.803 1.00 0.00 C ATOM 1490 C LYS A 95 -50.671 -25.398 34.187 1.00 0.00 C ATOM 1491 O LYS A 95 -49.645 -26.029 34.436 1.00 0.00 O ATOM 1492 CB LYS A 95 -50.019 -25.408 31.709 1.00 0.00 C ATOM 1493 CG LYS A 95 -50.711 -26.626 31.093 1.00 0.00 C ATOM 1494 CD LYS A 95 -51.510 -26.231 29.849 1.00 0.00 C ATOM 1495 CE LYS A 95 -53.010 -26.437 30.073 1.00 0.00 C ATOM 1496 NZ LYS A 95 -53.672 -26.833 28.810 1.00 0.00 N ATOM 0 H LYS A 95 -50.289 -23.019 33.768 1.00 0.00 H new ATOM 0 HA LYS A 95 -51.918 -24.988 32.518 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -49.815 -24.670 30.933 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -49.057 -25.704 32.127 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -49.966 -27.377 30.828 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -51.376 -27.081 31.827 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -51.315 -25.187 29.604 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -51.181 -26.826 28.997 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -53.169 -27.205 30.830 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -53.457 -25.518 30.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -54.689 -26.969 28.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -53.536 -26.087 28.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -53.257 -27.722 28.464 1.00 0.00 H new ATOM 1510 N ILE A 96 -51.654 -25.193 35.050 1.00 0.00 N ATOM 1511 CA ILE A 96 -51.586 -25.720 36.402 1.00 0.00 C ATOM 1512 C ILE A 96 -51.570 -27.249 36.348 1.00 0.00 C ATOM 1513 O ILE A 96 -51.798 -27.839 35.293 1.00 0.00 O ATOM 1514 CB ILE A 96 -52.716 -25.147 37.260 1.00 0.00 C ATOM 1515 CG1 ILE A 96 -52.484 -25.444 38.743 1.00 0.00 C ATOM 1516 CG2 ILE A 96 -54.078 -25.651 36.780 1.00 0.00 C ATOM 1517 CD1 ILE A 96 -53.316 -24.512 39.625 1.00 0.00 C ATOM 0 H ILE A 96 -52.503 -24.669 34.839 1.00 0.00 H new ATOM 0 HA ILE A 96 -50.661 -25.407 36.886 1.00 0.00 H new ATOM 0 HB ILE A 96 -52.716 -24.063 37.146 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -52.745 -26.481 38.955 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -51.427 -25.327 38.980 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -54.864 -25.229 37.407 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -54.235 -25.345 35.746 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -54.107 -26.739 36.845 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -53.133 -24.744 40.674 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -53.035 -23.477 39.428 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -54.374 -24.649 39.403 1.00 0.00 H new ATOM 1529 N THR A 97 -51.298 -27.848 37.499 1.00 0.00 N ATOM 1530 CA THR A 97 -51.250 -29.297 37.595 1.00 0.00 C ATOM 1531 C THR A 97 -51.231 -29.733 39.062 1.00 0.00 C ATOM 1532 O THR A 97 -50.870 -28.952 39.941 1.00 0.00 O ATOM 1533 CB THR A 97 -50.036 -29.783 36.801 1.00 0.00 C ATOM 1534 OG1 THR A 97 -50.073 -31.201 36.945 1.00 0.00 O ATOM 1535 CG2 THR A 97 -48.711 -29.377 37.449 1.00 0.00 C ATOM 0 H THR A 97 -51.109 -27.356 38.372 1.00 0.00 H new ATOM 0 HA THR A 97 -52.142 -29.752 37.164 1.00 0.00 H new ATOM 0 HB THR A 97 -50.081 -29.384 35.788 1.00 0.00 H new ATOM 0 HG1 THR A 97 -49.321 -31.599 36.459 1.00 0.00 H new ATOM 0 HG21 THR A 97 -47.882 -29.747 36.845 1.00 0.00 H new ATOM 0 HG22 THR A 97 -48.656 -28.290 37.514 1.00 0.00 H new ATOM 0 HG23 THR A 97 -48.650 -29.804 38.450 1.00 0.00 H new ATOM 1543 N ARG A 98 -51.624 -30.979 39.280 1.00 0.00 N ATOM 1544 CA ARG A 98 -51.657 -31.529 40.625 1.00 0.00 C ATOM 1545 C ARG A 98 -52.181 -32.966 40.598 1.00 0.00 C ATOM 1546 O ARG A 98 -52.839 -33.373 39.642 1.00 0.00 O ATOM 1547 CB ARG A 98 -52.545 -30.686 41.543 1.00 0.00 C ATOM 1548 CG ARG A 98 -51.702 -29.876 42.529 1.00 0.00 C ATOM 1549 CD ARG A 98 -51.974 -30.312 43.970 1.00 0.00 C ATOM 1550 NE ARG A 98 -50.839 -29.927 44.838 1.00 0.00 N ATOM 1551 CZ ARG A 98 -49.660 -30.564 44.860 1.00 0.00 C ATOM 1552 NH1 ARG A 98 -49.455 -31.621 44.061 1.00 0.00 N ATOM 1553 NH2 ARG A 98 -48.687 -30.145 45.680 1.00 0.00 N ATOM 0 H ARG A 98 -51.922 -31.624 38.548 1.00 0.00 H new ATOM 0 HA ARG A 98 -50.639 -31.518 41.013 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -53.158 -30.012 40.944 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -53.228 -31.335 42.091 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -50.644 -30.005 42.300 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -51.925 -28.815 42.418 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -52.892 -29.849 44.331 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -52.124 -31.391 44.010 1.00 0.00 H new ATOM 0 HE ARG A 98 -50.962 -29.127 45.458 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -50.196 -31.940 43.437 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -48.558 -32.106 44.077 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -48.843 -29.341 46.288 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -47.790 -30.630 45.696 1.00 0.00 H new ATOM 1567 N ASN A 99 -51.870 -33.695 41.660 1.00 0.00 N ATOM 1568 CA ASN A 99 -52.301 -35.078 41.770 1.00 0.00 C ATOM 1569 C ASN A 99 -51.684 -35.702 43.024 1.00 0.00 C ATOM 1570 O ASN A 99 -50.602 -35.304 43.451 1.00 0.00 O ATOM 1571 CB ASN A 99 -51.843 -35.896 40.561 1.00 0.00 C ATOM 1572 CG ASN A 99 -50.338 -35.738 40.331 1.00 0.00 C ATOM 1573 OD1 ASN A 99 -49.514 -36.224 41.088 1.00 0.00 O ATOM 1574 ND2 ASN A 99 -50.028 -35.034 39.246 1.00 0.00 N ATOM 0 H ASN A 99 -51.325 -33.354 42.452 1.00 0.00 H new ATOM 0 HA ASN A 99 -53.390 -35.088 41.821 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -52.082 -36.948 40.717 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -52.386 -35.574 39.673 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -49.050 -34.873 39.005 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -50.768 -34.655 38.655 1.00 0.00 H new ATOM 1581 N GLN A 100 -52.401 -36.669 43.579 1.00 0.00 N ATOM 1582 CA GLN A 100 -51.937 -37.351 44.775 1.00 0.00 C ATOM 1583 C GLN A 100 -52.876 -38.508 45.123 1.00 0.00 C ATOM 1584 O GLN A 100 -54.008 -38.559 44.645 1.00 0.00 O ATOM 1585 CB GLN A 100 -51.810 -36.376 45.947 1.00 0.00 C ATOM 1586 CG GLN A 100 -50.519 -36.625 46.730 1.00 0.00 C ATOM 1587 CD GLN A 100 -49.352 -35.843 46.125 1.00 0.00 C ATOM 1588 OE1 GLN A 100 -49.156 -34.668 46.387 1.00 0.00 O ATOM 1589 NE2 GLN A 100 -48.589 -36.559 45.303 1.00 0.00 N ATOM 0 H GLN A 100 -53.299 -36.996 43.222 1.00 0.00 H new ATOM 0 HA GLN A 100 -50.946 -37.760 44.576 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -51.822 -35.351 45.575 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -52.668 -36.485 46.610 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -50.658 -36.331 47.770 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -50.288 -37.690 46.728 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -48.809 -37.539 45.127 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -47.784 -36.128 44.849 1.00 0.00 H new ATOM 1598 N LYS A 101 -52.371 -39.408 45.954 1.00 0.00 N ATOM 1599 CA LYS A 101 -53.150 -40.561 46.372 1.00 0.00 C ATOM 1600 C LYS A 101 -52.373 -41.338 47.437 1.00 0.00 C ATOM 1601 O LYS A 101 -51.207 -41.045 47.695 1.00 0.00 O ATOM 1602 CB LYS A 101 -53.547 -41.408 45.160 1.00 0.00 C ATOM 1603 CG LYS A 101 -52.319 -42.059 44.521 1.00 0.00 C ATOM 1604 CD LYS A 101 -52.088 -43.464 45.081 1.00 0.00 C ATOM 1605 CE LYS A 101 -52.395 -44.531 44.029 1.00 0.00 C ATOM 1606 NZ LYS A 101 -51.352 -45.582 44.037 1.00 0.00 N ATOM 0 H LYS A 101 -51.432 -39.362 46.349 1.00 0.00 H new ATOM 0 HA LYS A 101 -54.086 -40.242 46.830 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -54.254 -42.179 45.466 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -54.055 -40.783 44.426 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -52.452 -42.112 43.440 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -51.439 -41.442 44.704 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -51.054 -43.562 45.412 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -52.719 -43.619 45.956 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -53.370 -44.976 44.228 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -52.450 -44.072 43.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -51.576 -46.298 43.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -50.428 -45.155 43.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -51.319 -46.032 44.974 1.00 0.00 H new ATOM 1620 N ARG A 102 -53.051 -42.312 48.025 1.00 0.00 N ATOM 1621 CA ARG A 102 -52.438 -43.133 49.056 1.00 0.00 C ATOM 1622 C ARG A 102 -53.418 -44.210 49.528 1.00 0.00 C ATOM 1623 O ARG A 102 -54.625 -43.980 49.572 1.00 0.00 O ATOM 1624 CB ARG A 102 -52.008 -42.283 50.253 1.00 0.00 C ATOM 1625 CG ARG A 102 -50.638 -42.722 50.773 1.00 0.00 C ATOM 1626 CD ARG A 102 -49.971 -41.602 51.574 1.00 0.00 C ATOM 1627 NE ARG A 102 -49.017 -42.176 52.549 1.00 0.00 N ATOM 1628 CZ ARG A 102 -48.409 -41.468 53.511 1.00 0.00 C ATOM 1629 NH1 ARG A 102 -48.650 -40.156 53.631 1.00 0.00 N ATOM 1630 NH2 ARG A 102 -47.558 -42.073 54.351 1.00 0.00 N ATOM 0 H ARG A 102 -54.018 -42.551 47.808 1.00 0.00 H new ATOM 0 HA ARG A 102 -51.555 -43.604 48.625 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -51.972 -41.233 49.963 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -52.748 -42.369 51.049 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -50.750 -43.606 51.401 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -50.000 -43.004 49.935 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -49.450 -40.922 50.900 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -50.728 -41.016 52.095 1.00 0.00 H new ATOM 0 HE ARG A 102 -48.809 -43.173 52.485 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -49.296 -39.696 52.990 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -48.187 -39.617 54.363 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -47.373 -43.072 54.258 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -47.095 -41.535 55.083 1.00 0.00 H new ATOM 1644 N LYS A 103 -52.860 -45.362 49.871 1.00 0.00 N ATOM 1645 CA LYS A 103 -53.669 -46.475 50.338 1.00 0.00 C ATOM 1646 C LYS A 103 -52.812 -47.389 51.216 1.00 0.00 C ATOM 1647 O LYS A 103 -51.634 -47.601 50.933 1.00 0.00 O ATOM 1648 CB LYS A 103 -54.326 -47.193 49.158 1.00 0.00 C ATOM 1649 CG LYS A 103 -55.822 -46.882 49.090 1.00 0.00 C ATOM 1650 CD LYS A 103 -56.648 -48.022 49.688 1.00 0.00 C ATOM 1651 CE LYS A 103 -57.751 -47.481 50.600 1.00 0.00 C ATOM 1652 NZ LYS A 103 -57.278 -47.410 52.000 1.00 0.00 N ATOM 0 H LYS A 103 -51.858 -45.549 49.835 1.00 0.00 H new ATOM 0 HA LYS A 103 -54.490 -46.116 50.958 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -53.845 -46.888 48.229 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -54.179 -48.269 49.255 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -56.029 -45.957 49.628 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -56.116 -46.720 48.053 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -57.091 -48.614 48.887 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -55.998 -48.689 50.254 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -58.057 -46.491 50.263 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -58.629 -48.124 50.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -58.039 -47.041 52.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -57.008 -48.361 52.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -56.454 -46.778 52.056 1.00 0.00 H new ATOM 1666 N HIS A 104 -53.437 -47.908 52.263 1.00 0.00 N ATOM 1667 CA HIS A 104 -52.747 -48.795 53.183 1.00 0.00 C ATOM 1668 C HIS A 104 -53.752 -49.756 53.821 1.00 0.00 C ATOM 1669 O HIS A 104 -54.959 -49.530 53.758 1.00 0.00 O ATOM 1670 CB HIS A 104 -51.953 -47.994 54.218 1.00 0.00 C ATOM 1671 CG HIS A 104 -52.783 -46.997 54.990 1.00 0.00 C ATOM 1672 ND1 HIS A 104 -54.055 -47.082 55.476 1.00 0.00 N flip ATOM 1673 CD2 HIS A 104 -52.315 -45.742 55.340 1.00 0.00 C flip ATOM 1674 CE1 HIS A 104 -54.347 -45.942 56.090 1.00 0.00 C flip ATOM 1675 NE2 HIS A 104 -53.270 -45.110 56.007 1.00 0.00 N flip ATOM 0 H HIS A 104 -54.414 -47.731 52.494 1.00 0.00 H new ATOM 0 HA HIS A 104 -52.019 -49.395 52.637 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -51.489 -48.686 54.920 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -51.146 -47.465 53.712 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -51.337 -45.345 55.109 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -55.284 -45.711 56.576 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -53.210 -44.167 56.391 1.00 0.00 H new ATOM 1683 N ASP A 105 -53.216 -50.809 54.421 1.00 0.00 N ATOM 1684 CA ASP A 105 -54.051 -51.805 55.070 1.00 0.00 C ATOM 1685 C ASP A 105 -53.159 -52.841 55.758 1.00 0.00 C ATOM 1686 O ASP A 105 -51.952 -52.880 55.525 1.00 0.00 O ATOM 1687 CB ASP A 105 -54.927 -52.537 54.052 1.00 0.00 C ATOM 1688 CG ASP A 105 -54.163 -53.364 53.017 1.00 0.00 C ATOM 1689 OD1 ASP A 105 -53.766 -54.494 53.374 1.00 0.00 O ATOM 1690 OD2 ASP A 105 -53.993 -52.847 51.891 1.00 0.00 O ATOM 0 H ASP A 105 -52.214 -50.994 54.471 1.00 0.00 H new ATOM 0 HA ASP A 105 -54.688 -51.293 55.792 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -55.609 -53.196 54.589 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -55.539 -51.803 53.528 1.00 0.00 H new ATOM 1695 N GLU A 106 -53.789 -53.655 56.593 1.00 0.00 N ATOM 1696 CA GLU A 106 -53.068 -54.689 57.316 1.00 0.00 C ATOM 1697 C GLU A 106 -54.019 -55.818 57.718 1.00 0.00 C ATOM 1698 O GLU A 106 -55.142 -55.563 58.150 1.00 0.00 O ATOM 1699 CB GLU A 106 -52.358 -54.108 58.541 1.00 0.00 C ATOM 1700 CG GLU A 106 -51.277 -55.062 59.053 1.00 0.00 C ATOM 1701 CD GLU A 106 -51.060 -54.888 60.557 1.00 0.00 C ATOM 1702 OE1 GLU A 106 -52.081 -54.816 61.274 1.00 0.00 O ATOM 1703 OE2 GLU A 106 -49.876 -54.830 60.956 1.00 0.00 O ATOM 0 H GLU A 106 -54.790 -53.619 56.785 1.00 0.00 H new ATOM 0 HA GLU A 106 -52.305 -55.101 56.656 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -51.909 -53.148 58.284 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -53.085 -53.919 59.331 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -51.565 -56.091 58.840 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -50.343 -54.876 58.523 1.00 0.00 H new ATOM 1710 N ILE A 107 -53.535 -57.041 57.561 1.00 0.00 N ATOM 1711 CA ILE A 107 -54.328 -58.209 57.903 1.00 0.00 C ATOM 1712 C ILE A 107 -54.293 -58.420 59.418 1.00 0.00 C ATOM 1713 O ILE A 107 -53.613 -57.686 60.134 1.00 0.00 O ATOM 1714 CB ILE A 107 -53.862 -59.426 57.101 1.00 0.00 C ATOM 1715 CG1 ILE A 107 -52.408 -59.772 57.427 1.00 0.00 C ATOM 1716 CG2 ILE A 107 -54.078 -59.212 55.602 1.00 0.00 C ATOM 1717 CD1 ILE A 107 -52.327 -60.996 58.342 1.00 0.00 C ATOM 0 H ILE A 107 -52.603 -57.248 57.201 1.00 0.00 H new ATOM 0 HA ILE A 107 -55.371 -58.055 57.628 1.00 0.00 H new ATOM 0 HB ILE A 107 -54.471 -60.281 57.394 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -51.861 -59.967 56.504 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -51.927 -58.921 57.909 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -53.738 -60.092 55.056 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -55.138 -59.051 55.407 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -53.512 -58.340 55.274 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -51.282 -61.220 58.558 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -52.854 -60.789 59.274 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -52.787 -61.851 57.847 1.00 0.00 H new ATOM 1729 N ASN A 108 -55.033 -59.425 59.861 1.00 0.00 N ATOM 1730 CA ASN A 108 -55.095 -59.742 61.278 1.00 0.00 C ATOM 1731 C ASN A 108 -55.871 -61.046 61.471 1.00 0.00 C ATOM 1732 O ASN A 108 -56.677 -61.425 60.623 1.00 0.00 O ATOM 1733 CB ASN A 108 -55.818 -58.641 62.057 1.00 0.00 C ATOM 1734 CG ASN A 108 -54.827 -57.602 62.586 1.00 0.00 C ATOM 1735 OD1 ASN A 108 -53.626 -57.816 62.626 1.00 0.00 O ATOM 1736 ND2 ASN A 108 -55.395 -56.469 62.988 1.00 0.00 N ATOM 0 H ASN A 108 -55.595 -60.031 59.264 1.00 0.00 H new ATOM 0 HA ASN A 108 -54.074 -59.835 61.648 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -56.550 -58.155 61.412 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -56.368 -59.081 62.889 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -54.819 -55.713 63.358 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -56.407 -56.356 62.927 1.00 0.00 H new ATOM 1743 N HIS A 109 -55.600 -61.697 62.593 1.00 0.00 N ATOM 1744 CA HIS A 109 -56.263 -62.951 62.909 1.00 0.00 C ATOM 1745 C HIS A 109 -55.878 -63.393 64.322 1.00 0.00 C ATOM 1746 O HIS A 109 -54.916 -62.885 64.895 1.00 0.00 O ATOM 1747 CB HIS A 109 -55.951 -64.012 61.851 1.00 0.00 C ATOM 1748 CG HIS A 109 -57.020 -65.069 61.708 1.00 0.00 C ATOM 1749 ND1 HIS A 109 -57.952 -65.059 60.684 1.00 0.00 N ATOM 1750 CD2 HIS A 109 -57.295 -66.168 62.468 1.00 0.00 C ATOM 1751 CE1 HIS A 109 -58.747 -66.109 60.832 1.00 0.00 C ATOM 1752 NE2 HIS A 109 -58.338 -66.794 61.938 1.00 0.00 N ATOM 0 H HIS A 109 -54.931 -61.380 63.294 1.00 0.00 H new ATOM 0 HA HIS A 109 -57.344 -62.810 62.891 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -55.810 -63.520 60.889 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -55.007 -64.496 62.103 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -56.755 -66.476 63.351 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -59.573 -66.375 60.190 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -58.764 -67.648 62.299 1.00 0.00 H new ATOM 1760 N VAL A 110 -56.650 -64.335 64.844 1.00 0.00 N ATOM 1761 CA VAL A 110 -56.403 -64.851 66.179 1.00 0.00 C ATOM 1762 C VAL A 110 -56.724 -66.347 66.211 1.00 0.00 C ATOM 1763 O VAL A 110 -57.629 -66.806 65.516 1.00 0.00 O ATOM 1764 CB VAL A 110 -57.201 -64.047 67.207 1.00 0.00 C ATOM 1765 CG1 VAL A 110 -58.406 -64.844 67.711 1.00 0.00 C ATOM 1766 CG2 VAL A 110 -56.310 -63.606 68.370 1.00 0.00 C ATOM 0 H VAL A 110 -57.447 -64.754 64.366 1.00 0.00 H new ATOM 0 HA VAL A 110 -55.351 -64.738 66.443 1.00 0.00 H new ATOM 0 HB VAL A 110 -57.575 -63.150 66.713 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -58.956 -64.250 68.441 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -59.059 -65.085 66.872 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -58.062 -65.766 68.180 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -56.902 -63.036 69.086 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -55.892 -64.485 68.862 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -55.500 -62.982 67.992 1.00 0.00 H new ATOM 1776 N GLN A 111 -55.963 -67.066 67.024 1.00 0.00 N ATOM 1777 CA GLN A 111 -56.155 -68.500 67.155 1.00 0.00 C ATOM 1778 C GLN A 111 -55.772 -68.960 68.563 1.00 0.00 C ATOM 1779 O GLN A 111 -54.985 -68.302 69.242 1.00 0.00 O ATOM 1780 CB GLN A 111 -55.356 -69.259 66.094 1.00 0.00 C ATOM 1781 CG GLN A 111 -55.955 -69.050 64.702 1.00 0.00 C ATOM 1782 CD GLN A 111 -57.467 -69.284 64.715 1.00 0.00 C ATOM 1783 OE1 GLN A 111 -58.233 -68.598 64.058 1.00 0.00 O ATOM 1784 NE2 GLN A 111 -57.852 -70.288 65.497 1.00 0.00 N ATOM 0 H GLN A 111 -55.213 -66.682 67.598 1.00 0.00 H new ATOM 0 HA GLN A 111 -57.210 -68.722 66.996 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -54.320 -68.920 66.102 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -55.346 -70.322 66.333 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -55.743 -68.037 64.359 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -55.484 -69.731 63.993 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -57.158 -70.822 66.020 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -58.841 -70.524 65.574 1.00 0.00 H new ATOM 1793 N LYS A 112 -56.347 -70.086 68.960 1.00 0.00 N ATOM 1794 CA LYS A 112 -56.076 -70.641 70.275 1.00 0.00 C ATOM 1795 C LYS A 112 -56.669 -72.049 70.361 1.00 0.00 C ATOM 1796 O LYS A 112 -57.693 -72.334 69.742 1.00 0.00 O ATOM 1797 CB LYS A 112 -56.576 -69.696 71.369 1.00 0.00 C ATOM 1798 CG LYS A 112 -55.980 -70.067 72.728 1.00 0.00 C ATOM 1799 CD LYS A 112 -56.962 -70.908 73.546 1.00 0.00 C ATOM 1800 CE LYS A 112 -56.343 -71.332 74.880 1.00 0.00 C ATOM 1801 NZ LYS A 112 -57.388 -71.832 75.801 1.00 0.00 N ATOM 0 H LYS A 112 -56.999 -70.629 68.394 1.00 0.00 H new ATOM 0 HA LYS A 112 -55.002 -70.736 70.434 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -56.308 -68.670 71.118 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -57.664 -69.738 71.421 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -55.053 -70.622 72.583 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -55.726 -69.161 73.278 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -57.872 -70.336 73.729 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -57.250 -71.792 72.978 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -55.597 -72.109 74.711 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -55.825 -70.486 75.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -56.951 -72.115 76.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -58.085 -71.080 75.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -57.864 -72.652 75.374 1.00 0.00 H new ATOM 1829 N TYR A 114 -56.680 -75.894 73.068 1.00 0.00 N ATOM 1830 CA TYR A 114 -56.423 -76.492 74.367 1.00 0.00 C ATOM 1831 C TYR A 114 -56.533 -78.017 74.300 1.00 0.00 C ATOM 1832 O TYR A 114 -56.845 -78.575 73.249 1.00 0.00 O ATOM 1833 CB TYR A 114 -57.509 -75.955 75.301 1.00 0.00 C ATOM 1834 CG TYR A 114 -58.839 -76.706 75.207 1.00 0.00 C ATOM 1835 CD1 TYR A 114 -59.038 -77.852 75.949 1.00 0.00 C ATOM 1836 CD2 TYR A 114 -59.838 -76.238 74.378 1.00 0.00 C ATOM 1837 CE1 TYR A 114 -60.289 -78.559 75.860 1.00 0.00 C ATOM 1838 CE2 TYR A 114 -61.090 -76.945 74.289 1.00 0.00 C ATOM 1839 CZ TYR A 114 -61.253 -78.071 75.035 1.00 0.00 C ATOM 1840 OH TYR A 114 -62.435 -78.739 74.951 1.00 0.00 O ATOM 0 HA TYR A 114 -55.418 -76.247 74.710 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -57.147 -76.005 76.328 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -57.681 -74.903 75.074 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -58.255 -78.219 76.597 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -59.681 -75.342 73.796 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -60.458 -79.457 76.436 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -61.881 -76.589 73.645 1.00 0.00 H new ATOM 0 HH TYR A 114 -62.440 -79.477 75.596 1.00 0.00 H new ATOM 1850 N ALA A 115 -56.272 -78.648 75.435 1.00 0.00 N ATOM 1851 CA ALA A 115 -56.338 -80.097 75.518 1.00 0.00 C ATOM 1852 C ALA A 115 -56.929 -80.499 76.871 1.00 0.00 C ATOM 1853 O ALA A 115 -56.727 -79.811 77.870 1.00 0.00 O ATOM 1854 CB ALA A 115 -54.944 -80.686 75.293 1.00 0.00 C ATOM 0 H ALA A 115 -56.014 -78.182 76.305 1.00 0.00 H new ATOM 0 HA ALA A 115 -56.990 -80.497 74.741 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -54.994 -81.773 75.355 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -54.581 -80.395 74.307 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -54.263 -80.310 76.056 1.00 0.00 H new ATOM 1860 N GLU A 116 -57.646 -81.613 76.860 1.00 0.00 N ATOM 1861 CA GLU A 116 -58.268 -82.115 78.073 1.00 0.00 C ATOM 1862 C GLU A 116 -57.410 -83.221 78.691 1.00 0.00 C ATOM 1863 O GLU A 116 -57.159 -84.245 78.056 1.00 0.00 O ATOM 1864 CB GLU A 116 -59.688 -82.613 77.796 1.00 0.00 C ATOM 1865 CG GLU A 116 -60.728 -81.654 78.377 1.00 0.00 C ATOM 1866 CD GLU A 116 -62.135 -82.011 77.891 1.00 0.00 C ATOM 1867 OE1 GLU A 116 -62.682 -83.003 78.418 1.00 0.00 O ATOM 1868 OE2 GLU A 116 -62.630 -81.283 77.003 1.00 0.00 O ATOM 0 H GLU A 116 -57.810 -82.182 76.030 1.00 0.00 H new ATOM 0 HA GLU A 116 -58.339 -81.295 78.787 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -59.839 -82.712 76.721 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -59.820 -83.605 78.229 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -60.695 -81.692 79.466 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -60.487 -80.631 78.086 1.00 0.00 H new ATOM 1875 N MET A 117 -56.982 -82.978 79.921 1.00 0.00 N ATOM 1876 CA MET A 117 -56.157 -83.940 80.631 1.00 0.00 C ATOM 1877 C MET A 117 -56.998 -84.773 81.601 1.00 0.00 C ATOM 1878 O MET A 117 -58.135 -84.415 81.907 1.00 0.00 O ATOM 1879 CB MET A 117 -55.064 -83.202 81.406 1.00 0.00 C ATOM 1880 CG MET A 117 -55.661 -82.386 82.554 1.00 0.00 C ATOM 1881 SD MET A 117 -54.932 -80.757 82.589 1.00 0.00 S ATOM 1882 CE MET A 117 -55.809 -79.996 81.233 1.00 0.00 C ATOM 0 H MET A 117 -57.191 -82.128 80.444 1.00 0.00 H new ATOM 0 HA MET A 117 -55.706 -84.612 79.901 1.00 0.00 H new ATOM 0 HB2 MET A 117 -54.345 -83.920 81.801 1.00 0.00 H new ATOM 0 HB3 MET A 117 -54.518 -82.542 80.732 1.00 0.00 H new ATOM 0 HG2 MET A 117 -56.741 -82.307 82.432 1.00 0.00 H new ATOM 0 HG3 MET A 117 -55.484 -82.893 83.502 1.00 0.00 H new ATOM 0 HE1 MET A 117 -55.580 -78.931 81.203 1.00 0.00 H new ATOM 0 HE2 MET A 117 -55.502 -80.459 80.295 1.00 0.00 H new ATOM 0 HE3 MET A 117 -56.882 -80.132 81.371 1.00 0.00 H new ATOM 1892 N ASP A 118 -56.406 -85.867 82.058 1.00 0.00 N ATOM 1893 CA ASP A 118 -57.087 -86.752 82.988 1.00 0.00 C ATOM 1894 C ASP A 118 -57.192 -86.069 84.352 1.00 0.00 C ATOM 1895 O ASP A 118 -56.275 -85.364 84.770 1.00 0.00 O ATOM 1896 CB ASP A 118 -56.311 -88.058 83.172 1.00 0.00 C ATOM 1897 CG ASP A 118 -57.059 -89.153 83.935 1.00 0.00 C ATOM 1898 OD1 ASP A 118 -58.033 -89.683 83.358 1.00 0.00 O ATOM 1899 OD2 ASP A 118 -56.641 -89.435 85.079 1.00 0.00 O ATOM 0 H ASP A 118 -55.463 -86.160 81.802 1.00 0.00 H new ATOM 0 HA ASP A 118 -58.075 -86.972 82.583 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -56.038 -88.443 82.189 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -55.382 -87.840 83.698 1.00 0.00 H new ATOM 1904 N PRO A 119 -58.349 -86.308 85.027 1.00 0.00 N ATOM 1905 CA PRO A 119 -58.586 -85.724 86.336 1.00 0.00 C ATOM 1906 C PRO A 119 -57.769 -86.441 87.413 1.00 0.00 C ATOM 1907 O PRO A 119 -56.802 -85.888 87.934 1.00 0.00 O ATOM 1908 CB PRO A 119 -60.086 -85.840 86.553 1.00 0.00 C ATOM 1909 CG PRO A 119 -60.568 -86.897 85.572 1.00 0.00 C ATOM 1910 CD PRO A 119 -59.457 -87.138 84.563 1.00 0.00 C ATOM 0 HA PRO A 119 -58.268 -84.683 86.396 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -60.311 -86.128 87.580 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -60.582 -84.886 86.374 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -60.814 -87.820 86.096 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -61.476 -86.565 85.068 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -59.176 -88.190 84.528 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -59.768 -86.857 83.557 1.00 0.00 H new ATOM 1918 N THR A 120 -58.188 -87.661 87.715 1.00 0.00 N ATOM 1919 CA THR A 120 -57.508 -88.459 88.720 1.00 0.00 C ATOM 1920 C THR A 120 -57.923 -89.927 88.607 1.00 0.00 C ATOM 1921 O THR A 120 -59.067 -90.228 88.269 1.00 0.00 O ATOM 1922 CB THR A 120 -57.805 -87.847 90.090 1.00 0.00 C ATOM 1923 OG1 THR A 120 -57.023 -88.623 90.994 1.00 0.00 O ATOM 1924 CG2 THR A 120 -59.247 -88.092 90.540 1.00 0.00 C ATOM 0 H THR A 120 -58.991 -88.116 87.281 1.00 0.00 H new ATOM 0 HA THR A 120 -56.428 -88.447 88.570 1.00 0.00 H new ATOM 0 HB THR A 120 -57.611 -86.775 90.058 1.00 0.00 H new ATOM 0 HG1 THR A 120 -57.155 -88.292 91.907 1.00 0.00 H new ATOM 0 HG21 THR A 120 -59.405 -87.637 91.518 1.00 0.00 H new ATOM 0 HG22 THR A 120 -59.934 -87.649 89.819 1.00 0.00 H new ATOM 0 HG23 THR A 120 -59.431 -89.164 90.605 1.00 0.00 H new ATOM 1932 N THR A 121 -56.971 -90.802 88.895 1.00 0.00 N ATOM 1933 CA THR A 121 -57.224 -92.232 88.830 1.00 0.00 C ATOM 1934 C THR A 121 -56.384 -92.970 89.874 1.00 0.00 C ATOM 1935 O THR A 121 -55.360 -92.460 90.326 1.00 0.00 O ATOM 1936 CB THR A 121 -56.956 -92.694 87.397 1.00 0.00 C ATOM 1937 OG1 THR A 121 -57.364 -94.060 87.390 1.00 0.00 O ATOM 1938 CG2 THR A 121 -55.462 -92.750 87.069 1.00 0.00 C ATOM 0 H THR A 121 -56.023 -90.549 89.174 1.00 0.00 H new ATOM 0 HA THR A 121 -58.262 -92.462 89.072 1.00 0.00 H new ATOM 0 HB THR A 121 -57.456 -92.021 86.700 1.00 0.00 H new ATOM 0 HG1 THR A 121 -57.226 -94.438 86.496 1.00 0.00 H new ATOM 0 HG21 THR A 121 -55.328 -93.084 86.040 1.00 0.00 H new ATOM 0 HG22 THR A 121 -55.026 -91.758 87.189 1.00 0.00 H new ATOM 0 HG23 THR A 121 -54.967 -93.448 87.744 1.00 0.00 H new ATOM 1946 N ALA A 122 -56.849 -94.159 90.228 1.00 0.00 N ATOM 1947 CA ALA A 122 -56.154 -94.973 91.210 1.00 0.00 C ATOM 1948 C ALA A 122 -56.865 -96.321 91.345 1.00 0.00 C ATOM 1949 O ALA A 122 -57.872 -96.564 90.683 1.00 0.00 O ATOM 1950 CB ALA A 122 -56.080 -94.217 92.539 1.00 0.00 C ATOM 0 H ALA A 122 -57.699 -94.578 89.852 1.00 0.00 H new ATOM 0 HA ALA A 122 -55.131 -95.171 90.890 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -55.559 -94.827 93.276 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -55.540 -93.281 92.396 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -57.089 -94.003 92.893 1.00 0.00 H new ATOM 1956 N ALA A 123 -56.312 -97.162 92.207 1.00 0.00 N ATOM 1957 CA ALA A 123 -56.880 -98.479 92.436 1.00 0.00 C ATOM 1958 C ALA A 123 -57.348 -98.582 93.890 1.00 0.00 C ATOM 1959 O ALA A 123 -57.333 -97.593 94.621 1.00 0.00 O ATOM 1960 CB ALA A 123 -55.848 -99.550 92.079 1.00 0.00 C ATOM 0 H ALA A 123 -55.477 -96.957 92.755 1.00 0.00 H new ATOM 0 HA ALA A 123 -57.749 -98.638 91.797 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -56.275-100.538 92.251 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -55.570 -99.452 91.029 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -54.962 -99.424 92.702 1.00 0.00 H new ATOM 1966 N LEU A 124 -57.751 -99.787 94.264 1.00 0.00 N ATOM 1967 CA LEU A 124 -58.222-100.031 95.617 1.00 0.00 C ATOM 1968 C LEU A 124 -57.188-100.871 96.369 1.00 0.00 C ATOM 1969 O LEU A 124 -56.097-100.392 96.674 1.00 0.00 O ATOM 1970 CB LEU A 124 -59.620-100.653 95.594 1.00 0.00 C ATOM 1971 CG LEU A 124 -59.824-101.808 94.611 1.00 0.00 C ATOM 1972 CD1 LEU A 124 -60.691-102.906 95.228 1.00 0.00 C ATOM 1973 CD2 LEU A 124 -60.395-101.304 93.284 1.00 0.00 C ATOM 0 H LEU A 124 -57.761-100.605 93.654 1.00 0.00 H new ATOM 0 HA LEU A 124 -58.325 -99.091 96.159 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -59.854-101.010 96.597 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -60.341 -99.870 95.358 1.00 0.00 H new ATOM 0 HG LEU A 124 -58.851-102.249 94.396 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -60.820-103.715 94.509 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -60.206-103.292 96.125 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -61.666-102.495 95.491 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -60.530-102.145 92.603 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -61.357-100.822 93.461 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -59.705-100.586 92.841 1.00 0.00 H new ATOM 1985 N GLU A 125 -57.567-102.111 96.645 1.00 0.00 N ATOM 1986 CA GLU A 125 -56.685-103.022 97.355 1.00 0.00 C ATOM 1987 C GLU A 125 -57.404-104.343 97.637 1.00 0.00 C ATOM 1988 O GLU A 125 -58.412-104.367 98.342 1.00 0.00 O ATOM 1989 CB GLU A 125 -56.171-102.390 98.649 1.00 0.00 C ATOM 1990 CG GLU A 125 -54.660-102.586 98.792 1.00 0.00 C ATOM 1991 CD GLU A 125 -54.109-101.764 99.959 1.00 0.00 C ATOM 1992 OE1 GLU A 125 -54.045-100.526 99.802 1.00 0.00 O ATOM 1993 OE2 GLU A 125 -53.763-102.393 100.983 1.00 0.00 O ATOM 0 H GLU A 125 -58.472-102.506 96.390 1.00 0.00 H new ATOM 0 HA GLU A 125 -55.821-103.228 96.723 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -56.406-101.326 98.656 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -56.682-102.835 99.503 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -54.440-103.642 98.950 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -54.162-102.292 97.868 1.00 0.00 H new ATOM 2000 N LYS A 126 -56.857-105.410 97.073 1.00 0.00 N ATOM 2001 CA LYS A 126 -57.434-106.731 97.256 1.00 0.00 C ATOM 2002 C LYS A 126 -56.824-107.381 98.499 1.00 0.00 C ATOM 2003 O LYS A 126 -55.740-106.998 98.936 1.00 0.00 O ATOM 2004 CB LYS A 126 -57.273-107.566 95.984 1.00 0.00 C ATOM 2005 CG LYS A 126 -56.449-108.827 96.256 1.00 0.00 C ATOM 2006 CD LYS A 126 -56.338-109.691 94.999 1.00 0.00 C ATOM 2007 CE LYS A 126 -56.309-111.178 95.357 1.00 0.00 C ATOM 2008 NZ LYS A 126 -56.441-112.008 94.138 1.00 0.00 N ATOM 0 H LYS A 126 -56.021-105.387 96.489 1.00 0.00 H new ATOM 0 HA LYS A 126 -58.508-106.658 97.428 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -58.255-107.844 95.601 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -56.787-106.969 95.212 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -55.453-108.548 96.599 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -56.912-109.403 97.057 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -57.181-109.489 94.339 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -55.433-109.427 94.451 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -55.376-111.417 95.867 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -57.119-111.407 96.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -56.419-113.014 94.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -57.343-111.792 93.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -55.654-111.801 93.490 1.00 0.00 H new ATOM 2022 N GLU A 127 -57.548-108.353 99.035 1.00 0.00 N ATOM 2023 CA GLU A 127 -57.092-109.060 100.219 1.00 0.00 C ATOM 2024 C GLU A 127 -57.901-110.344 100.416 1.00 0.00 C ATOM 2025 O GLU A 127 -58.889-110.572 99.719 1.00 0.00 O ATOM 2026 CB GLU A 127 -57.175-108.165 101.458 1.00 0.00 C ATOM 2027 CG GLU A 127 -58.630-107.841 101.803 1.00 0.00 C ATOM 2028 CD GLU A 127 -58.783-106.374 102.210 1.00 0.00 C ATOM 2029 OE1 GLU A 127 -58.267-106.029 103.295 1.00 0.00 O ATOM 2030 OE2 GLU A 127 -59.412-105.631 101.426 1.00 0.00 O ATOM 0 H GLU A 127 -58.447-108.667 98.671 1.00 0.00 H new ATOM 0 HA GLU A 127 -56.046-109.331 100.076 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -56.699-108.662 102.303 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -56.625-107.241 101.281 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -59.267-108.052 100.944 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -58.967-108.485 102.616 1.00 0.00 H new ATOM 2037 N SER A 128 -57.451-111.149 101.367 1.00 0.00 N ATOM 2038 CA SER A 128 -58.121-112.404 101.664 1.00 0.00 C ATOM 2039 C SER A 128 -57.574-112.995 102.965 1.00 0.00 C ATOM 2040 O SER A 128 -56.613-112.476 103.530 1.00 0.00 O ATOM 2041 CB SER A 128 -57.954-113.402 100.516 1.00 0.00 C ATOM 2042 OG SER A 128 -56.663-114.006 100.517 1.00 0.00 O ATOM 0 H SER A 128 -56.631-110.957 101.942 1.00 0.00 H new ATOM 0 HA SER A 128 -59.186-112.203 101.784 1.00 0.00 H new ATOM 0 HB2 SER A 128 -58.717-114.177 100.595 1.00 0.00 H new ATOM 0 HB3 SER A 128 -58.115-112.892 99.566 1.00 0.00 H new ATOM 0 HG SER A 128 -56.597-114.638 99.771 1.00 0.00 H new ATOM 2048 N GLY A 129 -58.209-114.072 103.401 1.00 0.00 N ATOM 2049 CA GLY A 129 -57.798-114.739 104.625 1.00 0.00 C ATOM 2050 C GLY A 129 -58.296-116.185 104.656 1.00 0.00 C ATOM 2051 O GLY A 129 -59.337-116.499 104.082 1.00 0.00 O ATOM 0 H GLY A 129 -59.005-114.500 102.929 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -56.711-114.723 104.704 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -58.188-114.198 105.487 1.00 0.00 H new ATOM 2055 N PRO A 130 -57.507-117.050 105.349 1.00 0.00 N ATOM 2056 CA PRO A 130 -57.857-118.455 105.462 1.00 0.00 C ATOM 2057 C PRO A 130 -59.007-118.657 106.450 1.00 0.00 C ATOM 2058 O PRO A 130 -59.594-117.688 106.931 1.00 0.00 O ATOM 2059 CB PRO A 130 -56.574-119.147 105.894 1.00 0.00 C ATOM 2060 CG PRO A 130 -55.680-118.053 106.455 1.00 0.00 C ATOM 2061 CD PRO A 130 -56.267-116.713 106.041 1.00 0.00 C ATOM 0 HA PRO A 130 -58.223-118.873 104.524 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -56.776-119.910 106.645 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -56.097-119.647 105.051 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -55.623-118.126 107.541 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -54.664-118.158 106.075 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -56.457-116.079 106.907 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -55.586-116.167 105.389 1.00 0.00 H new ATOM 2069 N SER A 131 -59.295-119.921 106.725 1.00 0.00 N ATOM 2070 CA SER A 131 -60.364-120.261 107.647 1.00 0.00 C ATOM 2071 C SER A 131 -59.867-121.285 108.670 1.00 0.00 C ATOM 2072 O SER A 131 -59.914-121.039 109.874 1.00 0.00 O ATOM 2073 CB SER A 131 -61.583-120.806 106.901 1.00 0.00 C ATOM 2074 OG SER A 131 -62.235-119.796 106.135 1.00 0.00 O ATOM 0 H SER A 131 -58.806-120.722 106.325 1.00 0.00 H new ATOM 0 HA SER A 131 -60.667-119.353 108.168 1.00 0.00 H new ATOM 0 HB2 SER A 131 -61.272-121.617 106.242 1.00 0.00 H new ATOM 0 HB3 SER A 131 -62.287-121.229 107.617 1.00 0.00 H new ATOM 0 HG SER A 131 -63.007-120.184 105.672 1.00 0.00 H new ATOM 2080 N SER A 132 -59.402-122.413 108.152 1.00 0.00 N ATOM 2081 CA SER A 132 -58.896-123.475 109.005 1.00 0.00 C ATOM 2082 C SER A 132 -58.010-122.887 110.104 1.00 0.00 C ATOM 2083 O SER A 132 -57.558-121.748 109.999 1.00 0.00 O ATOM 2084 CB SER A 132 -58.115-124.510 108.191 1.00 0.00 C ATOM 2085 OG SER A 132 -58.979-125.424 107.521 1.00 0.00 O ATOM 0 H SER A 132 -59.365-122.614 107.153 1.00 0.00 H new ATOM 0 HA SER A 132 -59.747-123.979 109.464 1.00 0.00 H new ATOM 0 HB2 SER A 132 -57.490-123.999 107.459 1.00 0.00 H new ATOM 0 HB3 SER A 132 -57.446-125.061 108.852 1.00 0.00 H new ATOM 0 HG SER A 132 -58.443-126.067 107.011 1.00 0.00 H new ATOM 2091 N GLY A 133 -57.789-123.689 111.135 1.00 0.00 N ATOM 2092 CA GLY A 133 -56.965-123.262 112.253 1.00 0.00 C ATOM 2093 C GLY A 133 -57.535-122.000 112.903 1.00 0.00 C ATOM 2094 O GLY A 133 -57.636-121.918 114.126 1.00 0.00 O ATOM 0 H GLY A 133 -58.166-124.633 111.220 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -56.906-124.061 112.992 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -55.949-123.071 111.908 1.00 0.00 H new