USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1045 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 102 ASN : amide:sc= -0.24 X(o=0.83,f=1) USER MOD Set 1.2: A 108 SER OG : rot -82:sc= 1.07 USER MOD Set 2.1: A 69 THR OG1 : rot -139:sc= -0.427 USER MOD Set 2.2: A 82 HIS : no HD1:sc= -0.552 K(o=-0.98,f=-4.2!) USER MOD Set 3.1: A 60 HIS : no HE2:sc= -1.4 X(o=-1.4,f=-1.9!) USER MOD Set 3.2: A 71 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 25 TYR OH : rot 180:sc= 0.619 USER MOD Set 4.2: A 28 SER OG : rot 101:sc= 0.774 USER MOD Set 4.3: A 127 HIS :FLIP no HE2:sc= 0.326 F(o=0.19,f=1.7) USER MOD Single : A 17 GLN : amide:sc=-0.000593 K(o=-0.00059,f=-0.8) USER MOD Single : A 21 CYS SG : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.195 USER MOD Single : A 31 THR OG1 : rot -2:sc= 0.173 USER MOD Single : A 33 SER OG : rot 180:sc= 0.0668 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.0609! USER MOD Single : A 38 GLN : amide:sc= -0.172 K(o=-0.17,f=-1.3!) USER MOD Single : A 44 SER OG : rot -93:sc= 1.25 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0.0364 USER MOD Single : A 66 GLN : amide:sc= -0.0735 X(o=-0.074,f=0) USER MOD Single : A 73 ASN : amide:sc= -0.0541 X(o=-0.054,f=0) USER MOD Single : A 74 GLN : amide:sc= -0.254 K(o=-0.25,f=-1.3) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0.0116 USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=-0.077) USER MOD Single : A 87 SER OG : rot 180:sc= -0.0157 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 150:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0127 USER MOD Single : A 96 GLN : amide:sc= -0.169 K(o=-0.17,f=-0.76) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.536 K(o=-0.54,f=-1.8) USER MOD Single : A 126 CYS SG : rot 38:sc= 0.226 USER MOD Single : A 136 GLN : amide:sc= -0.0779 X(o=-0.078,f=-0.078) USER MOD Single : A 143 THR OG1 : rot 84:sc= 1.2 USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 159 N LEU A 15 11.548 2.394 -12.968 1.00 0.00 N ATOM 160 CA LEU A 15 11.342 3.821 -12.742 1.00 0.00 C ATOM 161 C LEU A 15 10.844 4.506 -14.010 1.00 0.00 C ATOM 162 O LEU A 15 9.752 5.074 -14.033 1.00 0.00 O ATOM 163 CB LEU A 15 12.642 4.475 -12.271 1.00 0.00 C ATOM 164 CG LEU A 15 13.085 4.140 -10.847 1.00 0.00 C ATOM 165 CD1 LEU A 15 14.475 4.693 -10.576 1.00 0.00 C ATOM 166 CD2 LEU A 15 12.086 4.683 -9.836 1.00 0.00 C ATOM 0 HA LEU A 15 10.584 3.936 -11.968 1.00 0.00 H new ATOM 0 HB2 LEU A 15 13.439 4.186 -12.956 1.00 0.00 H new ATOM 0 HB3 LEU A 15 12.531 5.556 -12.350 1.00 0.00 H new ATOM 0 HG LEU A 15 13.122 3.055 -10.744 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.773 4.445 -9.557 1.00 0.00 H new ATOM 0 HD12 LEU A 15 15.184 4.255 -11.279 1.00 0.00 H new ATOM 0 HD13 LEU A 15 14.466 5.776 -10.697 1.00 0.00 H new ATOM 0 HD21 LEU A 15 12.418 4.435 -8.828 1.00 0.00 H new ATOM 0 HD22 LEU A 15 12.016 5.766 -9.939 1.00 0.00 H new ATOM 0 HD23 LEU A 15 11.108 4.238 -10.016 1.00 0.00 H new ATOM 178 N ARG A 16 11.651 4.447 -15.065 1.00 0.00 N ATOM 179 CA ARG A 16 11.291 5.062 -16.337 1.00 0.00 C ATOM 180 C ARG A 16 9.804 4.884 -16.626 1.00 0.00 C ATOM 181 O ARG A 16 9.120 5.831 -17.013 1.00 0.00 O ATOM 182 CB ARG A 16 12.118 4.455 -17.472 1.00 0.00 C ATOM 183 CG ARG A 16 13.611 4.710 -17.342 1.00 0.00 C ATOM 184 CD ARG A 16 14.292 4.737 -18.701 1.00 0.00 C ATOM 185 NE ARG A 16 15.549 5.481 -18.669 1.00 0.00 N ATOM 186 CZ ARG A 16 16.378 5.567 -19.703 1.00 0.00 C ATOM 187 NH1 ARG A 16 16.085 4.960 -20.845 1.00 0.00 N ATOM 188 NH2 ARG A 16 17.503 6.262 -19.597 1.00 0.00 N ATOM 0 H ARG A 16 12.558 3.980 -15.064 1.00 0.00 H new ATOM 0 HA ARG A 16 11.505 6.129 -16.270 1.00 0.00 H new ATOM 0 HB2 ARG A 16 11.943 3.380 -17.503 1.00 0.00 H new ATOM 0 HB3 ARG A 16 11.770 4.862 -18.421 1.00 0.00 H new ATOM 0 HG2 ARG A 16 13.776 5.659 -16.832 1.00 0.00 H new ATOM 0 HG3 ARG A 16 14.061 3.934 -16.724 1.00 0.00 H new ATOM 0 HD2 ARG A 16 14.483 3.716 -19.031 1.00 0.00 H new ATOM 0 HD3 ARG A 16 13.622 5.188 -19.433 1.00 0.00 H new ATOM 0 HE ARG A 16 15.804 5.960 -17.806 1.00 0.00 H new ATOM 0 HH11 ARG A 16 15.221 4.425 -20.931 1.00 0.00 H new ATOM 0 HH12 ARG A 16 16.724 5.028 -21.637 1.00 0.00 H new ATOM 0 HH21 ARG A 16 17.732 6.731 -18.721 1.00 0.00 H new ATOM 0 HH22 ARG A 16 18.139 6.327 -20.392 1.00 0.00 H new ATOM 202 N GLN A 17 9.311 3.665 -16.434 1.00 0.00 N ATOM 203 CA GLN A 17 7.905 3.363 -16.676 1.00 0.00 C ATOM 204 C GLN A 17 7.010 4.128 -15.706 1.00 0.00 C ATOM 205 O GLN A 17 6.059 4.792 -16.115 1.00 0.00 O ATOM 206 CB GLN A 17 7.653 1.860 -16.543 1.00 0.00 C ATOM 207 CG GLN A 17 8.580 1.011 -17.398 1.00 0.00 C ATOM 208 CD GLN A 17 8.219 -0.461 -17.363 1.00 0.00 C ATOM 209 OE1 GLN A 17 7.046 -0.823 -17.266 1.00 0.00 O ATOM 210 NE2 GLN A 17 9.229 -1.320 -17.444 1.00 0.00 N ATOM 0 H GLN A 17 9.864 2.871 -16.112 1.00 0.00 H new ATOM 0 HA GLN A 17 7.662 3.676 -17.691 1.00 0.00 H new ATOM 0 HB2 GLN A 17 7.769 1.571 -15.498 1.00 0.00 H new ATOM 0 HB3 GLN A 17 6.620 1.647 -16.819 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.545 1.366 -18.428 1.00 0.00 H new ATOM 0 HG3 GLN A 17 9.606 1.138 -17.052 1.00 0.00 H new ATOM 0 HE21 GLN A 17 10.186 -0.976 -17.523 1.00 0.00 H new ATOM 0 HE22 GLN A 17 9.048 -2.324 -17.427 1.00 0.00 H new ATOM 219 N GLY A 18 7.321 4.029 -14.417 1.00 0.00 N ATOM 220 CA GLY A 18 6.535 4.716 -13.409 1.00 0.00 C ATOM 221 C GLY A 18 5.108 4.209 -13.341 1.00 0.00 C ATOM 222 O GLY A 18 4.473 3.985 -14.371 1.00 0.00 O ATOM 0 H GLY A 18 8.103 3.485 -14.053 1.00 0.00 H new ATOM 0 HA2 GLY A 18 7.009 4.590 -12.435 1.00 0.00 H new ATOM 0 HA3 GLY A 18 6.528 5.784 -13.624 1.00 0.00 H new ATOM 226 N ALA A 19 4.604 4.026 -12.126 1.00 0.00 N ATOM 227 CA ALA A 19 3.243 3.543 -11.928 1.00 0.00 C ATOM 228 C ALA A 19 2.447 4.492 -11.039 1.00 0.00 C ATOM 229 O ALA A 19 2.819 4.744 -9.893 1.00 0.00 O ATOM 230 CB ALA A 19 3.262 2.145 -11.327 1.00 0.00 C ATOM 0 H ALA A 19 5.118 4.205 -11.263 1.00 0.00 H new ATOM 0 HA ALA A 19 2.753 3.502 -12.901 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.239 1.796 -11.184 1.00 0.00 H new ATOM 0 HB2 ALA A 19 3.786 1.467 -12.000 1.00 0.00 H new ATOM 0 HB3 ALA A 19 3.774 2.169 -10.365 1.00 0.00 H new ATOM 236 N ALA A 20 1.350 5.018 -11.576 1.00 0.00 N ATOM 237 CA ALA A 20 0.501 5.939 -10.830 1.00 0.00 C ATOM 238 C ALA A 20 -0.964 5.774 -11.222 1.00 0.00 C ATOM 239 O ALA A 20 -1.316 5.868 -12.398 1.00 0.00 O ATOM 240 CB ALA A 20 0.952 7.374 -11.058 1.00 0.00 C ATOM 0 H ALA A 20 1.029 4.822 -12.524 1.00 0.00 H new ATOM 0 HA ALA A 20 0.595 5.704 -9.770 1.00 0.00 H new ATOM 0 HB1 ALA A 20 0.309 8.051 -10.495 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.983 7.489 -10.723 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.887 7.611 -12.120 1.00 0.00 H new ATOM 246 N CYS A 21 -1.812 5.527 -10.230 1.00 0.00 N ATOM 247 CA CYS A 21 -3.239 5.347 -10.471 1.00 0.00 C ATOM 248 C CYS A 21 -4.039 5.565 -9.191 1.00 0.00 C ATOM 249 O CYS A 21 -3.471 5.811 -8.127 1.00 0.00 O ATOM 250 CB CYS A 21 -3.512 3.948 -11.026 1.00 0.00 C ATOM 251 SG CYS A 21 -3.115 2.609 -9.878 1.00 0.00 S ATOM 0 H CYS A 21 -1.536 5.447 -9.251 1.00 0.00 H new ATOM 0 HA CYS A 21 -3.554 6.089 -11.205 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -4.564 3.877 -11.301 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -2.934 3.812 -11.940 1.00 0.00 H new ATOM 0 HG CYS A 21 -3.382 1.466 -10.436 1.00 0.00 H new ATOM 257 N SER A 22 -5.360 5.474 -9.302 1.00 0.00 N ATOM 258 CA SER A 22 -6.239 5.666 -8.154 1.00 0.00 C ATOM 259 C SER A 22 -6.505 4.341 -7.446 1.00 0.00 C ATOM 260 O SER A 22 -6.775 3.325 -8.086 1.00 0.00 O ATOM 261 CB SER A 22 -7.561 6.295 -8.596 1.00 0.00 C ATOM 262 OG SER A 22 -7.337 7.471 -9.356 1.00 0.00 O ATOM 0 H SER A 22 -5.846 5.269 -10.175 1.00 0.00 H new ATOM 0 HA SER A 22 -5.741 6.338 -7.455 1.00 0.00 H new ATOM 0 HB2 SER A 22 -8.129 5.578 -9.189 1.00 0.00 H new ATOM 0 HB3 SER A 22 -8.165 6.533 -7.720 1.00 0.00 H new ATOM 0 HG SER A 22 -8.197 7.853 -9.628 1.00 0.00 H new ATOM 268 N VAL A 23 -6.427 4.360 -6.119 1.00 0.00 N ATOM 269 CA VAL A 23 -6.660 3.162 -5.322 1.00 0.00 C ATOM 270 C VAL A 23 -7.846 3.349 -4.382 1.00 0.00 C ATOM 271 O VAL A 23 -8.334 4.464 -4.195 1.00 0.00 O ATOM 272 CB VAL A 23 -5.417 2.788 -4.494 1.00 0.00 C ATOM 273 CG1 VAL A 23 -4.241 2.476 -5.407 1.00 0.00 C ATOM 274 CG2 VAL A 23 -5.067 3.906 -3.523 1.00 0.00 C ATOM 0 H VAL A 23 -6.204 5.192 -5.573 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.878 2.355 -6.021 1.00 0.00 H new ATOM 0 HB VAL A 23 -5.644 1.893 -3.915 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.372 2.214 -4.804 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.497 1.640 -6.057 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.010 3.351 -6.015 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -4.186 3.624 -2.946 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.859 4.820 -4.080 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.905 4.076 -2.846 1.00 0.00 H new ATOM 284 N LEU A 24 -8.305 2.251 -3.793 1.00 0.00 N ATOM 285 CA LEU A 24 -9.435 2.293 -2.870 1.00 0.00 C ATOM 286 C LEU A 24 -8.957 2.245 -1.422 1.00 0.00 C ATOM 287 O LEU A 24 -8.410 1.239 -0.971 1.00 0.00 O ATOM 288 CB LEU A 24 -10.386 1.127 -3.144 1.00 0.00 C ATOM 289 CG LEU A 24 -11.756 1.206 -2.470 1.00 0.00 C ATOM 290 CD1 LEU A 24 -11.639 0.896 -0.985 1.00 0.00 C ATOM 291 CD2 LEU A 24 -12.377 2.579 -2.682 1.00 0.00 C ATOM 0 H LEU A 24 -7.913 1.321 -3.937 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.966 3.232 -3.027 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -10.537 1.053 -4.221 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.899 0.205 -2.826 1.00 0.00 H new ATOM 0 HG LEU A 24 -12.407 0.460 -2.926 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -12.624 0.957 -0.522 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.238 -0.109 -0.854 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -10.971 1.618 -0.514 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -13.352 2.617 -2.195 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.728 3.342 -2.253 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -12.497 2.763 -3.750 1.00 0.00 H new ATOM 303 N TYR A 25 -9.171 3.338 -0.698 1.00 0.00 N ATOM 304 CA TYR A 25 -8.762 3.421 0.699 1.00 0.00 C ATOM 305 C TYR A 25 -9.805 2.781 1.611 1.00 0.00 C ATOM 306 O TYR A 25 -10.855 3.366 1.879 1.00 0.00 O ATOM 307 CB TYR A 25 -8.543 4.880 1.102 1.00 0.00 C ATOM 308 CG TYR A 25 -8.195 5.059 2.563 1.00 0.00 C ATOM 309 CD1 TYR A 25 -7.322 4.185 3.201 1.00 0.00 C ATOM 310 CD2 TYR A 25 -8.738 6.100 3.305 1.00 0.00 C ATOM 311 CE1 TYR A 25 -7.001 4.344 4.535 1.00 0.00 C ATOM 312 CE2 TYR A 25 -8.422 6.267 4.639 1.00 0.00 C ATOM 313 CZ TYR A 25 -7.553 5.387 5.250 1.00 0.00 C ATOM 314 OH TYR A 25 -7.237 5.549 6.579 1.00 0.00 O ATOM 0 H TYR A 25 -9.625 4.178 -1.055 1.00 0.00 H new ATOM 0 HA TYR A 25 -7.825 2.876 0.810 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -7.743 5.300 0.492 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -9.446 5.449 0.880 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -6.888 3.368 2.644 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -9.419 6.791 2.831 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -6.322 3.656 5.016 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -8.853 7.082 5.201 1.00 0.00 H new ATOM 0 HH TYR A 25 -7.709 6.331 6.935 1.00 0.00 H new ATOM 324 N LEU A 26 -9.507 1.576 2.084 1.00 0.00 N ATOM 325 CA LEU A 26 -10.417 0.855 2.967 1.00 0.00 C ATOM 326 C LEU A 26 -10.393 1.444 4.374 1.00 0.00 C ATOM 327 O LEU A 26 -11.337 2.112 4.796 1.00 0.00 O ATOM 328 CB LEU A 26 -10.044 -0.628 3.016 1.00 0.00 C ATOM 329 CG LEU A 26 -10.046 -1.365 1.676 1.00 0.00 C ATOM 330 CD1 LEU A 26 -9.399 -2.734 1.820 1.00 0.00 C ATOM 331 CD2 LEU A 26 -11.465 -1.497 1.142 1.00 0.00 C ATOM 0 H LEU A 26 -8.643 1.078 1.871 1.00 0.00 H new ATOM 0 HA LEU A 26 -11.426 0.957 2.568 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -9.051 -0.718 3.456 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -10.737 -1.134 3.688 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.463 -0.783 0.962 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -9.409 -3.244 0.857 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.369 -2.616 2.157 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -9.954 -3.324 2.549 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -11.447 -2.024 0.188 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -12.071 -2.057 1.854 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -11.894 -0.505 1.001 1.00 0.00 H new ATOM 343 N THR A 27 -9.305 1.193 5.096 1.00 0.00 N ATOM 344 CA THR A 27 -9.156 1.699 6.455 1.00 0.00 C ATOM 345 C THR A 27 -7.713 1.580 6.931 1.00 0.00 C ATOM 346 O THR A 27 -6.844 1.108 6.197 1.00 0.00 O ATOM 347 CB THR A 27 -10.073 0.947 7.438 1.00 0.00 C ATOM 348 OG1 THR A 27 -10.006 1.554 8.733 1.00 0.00 O ATOM 349 CG2 THR A 27 -9.674 -0.518 7.538 1.00 0.00 C ATOM 0 H THR A 27 -8.514 0.642 4.762 1.00 0.00 H new ATOM 0 HA THR A 27 -9.443 2.750 6.434 1.00 0.00 H new ATOM 0 HB THR A 27 -11.095 1.004 7.063 1.00 0.00 H new ATOM 0 HG1 THR A 27 -10.593 1.071 9.351 1.00 0.00 H new ATOM 0 HG21 THR A 27 -10.336 -1.028 8.238 1.00 0.00 H new ATOM 0 HG22 THR A 27 -9.754 -0.985 6.556 1.00 0.00 H new ATOM 0 HG23 THR A 27 -8.646 -0.592 7.892 1.00 0.00 H new ATOM 357 N SER A 28 -7.464 2.010 8.164 1.00 0.00 N ATOM 358 CA SER A 28 -6.125 1.954 8.737 1.00 0.00 C ATOM 359 C SER A 28 -6.181 1.574 10.213 1.00 0.00 C ATOM 360 O SER A 28 -6.825 2.249 11.016 1.00 0.00 O ATOM 361 CB SER A 28 -5.420 3.302 8.572 1.00 0.00 C ATOM 362 OG SER A 28 -5.181 3.590 7.205 1.00 0.00 O ATOM 0 H SER A 28 -8.172 2.401 8.785 1.00 0.00 H new ATOM 0 HA SER A 28 -5.560 1.189 8.204 1.00 0.00 H new ATOM 0 HB2 SER A 28 -6.030 4.091 9.012 1.00 0.00 H new ATOM 0 HB3 SER A 28 -4.475 3.290 9.115 1.00 0.00 H new ATOM 0 HG SER A 28 -5.853 4.226 6.882 1.00 0.00 H new ATOM 368 N VAL A 29 -5.500 0.487 10.564 1.00 0.00 N ATOM 369 CA VAL A 29 -5.471 0.016 11.943 1.00 0.00 C ATOM 370 C VAL A 29 -4.058 0.071 12.513 1.00 0.00 C ATOM 371 O VAL A 29 -3.077 -0.023 11.776 1.00 0.00 O ATOM 372 CB VAL A 29 -6.001 -1.426 12.055 1.00 0.00 C ATOM 373 CG1 VAL A 29 -5.886 -1.928 13.486 1.00 0.00 C ATOM 374 CG2 VAL A 29 -7.440 -1.503 11.569 1.00 0.00 C ATOM 0 H VAL A 29 -4.961 -0.083 9.912 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.118 0.679 12.517 1.00 0.00 H new ATOM 0 HB VAL A 29 -5.392 -2.069 11.420 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.265 -2.948 13.545 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.841 -1.911 13.795 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -6.469 -1.285 14.145 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -7.799 -2.529 11.655 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -8.065 -0.848 12.176 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -7.489 -1.188 10.527 1.00 0.00 H new ATOM 384 N GLU A 30 -3.962 0.224 13.830 1.00 0.00 N ATOM 385 CA GLU A 30 -2.668 0.293 14.498 1.00 0.00 C ATOM 386 C GLU A 30 -2.029 -1.090 14.589 1.00 0.00 C ATOM 387 O GLU A 30 -2.630 -2.033 15.105 1.00 0.00 O ATOM 388 CB GLU A 30 -2.824 0.887 15.900 1.00 0.00 C ATOM 389 CG GLU A 30 -2.863 2.406 15.915 1.00 0.00 C ATOM 390 CD GLU A 30 -3.647 2.957 17.090 1.00 0.00 C ATOM 391 OE1 GLU A 30 -3.376 2.535 18.234 1.00 0.00 O ATOM 392 OE2 GLU A 30 -4.532 3.810 16.867 1.00 0.00 O ATOM 0 H GLU A 30 -4.764 0.302 14.455 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.017 0.938 13.908 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -3.741 0.504 16.348 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.998 0.547 16.524 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.844 2.792 15.950 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.308 2.764 14.986 1.00 0.00 H new ATOM 399 N THR A 31 -0.804 -1.203 14.083 1.00 0.00 N ATOM 400 CA THR A 31 -0.083 -2.470 14.104 1.00 0.00 C ATOM 401 C THR A 31 1.239 -2.337 14.851 1.00 0.00 C ATOM 402 O THR A 31 2.243 -2.933 14.464 1.00 0.00 O ATOM 403 CB THR A 31 0.195 -2.982 12.678 1.00 0.00 C ATOM 404 OG1 THR A 31 0.991 -2.030 11.963 1.00 0.00 O ATOM 405 CG2 THR A 31 -1.105 -3.229 11.928 1.00 0.00 C ATOM 0 H THR A 31 -0.291 -0.433 13.654 1.00 0.00 H new ATOM 0 HA THR A 31 -0.719 -3.188 14.622 1.00 0.00 H new ATOM 0 HB THR A 31 0.737 -3.925 12.753 1.00 0.00 H new ATOM 0 HG1 THR A 31 1.158 -1.250 12.532 1.00 0.00 H new ATOM 0 HG21 THR A 31 -0.883 -3.590 10.924 1.00 0.00 H new ATOM 0 HG22 THR A 31 -1.696 -3.975 12.459 1.00 0.00 H new ATOM 0 HG23 THR A 31 -1.670 -2.299 11.863 1.00 0.00 H new ATOM 413 N GLU A 32 1.231 -1.552 15.924 1.00 0.00 N ATOM 414 CA GLU A 32 2.431 -1.342 16.725 1.00 0.00 C ATOM 415 C GLU A 32 3.154 -2.661 16.978 1.00 0.00 C ATOM 416 O GLU A 32 4.372 -2.754 16.823 1.00 0.00 O ATOM 417 CB GLU A 32 2.073 -0.680 18.058 1.00 0.00 C ATOM 418 CG GLU A 32 0.803 -1.229 18.687 1.00 0.00 C ATOM 419 CD GLU A 32 0.512 -0.615 20.043 1.00 0.00 C ATOM 420 OE1 GLU A 32 1.452 -0.502 20.858 1.00 0.00 O ATOM 421 OE2 GLU A 32 -0.656 -0.248 20.289 1.00 0.00 O ATOM 0 H GLU A 32 0.407 -1.052 16.258 1.00 0.00 H new ATOM 0 HA GLU A 32 3.097 -0.683 16.168 1.00 0.00 H new ATOM 0 HB2 GLU A 32 2.901 -0.813 18.755 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.957 0.393 17.902 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -0.039 -1.043 18.020 1.00 0.00 H new ATOM 0 HG3 GLU A 32 0.892 -2.310 18.793 1.00 0.00 H new ATOM 428 N SER A 33 2.395 -3.680 17.369 1.00 0.00 N ATOM 429 CA SER A 33 2.963 -4.994 17.648 1.00 0.00 C ATOM 430 C SER A 33 2.948 -5.869 16.398 1.00 0.00 C ATOM 431 O SER A 33 3.769 -6.775 16.250 1.00 0.00 O ATOM 432 CB SER A 33 2.188 -5.679 18.774 1.00 0.00 C ATOM 433 OG SER A 33 0.847 -5.222 18.822 1.00 0.00 O ATOM 0 H SER A 33 1.385 -3.621 17.500 1.00 0.00 H new ATOM 0 HA SER A 33 3.998 -4.856 17.961 1.00 0.00 H new ATOM 0 HB2 SER A 33 2.202 -6.759 18.625 1.00 0.00 H new ATOM 0 HB3 SER A 33 2.677 -5.482 19.728 1.00 0.00 H new ATOM 0 HG SER A 33 0.372 -5.676 19.549 1.00 0.00 H new ATOM 439 N LEU A 34 2.007 -5.592 15.502 1.00 0.00 N ATOM 440 CA LEU A 34 1.882 -6.354 14.264 1.00 0.00 C ATOM 441 C LEU A 34 2.884 -5.866 13.222 1.00 0.00 C ATOM 442 O LEU A 34 3.288 -4.703 13.229 1.00 0.00 O ATOM 443 CB LEU A 34 0.460 -6.240 13.713 1.00 0.00 C ATOM 444 CG LEU A 34 -0.517 -7.333 14.146 1.00 0.00 C ATOM 445 CD1 LEU A 34 -0.509 -8.481 13.148 1.00 0.00 C ATOM 446 CD2 LEU A 34 -0.173 -7.834 15.541 1.00 0.00 C ATOM 0 H LEU A 34 1.320 -4.846 15.609 1.00 0.00 H new ATOM 0 HA LEU A 34 2.096 -7.399 14.486 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.051 -5.275 14.014 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.513 -6.238 12.624 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.520 -6.908 14.172 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.210 -9.250 13.472 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -0.804 -8.111 12.166 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.493 -8.905 13.090 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.879 -8.612 15.833 1.00 0.00 H new ATOM 0 HD22 LEU A 34 0.838 -8.242 15.542 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.231 -7.007 16.249 1.00 0.00 H new ATOM 458 N THR A 35 3.280 -6.763 12.324 1.00 0.00 N ATOM 459 CA THR A 35 4.233 -6.424 11.274 1.00 0.00 C ATOM 460 C THR A 35 4.294 -7.517 10.214 1.00 0.00 C ATOM 461 O THR A 35 3.540 -8.488 10.264 1.00 0.00 O ATOM 462 CB THR A 35 5.645 -6.202 11.848 1.00 0.00 C ATOM 463 OG1 THR A 35 6.560 -5.891 10.792 1.00 0.00 O ATOM 464 CG2 THR A 35 6.126 -7.437 12.595 1.00 0.00 C ATOM 0 H THR A 35 2.955 -7.730 12.303 1.00 0.00 H new ATOM 0 HA THR A 35 3.885 -5.498 10.817 1.00 0.00 H new ATOM 0 HB THR A 35 5.601 -5.367 12.548 1.00 0.00 H new ATOM 0 HG1 THR A 35 7.455 -5.750 11.166 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.125 -7.256 12.991 1.00 0.00 H new ATOM 0 HG22 THR A 35 5.444 -7.654 13.417 1.00 0.00 H new ATOM 0 HG23 THR A 35 6.154 -8.287 11.913 1.00 0.00 H new ATOM 472 N GLY A 36 5.198 -7.353 9.253 1.00 0.00 N ATOM 473 CA GLY A 36 5.341 -8.335 8.193 1.00 0.00 C ATOM 474 C GLY A 36 4.006 -8.773 7.625 1.00 0.00 C ATOM 475 O GLY A 36 3.067 -7.985 7.510 1.00 0.00 O ATOM 0 H GLY A 36 5.834 -6.558 9.189 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.953 -7.916 7.394 1.00 0.00 H new ATOM 0 HA3 GLY A 36 5.872 -9.206 8.578 1.00 0.00 H new ATOM 479 N PRO A 37 3.909 -10.059 7.257 1.00 0.00 N ATOM 480 CA PRO A 37 2.683 -10.630 6.690 1.00 0.00 C ATOM 481 C PRO A 37 1.564 -10.738 7.720 1.00 0.00 C ATOM 482 O PRO A 37 0.455 -11.166 7.401 1.00 0.00 O ATOM 483 CB PRO A 37 3.121 -12.022 6.227 1.00 0.00 C ATOM 484 CG PRO A 37 4.289 -12.358 7.089 1.00 0.00 C ATOM 485 CD PRO A 37 4.988 -11.056 7.366 1.00 0.00 C ATOM 0 HA PRO A 37 2.275 -10.010 5.892 1.00 0.00 H new ATOM 0 HB2 PRO A 37 2.318 -12.750 6.347 1.00 0.00 H new ATOM 0 HB3 PRO A 37 3.395 -12.020 5.172 1.00 0.00 H new ATOM 0 HG2 PRO A 37 3.966 -12.832 8.016 1.00 0.00 H new ATOM 0 HG3 PRO A 37 4.955 -13.060 6.587 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.444 -11.048 8.356 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.784 -10.866 6.646 1.00 0.00 H new ATOM 493 N GLN A 38 1.863 -10.348 8.955 1.00 0.00 N ATOM 494 CA GLN A 38 0.880 -10.402 10.031 1.00 0.00 C ATOM 495 C GLN A 38 0.033 -9.134 10.059 1.00 0.00 C ATOM 496 O GLN A 38 -1.192 -9.197 10.156 1.00 0.00 O ATOM 497 CB GLN A 38 1.579 -10.593 11.378 1.00 0.00 C ATOM 498 CG GLN A 38 1.751 -12.051 11.773 1.00 0.00 C ATOM 499 CD GLN A 38 2.974 -12.281 12.640 1.00 0.00 C ATOM 500 OE1 GLN A 38 3.996 -11.614 12.480 1.00 0.00 O ATOM 501 NE2 GLN A 38 2.875 -13.228 13.565 1.00 0.00 N ATOM 0 H GLN A 38 2.777 -9.992 9.235 1.00 0.00 H new ATOM 0 HA GLN A 38 0.222 -11.251 9.847 1.00 0.00 H new ATOM 0 HB2 GLN A 38 2.559 -10.118 11.340 1.00 0.00 H new ATOM 0 HB3 GLN A 38 1.006 -10.081 12.151 1.00 0.00 H new ATOM 0 HG2 GLN A 38 0.863 -12.385 12.309 1.00 0.00 H new ATOM 0 HG3 GLN A 38 1.829 -12.661 10.873 1.00 0.00 H new ATOM 0 HE21 GLN A 38 2.008 -13.757 13.663 1.00 0.00 H new ATOM 0 HE22 GLN A 38 3.666 -13.427 14.178 1.00 0.00 H new ATOM 510 N ALA A 39 0.695 -7.985 9.975 1.00 0.00 N ATOM 511 CA ALA A 39 0.002 -6.702 9.990 1.00 0.00 C ATOM 512 C ALA A 39 -1.033 -6.625 8.873 1.00 0.00 C ATOM 513 O ALA A 39 -2.203 -6.330 9.117 1.00 0.00 O ATOM 514 CB ALA A 39 1.002 -5.562 9.866 1.00 0.00 C ATOM 0 H ALA A 39 1.710 -7.916 9.896 1.00 0.00 H new ATOM 0 HA ALA A 39 -0.522 -6.610 10.942 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.472 -4.610 9.878 1.00 0.00 H new ATOM 0 HB2 ALA A 39 1.701 -5.599 10.701 1.00 0.00 H new ATOM 0 HB3 ALA A 39 1.551 -5.659 8.929 1.00 0.00 H new ATOM 520 N VAL A 40 -0.595 -6.891 7.646 1.00 0.00 N ATOM 521 CA VAL A 40 -1.484 -6.851 6.492 1.00 0.00 C ATOM 522 C VAL A 40 -2.655 -7.813 6.666 1.00 0.00 C ATOM 523 O VAL A 40 -3.775 -7.526 6.245 1.00 0.00 O ATOM 524 CB VAL A 40 -0.734 -7.204 5.193 1.00 0.00 C ATOM 525 CG1 VAL A 40 -1.646 -7.036 3.987 1.00 0.00 C ATOM 526 CG2 VAL A 40 0.515 -6.348 5.051 1.00 0.00 C ATOM 0 H VAL A 40 0.370 -7.136 7.426 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.862 -5.831 6.420 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.427 -8.249 5.243 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.099 -7.290 3.079 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.508 -7.696 4.088 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.986 -6.002 3.929 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.033 -6.610 4.128 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.233 -5.295 5.023 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.175 -6.524 5.900 1.00 0.00 H new ATOM 536 N ALA A 41 -2.387 -8.955 7.291 1.00 0.00 N ATOM 537 CA ALA A 41 -3.418 -9.958 7.524 1.00 0.00 C ATOM 538 C ALA A 41 -4.380 -9.512 8.621 1.00 0.00 C ATOM 539 O ALA A 41 -5.553 -9.886 8.621 1.00 0.00 O ATOM 540 CB ALA A 41 -2.784 -11.293 7.886 1.00 0.00 C ATOM 0 H ALA A 41 -1.464 -9.208 7.645 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.989 -10.077 6.603 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -3.566 -12.033 8.057 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -2.143 -11.625 7.069 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -2.188 -11.179 8.791 1.00 0.00 H new ATOM 546 N ARG A 42 -3.875 -8.712 9.554 1.00 0.00 N ATOM 547 CA ARG A 42 -4.689 -8.217 10.657 1.00 0.00 C ATOM 548 C ARG A 42 -5.732 -7.220 10.160 1.00 0.00 C ATOM 549 O ARG A 42 -6.934 -7.473 10.240 1.00 0.00 O ATOM 550 CB ARG A 42 -3.804 -7.558 11.717 1.00 0.00 C ATOM 551 CG ARG A 42 -4.505 -6.460 12.499 1.00 0.00 C ATOM 552 CD ARG A 42 -3.911 -6.300 13.890 1.00 0.00 C ATOM 553 NE ARG A 42 -4.858 -5.698 14.824 1.00 0.00 N ATOM 554 CZ ARG A 42 -4.516 -5.232 16.020 1.00 0.00 C ATOM 555 NH1 ARG A 42 -3.255 -5.297 16.424 1.00 0.00 N ATOM 556 NH2 ARG A 42 -5.436 -4.698 16.814 1.00 0.00 N ATOM 0 H ARG A 42 -2.906 -8.393 9.568 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.207 -9.067 11.102 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -3.455 -8.321 12.412 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -2.921 -7.140 11.233 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -4.424 -5.518 11.957 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -5.567 -6.691 12.580 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -3.601 -7.275 14.266 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -3.015 -5.681 13.833 1.00 0.00 H new ATOM 0 HE ARG A 42 -5.836 -5.632 14.543 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -2.545 -5.705 15.816 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -2.995 -4.939 17.343 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -6.407 -4.645 16.506 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -5.172 -4.341 17.732 1.00 0.00 H new ATOM 570 N ALA A 43 -5.263 -6.088 9.646 1.00 0.00 N ATOM 571 CA ALA A 43 -6.155 -5.055 9.134 1.00 0.00 C ATOM 572 C ALA A 43 -7.309 -5.666 8.347 1.00 0.00 C ATOM 573 O ALA A 43 -8.477 -5.455 8.675 1.00 0.00 O ATOM 574 CB ALA A 43 -5.382 -4.074 8.264 1.00 0.00 C ATOM 0 H ALA A 43 -4.271 -5.863 9.573 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.574 -4.518 9.985 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.060 -3.308 7.888 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.596 -3.604 8.855 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.935 -4.606 7.424 1.00 0.00 H new ATOM 580 N SER A 44 -6.975 -6.423 7.307 1.00 0.00 N ATOM 581 CA SER A 44 -7.985 -7.062 6.471 1.00 0.00 C ATOM 582 C SER A 44 -8.916 -7.931 7.311 1.00 0.00 C ATOM 583 O SER A 44 -10.138 -7.840 7.197 1.00 0.00 O ATOM 584 CB SER A 44 -7.317 -7.910 5.386 1.00 0.00 C ATOM 585 OG SER A 44 -6.089 -8.448 5.844 1.00 0.00 O ATOM 0 H SER A 44 -6.013 -6.609 7.023 1.00 0.00 H new ATOM 0 HA SER A 44 -8.577 -6.279 5.997 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.984 -8.719 5.090 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.143 -7.300 4.499 1.00 0.00 H new ATOM 0 HG SER A 44 -5.355 -7.848 5.593 1.00 0.00 H new ATOM 591 N SER A 45 -8.328 -8.774 8.154 1.00 0.00 N ATOM 592 CA SER A 45 -9.103 -9.663 9.011 1.00 0.00 C ATOM 593 C SER A 45 -10.158 -8.883 9.790 1.00 0.00 C ATOM 594 O SER A 45 -11.309 -9.305 9.890 1.00 0.00 O ATOM 595 CB SER A 45 -8.180 -10.403 9.981 1.00 0.00 C ATOM 596 OG SER A 45 -8.906 -11.336 10.763 1.00 0.00 O ATOM 0 H SER A 45 -7.317 -8.860 8.262 1.00 0.00 H new ATOM 0 HA SER A 45 -9.609 -10.390 8.376 1.00 0.00 H new ATOM 0 HB2 SER A 45 -7.400 -10.920 9.423 1.00 0.00 H new ATOM 0 HB3 SER A 45 -7.682 -9.686 10.634 1.00 0.00 H new ATOM 0 HG SER A 45 -8.294 -11.797 11.374 1.00 0.00 H new ATOM 602 N ALA A 46 -9.755 -7.742 10.340 1.00 0.00 N ATOM 603 CA ALA A 46 -10.665 -6.901 11.108 1.00 0.00 C ATOM 604 C ALA A 46 -11.674 -6.210 10.198 1.00 0.00 C ATOM 605 O ALA A 46 -12.883 -6.382 10.353 1.00 0.00 O ATOM 606 CB ALA A 46 -9.882 -5.872 11.909 1.00 0.00 C ATOM 0 H ALA A 46 -8.805 -7.379 10.268 1.00 0.00 H new ATOM 0 HA ALA A 46 -11.216 -7.540 11.798 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -10.574 -5.251 12.478 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -9.205 -6.383 12.594 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.305 -5.244 11.230 1.00 0.00 H new ATOM 612 N ALA A 47 -11.170 -5.427 9.250 1.00 0.00 N ATOM 613 CA ALA A 47 -12.029 -4.711 8.314 1.00 0.00 C ATOM 614 C ALA A 47 -13.228 -5.561 7.909 1.00 0.00 C ATOM 615 O ALA A 47 -14.283 -5.035 7.552 1.00 0.00 O ATOM 616 CB ALA A 47 -11.236 -4.293 7.085 1.00 0.00 C ATOM 0 H ALA A 47 -10.172 -5.272 9.110 1.00 0.00 H new ATOM 0 HA ALA A 47 -12.403 -3.817 8.813 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -11.889 -3.760 6.395 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -10.416 -3.641 7.386 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -10.834 -5.179 6.593 1.00 0.00 H new ATOM 622 N LEU A 48 -13.060 -6.878 7.965 1.00 0.00 N ATOM 623 CA LEU A 48 -14.129 -7.802 7.602 1.00 0.00 C ATOM 624 C LEU A 48 -14.842 -8.324 8.845 1.00 0.00 C ATOM 625 O LEU A 48 -16.070 -8.400 8.883 1.00 0.00 O ATOM 626 CB LEU A 48 -13.567 -8.972 6.794 1.00 0.00 C ATOM 627 CG LEU A 48 -12.761 -8.601 5.548 1.00 0.00 C ATOM 628 CD1 LEU A 48 -11.833 -9.740 5.154 1.00 0.00 C ATOM 629 CD2 LEU A 48 -13.690 -8.246 4.397 1.00 0.00 C ATOM 0 H LEU A 48 -12.194 -7.330 8.258 1.00 0.00 H new ATOM 0 HA LEU A 48 -14.851 -7.261 6.991 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -12.932 -9.568 7.449 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -14.397 -9.609 6.489 1.00 0.00 H new ATOM 0 HG LEU A 48 -12.153 -7.727 5.780 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -11.268 -9.458 4.266 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -11.143 -9.947 5.972 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -12.422 -10.632 4.941 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.099 -7.985 3.519 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -14.325 -9.101 4.165 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -14.313 -7.398 4.680 1.00 0.00 H new ATOM 641 N SER A 49 -14.064 -8.680 9.862 1.00 0.00 N ATOM 642 CA SER A 49 -14.621 -9.196 11.107 1.00 0.00 C ATOM 643 C SER A 49 -15.419 -8.118 11.834 1.00 0.00 C ATOM 644 O SER A 49 -16.584 -8.318 12.177 1.00 0.00 O ATOM 645 CB SER A 49 -13.503 -9.717 12.013 1.00 0.00 C ATOM 646 OG SER A 49 -14.031 -10.274 13.205 1.00 0.00 O ATOM 0 H SER A 49 -13.046 -8.621 9.848 1.00 0.00 H new ATOM 0 HA SER A 49 -15.294 -10.018 10.862 1.00 0.00 H new ATOM 0 HB2 SER A 49 -12.922 -10.471 11.482 1.00 0.00 H new ATOM 0 HB3 SER A 49 -12.821 -8.903 12.259 1.00 0.00 H new ATOM 0 HG SER A 49 -13.297 -10.601 13.766 1.00 0.00 H new ATOM 652 N CYS A 50 -14.782 -6.975 12.064 1.00 0.00 N ATOM 653 CA CYS A 50 -15.431 -5.864 12.751 1.00 0.00 C ATOM 654 C CYS A 50 -16.551 -5.276 11.898 1.00 0.00 C ATOM 655 O CYS A 50 -16.479 -5.287 10.669 1.00 0.00 O ATOM 656 CB CYS A 50 -14.408 -4.778 13.089 1.00 0.00 C ATOM 657 SG CYS A 50 -13.639 -4.970 14.714 1.00 0.00 S ATOM 0 H CYS A 50 -13.818 -6.793 11.785 1.00 0.00 H new ATOM 0 HA CYS A 50 -15.865 -6.245 13.675 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -13.628 -4.778 12.327 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -14.898 -3.805 13.043 1.00 0.00 H new ATOM 0 HG CYS A 50 -12.788 -4.007 14.908 1.00 0.00 H new ATOM 663 N SER A 51 -17.585 -4.766 12.558 1.00 0.00 N ATOM 664 CA SER A 51 -18.723 -4.179 11.860 1.00 0.00 C ATOM 665 C SER A 51 -19.355 -3.066 12.690 1.00 0.00 C ATOM 666 O SER A 51 -19.179 -2.987 13.906 1.00 0.00 O ATOM 667 CB SER A 51 -19.767 -5.253 11.548 1.00 0.00 C ATOM 668 OG SER A 51 -19.771 -6.263 12.542 1.00 0.00 O ATOM 0 H SER A 51 -17.659 -4.747 13.575 1.00 0.00 H new ATOM 0 HA SER A 51 -18.362 -3.751 10.925 1.00 0.00 H new ATOM 0 HB2 SER A 51 -20.755 -4.797 11.484 1.00 0.00 H new ATOM 0 HB3 SER A 51 -19.557 -5.697 10.575 1.00 0.00 H new ATOM 0 HG SER A 51 -20.448 -6.937 12.321 1.00 0.00 H new ATOM 674 N PRO A 52 -20.108 -2.182 12.019 1.00 0.00 N ATOM 675 CA PRO A 52 -20.323 -2.265 10.571 1.00 0.00 C ATOM 676 C PRO A 52 -19.062 -1.940 9.778 1.00 0.00 C ATOM 677 O PRO A 52 -18.087 -1.428 10.327 1.00 0.00 O ATOM 678 CB PRO A 52 -21.403 -1.211 10.312 1.00 0.00 C ATOM 679 CG PRO A 52 -21.255 -0.235 11.428 1.00 0.00 C ATOM 680 CD PRO A 52 -20.807 -1.034 12.620 1.00 0.00 C ATOM 0 HA PRO A 52 -20.605 -3.270 10.258 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -21.263 -0.730 9.344 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -22.398 -1.657 10.305 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -20.526 0.536 11.178 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -22.198 0.272 11.630 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -20.147 -0.455 13.266 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -21.652 -1.353 13.230 1.00 0.00 H new ATOM 688 N ARG A 53 -19.089 -2.241 8.483 1.00 0.00 N ATOM 689 CA ARG A 53 -17.947 -1.982 7.615 1.00 0.00 C ATOM 690 C ARG A 53 -17.669 -0.485 7.515 1.00 0.00 C ATOM 691 O ARG A 53 -18.582 0.341 7.490 1.00 0.00 O ATOM 692 CB ARG A 53 -18.198 -2.559 6.221 1.00 0.00 C ATOM 693 CG ARG A 53 -19.270 -1.818 5.439 1.00 0.00 C ATOM 694 CD ARG A 53 -19.211 -2.154 3.957 1.00 0.00 C ATOM 695 NE ARG A 53 -20.007 -3.335 3.632 1.00 0.00 N ATOM 696 CZ ARG A 53 -19.558 -4.580 3.754 1.00 0.00 C ATOM 697 NH1 ARG A 53 -18.327 -4.805 4.192 1.00 0.00 N ATOM 698 NH2 ARG A 53 -20.342 -5.603 3.439 1.00 0.00 N ATOM 0 H ARG A 53 -19.889 -2.664 8.013 1.00 0.00 H new ATOM 0 HA ARG A 53 -17.074 -2.468 8.050 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -17.267 -2.537 5.655 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -18.488 -3.605 6.317 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -20.253 -2.076 5.833 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -19.144 -0.744 5.575 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -19.571 -1.304 3.378 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -18.175 -2.323 3.665 1.00 0.00 H new ATOM 0 HE ARG A 53 -20.959 -3.197 3.293 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -17.721 -4.021 4.437 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -17.985 -5.762 4.285 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -21.290 -5.434 3.103 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -19.997 -6.558 3.533 1.00 0.00 H new ATOM 712 N PRO A 54 -16.378 -0.125 7.457 1.00 0.00 N ATOM 713 CA PRO A 54 -15.949 1.273 7.359 1.00 0.00 C ATOM 714 C PRO A 54 -16.283 1.888 6.004 1.00 0.00 C ATOM 715 O PRO A 54 -16.578 1.177 5.043 1.00 0.00 O ATOM 716 CB PRO A 54 -14.433 1.194 7.551 1.00 0.00 C ATOM 717 CG PRO A 54 -14.068 -0.184 7.118 1.00 0.00 C ATOM 718 CD PRO A 54 -15.237 -1.056 7.482 1.00 0.00 C ATOM 0 HA PRO A 54 -16.452 1.906 8.090 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -13.918 1.946 6.953 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -14.156 1.369 8.591 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -13.875 -0.218 6.046 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -13.159 -0.522 7.616 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -15.368 -1.871 6.770 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -15.110 -1.509 8.465 1.00 0.00 H new ATOM 726 N THR A 55 -16.235 3.215 5.933 1.00 0.00 N ATOM 727 CA THR A 55 -16.532 3.925 4.696 1.00 0.00 C ATOM 728 C THR A 55 -15.253 4.329 3.972 1.00 0.00 C ATOM 729 O THR A 55 -14.583 5.295 4.336 1.00 0.00 O ATOM 730 CB THR A 55 -17.377 5.186 4.961 1.00 0.00 C ATOM 731 OG1 THR A 55 -18.632 4.820 5.546 1.00 0.00 O ATOM 732 CG2 THR A 55 -17.618 5.957 3.672 1.00 0.00 C ATOM 0 H THR A 55 -15.993 3.819 6.718 1.00 0.00 H new ATOM 0 HA THR A 55 -17.101 3.239 4.068 1.00 0.00 H new ATOM 0 HB THR A 55 -16.828 5.827 5.651 1.00 0.00 H new ATOM 0 HG1 THR A 55 -19.163 5.627 5.713 1.00 0.00 H new ATOM 0 HG21 THR A 55 -18.217 6.843 3.884 1.00 0.00 H new ATOM 0 HG22 THR A 55 -16.662 6.259 3.245 1.00 0.00 H new ATOM 0 HG23 THR A 55 -18.148 5.322 2.962 1.00 0.00 H new ATOM 740 N PRO A 56 -14.904 3.573 2.920 1.00 0.00 N ATOM 741 CA PRO A 56 -13.703 3.834 2.121 1.00 0.00 C ATOM 742 C PRO A 56 -13.824 5.107 1.291 1.00 0.00 C ATOM 743 O PRO A 56 -14.896 5.705 1.207 1.00 0.00 O ATOM 744 CB PRO A 56 -13.610 2.608 1.210 1.00 0.00 C ATOM 745 CG PRO A 56 -15.009 2.106 1.105 1.00 0.00 C ATOM 746 CD PRO A 56 -15.656 2.406 2.429 1.00 0.00 C ATOM 0 HA PRO A 56 -12.823 3.985 2.746 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -13.210 2.872 0.231 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -12.949 1.851 1.631 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -15.540 2.598 0.290 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -15.025 1.036 0.896 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -16.717 2.630 2.316 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -15.580 1.562 3.114 1.00 0.00 H new ATOM 754 N ALA A 57 -12.717 5.516 0.679 1.00 0.00 N ATOM 755 CA ALA A 57 -12.700 6.717 -0.147 1.00 0.00 C ATOM 756 C ALA A 57 -11.692 6.587 -1.284 1.00 0.00 C ATOM 757 O ALA A 57 -10.710 5.853 -1.175 1.00 0.00 O ATOM 758 CB ALA A 57 -12.385 7.938 0.704 1.00 0.00 C ATOM 0 H ALA A 57 -11.821 5.033 0.740 1.00 0.00 H new ATOM 0 HA ALA A 57 -13.690 6.840 -0.587 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -12.376 8.828 0.074 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -13.145 8.049 1.477 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -11.408 7.814 1.171 1.00 0.00 H new ATOM 764 N VAL A 58 -11.942 7.305 -2.374 1.00 0.00 N ATOM 765 CA VAL A 58 -11.055 7.271 -3.531 1.00 0.00 C ATOM 766 C VAL A 58 -9.884 8.231 -3.355 1.00 0.00 C ATOM 767 O VAL A 58 -10.069 9.393 -2.995 1.00 0.00 O ATOM 768 CB VAL A 58 -11.809 7.629 -4.826 1.00 0.00 C ATOM 769 CG1 VAL A 58 -10.851 7.670 -6.007 1.00 0.00 C ATOM 770 CG2 VAL A 58 -12.937 6.640 -5.077 1.00 0.00 C ATOM 0 H VAL A 58 -12.751 7.917 -2.480 1.00 0.00 H new ATOM 0 HA VAL A 58 -10.676 6.252 -3.610 1.00 0.00 H new ATOM 0 HB VAL A 58 -12.246 8.620 -4.709 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -11.401 7.924 -6.913 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -10.082 8.421 -5.826 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -10.382 6.694 -6.129 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -13.459 6.908 -5.996 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -12.525 5.635 -5.174 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -13.637 6.666 -4.242 1.00 0.00 H new ATOM 780 N VAL A 59 -8.677 7.737 -3.613 1.00 0.00 N ATOM 781 CA VAL A 59 -7.475 8.551 -3.485 1.00 0.00 C ATOM 782 C VAL A 59 -6.473 8.229 -4.588 1.00 0.00 C ATOM 783 O VAL A 59 -6.671 7.298 -5.369 1.00 0.00 O ATOM 784 CB VAL A 59 -6.799 8.343 -2.116 1.00 0.00 C ATOM 785 CG1 VAL A 59 -7.763 8.679 -0.988 1.00 0.00 C ATOM 786 CG2 VAL A 59 -6.289 6.916 -1.986 1.00 0.00 C ATOM 0 H VAL A 59 -8.506 6.777 -3.912 1.00 0.00 H new ATOM 0 HA VAL A 59 -7.787 9.592 -3.574 1.00 0.00 H new ATOM 0 HB VAL A 59 -5.946 9.017 -2.045 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.268 8.526 -0.029 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -8.075 9.720 -1.074 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -8.638 8.032 -1.052 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -5.814 6.786 -1.013 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -7.124 6.221 -2.078 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.563 6.716 -2.774 1.00 0.00 H new ATOM 796 N HIS A 60 -5.395 9.006 -4.646 1.00 0.00 N ATOM 797 CA HIS A 60 -4.360 8.802 -5.654 1.00 0.00 C ATOM 798 C HIS A 60 -3.245 7.912 -5.115 1.00 0.00 C ATOM 799 O HIS A 60 -2.968 7.903 -3.915 1.00 0.00 O ATOM 800 CB HIS A 60 -3.785 10.146 -6.102 1.00 0.00 C ATOM 801 CG HIS A 60 -2.369 10.060 -6.584 1.00 0.00 C ATOM 802 ND1 HIS A 60 -2.036 9.843 -7.905 1.00 0.00 N ATOM 803 CD2 HIS A 60 -1.198 10.166 -5.914 1.00 0.00 C ATOM 804 CE1 HIS A 60 -0.721 9.817 -8.026 1.00 0.00 C ATOM 805 NE2 HIS A 60 -0.188 10.011 -6.832 1.00 0.00 N ATOM 0 H HIS A 60 -5.216 9.781 -4.008 1.00 0.00 H new ATOM 0 HA HIS A 60 -4.814 8.305 -6.511 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -4.408 10.551 -6.900 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -3.835 10.849 -5.270 1.00 0.00 H new ATOM 0 HD1 HIS A 60 -2.701 9.722 -8.669 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -1.080 10.340 -4.855 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -0.174 9.663 -8.945 1.00 0.00 H new ATOM 814 N PHE A 61 -2.608 7.163 -6.009 1.00 0.00 N ATOM 815 CA PHE A 61 -1.524 6.267 -5.623 1.00 0.00 C ATOM 816 C PHE A 61 -0.348 6.389 -6.589 1.00 0.00 C ATOM 817 O PHE A 61 -0.534 6.490 -7.802 1.00 0.00 O ATOM 818 CB PHE A 61 -2.019 4.820 -5.584 1.00 0.00 C ATOM 819 CG PHE A 61 -1.163 3.917 -4.743 1.00 0.00 C ATOM 820 CD1 PHE A 61 -0.072 3.263 -5.294 1.00 0.00 C ATOM 821 CD2 PHE A 61 -1.449 3.721 -3.401 1.00 0.00 C ATOM 822 CE1 PHE A 61 0.716 2.431 -4.522 1.00 0.00 C ATOM 823 CE2 PHE A 61 -0.664 2.890 -2.625 1.00 0.00 C ATOM 824 CZ PHE A 61 0.421 2.245 -3.186 1.00 0.00 C ATOM 0 H PHE A 61 -2.824 7.159 -7.006 1.00 0.00 H new ATOM 0 HA PHE A 61 -1.185 6.554 -4.628 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -3.039 4.803 -5.199 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.056 4.429 -6.601 1.00 0.00 H new ATOM 0 HD1 PHE A 61 0.165 3.405 -6.338 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.295 4.224 -2.957 1.00 0.00 H new ATOM 0 HE1 PHE A 61 1.563 1.926 -4.964 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -0.898 2.745 -1.581 1.00 0.00 H new ATOM 0 HZ PHE A 61 1.037 1.597 -2.581 1.00 0.00 H new ATOM 834 N LYS A 62 0.862 6.378 -6.042 1.00 0.00 N ATOM 835 CA LYS A 62 2.070 6.486 -6.852 1.00 0.00 C ATOM 836 C LYS A 62 3.238 5.767 -6.186 1.00 0.00 C ATOM 837 O LYS A 62 3.306 5.675 -4.960 1.00 0.00 O ATOM 838 CB LYS A 62 2.426 7.957 -7.080 1.00 0.00 C ATOM 839 CG LYS A 62 3.602 8.159 -8.020 1.00 0.00 C ATOM 840 CD LYS A 62 3.565 9.532 -8.672 1.00 0.00 C ATOM 841 CE LYS A 62 4.239 10.580 -7.800 1.00 0.00 C ATOM 842 NZ LYS A 62 4.494 11.843 -8.548 1.00 0.00 N ATOM 0 H LYS A 62 1.033 6.295 -5.040 1.00 0.00 H new ATOM 0 HA LYS A 62 1.876 6.012 -7.814 1.00 0.00 H new ATOM 0 HB2 LYS A 62 1.556 8.474 -7.484 1.00 0.00 H new ATOM 0 HB3 LYS A 62 2.655 8.420 -6.120 1.00 0.00 H new ATOM 0 HG2 LYS A 62 4.535 8.042 -7.468 1.00 0.00 H new ATOM 0 HG3 LYS A 62 3.589 7.389 -8.791 1.00 0.00 H new ATOM 0 HD2 LYS A 62 4.062 9.489 -9.641 1.00 0.00 H new ATOM 0 HD3 LYS A 62 2.530 9.821 -8.856 1.00 0.00 H new ATOM 0 HE2 LYS A 62 3.611 10.791 -6.934 1.00 0.00 H new ATOM 0 HE3 LYS A 62 5.182 10.186 -7.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 4.954 12.532 -7.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 5.114 11.647 -9.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 3.592 12.233 -8.888 1.00 0.00 H new ATOM 856 N VAL A 63 4.157 5.259 -7.002 1.00 0.00 N ATOM 857 CA VAL A 63 5.324 4.550 -6.491 1.00 0.00 C ATOM 858 C VAL A 63 6.596 5.003 -7.200 1.00 0.00 C ATOM 859 O VAL A 63 6.742 4.824 -8.409 1.00 0.00 O ATOM 860 CB VAL A 63 5.172 3.026 -6.656 1.00 0.00 C ATOM 861 CG1 VAL A 63 6.419 2.308 -6.162 1.00 0.00 C ATOM 862 CG2 VAL A 63 3.935 2.532 -5.921 1.00 0.00 C ATOM 0 H VAL A 63 4.116 5.325 -8.019 1.00 0.00 H new ATOM 0 HA VAL A 63 5.399 4.787 -5.430 1.00 0.00 H new ATOM 0 HB VAL A 63 5.050 2.803 -7.716 1.00 0.00 H new ATOM 0 HG11 VAL A 63 6.293 1.232 -6.287 1.00 0.00 H new ATOM 0 HG12 VAL A 63 7.283 2.641 -6.737 1.00 0.00 H new ATOM 0 HG13 VAL A 63 6.576 2.535 -5.108 1.00 0.00 H new ATOM 0 HG21 VAL A 63 3.843 1.453 -6.048 1.00 0.00 H new ATOM 0 HG22 VAL A 63 4.024 2.766 -4.860 1.00 0.00 H new ATOM 0 HG23 VAL A 63 3.050 3.022 -6.327 1.00 0.00 H new ATOM 872 N SER A 64 7.514 5.589 -6.439 1.00 0.00 N ATOM 873 CA SER A 64 8.773 6.071 -6.995 1.00 0.00 C ATOM 874 C SER A 64 9.922 5.840 -6.018 1.00 0.00 C ATOM 875 O SER A 64 9.727 5.301 -4.930 1.00 0.00 O ATOM 876 CB SER A 64 8.669 7.559 -7.335 1.00 0.00 C ATOM 877 OG SER A 64 9.630 7.928 -8.309 1.00 0.00 O ATOM 0 H SER A 64 7.410 5.742 -5.436 1.00 0.00 H new ATOM 0 HA SER A 64 8.977 5.511 -7.908 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.668 7.782 -7.705 1.00 0.00 H new ATOM 0 HB3 SER A 64 8.815 8.153 -6.432 1.00 0.00 H new ATOM 0 HG SER A 64 9.542 8.883 -8.510 1.00 0.00 H new ATOM 883 N ALA A 65 11.121 6.253 -6.416 1.00 0.00 N ATOM 884 CA ALA A 65 12.302 6.094 -5.577 1.00 0.00 C ATOM 885 C ALA A 65 12.155 6.867 -4.271 1.00 0.00 C ATOM 886 O ALA A 65 12.911 6.652 -3.324 1.00 0.00 O ATOM 887 CB ALA A 65 13.547 6.548 -6.324 1.00 0.00 C ATOM 0 H ALA A 65 11.300 6.700 -7.315 1.00 0.00 H new ATOM 0 HA ALA A 65 12.404 5.036 -5.334 1.00 0.00 H new ATOM 0 HB1 ALA A 65 14.421 6.423 -5.684 1.00 0.00 H new ATOM 0 HB2 ALA A 65 13.669 5.948 -7.226 1.00 0.00 H new ATOM 0 HB3 ALA A 65 13.445 7.598 -6.597 1.00 0.00 H new ATOM 893 N GLN A 66 11.178 7.768 -4.228 1.00 0.00 N ATOM 894 CA GLN A 66 10.934 8.574 -3.038 1.00 0.00 C ATOM 895 C GLN A 66 9.920 7.898 -2.121 1.00 0.00 C ATOM 896 O GLN A 66 9.375 8.524 -1.213 1.00 0.00 O ATOM 897 CB GLN A 66 10.435 9.965 -3.432 1.00 0.00 C ATOM 898 CG GLN A 66 11.552 10.976 -3.637 1.00 0.00 C ATOM 899 CD GLN A 66 11.114 12.397 -3.341 1.00 0.00 C ATOM 900 OE1 GLN A 66 11.112 13.255 -4.225 1.00 0.00 O ATOM 901 NE2 GLN A 66 10.740 12.654 -2.093 1.00 0.00 N ATOM 0 H GLN A 66 10.543 7.958 -5.003 1.00 0.00 H new ATOM 0 HA GLN A 66 11.876 8.673 -2.498 1.00 0.00 H new ATOM 0 HB2 GLN A 66 9.854 9.887 -4.351 1.00 0.00 H new ATOM 0 HB3 GLN A 66 9.761 10.333 -2.659 1.00 0.00 H new ATOM 0 HG2 GLN A 66 12.393 10.718 -2.994 1.00 0.00 H new ATOM 0 HG3 GLN A 66 11.907 10.916 -4.666 1.00 0.00 H new ATOM 0 HE21 GLN A 66 10.757 11.913 -1.393 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.435 13.593 -1.835 1.00 0.00 H new ATOM 910 N GLY A 67 9.671 6.615 -2.366 1.00 0.00 N ATOM 911 CA GLY A 67 8.723 5.875 -1.554 1.00 0.00 C ATOM 912 C GLY A 67 7.324 5.892 -2.137 1.00 0.00 C ATOM 913 O GLY A 67 7.153 5.898 -3.356 1.00 0.00 O ATOM 0 H GLY A 67 10.109 6.075 -3.112 1.00 0.00 H new ATOM 0 HA2 GLY A 67 9.060 4.843 -1.457 1.00 0.00 H new ATOM 0 HA3 GLY A 67 8.700 6.299 -0.550 1.00 0.00 H new ATOM 917 N ILE A 68 6.321 5.899 -1.265 1.00 0.00 N ATOM 918 CA ILE A 68 4.930 5.915 -1.701 1.00 0.00 C ATOM 919 C ILE A 68 4.318 7.302 -1.537 1.00 0.00 C ATOM 920 O ILE A 68 4.603 8.008 -0.569 1.00 0.00 O ATOM 921 CB ILE A 68 4.083 4.896 -0.916 1.00 0.00 C ATOM 922 CG1 ILE A 68 4.456 3.469 -1.322 1.00 0.00 C ATOM 923 CG2 ILE A 68 2.601 5.148 -1.150 1.00 0.00 C ATOM 924 CD1 ILE A 68 3.747 2.405 -0.513 1.00 0.00 C ATOM 0 H ILE A 68 6.446 5.894 -0.253 1.00 0.00 H new ATOM 0 HA ILE A 68 4.927 5.642 -2.756 1.00 0.00 H new ATOM 0 HB ILE A 68 4.289 5.017 0.147 1.00 0.00 H new ATOM 0 HG12 ILE A 68 4.222 3.327 -2.377 1.00 0.00 H new ATOM 0 HG13 ILE A 68 5.533 3.339 -1.214 1.00 0.00 H new ATOM 0 HG21 ILE A 68 2.015 4.420 -0.589 1.00 0.00 H new ATOM 0 HG22 ILE A 68 2.346 6.154 -0.816 1.00 0.00 H new ATOM 0 HG23 ILE A 68 2.379 5.051 -2.213 1.00 0.00 H new ATOM 0 HD11 ILE A 68 4.060 1.419 -0.856 1.00 0.00 H new ATOM 0 HD12 ILE A 68 4.000 2.520 0.541 1.00 0.00 H new ATOM 0 HD13 ILE A 68 2.669 2.509 -0.641 1.00 0.00 H new ATOM 936 N THR A 69 3.474 7.686 -2.489 1.00 0.00 N ATOM 937 CA THR A 69 2.820 8.988 -2.450 1.00 0.00 C ATOM 938 C THR A 69 1.332 8.866 -2.756 1.00 0.00 C ATOM 939 O THR A 69 0.934 8.154 -3.679 1.00 0.00 O ATOM 940 CB THR A 69 3.460 9.968 -3.453 1.00 0.00 C ATOM 941 OG1 THR A 69 4.811 10.247 -3.070 1.00 0.00 O ATOM 942 CG2 THR A 69 2.668 11.265 -3.522 1.00 0.00 C ATOM 0 H THR A 69 3.227 7.114 -3.297 1.00 0.00 H new ATOM 0 HA THR A 69 2.949 9.376 -1.440 1.00 0.00 H new ATOM 0 HB THR A 69 3.451 9.503 -4.439 1.00 0.00 H new ATOM 0 HG1 THR A 69 4.999 11.199 -3.206 1.00 0.00 H new ATOM 0 HG21 THR A 69 3.138 11.941 -4.236 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.648 11.052 -3.842 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.649 11.733 -2.538 1.00 0.00 H new ATOM 950 N LEU A 70 0.513 9.565 -1.978 1.00 0.00 N ATOM 951 CA LEU A 70 -0.933 9.535 -2.166 1.00 0.00 C ATOM 952 C LEU A 70 -1.511 10.946 -2.167 1.00 0.00 C ATOM 953 O LEU A 70 -0.995 11.841 -1.497 1.00 0.00 O ATOM 954 CB LEU A 70 -1.593 8.701 -1.067 1.00 0.00 C ATOM 955 CG LEU A 70 -0.886 7.397 -0.697 1.00 0.00 C ATOM 956 CD1 LEU A 70 -1.450 6.832 0.597 1.00 0.00 C ATOM 957 CD2 LEU A 70 -1.014 6.383 -1.825 1.00 0.00 C ATOM 0 H LEU A 70 0.826 10.160 -1.211 1.00 0.00 H new ATOM 0 HA LEU A 70 -1.140 9.077 -3.133 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -1.671 9.315 -0.170 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -2.610 8.463 -1.380 1.00 0.00 H new ATOM 0 HG LEU A 70 0.172 7.610 -0.545 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.934 5.904 0.844 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -1.306 7.553 1.402 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -2.515 6.634 0.474 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -0.505 5.461 -1.545 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.068 6.174 -2.009 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.561 6.787 -2.730 1.00 0.00 H new ATOM 969 N THR A 71 -2.589 11.139 -2.921 1.00 0.00 N ATOM 970 CA THR A 71 -3.238 12.441 -3.008 1.00 0.00 C ATOM 971 C THR A 71 -4.756 12.298 -3.018 1.00 0.00 C ATOM 972 O THR A 71 -5.328 11.710 -3.936 1.00 0.00 O ATOM 973 CB THR A 71 -2.798 13.205 -4.271 1.00 0.00 C ATOM 974 OG1 THR A 71 -1.378 13.111 -4.430 1.00 0.00 O ATOM 975 CG2 THR A 71 -3.208 14.668 -4.188 1.00 0.00 C ATOM 0 H THR A 71 -3.031 10.409 -3.480 1.00 0.00 H new ATOM 0 HA THR A 71 -2.934 13.006 -2.127 1.00 0.00 H new ATOM 0 HB THR A 71 -3.291 12.754 -5.132 1.00 0.00 H new ATOM 0 HG1 THR A 71 -1.106 13.598 -5.236 1.00 0.00 H new ATOM 0 HG21 THR A 71 -2.887 15.188 -5.091 1.00 0.00 H new ATOM 0 HG22 THR A 71 -4.292 14.737 -4.095 1.00 0.00 H new ATOM 0 HG23 THR A 71 -2.739 15.128 -3.318 1.00 0.00 H new ATOM 983 N ASP A 72 -5.403 12.839 -1.992 1.00 0.00 N ATOM 984 CA ASP A 72 -6.856 12.774 -1.884 1.00 0.00 C ATOM 985 C ASP A 72 -7.481 14.143 -2.132 1.00 0.00 C ATOM 986 O ASP A 72 -7.174 15.112 -1.440 1.00 0.00 O ATOM 987 CB ASP A 72 -7.263 12.257 -0.503 1.00 0.00 C ATOM 988 CG ASP A 72 -8.683 11.727 -0.479 1.00 0.00 C ATOM 989 OD1 ASP A 72 -9.467 12.092 -1.379 1.00 0.00 O ATOM 990 OD2 ASP A 72 -9.010 10.947 0.441 1.00 0.00 O ATOM 0 H ASP A 72 -4.944 13.328 -1.223 1.00 0.00 H new ATOM 0 HA ASP A 72 -7.222 12.084 -2.645 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -6.578 11.466 -0.198 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -7.166 13.061 0.226 1.00 0.00 H new ATOM 995 N ASN A 73 -8.361 14.214 -3.127 1.00 0.00 N ATOM 996 CA ASN A 73 -9.028 15.465 -3.468 1.00 0.00 C ATOM 997 C ASN A 73 -10.353 15.596 -2.722 1.00 0.00 C ATOM 998 O ASN A 73 -11.152 16.487 -3.009 1.00 0.00 O ATOM 999 CB ASN A 73 -9.270 15.544 -4.977 1.00 0.00 C ATOM 1000 CG ASN A 73 -9.264 16.971 -5.490 1.00 0.00 C ATOM 1001 OD1 ASN A 73 -10.271 17.462 -6.002 1.00 0.00 O ATOM 1002 ND2 ASN A 73 -8.128 17.644 -5.354 1.00 0.00 N ATOM 0 H ASN A 73 -8.628 13.421 -3.710 1.00 0.00 H new ATOM 0 HA ASN A 73 -8.379 16.287 -3.167 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -8.501 14.971 -5.496 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -10.228 15.080 -5.213 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -8.064 18.608 -5.680 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -7.319 17.197 -4.924 1.00 0.00 H new ATOM 1009 N GLN A 74 -10.578 14.701 -1.765 1.00 0.00 N ATOM 1010 CA GLN A 74 -11.806 14.717 -0.979 1.00 0.00 C ATOM 1011 C GLN A 74 -11.564 15.333 0.395 1.00 0.00 C ATOM 1012 O GLN A 74 -12.504 15.746 1.075 1.00 0.00 O ATOM 1013 CB GLN A 74 -12.356 13.298 -0.825 1.00 0.00 C ATOM 1014 CG GLN A 74 -12.711 12.636 -2.147 1.00 0.00 C ATOM 1015 CD GLN A 74 -13.532 11.375 -1.967 1.00 0.00 C ATOM 1016 OE1 GLN A 74 -13.462 10.719 -0.927 1.00 0.00 O ATOM 1017 NE2 GLN A 74 -14.315 11.028 -2.981 1.00 0.00 N ATOM 0 H GLN A 74 -9.927 13.957 -1.516 1.00 0.00 H new ATOM 0 HA GLN A 74 -12.538 15.328 -1.507 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -11.617 12.685 -0.308 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -13.244 13.328 -0.193 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -13.267 13.342 -2.764 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -11.795 12.394 -2.685 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -14.342 11.601 -3.824 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -14.890 10.188 -2.917 1.00 0.00 H new ATOM 1026 N ARG A 75 -10.299 15.391 0.798 1.00 0.00 N ATOM 1027 CA ARG A 75 -9.935 15.955 2.092 1.00 0.00 C ATOM 1028 C ARG A 75 -10.883 15.468 3.184 1.00 0.00 C ATOM 1029 O ARG A 75 -11.419 16.263 3.956 1.00 0.00 O ATOM 1030 CB ARG A 75 -9.954 17.483 2.030 1.00 0.00 C ATOM 1031 CG ARG A 75 -8.767 18.077 1.288 1.00 0.00 C ATOM 1032 CD ARG A 75 -8.664 19.578 1.514 1.00 0.00 C ATOM 1033 NE ARG A 75 -7.758 20.213 0.561 1.00 0.00 N ATOM 1034 CZ ARG A 75 -8.075 20.454 -0.707 1.00 0.00 C ATOM 1035 NH1 ARG A 75 -9.270 20.114 -1.171 1.00 0.00 N ATOM 1036 NH2 ARG A 75 -7.196 21.036 -1.513 1.00 0.00 N ATOM 0 H ARG A 75 -9.509 15.054 0.247 1.00 0.00 H new ATOM 0 HA ARG A 75 -8.926 15.620 2.335 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -10.874 17.807 1.544 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -9.972 17.879 3.045 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -7.849 17.594 1.622 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -8.864 17.874 0.221 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -9.654 20.027 1.428 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -8.315 19.769 2.529 1.00 0.00 H new ATOM 0 HE ARG A 75 -6.831 20.487 0.886 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -9.948 19.667 -0.554 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -9.511 20.300 -2.145 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -6.276 21.299 -1.160 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -7.440 21.220 -2.486 1.00 0.00 H new ATOM 1050 N LYS A 76 -11.085 14.156 3.243 1.00 0.00 N ATOM 1051 CA LYS A 76 -11.968 13.562 4.240 1.00 0.00 C ATOM 1052 C LYS A 76 -11.163 12.932 5.372 1.00 0.00 C ATOM 1053 O LYS A 76 -11.253 13.359 6.524 1.00 0.00 O ATOM 1054 CB LYS A 76 -12.867 12.507 3.591 1.00 0.00 C ATOM 1055 CG LYS A 76 -13.895 13.088 2.636 1.00 0.00 C ATOM 1056 CD LYS A 76 -15.156 13.518 3.368 1.00 0.00 C ATOM 1057 CE LYS A 76 -14.918 14.769 4.200 1.00 0.00 C ATOM 1058 NZ LYS A 76 -16.169 15.553 4.394 1.00 0.00 N ATOM 0 H LYS A 76 -10.649 13.484 2.612 1.00 0.00 H new ATOM 0 HA LYS A 76 -12.590 14.354 4.657 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -12.244 11.794 3.051 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -13.384 11.951 4.373 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -13.466 13.944 2.115 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -14.148 12.347 1.878 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -15.951 13.706 2.646 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -15.497 12.709 4.014 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -14.512 14.487 5.171 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -14.170 15.393 3.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -15.964 16.397 4.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -16.543 15.844 3.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -16.874 14.966 4.884 1.00 0.00 H new ATOM 1072 N LEU A 77 -10.376 11.915 5.038 1.00 0.00 N ATOM 1073 CA LEU A 77 -9.554 11.227 6.027 1.00 0.00 C ATOM 1074 C LEU A 77 -8.124 11.758 6.010 1.00 0.00 C ATOM 1075 O LEU A 77 -7.549 12.057 7.057 1.00 0.00 O ATOM 1076 CB LEU A 77 -9.554 9.721 5.760 1.00 0.00 C ATOM 1077 CG LEU A 77 -10.871 8.992 6.028 1.00 0.00 C ATOM 1078 CD1 LEU A 77 -11.338 9.239 7.454 1.00 0.00 C ATOM 1079 CD2 LEU A 77 -11.935 9.430 5.033 1.00 0.00 C ATOM 0 H LEU A 77 -10.290 11.549 4.090 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.980 11.415 7.012 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -9.276 9.557 4.719 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.777 9.264 6.373 1.00 0.00 H new ATOM 0 HG LEU A 77 -10.703 7.922 5.903 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -12.277 8.712 7.626 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -10.584 8.875 8.152 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -11.488 10.308 7.608 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -12.865 8.901 5.239 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.100 10.503 5.126 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -11.603 9.200 4.021 1.00 0.00 H new ATOM 1091 N PHE A 78 -7.555 11.873 4.815 1.00 0.00 N ATOM 1092 CA PHE A 78 -6.192 12.369 4.661 1.00 0.00 C ATOM 1093 C PHE A 78 -6.037 13.134 3.350 1.00 0.00 C ATOM 1094 O PHE A 78 -6.267 12.590 2.270 1.00 0.00 O ATOM 1095 CB PHE A 78 -5.196 11.209 4.709 1.00 0.00 C ATOM 1096 CG PHE A 78 -5.177 10.383 3.455 1.00 0.00 C ATOM 1097 CD1 PHE A 78 -6.158 9.433 3.220 1.00 0.00 C ATOM 1098 CD2 PHE A 78 -4.177 10.556 2.512 1.00 0.00 C ATOM 1099 CE1 PHE A 78 -6.143 8.671 2.067 1.00 0.00 C ATOM 1100 CE2 PHE A 78 -4.157 9.797 1.356 1.00 0.00 C ATOM 1101 CZ PHE A 78 -5.141 8.853 1.134 1.00 0.00 C ATOM 0 H PHE A 78 -8.016 11.629 3.939 1.00 0.00 H new ATOM 0 HA PHE A 78 -5.984 13.051 5.486 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.197 11.606 4.888 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -5.440 10.566 5.555 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -6.944 9.286 3.946 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.405 11.292 2.681 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -6.914 7.934 1.896 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -3.373 9.942 0.628 1.00 0.00 H new ATOM 0 HZ PHE A 78 -5.127 8.258 0.233 1.00 0.00 H new ATOM 1111 N PHE A 79 -5.645 14.399 3.453 1.00 0.00 N ATOM 1112 CA PHE A 79 -5.459 15.241 2.276 1.00 0.00 C ATOM 1113 C PHE A 79 -4.341 14.698 1.391 1.00 0.00 C ATOM 1114 O PHE A 79 -4.594 14.158 0.314 1.00 0.00 O ATOM 1115 CB PHE A 79 -5.142 16.678 2.695 1.00 0.00 C ATOM 1116 CG PHE A 79 -4.569 17.513 1.586 1.00 0.00 C ATOM 1117 CD1 PHE A 79 -4.964 17.310 0.273 1.00 0.00 C ATOM 1118 CD2 PHE A 79 -3.636 18.500 1.855 1.00 0.00 C ATOM 1119 CE1 PHE A 79 -4.439 18.077 -0.750 1.00 0.00 C ATOM 1120 CE2 PHE A 79 -3.108 19.271 0.836 1.00 0.00 C ATOM 1121 CZ PHE A 79 -3.509 19.058 -0.468 1.00 0.00 C ATOM 0 H PHE A 79 -5.450 14.864 4.339 1.00 0.00 H new ATOM 0 HA PHE A 79 -6.387 15.234 1.704 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -6.053 17.151 3.061 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -4.437 16.659 3.526 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -5.690 16.544 0.047 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -3.317 18.670 2.873 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -4.756 17.909 -1.769 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -2.383 20.039 1.060 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.096 19.657 -1.266 1.00 0.00 H new ATOM 1131 N ARG A 80 -3.104 14.848 1.853 1.00 0.00 N ATOM 1132 CA ARG A 80 -1.946 14.375 1.103 1.00 0.00 C ATOM 1133 C ARG A 80 -0.855 13.874 2.045 1.00 0.00 C ATOM 1134 O ARG A 80 -0.381 14.611 2.909 1.00 0.00 O ATOM 1135 CB ARG A 80 -1.394 15.493 0.216 1.00 0.00 C ATOM 1136 CG ARG A 80 -0.263 15.046 -0.695 1.00 0.00 C ATOM 1137 CD ARG A 80 0.608 16.219 -1.118 1.00 0.00 C ATOM 1138 NE ARG A 80 1.843 15.778 -1.762 1.00 0.00 N ATOM 1139 CZ ARG A 80 1.931 15.477 -3.053 1.00 0.00 C ATOM 1140 NH1 ARG A 80 0.862 15.568 -3.833 1.00 0.00 N ATOM 1141 NH2 ARG A 80 3.089 15.084 -3.566 1.00 0.00 N ATOM 0 H ARG A 80 -2.878 15.293 2.742 1.00 0.00 H new ATOM 0 HA ARG A 80 -2.268 13.546 0.473 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -2.203 15.894 -0.394 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -1.039 16.306 0.849 1.00 0.00 H new ATOM 0 HG2 ARG A 80 0.348 14.304 -0.181 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -0.677 14.561 -1.579 1.00 0.00 H new ATOM 0 HD2 ARG A 80 0.050 16.857 -1.803 1.00 0.00 H new ATOM 0 HD3 ARG A 80 0.850 16.824 -0.245 1.00 0.00 H new ATOM 0 HE ARG A 80 2.683 15.697 -1.189 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -0.030 15.870 -3.442 1.00 0.00 H new ATOM 0 HH12 ARG A 80 0.932 15.336 -4.824 1.00 0.00 H new ATOM 0 HH21 ARG A 80 3.913 15.013 -2.969 1.00 0.00 H new ATOM 0 HH22 ARG A 80 3.156 14.853 -4.557 1.00 0.00 H new ATOM 1155 N ARG A 81 -0.463 12.616 1.872 1.00 0.00 N ATOM 1156 CA ARG A 81 0.569 12.016 2.708 1.00 0.00 C ATOM 1157 C ARG A 81 1.701 11.452 1.854 1.00 0.00 C ATOM 1158 O ARG A 81 1.459 10.787 0.846 1.00 0.00 O ATOM 1159 CB ARG A 81 -0.028 10.908 3.578 1.00 0.00 C ATOM 1160 CG ARG A 81 -0.923 11.425 4.693 1.00 0.00 C ATOM 1161 CD ARG A 81 -0.112 11.838 5.911 1.00 0.00 C ATOM 1162 NE ARG A 81 0.306 10.686 6.706 1.00 0.00 N ATOM 1163 CZ ARG A 81 0.900 10.787 7.890 1.00 0.00 C ATOM 1164 NH1 ARG A 81 1.144 11.981 8.414 1.00 0.00 N ATOM 1165 NH2 ARG A 81 1.251 9.693 8.553 1.00 0.00 N ATOM 0 H ARG A 81 -0.845 11.993 1.160 1.00 0.00 H new ATOM 0 HA ARG A 81 0.976 12.795 3.353 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -0.603 10.231 2.946 1.00 0.00 H new ATOM 0 HB3 ARG A 81 0.782 10.324 4.015 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -1.500 12.277 4.333 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -1.638 10.652 4.975 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.768 12.395 5.589 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -0.705 12.510 6.531 1.00 0.00 H new ATOM 0 HE ARG A 81 0.132 9.753 6.332 1.00 0.00 H new ATOM 0 HH11 ARG A 81 0.875 12.825 7.908 1.00 0.00 H new ATOM 0 HH12 ARG A 81 1.600 12.055 9.323 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.065 8.773 8.154 1.00 0.00 H new ATOM 0 HH22 ARG A 81 1.707 9.772 9.462 1.00 0.00 H new ATOM 1179 N HIS A 82 2.936 11.723 2.263 1.00 0.00 N ATOM 1180 CA HIS A 82 4.105 11.242 1.535 1.00 0.00 C ATOM 1181 C HIS A 82 4.968 10.350 2.421 1.00 0.00 C ATOM 1182 O HIS A 82 5.416 10.766 3.490 1.00 0.00 O ATOM 1183 CB HIS A 82 4.931 12.421 1.020 1.00 0.00 C ATOM 1184 CG HIS A 82 5.691 12.117 -0.235 1.00 0.00 C ATOM 1185 ND1 HIS A 82 6.529 11.030 -0.362 1.00 0.00 N ATOM 1186 CD2 HIS A 82 5.735 12.765 -1.423 1.00 0.00 C ATOM 1187 CE1 HIS A 82 7.057 11.023 -1.574 1.00 0.00 C ATOM 1188 NE2 HIS A 82 6.590 12.065 -2.237 1.00 0.00 N ATOM 0 H HIS A 82 3.153 12.273 3.094 1.00 0.00 H new ATOM 0 HA HIS A 82 3.757 10.653 0.686 1.00 0.00 H new ATOM 0 HB2 HIS A 82 4.268 13.267 0.838 1.00 0.00 H new ATOM 0 HB3 HIS A 82 5.633 12.728 1.795 1.00 0.00 H new ATOM 0 HD2 HIS A 82 5.197 13.665 -1.682 1.00 0.00 H new ATOM 0 HE1 HIS A 82 7.752 10.290 -1.957 1.00 0.00 H new ATOM 0 HE2 HIS A 82 6.826 12.310 -3.198 1.00 0.00 H new ATOM 1197 N TYR A 83 5.197 9.121 1.971 1.00 0.00 N ATOM 1198 CA TYR A 83 6.004 8.169 2.725 1.00 0.00 C ATOM 1199 C TYR A 83 7.324 7.889 2.013 1.00 0.00 C ATOM 1200 O TYR A 83 7.362 7.552 0.830 1.00 0.00 O ATOM 1201 CB TYR A 83 5.234 6.863 2.926 1.00 0.00 C ATOM 1202 CG TYR A 83 3.970 7.024 3.739 1.00 0.00 C ATOM 1203 CD1 TYR A 83 3.974 7.739 4.931 1.00 0.00 C ATOM 1204 CD2 TYR A 83 2.772 6.461 3.318 1.00 0.00 C ATOM 1205 CE1 TYR A 83 2.822 7.889 5.678 1.00 0.00 C ATOM 1206 CE2 TYR A 83 1.615 6.606 4.058 1.00 0.00 C ATOM 1207 CZ TYR A 83 1.645 7.321 5.237 1.00 0.00 C ATOM 1208 OH TYR A 83 0.494 7.467 5.978 1.00 0.00 O ATOM 0 H TYR A 83 4.835 8.761 1.088 1.00 0.00 H new ATOM 0 HA TYR A 83 6.223 8.608 3.698 1.00 0.00 H new ATOM 0 HB2 TYR A 83 4.978 6.448 1.951 1.00 0.00 H new ATOM 0 HB3 TYR A 83 5.884 6.140 3.420 1.00 0.00 H new ATOM 0 HD1 TYR A 83 4.894 8.185 5.279 1.00 0.00 H new ATOM 0 HD2 TYR A 83 2.745 5.900 2.396 1.00 0.00 H new ATOM 0 HE1 TYR A 83 2.843 8.448 6.602 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.692 6.162 3.715 1.00 0.00 H new ATOM 0 HH TYR A 83 -0.245 7.008 5.528 1.00 0.00 H new ATOM 1218 N PRO A 84 8.435 8.033 2.751 1.00 0.00 N ATOM 1219 CA PRO A 84 9.779 7.800 2.213 1.00 0.00 C ATOM 1220 C PRO A 84 10.041 6.325 1.927 1.00 0.00 C ATOM 1221 O PRO A 84 9.585 5.449 2.662 1.00 0.00 O ATOM 1222 CB PRO A 84 10.699 8.300 3.329 1.00 0.00 C ATOM 1223 CG PRO A 84 9.890 8.173 4.573 1.00 0.00 C ATOM 1224 CD PRO A 84 8.465 8.432 4.168 1.00 0.00 C ATOM 0 HA PRO A 84 9.930 8.305 1.259 1.00 0.00 H new ATOM 0 HB2 PRO A 84 11.610 7.705 3.387 1.00 0.00 H new ATOM 0 HB3 PRO A 84 11.003 9.333 3.158 1.00 0.00 H new ATOM 0 HG2 PRO A 84 9.998 7.180 5.009 1.00 0.00 H new ATOM 0 HG3 PRO A 84 10.218 8.889 5.327 1.00 0.00 H new ATOM 0 HD2 PRO A 84 7.765 7.847 4.765 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.195 9.480 4.296 1.00 0.00 H new ATOM 1232 N VAL A 85 10.779 6.057 0.854 1.00 0.00 N ATOM 1233 CA VAL A 85 11.103 4.688 0.472 1.00 0.00 C ATOM 1234 C VAL A 85 11.600 3.886 1.669 1.00 0.00 C ATOM 1235 O VAL A 85 11.180 2.750 1.885 1.00 0.00 O ATOM 1236 CB VAL A 85 12.173 4.653 -0.635 1.00 0.00 C ATOM 1237 CG1 VAL A 85 13.363 5.522 -0.256 1.00 0.00 C ATOM 1238 CG2 VAL A 85 12.612 3.222 -0.907 1.00 0.00 C ATOM 0 H VAL A 85 11.164 6.770 0.234 1.00 0.00 H new ATOM 0 HA VAL A 85 10.184 4.239 0.094 1.00 0.00 H new ATOM 0 HB VAL A 85 11.737 5.055 -1.550 1.00 0.00 H new ATOM 0 HG11 VAL A 85 14.108 5.485 -1.050 1.00 0.00 H new ATOM 0 HG12 VAL A 85 13.032 6.551 -0.117 1.00 0.00 H new ATOM 0 HG13 VAL A 85 13.802 5.154 0.671 1.00 0.00 H new ATOM 0 HG21 VAL A 85 13.368 3.216 -1.692 1.00 0.00 H new ATOM 0 HG22 VAL A 85 13.030 2.790 0.003 1.00 0.00 H new ATOM 0 HG23 VAL A 85 11.753 2.632 -1.227 1.00 0.00 H new ATOM 1248 N ASN A 86 12.497 4.486 2.445 1.00 0.00 N ATOM 1249 CA ASN A 86 13.052 3.828 3.622 1.00 0.00 C ATOM 1250 C ASN A 86 11.941 3.366 4.561 1.00 0.00 C ATOM 1251 O ASN A 86 11.789 2.172 4.819 1.00 0.00 O ATOM 1252 CB ASN A 86 14.000 4.773 4.362 1.00 0.00 C ATOM 1253 CG ASN A 86 15.047 4.028 5.167 1.00 0.00 C ATOM 1254 OD1 ASN A 86 15.796 3.212 4.629 1.00 0.00 O ATOM 1255 ND2 ASN A 86 15.105 4.307 6.464 1.00 0.00 N ATOM 0 H ASN A 86 12.855 5.427 2.280 1.00 0.00 H new ATOM 0 HA ASN A 86 13.610 2.953 3.289 1.00 0.00 H new ATOM 0 HB2 ASN A 86 14.495 5.424 3.642 1.00 0.00 H new ATOM 0 HB3 ASN A 86 13.423 5.415 5.028 1.00 0.00 H new ATOM 0 HD21 ASN A 86 15.790 3.838 7.056 1.00 0.00 H new ATOM 0 HD22 ASN A 86 14.464 4.990 6.868 1.00 0.00 H new ATOM 1262 N SER A 87 11.168 4.320 5.069 1.00 0.00 N ATOM 1263 CA SER A 87 10.073 4.012 5.982 1.00 0.00 C ATOM 1264 C SER A 87 9.398 2.700 5.596 1.00 0.00 C ATOM 1265 O SER A 87 9.035 1.899 6.459 1.00 0.00 O ATOM 1266 CB SER A 87 9.047 5.146 5.982 1.00 0.00 C ATOM 1267 OG SER A 87 7.849 4.750 6.627 1.00 0.00 O ATOM 0 H SER A 87 11.279 5.313 4.864 1.00 0.00 H new ATOM 0 HA SER A 87 10.487 3.907 6.985 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.464 6.018 6.486 1.00 0.00 H new ATOM 0 HB3 SER A 87 8.830 5.444 4.956 1.00 0.00 H new ATOM 0 HG SER A 87 7.210 5.493 6.615 1.00 0.00 H new ATOM 1273 N ILE A 88 9.231 2.487 4.295 1.00 0.00 N ATOM 1274 CA ILE A 88 8.600 1.272 3.795 1.00 0.00 C ATOM 1275 C ILE A 88 9.580 0.103 3.797 1.00 0.00 C ATOM 1276 O ILE A 88 10.652 0.176 3.196 1.00 0.00 O ATOM 1277 CB ILE A 88 8.054 1.468 2.368 1.00 0.00 C ATOM 1278 CG1 ILE A 88 7.089 2.654 2.327 1.00 0.00 C ATOM 1279 CG2 ILE A 88 7.365 0.200 1.887 1.00 0.00 C ATOM 1280 CD1 ILE A 88 6.651 3.028 0.928 1.00 0.00 C ATOM 0 H ILE A 88 9.524 3.140 3.568 1.00 0.00 H new ATOM 0 HA ILE A 88 7.770 1.048 4.465 1.00 0.00 H new ATOM 0 HB ILE A 88 8.889 1.680 1.700 1.00 0.00 H new ATOM 0 HG12 ILE A 88 6.208 2.416 2.923 1.00 0.00 H new ATOM 0 HG13 ILE A 88 7.566 3.516 2.793 1.00 0.00 H new ATOM 0 HG21 ILE A 88 6.984 0.353 0.877 1.00 0.00 H new ATOM 0 HG22 ILE A 88 8.079 -0.623 1.884 1.00 0.00 H new ATOM 0 HG23 ILE A 88 6.537 -0.040 2.554 1.00 0.00 H new ATOM 0 HD11 ILE A 88 5.968 3.876 0.975 1.00 0.00 H new ATOM 0 HD12 ILE A 88 7.524 3.297 0.333 1.00 0.00 H new ATOM 0 HD13 ILE A 88 6.145 2.180 0.466 1.00 0.00 H new ATOM 1292 N THR A 89 9.203 -0.977 4.475 1.00 0.00 N ATOM 1293 CA THR A 89 10.047 -2.162 4.554 1.00 0.00 C ATOM 1294 C THR A 89 9.295 -3.405 4.092 1.00 0.00 C ATOM 1295 O THR A 89 9.902 -4.385 3.661 1.00 0.00 O ATOM 1296 CB THR A 89 10.561 -2.391 5.988 1.00 0.00 C ATOM 1297 OG1 THR A 89 9.473 -2.756 6.846 1.00 0.00 O ATOM 1298 CG2 THR A 89 11.239 -1.140 6.527 1.00 0.00 C ATOM 0 H THR A 89 8.319 -1.055 4.977 1.00 0.00 H new ATOM 0 HA THR A 89 10.897 -1.989 3.894 1.00 0.00 H new ATOM 0 HB THR A 89 11.292 -3.199 5.963 1.00 0.00 H new ATOM 0 HG1 THR A 89 9.808 -2.902 7.755 1.00 0.00 H new ATOM 0 HG21 THR A 89 11.593 -1.326 7.541 1.00 0.00 H new ATOM 0 HG22 THR A 89 12.084 -0.881 5.889 1.00 0.00 H new ATOM 0 HG23 THR A 89 10.526 -0.316 6.538 1.00 0.00 H new ATOM 1306 N PHE A 90 7.970 -3.357 4.183 1.00 0.00 N ATOM 1307 CA PHE A 90 7.135 -4.479 3.773 1.00 0.00 C ATOM 1308 C PHE A 90 5.892 -3.992 3.034 1.00 0.00 C ATOM 1309 O PHE A 90 5.271 -3.004 3.427 1.00 0.00 O ATOM 1310 CB PHE A 90 6.725 -5.309 4.992 1.00 0.00 C ATOM 1311 CG PHE A 90 6.157 -6.654 4.639 1.00 0.00 C ATOM 1312 CD1 PHE A 90 6.989 -7.686 4.235 1.00 0.00 C ATOM 1313 CD2 PHE A 90 4.793 -6.886 4.710 1.00 0.00 C ATOM 1314 CE1 PHE A 90 6.469 -8.925 3.909 1.00 0.00 C ATOM 1315 CE2 PHE A 90 4.268 -8.122 4.386 1.00 0.00 C ATOM 1316 CZ PHE A 90 5.107 -9.143 3.985 1.00 0.00 C ATOM 0 H PHE A 90 7.452 -2.553 4.537 1.00 0.00 H new ATOM 0 HA PHE A 90 7.717 -5.103 3.095 1.00 0.00 H new ATOM 0 HB2 PHE A 90 7.594 -5.448 5.635 1.00 0.00 H new ATOM 0 HB3 PHE A 90 5.987 -4.752 5.569 1.00 0.00 H new ATOM 0 HD1 PHE A 90 8.055 -7.521 4.174 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.132 -6.091 5.022 1.00 0.00 H new ATOM 0 HE1 PHE A 90 7.127 -9.722 3.595 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.203 -8.290 4.446 1.00 0.00 H new ATOM 0 HZ PHE A 90 4.699 -10.110 3.731 1.00 0.00 H new ATOM 1326 N SER A 91 5.536 -4.691 1.961 1.00 0.00 N ATOM 1327 CA SER A 91 4.371 -4.328 1.164 1.00 0.00 C ATOM 1328 C SER A 91 3.984 -5.461 0.219 1.00 0.00 C ATOM 1329 O SER A 91 4.715 -5.779 -0.719 1.00 0.00 O ATOM 1330 CB SER A 91 4.651 -3.054 0.363 1.00 0.00 C ATOM 1331 OG SER A 91 3.766 -2.938 -0.737 1.00 0.00 O ATOM 0 H SER A 91 6.038 -5.512 1.624 1.00 0.00 H new ATOM 0 HA SER A 91 3.539 -4.146 1.844 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.547 -2.183 1.011 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.681 -3.064 0.006 1.00 0.00 H new ATOM 0 HG SER A 91 3.612 -1.991 -0.934 1.00 0.00 H new ATOM 1337 N SER A 92 2.829 -6.068 0.475 1.00 0.00 N ATOM 1338 CA SER A 92 2.345 -7.169 -0.350 1.00 0.00 C ATOM 1339 C SER A 92 0.850 -7.387 -0.142 1.00 0.00 C ATOM 1340 O SER A 92 0.317 -7.134 0.939 1.00 0.00 O ATOM 1341 CB SER A 92 3.110 -8.453 -0.023 1.00 0.00 C ATOM 1342 OG SER A 92 2.625 -9.544 -0.786 1.00 0.00 O ATOM 0 H SER A 92 2.211 -5.816 1.247 1.00 0.00 H new ATOM 0 HA SER A 92 2.514 -6.910 -1.395 1.00 0.00 H new ATOM 0 HB2 SER A 92 4.172 -8.309 -0.223 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.014 -8.677 1.039 1.00 0.00 H new ATOM 0 HG SER A 92 3.131 -10.352 -0.560 1.00 0.00 H new ATOM 1348 N THR A 93 0.176 -7.860 -1.186 1.00 0.00 N ATOM 1349 CA THR A 93 -1.258 -8.111 -1.120 1.00 0.00 C ATOM 1350 C THR A 93 -1.622 -8.893 0.137 1.00 0.00 C ATOM 1351 O THR A 93 -0.760 -9.500 0.773 1.00 0.00 O ATOM 1352 CB THR A 93 -1.749 -8.890 -2.355 1.00 0.00 C ATOM 1353 OG1 THR A 93 -0.740 -9.810 -2.787 1.00 0.00 O ATOM 1354 CG2 THR A 93 -2.097 -7.941 -3.491 1.00 0.00 C ATOM 0 H THR A 93 0.601 -8.077 -2.088 1.00 0.00 H new ATOM 0 HA THR A 93 -1.748 -7.138 -1.094 1.00 0.00 H new ATOM 0 HB THR A 93 -2.647 -9.441 -2.076 1.00 0.00 H new ATOM 0 HG1 THR A 93 -1.061 -10.302 -3.571 1.00 0.00 H new ATOM 0 HG21 THR A 93 -2.441 -8.514 -4.352 1.00 0.00 H new ATOM 0 HG22 THR A 93 -2.886 -7.262 -3.169 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.214 -7.366 -3.768 1.00 0.00 H new ATOM 1362 N ASP A 94 -2.902 -8.873 0.490 1.00 0.00 N ATOM 1363 CA ASP A 94 -3.380 -9.582 1.672 1.00 0.00 C ATOM 1364 C ASP A 94 -3.259 -11.091 1.486 1.00 0.00 C ATOM 1365 O ASP A 94 -3.517 -11.632 0.411 1.00 0.00 O ATOM 1366 CB ASP A 94 -4.834 -9.207 1.965 1.00 0.00 C ATOM 1367 CG ASP A 94 -5.806 -9.861 1.003 1.00 0.00 C ATOM 1368 OD1 ASP A 94 -5.559 -9.804 -0.220 1.00 0.00 O ATOM 1369 OD2 ASP A 94 -6.814 -10.430 1.472 1.00 0.00 O ATOM 0 H ASP A 94 -3.628 -8.374 -0.025 1.00 0.00 H new ATOM 0 HA ASP A 94 -2.759 -9.287 2.518 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -5.083 -9.501 2.985 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -4.945 -8.124 1.909 1.00 0.00 H new ATOM 1374 N PRO A 95 -2.856 -11.789 2.558 1.00 0.00 N ATOM 1375 CA PRO A 95 -2.691 -13.246 2.539 1.00 0.00 C ATOM 1376 C PRO A 95 -4.025 -13.979 2.440 1.00 0.00 C ATOM 1377 O PRO A 95 -4.153 -14.954 1.700 1.00 0.00 O ATOM 1378 CB PRO A 95 -2.015 -13.544 3.879 1.00 0.00 C ATOM 1379 CG PRO A 95 -2.414 -12.416 4.765 1.00 0.00 C ATOM 1380 CD PRO A 95 -2.532 -11.211 3.873 1.00 0.00 C ATOM 0 HA PRO A 95 -2.118 -13.580 1.674 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -2.344 -14.501 4.284 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -0.932 -13.599 3.772 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -3.360 -12.627 5.263 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -1.672 -12.252 5.546 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -3.312 -10.532 4.217 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.604 -10.641 3.843 1.00 0.00 H new ATOM 1388 N GLN A 96 -5.013 -13.504 3.190 1.00 0.00 N ATOM 1389 CA GLN A 96 -6.337 -14.115 3.187 1.00 0.00 C ATOM 1390 C GLN A 96 -6.984 -14.004 1.810 1.00 0.00 C ATOM 1391 O GLN A 96 -7.964 -14.689 1.517 1.00 0.00 O ATOM 1392 CB GLN A 96 -7.230 -13.455 4.239 1.00 0.00 C ATOM 1393 CG GLN A 96 -6.651 -13.501 5.644 1.00 0.00 C ATOM 1394 CD GLN A 96 -6.232 -14.898 6.057 1.00 0.00 C ATOM 1395 OE1 GLN A 96 -6.885 -15.882 5.711 1.00 0.00 O ATOM 1396 NE2 GLN A 96 -5.136 -14.991 6.802 1.00 0.00 N ATOM 0 H GLN A 96 -4.922 -12.698 3.808 1.00 0.00 H new ATOM 0 HA GLN A 96 -6.223 -15.171 3.431 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -7.400 -12.415 3.959 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -8.202 -13.948 4.239 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -5.789 -12.836 5.700 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -7.391 -13.124 6.350 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -4.625 -14.148 7.066 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -4.805 -15.905 7.110 1.00 0.00 H new ATOM 1405 N ASP A 97 -6.430 -13.136 0.970 1.00 0.00 N ATOM 1406 CA ASP A 97 -6.954 -12.935 -0.376 1.00 0.00 C ATOM 1407 C ASP A 97 -8.453 -12.658 -0.340 1.00 0.00 C ATOM 1408 O ASP A 97 -9.180 -12.998 -1.274 1.00 0.00 O ATOM 1409 CB ASP A 97 -6.669 -14.161 -1.245 1.00 0.00 C ATOM 1410 CG ASP A 97 -5.297 -14.111 -1.886 1.00 0.00 C ATOM 1411 OD1 ASP A 97 -5.132 -13.371 -2.879 1.00 0.00 O ATOM 1412 OD2 ASP A 97 -4.387 -14.811 -1.395 1.00 0.00 O ATOM 0 H ASP A 97 -5.619 -12.561 1.197 1.00 0.00 H new ATOM 0 HA ASP A 97 -6.454 -12.069 -0.809 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -6.749 -15.061 -0.635 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -7.428 -14.235 -2.024 1.00 0.00 H new ATOM 1417 N ARG A 98 -8.910 -12.040 0.744 1.00 0.00 N ATOM 1418 CA ARG A 98 -10.323 -11.719 0.902 1.00 0.00 C ATOM 1419 C ARG A 98 -10.743 -10.618 -0.068 1.00 0.00 C ATOM 1420 O ARG A 98 -9.914 -9.832 -0.526 1.00 0.00 O ATOM 1421 CB ARG A 98 -10.612 -11.284 2.340 1.00 0.00 C ATOM 1422 CG ARG A 98 -10.762 -12.445 3.309 1.00 0.00 C ATOM 1423 CD ARG A 98 -12.173 -13.010 3.288 1.00 0.00 C ATOM 1424 NE ARG A 98 -12.428 -13.801 2.087 1.00 0.00 N ATOM 1425 CZ ARG A 98 -11.905 -15.004 1.875 1.00 0.00 C ATOM 1426 NH1 ARG A 98 -11.104 -15.551 2.779 1.00 0.00 N ATOM 1427 NH2 ARG A 98 -12.184 -15.663 0.758 1.00 0.00 N ATOM 0 H ARG A 98 -8.322 -11.752 1.526 1.00 0.00 H new ATOM 0 HA ARG A 98 -10.900 -12.616 0.678 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -9.805 -10.637 2.684 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -11.526 -10.690 2.354 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -10.051 -13.230 3.051 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -10.517 -12.112 4.318 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -12.328 -13.631 4.171 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -12.892 -12.192 3.343 1.00 0.00 H new ATOM 0 HE ARG A 98 -13.041 -13.409 1.372 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -10.888 -15.048 3.640 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -10.704 -16.475 2.614 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -12.801 -15.246 0.061 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -11.782 -16.586 0.597 1.00 0.00 H new ATOM 1441 N ARG A 99 -12.035 -10.569 -0.376 1.00 0.00 N ATOM 1442 CA ARG A 99 -12.564 -9.566 -1.292 1.00 0.00 C ATOM 1443 C ARG A 99 -13.376 -8.516 -0.539 1.00 0.00 C ATOM 1444 O ARG A 99 -14.148 -8.843 0.362 1.00 0.00 O ATOM 1445 CB ARG A 99 -13.436 -10.230 -2.360 1.00 0.00 C ATOM 1446 CG ARG A 99 -12.676 -11.202 -3.248 1.00 0.00 C ATOM 1447 CD ARG A 99 -11.919 -10.475 -4.349 1.00 0.00 C ATOM 1448 NE ARG A 99 -10.891 -11.318 -4.955 1.00 0.00 N ATOM 1449 CZ ARG A 99 -11.159 -12.332 -5.771 1.00 0.00 C ATOM 1450 NH1 ARG A 99 -12.414 -12.626 -6.078 1.00 0.00 N ATOM 1451 NH2 ARG A 99 -10.169 -13.052 -6.282 1.00 0.00 N ATOM 0 H ARG A 99 -12.734 -11.212 -0.005 1.00 0.00 H new ATOM 0 HA ARG A 99 -11.721 -9.071 -1.775 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -14.254 -10.760 -1.872 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -13.885 -9.456 -2.983 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -11.976 -11.778 -2.643 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -13.373 -11.912 -3.692 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -12.620 -10.150 -5.117 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -11.456 -9.577 -3.939 1.00 0.00 H new ATOM 0 HE ARG A 99 -9.914 -11.117 -4.740 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -13.177 -12.073 -5.688 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -12.617 -13.405 -6.705 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -9.202 -12.827 -6.049 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -10.375 -13.830 -6.908 1.00 0.00 H new ATOM 1465 N TRP A 100 -13.194 -7.255 -0.914 1.00 0.00 N ATOM 1466 CA TRP A 100 -13.909 -6.157 -0.274 1.00 0.00 C ATOM 1467 C TRP A 100 -15.089 -5.704 -1.128 1.00 0.00 C ATOM 1468 O TRP A 100 -14.921 -5.336 -2.291 1.00 0.00 O ATOM 1469 CB TRP A 100 -12.963 -4.982 -0.024 1.00 0.00 C ATOM 1470 CG TRP A 100 -13.676 -3.701 0.287 1.00 0.00 C ATOM 1471 CD1 TRP A 100 -13.915 -2.666 -0.572 1.00 0.00 C ATOM 1472 CD2 TRP A 100 -14.239 -3.318 1.546 1.00 0.00 C ATOM 1473 NE1 TRP A 100 -14.594 -1.663 0.077 1.00 0.00 N ATOM 1474 CE2 TRP A 100 -14.805 -2.039 1.377 1.00 0.00 C ATOM 1475 CE3 TRP A 100 -14.322 -3.931 2.799 1.00 0.00 C ATOM 1476 CZ2 TRP A 100 -15.444 -1.365 2.415 1.00 0.00 C ATOM 1477 CZ3 TRP A 100 -14.956 -3.260 3.828 1.00 0.00 C ATOM 1478 CH2 TRP A 100 -15.510 -1.989 3.631 1.00 0.00 C ATOM 0 H TRP A 100 -12.558 -6.968 -1.658 1.00 0.00 H new ATOM 0 HA TRP A 100 -14.293 -6.514 0.682 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -12.298 -5.230 0.804 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -12.336 -4.836 -0.904 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -13.614 -2.640 -1.609 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -14.892 -0.782 -0.341 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -13.898 -4.911 2.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -15.872 -0.385 2.265 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -15.025 -3.724 4.801 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -15.999 -1.491 4.455 1.00 0.00 H new ATOM 1489 N THR A 101 -16.282 -5.732 -0.543 1.00 0.00 N ATOM 1490 CA THR A 101 -17.490 -5.325 -1.251 1.00 0.00 C ATOM 1491 C THR A 101 -17.638 -3.808 -1.257 1.00 0.00 C ATOM 1492 O THR A 101 -18.069 -3.214 -0.270 1.00 0.00 O ATOM 1493 CB THR A 101 -18.748 -5.950 -0.621 1.00 0.00 C ATOM 1494 OG1 THR A 101 -18.567 -7.362 -0.462 1.00 0.00 O ATOM 1495 CG2 THR A 101 -19.974 -5.686 -1.483 1.00 0.00 C ATOM 0 H THR A 101 -16.438 -6.032 0.419 1.00 0.00 H new ATOM 0 HA THR A 101 -17.391 -5.682 -2.276 1.00 0.00 H new ATOM 0 HB THR A 101 -18.904 -5.491 0.355 1.00 0.00 H new ATOM 0 HG1 THR A 101 -19.371 -7.752 -0.059 1.00 0.00 H new ATOM 0 HG21 THR A 101 -20.850 -6.137 -1.017 1.00 0.00 H new ATOM 0 HG22 THR A 101 -20.127 -4.611 -1.579 1.00 0.00 H new ATOM 0 HG23 THR A 101 -19.824 -6.120 -2.471 1.00 0.00 H new ATOM 1503 N ASN A 102 -17.280 -3.187 -2.376 1.00 0.00 N ATOM 1504 CA ASN A 102 -17.374 -1.738 -2.510 1.00 0.00 C ATOM 1505 C ASN A 102 -18.785 -1.253 -2.193 1.00 0.00 C ATOM 1506 O ASN A 102 -19.770 -1.970 -2.371 1.00 0.00 O ATOM 1507 CB ASN A 102 -16.982 -1.309 -3.926 1.00 0.00 C ATOM 1508 CG ASN A 102 -15.479 -1.281 -4.126 1.00 0.00 C ATOM 1509 OD1 ASN A 102 -14.870 -0.214 -4.191 1.00 0.00 O ATOM 1510 ND2 ASN A 102 -14.873 -2.459 -4.224 1.00 0.00 N ATOM 0 H ASN A 102 -16.922 -3.665 -3.203 1.00 0.00 H new ATOM 0 HA ASN A 102 -16.684 -1.287 -1.797 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -17.429 -1.993 -4.647 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -17.391 -0.320 -4.129 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -13.863 -2.503 -4.359 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -15.418 -3.319 -4.164 1.00 0.00 H new ATOM 1517 N PRO A 103 -18.887 -0.005 -1.711 1.00 0.00 N ATOM 1518 CA PRO A 103 -20.173 0.605 -1.359 1.00 0.00 C ATOM 1519 C PRO A 103 -21.028 0.904 -2.586 1.00 0.00 C ATOM 1520 O PRO A 103 -22.122 1.457 -2.473 1.00 0.00 O ATOM 1521 CB PRO A 103 -19.770 1.905 -0.659 1.00 0.00 C ATOM 1522 CG PRO A 103 -18.423 2.228 -1.207 1.00 0.00 C ATOM 1523 CD PRO A 103 -17.756 0.906 -1.473 1.00 0.00 C ATOM 0 HA PRO A 103 -20.782 -0.056 -0.742 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -20.483 2.703 -0.865 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -19.737 1.778 0.423 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -18.504 2.815 -2.122 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -17.845 2.821 -0.498 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -17.093 0.957 -2.336 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -17.152 0.583 -0.625 1.00 0.00 H new ATOM 1531 N ASP A 104 -20.522 0.534 -3.758 1.00 0.00 N ATOM 1532 CA ASP A 104 -21.241 0.761 -5.006 1.00 0.00 C ATOM 1533 C ASP A 104 -21.959 -0.507 -5.458 1.00 0.00 C ATOM 1534 O ASP A 104 -22.955 -0.445 -6.178 1.00 0.00 O ATOM 1535 CB ASP A 104 -20.276 1.231 -6.096 1.00 0.00 C ATOM 1536 CG ASP A 104 -20.880 1.136 -7.484 1.00 0.00 C ATOM 1537 OD1 ASP A 104 -21.528 2.112 -7.917 1.00 0.00 O ATOM 1538 OD2 ASP A 104 -20.703 0.086 -8.136 1.00 0.00 O ATOM 0 H ASP A 104 -19.617 0.076 -3.869 1.00 0.00 H new ATOM 0 HA ASP A 104 -21.987 1.537 -4.832 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -19.985 2.263 -5.899 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -19.367 0.630 -6.056 1.00 0.00 H new ATOM 1543 N GLY A 105 -21.446 -1.657 -5.031 1.00 0.00 N ATOM 1544 CA GLY A 105 -22.050 -2.922 -5.403 1.00 0.00 C ATOM 1545 C GLY A 105 -21.135 -3.771 -6.263 1.00 0.00 C ATOM 1546 O GLY A 105 -21.487 -4.138 -7.385 1.00 0.00 O ATOM 0 H GLY A 105 -20.623 -1.735 -4.434 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -22.312 -3.475 -4.501 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -22.978 -2.733 -5.942 1.00 0.00 H new ATOM 1550 N THR A 106 -19.955 -4.085 -5.738 1.00 0.00 N ATOM 1551 CA THR A 106 -18.985 -4.894 -6.466 1.00 0.00 C ATOM 1552 C THR A 106 -17.859 -5.358 -5.550 1.00 0.00 C ATOM 1553 O THR A 106 -17.505 -4.676 -4.587 1.00 0.00 O ATOM 1554 CB THR A 106 -18.380 -4.115 -7.650 1.00 0.00 C ATOM 1555 OG1 THR A 106 -17.611 -4.998 -8.474 1.00 0.00 O ATOM 1556 CG2 THR A 106 -17.500 -2.978 -7.156 1.00 0.00 C ATOM 0 H THR A 106 -19.648 -3.791 -4.811 1.00 0.00 H new ATOM 0 HA THR A 106 -19.521 -5.763 -6.848 1.00 0.00 H new ATOM 0 HB THR A 106 -19.197 -3.692 -8.235 1.00 0.00 H new ATOM 0 HG1 THR A 106 -17.231 -4.496 -9.225 1.00 0.00 H new ATOM 0 HG21 THR A 106 -17.084 -2.443 -8.009 1.00 0.00 H new ATOM 0 HG22 THR A 106 -18.096 -2.293 -6.553 1.00 0.00 H new ATOM 0 HG23 THR A 106 -16.689 -3.382 -6.551 1.00 0.00 H new ATOM 1564 N THR A 107 -17.297 -6.524 -5.855 1.00 0.00 N ATOM 1565 CA THR A 107 -16.210 -7.080 -5.058 1.00 0.00 C ATOM 1566 C THR A 107 -14.853 -6.717 -5.650 1.00 0.00 C ATOM 1567 O THR A 107 -14.719 -6.546 -6.862 1.00 0.00 O ATOM 1568 CB THR A 107 -16.318 -8.613 -4.954 1.00 0.00 C ATOM 1569 OG1 THR A 107 -16.371 -9.191 -6.263 1.00 0.00 O ATOM 1570 CG2 THR A 107 -17.556 -9.016 -4.166 1.00 0.00 C ATOM 0 H THR A 107 -17.577 -7.101 -6.648 1.00 0.00 H new ATOM 0 HA THR A 107 -16.296 -6.648 -4.061 1.00 0.00 H new ATOM 0 HB THR A 107 -15.436 -8.982 -4.430 1.00 0.00 H new ATOM 0 HG1 THR A 107 -16.438 -10.166 -6.188 1.00 0.00 H new ATOM 0 HG21 THR A 107 -17.611 -10.103 -4.106 1.00 0.00 H new ATOM 0 HG22 THR A 107 -17.499 -8.599 -3.160 1.00 0.00 H new ATOM 0 HG23 THR A 107 -18.446 -8.635 -4.667 1.00 0.00 H new ATOM 1578 N SER A 108 -13.848 -6.602 -4.788 1.00 0.00 N ATOM 1579 CA SER A 108 -12.501 -6.256 -5.225 1.00 0.00 C ATOM 1580 C SER A 108 -11.454 -6.934 -4.347 1.00 0.00 C ATOM 1581 O SER A 108 -11.775 -7.504 -3.304 1.00 0.00 O ATOM 1582 CB SER A 108 -12.305 -4.739 -5.193 1.00 0.00 C ATOM 1583 OG SER A 108 -12.931 -4.120 -6.303 1.00 0.00 O ATOM 0 H SER A 108 -13.941 -6.744 -3.782 1.00 0.00 H new ATOM 0 HA SER A 108 -12.376 -6.610 -6.248 1.00 0.00 H new ATOM 0 HB2 SER A 108 -12.717 -4.336 -4.268 1.00 0.00 H new ATOM 0 HB3 SER A 108 -11.240 -4.507 -5.196 1.00 0.00 H new ATOM 0 HG SER A 108 -12.345 -4.183 -7.086 1.00 0.00 H new ATOM 1589 N LYS A 109 -10.199 -6.869 -4.778 1.00 0.00 N ATOM 1590 CA LYS A 109 -9.101 -7.475 -4.033 1.00 0.00 C ATOM 1591 C LYS A 109 -8.566 -6.514 -2.976 1.00 0.00 C ATOM 1592 O LYS A 109 -8.590 -5.297 -3.160 1.00 0.00 O ATOM 1593 CB LYS A 109 -7.974 -7.882 -4.985 1.00 0.00 C ATOM 1594 CG LYS A 109 -6.902 -8.734 -4.329 1.00 0.00 C ATOM 1595 CD LYS A 109 -6.145 -9.563 -5.352 1.00 0.00 C ATOM 1596 CE LYS A 109 -5.054 -10.397 -4.698 1.00 0.00 C ATOM 1597 NZ LYS A 109 -4.475 -11.393 -5.641 1.00 0.00 N ATOM 0 H LYS A 109 -9.916 -6.403 -5.640 1.00 0.00 H new ATOM 0 HA LYS A 109 -9.483 -8.364 -3.531 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -8.400 -8.431 -5.825 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -7.512 -6.983 -5.394 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -6.204 -8.092 -3.791 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -7.361 -9.394 -3.592 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -6.840 -10.219 -5.877 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -5.702 -8.905 -6.099 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -4.264 -9.740 -4.334 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -5.464 -10.914 -3.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -3.735 -11.941 -5.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -5.223 -12.036 -5.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -4.061 -10.899 -6.457 1.00 0.00 H new ATOM 1611 N ILE A 110 -8.082 -7.069 -1.869 1.00 0.00 N ATOM 1612 CA ILE A 110 -7.539 -6.261 -0.785 1.00 0.00 C ATOM 1613 C ILE A 110 -6.014 -6.290 -0.789 1.00 0.00 C ATOM 1614 O ILE A 110 -5.402 -7.319 -1.074 1.00 0.00 O ATOM 1615 CB ILE A 110 -8.046 -6.744 0.586 1.00 0.00 C ATOM 1616 CG1 ILE A 110 -9.555 -6.519 0.704 1.00 0.00 C ATOM 1617 CG2 ILE A 110 -7.309 -6.027 1.707 1.00 0.00 C ATOM 1618 CD1 ILE A 110 -10.200 -7.318 1.815 1.00 0.00 C ATOM 0 H ILE A 110 -8.055 -8.075 -1.700 1.00 0.00 H new ATOM 0 HA ILE A 110 -7.882 -5.240 -0.951 1.00 0.00 H new ATOM 0 HB ILE A 110 -7.849 -7.812 0.674 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -9.744 -5.459 0.873 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -10.028 -6.780 -0.242 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -7.679 -6.380 2.670 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -6.241 -6.233 1.631 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -7.478 -4.953 1.625 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -11.269 -7.109 1.840 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.042 -8.382 1.637 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.754 -7.040 2.770 1.00 0.00 H new ATOM 1630 N PHE A 111 -5.405 -5.153 -0.468 1.00 0.00 N ATOM 1631 CA PHE A 111 -3.951 -5.047 -0.434 1.00 0.00 C ATOM 1632 C PHE A 111 -3.513 -3.840 0.390 1.00 0.00 C ATOM 1633 O PHE A 111 -4.322 -2.974 0.722 1.00 0.00 O ATOM 1634 CB PHE A 111 -3.393 -4.939 -1.854 1.00 0.00 C ATOM 1635 CG PHE A 111 -3.384 -3.536 -2.390 1.00 0.00 C ATOM 1636 CD1 PHE A 111 -4.559 -2.933 -2.810 1.00 0.00 C ATOM 1637 CD2 PHE A 111 -2.201 -2.820 -2.473 1.00 0.00 C ATOM 1638 CE1 PHE A 111 -4.554 -1.642 -3.303 1.00 0.00 C ATOM 1639 CE2 PHE A 111 -2.190 -1.528 -2.965 1.00 0.00 C ATOM 1640 CZ PHE A 111 -3.368 -0.939 -3.381 1.00 0.00 C ATOM 0 H PHE A 111 -5.896 -4.292 -0.228 1.00 0.00 H new ATOM 0 HA PHE A 111 -3.557 -5.948 0.036 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.376 -5.331 -1.867 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -3.986 -5.569 -2.517 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -5.489 -3.478 -2.751 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.277 -3.276 -2.150 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -5.477 -1.183 -3.627 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -1.261 -0.980 -3.024 1.00 0.00 H new ATOM 0 HZ PHE A 111 -3.362 0.070 -3.767 1.00 0.00 H new ATOM 1650 N GLY A 112 -2.225 -3.791 0.718 1.00 0.00 N ATOM 1651 CA GLY A 112 -1.701 -2.687 1.501 1.00 0.00 C ATOM 1652 C GLY A 112 -0.228 -2.849 1.818 1.00 0.00 C ATOM 1653 O GLY A 112 0.437 -3.733 1.276 1.00 0.00 O ATOM 0 H GLY A 112 -1.536 -4.496 0.456 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -1.852 -1.755 0.956 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -2.263 -2.607 2.431 1.00 0.00 H new ATOM 1657 N PHE A 113 0.285 -1.993 2.695 1.00 0.00 N ATOM 1658 CA PHE A 113 1.691 -2.044 3.081 1.00 0.00 C ATOM 1659 C PHE A 113 1.877 -1.576 4.521 1.00 0.00 C ATOM 1660 O PHE A 113 0.972 -0.991 5.118 1.00 0.00 O ATOM 1661 CB PHE A 113 2.531 -1.179 2.139 1.00 0.00 C ATOM 1662 CG PHE A 113 2.103 0.261 2.106 1.00 0.00 C ATOM 1663 CD1 PHE A 113 1.084 0.675 1.263 1.00 0.00 C ATOM 1664 CD2 PHE A 113 2.721 1.200 2.916 1.00 0.00 C ATOM 1665 CE1 PHE A 113 0.687 1.998 1.230 1.00 0.00 C ATOM 1666 CE2 PHE A 113 2.328 2.525 2.887 1.00 0.00 C ATOM 1667 CZ PHE A 113 1.311 2.925 2.043 1.00 0.00 C ATOM 0 H PHE A 113 -0.251 -1.256 3.152 1.00 0.00 H new ATOM 0 HA PHE A 113 2.025 -3.079 3.008 1.00 0.00 H new ATOM 0 HB2 PHE A 113 3.576 -1.232 2.445 1.00 0.00 H new ATOM 0 HB3 PHE A 113 2.472 -1.590 1.131 1.00 0.00 H new ATOM 0 HD1 PHE A 113 0.594 -0.045 0.624 1.00 0.00 H new ATOM 0 HD2 PHE A 113 3.518 0.893 3.577 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -0.110 2.307 0.570 1.00 0.00 H new ATOM 0 HE2 PHE A 113 2.816 3.247 3.524 1.00 0.00 H new ATOM 0 HZ PHE A 113 1.004 3.960 2.018 1.00 0.00 H new ATOM 1677 N VAL A 114 3.056 -1.838 5.075 1.00 0.00 N ATOM 1678 CA VAL A 114 3.363 -1.444 6.445 1.00 0.00 C ATOM 1679 C VAL A 114 4.501 -0.431 6.484 1.00 0.00 C ATOM 1680 O VAL A 114 5.638 -0.746 6.132 1.00 0.00 O ATOM 1681 CB VAL A 114 3.744 -2.662 7.307 1.00 0.00 C ATOM 1682 CG1 VAL A 114 3.669 -2.315 8.786 1.00 0.00 C ATOM 1683 CG2 VAL A 114 2.845 -3.846 6.983 1.00 0.00 C ATOM 0 H VAL A 114 3.815 -2.322 4.596 1.00 0.00 H new ATOM 0 HA VAL A 114 2.461 -0.988 6.853 1.00 0.00 H new ATOM 0 HB VAL A 114 4.772 -2.941 7.076 1.00 0.00 H new ATOM 0 HG11 VAL A 114 3.942 -3.188 9.379 1.00 0.00 H new ATOM 0 HG12 VAL A 114 4.358 -1.499 9.004 1.00 0.00 H new ATOM 0 HG13 VAL A 114 2.653 -2.009 9.037 1.00 0.00 H new ATOM 0 HG21 VAL A 114 3.128 -4.698 7.601 1.00 0.00 H new ATOM 0 HG22 VAL A 114 1.807 -3.581 7.184 1.00 0.00 H new ATOM 0 HG23 VAL A 114 2.955 -4.109 5.931 1.00 0.00 H new ATOM 1693 N ALA A 115 4.188 0.786 6.914 1.00 0.00 N ATOM 1694 CA ALA A 115 5.186 1.845 7.002 1.00 0.00 C ATOM 1695 C ALA A 115 5.357 2.321 8.441 1.00 0.00 C ATOM 1696 O ALA A 115 4.439 2.213 9.255 1.00 0.00 O ATOM 1697 CB ALA A 115 4.800 3.010 6.102 1.00 0.00 C ATOM 0 H ALA A 115 3.251 1.064 7.207 1.00 0.00 H new ATOM 0 HA ALA A 115 6.140 1.439 6.665 1.00 0.00 H new ATOM 0 HB1 ALA A 115 5.554 3.794 6.178 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.736 2.666 5.070 1.00 0.00 H new ATOM 0 HB3 ALA A 115 3.833 3.406 6.413 1.00 0.00 H new ATOM 1703 N LYS A 116 6.538 2.846 8.749 1.00 0.00 N ATOM 1704 CA LYS A 116 6.830 3.339 10.090 1.00 0.00 C ATOM 1705 C LYS A 116 6.255 4.737 10.293 1.00 0.00 C ATOM 1706 O LYS A 116 6.212 5.543 9.364 1.00 0.00 O ATOM 1707 CB LYS A 116 8.341 3.357 10.330 1.00 0.00 C ATOM 1708 CG LYS A 116 9.047 2.096 9.864 1.00 0.00 C ATOM 1709 CD LYS A 116 10.543 2.317 9.713 1.00 0.00 C ATOM 1710 CE LYS A 116 11.223 1.113 9.081 1.00 0.00 C ATOM 1711 NZ LYS A 116 12.643 0.988 9.513 1.00 0.00 N ATOM 0 H LYS A 116 7.309 2.941 8.088 1.00 0.00 H new ATOM 0 HA LYS A 116 6.362 2.666 10.808 1.00 0.00 H new ATOM 0 HB2 LYS A 116 8.772 4.216 9.815 1.00 0.00 H new ATOM 0 HB3 LYS A 116 8.529 3.496 11.395 1.00 0.00 H new ATOM 0 HG2 LYS A 116 8.867 1.292 10.578 1.00 0.00 H new ATOM 0 HG3 LYS A 116 8.628 1.775 8.911 1.00 0.00 H new ATOM 0 HD2 LYS A 116 10.721 3.200 9.100 1.00 0.00 H new ATOM 0 HD3 LYS A 116 10.983 2.513 10.691 1.00 0.00 H new ATOM 0 HE2 LYS A 116 10.680 0.207 9.350 1.00 0.00 H new ATOM 0 HE3 LYS A 116 11.180 1.200 7.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.072 0.155 9.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 13.167 1.842 9.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 12.683 0.879 10.547 1.00 0.00 H new ATOM 1725 N LYS A 117 5.815 5.018 11.515 1.00 0.00 N ATOM 1726 CA LYS A 117 5.245 6.320 11.842 1.00 0.00 C ATOM 1727 C LYS A 117 6.293 7.420 11.715 1.00 0.00 C ATOM 1728 O LYS A 117 7.483 7.207 11.947 1.00 0.00 O ATOM 1729 CB LYS A 117 4.673 6.307 13.262 1.00 0.00 C ATOM 1730 CG LYS A 117 3.231 5.835 13.332 1.00 0.00 C ATOM 1731 CD LYS A 117 2.542 6.334 14.591 1.00 0.00 C ATOM 1732 CE LYS A 117 2.127 7.791 14.459 1.00 0.00 C ATOM 1733 NZ LYS A 117 1.506 8.307 15.710 1.00 0.00 N ATOM 0 H LYS A 117 5.842 4.362 12.295 1.00 0.00 H new ATOM 0 HA LYS A 117 4.441 6.525 11.135 1.00 0.00 H new ATOM 0 HB2 LYS A 117 5.289 5.660 13.887 1.00 0.00 H new ATOM 0 HB3 LYS A 117 4.739 7.311 13.680 1.00 0.00 H new ATOM 0 HG2 LYS A 117 2.689 6.188 12.455 1.00 0.00 H new ATOM 0 HG3 LYS A 117 3.202 4.746 13.308 1.00 0.00 H new ATOM 0 HD2 LYS A 117 1.664 5.721 14.793 1.00 0.00 H new ATOM 0 HD3 LYS A 117 3.212 6.221 15.443 1.00 0.00 H new ATOM 0 HE2 LYS A 117 2.999 8.396 14.210 1.00 0.00 H new ATOM 0 HE3 LYS A 117 1.422 7.894 13.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 1.237 9.303 15.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 0.659 7.746 15.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 2.187 8.232 16.492 1.00 0.00 H new ATOM 1747 N PRO A 118 5.843 8.627 11.339 1.00 0.00 N ATOM 1748 CA PRO A 118 6.726 9.785 11.175 1.00 0.00 C ATOM 1749 C PRO A 118 7.269 10.294 12.507 1.00 0.00 C ATOM 1750 O PRO A 118 8.393 10.787 12.582 1.00 0.00 O ATOM 1751 CB PRO A 118 5.817 10.836 10.532 1.00 0.00 C ATOM 1752 CG PRO A 118 4.440 10.454 10.952 1.00 0.00 C ATOM 1753 CD PRO A 118 4.437 8.953 11.046 1.00 0.00 C ATOM 0 HA PRO A 118 7.608 9.544 10.582 1.00 0.00 H new ATOM 0 HB2 PRO A 118 6.070 11.840 10.872 1.00 0.00 H new ATOM 0 HB3 PRO A 118 5.915 10.833 9.446 1.00 0.00 H new ATOM 0 HG2 PRO A 118 4.185 10.906 11.911 1.00 0.00 H new ATOM 0 HG3 PRO A 118 3.701 10.801 10.230 1.00 0.00 H new ATOM 0 HD2 PRO A 118 3.770 8.601 11.833 1.00 0.00 H new ATOM 0 HD3 PRO A 118 4.103 8.493 10.116 1.00 0.00 H new ATOM 1761 N GLY A 119 6.461 10.170 13.556 1.00 0.00 N ATOM 1762 CA GLY A 119 6.879 10.621 14.871 1.00 0.00 C ATOM 1763 C GLY A 119 7.287 9.475 15.774 1.00 0.00 C ATOM 1764 O GLY A 119 8.021 9.671 16.743 1.00 0.00 O ATOM 0 H GLY A 119 5.525 9.766 13.519 1.00 0.00 H new ATOM 0 HA2 GLY A 119 7.715 11.312 14.766 1.00 0.00 H new ATOM 0 HA3 GLY A 119 6.064 11.175 15.338 1.00 0.00 H new ATOM 1768 N SER A 120 6.810 8.275 15.458 1.00 0.00 N ATOM 1769 CA SER A 120 7.126 7.094 16.252 1.00 0.00 C ATOM 1770 C SER A 120 7.859 6.053 15.411 1.00 0.00 C ATOM 1771 O SER A 120 7.262 5.120 14.874 1.00 0.00 O ATOM 1772 CB SER A 120 5.847 6.487 16.834 1.00 0.00 C ATOM 1773 OG SER A 120 5.296 7.324 17.836 1.00 0.00 O ATOM 0 H SER A 120 6.203 8.095 14.658 1.00 0.00 H new ATOM 0 HA SER A 120 7.779 7.401 17.069 1.00 0.00 H new ATOM 0 HB2 SER A 120 5.117 6.337 16.039 1.00 0.00 H new ATOM 0 HB3 SER A 120 6.065 5.506 17.255 1.00 0.00 H new ATOM 0 HG SER A 120 4.479 6.915 18.191 1.00 0.00 H new ATOM 1779 N PRO A 121 9.185 6.216 15.293 1.00 0.00 N ATOM 1780 CA PRO A 121 10.029 5.301 14.518 1.00 0.00 C ATOM 1781 C PRO A 121 10.157 3.933 15.178 1.00 0.00 C ATOM 1782 O PRO A 121 10.801 3.032 14.640 1.00 0.00 O ATOM 1783 CB PRO A 121 11.385 6.010 14.488 1.00 0.00 C ATOM 1784 CG PRO A 121 11.388 6.874 15.702 1.00 0.00 C ATOM 1785 CD PRO A 121 9.962 7.306 15.906 1.00 0.00 C ATOM 0 HA PRO A 121 9.615 5.102 13.530 1.00 0.00 H new ATOM 0 HB2 PRO A 121 12.207 5.294 14.510 1.00 0.00 H new ATOM 0 HB3 PRO A 121 11.502 6.602 13.580 1.00 0.00 H new ATOM 0 HG2 PRO A 121 11.758 6.327 16.569 1.00 0.00 H new ATOM 0 HG3 PRO A 121 12.041 7.736 15.566 1.00 0.00 H new ATOM 0 HD2 PRO A 121 9.725 7.423 16.963 1.00 0.00 H new ATOM 0 HD3 PRO A 121 9.759 8.263 15.426 1.00 0.00 H new ATOM 1793 N TRP A 122 9.542 3.784 16.346 1.00 0.00 N ATOM 1794 CA TRP A 122 9.588 2.524 17.078 1.00 0.00 C ATOM 1795 C TRP A 122 8.277 1.759 16.928 1.00 0.00 C ATOM 1796 O TRP A 122 8.150 0.630 17.402 1.00 0.00 O ATOM 1797 CB TRP A 122 9.876 2.781 18.558 1.00 0.00 C ATOM 1798 CG TRP A 122 9.178 3.993 19.097 1.00 0.00 C ATOM 1799 CD1 TRP A 122 7.898 4.060 19.568 1.00 0.00 C ATOM 1800 CD2 TRP A 122 9.722 5.312 19.219 1.00 0.00 C ATOM 1801 NE1 TRP A 122 7.613 5.342 19.975 1.00 0.00 N ATOM 1802 CE2 TRP A 122 8.716 6.128 19.772 1.00 0.00 C ATOM 1803 CE3 TRP A 122 10.962 5.882 18.917 1.00 0.00 C ATOM 1804 CZ2 TRP A 122 8.913 7.483 20.026 1.00 0.00 C ATOM 1805 CZ3 TRP A 122 11.156 7.227 19.169 1.00 0.00 C ATOM 1806 CH2 TRP A 122 10.137 8.015 19.720 1.00 0.00 C ATOM 0 H TRP A 122 9.006 4.520 16.806 1.00 0.00 H new ATOM 0 HA TRP A 122 10.391 1.918 16.659 1.00 0.00 H new ATOM 0 HB2 TRP A 122 9.573 1.908 19.137 1.00 0.00 H new ATOM 0 HB3 TRP A 122 10.951 2.898 18.697 1.00 0.00 H new ATOM 0 HD1 TRP A 122 7.211 3.228 19.614 1.00 0.00 H new ATOM 0 HE1 TRP A 122 6.724 5.657 20.365 1.00 0.00 H new ATOM 0 HE3 TRP A 122 11.754 5.282 18.494 1.00 0.00 H new ATOM 0 HZ2 TRP A 122 8.128 8.093 20.449 1.00 0.00 H new ATOM 0 HZ3 TRP A 122 12.109 7.678 18.937 1.00 0.00 H new ATOM 0 HH2 TRP A 122 10.321 9.063 19.907 1.00 0.00 H new ATOM 1817 N GLU A 123 7.306 2.381 16.267 1.00 0.00 N ATOM 1818 CA GLU A 123 6.005 1.757 16.056 1.00 0.00 C ATOM 1819 C GLU A 123 5.756 1.506 14.572 1.00 0.00 C ATOM 1820 O GLU A 123 6.451 2.049 13.715 1.00 0.00 O ATOM 1821 CB GLU A 123 4.893 2.638 16.629 1.00 0.00 C ATOM 1822 CG GLU A 123 4.598 2.369 18.095 1.00 0.00 C ATOM 1823 CD GLU A 123 3.338 3.064 18.573 1.00 0.00 C ATOM 1824 OE1 GLU A 123 2.758 3.846 17.790 1.00 0.00 O ATOM 1825 OE2 GLU A 123 2.931 2.826 19.730 1.00 0.00 O ATOM 0 H GLU A 123 7.395 3.316 15.869 1.00 0.00 H new ATOM 0 HA GLU A 123 6.003 0.798 16.574 1.00 0.00 H new ATOM 0 HB2 GLU A 123 5.172 3.685 16.509 1.00 0.00 H new ATOM 0 HB3 GLU A 123 3.983 2.483 16.049 1.00 0.00 H new ATOM 0 HG2 GLU A 123 4.497 1.295 18.250 1.00 0.00 H new ATOM 0 HG3 GLU A 123 5.443 2.701 18.699 1.00 0.00 H new ATOM 1832 N ASN A 124 4.760 0.678 14.277 1.00 0.00 N ATOM 1833 CA ASN A 124 4.419 0.353 12.896 1.00 0.00 C ATOM 1834 C ASN A 124 2.937 0.598 12.630 1.00 0.00 C ATOM 1835 O ASN A 124 2.090 0.335 13.484 1.00 0.00 O ATOM 1836 CB ASN A 124 4.769 -1.105 12.592 1.00 0.00 C ATOM 1837 CG ASN A 124 5.978 -1.584 13.373 1.00 0.00 C ATOM 1838 OD1 ASN A 124 6.968 -0.865 13.509 1.00 0.00 O ATOM 1839 ND2 ASN A 124 5.902 -2.805 13.889 1.00 0.00 N ATOM 0 H ASN A 124 4.174 0.219 14.975 1.00 0.00 H new ATOM 0 HA ASN A 124 5.000 1.003 12.242 1.00 0.00 H new ATOM 0 HB2 ASN A 124 3.913 -1.738 12.828 1.00 0.00 H new ATOM 0 HB3 ASN A 124 4.962 -1.215 11.525 1.00 0.00 H new ATOM 0 HD21 ASN A 124 6.684 -3.182 14.424 1.00 0.00 H new ATOM 0 HD22 ASN A 124 5.061 -3.366 13.751 1.00 0.00 H new ATOM 1846 N VAL A 125 2.631 1.102 11.439 1.00 0.00 N ATOM 1847 CA VAL A 125 1.251 1.381 11.058 1.00 0.00 C ATOM 1848 C VAL A 125 0.961 0.888 9.645 1.00 0.00 C ATOM 1849 O VAL A 125 1.531 1.386 8.673 1.00 0.00 O ATOM 1850 CB VAL A 125 0.941 2.888 11.138 1.00 0.00 C ATOM 1851 CG1 VAL A 125 -0.519 3.151 10.802 1.00 0.00 C ATOM 1852 CG2 VAL A 125 1.285 3.430 12.517 1.00 0.00 C ATOM 0 H VAL A 125 3.320 1.326 10.721 1.00 0.00 H new ATOM 0 HA VAL A 125 0.613 0.848 11.764 1.00 0.00 H new ATOM 0 HB VAL A 125 1.557 3.408 10.404 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -0.720 4.221 10.864 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -0.729 2.800 9.792 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -1.156 2.621 11.510 1.00 0.00 H new ATOM 0 HG21 VAL A 125 1.060 4.496 12.556 1.00 0.00 H new ATOM 0 HG22 VAL A 125 0.696 2.907 13.271 1.00 0.00 H new ATOM 0 HG23 VAL A 125 2.346 3.276 12.714 1.00 0.00 H new ATOM 1862 N CYS A 126 0.070 -0.091 9.538 1.00 0.00 N ATOM 1863 CA CYS A 126 -0.297 -0.653 8.242 1.00 0.00 C ATOM 1864 C CYS A 126 -1.564 0.004 7.705 1.00 0.00 C ATOM 1865 O CYS A 126 -2.469 0.346 8.466 1.00 0.00 O ATOM 1866 CB CYS A 126 -0.500 -2.164 8.358 1.00 0.00 C ATOM 1867 SG CYS A 126 -1.007 -2.960 6.816 1.00 0.00 S ATOM 0 H CYS A 126 -0.412 -0.512 10.332 1.00 0.00 H new ATOM 0 HA CYS A 126 0.516 -0.456 7.543 1.00 0.00 H new ATOM 0 HB2 CYS A 126 0.429 -2.619 8.701 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -1.253 -2.361 9.121 1.00 0.00 H new ATOM 0 HG CYS A 126 -0.385 -2.407 5.817 1.00 0.00 H new ATOM 1873 N HIS A 127 -1.621 0.178 6.388 1.00 0.00 N ATOM 1874 CA HIS A 127 -2.778 0.794 5.748 1.00 0.00 C ATOM 1875 C HIS A 127 -3.462 -0.187 4.801 1.00 0.00 C ATOM 1876 O HIS A 127 -2.822 -0.771 3.926 1.00 0.00 O ATOM 1877 CB HIS A 127 -2.355 2.049 4.983 1.00 0.00 C ATOM 1878 CG HIS A 127 -1.291 2.843 5.676 1.00 0.00 C ATOM 1879 ND1 HIS A 127 0.001 3.071 5.344 1.00 0.00 N flip ATOM 1880 CD2 HIS A 127 -1.505 3.513 6.863 1.00 0.00 C flip ATOM 1881 CE1 HIS A 127 0.539 3.867 6.326 1.00 0.00 C flip ATOM 1882 NE2 HIS A 127 -0.390 4.120 7.230 1.00 0.00 N flip ATOM 0 H HIS A 127 -0.880 -0.099 5.744 1.00 0.00 H new ATOM 0 HA HIS A 127 -3.487 1.074 6.527 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -1.995 1.759 3.996 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -3.228 2.683 4.830 1.00 0.00 H new ATOM 0 HD1 HIS A 127 0.485 2.718 4.519 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -2.438 3.538 7.407 1.00 0.00 H new ATOM 0 HE1 HIS A 127 1.557 4.227 6.354 1.00 0.00 H new ATOM 1891 N LEU A 128 -4.766 -0.364 4.982 1.00 0.00 N ATOM 1892 CA LEU A 128 -5.538 -1.275 4.144 1.00 0.00 C ATOM 1893 C LEU A 128 -6.033 -0.570 2.885 1.00 0.00 C ATOM 1894 O LEU A 128 -6.446 0.589 2.932 1.00 0.00 O ATOM 1895 CB LEU A 128 -6.725 -1.838 4.927 1.00 0.00 C ATOM 1896 CG LEU A 128 -7.186 -3.241 4.531 1.00 0.00 C ATOM 1897 CD1 LEU A 128 -6.035 -4.230 4.634 1.00 0.00 C ATOM 1898 CD2 LEU A 128 -8.352 -3.685 5.403 1.00 0.00 C ATOM 0 H LEU A 128 -5.311 0.111 5.701 1.00 0.00 H new ATOM 0 HA LEU A 128 -4.885 -2.096 3.846 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.464 -1.848 5.985 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -7.567 -1.155 4.813 1.00 0.00 H new ATOM 0 HG LEU A 128 -7.523 -3.213 3.495 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -6.382 -5.223 4.348 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.229 -3.921 3.968 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -5.668 -4.255 5.660 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -8.667 -4.686 5.107 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -8.041 -3.696 6.448 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -9.184 -2.991 5.279 1.00 0.00 H new ATOM 1910 N PHE A 129 -5.991 -1.278 1.761 1.00 0.00 N ATOM 1911 CA PHE A 129 -6.437 -0.721 0.490 1.00 0.00 C ATOM 1912 C PHE A 129 -7.093 -1.794 -0.374 1.00 0.00 C ATOM 1913 O PHE A 129 -7.072 -2.977 -0.036 1.00 0.00 O ATOM 1914 CB PHE A 129 -5.257 -0.098 -0.260 1.00 0.00 C ATOM 1915 CG PHE A 129 -4.930 1.297 0.191 1.00 0.00 C ATOM 1916 CD1 PHE A 129 -4.126 1.510 1.300 1.00 0.00 C ATOM 1917 CD2 PHE A 129 -5.425 2.395 -0.494 1.00 0.00 C ATOM 1918 CE1 PHE A 129 -3.824 2.793 1.717 1.00 0.00 C ATOM 1919 CE2 PHE A 129 -5.126 3.680 -0.081 1.00 0.00 C ATOM 1920 CZ PHE A 129 -4.324 3.879 1.025 1.00 0.00 C ATOM 0 H PHE A 129 -5.653 -2.239 1.705 1.00 0.00 H new ATOM 0 HA PHE A 129 -7.175 0.053 0.700 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -4.378 -0.729 -0.128 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -5.481 -0.083 -1.327 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -3.731 0.665 1.844 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -6.052 2.245 -1.361 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -3.198 2.946 2.583 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -5.519 4.527 -0.623 1.00 0.00 H new ATOM 0 HZ PHE A 129 -4.088 4.882 1.349 1.00 0.00 H new ATOM 1930 N ALA A 130 -7.676 -1.371 -1.491 1.00 0.00 N ATOM 1931 CA ALA A 130 -8.337 -2.294 -2.405 1.00 0.00 C ATOM 1932 C ALA A 130 -8.216 -1.819 -3.849 1.00 0.00 C ATOM 1933 O ALA A 130 -8.372 -0.633 -4.136 1.00 0.00 O ATOM 1934 CB ALA A 130 -9.800 -2.458 -2.022 1.00 0.00 C ATOM 0 H ALA A 130 -7.704 -0.395 -1.785 1.00 0.00 H new ATOM 0 HA ALA A 130 -7.841 -3.262 -2.326 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -10.282 -3.150 -2.713 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -9.869 -2.851 -1.008 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -10.299 -1.490 -2.071 1.00 0.00 H new ATOM 1940 N GLU A 131 -7.936 -2.753 -4.753 1.00 0.00 N ATOM 1941 CA GLU A 131 -7.792 -2.428 -6.167 1.00 0.00 C ATOM 1942 C GLU A 131 -9.006 -1.654 -6.673 1.00 0.00 C ATOM 1943 O GLU A 131 -10.121 -2.177 -6.705 1.00 0.00 O ATOM 1944 CB GLU A 131 -7.607 -3.704 -6.990 1.00 0.00 C ATOM 1945 CG GLU A 131 -8.765 -4.680 -6.868 1.00 0.00 C ATOM 1946 CD GLU A 131 -9.849 -4.432 -7.898 1.00 0.00 C ATOM 1947 OE1 GLU A 131 -9.538 -3.844 -8.956 1.00 0.00 O ATOM 1948 OE2 GLU A 131 -11.008 -4.824 -7.648 1.00 0.00 O ATOM 0 H GLU A 131 -7.805 -3.740 -4.531 1.00 0.00 H new ATOM 0 HA GLU A 131 -6.909 -1.800 -6.281 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -7.479 -3.435 -8.038 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -6.690 -4.200 -6.674 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.390 -5.698 -6.978 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -9.195 -4.605 -5.869 1.00 0.00 H new ATOM 1955 N LEU A 132 -8.782 -0.405 -7.067 1.00 0.00 N ATOM 1956 CA LEU A 132 -9.857 0.442 -7.572 1.00 0.00 C ATOM 1957 C LEU A 132 -10.115 0.172 -9.051 1.00 0.00 C ATOM 1958 O LEU A 132 -11.230 -0.171 -9.444 1.00 0.00 O ATOM 1959 CB LEU A 132 -9.510 1.918 -7.364 1.00 0.00 C ATOM 1960 CG LEU A 132 -10.582 2.925 -7.781 1.00 0.00 C ATOM 1961 CD1 LEU A 132 -10.502 4.176 -6.921 1.00 0.00 C ATOM 1962 CD2 LEU A 132 -10.439 3.277 -9.254 1.00 0.00 C ATOM 0 H LEU A 132 -7.866 0.043 -7.046 1.00 0.00 H new ATOM 0 HA LEU A 132 -10.764 0.206 -7.015 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -9.286 2.073 -6.309 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -8.598 2.138 -7.919 1.00 0.00 H new ATOM 0 HG LEU A 132 -11.560 2.468 -7.631 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -11.272 4.881 -7.232 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -10.655 3.909 -5.875 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -9.521 4.636 -7.038 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -11.210 3.995 -9.533 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -9.456 3.714 -9.430 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -10.548 2.375 -9.856 1.00 0.00 H new ATOM 1974 N ASP A 133 -9.076 0.326 -9.865 1.00 0.00 N ATOM 1975 CA ASP A 133 -9.189 0.096 -11.300 1.00 0.00 C ATOM 1976 C ASP A 133 -8.825 -1.344 -11.650 1.00 0.00 C ATOM 1977 O ASP A 133 -7.927 -1.943 -11.058 1.00 0.00 O ATOM 1978 CB ASP A 133 -8.287 1.064 -12.066 1.00 0.00 C ATOM 1979 CG ASP A 133 -8.198 0.728 -13.542 1.00 0.00 C ATOM 1980 OD1 ASP A 133 -7.382 -0.146 -13.903 1.00 0.00 O ATOM 1981 OD2 ASP A 133 -8.944 1.339 -14.336 1.00 0.00 O ATOM 0 H ASP A 133 -8.146 0.609 -9.555 1.00 0.00 H new ATOM 0 HA ASP A 133 -10.225 0.271 -11.590 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -8.667 2.079 -11.950 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -7.288 1.046 -11.631 1.00 0.00 H new ATOM 1986 N PRO A 134 -9.538 -1.913 -12.633 1.00 0.00 N ATOM 1987 CA PRO A 134 -9.307 -3.289 -13.083 1.00 0.00 C ATOM 1988 C PRO A 134 -7.982 -3.443 -13.821 1.00 0.00 C ATOM 1989 O PRO A 134 -7.204 -4.354 -13.536 1.00 0.00 O ATOM 1990 CB PRO A 134 -10.481 -3.554 -14.030 1.00 0.00 C ATOM 1991 CG PRO A 134 -10.884 -2.206 -14.519 1.00 0.00 C ATOM 1992 CD PRO A 134 -10.623 -1.257 -13.382 1.00 0.00 C ATOM 0 HA PRO A 134 -9.249 -3.987 -12.248 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -10.186 -4.203 -14.855 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -11.303 -4.050 -13.513 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -10.311 -1.924 -15.402 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -11.936 -2.193 -14.804 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -10.325 -0.272 -13.741 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -11.510 -1.116 -12.764 1.00 0.00 H new ATOM 2000 N ASP A 135 -7.731 -2.549 -14.770 1.00 0.00 N ATOM 2001 CA ASP A 135 -6.499 -2.585 -15.549 1.00 0.00 C ATOM 2002 C ASP A 135 -5.282 -2.704 -14.635 1.00 0.00 C ATOM 2003 O ASP A 135 -4.331 -3.420 -14.945 1.00 0.00 O ATOM 2004 CB ASP A 135 -6.380 -1.330 -16.415 1.00 0.00 C ATOM 2005 CG ASP A 135 -7.717 -0.883 -16.972 1.00 0.00 C ATOM 2006 OD1 ASP A 135 -8.573 -1.754 -17.233 1.00 0.00 O ATOM 2007 OD2 ASP A 135 -7.909 0.339 -17.147 1.00 0.00 O ATOM 0 H ASP A 135 -8.365 -1.790 -15.019 1.00 0.00 H new ATOM 0 HA ASP A 135 -6.533 -3.461 -16.196 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -5.948 -0.523 -15.823 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -5.693 -1.524 -17.239 1.00 0.00 H new ATOM 2012 N GLN A 136 -5.322 -1.997 -13.511 1.00 0.00 N ATOM 2013 CA GLN A 136 -4.222 -2.023 -12.554 1.00 0.00 C ATOM 2014 C GLN A 136 -4.687 -2.559 -11.204 1.00 0.00 C ATOM 2015 O GLN A 136 -4.990 -1.804 -10.280 1.00 0.00 O ATOM 2016 CB GLN A 136 -3.633 -0.622 -12.384 1.00 0.00 C ATOM 2017 CG GLN A 136 -2.721 -0.202 -13.526 1.00 0.00 C ATOM 2018 CD GLN A 136 -1.413 -0.968 -13.540 1.00 0.00 C ATOM 2019 OE1 GLN A 136 -1.111 -1.686 -14.493 1.00 0.00 O ATOM 2020 NE2 GLN A 136 -0.628 -0.817 -12.480 1.00 0.00 N ATOM 0 H GLN A 136 -6.103 -1.400 -13.240 1.00 0.00 H new ATOM 0 HA GLN A 136 -3.452 -2.689 -12.943 1.00 0.00 H new ATOM 0 HB2 GLN A 136 -4.447 0.097 -12.297 1.00 0.00 H new ATOM 0 HB3 GLN A 136 -3.073 -0.583 -11.450 1.00 0.00 H new ATOM 0 HG2 GLN A 136 -3.238 -0.355 -14.474 1.00 0.00 H new ATOM 0 HG3 GLN A 136 -2.512 0.865 -13.446 1.00 0.00 H new ATOM 0 HE21 GLN A 136 -0.918 -0.211 -11.712 1.00 0.00 H new ATOM 0 HE22 GLN A 136 0.266 -1.307 -12.433 1.00 0.00 H new ATOM 2029 N PRO A 137 -4.747 -3.894 -11.085 1.00 0.00 N ATOM 2030 CA PRO A 137 -5.174 -4.561 -9.852 1.00 0.00 C ATOM 2031 C PRO A 137 -4.156 -4.408 -8.727 1.00 0.00 C ATOM 2032 O PRO A 137 -3.095 -3.813 -8.915 1.00 0.00 O ATOM 2033 CB PRO A 137 -5.297 -6.029 -10.267 1.00 0.00 C ATOM 2034 CG PRO A 137 -4.372 -6.174 -11.425 1.00 0.00 C ATOM 2035 CD PRO A 137 -4.401 -4.855 -12.146 1.00 0.00 C ATOM 0 HA PRO A 137 -6.098 -4.137 -9.458 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -5.018 -6.696 -9.451 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -6.321 -6.277 -10.545 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -3.363 -6.414 -11.091 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -4.691 -6.984 -12.081 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -3.437 -4.623 -12.599 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -5.139 -4.851 -12.948 1.00 0.00 H new ATOM 2043 N ALA A 138 -4.485 -4.950 -7.559 1.00 0.00 N ATOM 2044 CA ALA A 138 -3.598 -4.876 -6.405 1.00 0.00 C ATOM 2045 C ALA A 138 -2.299 -5.633 -6.662 1.00 0.00 C ATOM 2046 O ALA A 138 -1.209 -5.113 -6.427 1.00 0.00 O ATOM 2047 CB ALA A 138 -4.294 -5.422 -5.168 1.00 0.00 C ATOM 0 H ALA A 138 -5.360 -5.445 -7.387 1.00 0.00 H new ATOM 0 HA ALA A 138 -3.350 -3.828 -6.235 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -3.619 -5.360 -4.314 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -5.190 -4.835 -4.966 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -4.572 -6.462 -5.336 1.00 0.00 H new ATOM 2053 N GLY A 139 -2.424 -6.865 -7.145 1.00 0.00 N ATOM 2054 CA GLY A 139 -1.252 -7.675 -7.425 1.00 0.00 C ATOM 2055 C GLY A 139 -0.212 -6.928 -8.236 1.00 0.00 C ATOM 2056 O GLY A 139 0.975 -6.958 -7.913 1.00 0.00 O ATOM 0 H GLY A 139 -3.316 -7.317 -7.348 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -0.808 -8.004 -6.485 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -1.555 -8.572 -7.966 1.00 0.00 H new ATOM 2060 N ALA A 140 -0.657 -6.256 -9.292 1.00 0.00 N ATOM 2061 CA ALA A 140 0.244 -5.498 -10.151 1.00 0.00 C ATOM 2062 C ALA A 140 0.901 -4.355 -9.385 1.00 0.00 C ATOM 2063 O ALA A 140 1.975 -3.883 -9.756 1.00 0.00 O ATOM 2064 CB ALA A 140 -0.507 -4.962 -11.361 1.00 0.00 C ATOM 0 H ALA A 140 -1.637 -6.221 -9.573 1.00 0.00 H new ATOM 0 HA ALA A 140 1.031 -6.170 -10.494 1.00 0.00 H new ATOM 0 HB1 ALA A 140 0.178 -4.398 -11.994 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -0.924 -5.794 -11.929 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -1.314 -4.309 -11.028 1.00 0.00 H new ATOM 2070 N ILE A 141 0.248 -3.914 -8.314 1.00 0.00 N ATOM 2071 CA ILE A 141 0.770 -2.827 -7.496 1.00 0.00 C ATOM 2072 C ILE A 141 1.862 -3.323 -6.555 1.00 0.00 C ATOM 2073 O ILE A 141 3.042 -3.031 -6.748 1.00 0.00 O ATOM 2074 CB ILE A 141 -0.345 -2.162 -6.666 1.00 0.00 C ATOM 2075 CG1 ILE A 141 -1.411 -1.567 -7.588 1.00 0.00 C ATOM 2076 CG2 ILE A 141 0.238 -1.089 -5.760 1.00 0.00 C ATOM 2077 CD1 ILE A 141 -2.764 -1.415 -6.928 1.00 0.00 C ATOM 0 H ILE A 141 -0.643 -4.293 -7.993 1.00 0.00 H new ATOM 0 HA ILE A 141 1.191 -2.090 -8.180 1.00 0.00 H new ATOM 0 HB ILE A 141 -0.815 -2.922 -6.041 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -1.074 -0.591 -7.937 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -1.514 -2.202 -8.468 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -0.562 -0.628 -5.180 1.00 0.00 H new ATOM 0 HG22 ILE A 141 0.964 -1.539 -5.083 1.00 0.00 H new ATOM 0 HG23 ILE A 141 0.730 -0.329 -6.366 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -3.470 -0.988 -7.640 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -3.122 -2.392 -6.604 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -2.676 -0.756 -6.064 1.00 0.00 H new ATOM 2089 N VAL A 142 1.461 -4.075 -5.535 1.00 0.00 N ATOM 2090 CA VAL A 142 2.405 -4.615 -4.564 1.00 0.00 C ATOM 2091 C VAL A 142 3.687 -5.082 -5.246 1.00 0.00 C ATOM 2092 O VAL A 142 4.790 -4.822 -4.765 1.00 0.00 O ATOM 2093 CB VAL A 142 1.795 -5.792 -3.781 1.00 0.00 C ATOM 2094 CG1 VAL A 142 0.852 -5.283 -2.701 1.00 0.00 C ATOM 2095 CG2 VAL A 142 1.073 -6.742 -4.725 1.00 0.00 C ATOM 0 H VAL A 142 0.488 -4.324 -5.360 1.00 0.00 H new ATOM 0 HA VAL A 142 2.639 -3.809 -3.868 1.00 0.00 H new ATOM 0 HB VAL A 142 2.602 -6.341 -3.296 1.00 0.00 H new ATOM 0 HG11 VAL A 142 0.430 -6.129 -2.158 1.00 0.00 H new ATOM 0 HG12 VAL A 142 1.402 -4.645 -2.009 1.00 0.00 H new ATOM 0 HG13 VAL A 142 0.047 -4.710 -3.161 1.00 0.00 H new ATOM 0 HG21 VAL A 142 0.648 -7.568 -4.155 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.274 -6.207 -5.239 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.779 -7.132 -5.458 1.00 0.00 H new ATOM 2105 N THR A 143 3.534 -5.775 -6.370 1.00 0.00 N ATOM 2106 CA THR A 143 4.678 -6.280 -7.119 1.00 0.00 C ATOM 2107 C THR A 143 5.607 -5.146 -7.533 1.00 0.00 C ATOM 2108 O THR A 143 6.802 -5.169 -7.236 1.00 0.00 O ATOM 2109 CB THR A 143 4.231 -7.048 -8.377 1.00 0.00 C ATOM 2110 OG1 THR A 143 3.434 -8.178 -8.004 1.00 0.00 O ATOM 2111 CG2 THR A 143 5.435 -7.515 -9.182 1.00 0.00 C ATOM 0 H THR A 143 2.628 -5.999 -6.782 1.00 0.00 H new ATOM 0 HA THR A 143 5.213 -6.961 -6.458 1.00 0.00 H new ATOM 0 HB THR A 143 3.639 -6.374 -8.996 1.00 0.00 H new ATOM 0 HG1 THR A 143 2.504 -7.895 -7.878 1.00 0.00 H new ATOM 0 HG21 THR A 143 5.095 -8.055 -10.066 1.00 0.00 H new ATOM 0 HG22 THR A 143 6.025 -6.651 -9.489 1.00 0.00 H new ATOM 0 HG23 THR A 143 6.049 -8.174 -8.569 1.00 0.00 H new ATOM 2119 N PHE A 144 5.052 -4.153 -8.221 1.00 0.00 N ATOM 2120 CA PHE A 144 5.833 -3.009 -8.677 1.00 0.00 C ATOM 2121 C PHE A 144 6.548 -2.338 -7.508 1.00 0.00 C ATOM 2122 O PHE A 144 7.601 -1.723 -7.681 1.00 0.00 O ATOM 2123 CB PHE A 144 4.929 -1.997 -9.385 1.00 0.00 C ATOM 2124 CG PHE A 144 5.672 -0.819 -9.947 1.00 0.00 C ATOM 2125 CD1 PHE A 144 5.968 0.275 -9.149 1.00 0.00 C ATOM 2126 CD2 PHE A 144 6.075 -0.806 -11.272 1.00 0.00 C ATOM 2127 CE1 PHE A 144 6.652 1.361 -9.663 1.00 0.00 C ATOM 2128 CE2 PHE A 144 6.760 0.277 -11.791 1.00 0.00 C ATOM 2129 CZ PHE A 144 7.048 1.362 -10.986 1.00 0.00 C ATOM 0 H PHE A 144 4.065 -4.118 -8.475 1.00 0.00 H new ATOM 0 HA PHE A 144 6.583 -3.370 -9.380 1.00 0.00 H new ATOM 0 HB2 PHE A 144 4.397 -2.500 -10.193 1.00 0.00 H new ATOM 0 HB3 PHE A 144 4.177 -1.640 -8.682 1.00 0.00 H new ATOM 0 HD1 PHE A 144 5.661 0.279 -8.114 1.00 0.00 H new ATOM 0 HD2 PHE A 144 5.852 -1.651 -11.907 1.00 0.00 H new ATOM 0 HE1 PHE A 144 6.876 2.207 -9.031 1.00 0.00 H new ATOM 0 HE2 PHE A 144 7.070 0.275 -12.826 1.00 0.00 H new ATOM 0 HZ PHE A 144 7.582 2.209 -11.390 1.00 0.00 H new ATOM 2139 N ILE A 145 5.968 -2.460 -6.319 1.00 0.00 N ATOM 2140 CA ILE A 145 6.550 -1.866 -5.121 1.00 0.00 C ATOM 2141 C ILE A 145 7.747 -2.674 -4.633 1.00 0.00 C ATOM 2142 O ILE A 145 8.894 -2.241 -4.753 1.00 0.00 O ATOM 2143 CB ILE A 145 5.516 -1.763 -3.984 1.00 0.00 C ATOM 2144 CG1 ILE A 145 4.269 -1.018 -4.465 1.00 0.00 C ATOM 2145 CG2 ILE A 145 6.124 -1.066 -2.777 1.00 0.00 C ATOM 2146 CD1 ILE A 145 3.139 -1.020 -3.460 1.00 0.00 C ATOM 0 H ILE A 145 5.096 -2.964 -6.159 1.00 0.00 H new ATOM 0 HA ILE A 145 6.879 -0.863 -5.394 1.00 0.00 H new ATOM 0 HB ILE A 145 5.222 -2.770 -3.687 1.00 0.00 H new ATOM 0 HG12 ILE A 145 4.538 0.013 -4.695 1.00 0.00 H new ATOM 0 HG13 ILE A 145 3.920 -1.471 -5.393 1.00 0.00 H new ATOM 0 HG21 ILE A 145 5.381 -1.001 -1.982 1.00 0.00 H new ATOM 0 HG22 ILE A 145 6.984 -1.634 -2.424 1.00 0.00 H new ATOM 0 HG23 ILE A 145 6.443 -0.062 -3.059 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.288 -0.474 -3.868 1.00 0.00 H new ATOM 0 HD12 ILE A 145 2.843 -2.047 -3.247 1.00 0.00 H new ATOM 0 HD13 ILE A 145 3.470 -0.540 -2.539 1.00 0.00 H new ATOM 2158 N THR A 146 7.474 -3.853 -4.082 1.00 0.00 N ATOM 2159 CA THR A 146 8.528 -4.723 -3.576 1.00 0.00 C ATOM 2160 C THR A 146 9.655 -4.869 -4.592 1.00 0.00 C ATOM 2161 O THR A 146 10.778 -5.233 -4.241 1.00 0.00 O ATOM 2162 CB THR A 146 7.983 -6.121 -3.227 1.00 0.00 C ATOM 2163 OG1 THR A 146 7.747 -6.869 -4.425 1.00 0.00 O ATOM 2164 CG2 THR A 146 6.693 -6.014 -2.427 1.00 0.00 C ATOM 0 H THR A 146 6.531 -4.227 -3.975 1.00 0.00 H new ATOM 0 HA THR A 146 8.916 -4.256 -2.671 1.00 0.00 H new ATOM 0 HB THR A 146 8.728 -6.636 -2.620 1.00 0.00 H new ATOM 0 HG1 THR A 146 7.402 -7.757 -4.194 1.00 0.00 H new ATOM 0 HG21 THR A 146 6.327 -7.013 -2.192 1.00 0.00 H new ATOM 0 HG22 THR A 146 6.883 -5.470 -1.502 1.00 0.00 H new ATOM 0 HG23 THR A 146 5.944 -5.482 -3.014 1.00 0.00 H new ATOM 2172 N LYS A 147 9.350 -4.583 -5.853 1.00 0.00 N ATOM 2173 CA LYS A 147 10.338 -4.680 -6.921 1.00 0.00 C ATOM 2174 C LYS A 147 11.357 -3.549 -6.824 1.00 0.00 C ATOM 2175 O LYS A 147 12.565 -3.787 -6.809 1.00 0.00 O ATOM 2176 CB LYS A 147 9.648 -4.644 -8.286 1.00 0.00 C ATOM 2177 CG LYS A 147 8.928 -5.933 -8.638 1.00 0.00 C ATOM 2178 CD LYS A 147 9.850 -6.912 -9.345 1.00 0.00 C ATOM 2179 CE LYS A 147 9.457 -8.354 -9.060 1.00 0.00 C ATOM 2180 NZ LYS A 147 10.515 -9.312 -9.485 1.00 0.00 N ATOM 0 H LYS A 147 8.425 -4.282 -6.161 1.00 0.00 H new ATOM 0 HA LYS A 147 10.863 -5.629 -6.811 1.00 0.00 H new ATOM 0 HB2 LYS A 147 8.932 -3.822 -8.300 1.00 0.00 H new ATOM 0 HB3 LYS A 147 10.392 -4.432 -9.054 1.00 0.00 H new ATOM 0 HG2 LYS A 147 8.536 -6.392 -7.730 1.00 0.00 H new ATOM 0 HG3 LYS A 147 8.073 -5.711 -9.277 1.00 0.00 H new ATOM 0 HD2 LYS A 147 9.819 -6.731 -10.419 1.00 0.00 H new ATOM 0 HD3 LYS A 147 10.877 -6.743 -9.023 1.00 0.00 H new ATOM 0 HE2 LYS A 147 9.265 -8.474 -7.994 1.00 0.00 H new ATOM 0 HE3 LYS A 147 8.527 -8.586 -9.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 10.209 -10.283 -9.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 10.680 -9.216 -10.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 11.396 -9.107 -8.971 1.00 0.00 H new ATOM 2194 N VAL A 148 10.862 -2.317 -6.756 1.00 0.00 N ATOM 2195 CA VAL A 148 11.730 -1.149 -6.658 1.00 0.00 C ATOM 2196 C VAL A 148 11.987 -0.777 -5.202 1.00 0.00 C ATOM 2197 O VAL A 148 13.133 -0.586 -4.791 1.00 0.00 O ATOM 2198 CB VAL A 148 11.123 0.064 -7.387 1.00 0.00 C ATOM 2199 CG1 VAL A 148 9.774 0.429 -6.785 1.00 0.00 C ATOM 2200 CG2 VAL A 148 12.077 1.248 -7.336 1.00 0.00 C ATOM 0 H VAL A 148 9.865 -2.102 -6.767 1.00 0.00 H new ATOM 0 HA VAL A 148 12.674 -1.414 -7.134 1.00 0.00 H new ATOM 0 HB VAL A 148 10.967 -0.203 -8.432 1.00 0.00 H new ATOM 0 HG11 VAL A 148 9.360 1.288 -7.313 1.00 0.00 H new ATOM 0 HG12 VAL A 148 9.093 -0.417 -6.879 1.00 0.00 H new ATOM 0 HG13 VAL A 148 9.901 0.677 -5.731 1.00 0.00 H new ATOM 0 HG21 VAL A 148 11.632 2.096 -7.856 1.00 0.00 H new ATOM 0 HG22 VAL A 148 12.267 1.518 -6.297 1.00 0.00 H new ATOM 0 HG23 VAL A 148 13.017 0.979 -7.818 1.00 0.00 H new ATOM 2210 N LEU A 149 10.915 -0.675 -4.425 1.00 0.00 N ATOM 2211 CA LEU A 149 11.023 -0.325 -3.013 1.00 0.00 C ATOM 2212 C LEU A 149 12.006 -1.247 -2.298 1.00 0.00 C ATOM 2213 O LEU A 149 13.045 -0.804 -1.807 1.00 0.00 O ATOM 2214 CB LEU A 149 9.652 -0.404 -2.340 1.00 0.00 C ATOM 2215 CG LEU A 149 8.824 0.882 -2.351 1.00 0.00 C ATOM 2216 CD1 LEU A 149 9.425 1.912 -1.408 1.00 0.00 C ATOM 2217 CD2 LEU A 149 8.727 1.442 -3.763 1.00 0.00 C ATOM 0 H LEU A 149 9.960 -0.830 -4.749 1.00 0.00 H new ATOM 0 HA LEU A 149 11.395 0.697 -2.945 1.00 0.00 H new ATOM 0 HB2 LEU A 149 9.074 -1.189 -2.829 1.00 0.00 H new ATOM 0 HB3 LEU A 149 9.795 -0.712 -1.304 1.00 0.00 H new ATOM 0 HG LEU A 149 7.818 0.646 -2.005 1.00 0.00 H new ATOM 0 HD11 LEU A 149 8.822 2.820 -1.429 1.00 0.00 H new ATOM 0 HD12 LEU A 149 9.442 1.511 -0.394 1.00 0.00 H new ATOM 0 HD13 LEU A 149 10.442 2.144 -1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 149 8.134 2.357 -3.752 1.00 0.00 H new ATOM 0 HD22 LEU A 149 9.727 1.662 -4.137 1.00 0.00 H new ATOM 0 HD23 LEU A 149 8.250 0.709 -4.413 1.00 0.00 H new ATOM 2229 N LEU A 150 11.672 -2.532 -2.244 1.00 0.00 N ATOM 2230 CA LEU A 150 12.526 -3.518 -1.591 1.00 0.00 C ATOM 2231 C LEU A 150 13.714 -3.881 -2.477 1.00 0.00 C ATOM 2232 O LEU A 150 14.488 -4.782 -2.156 1.00 0.00 O ATOM 2233 CB LEU A 150 11.723 -4.775 -1.255 1.00 0.00 C ATOM 2234 CG LEU A 150 10.901 -4.722 0.033 1.00 0.00 C ATOM 2235 CD1 LEU A 150 9.591 -3.984 -0.199 1.00 0.00 C ATOM 2236 CD2 LEU A 150 10.638 -6.126 0.557 1.00 0.00 C ATOM 0 H LEU A 150 10.816 -2.915 -2.645 1.00 0.00 H new ATOM 0 HA LEU A 150 12.905 -3.079 -0.668 1.00 0.00 H new ATOM 0 HB2 LEU A 150 11.048 -4.983 -2.085 1.00 0.00 H new ATOM 0 HB3 LEU A 150 12.413 -5.616 -1.187 1.00 0.00 H new ATOM 0 HG LEU A 150 11.474 -4.177 0.784 1.00 0.00 H new ATOM 0 HD11 LEU A 150 9.020 -3.956 0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 150 9.800 -2.966 -0.527 1.00 0.00 H new ATOM 0 HD13 LEU A 150 9.013 -4.500 -0.966 1.00 0.00 H new ATOM 0 HD21 LEU A 150 10.052 -6.068 1.474 1.00 0.00 H new ATOM 0 HD22 LEU A 150 10.087 -6.696 -0.191 1.00 0.00 H new ATOM 0 HD23 LEU A 150 11.587 -6.621 0.764 1.00 0.00 H new