USER MOD reduce.3.24.130724 H: found=0, std=0, add=1191, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1192 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 104 LYS NZ :NH3+ -173:sc= 0 (180deg=0) USER MOD Set 1.2: A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 GLN : amide:sc= -5.12! C(o=-5.1!,f=-9.9!) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.164) USER MOD Single : A 42 TYR OH : rot 57:sc= 0.15 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -2.33! C(o=-2.3!,f=-4.7!) USER MOD Single : A 56 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.234) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.0854 X(o=-0.085,f=-0.12) USER MOD Single : A 77 SER OG : rot 180:sc= -0.0336 USER MOD Single : A 81 SER OG : rot -90:sc= -0.734 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 134:sc= -0.115 (180deg=-0.819) USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.17 USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.701 USER MOD Single : A 94 THR OG1 : rot 113:sc= 0.639 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl -155:sc= -0.594 (180deg=-2.7!) USER MOD Single : A 105 THR OG1 : rot 77:sc= 0.856 USER MOD Single : A 107 ASN : amide:sc= -4.09 K(o=-4.1,f=-13!) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 ASN :FLIP amide:sc= -1.69 F(o=-5.7!,f=-1.7) USER MOD Single : A 129 GLN : amide:sc= -17.1! C(o=-17!,f=-23!) USER MOD Single : A 131 TYR OH : rot 15:sc= -0.0197 USER MOD Single : A 132 TYR OH : rot 165:sc= 0 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 TYR OH : rot 60:sc= 0.489 USER MOD Single : A 143 ASN :FLIP amide:sc= -1.55 F(o=-2.5,f=-1.5) USER MOD Single : A 147 HIS : no HD1:sc= -0.676 K(o=-0.68,f=-3.8!) USER MOD Single : A 151 SER OG : rot 25:sc= 0.844 USER MOD Single : A 153 THR OG1 : rot 110:sc= -0.0691 USER MOD Single : A 154 THR OG1 : rot 180:sc= 0.00147 USER MOD Single : A 155 ASN :FLIP amide:sc= -3.9! C(o=-7.5!,f=-3.9!) USER MOD Single : A 158 LYS NZ :NH3+ -121:sc= -1.42! (180deg=-2.7!) USER MOD Single : A 161 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 SER OG : rot 180:sc= 0 USER MOD Single : A 166 THR OG1 : rot -160:sc= -0.462 USER MOD Single : A 173 THR OG1 : rot 180:sc= 0 USER MOD Single : A 175 LYS NZ :NH3+ -112:sc= -1.84 (180deg=-4.49!) USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD Single : A 180 THR OG1 : rot 85:sc= 1.26 USER MOD Single : A 183 SER OG : rot -28:sc= 0.375 USER MOD Single : A 184 SER OG : rot -36:sc= 0.257 USER MOD Single : A 186 HIS : no HD1:sc= -0.189 X(o=-0.19,f=-0.058) USER MOD Single : A 188 TYR OH : rot 180:sc= -0.185 USER MOD ----------------------------------------------------------------- ATOM 149 N LEU A 32 19.282 -5.782 -9.496 1.00 0.00 N ATOM 150 CA LEU A 32 17.952 -5.219 -9.245 1.00 0.00 C ATOM 151 C LEU A 32 17.323 -4.741 -10.549 1.00 0.00 C ATOM 152 O LEU A 32 18.004 -4.183 -11.410 1.00 0.00 O ATOM 153 CB LEU A 32 18.060 -4.039 -8.275 1.00 0.00 C ATOM 154 CG LEU A 32 18.781 -4.476 -6.993 1.00 0.00 C ATOM 155 CD1 LEU A 32 18.880 -3.281 -6.041 1.00 0.00 C ATOM 156 CD2 LEU A 32 17.999 -5.613 -6.312 1.00 0.00 C ATOM 0 HA LEU A 32 17.324 -5.996 -8.809 1.00 0.00 H new ATOM 0 HB2 LEU A 32 18.603 -3.219 -8.746 1.00 0.00 H new ATOM 0 HB3 LEU A 32 17.065 -3.665 -8.033 1.00 0.00 H new ATOM 0 HG LEU A 32 19.780 -4.833 -7.243 1.00 0.00 H new ATOM 0 HD11 LEU A 32 19.391 -3.585 -5.128 1.00 0.00 H new ATOM 0 HD12 LEU A 32 19.440 -2.479 -6.521 1.00 0.00 H new ATOM 0 HD13 LEU A 32 17.879 -2.927 -5.796 1.00 0.00 H new ATOM 0 HD21 LEU A 32 18.517 -5.917 -5.403 1.00 0.00 H new ATOM 0 HD22 LEU A 32 16.997 -5.265 -6.059 1.00 0.00 H new ATOM 0 HD23 LEU A 32 17.928 -6.463 -6.991 1.00 0.00 H new ATOM 168 N GLN A 33 16.016 -4.955 -10.685 1.00 0.00 N ATOM 169 CA GLN A 33 15.289 -4.536 -11.884 1.00 0.00 C ATOM 170 C GLN A 33 14.484 -3.279 -11.589 1.00 0.00 C ATOM 171 O GLN A 33 14.029 -3.078 -10.464 1.00 0.00 O ATOM 172 CB GLN A 33 14.343 -5.650 -12.339 1.00 0.00 C ATOM 173 CG GLN A 33 15.157 -6.809 -12.916 1.00 0.00 C ATOM 174 CD GLN A 33 16.063 -7.397 -11.839 1.00 0.00 C ATOM 175 OE1 GLN A 33 15.731 -7.351 -10.655 1.00 0.00 O ATOM 176 NE2 GLN A 33 17.191 -7.955 -12.186 1.00 0.00 N ATOM 0 H GLN A 33 15.438 -5.415 -9.982 1.00 0.00 H new ATOM 0 HA GLN A 33 16.008 -4.328 -12.676 1.00 0.00 H new ATOM 0 HB2 GLN A 33 13.742 -5.997 -11.498 1.00 0.00 H new ATOM 0 HB3 GLN A 33 13.651 -5.269 -13.090 1.00 0.00 H new ATOM 0 HG2 GLN A 33 14.488 -7.579 -13.300 1.00 0.00 H new ATOM 0 HG3 GLN A 33 15.757 -6.460 -13.757 1.00 0.00 H new ATOM 0 HE21 GLN A 33 17.461 -7.990 -13.169 1.00 0.00 H new ATOM 0 HE22 GLN A 33 17.802 -8.356 -11.474 1.00 0.00 H new ATOM 185 N ARG A 34 14.314 -2.432 -12.603 1.00 0.00 N ATOM 186 CA ARG A 34 13.563 -1.183 -12.444 1.00 0.00 C ATOM 187 C ARG A 34 12.358 -1.153 -13.367 1.00 0.00 C ATOM 188 O ARG A 34 12.445 -1.514 -14.541 1.00 0.00 O ATOM 189 CB ARG A 34 14.473 0.009 -12.747 1.00 0.00 C ATOM 190 CG ARG A 34 14.894 -0.027 -14.217 1.00 0.00 C ATOM 191 CD ARG A 34 16.001 1.003 -14.452 1.00 0.00 C ATOM 192 NE ARG A 34 16.342 1.066 -15.869 1.00 0.00 N ATOM 193 CZ ARG A 34 17.172 1.995 -16.333 1.00 0.00 C ATOM 194 NH1 ARG A 34 17.688 2.874 -15.516 1.00 0.00 N ATOM 195 NH2 ARG A 34 17.470 2.029 -17.603 1.00 0.00 N ATOM 0 H ARG A 34 14.684 -2.585 -13.541 1.00 0.00 H new ATOM 0 HA ARG A 34 13.210 -1.123 -11.414 1.00 0.00 H new ATOM 0 HB2 ARG A 34 13.952 0.941 -12.530 1.00 0.00 H new ATOM 0 HB3 ARG A 34 15.354 -0.021 -12.105 1.00 0.00 H new ATOM 0 HG2 ARG A 34 15.247 -1.024 -14.482 1.00 0.00 H new ATOM 0 HG3 ARG A 34 14.039 0.189 -14.857 1.00 0.00 H new ATOM 0 HD2 ARG A 34 15.674 1.984 -14.106 1.00 0.00 H new ATOM 0 HD3 ARG A 34 16.884 0.737 -13.870 1.00 0.00 H new ATOM 0 HE ARG A 34 15.937 0.387 -16.514 1.00 0.00 H new ATOM 0 HH11 ARG A 34 17.454 2.847 -14.524 1.00 0.00 H new ATOM 0 HH12 ARG A 34 18.325 3.587 -15.870 1.00 0.00 H new ATOM 0 HH21 ARG A 34 17.066 1.343 -18.240 1.00 0.00 H new ATOM 0 HH22 ARG A 34 18.107 2.742 -17.958 1.00 0.00 H new ATOM 209 N TYR A 35 11.229 -0.705 -12.820 1.00 0.00 N ATOM 210 CA TYR A 35 9.985 -0.607 -13.580 1.00 0.00 C ATOM 211 C TYR A 35 9.434 0.809 -13.488 1.00 0.00 C ATOM 212 O TYR A 35 9.423 1.404 -12.413 1.00 0.00 O ATOM 213 CB TYR A 35 8.953 -1.594 -13.029 1.00 0.00 C ATOM 214 CG TYR A 35 7.728 -1.582 -13.912 1.00 0.00 C ATOM 215 CD1 TYR A 35 7.698 -2.357 -15.078 1.00 0.00 C ATOM 216 CD2 TYR A 35 6.624 -0.794 -13.568 1.00 0.00 C ATOM 217 CE1 TYR A 35 6.565 -2.345 -15.898 1.00 0.00 C ATOM 218 CE2 TYR A 35 5.489 -0.781 -14.389 1.00 0.00 C ATOM 219 CZ TYR A 35 5.460 -1.556 -15.554 1.00 0.00 C ATOM 220 OH TYR A 35 4.343 -1.543 -16.363 1.00 0.00 O ATOM 0 H TYR A 35 11.151 -0.403 -11.849 1.00 0.00 H new ATOM 0 HA TYR A 35 10.190 -0.849 -14.623 1.00 0.00 H new ATOM 0 HB2 TYR A 35 9.377 -2.597 -12.990 1.00 0.00 H new ATOM 0 HB3 TYR A 35 8.682 -1.323 -12.009 1.00 0.00 H new ATOM 0 HD1 TYR A 35 8.550 -2.964 -15.344 1.00 0.00 H new ATOM 0 HD2 TYR A 35 6.647 -0.196 -12.669 1.00 0.00 H new ATOM 0 HE1 TYR A 35 6.542 -2.944 -16.796 1.00 0.00 H new ATOM 0 HE2 TYR A 35 4.637 -0.173 -14.123 1.00 0.00 H new ATOM 0 HH TYR A 35 3.668 -0.945 -15.979 1.00 0.00 H new ATOM 230 N SER A 36 8.980 1.348 -14.617 1.00 0.00 N ATOM 231 CA SER A 36 8.429 2.705 -14.645 1.00 0.00 C ATOM 232 C SER A 36 7.294 2.799 -15.657 1.00 0.00 C ATOM 233 O SER A 36 7.225 2.014 -16.602 1.00 0.00 O ATOM 234 CB SER A 36 9.526 3.706 -15.009 1.00 0.00 C ATOM 235 OG SER A 36 9.915 3.505 -16.361 1.00 0.00 O ATOM 0 H SER A 36 8.981 0.872 -15.519 1.00 0.00 H new ATOM 0 HA SER A 36 8.038 2.940 -13.655 1.00 0.00 H new ATOM 0 HB2 SER A 36 9.165 4.725 -14.870 1.00 0.00 H new ATOM 0 HB3 SER A 36 10.384 3.579 -14.349 1.00 0.00 H new ATOM 0 HG SER A 36 10.617 4.146 -16.598 1.00 0.00 H new ATOM 241 N ASP A 37 6.403 3.768 -15.454 1.00 0.00 N ATOM 242 CA ASP A 37 5.269 3.959 -16.357 1.00 0.00 C ATOM 243 C ASP A 37 4.892 5.433 -16.438 1.00 0.00 C ATOM 244 O ASP A 37 4.524 6.043 -15.435 1.00 0.00 O ATOM 245 CB ASP A 37 4.067 3.162 -15.855 1.00 0.00 C ATOM 246 CG ASP A 37 2.997 3.094 -16.939 1.00 0.00 C ATOM 247 OD1 ASP A 37 3.261 3.564 -18.034 1.00 0.00 O ATOM 248 OD2 ASP A 37 1.929 2.574 -16.659 1.00 0.00 O ATOM 0 H ASP A 37 6.443 4.429 -14.678 1.00 0.00 H new ATOM 0 HA ASP A 37 5.557 3.609 -17.349 1.00 0.00 H new ATOM 0 HB2 ASP A 37 4.378 2.155 -15.576 1.00 0.00 H new ATOM 0 HB3 ASP A 37 3.659 3.629 -14.959 1.00 0.00 H new ATOM 253 N THR A 38 4.975 5.998 -17.636 1.00 0.00 N ATOM 254 CA THR A 38 4.628 7.399 -17.827 1.00 0.00 C ATOM 255 C THR A 38 3.121 7.593 -17.686 1.00 0.00 C ATOM 256 O THR A 38 2.659 8.636 -17.225 1.00 0.00 O ATOM 257 CB THR A 38 5.078 7.870 -19.210 1.00 0.00 C ATOM 258 OG1 THR A 38 4.362 7.157 -20.209 1.00 0.00 O ATOM 259 CG2 THR A 38 6.578 7.614 -19.374 1.00 0.00 C ATOM 0 H THR A 38 5.276 5.513 -18.481 1.00 0.00 H new ATOM 0 HA THR A 38 5.137 7.989 -17.065 1.00 0.00 H new ATOM 0 HB THR A 38 4.880 8.937 -19.313 1.00 0.00 H new ATOM 0 HG1 THR A 38 4.649 7.460 -21.096 1.00 0.00 H new ATOM 0 HG21 THR A 38 6.899 7.950 -20.360 1.00 0.00 H new ATOM 0 HG22 THR A 38 7.127 8.162 -18.608 1.00 0.00 H new ATOM 0 HG23 THR A 38 6.779 6.548 -19.271 1.00 0.00 H new ATOM 267 N LYS A 39 2.361 6.577 -18.089 1.00 0.00 N ATOM 268 CA LYS A 39 0.908 6.645 -18.005 1.00 0.00 C ATOM 269 C LYS A 39 0.455 6.793 -16.554 1.00 0.00 C ATOM 270 O LYS A 39 -0.344 7.672 -16.233 1.00 0.00 O ATOM 271 CB LYS A 39 0.295 5.378 -18.608 1.00 0.00 C ATOM 272 CG LYS A 39 -1.228 5.523 -18.677 1.00 0.00 C ATOM 273 CD LYS A 39 -1.840 4.234 -19.229 1.00 0.00 C ATOM 274 CE LYS A 39 -3.342 4.434 -19.444 1.00 0.00 C ATOM 275 NZ LYS A 39 -4.018 4.570 -18.124 1.00 0.00 N ATOM 0 H LYS A 39 2.725 5.705 -18.473 1.00 0.00 H new ATOM 0 HA LYS A 39 0.571 7.517 -18.565 1.00 0.00 H new ATOM 0 HB2 LYS A 39 0.699 5.206 -19.606 1.00 0.00 H new ATOM 0 HB3 LYS A 39 0.560 4.511 -18.003 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.629 5.733 -17.685 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -1.495 6.366 -19.314 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -1.360 3.965 -20.170 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -1.667 3.411 -18.536 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -3.519 5.324 -20.048 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -3.758 3.589 -19.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.048 4.502 -18.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -3.697 3.811 -17.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.782 5.493 -17.706 1.00 0.00 H new ATOM 289 N ASP A 40 0.973 5.932 -15.678 1.00 0.00 N ATOM 290 CA ASP A 40 0.612 5.985 -14.263 1.00 0.00 C ATOM 291 C ASP A 40 1.513 6.961 -13.517 1.00 0.00 C ATOM 292 O ASP A 40 1.163 7.450 -12.443 1.00 0.00 O ATOM 293 CB ASP A 40 0.733 4.595 -13.640 1.00 0.00 C ATOM 294 CG ASP A 40 -0.289 3.653 -14.269 1.00 0.00 C ATOM 295 OD1 ASP A 40 -1.231 4.147 -14.866 1.00 0.00 O ATOM 296 OD2 ASP A 40 -0.114 2.452 -14.145 1.00 0.00 O ATOM 0 H ASP A 40 1.637 5.197 -15.920 1.00 0.00 H new ATOM 0 HA ASP A 40 -0.419 6.328 -14.183 1.00 0.00 H new ATOM 0 HB2 ASP A 40 1.740 4.206 -13.791 1.00 0.00 H new ATOM 0 HB3 ASP A 40 0.572 4.654 -12.564 1.00 0.00 H new ATOM 301 N GLY A 41 2.670 7.248 -14.100 1.00 0.00 N ATOM 302 CA GLY A 41 3.611 8.175 -13.493 1.00 0.00 C ATOM 303 C GLY A 41 4.180 7.627 -12.190 1.00 0.00 C ATOM 304 O GLY A 41 4.295 8.358 -11.211 1.00 0.00 O ATOM 0 H GLY A 41 2.977 6.853 -14.989 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.425 8.376 -14.190 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.113 9.126 -13.302 1.00 0.00 H new ATOM 308 N TYR A 42 4.545 6.341 -12.175 1.00 0.00 N ATOM 309 CA TYR A 42 5.115 5.731 -10.968 1.00 0.00 C ATOM 310 C TYR A 42 6.226 4.747 -11.342 1.00 0.00 C ATOM 311 O TYR A 42 6.176 4.111 -12.394 1.00 0.00 O ATOM 312 CB TYR A 42 4.002 5.041 -10.150 1.00 0.00 C ATOM 313 CG TYR A 42 3.784 3.614 -10.613 1.00 0.00 C ATOM 314 CD1 TYR A 42 3.700 3.326 -11.979 1.00 0.00 C ATOM 315 CD2 TYR A 42 3.668 2.583 -9.672 1.00 0.00 C ATOM 316 CE1 TYR A 42 3.504 2.008 -12.405 1.00 0.00 C ATOM 317 CE2 TYR A 42 3.470 1.265 -10.098 1.00 0.00 C ATOM 318 CZ TYR A 42 3.389 0.977 -11.465 1.00 0.00 C ATOM 319 OH TYR A 42 3.197 -0.324 -11.884 1.00 0.00 O ATOM 0 H TYR A 42 4.458 5.710 -12.972 1.00 0.00 H new ATOM 0 HA TYR A 42 5.558 6.510 -10.347 1.00 0.00 H new ATOM 0 HB2 TYR A 42 4.268 5.046 -9.093 1.00 0.00 H new ATOM 0 HB3 TYR A 42 3.074 5.603 -10.248 1.00 0.00 H new ATOM 0 HD1 TYR A 42 3.786 4.121 -12.705 1.00 0.00 H new ATOM 0 HD2 TYR A 42 3.731 2.805 -8.617 1.00 0.00 H new ATOM 0 HE1 TYR A 42 3.441 1.786 -13.460 1.00 0.00 H new ATOM 0 HE2 TYR A 42 3.380 0.470 -9.372 1.00 0.00 H new ATOM 0 HH TYR A 42 3.921 -0.582 -12.492 1.00 0.00 H new ATOM 329 N GLU A 43 7.231 4.634 -10.473 1.00 0.00 N ATOM 330 CA GLU A 43 8.357 3.730 -10.722 1.00 0.00 C ATOM 331 C GLU A 43 8.913 3.174 -9.413 1.00 0.00 C ATOM 332 O GLU A 43 8.749 3.778 -8.354 1.00 0.00 O ATOM 333 CB GLU A 43 9.461 4.474 -11.477 1.00 0.00 C ATOM 334 CG GLU A 43 9.953 5.653 -10.634 1.00 0.00 C ATOM 335 CD GLU A 43 10.960 6.480 -11.428 1.00 0.00 C ATOM 336 OE1 GLU A 43 11.287 6.080 -12.534 1.00 0.00 O ATOM 337 OE2 GLU A 43 11.392 7.501 -10.918 1.00 0.00 O ATOM 0 H GLU A 43 7.290 5.152 -9.597 1.00 0.00 H new ATOM 0 HA GLU A 43 7.999 2.895 -11.325 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.288 3.797 -11.692 1.00 0.00 H new ATOM 0 HB3 GLU A 43 9.083 4.831 -12.435 1.00 0.00 H new ATOM 0 HG2 GLU A 43 9.109 6.277 -10.340 1.00 0.00 H new ATOM 0 HG3 GLU A 43 10.414 5.287 -9.717 1.00 0.00 H new ATOM 344 N PHE A 44 9.566 2.014 -9.494 1.00 0.00 N ATOM 345 CA PHE A 44 10.133 1.386 -8.302 1.00 0.00 C ATOM 346 C PHE A 44 10.975 0.163 -8.670 1.00 0.00 C ATOM 347 O PHE A 44 10.630 -0.590 -9.580 1.00 0.00 O ATOM 348 CB PHE A 44 8.992 0.977 -7.360 1.00 0.00 C ATOM 349 CG PHE A 44 9.511 0.079 -6.254 1.00 0.00 C ATOM 350 CD1 PHE A 44 10.281 0.614 -5.215 1.00 0.00 C ATOM 351 CD2 PHE A 44 9.214 -1.291 -6.270 1.00 0.00 C ATOM 352 CE1 PHE A 44 10.754 -0.220 -4.193 1.00 0.00 C ATOM 353 CE2 PHE A 44 9.688 -2.123 -5.249 1.00 0.00 C ATOM 354 CZ PHE A 44 10.457 -1.588 -4.210 1.00 0.00 C ATOM 0 H PHE A 44 9.714 1.497 -10.361 1.00 0.00 H new ATOM 0 HA PHE A 44 10.787 2.102 -7.804 1.00 0.00 H new ATOM 0 HB2 PHE A 44 8.533 1.866 -6.929 1.00 0.00 H new ATOM 0 HB3 PHE A 44 8.216 0.459 -7.923 1.00 0.00 H new ATOM 0 HD1 PHE A 44 10.511 1.669 -5.201 1.00 0.00 H new ATOM 0 HD2 PHE A 44 8.619 -1.705 -7.071 1.00 0.00 H new ATOM 0 HE1 PHE A 44 11.348 0.193 -3.391 1.00 0.00 H new ATOM 0 HE2 PHE A 44 9.460 -3.179 -5.263 1.00 0.00 H new ATOM 0 HZ PHE A 44 10.821 -2.230 -3.422 1.00 0.00 H new ATOM 364 N LEU A 45 12.073 -0.040 -7.935 1.00 0.00 N ATOM 365 CA LEU A 45 12.951 -1.191 -8.166 1.00 0.00 C ATOM 366 C LEU A 45 12.529 -2.346 -7.266 1.00 0.00 C ATOM 367 O LEU A 45 12.156 -2.138 -6.113 1.00 0.00 O ATOM 368 CB LEU A 45 14.425 -0.818 -7.884 1.00 0.00 C ATOM 369 CG LEU A 45 15.099 -0.268 -9.147 1.00 0.00 C ATOM 370 CD1 LEU A 45 14.479 1.075 -9.533 1.00 0.00 C ATOM 371 CD2 LEU A 45 16.596 -0.085 -8.882 1.00 0.00 C ATOM 0 H LEU A 45 12.374 0.575 -7.179 1.00 0.00 H new ATOM 0 HA LEU A 45 12.864 -1.492 -9.210 1.00 0.00 H new ATOM 0 HB2 LEU A 45 14.471 -0.074 -7.089 1.00 0.00 H new ATOM 0 HB3 LEU A 45 14.966 -1.696 -7.531 1.00 0.00 H new ATOM 0 HG LEU A 45 14.953 -0.972 -9.966 1.00 0.00 H new ATOM 0 HD11 LEU A 45 14.966 1.456 -10.431 1.00 0.00 H new ATOM 0 HD12 LEU A 45 13.414 0.942 -9.726 1.00 0.00 H new ATOM 0 HD13 LEU A 45 14.614 1.786 -8.718 1.00 0.00 H new ATOM 0 HD21 LEU A 45 17.079 0.306 -9.778 1.00 0.00 H new ATOM 0 HD22 LEU A 45 16.737 0.615 -8.059 1.00 0.00 H new ATOM 0 HD23 LEU A 45 17.039 -1.046 -8.621 1.00 0.00 H new ATOM 383 N TYR A 46 12.589 -3.565 -7.800 1.00 0.00 N ATOM 384 CA TYR A 46 12.206 -4.753 -7.035 1.00 0.00 C ATOM 385 C TYR A 46 13.250 -5.870 -7.209 1.00 0.00 C ATOM 386 O TYR A 46 13.768 -6.057 -8.310 1.00 0.00 O ATOM 387 CB TYR A 46 10.840 -5.246 -7.525 1.00 0.00 C ATOM 388 CG TYR A 46 10.912 -5.564 -9.004 1.00 0.00 C ATOM 389 CD1 TYR A 46 10.894 -4.529 -9.954 1.00 0.00 C ATOM 390 CD2 TYR A 46 10.991 -6.896 -9.425 1.00 0.00 C ATOM 391 CE1 TYR A 46 10.958 -4.834 -11.320 1.00 0.00 C ATOM 392 CE2 TYR A 46 11.054 -7.198 -10.790 1.00 0.00 C ATOM 393 CZ TYR A 46 11.037 -6.166 -11.736 1.00 0.00 C ATOM 394 OH TYR A 46 11.101 -6.466 -13.082 1.00 0.00 O ATOM 0 H TYR A 46 12.897 -3.757 -8.753 1.00 0.00 H new ATOM 0 HA TYR A 46 12.152 -4.492 -5.978 1.00 0.00 H new ATOM 0 HB2 TYR A 46 10.541 -6.133 -6.967 1.00 0.00 H new ATOM 0 HB3 TYR A 46 10.081 -4.485 -7.343 1.00 0.00 H new ATOM 0 HD1 TYR A 46 10.831 -3.500 -9.632 1.00 0.00 H new ATOM 0 HD2 TYR A 46 11.003 -7.692 -8.695 1.00 0.00 H new ATOM 0 HE1 TYR A 46 10.946 -4.040 -12.052 1.00 0.00 H new ATOM 0 HE2 TYR A 46 11.116 -8.227 -11.114 1.00 0.00 H new ATOM 0 HH TYR A 46 11.153 -7.438 -13.198 1.00 0.00 H new ATOM 404 N PRO A 47 13.572 -6.623 -6.169 1.00 0.00 N ATOM 405 CA PRO A 47 14.571 -7.732 -6.275 1.00 0.00 C ATOM 406 C PRO A 47 14.364 -8.588 -7.525 1.00 0.00 C ATOM 407 O PRO A 47 13.249 -8.707 -8.033 1.00 0.00 O ATOM 408 CB PRO A 47 14.329 -8.557 -5.006 1.00 0.00 C ATOM 409 CG PRO A 47 13.814 -7.579 -4.000 1.00 0.00 C ATOM 410 CD PRO A 47 13.044 -6.509 -4.789 1.00 0.00 C ATOM 0 HA PRO A 47 15.590 -7.354 -6.361 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.608 -9.355 -5.186 1.00 0.00 H new ATOM 0 HB3 PRO A 47 15.249 -9.030 -4.662 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.164 -8.072 -3.277 1.00 0.00 H new ATOM 0 HG3 PRO A 47 14.634 -7.132 -3.438 1.00 0.00 H new ATOM 0 HD2 PRO A 47 11.969 -6.688 -4.758 1.00 0.00 H new ATOM 0 HD3 PRO A 47 13.213 -5.513 -4.379 1.00 0.00 H new ATOM 418 N ASN A 48 15.449 -9.187 -8.009 1.00 0.00 N ATOM 419 CA ASN A 48 15.381 -10.040 -9.191 1.00 0.00 C ATOM 420 C ASN A 48 14.894 -11.435 -8.808 1.00 0.00 C ATOM 421 O ASN A 48 14.990 -11.838 -7.648 1.00 0.00 O ATOM 422 CB ASN A 48 16.761 -10.135 -9.846 1.00 0.00 C ATOM 423 CG ASN A 48 17.741 -10.852 -8.923 1.00 0.00 C ATOM 424 OD1 ASN A 48 17.343 -11.407 -7.899 1.00 0.00 O ATOM 425 ND2 ASN A 48 19.012 -10.867 -9.222 1.00 0.00 N ATOM 0 H ASN A 48 16.381 -9.098 -7.603 1.00 0.00 H new ATOM 0 HA ASN A 48 14.677 -9.602 -9.899 1.00 0.00 H new ATOM 0 HB2 ASN A 48 16.685 -10.671 -10.792 1.00 0.00 H new ATOM 0 HB3 ASN A 48 17.132 -9.136 -10.074 1.00 0.00 H new ATOM 0 HD21 ASN A 48 19.675 -11.339 -8.607 1.00 0.00 H new ATOM 0 HD22 ASN A 48 19.342 -10.407 -10.071 1.00 0.00 H new ATOM 432 N GLY A 49 14.373 -12.168 -9.787 1.00 0.00 N ATOM 433 CA GLY A 49 13.875 -13.520 -9.538 1.00 0.00 C ATOM 434 C GLY A 49 12.418 -13.489 -9.090 1.00 0.00 C ATOM 435 O GLY A 49 11.863 -14.508 -8.678 1.00 0.00 O ATOM 0 H GLY A 49 14.284 -11.854 -10.753 1.00 0.00 H new ATOM 0 HA2 GLY A 49 13.968 -14.119 -10.444 1.00 0.00 H new ATOM 0 HA3 GLY A 49 14.485 -14.001 -8.773 1.00 0.00 H new ATOM 439 N TRP A 50 11.801 -12.311 -9.175 1.00 0.00 N ATOM 440 CA TRP A 50 10.400 -12.148 -8.781 1.00 0.00 C ATOM 441 C TRP A 50 9.486 -12.300 -9.990 1.00 0.00 C ATOM 442 O TRP A 50 9.860 -11.960 -11.112 1.00 0.00 O ATOM 443 CB TRP A 50 10.183 -10.761 -8.159 1.00 0.00 C ATOM 444 CG TRP A 50 10.693 -10.733 -6.754 1.00 0.00 C ATOM 445 CD1 TRP A 50 11.585 -11.598 -6.219 1.00 0.00 C ATOM 446 CD2 TRP A 50 10.342 -9.800 -5.698 1.00 0.00 C ATOM 447 NE1 TRP A 50 11.803 -11.251 -4.897 1.00 0.00 N ATOM 448 CE2 TRP A 50 11.058 -10.146 -4.530 1.00 0.00 C ATOM 449 CE3 TRP A 50 9.478 -8.696 -5.648 1.00 0.00 C ATOM 450 CZ2 TRP A 50 10.918 -9.419 -3.347 1.00 0.00 C ATOM 451 CZ3 TRP A 50 9.334 -7.961 -4.464 1.00 0.00 C ATOM 452 CH2 TRP A 50 10.052 -8.321 -3.314 1.00 0.00 C ATOM 0 H TRP A 50 12.246 -11.457 -9.512 1.00 0.00 H new ATOM 0 HA TRP A 50 10.160 -12.919 -8.049 1.00 0.00 H new ATOM 0 HB2 TRP A 50 10.696 -10.005 -8.754 1.00 0.00 H new ATOM 0 HB3 TRP A 50 9.122 -10.512 -8.172 1.00 0.00 H new ATOM 0 HD1 TRP A 50 12.050 -12.423 -6.738 1.00 0.00 H new ATOM 0 HE1 TRP A 50 12.435 -11.749 -4.271 1.00 0.00 H new ATOM 0 HE3 TRP A 50 8.920 -8.411 -6.528 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 11.473 -9.702 -2.465 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 8.666 -7.112 -4.437 1.00 0.00 H new ATOM 0 HH2 TRP A 50 9.936 -7.751 -2.404 1.00 0.00 H new ATOM 463 N ILE A 51 8.275 -12.804 -9.750 1.00 0.00 N ATOM 464 CA ILE A 51 7.293 -12.993 -10.819 1.00 0.00 C ATOM 465 C ILE A 51 6.090 -12.082 -10.605 1.00 0.00 C ATOM 466 O ILE A 51 5.632 -11.889 -9.480 1.00 0.00 O ATOM 467 CB ILE A 51 6.837 -14.455 -10.857 1.00 0.00 C ATOM 468 CG1 ILE A 51 6.372 -14.895 -9.462 1.00 0.00 C ATOM 469 CG2 ILE A 51 8.004 -15.338 -11.307 1.00 0.00 C ATOM 470 CD1 ILE A 51 5.665 -16.250 -9.561 1.00 0.00 C ATOM 0 H ILE A 51 7.951 -13.089 -8.826 1.00 0.00 H new ATOM 0 HA ILE A 51 7.761 -12.737 -11.770 1.00 0.00 H new ATOM 0 HB ILE A 51 6.008 -14.555 -11.558 1.00 0.00 H new ATOM 0 HG12 ILE A 51 7.226 -14.967 -8.789 1.00 0.00 H new ATOM 0 HG13 ILE A 51 5.696 -14.151 -9.041 1.00 0.00 H new ATOM 0 HG21 ILE A 51 7.683 -16.379 -11.335 1.00 0.00 H new ATOM 0 HG22 ILE A 51 8.330 -15.032 -12.301 1.00 0.00 H new ATOM 0 HG23 ILE A 51 8.832 -15.232 -10.606 1.00 0.00 H new ATOM 0 HD11 ILE A 51 5.335 -16.562 -8.570 1.00 0.00 H new ATOM 0 HD12 ILE A 51 4.801 -16.162 -10.220 1.00 0.00 H new ATOM 0 HD13 ILE A 51 6.355 -16.992 -9.964 1.00 0.00 H new ATOM 482 N GLY A 52 5.582 -11.522 -11.699 1.00 0.00 N ATOM 483 CA GLY A 52 4.425 -10.633 -11.631 1.00 0.00 C ATOM 484 C GLY A 52 3.148 -11.411 -11.917 1.00 0.00 C ATOM 485 O GLY A 52 3.092 -12.202 -12.859 1.00 0.00 O ATOM 0 H GLY A 52 5.951 -11.667 -12.639 1.00 0.00 H new ATOM 0 HA2 GLY A 52 4.367 -10.174 -10.644 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.536 -9.824 -12.353 1.00 0.00 H new ATOM 489 N VAL A 53 2.122 -11.190 -11.097 1.00 0.00 N ATOM 490 CA VAL A 53 0.845 -11.886 -11.269 1.00 0.00 C ATOM 491 C VAL A 53 -0.226 -10.924 -11.767 1.00 0.00 C ATOM 492 O VAL A 53 -0.391 -9.826 -11.233 1.00 0.00 O ATOM 493 CB VAL A 53 0.400 -12.486 -9.936 1.00 0.00 C ATOM 494 CG1 VAL A 53 -0.828 -13.370 -10.156 1.00 0.00 C ATOM 495 CG2 VAL A 53 1.538 -13.325 -9.351 1.00 0.00 C ATOM 0 H VAL A 53 2.148 -10.540 -10.312 1.00 0.00 H new ATOM 0 HA VAL A 53 0.981 -12.679 -12.005 1.00 0.00 H new ATOM 0 HB VAL A 53 0.147 -11.684 -9.243 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.144 -13.797 -9.204 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -1.638 -12.771 -10.572 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.579 -14.173 -10.849 1.00 0.00 H new ATOM 0 HG21 VAL A 53 1.222 -13.754 -8.400 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.792 -14.127 -10.044 1.00 0.00 H new ATOM 0 HG23 VAL A 53 2.411 -12.693 -9.192 1.00 0.00 H new ATOM 505 N ASP A 54 -0.955 -11.349 -12.791 1.00 0.00 N ATOM 506 CA ASP A 54 -2.019 -10.528 -13.361 1.00 0.00 C ATOM 507 C ASP A 54 -3.306 -10.700 -12.563 1.00 0.00 C ATOM 508 O ASP A 54 -3.663 -11.812 -12.174 1.00 0.00 O ATOM 509 CB ASP A 54 -2.262 -10.923 -14.818 1.00 0.00 C ATOM 510 CG ASP A 54 -1.047 -10.561 -15.666 1.00 0.00 C ATOM 511 OD1 ASP A 54 -0.209 -9.820 -15.178 1.00 0.00 O ATOM 512 OD2 ASP A 54 -0.972 -11.030 -16.789 1.00 0.00 O ATOM 0 H ASP A 54 -0.831 -12.255 -13.244 1.00 0.00 H new ATOM 0 HA ASP A 54 -1.712 -9.483 -13.318 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -2.457 -11.993 -14.886 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -3.147 -10.413 -15.199 1.00 0.00 H new ATOM 517 N VAL A 55 -4.000 -9.590 -12.322 1.00 0.00 N ATOM 518 CA VAL A 55 -5.254 -9.618 -11.566 1.00 0.00 C ATOM 519 C VAL A 55 -6.280 -8.688 -12.205 1.00 0.00 C ATOM 520 O VAL A 55 -6.855 -7.828 -11.539 1.00 0.00 O ATOM 521 CB VAL A 55 -4.996 -9.189 -10.119 1.00 0.00 C ATOM 522 CG1 VAL A 55 -4.314 -10.329 -9.359 1.00 0.00 C ATOM 523 CG2 VAL A 55 -4.086 -7.960 -10.109 1.00 0.00 C ATOM 0 H VAL A 55 -3.718 -8.662 -12.637 1.00 0.00 H new ATOM 0 HA VAL A 55 -5.648 -10.634 -11.577 1.00 0.00 H new ATOM 0 HB VAL A 55 -5.944 -8.948 -9.639 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -4.131 -10.022 -8.329 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -4.959 -11.208 -9.366 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -3.366 -10.570 -9.839 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.901 -7.653 -9.080 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -3.139 -8.204 -10.591 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.568 -7.146 -10.650 1.00 0.00 H new ATOM 533 N LYS A 56 -6.506 -8.871 -13.503 1.00 0.00 N ATOM 534 CA LYS A 56 -7.466 -8.048 -14.225 1.00 0.00 C ATOM 535 C LYS A 56 -8.889 -8.428 -13.835 1.00 0.00 C ATOM 536 O LYS A 56 -9.234 -9.608 -13.762 1.00 0.00 O ATOM 537 CB LYS A 56 -7.268 -8.217 -15.736 1.00 0.00 C ATOM 538 CG LYS A 56 -7.616 -9.650 -16.150 1.00 0.00 C ATOM 539 CD LYS A 56 -7.245 -9.858 -17.621 1.00 0.00 C ATOM 540 CE LYS A 56 -7.848 -11.173 -18.119 1.00 0.00 C ATOM 541 NZ LYS A 56 -7.283 -12.306 -17.332 1.00 0.00 N ATOM 0 H LYS A 56 -6.040 -9.578 -14.072 1.00 0.00 H new ATOM 0 HA LYS A 56 -7.302 -7.003 -13.961 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -7.898 -7.510 -16.276 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -6.236 -7.992 -16.004 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -7.079 -10.362 -15.524 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -8.680 -9.835 -16.002 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -7.614 -9.026 -18.221 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -6.161 -9.877 -17.734 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -8.933 -11.150 -18.017 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -7.630 -11.307 -19.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -7.514 -13.204 -17.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -6.250 -12.204 -17.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -7.690 -12.301 -16.375 1.00 0.00 H new ATOM 555 N GLY A 57 -9.707 -7.416 -13.571 1.00 0.00 N ATOM 556 CA GLY A 57 -11.094 -7.641 -13.175 1.00 0.00 C ATOM 557 C GLY A 57 -11.190 -7.842 -11.667 1.00 0.00 C ATOM 558 O GLY A 57 -12.261 -8.132 -11.133 1.00 0.00 O ATOM 0 H GLY A 57 -9.436 -6.434 -13.623 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -11.707 -6.791 -13.475 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -11.489 -8.516 -13.691 1.00 0.00 H new ATOM 562 N ALA A 58 -10.058 -7.684 -10.987 1.00 0.00 N ATOM 563 CA ALA A 58 -10.007 -7.847 -9.539 1.00 0.00 C ATOM 564 C ALA A 58 -10.524 -6.595 -8.837 1.00 0.00 C ATOM 565 O ALA A 58 -11.176 -5.752 -9.454 1.00 0.00 O ATOM 566 CB ALA A 58 -8.570 -8.131 -9.098 1.00 0.00 C ATOM 0 H ALA A 58 -9.164 -7.443 -11.416 1.00 0.00 H new ATOM 0 HA ALA A 58 -10.644 -8.688 -9.264 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -8.539 -8.252 -8.015 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -8.217 -9.045 -9.575 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.929 -7.299 -9.389 1.00 0.00 H new ATOM 572 N SER A 59 -10.236 -6.481 -7.542 1.00 0.00 N ATOM 573 CA SER A 59 -10.684 -5.330 -6.767 1.00 0.00 C ATOM 574 C SER A 59 -10.436 -4.032 -7.540 1.00 0.00 C ATOM 575 O SER A 59 -9.525 -3.960 -8.364 1.00 0.00 O ATOM 576 CB SER A 59 -9.949 -5.301 -5.418 1.00 0.00 C ATOM 577 OG SER A 59 -10.714 -6.016 -4.457 1.00 0.00 O ATOM 0 H SER A 59 -9.698 -7.167 -7.012 1.00 0.00 H new ATOM 0 HA SER A 59 -11.756 -5.417 -6.588 1.00 0.00 H new ATOM 0 HB2 SER A 59 -8.960 -5.747 -5.519 1.00 0.00 H new ATOM 0 HB3 SER A 59 -9.802 -4.271 -5.092 1.00 0.00 H new ATOM 0 HG SER A 59 -10.250 -6.003 -3.594 1.00 0.00 H new ATOM 583 N PRO A 60 -11.229 -3.013 -7.298 1.00 0.00 N ATOM 584 CA PRO A 60 -11.081 -1.706 -8.000 1.00 0.00 C ATOM 585 C PRO A 60 -9.804 -0.984 -7.582 1.00 0.00 C ATOM 586 O PRO A 60 -9.500 -0.876 -6.394 1.00 0.00 O ATOM 587 CB PRO A 60 -12.335 -0.922 -7.579 1.00 0.00 C ATOM 588 CG PRO A 60 -12.729 -1.511 -6.263 1.00 0.00 C ATOM 589 CD PRO A 60 -12.342 -2.988 -6.332 1.00 0.00 C ATOM 0 HA PRO A 60 -10.999 -1.819 -9.081 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -12.124 0.143 -7.488 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -13.133 -1.027 -8.314 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -12.216 -1.011 -5.442 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -13.799 -1.395 -6.088 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -12.035 -3.367 -5.357 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -13.176 -3.605 -6.666 1.00 0.00 H new ATOM 597 N GLY A 61 -9.064 -0.489 -8.569 1.00 0.00 N ATOM 598 CA GLY A 61 -7.820 0.229 -8.306 1.00 0.00 C ATOM 599 C GLY A 61 -6.615 -0.697 -8.419 1.00 0.00 C ATOM 600 O GLY A 61 -5.513 -0.252 -8.738 1.00 0.00 O ATOM 0 H GLY A 61 -9.303 -0.571 -9.557 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -7.716 1.053 -9.012 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -7.853 0.667 -7.308 1.00 0.00 H new ATOM 604 N VAL A 62 -6.824 -1.987 -8.161 1.00 0.00 N ATOM 605 CA VAL A 62 -5.727 -2.947 -8.246 1.00 0.00 C ATOM 606 C VAL A 62 -5.159 -2.970 -9.663 1.00 0.00 C ATOM 607 O VAL A 62 -5.911 -3.004 -10.637 1.00 0.00 O ATOM 608 CB VAL A 62 -6.221 -4.343 -7.862 1.00 0.00 C ATOM 609 CG1 VAL A 62 -5.075 -5.344 -8.019 1.00 0.00 C ATOM 610 CG2 VAL A 62 -6.694 -4.336 -6.403 1.00 0.00 C ATOM 0 H VAL A 62 -7.725 -2.385 -7.896 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.941 -2.645 -7.554 1.00 0.00 H new ATOM 0 HB VAL A 62 -7.050 -4.628 -8.510 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.422 -6.341 -7.746 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.735 -5.349 -9.055 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.249 -5.057 -7.368 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.046 -5.331 -6.130 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.866 -4.053 -5.753 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -7.507 -3.619 -6.288 1.00 0.00 H new ATOM 620 N ASP A 63 -3.827 -2.935 -9.775 1.00 0.00 N ATOM 621 CA ASP A 63 -3.169 -2.938 -11.089 1.00 0.00 C ATOM 622 C ASP A 63 -2.329 -4.198 -11.296 1.00 0.00 C ATOM 623 O ASP A 63 -2.552 -4.946 -12.247 1.00 0.00 O ATOM 624 CB ASP A 63 -2.262 -1.711 -11.203 1.00 0.00 C ATOM 625 CG ASP A 63 -1.623 -1.660 -12.587 1.00 0.00 C ATOM 626 OD1 ASP A 63 -2.074 -2.389 -13.454 1.00 0.00 O ATOM 627 OD2 ASP A 63 -0.692 -0.889 -12.760 1.00 0.00 O ATOM 0 H ASP A 63 -3.187 -2.905 -8.981 1.00 0.00 H new ATOM 0 HA ASP A 63 -3.945 -2.915 -11.854 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -2.840 -0.804 -11.027 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.487 -1.749 -10.437 1.00 0.00 H new ATOM 632 N VAL A 64 -1.357 -4.424 -10.411 1.00 0.00 N ATOM 633 CA VAL A 64 -0.485 -5.599 -10.527 1.00 0.00 C ATOM 634 C VAL A 64 -0.008 -6.079 -9.160 1.00 0.00 C ATOM 635 O VAL A 64 0.201 -5.283 -8.245 1.00 0.00 O ATOM 636 CB VAL A 64 0.728 -5.268 -11.397 1.00 0.00 C ATOM 637 CG1 VAL A 64 1.630 -6.500 -11.502 1.00 0.00 C ATOM 638 CG2 VAL A 64 0.259 -4.865 -12.796 1.00 0.00 C ATOM 0 H VAL A 64 -1.153 -3.819 -9.615 1.00 0.00 H new ATOM 0 HA VAL A 64 -1.067 -6.397 -10.989 1.00 0.00 H new ATOM 0 HB VAL A 64 1.283 -4.445 -10.947 1.00 0.00 H new ATOM 0 HG11 VAL A 64 2.495 -6.266 -12.122 1.00 0.00 H new ATOM 0 HG12 VAL A 64 1.965 -6.792 -10.507 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.073 -7.322 -11.952 1.00 0.00 H new ATOM 0 HG21 VAL A 64 1.124 -4.629 -13.416 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.295 -5.689 -13.245 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -0.386 -3.989 -12.725 1.00 0.00 H new ATOM 648 N VAL A 65 0.177 -7.392 -9.035 1.00 0.00 N ATOM 649 CA VAL A 65 0.651 -7.992 -7.783 1.00 0.00 C ATOM 650 C VAL A 65 1.991 -8.690 -8.008 1.00 0.00 C ATOM 651 O VAL A 65 2.167 -9.412 -8.989 1.00 0.00 O ATOM 652 CB VAL A 65 -0.375 -9.004 -7.270 1.00 0.00 C ATOM 653 CG1 VAL A 65 0.114 -9.602 -5.950 1.00 0.00 C ATOM 654 CG2 VAL A 65 -1.714 -8.297 -7.042 1.00 0.00 C ATOM 0 H VAL A 65 0.007 -8.063 -9.784 1.00 0.00 H new ATOM 0 HA VAL A 65 0.781 -7.203 -7.043 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.501 -9.799 -8.005 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.617 -10.323 -5.584 1.00 0.00 H new ATOM 0 HG12 VAL A 65 1.069 -10.102 -6.109 1.00 0.00 H new ATOM 0 HG13 VAL A 65 0.239 -8.807 -5.215 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -2.447 -9.016 -6.676 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.586 -7.503 -6.306 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -2.063 -7.868 -7.981 1.00 0.00 H new ATOM 664 N PHE A 66 2.933 -8.466 -7.091 1.00 0.00 N ATOM 665 CA PHE A 66 4.266 -9.072 -7.184 1.00 0.00 C ATOM 666 C PHE A 66 4.466 -10.091 -6.067 1.00 0.00 C ATOM 667 O PHE A 66 4.086 -9.850 -4.921 1.00 0.00 O ATOM 668 CB PHE A 66 5.339 -7.987 -7.067 1.00 0.00 C ATOM 669 CG PHE A 66 5.274 -7.070 -8.265 1.00 0.00 C ATOM 670 CD1 PHE A 66 4.350 -6.020 -8.293 1.00 0.00 C ATOM 671 CD2 PHE A 66 6.136 -7.276 -9.348 1.00 0.00 C ATOM 672 CE1 PHE A 66 4.288 -5.173 -9.406 1.00 0.00 C ATOM 673 CE2 PHE A 66 6.074 -6.429 -10.461 1.00 0.00 C ATOM 674 CZ PHE A 66 5.150 -5.377 -10.490 1.00 0.00 C ATOM 0 H PHE A 66 2.800 -7.870 -6.274 1.00 0.00 H new ATOM 0 HA PHE A 66 4.350 -9.574 -8.148 1.00 0.00 H new ATOM 0 HB2 PHE A 66 5.192 -7.415 -6.151 1.00 0.00 H new ATOM 0 HB3 PHE A 66 6.326 -8.445 -7.001 1.00 0.00 H new ATOM 0 HD1 PHE A 66 3.685 -5.863 -7.457 1.00 0.00 H new ATOM 0 HD2 PHE A 66 6.848 -8.087 -9.325 1.00 0.00 H new ATOM 0 HE1 PHE A 66 3.575 -4.362 -9.428 1.00 0.00 H new ATOM 0 HE2 PHE A 66 6.739 -6.587 -11.297 1.00 0.00 H new ATOM 0 HZ PHE A 66 5.102 -4.723 -11.348 1.00 0.00 H new ATOM 684 N ARG A 67 5.070 -11.231 -6.406 1.00 0.00 N ATOM 685 CA ARG A 67 5.325 -12.287 -5.422 1.00 0.00 C ATOM 686 C ARG A 67 6.785 -12.721 -5.470 1.00 0.00 C ATOM 687 O ARG A 67 7.340 -12.953 -6.544 1.00 0.00 O ATOM 688 CB ARG A 67 4.421 -13.488 -5.706 1.00 0.00 C ATOM 689 CG ARG A 67 2.961 -13.086 -5.489 1.00 0.00 C ATOM 690 CD ARG A 67 2.062 -14.311 -5.660 1.00 0.00 C ATOM 691 NE ARG A 67 0.658 -13.912 -5.657 1.00 0.00 N ATOM 692 CZ ARG A 67 0.018 -13.663 -4.520 1.00 0.00 C ATOM 693 NH1 ARG A 67 0.644 -13.771 -3.381 1.00 0.00 N ATOM 694 NH2 ARG A 67 -1.238 -13.308 -4.543 1.00 0.00 N ATOM 0 H ARG A 67 5.391 -11.447 -7.350 1.00 0.00 H new ATOM 0 HA ARG A 67 5.109 -11.896 -4.428 1.00 0.00 H new ATOM 0 HB2 ARG A 67 4.567 -13.833 -6.730 1.00 0.00 H new ATOM 0 HB3 ARG A 67 4.683 -14.318 -5.050 1.00 0.00 H new ATOM 0 HG2 ARG A 67 2.833 -12.665 -4.492 1.00 0.00 H new ATOM 0 HG3 ARG A 67 2.677 -12.311 -6.201 1.00 0.00 H new ATOM 0 HD2 ARG A 67 2.301 -14.819 -6.594 1.00 0.00 H new ATOM 0 HD3 ARG A 67 2.247 -15.022 -4.855 1.00 0.00 H new ATOM 0 HE ARG A 67 0.160 -13.823 -6.543 1.00 0.00 H new ATOM 0 HH11 ARG A 67 1.626 -14.047 -3.363 1.00 0.00 H new ATOM 0 HH12 ARG A 67 0.152 -13.580 -2.508 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -1.727 -13.222 -5.434 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -1.730 -13.117 -3.670 1.00 0.00 H new ATOM 708 N ASP A 68 7.401 -12.835 -4.295 1.00 0.00 N ATOM 709 CA ASP A 68 8.799 -13.248 -4.204 1.00 0.00 C ATOM 710 C ASP A 68 8.902 -14.768 -4.135 1.00 0.00 C ATOM 711 O ASP A 68 8.383 -15.392 -3.212 1.00 0.00 O ATOM 712 CB ASP A 68 9.440 -12.634 -2.957 1.00 0.00 C ATOM 713 CG ASP A 68 10.930 -12.956 -2.924 1.00 0.00 C ATOM 714 OD1 ASP A 68 11.416 -13.520 -3.891 1.00 0.00 O ATOM 715 OD2 ASP A 68 11.563 -12.635 -1.932 1.00 0.00 O ATOM 0 H ASP A 68 6.956 -12.648 -3.396 1.00 0.00 H new ATOM 0 HA ASP A 68 9.324 -12.899 -5.093 1.00 0.00 H new ATOM 0 HB2 ASP A 68 9.293 -11.554 -2.957 1.00 0.00 H new ATOM 0 HB3 ASP A 68 8.956 -13.022 -2.061 1.00 0.00 H new ATOM 720 N LEU A 69 9.573 -15.359 -5.118 1.00 0.00 N ATOM 721 CA LEU A 69 9.730 -16.809 -5.153 1.00 0.00 C ATOM 722 C LEU A 69 10.463 -17.303 -3.910 1.00 0.00 C ATOM 723 O LEU A 69 10.144 -18.366 -3.374 1.00 0.00 O ATOM 724 CB LEU A 69 10.517 -17.224 -6.400 1.00 0.00 C ATOM 725 CG LEU A 69 9.838 -16.684 -7.665 1.00 0.00 C ATOM 726 CD1 LEU A 69 10.626 -17.158 -8.891 1.00 0.00 C ATOM 727 CD2 LEU A 69 8.392 -17.201 -7.752 1.00 0.00 C ATOM 0 H LEU A 69 10.013 -14.863 -5.893 1.00 0.00 H new ATOM 0 HA LEU A 69 8.736 -17.256 -5.181 1.00 0.00 H new ATOM 0 HB2 LEU A 69 11.537 -16.845 -6.337 1.00 0.00 H new ATOM 0 HB3 LEU A 69 10.583 -18.311 -6.451 1.00 0.00 H new ATOM 0 HG LEU A 69 9.820 -15.595 -7.630 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.152 -16.780 -9.797 1.00 0.00 H new ATOM 0 HD12 LEU A 69 11.648 -16.784 -8.833 1.00 0.00 H new ATOM 0 HD13 LEU A 69 10.639 -18.248 -8.916 1.00 0.00 H new ATOM 0 HD21 LEU A 69 7.920 -16.811 -8.654 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.397 -18.290 -7.787 1.00 0.00 H new ATOM 0 HD23 LEU A 69 7.833 -16.868 -6.877 1.00 0.00 H new ATOM 739 N ILE A 70 11.450 -16.535 -3.456 1.00 0.00 N ATOM 740 CA ILE A 70 12.215 -16.923 -2.277 1.00 0.00 C ATOM 741 C ILE A 70 11.341 -16.884 -1.026 1.00 0.00 C ATOM 742 O ILE A 70 11.414 -17.777 -0.184 1.00 0.00 O ATOM 743 CB ILE A 70 13.426 -15.998 -2.086 1.00 0.00 C ATOM 744 CG1 ILE A 70 14.382 -16.109 -3.297 1.00 0.00 C ATOM 745 CG2 ILE A 70 14.171 -16.421 -0.812 1.00 0.00 C ATOM 746 CD1 ILE A 70 13.934 -15.180 -4.437 1.00 0.00 C ATOM 0 H ILE A 70 11.735 -15.652 -3.880 1.00 0.00 H new ATOM 0 HA ILE A 70 12.567 -17.943 -2.431 1.00 0.00 H new ATOM 0 HB ILE A 70 13.084 -14.966 -2.002 1.00 0.00 H new ATOM 0 HG12 ILE A 70 15.396 -15.852 -2.990 1.00 0.00 H new ATOM 0 HG13 ILE A 70 14.408 -17.139 -3.651 1.00 0.00 H new ATOM 0 HG21 ILE A 70 15.034 -15.773 -0.663 1.00 0.00 H new ATOM 0 HG22 ILE A 70 13.503 -16.338 0.045 1.00 0.00 H new ATOM 0 HG23 ILE A 70 14.506 -17.453 -0.912 1.00 0.00 H new ATOM 0 HD11 ILE A 70 14.622 -15.276 -5.277 1.00 0.00 H new ATOM 0 HD12 ILE A 70 12.929 -15.456 -4.758 1.00 0.00 H new ATOM 0 HD13 ILE A 70 13.932 -14.148 -4.086 1.00 0.00 H new ATOM 758 N GLU A 71 10.515 -15.840 -0.909 1.00 0.00 N ATOM 759 CA GLU A 71 9.628 -15.688 0.249 1.00 0.00 C ATOM 760 C GLU A 71 8.174 -15.624 -0.194 1.00 0.00 C ATOM 761 O GLU A 71 7.795 -14.780 -1.006 1.00 0.00 O ATOM 762 CB GLU A 71 9.976 -14.406 1.008 1.00 0.00 C ATOM 763 CG GLU A 71 11.437 -14.453 1.456 1.00 0.00 C ATOM 764 CD GLU A 71 11.759 -13.232 2.312 1.00 0.00 C ATOM 765 OE1 GLU A 71 10.924 -12.347 2.383 1.00 0.00 O ATOM 766 OE2 GLU A 71 12.837 -13.203 2.881 1.00 0.00 O ATOM 0 H GLU A 71 10.442 -15.091 -1.598 1.00 0.00 H new ATOM 0 HA GLU A 71 9.765 -16.552 0.900 1.00 0.00 H new ATOM 0 HB2 GLU A 71 9.809 -13.538 0.371 1.00 0.00 H new ATOM 0 HB3 GLU A 71 9.323 -14.296 1.874 1.00 0.00 H new ATOM 0 HG2 GLU A 71 11.623 -15.365 2.024 1.00 0.00 H new ATOM 0 HG3 GLU A 71 12.092 -14.480 0.585 1.00 0.00 H new ATOM 773 N ARG A 72 7.358 -16.518 0.355 1.00 0.00 N ATOM 774 CA ARG A 72 5.936 -16.556 0.024 1.00 0.00 C ATOM 775 C ARG A 72 5.150 -15.610 0.928 1.00 0.00 C ATOM 776 O ARG A 72 4.222 -14.936 0.482 1.00 0.00 O ATOM 777 CB ARG A 72 5.400 -17.982 0.181 1.00 0.00 C ATOM 778 CG ARG A 72 5.547 -18.432 1.636 1.00 0.00 C ATOM 779 CD ARG A 72 5.233 -19.925 1.741 1.00 0.00 C ATOM 780 NE ARG A 72 3.877 -20.189 1.273 1.00 0.00 N ATOM 781 CZ ARG A 72 3.484 -21.421 0.964 1.00 0.00 C ATOM 782 NH1 ARG A 72 4.317 -22.420 1.075 1.00 0.00 N ATOM 783 NH2 ARG A 72 2.264 -21.632 0.551 1.00 0.00 N ATOM 0 H ARG A 72 7.655 -17.224 1.029 1.00 0.00 H new ATOM 0 HA ARG A 72 5.814 -16.236 -1.011 1.00 0.00 H new ATOM 0 HB2 ARG A 72 4.353 -18.022 -0.118 1.00 0.00 H new ATOM 0 HB3 ARG A 72 5.945 -18.660 -0.476 1.00 0.00 H new ATOM 0 HG2 ARG A 72 6.560 -18.237 1.988 1.00 0.00 H new ATOM 0 HG3 ARG A 72 4.872 -17.862 2.274 1.00 0.00 H new ATOM 0 HD2 ARG A 72 5.948 -20.497 1.149 1.00 0.00 H new ATOM 0 HD3 ARG A 72 5.339 -20.255 2.775 1.00 0.00 H new ATOM 0 HE ARG A 72 3.219 -19.415 1.181 1.00 0.00 H new ATOM 0 HH11 ARG A 72 5.270 -22.256 1.399 1.00 0.00 H new ATOM 0 HH12 ARG A 72 4.015 -23.365 0.838 1.00 0.00 H new ATOM 0 HH21 ARG A 72 1.612 -20.852 0.465 1.00 0.00 H new ATOM 0 HH22 ARG A 72 1.962 -22.577 0.314 1.00 0.00 H new ATOM 797 N ASP A 73 5.526 -15.571 2.203 1.00 0.00 N ATOM 798 CA ASP A 73 4.851 -14.709 3.168 1.00 0.00 C ATOM 799 C ASP A 73 4.940 -13.246 2.749 1.00 0.00 C ATOM 800 O ASP A 73 3.998 -12.479 2.941 1.00 0.00 O ATOM 801 CB ASP A 73 5.480 -14.884 4.551 1.00 0.00 C ATOM 802 CG ASP A 73 5.199 -16.286 5.078 1.00 0.00 C ATOM 803 OD1 ASP A 73 4.362 -16.959 4.500 1.00 0.00 O ATOM 804 OD2 ASP A 73 5.826 -16.668 6.053 1.00 0.00 O ATOM 0 H ASP A 73 6.291 -16.123 2.591 1.00 0.00 H new ATOM 0 HA ASP A 73 3.800 -14.996 3.204 1.00 0.00 H new ATOM 0 HB2 ASP A 73 6.556 -14.717 4.494 1.00 0.00 H new ATOM 0 HB3 ASP A 73 5.078 -14.141 5.239 1.00 0.00 H new ATOM 809 N GLU A 74 6.080 -12.863 2.180 1.00 0.00 N ATOM 810 CA GLU A 74 6.278 -11.482 1.744 1.00 0.00 C ATOM 811 C GLU A 74 5.710 -11.280 0.345 1.00 0.00 C ATOM 812 O GLU A 74 5.962 -12.079 -0.558 1.00 0.00 O ATOM 813 CB GLU A 74 7.772 -11.148 1.742 1.00 0.00 C ATOM 814 CG GLU A 74 7.968 -9.655 1.466 1.00 0.00 C ATOM 815 CD GLU A 74 9.456 -9.332 1.379 1.00 0.00 C ATOM 816 OE1 GLU A 74 10.250 -10.249 1.507 1.00 0.00 O ATOM 817 OE2 GLU A 74 9.780 -8.171 1.185 1.00 0.00 O ATOM 0 H GLU A 74 6.873 -13.481 2.011 1.00 0.00 H new ATOM 0 HA GLU A 74 5.757 -10.820 2.436 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.214 -11.411 2.703 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.285 -11.738 0.983 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.473 -9.381 0.534 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.505 -9.066 2.258 1.00 0.00 H new ATOM 824 N ASN A 75 4.945 -10.206 0.171 1.00 0.00 N ATOM 825 CA ASN A 75 4.349 -9.907 -1.128 1.00 0.00 C ATOM 826 C ASN A 75 4.050 -8.416 -1.261 1.00 0.00 C ATOM 827 O ASN A 75 3.575 -7.780 -0.320 1.00 0.00 O ATOM 828 CB ASN A 75 3.056 -10.711 -1.298 1.00 0.00 C ATOM 829 CG ASN A 75 2.128 -10.468 -0.111 1.00 0.00 C ATOM 830 OD1 ASN A 75 1.229 -9.629 -0.185 1.00 0.00 O ATOM 831 ND2 ASN A 75 2.291 -11.158 0.987 1.00 0.00 N ATOM 0 H ASN A 75 4.724 -9.534 0.906 1.00 0.00 H new ATOM 0 HA ASN A 75 5.060 -10.185 -1.906 1.00 0.00 H new ATOM 0 HB2 ASN A 75 2.558 -10.423 -2.224 1.00 0.00 H new ATOM 0 HB3 ASN A 75 3.287 -11.773 -1.378 1.00 0.00 H new ATOM 0 HD21 ASN A 75 1.673 -11.002 1.784 1.00 0.00 H new ATOM 0 HD22 ASN A 75 3.036 -11.852 1.047 1.00 0.00 H new ATOM 838 N LEU A 76 4.329 -7.868 -2.444 1.00 0.00 N ATOM 839 CA LEU A 76 4.090 -6.448 -2.721 1.00 0.00 C ATOM 840 C LEU A 76 2.978 -6.297 -3.750 1.00 0.00 C ATOM 841 O LEU A 76 2.977 -6.971 -4.780 1.00 0.00 O ATOM 842 CB LEU A 76 5.384 -5.809 -3.251 1.00 0.00 C ATOM 843 CG LEU A 76 5.231 -4.273 -3.393 1.00 0.00 C ATOM 844 CD1 LEU A 76 6.611 -3.612 -3.276 1.00 0.00 C ATOM 845 CD2 LEU A 76 4.609 -3.896 -4.758 1.00 0.00 C ATOM 0 H LEU A 76 4.722 -8.387 -3.229 1.00 0.00 H new ATOM 0 HA LEU A 76 3.787 -5.947 -1.802 1.00 0.00 H new ATOM 0 HB2 LEU A 76 6.208 -6.034 -2.574 1.00 0.00 H new ATOM 0 HB3 LEU A 76 5.638 -6.243 -4.218 1.00 0.00 H new ATOM 0 HG LEU A 76 4.570 -3.922 -2.600 1.00 0.00 H new ATOM 0 HD11 LEU A 76 6.507 -2.532 -3.376 1.00 0.00 H new ATOM 0 HD12 LEU A 76 7.046 -3.847 -2.304 1.00 0.00 H new ATOM 0 HD13 LEU A 76 7.262 -3.988 -4.065 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.514 -2.812 -4.828 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.250 -4.257 -5.562 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.623 -4.353 -4.847 1.00 0.00 H new ATOM 857 N SER A 77 2.036 -5.397 -3.469 1.00 0.00 N ATOM 858 CA SER A 77 0.917 -5.143 -4.378 1.00 0.00 C ATOM 859 C SER A 77 0.801 -3.649 -4.658 1.00 0.00 C ATOM 860 O SER A 77 1.099 -2.825 -3.793 1.00 0.00 O ATOM 861 CB SER A 77 -0.385 -5.650 -3.758 1.00 0.00 C ATOM 862 OG SER A 77 -0.271 -7.043 -3.500 1.00 0.00 O ATOM 0 H SER A 77 2.025 -4.832 -2.620 1.00 0.00 H new ATOM 0 HA SER A 77 1.099 -5.671 -5.314 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.594 -5.113 -2.833 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.220 -5.460 -4.432 1.00 0.00 H new ATOM 0 HG SER A 77 -1.104 -7.371 -3.101 1.00 0.00 H new ATOM 868 N VAL A 78 0.368 -3.303 -5.871 1.00 0.00 N ATOM 869 CA VAL A 78 0.215 -1.898 -6.260 1.00 0.00 C ATOM 870 C VAL A 78 -1.211 -1.623 -6.732 1.00 0.00 C ATOM 871 O VAL A 78 -1.762 -2.357 -7.552 1.00 0.00 O ATOM 872 CB VAL A 78 1.208 -1.558 -7.383 1.00 0.00 C ATOM 873 CG1 VAL A 78 2.610 -1.391 -6.794 1.00 0.00 C ATOM 874 CG2 VAL A 78 1.226 -2.693 -8.411 1.00 0.00 C ATOM 0 H VAL A 78 0.118 -3.972 -6.599 1.00 0.00 H new ATOM 0 HA VAL A 78 0.421 -1.273 -5.391 1.00 0.00 H new ATOM 0 HB VAL A 78 0.901 -0.630 -7.866 1.00 0.00 H new ATOM 0 HG11 VAL A 78 3.313 -1.150 -7.591 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.603 -0.585 -6.060 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.914 -2.319 -6.310 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.930 -2.452 -9.207 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.532 -3.619 -7.925 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.229 -2.817 -8.834 1.00 0.00 H new ATOM 884 N ILE A 79 -1.798 -0.551 -6.200 1.00 0.00 N ATOM 885 CA ILE A 79 -3.162 -0.155 -6.557 1.00 0.00 C ATOM 886 C ILE A 79 -3.144 1.237 -7.178 1.00 0.00 C ATOM 887 O ILE A 79 -2.641 2.187 -6.578 1.00 0.00 O ATOM 888 CB ILE A 79 -4.039 -0.154 -5.295 1.00 0.00 C ATOM 889 CG1 ILE A 79 -3.897 -1.505 -4.582 1.00 0.00 C ATOM 890 CG2 ILE A 79 -5.517 0.078 -5.664 1.00 0.00 C ATOM 891 CD1 ILE A 79 -4.664 -1.470 -3.259 1.00 0.00 C ATOM 0 H ILE A 79 -1.349 0.061 -5.518 1.00 0.00 H new ATOM 0 HA ILE A 79 -3.571 -0.862 -7.279 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.713 0.652 -4.638 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.281 -2.304 -5.216 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.845 -1.722 -4.398 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -6.123 0.076 -4.758 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.620 1.040 -6.167 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.855 -0.717 -6.329 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -4.562 -2.430 -2.754 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.259 -0.682 -2.625 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -5.718 -1.273 -3.455 1.00 0.00 H new ATOM 903 N ILE A 80 -3.687 1.350 -8.390 1.00 0.00 N ATOM 904 CA ILE A 80 -3.723 2.631 -9.101 1.00 0.00 C ATOM 905 C ILE A 80 -5.161 3.056 -9.378 1.00 0.00 C ATOM 906 O ILE A 80 -5.953 2.293 -9.930 1.00 0.00 O ATOM 907 CB ILE A 80 -2.962 2.498 -10.418 1.00 0.00 C ATOM 908 CG1 ILE A 80 -1.544 2.004 -10.118 1.00 0.00 C ATOM 909 CG2 ILE A 80 -2.893 3.862 -11.112 1.00 0.00 C ATOM 910 CD1 ILE A 80 -0.795 1.763 -11.426 1.00 0.00 C ATOM 0 H ILE A 80 -4.107 0.573 -8.900 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.254 3.392 -8.477 1.00 0.00 H new ATOM 0 HB ILE A 80 -3.472 1.791 -11.072 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -1.013 2.739 -9.514 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.585 1.083 -9.536 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -2.349 3.765 -12.052 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.903 4.220 -11.312 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.377 4.573 -10.466 1.00 0.00 H new ATOM 0 HD11 ILE A 80 0.214 1.412 -11.208 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.322 1.012 -12.014 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -0.741 2.694 -11.991 1.00 0.00 H new ATOM 922 N SER A 81 -5.486 4.288 -8.995 1.00 0.00 N ATOM 923 CA SER A 81 -6.828 4.831 -9.202 1.00 0.00 C ATOM 924 C SER A 81 -6.755 6.340 -9.409 1.00 0.00 C ATOM 925 O SER A 81 -5.726 6.958 -9.142 1.00 0.00 O ATOM 926 CB SER A 81 -7.713 4.517 -7.995 1.00 0.00 C ATOM 927 OG SER A 81 -7.893 3.110 -7.899 1.00 0.00 O ATOM 0 H SER A 81 -4.838 4.931 -8.539 1.00 0.00 H new ATOM 0 HA SER A 81 -7.260 4.370 -10.090 1.00 0.00 H new ATOM 0 HB2 SER A 81 -7.254 4.900 -7.083 1.00 0.00 H new ATOM 0 HB3 SER A 81 -8.678 5.013 -8.098 1.00 0.00 H new ATOM 0 HG SER A 81 -8.686 2.846 -8.411 1.00 0.00 H new ATOM 933 N GLU A 82 -7.850 6.932 -9.885 1.00 0.00 N ATOM 934 CA GLU A 82 -7.898 8.377 -10.122 1.00 0.00 C ATOM 935 C GLU A 82 -8.711 9.060 -9.028 1.00 0.00 C ATOM 936 O GLU A 82 -9.767 8.569 -8.631 1.00 0.00 O ATOM 937 CB GLU A 82 -8.541 8.657 -11.483 1.00 0.00 C ATOM 938 CG GLU A 82 -7.709 7.999 -12.592 1.00 0.00 C ATOM 939 CD GLU A 82 -7.989 6.498 -12.649 1.00 0.00 C ATOM 940 OE1 GLU A 82 -8.989 6.077 -12.090 1.00 0.00 O ATOM 941 OE2 GLU A 82 -7.196 5.793 -13.250 1.00 0.00 O ATOM 0 H GLU A 82 -8.712 6.438 -10.114 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.881 8.770 -10.111 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.560 8.270 -11.501 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.605 9.732 -11.652 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.946 8.456 -13.553 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.648 8.171 -12.410 1.00 0.00 H new ATOM 948 N ILE A 83 -8.212 10.194 -8.539 1.00 0.00 N ATOM 949 CA ILE A 83 -8.898 10.936 -7.485 1.00 0.00 C ATOM 950 C ILE A 83 -9.824 11.994 -8.093 1.00 0.00 C ATOM 951 O ILE A 83 -9.532 12.526 -9.165 1.00 0.00 O ATOM 952 CB ILE A 83 -7.864 11.609 -6.574 1.00 0.00 C ATOM 953 CG1 ILE A 83 -7.155 12.745 -7.324 1.00 0.00 C ATOM 954 CG2 ILE A 83 -6.829 10.573 -6.136 1.00 0.00 C ATOM 955 CD1 ILE A 83 -6.014 13.282 -6.459 1.00 0.00 C ATOM 0 H ILE A 83 -7.339 10.617 -8.855 1.00 0.00 H new ATOM 0 HA ILE A 83 -9.501 10.242 -6.899 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.373 12.021 -5.703 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.766 12.382 -8.275 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.861 13.543 -7.552 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -6.092 11.047 -5.488 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.326 9.769 -5.593 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -6.330 10.163 -7.014 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -5.506 14.089 -6.987 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -6.417 13.659 -5.519 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -5.305 12.480 -6.254 1.00 0.00 H new ATOM 967 N PRO A 84 -10.918 12.326 -7.442 1.00 0.00 N ATOM 968 CA PRO A 84 -11.854 13.356 -7.964 1.00 0.00 C ATOM 969 C PRO A 84 -11.117 14.592 -8.461 1.00 0.00 C ATOM 970 O PRO A 84 -10.197 15.088 -7.810 1.00 0.00 O ATOM 971 CB PRO A 84 -12.734 13.712 -6.759 1.00 0.00 C ATOM 972 CG PRO A 84 -12.687 12.519 -5.857 1.00 0.00 C ATOM 973 CD PRO A 84 -11.383 11.757 -6.167 1.00 0.00 C ATOM 0 HA PRO A 84 -12.423 12.986 -8.817 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -12.361 14.602 -6.251 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -13.756 13.927 -7.071 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -12.712 12.827 -4.812 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -13.554 11.879 -6.022 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -10.645 11.896 -5.377 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -11.560 10.685 -6.252 1.00 0.00 H new ATOM 981 N SER A 85 -11.544 15.089 -9.604 1.00 0.00 N ATOM 982 CA SER A 85 -10.939 16.279 -10.178 1.00 0.00 C ATOM 983 C SER A 85 -11.200 17.490 -9.288 1.00 0.00 C ATOM 984 O SER A 85 -10.436 18.455 -9.297 1.00 0.00 O ATOM 985 CB SER A 85 -11.516 16.538 -11.568 1.00 0.00 C ATOM 986 OG SER A 85 -10.793 17.593 -12.188 1.00 0.00 O ATOM 0 H SER A 85 -12.305 14.691 -10.154 1.00 0.00 H new ATOM 0 HA SER A 85 -9.864 16.118 -10.254 1.00 0.00 H new ATOM 0 HB2 SER A 85 -11.454 15.634 -12.174 1.00 0.00 H new ATOM 0 HB3 SER A 85 -12.571 16.800 -11.493 1.00 0.00 H new ATOM 0 HG SER A 85 -11.160 17.760 -13.081 1.00 0.00 H new ATOM 992 N ASP A 86 -12.304 17.444 -8.542 1.00 0.00 N ATOM 993 CA ASP A 86 -12.685 18.556 -7.673 1.00 0.00 C ATOM 994 C ASP A 86 -12.076 18.456 -6.272 1.00 0.00 C ATOM 995 O ASP A 86 -12.061 19.445 -5.540 1.00 0.00 O ATOM 996 CB ASP A 86 -14.209 18.604 -7.564 1.00 0.00 C ATOM 997 CG ASP A 86 -14.736 17.288 -7.003 1.00 0.00 C ATOM 998 OD1 ASP A 86 -13.924 16.435 -6.688 1.00 0.00 O ATOM 999 OD2 ASP A 86 -15.944 17.148 -6.910 1.00 0.00 O ATOM 0 H ASP A 86 -12.947 16.652 -8.522 1.00 0.00 H new ATOM 0 HA ASP A 86 -12.296 19.469 -8.123 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -14.509 19.430 -6.919 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -14.646 18.791 -8.545 1.00 0.00 H new ATOM 1004 N LYS A 87 -11.578 17.276 -5.889 1.00 0.00 N ATOM 1005 CA LYS A 87 -10.979 17.102 -4.555 1.00 0.00 C ATOM 1006 C LYS A 87 -9.622 16.415 -4.641 1.00 0.00 C ATOM 1007 O LYS A 87 -9.326 15.713 -5.608 1.00 0.00 O ATOM 1008 CB LYS A 87 -11.903 16.285 -3.650 1.00 0.00 C ATOM 1009 CG LYS A 87 -13.238 17.013 -3.488 1.00 0.00 C ATOM 1010 CD LYS A 87 -14.115 16.252 -2.494 1.00 0.00 C ATOM 1011 CE LYS A 87 -15.507 16.887 -2.454 1.00 0.00 C ATOM 1012 NZ LYS A 87 -16.152 16.753 -3.790 1.00 0.00 N ATOM 0 H LYS A 87 -11.575 16.438 -6.470 1.00 0.00 H new ATOM 0 HA LYS A 87 -10.841 18.096 -4.130 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.066 15.296 -4.078 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -11.437 16.138 -2.676 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.069 18.031 -3.136 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.743 17.089 -4.451 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.189 15.204 -2.786 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.664 16.275 -1.502 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.118 16.402 -1.693 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.431 17.939 -2.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -17.132 16.425 -3.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -16.152 17.676 -4.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -15.623 16.065 -4.363 1.00 0.00 H new ATOM 1026 N THR A 88 -8.805 16.626 -3.609 1.00 0.00 N ATOM 1027 CA THR A 88 -7.468 16.033 -3.536 1.00 0.00 C ATOM 1028 C THR A 88 -7.322 15.198 -2.265 1.00 0.00 C ATOM 1029 O THR A 88 -8.234 15.134 -1.440 1.00 0.00 O ATOM 1030 CB THR A 88 -6.405 17.134 -3.551 1.00 0.00 C ATOM 1031 OG1 THR A 88 -5.122 16.543 -3.704 1.00 0.00 O ATOM 1032 CG2 THR A 88 -6.456 17.924 -2.243 1.00 0.00 C ATOM 0 H THR A 88 -9.047 17.207 -2.807 1.00 0.00 H new ATOM 0 HA THR A 88 -7.330 15.385 -4.402 1.00 0.00 H new ATOM 0 HB THR A 88 -6.597 17.813 -4.382 1.00 0.00 H new ATOM 0 HG1 THR A 88 -4.438 17.245 -3.716 1.00 0.00 H new ATOM 0 HG21 THR A 88 -5.697 18.706 -2.260 1.00 0.00 H new ATOM 0 HG22 THR A 88 -7.441 18.377 -2.130 1.00 0.00 H new ATOM 0 HG23 THR A 88 -6.267 17.253 -1.405 1.00 0.00 H new ATOM 1040 N LEU A 89 -6.171 14.554 -2.127 1.00 0.00 N ATOM 1041 CA LEU A 89 -5.899 13.711 -0.966 1.00 0.00 C ATOM 1042 C LEU A 89 -6.164 14.464 0.337 1.00 0.00 C ATOM 1043 O LEU A 89 -6.768 13.921 1.262 1.00 0.00 O ATOM 1044 CB LEU A 89 -4.434 13.257 -1.008 1.00 0.00 C ATOM 1045 CG LEU A 89 -4.116 12.305 0.159 1.00 0.00 C ATOM 1046 CD1 LEU A 89 -4.861 10.973 -0.017 1.00 0.00 C ATOM 1047 CD2 LEU A 89 -2.606 12.049 0.184 1.00 0.00 C ATOM 0 H LEU A 89 -5.409 14.598 -2.804 1.00 0.00 H new ATOM 0 HA LEU A 89 -6.563 12.847 -1.000 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.232 12.757 -1.955 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -3.779 14.127 -0.961 1.00 0.00 H new ATOM 0 HG LEU A 89 -4.438 12.760 1.096 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -4.625 10.311 0.816 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -5.935 11.157 -0.041 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -4.552 10.504 -0.951 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.365 11.375 1.006 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -2.298 11.596 -0.758 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -2.079 12.993 0.322 1.00 0.00 H new ATOM 1059 N THR A 90 -5.700 15.706 0.411 1.00 0.00 N ATOM 1060 CA THR A 90 -5.889 16.502 1.621 1.00 0.00 C ATOM 1061 C THR A 90 -7.367 16.795 1.855 1.00 0.00 C ATOM 1062 O THR A 90 -7.862 16.676 2.975 1.00 0.00 O ATOM 1063 CB THR A 90 -5.119 17.820 1.507 1.00 0.00 C ATOM 1064 OG1 THR A 90 -5.697 18.620 0.486 1.00 0.00 O ATOM 1065 CG2 THR A 90 -3.656 17.532 1.165 1.00 0.00 C ATOM 0 H THR A 90 -5.197 16.180 -0.340 1.00 0.00 H new ATOM 0 HA THR A 90 -5.509 15.929 2.467 1.00 0.00 H new ATOM 0 HB THR A 90 -5.170 18.352 2.457 1.00 0.00 H new ATOM 0 HG1 THR A 90 -5.205 19.465 0.414 1.00 0.00 H new ATOM 0 HG21 THR A 90 -3.109 18.472 1.084 1.00 0.00 H new ATOM 0 HG22 THR A 90 -3.212 16.920 1.951 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.602 16.998 0.216 1.00 0.00 H new ATOM 1073 N ASP A 91 -8.068 17.177 0.794 1.00 0.00 N ATOM 1074 CA ASP A 91 -9.490 17.481 0.899 1.00 0.00 C ATOM 1075 C ASP A 91 -10.292 16.224 1.217 1.00 0.00 C ATOM 1076 O ASP A 91 -11.301 16.280 1.920 1.00 0.00 O ATOM 1077 CB ASP A 91 -9.994 18.092 -0.409 1.00 0.00 C ATOM 1078 CG ASP A 91 -9.320 19.438 -0.649 1.00 0.00 C ATOM 1079 OD1 ASP A 91 -8.734 19.961 0.286 1.00 0.00 O ATOM 1080 OD2 ASP A 91 -9.400 19.928 -1.763 1.00 0.00 O ATOM 0 H ASP A 91 -7.678 17.283 -0.143 1.00 0.00 H new ATOM 0 HA ASP A 91 -9.625 18.196 1.710 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -9.784 17.418 -1.239 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.076 18.220 -0.367 1.00 0.00 H new ATOM 1085 N LEU A 92 -9.842 15.092 0.684 1.00 0.00 N ATOM 1086 CA LEU A 92 -10.532 13.826 0.907 1.00 0.00 C ATOM 1087 C LEU A 92 -10.681 13.572 2.407 1.00 0.00 C ATOM 1088 O LEU A 92 -11.771 13.275 2.893 1.00 0.00 O ATOM 1089 CB LEU A 92 -9.727 12.688 0.247 1.00 0.00 C ATOM 1090 CG LEU A 92 -10.636 11.501 -0.142 1.00 0.00 C ATOM 1091 CD1 LEU A 92 -11.516 11.087 1.042 1.00 0.00 C ATOM 1092 CD2 LEU A 92 -11.528 11.870 -1.345 1.00 0.00 C ATOM 0 H LEU A 92 -9.009 15.025 0.099 1.00 0.00 H new ATOM 0 HA LEU A 92 -11.527 13.866 0.463 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -9.222 13.067 -0.641 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -8.952 12.345 0.932 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.995 10.664 -0.420 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -12.149 10.250 0.749 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -10.884 10.789 1.878 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -12.142 11.928 1.342 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -12.160 11.021 -1.603 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -12.155 12.723 -1.085 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.900 12.127 -2.198 1.00 0.00 H new ATOM 1104 N GLY A 93 -9.577 13.699 3.137 1.00 0.00 N ATOM 1105 CA GLY A 93 -9.604 13.486 4.578 1.00 0.00 C ATOM 1106 C GLY A 93 -8.213 13.624 5.183 1.00 0.00 C ATOM 1107 O GLY A 93 -7.233 13.855 4.475 1.00 0.00 O ATOM 0 H GLY A 93 -8.662 13.946 2.759 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -10.278 14.206 5.042 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -10.000 12.494 4.794 1.00 0.00 H new ATOM 1111 N THR A 94 -8.138 13.463 6.500 1.00 0.00 N ATOM 1112 CA THR A 94 -6.868 13.549 7.215 1.00 0.00 C ATOM 1113 C THR A 94 -6.233 12.167 7.303 1.00 0.00 C ATOM 1114 O THR A 94 -6.859 11.169 6.947 1.00 0.00 O ATOM 1115 CB THR A 94 -7.099 14.097 8.624 1.00 0.00 C ATOM 1116 OG1 THR A 94 -7.813 13.137 9.391 1.00 0.00 O ATOM 1117 CG2 THR A 94 -7.907 15.394 8.545 1.00 0.00 C ATOM 0 H THR A 94 -8.943 13.272 7.096 1.00 0.00 H new ATOM 0 HA THR A 94 -6.201 14.220 6.674 1.00 0.00 H new ATOM 0 HB THR A 94 -6.138 14.300 9.097 1.00 0.00 H new ATOM 0 HG1 THR A 94 -7.236 12.794 10.105 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.070 15.783 9.550 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.358 16.129 7.956 1.00 0.00 H new ATOM 0 HG23 THR A 94 -8.869 15.195 8.072 1.00 0.00 H new ATOM 1125 N ALA A 95 -4.994 12.106 7.775 1.00 0.00 N ATOM 1126 CA ALA A 95 -4.313 10.824 7.892 1.00 0.00 C ATOM 1127 C ALA A 95 -5.142 9.873 8.749 1.00 0.00 C ATOM 1128 O ALA A 95 -5.271 8.690 8.433 1.00 0.00 O ATOM 1129 CB ALA A 95 -2.933 11.016 8.524 1.00 0.00 C ATOM 0 H ALA A 95 -4.449 12.913 8.078 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.191 10.398 6.896 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -2.433 10.051 8.606 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -2.336 11.681 7.900 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.045 11.453 9.516 1.00 0.00 H new ATOM 1135 N THR A 96 -5.709 10.401 9.831 1.00 0.00 N ATOM 1136 CA THR A 96 -6.534 9.594 10.722 1.00 0.00 C ATOM 1137 C THR A 96 -7.878 9.270 10.074 1.00 0.00 C ATOM 1138 O THR A 96 -8.343 8.131 10.120 1.00 0.00 O ATOM 1139 CB THR A 96 -6.765 10.345 12.036 1.00 0.00 C ATOM 1140 OG1 THR A 96 -5.513 10.666 12.624 1.00 0.00 O ATOM 1141 CG2 THR A 96 -7.576 9.472 12.997 1.00 0.00 C ATOM 0 H THR A 96 -5.613 11.377 10.110 1.00 0.00 H new ATOM 0 HA THR A 96 -6.011 8.659 10.921 1.00 0.00 H new ATOM 0 HB THR A 96 -7.318 11.263 11.834 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.660 11.148 13.464 1.00 0.00 H new ATOM 0 HG21 THR A 96 -7.737 10.011 13.930 1.00 0.00 H new ATOM 0 HG22 THR A 96 -8.539 9.232 12.546 1.00 0.00 H new ATOM 0 HG23 THR A 96 -7.030 8.551 13.200 1.00 0.00 H new ATOM 1149 N ASP A 97 -8.497 10.282 9.471 1.00 0.00 N ATOM 1150 CA ASP A 97 -9.789 10.098 8.819 1.00 0.00 C ATOM 1151 C ASP A 97 -9.669 9.092 7.685 1.00 0.00 C ATOM 1152 O ASP A 97 -10.425 8.123 7.616 1.00 0.00 O ATOM 1153 CB ASP A 97 -10.282 11.434 8.260 1.00 0.00 C ATOM 1154 CG ASP A 97 -11.752 11.326 7.867 1.00 0.00 C ATOM 1155 OD1 ASP A 97 -12.342 10.292 8.132 1.00 0.00 O ATOM 1156 OD2 ASP A 97 -12.266 12.280 7.306 1.00 0.00 O ATOM 0 H ASP A 97 -8.127 11.231 9.421 1.00 0.00 H new ATOM 0 HA ASP A 97 -10.501 9.724 9.555 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -10.153 12.219 9.005 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -9.685 11.717 7.393 1.00 0.00 H new ATOM 1161 N VAL A 98 -8.702 9.321 6.804 1.00 0.00 N ATOM 1162 CA VAL A 98 -8.480 8.422 5.682 1.00 0.00 C ATOM 1163 C VAL A 98 -8.111 7.040 6.203 1.00 0.00 C ATOM 1164 O VAL A 98 -8.537 6.022 5.657 1.00 0.00 O ATOM 1165 CB VAL A 98 -7.353 8.958 4.795 1.00 0.00 C ATOM 1166 CG1 VAL A 98 -7.030 7.939 3.701 1.00 0.00 C ATOM 1167 CG2 VAL A 98 -7.795 10.272 4.150 1.00 0.00 C ATOM 0 H VAL A 98 -8.064 10.116 6.845 1.00 0.00 H new ATOM 0 HA VAL A 98 -9.394 8.355 5.091 1.00 0.00 H new ATOM 0 HB VAL A 98 -6.465 9.129 5.403 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -6.228 8.323 3.071 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -6.715 7.001 4.159 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -7.917 7.765 3.092 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -6.994 10.655 3.518 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -8.684 10.099 3.543 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -8.023 11.001 4.928 1.00 0.00 H new ATOM 1177 N GLY A 99 -7.318 7.018 7.267 1.00 0.00 N ATOM 1178 CA GLY A 99 -6.896 5.761 7.865 1.00 0.00 C ATOM 1179 C GLY A 99 -8.102 4.931 8.291 1.00 0.00 C ATOM 1180 O GLY A 99 -8.146 3.725 8.057 1.00 0.00 O ATOM 0 H GLY A 99 -6.957 7.852 7.730 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -6.295 5.197 7.151 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -6.262 5.959 8.729 1.00 0.00 H new ATOM 1184 N TYR A 100 -9.081 5.581 8.915 1.00 0.00 N ATOM 1185 CA TYR A 100 -10.282 4.882 9.361 1.00 0.00 C ATOM 1186 C TYR A 100 -11.111 4.402 8.167 1.00 0.00 C ATOM 1187 O TYR A 100 -11.620 3.281 8.169 1.00 0.00 O ATOM 1188 CB TYR A 100 -11.131 5.805 10.260 1.00 0.00 C ATOM 1189 CG TYR A 100 -10.624 5.748 11.689 1.00 0.00 C ATOM 1190 CD1 TYR A 100 -10.709 4.548 12.406 1.00 0.00 C ATOM 1191 CD2 TYR A 100 -10.079 6.887 12.295 1.00 0.00 C ATOM 1192 CE1 TYR A 100 -10.249 4.485 13.726 1.00 0.00 C ATOM 1193 CE2 TYR A 100 -9.618 6.823 13.618 1.00 0.00 C ATOM 1194 CZ TYR A 100 -9.704 5.622 14.332 1.00 0.00 C ATOM 1195 OH TYR A 100 -9.252 5.559 15.634 1.00 0.00 O ATOM 0 H TYR A 100 -9.067 6.580 9.121 1.00 0.00 H new ATOM 0 HA TYR A 100 -9.975 4.009 9.936 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -11.085 6.829 9.890 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -12.177 5.500 10.224 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -11.130 3.670 11.939 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -10.014 7.814 11.744 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -10.315 3.558 14.277 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -9.197 7.700 14.086 1.00 0.00 H new ATOM 0 HH TYR A 100 -8.903 6.435 15.902 1.00 0.00 H new ATOM 1205 N ARG A 101 -11.245 5.251 7.154 1.00 0.00 N ATOM 1206 CA ARG A 101 -12.018 4.888 5.971 1.00 0.00 C ATOM 1207 C ARG A 101 -11.394 3.688 5.266 1.00 0.00 C ATOM 1208 O ARG A 101 -12.099 2.815 4.762 1.00 0.00 O ATOM 1209 CB ARG A 101 -12.079 6.072 4.998 1.00 0.00 C ATOM 1210 CG ARG A 101 -12.772 7.273 5.661 1.00 0.00 C ATOM 1211 CD ARG A 101 -14.296 7.094 5.640 1.00 0.00 C ATOM 1212 NE ARG A 101 -14.949 8.326 6.067 1.00 0.00 N ATOM 1213 CZ ARG A 101 -16.273 8.443 6.054 1.00 0.00 C ATOM 1214 NH1 ARG A 101 -17.011 7.449 5.645 1.00 0.00 N ATOM 1215 NH2 ARG A 101 -16.834 9.553 6.449 1.00 0.00 N ATOM 0 H ARG A 101 -10.834 6.184 7.127 1.00 0.00 H new ATOM 0 HA ARG A 101 -13.026 4.626 6.291 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -11.071 6.350 4.689 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -12.620 5.783 4.097 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -12.426 7.377 6.690 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -12.501 8.191 5.139 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -14.625 6.827 4.636 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -14.583 6.274 6.298 1.00 0.00 H new ATOM 0 HE ARG A 101 -14.380 9.112 6.381 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -16.572 6.582 5.335 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -18.027 7.539 5.635 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -16.256 10.331 6.768 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -17.850 9.643 6.439 1.00 0.00 H new ATOM 1229 N PHE A 102 -10.068 3.659 5.228 1.00 0.00 N ATOM 1230 CA PHE A 102 -9.356 2.567 4.573 1.00 0.00 C ATOM 1231 C PHE A 102 -9.666 1.237 5.259 1.00 0.00 C ATOM 1232 O PHE A 102 -9.854 0.219 4.594 1.00 0.00 O ATOM 1233 CB PHE A 102 -7.847 2.840 4.593 1.00 0.00 C ATOM 1234 CG PHE A 102 -7.143 1.910 3.624 1.00 0.00 C ATOM 1235 CD1 PHE A 102 -7.386 2.023 2.248 1.00 0.00 C ATOM 1236 CD2 PHE A 102 -6.252 0.938 4.097 1.00 0.00 C ATOM 1237 CE1 PHE A 102 -6.739 1.166 1.349 1.00 0.00 C ATOM 1238 CE2 PHE A 102 -5.606 0.081 3.196 1.00 0.00 C ATOM 1239 CZ PHE A 102 -5.849 0.195 1.824 1.00 0.00 C ATOM 0 H PHE A 102 -9.467 4.373 5.639 1.00 0.00 H new ATOM 0 HA PHE A 102 -9.689 2.503 3.537 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -7.652 3.878 4.322 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -7.455 2.695 5.600 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -8.073 2.771 1.881 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -6.063 0.849 5.157 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.927 1.254 0.289 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -4.920 -0.668 3.562 1.00 0.00 H new ATOM 0 HZ PHE A 102 -5.350 -0.466 1.130 1.00 0.00 H new ATOM 1249 N MET A 103 -9.723 1.247 6.592 1.00 0.00 N ATOM 1250 CA MET A 103 -10.017 0.023 7.337 1.00 0.00 C ATOM 1251 C MET A 103 -11.368 -0.542 6.923 1.00 0.00 C ATOM 1252 O MET A 103 -11.510 -1.745 6.710 1.00 0.00 O ATOM 1253 CB MET A 103 -10.048 0.313 8.841 1.00 0.00 C ATOM 1254 CG MET A 103 -8.651 0.688 9.335 1.00 0.00 C ATOM 1255 SD MET A 103 -7.560 -0.756 9.227 1.00 0.00 S ATOM 1256 CE MET A 103 -6.514 -0.180 7.865 1.00 0.00 C ATOM 0 H MET A 103 -9.572 2.074 7.169 1.00 0.00 H new ATOM 0 HA MET A 103 -9.234 -0.702 7.115 1.00 0.00 H new ATOM 0 HB2 MET A 103 -10.745 1.125 9.048 1.00 0.00 H new ATOM 0 HB3 MET A 103 -10.410 -0.563 9.380 1.00 0.00 H new ATOM 0 HG2 MET A 103 -8.250 1.505 8.736 1.00 0.00 H new ATOM 0 HG3 MET A 103 -8.701 1.042 10.365 1.00 0.00 H new ATOM 0 HE1 MET A 103 -6.085 -1.038 7.348 1.00 0.00 H new ATOM 0 HE2 MET A 103 -7.115 0.402 7.166 1.00 0.00 H new ATOM 0 HE3 MET A 103 -5.712 0.444 8.261 1.00 0.00 H new ATOM 1266 N LYS A 104 -12.359 0.335 6.809 1.00 0.00 N ATOM 1267 CA LYS A 104 -13.693 -0.090 6.417 1.00 0.00 C ATOM 1268 C LYS A 104 -13.672 -0.619 4.987 1.00 0.00 C ATOM 1269 O LYS A 104 -14.239 -1.669 4.694 1.00 0.00 O ATOM 1270 CB LYS A 104 -14.668 1.090 6.526 1.00 0.00 C ATOM 1271 CG LYS A 104 -16.119 0.618 6.325 1.00 0.00 C ATOM 1272 CD LYS A 104 -16.674 0.021 7.627 1.00 0.00 C ATOM 1273 CE LYS A 104 -18.172 -0.247 7.463 1.00 0.00 C ATOM 1274 NZ LYS A 104 -18.743 -0.687 8.768 1.00 0.00 N ATOM 0 H LYS A 104 -12.263 1.336 6.981 1.00 0.00 H new ATOM 0 HA LYS A 104 -14.023 -0.887 7.083 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -14.566 1.563 7.503 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -14.419 1.844 5.779 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -16.740 1.456 6.008 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -16.159 -0.127 5.530 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -16.152 -0.905 7.868 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -16.504 0.707 8.457 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -18.678 0.655 7.118 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -18.335 -1.014 6.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -19.731 -0.983 8.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -18.190 -1.487 9.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -18.707 0.101 9.446 1.00 0.00 H new ATOM 1288 N THR A 105 -13.010 0.122 4.105 1.00 0.00 N ATOM 1289 CA THR A 105 -12.917 -0.271 2.703 1.00 0.00 C ATOM 1290 C THR A 105 -12.257 -1.638 2.561 1.00 0.00 C ATOM 1291 O THR A 105 -12.743 -2.498 1.825 1.00 0.00 O ATOM 1292 CB THR A 105 -12.104 0.773 1.934 1.00 0.00 C ATOM 1293 OG1 THR A 105 -12.716 2.046 2.080 1.00 0.00 O ATOM 1294 CG2 THR A 105 -12.044 0.399 0.453 1.00 0.00 C ATOM 0 H THR A 105 -12.532 0.994 4.334 1.00 0.00 H new ATOM 0 HA THR A 105 -13.925 -0.332 2.294 1.00 0.00 H new ATOM 0 HB THR A 105 -11.090 0.806 2.333 1.00 0.00 H new ATOM 0 HG1 THR A 105 -12.512 2.407 2.968 1.00 0.00 H new ATOM 0 HG21 THR A 105 -11.464 1.147 -0.088 1.00 0.00 H new ATOM 0 HG22 THR A 105 -11.571 -0.577 0.343 1.00 0.00 H new ATOM 0 HG23 THR A 105 -13.055 0.360 0.046 1.00 0.00 H new ATOM 1302 N VAL A 106 -11.152 -1.839 3.270 1.00 0.00 N ATOM 1303 CA VAL A 106 -10.446 -3.112 3.210 1.00 0.00 C ATOM 1304 C VAL A 106 -11.281 -4.210 3.858 1.00 0.00 C ATOM 1305 O VAL A 106 -11.438 -5.297 3.302 1.00 0.00 O ATOM 1306 CB VAL A 106 -9.102 -3.001 3.932 1.00 0.00 C ATOM 1307 CG1 VAL A 106 -8.419 -4.369 3.959 1.00 0.00 C ATOM 1308 CG2 VAL A 106 -8.207 -2.001 3.196 1.00 0.00 C ATOM 0 H VAL A 106 -10.730 -1.145 3.887 1.00 0.00 H new ATOM 0 HA VAL A 106 -10.274 -3.364 2.163 1.00 0.00 H new ATOM 0 HB VAL A 106 -9.269 -2.658 4.953 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -7.462 -4.288 4.474 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -9.054 -5.082 4.484 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -8.254 -4.713 2.938 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -7.249 -1.922 3.711 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -8.043 -2.343 2.174 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -8.691 -1.024 3.178 1.00 0.00 H new ATOM 1318 N ASN A 107 -11.807 -3.913 5.041 1.00 0.00 N ATOM 1319 CA ASN A 107 -12.622 -4.875 5.769 1.00 0.00 C ATOM 1320 C ASN A 107 -13.895 -5.216 5.000 1.00 0.00 C ATOM 1321 O ASN A 107 -14.333 -6.355 5.000 1.00 0.00 O ATOM 1322 CB ASN A 107 -12.990 -4.312 7.144 1.00 0.00 C ATOM 1323 CG ASN A 107 -11.734 -4.153 7.995 1.00 0.00 C ATOM 1324 OD1 ASN A 107 -10.702 -4.755 7.695 1.00 0.00 O ATOM 1325 ND2 ASN A 107 -11.758 -3.376 9.043 1.00 0.00 N ATOM 0 H ASN A 107 -11.684 -3.018 5.514 1.00 0.00 H new ATOM 0 HA ASN A 107 -12.038 -5.788 5.889 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -13.487 -3.349 7.031 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -13.695 -4.978 7.642 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -10.921 -3.266 9.616 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -12.614 -2.878 9.290 1.00 0.00 H new ATOM 1332 N ASP A 108 -14.486 -4.227 4.344 1.00 0.00 N ATOM 1333 CA ASP A 108 -15.720 -4.454 3.592 1.00 0.00 C ATOM 1334 C ASP A 108 -15.639 -5.739 2.772 1.00 0.00 C ATOM 1335 O ASP A 108 -16.624 -6.466 2.643 1.00 0.00 O ATOM 1336 CB ASP A 108 -15.987 -3.270 2.653 1.00 0.00 C ATOM 1337 CG ASP A 108 -16.482 -2.064 3.443 1.00 0.00 C ATOM 1338 OD1 ASP A 108 -16.733 -2.216 4.626 1.00 0.00 O ATOM 1339 OD2 ASP A 108 -16.604 -1.004 2.851 1.00 0.00 O ATOM 0 H ASP A 108 -14.139 -3.268 4.315 1.00 0.00 H new ATOM 0 HA ASP A 108 -16.536 -4.550 4.309 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -15.074 -3.011 2.116 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -16.728 -3.551 1.905 1.00 0.00 H new ATOM 1344 N ALA A 109 -14.471 -6.004 2.209 1.00 0.00 N ATOM 1345 CA ALA A 109 -14.287 -7.194 1.388 1.00 0.00 C ATOM 1346 C ALA A 109 -14.396 -8.484 2.206 1.00 0.00 C ATOM 1347 O ALA A 109 -15.056 -9.434 1.783 1.00 0.00 O ATOM 1348 CB ALA A 109 -12.917 -7.139 0.707 1.00 0.00 C ATOM 0 H ALA A 109 -13.641 -5.418 2.303 1.00 0.00 H new ATOM 0 HA ALA A 109 -15.083 -7.205 0.643 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -12.780 -8.029 0.093 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -12.859 -6.251 0.077 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -12.135 -7.097 1.465 1.00 0.00 H new ATOM 1354 N SER A 110 -13.719 -8.533 3.358 1.00 0.00 N ATOM 1355 CA SER A 110 -13.723 -9.741 4.206 1.00 0.00 C ATOM 1356 C SER A 110 -14.196 -9.462 5.638 1.00 0.00 C ATOM 1357 O SER A 110 -13.844 -10.197 6.561 1.00 0.00 O ATOM 1358 CB SER A 110 -12.313 -10.327 4.240 1.00 0.00 C ATOM 1359 OG SER A 110 -11.997 -10.863 2.960 1.00 0.00 O ATOM 0 H SER A 110 -13.164 -7.760 3.727 1.00 0.00 H new ATOM 0 HA SER A 110 -14.430 -10.447 3.769 1.00 0.00 H new ATOM 0 HB2 SER A 110 -11.592 -9.556 4.512 1.00 0.00 H new ATOM 0 HB3 SER A 110 -12.248 -11.106 5.000 1.00 0.00 H new ATOM 0 HG SER A 110 -11.092 -11.239 2.977 1.00 0.00 H new ATOM 1365 N GLN A 111 -14.963 -8.397 5.828 1.00 0.00 N ATOM 1366 CA GLN A 111 -15.441 -8.030 7.162 1.00 0.00 C ATOM 1367 C GLN A 111 -16.041 -9.229 7.892 1.00 0.00 C ATOM 1368 O GLN A 111 -16.033 -9.281 9.121 1.00 0.00 O ATOM 1369 CB GLN A 111 -16.500 -6.923 7.056 1.00 0.00 C ATOM 1370 CG GLN A 111 -16.826 -6.389 8.451 1.00 0.00 C ATOM 1371 CD GLN A 111 -17.931 -5.343 8.362 1.00 0.00 C ATOM 1372 OE1 GLN A 111 -19.042 -5.647 7.928 1.00 0.00 O ATOM 1373 NE2 GLN A 111 -17.691 -4.119 8.749 1.00 0.00 N ATOM 0 H GLN A 111 -15.269 -7.772 5.082 1.00 0.00 H new ATOM 0 HA GLN A 111 -14.583 -7.672 7.732 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -16.134 -6.115 6.423 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -17.402 -7.313 6.585 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -17.140 -7.208 9.099 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -15.934 -5.951 8.900 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -16.770 -3.869 9.108 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -18.425 -3.413 8.692 1.00 0.00 H new ATOM 1382 N GLY A 112 -16.584 -10.174 7.138 1.00 0.00 N ATOM 1383 CA GLY A 112 -17.209 -11.346 7.740 1.00 0.00 C ATOM 1384 C GLY A 112 -16.369 -11.927 8.877 1.00 0.00 C ATOM 1385 O GLY A 112 -16.827 -11.990 10.018 1.00 0.00 O ATOM 0 H GLY A 112 -16.606 -10.155 6.118 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -18.194 -11.076 8.120 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -17.360 -12.108 6.976 1.00 0.00 H new ATOM 1389 N ASP A 113 -15.145 -12.364 8.564 1.00 0.00 N ATOM 1390 CA ASP A 113 -14.256 -12.955 9.578 1.00 0.00 C ATOM 1391 C ASP A 113 -12.988 -12.127 9.775 1.00 0.00 C ATOM 1392 O ASP A 113 -12.468 -12.029 10.886 1.00 0.00 O ATOM 1393 CB ASP A 113 -13.867 -14.374 9.154 1.00 0.00 C ATOM 1394 CG ASP A 113 -15.088 -15.286 9.199 1.00 0.00 C ATOM 1395 OD1 ASP A 113 -16.089 -14.877 9.763 1.00 0.00 O ATOM 1396 OD2 ASP A 113 -15.004 -16.382 8.669 1.00 0.00 O ATOM 0 H ASP A 113 -14.747 -12.322 7.626 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.799 -12.974 10.523 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -13.451 -14.360 8.147 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -13.091 -14.760 9.815 1.00 0.00 H new ATOM 1401 N ARG A 114 -12.482 -11.553 8.689 1.00 0.00 N ATOM 1402 CA ARG A 114 -11.258 -10.758 8.754 1.00 0.00 C ATOM 1403 C ARG A 114 -11.533 -9.364 9.311 1.00 0.00 C ATOM 1404 O ARG A 114 -12.535 -8.735 8.972 1.00 0.00 O ATOM 1405 CB ARG A 114 -10.656 -10.627 7.355 1.00 0.00 C ATOM 1406 CG ARG A 114 -9.245 -10.044 7.450 1.00 0.00 C ATOM 1407 CD ARG A 114 -8.727 -9.750 6.040 1.00 0.00 C ATOM 1408 NE ARG A 114 -8.723 -10.967 5.239 1.00 0.00 N ATOM 1409 CZ ARG A 114 -8.126 -11.005 4.053 1.00 0.00 C ATOM 1410 NH1 ARG A 114 -7.515 -9.945 3.599 1.00 0.00 N ATOM 1411 NH2 ARG A 114 -8.148 -12.100 3.345 1.00 0.00 N ATOM 0 H ARG A 114 -12.896 -11.621 7.759 1.00 0.00 H new ATOM 0 HA ARG A 114 -10.560 -11.267 9.419 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -10.624 -11.603 6.870 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -11.284 -9.985 6.738 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -9.255 -9.131 8.045 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -8.582 -10.746 7.955 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -9.354 -8.996 5.565 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -7.719 -9.339 6.094 1.00 0.00 H new ATOM 0 HE ARG A 114 -9.186 -11.803 5.595 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -7.497 -9.090 4.155 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -7.056 -9.972 2.689 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -8.624 -12.929 3.702 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -7.689 -12.128 2.434 1.00 0.00 H new ATOM 1425 N GLN A 115 -10.623 -8.885 10.158 1.00 0.00 N ATOM 1426 CA GLN A 115 -10.750 -7.555 10.759 1.00 0.00 C ATOM 1427 C GLN A 115 -9.427 -6.801 10.641 1.00 0.00 C ATOM 1428 O GLN A 115 -8.360 -7.368 10.874 1.00 0.00 O ATOM 1429 CB GLN A 115 -11.127 -7.689 12.235 1.00 0.00 C ATOM 1430 CG GLN A 115 -12.465 -8.421 12.357 1.00 0.00 C ATOM 1431 CD GLN A 115 -12.881 -8.501 13.821 1.00 0.00 C ATOM 1432 OE1 GLN A 115 -13.361 -7.517 14.387 1.00 0.00 O ATOM 1433 NE2 GLN A 115 -12.727 -9.621 14.473 1.00 0.00 N ATOM 0 H GLN A 115 -9.789 -9.397 10.445 1.00 0.00 H new ATOM 0 HA GLN A 115 -11.528 -7.002 10.233 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -10.351 -8.236 12.771 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -11.197 -6.703 12.694 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -13.229 -7.899 11.781 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -12.380 -9.424 11.939 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -12.330 -10.434 14.003 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -13.004 -9.683 15.453 1.00 0.00 H new ATOM 1442 N ALA A 116 -9.502 -5.518 10.283 1.00 0.00 N ATOM 1443 CA ALA A 116 -8.299 -4.691 10.143 1.00 0.00 C ATOM 1444 C ALA A 116 -8.220 -3.669 11.273 1.00 0.00 C ATOM 1445 O ALA A 116 -9.231 -3.093 11.674 1.00 0.00 O ATOM 1446 CB ALA A 116 -8.317 -3.963 8.796 1.00 0.00 C ATOM 0 H ALA A 116 -10.376 -5.030 10.086 1.00 0.00 H new ATOM 0 HA ALA A 116 -7.426 -5.342 10.192 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -7.420 -3.351 8.701 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -8.345 -4.694 7.988 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.199 -3.325 8.739 1.00 0.00 H new ATOM 1452 N GLU A 117 -7.008 -3.451 11.782 1.00 0.00 N ATOM 1453 CA GLU A 117 -6.783 -2.497 12.872 1.00 0.00 C ATOM 1454 C GLU A 117 -5.730 -1.467 12.479 1.00 0.00 C ATOM 1455 O GLU A 117 -4.600 -1.818 12.141 1.00 0.00 O ATOM 1456 CB GLU A 117 -6.317 -3.255 14.121 1.00 0.00 C ATOM 1457 CG GLU A 117 -7.522 -3.879 14.832 1.00 0.00 C ATOM 1458 CD GLU A 117 -7.064 -4.607 16.090 1.00 0.00 C ATOM 1459 OE1 GLU A 117 -5.865 -4.735 16.273 1.00 0.00 O ATOM 1460 OE2 GLU A 117 -7.919 -5.027 16.851 1.00 0.00 O ATOM 0 H GLU A 117 -6.164 -3.922 11.457 1.00 0.00 H new ATOM 0 HA GLU A 117 -7.717 -1.975 13.080 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -5.606 -4.032 13.841 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -5.797 -2.576 14.796 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -8.243 -3.104 15.092 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -8.029 -4.575 14.163 1.00 0.00 H new ATOM 1467 N LEU A 118 -6.103 -0.193 12.546 1.00 0.00 N ATOM 1468 CA LEU A 118 -5.179 0.882 12.202 1.00 0.00 C ATOM 1469 C LEU A 118 -4.245 1.163 13.373 1.00 0.00 C ATOM 1470 O LEU A 118 -4.667 1.679 14.408 1.00 0.00 O ATOM 1471 CB LEU A 118 -5.972 2.148 11.855 1.00 0.00 C ATOM 1472 CG LEU A 118 -5.035 3.266 11.357 1.00 0.00 C ATOM 1473 CD1 LEU A 118 -4.551 2.971 9.929 1.00 0.00 C ATOM 1474 CD2 LEU A 118 -5.801 4.594 11.368 1.00 0.00 C ATOM 0 H LEU A 118 -7.031 0.119 12.833 1.00 0.00 H new ATOM 0 HA LEU A 118 -4.584 0.580 11.340 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -6.712 1.919 11.088 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -6.519 2.491 12.733 1.00 0.00 H new ATOM 0 HG LEU A 118 -4.167 3.322 12.014 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -3.891 3.772 9.596 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -4.009 2.025 9.917 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -5.409 2.906 9.260 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -5.148 5.393 11.017 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -6.668 4.519 10.712 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -6.132 4.815 12.383 1.00 0.00 H new ATOM 1486 N ILE A 119 -2.974 0.824 13.198 1.00 0.00 N ATOM 1487 CA ILE A 119 -1.985 1.048 14.240 1.00 0.00 C ATOM 1488 C ILE A 119 -1.591 2.520 14.307 1.00 0.00 C ATOM 1489 O ILE A 119 -1.691 3.152 15.359 1.00 0.00 O ATOM 1490 CB ILE A 119 -0.747 0.193 13.969 1.00 0.00 C ATOM 1491 CG1 ILE A 119 -1.132 -1.288 14.035 1.00 0.00 C ATOM 1492 CG2 ILE A 119 0.320 0.491 15.021 1.00 0.00 C ATOM 1493 CD1 ILE A 119 0.028 -2.147 13.525 1.00 0.00 C ATOM 0 H ILE A 119 -2.607 0.395 12.348 1.00 0.00 H new ATOM 0 HA ILE A 119 -2.422 0.764 15.197 1.00 0.00 H new ATOM 0 HB ILE A 119 -0.352 0.424 12.980 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -1.378 -1.564 15.060 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -2.023 -1.469 13.434 1.00 0.00 H new ATOM 0 HG21 ILE A 119 1.202 -0.119 14.827 1.00 0.00 H new ATOM 0 HG22 ILE A 119 0.591 1.546 14.976 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.071 0.259 16.012 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -0.250 -3.200 13.574 1.00 0.00 H new ATOM 0 HD12 ILE A 119 0.253 -1.879 12.493 1.00 0.00 H new ATOM 0 HD13 ILE A 119 0.908 -1.975 14.145 1.00 0.00 H new ATOM 1505 N ASN A 120 -1.139 3.060 13.175 1.00 0.00 N ATOM 1506 CA ASN A 120 -0.725 4.465 13.111 1.00 0.00 C ATOM 1507 C ASN A 120 -1.069 5.068 11.749 1.00 0.00 C ATOM 1508 O ASN A 120 -1.319 4.350 10.781 1.00 0.00 O ATOM 1509 CB ASN A 120 0.794 4.575 13.366 1.00 0.00 C ATOM 1510 CG ASN A 120 1.083 4.739 14.858 1.00 0.00 C ATOM 1511 OD1 ASN A 120 0.589 3.886 15.709 1.00 0.00 O flip ATOM 1512 ND2 ASN A 120 1.781 5.671 15.256 1.00 0.00 N flip ATOM 0 H ASN A 120 -1.050 2.552 12.295 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.262 5.020 13.880 1.00 0.00 H new ATOM 0 HB2 ASN A 120 1.296 3.684 12.989 1.00 0.00 H new ATOM 0 HB3 ASN A 120 1.199 5.425 12.817 1.00 0.00 H new ATOM 0 HD21 ASN A 120 2.168 6.339 14.590 1.00 0.00 H new ATOM 0 HD22 ASN A 120 1.973 5.775 16.252 1.00 0.00 H new ATOM 1519 N ALA A 121 -1.064 6.397 11.690 1.00 0.00 N ATOM 1520 CA ALA A 121 -1.362 7.110 10.450 1.00 0.00 C ATOM 1521 C ALA A 121 -0.759 8.512 10.489 1.00 0.00 C ATOM 1522 O ALA A 121 -1.142 9.338 11.317 1.00 0.00 O ATOM 1523 CB ALA A 121 -2.875 7.206 10.250 1.00 0.00 C ATOM 0 H ALA A 121 -0.857 7.002 12.485 1.00 0.00 H new ATOM 0 HA ALA A 121 -0.925 6.558 9.618 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -3.086 7.739 9.323 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.299 6.203 10.197 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -3.319 7.744 11.087 1.00 0.00 H new ATOM 1529 N GLU A 122 0.190 8.774 9.588 1.00 0.00 N ATOM 1530 CA GLU A 122 0.850 10.083 9.526 1.00 0.00 C ATOM 1531 C GLU A 122 1.043 10.517 8.077 1.00 0.00 C ATOM 1532 O GLU A 122 0.968 9.700 7.160 1.00 0.00 O ATOM 1533 CB GLU A 122 2.208 10.013 10.226 1.00 0.00 C ATOM 1534 CG GLU A 122 2.004 9.640 11.695 1.00 0.00 C ATOM 1535 CD GLU A 122 3.343 9.643 12.424 1.00 0.00 C ATOM 1536 OE1 GLU A 122 4.359 9.745 11.757 1.00 0.00 O ATOM 1537 OE2 GLU A 122 3.333 9.542 13.641 1.00 0.00 O ATOM 0 H GLU A 122 0.518 8.102 8.894 1.00 0.00 H new ATOM 0 HA GLU A 122 0.218 10.814 10.030 1.00 0.00 H new ATOM 0 HB2 GLU A 122 2.844 9.275 9.737 1.00 0.00 H new ATOM 0 HB3 GLU A 122 2.718 10.973 10.151 1.00 0.00 H new ATOM 0 HG2 GLU A 122 1.322 10.347 12.167 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.543 8.655 11.768 1.00 0.00 H new ATOM 1544 N ALA A 123 1.292 11.813 7.875 1.00 0.00 N ATOM 1545 CA ALA A 123 1.496 12.356 6.530 1.00 0.00 C ATOM 1546 C ALA A 123 2.664 13.336 6.511 1.00 0.00 C ATOM 1547 O ALA A 123 2.949 14.001 7.507 1.00 0.00 O ATOM 1548 CB ALA A 123 0.228 13.071 6.066 1.00 0.00 C ATOM 0 H ALA A 123 1.357 12.504 8.623 1.00 0.00 H new ATOM 0 HA ALA A 123 1.723 11.529 5.857 1.00 0.00 H new ATOM 0 HB1 ALA A 123 0.383 13.474 5.065 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.602 12.365 6.048 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.003 13.885 6.753 1.00 0.00 H new ATOM 1554 N ARG A 124 3.335 13.420 5.361 1.00 0.00 N ATOM 1555 CA ARG A 124 4.478 14.322 5.191 1.00 0.00 C ATOM 1556 C ARG A 124 4.307 15.164 3.933 1.00 0.00 C ATOM 1557 O ARG A 124 3.536 14.816 3.040 1.00 0.00 O ATOM 1558 CB ARG A 124 5.772 13.515 5.086 1.00 0.00 C ATOM 1559 CG ARG A 124 6.026 12.780 6.403 1.00 0.00 C ATOM 1560 CD ARG A 124 7.387 12.089 6.340 1.00 0.00 C ATOM 1561 NE ARG A 124 8.458 13.075 6.423 1.00 0.00 N ATOM 1562 CZ ARG A 124 9.722 12.703 6.599 1.00 0.00 C ATOM 1563 NH1 ARG A 124 10.021 11.437 6.699 1.00 0.00 N ATOM 1564 NH2 ARG A 124 10.664 13.604 6.673 1.00 0.00 N ATOM 0 H ARG A 124 3.107 12.873 4.531 1.00 0.00 H new ATOM 0 HA ARG A 124 4.529 14.980 6.058 1.00 0.00 H new ATOM 0 HB2 ARG A 124 5.701 12.800 4.266 1.00 0.00 H new ATOM 0 HB3 ARG A 124 6.608 14.177 4.860 1.00 0.00 H new ATOM 0 HG2 ARG A 124 6.000 13.483 7.236 1.00 0.00 H new ATOM 0 HG3 ARG A 124 5.240 12.046 6.581 1.00 0.00 H new ATOM 0 HD2 ARG A 124 7.478 11.374 7.157 1.00 0.00 H new ATOM 0 HD3 ARG A 124 7.474 11.525 5.411 1.00 0.00 H new ATOM 0 HE ARG A 124 8.234 14.067 6.345 1.00 0.00 H new ATOM 0 HH11 ARG A 124 9.285 10.733 6.642 1.00 0.00 H new ATOM 0 HH12 ARG A 124 10.991 11.151 6.834 1.00 0.00 H new ATOM 0 HH21 ARG A 124 10.430 14.594 6.596 1.00 0.00 H new ATOM 0 HH22 ARG A 124 11.634 13.318 6.808 1.00 0.00 H new ATOM 1578 N ASP A 125 5.035 16.279 3.869 1.00 0.00 N ATOM 1579 CA ASP A 125 4.963 17.178 2.713 1.00 0.00 C ATOM 1580 C ASP A 125 6.360 17.603 2.272 1.00 0.00 C ATOM 1581 O ASP A 125 7.064 18.302 3.000 1.00 0.00 O ATOM 1582 CB ASP A 125 4.143 18.419 3.071 1.00 0.00 C ATOM 1583 CG ASP A 125 3.960 19.295 1.837 1.00 0.00 C ATOM 1584 OD1 ASP A 125 4.335 18.855 0.762 1.00 0.00 O ATOM 1585 OD2 ASP A 125 3.449 20.393 1.984 1.00 0.00 O ATOM 0 H ASP A 125 5.679 16.582 4.600 1.00 0.00 H new ATOM 0 HA ASP A 125 4.483 16.645 1.892 1.00 0.00 H new ATOM 0 HB2 ASP A 125 3.171 18.122 3.464 1.00 0.00 H new ATOM 0 HB3 ASP A 125 4.646 18.983 3.857 1.00 0.00 H new ATOM 1590 N GLU A 126 6.752 17.178 1.071 1.00 0.00 N ATOM 1591 CA GLU A 126 8.068 17.519 0.526 1.00 0.00 C ATOM 1592 C GLU A 126 7.963 17.860 -0.957 1.00 0.00 C ATOM 1593 O GLU A 126 7.197 17.239 -1.693 1.00 0.00 O ATOM 1594 CB GLU A 126 9.028 16.342 0.711 1.00 0.00 C ATOM 1595 CG GLU A 126 9.183 16.035 2.201 1.00 0.00 C ATOM 1596 CD GLU A 126 10.195 14.911 2.398 1.00 0.00 C ATOM 1597 OE1 GLU A 126 10.584 14.311 1.409 1.00 0.00 O ATOM 1598 OE2 GLU A 126 10.564 14.666 3.534 1.00 0.00 O ATOM 0 H GLU A 126 6.179 16.598 0.457 1.00 0.00 H new ATOM 0 HA GLU A 126 8.448 18.389 1.062 1.00 0.00 H new ATOM 0 HB2 GLU A 126 8.649 15.465 0.186 1.00 0.00 H new ATOM 0 HB3 GLU A 126 9.999 16.580 0.276 1.00 0.00 H new ATOM 0 HG2 GLU A 126 9.511 16.928 2.733 1.00 0.00 H new ATOM 0 HG3 GLU A 126 8.220 15.747 2.624 1.00 0.00 H new ATOM 1605 N ASP A 127 8.744 18.844 -1.389 1.00 0.00 N ATOM 1606 CA ASP A 127 8.741 19.260 -2.789 1.00 0.00 C ATOM 1607 C ASP A 127 7.320 19.514 -3.283 1.00 0.00 C ATOM 1608 O ASP A 127 6.994 19.226 -4.435 1.00 0.00 O ATOM 1609 CB ASP A 127 9.393 18.179 -3.653 1.00 0.00 C ATOM 1610 CG ASP A 127 9.534 18.674 -5.088 1.00 0.00 C ATOM 1611 OD1 ASP A 127 10.510 19.350 -5.367 1.00 0.00 O ATOM 1612 OD2 ASP A 127 8.663 18.371 -5.887 1.00 0.00 O ATOM 0 H ASP A 127 9.385 19.368 -0.793 1.00 0.00 H new ATOM 0 HA ASP A 127 9.307 20.188 -2.868 1.00 0.00 H new ATOM 0 HB2 ASP A 127 10.373 17.922 -3.250 1.00 0.00 H new ATOM 0 HB3 ASP A 127 8.790 17.271 -3.630 1.00 0.00 H new ATOM 1617 N GLY A 128 6.480 20.060 -2.410 1.00 0.00 N ATOM 1618 CA GLY A 128 5.098 20.354 -2.776 1.00 0.00 C ATOM 1619 C GLY A 128 4.287 19.071 -2.927 1.00 0.00 C ATOM 1620 O GLY A 128 3.109 19.109 -3.282 1.00 0.00 O ATOM 0 H GLY A 128 6.728 20.306 -1.452 1.00 0.00 H new ATOM 0 HA2 GLY A 128 4.644 20.988 -2.015 1.00 0.00 H new ATOM 0 HA3 GLY A 128 5.077 20.914 -3.711 1.00 0.00 H new ATOM 1624 N GLN A 129 4.929 17.936 -2.656 1.00 0.00 N ATOM 1625 CA GLN A 129 4.268 16.634 -2.761 1.00 0.00 C ATOM 1626 C GLN A 129 3.869 16.137 -1.372 1.00 0.00 C ATOM 1627 O GLN A 129 4.657 16.210 -0.429 1.00 0.00 O ATOM 1628 CB GLN A 129 5.222 15.626 -3.422 1.00 0.00 C ATOM 1629 CG GLN A 129 4.426 14.487 -4.066 1.00 0.00 C ATOM 1630 CD GLN A 129 3.548 13.800 -3.025 1.00 0.00 C ATOM 1631 OE1 GLN A 129 3.981 13.573 -1.896 1.00 0.00 O ATOM 1632 NE2 GLN A 129 2.331 13.448 -3.341 1.00 0.00 N ATOM 0 H GLN A 129 5.905 17.890 -2.362 1.00 0.00 H new ATOM 0 HA GLN A 129 3.370 16.735 -3.371 1.00 0.00 H new ATOM 0 HB2 GLN A 129 5.827 16.128 -4.177 1.00 0.00 H new ATOM 0 HB3 GLN A 129 5.910 15.223 -2.678 1.00 0.00 H new ATOM 0 HG2 GLN A 129 3.807 14.878 -4.873 1.00 0.00 H new ATOM 0 HG3 GLN A 129 5.109 13.763 -4.511 1.00 0.00 H new ATOM 0 HE21 GLN A 129 1.972 13.636 -4.277 1.00 0.00 H new ATOM 0 HE22 GLN A 129 1.739 12.985 -2.652 1.00 0.00 H new ATOM 1641 N VAL A 130 2.640 15.635 -1.250 1.00 0.00 N ATOM 1642 CA VAL A 130 2.144 15.132 0.034 1.00 0.00 C ATOM 1643 C VAL A 130 2.094 13.608 0.029 1.00 0.00 C ATOM 1644 O VAL A 130 1.547 12.998 -0.889 1.00 0.00 O ATOM 1645 CB VAL A 130 0.743 15.685 0.298 1.00 0.00 C ATOM 1646 CG1 VAL A 130 0.264 15.228 1.678 1.00 0.00 C ATOM 1647 CG2 VAL A 130 0.785 17.214 0.253 1.00 0.00 C ATOM 0 H VAL A 130 1.973 15.565 -2.018 1.00 0.00 H new ATOM 0 HA VAL A 130 2.824 15.460 0.821 1.00 0.00 H new ATOM 0 HB VAL A 130 0.056 15.316 -0.464 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.735 15.623 1.866 1.00 0.00 H new ATOM 0 HG12 VAL A 130 0.236 14.139 1.711 1.00 0.00 H new ATOM 0 HG13 VAL A 130 0.949 15.597 2.441 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -0.213 17.611 0.441 1.00 0.00 H new ATOM 0 HG22 VAL A 130 1.471 17.582 1.016 1.00 0.00 H new ATOM 0 HG23 VAL A 130 1.126 17.540 -0.730 1.00 0.00 H new ATOM 1657 N TYR A 131 2.664 13.002 1.070 1.00 0.00 N ATOM 1658 CA TYR A 131 2.685 11.542 1.199 1.00 0.00 C ATOM 1659 C TYR A 131 1.956 11.119 2.470 1.00 0.00 C ATOM 1660 O TYR A 131 2.254 11.615 3.556 1.00 0.00 O ATOM 1661 CB TYR A 131 4.133 11.048 1.273 1.00 0.00 C ATOM 1662 CG TYR A 131 4.923 11.578 0.099 1.00 0.00 C ATOM 1663 CD1 TYR A 131 4.954 10.867 -1.106 1.00 0.00 C ATOM 1664 CD2 TYR A 131 5.629 12.782 0.220 1.00 0.00 C ATOM 1665 CE1 TYR A 131 5.692 11.359 -2.191 1.00 0.00 C ATOM 1666 CE2 TYR A 131 6.366 13.274 -0.865 1.00 0.00 C ATOM 1667 CZ TYR A 131 6.398 12.563 -2.070 1.00 0.00 C ATOM 1668 OH TYR A 131 7.125 13.047 -3.139 1.00 0.00 O ATOM 0 H TYR A 131 3.118 13.498 1.837 1.00 0.00 H new ATOM 0 HA TYR A 131 2.189 11.108 0.330 1.00 0.00 H new ATOM 0 HB2 TYR A 131 4.590 11.376 2.207 1.00 0.00 H new ATOM 0 HB3 TYR A 131 4.154 9.958 1.273 1.00 0.00 H new ATOM 0 HD1 TYR A 131 4.409 9.939 -1.200 1.00 0.00 H new ATOM 0 HD2 TYR A 131 5.605 13.331 1.150 1.00 0.00 H new ATOM 0 HE1 TYR A 131 5.716 10.810 -3.121 1.00 0.00 H new ATOM 0 HE2 TYR A 131 6.910 14.202 -0.772 1.00 0.00 H new ATOM 0 HH TYR A 131 6.858 12.576 -3.956 1.00 0.00 H new ATOM 1678 N TYR A 132 1.006 10.191 2.336 1.00 0.00 N ATOM 1679 CA TYR A 132 0.244 9.694 3.489 1.00 0.00 C ATOM 1680 C TYR A 132 0.711 8.281 3.831 1.00 0.00 C ATOM 1681 O TYR A 132 0.786 7.416 2.958 1.00 0.00 O ATOM 1682 CB TYR A 132 -1.269 9.678 3.160 1.00 0.00 C ATOM 1683 CG TYR A 132 -1.937 10.970 3.598 1.00 0.00 C ATOM 1684 CD1 TYR A 132 -1.268 12.194 3.481 1.00 0.00 C ATOM 1685 CD2 TYR A 132 -3.237 10.935 4.122 1.00 0.00 C ATOM 1686 CE1 TYR A 132 -1.895 13.379 3.887 1.00 0.00 C ATOM 1687 CE2 TYR A 132 -3.863 12.119 4.528 1.00 0.00 C ATOM 1688 CZ TYR A 132 -3.192 13.342 4.410 1.00 0.00 C ATOM 1689 OH TYR A 132 -3.810 14.510 4.809 1.00 0.00 O ATOM 0 H TYR A 132 0.745 9.768 1.445 1.00 0.00 H new ATOM 0 HA TYR A 132 0.412 10.352 4.341 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.410 9.537 2.088 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -1.744 8.832 3.658 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -0.267 12.225 3.077 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -3.756 9.992 4.213 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -1.377 14.322 3.796 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -4.864 12.089 4.932 1.00 0.00 H new ATOM 0 HH TYR A 132 -4.771 14.351 4.919 1.00 0.00 H new ATOM 1699 N THR A 133 1.020 8.052 5.107 1.00 0.00 N ATOM 1700 CA THR A 133 1.477 6.738 5.559 1.00 0.00 C ATOM 1701 C THR A 133 0.439 6.096 6.470 1.00 0.00 C ATOM 1702 O THR A 133 0.067 6.661 7.498 1.00 0.00 O ATOM 1703 CB THR A 133 2.796 6.880 6.321 1.00 0.00 C ATOM 1704 OG1 THR A 133 3.757 7.513 5.488 1.00 0.00 O ATOM 1705 CG2 THR A 133 3.301 5.496 6.730 1.00 0.00 C ATOM 0 H THR A 133 0.963 8.756 5.843 1.00 0.00 H new ATOM 0 HA THR A 133 1.624 6.105 4.684 1.00 0.00 H new ATOM 0 HB THR A 133 2.638 7.484 7.214 1.00 0.00 H new ATOM 0 HG1 THR A 133 4.602 7.606 5.976 1.00 0.00 H new ATOM 0 HG21 THR A 133 4.241 5.597 7.273 1.00 0.00 H new ATOM 0 HG22 THR A 133 2.562 5.014 7.370 1.00 0.00 H new ATOM 0 HG23 THR A 133 3.460 4.889 5.839 1.00 0.00 H new ATOM 1713 N LEU A 134 -0.014 4.903 6.088 1.00 0.00 N ATOM 1714 CA LEU A 134 -1.006 4.162 6.871 1.00 0.00 C ATOM 1715 C LEU A 134 -0.402 2.858 7.380 1.00 0.00 C ATOM 1716 O LEU A 134 0.087 2.042 6.599 1.00 0.00 O ATOM 1717 CB LEU A 134 -2.244 3.856 6.000 1.00 0.00 C ATOM 1718 CG LEU A 134 -3.316 4.937 6.180 1.00 0.00 C ATOM 1719 CD1 LEU A 134 -2.751 6.307 5.805 1.00 0.00 C ATOM 1720 CD2 LEU A 134 -4.511 4.607 5.281 1.00 0.00 C ATOM 0 H LEU A 134 0.290 4.426 5.239 1.00 0.00 H new ATOM 0 HA LEU A 134 -1.308 4.772 7.722 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -1.952 3.798 4.952 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -2.653 2.883 6.271 1.00 0.00 H new ATOM 0 HG LEU A 134 -3.633 4.964 7.223 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -3.521 7.067 5.937 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -1.900 6.538 6.446 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -2.428 6.295 4.764 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -5.279 5.371 5.402 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -4.187 4.580 4.241 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -4.918 3.635 5.560 1.00 0.00 H new ATOM 1732 N GLU A 135 -0.466 2.663 8.692 1.00 0.00 N ATOM 1733 CA GLU A 135 0.053 1.442 9.315 1.00 0.00 C ATOM 1734 C GLU A 135 -1.094 0.691 9.978 1.00 0.00 C ATOM 1735 O GLU A 135 -1.806 1.244 10.816 1.00 0.00 O ATOM 1736 CB GLU A 135 1.110 1.796 10.365 1.00 0.00 C ATOM 1737 CG GLU A 135 1.792 0.516 10.851 1.00 0.00 C ATOM 1738 CD GLU A 135 2.762 0.840 11.983 1.00 0.00 C ATOM 1739 OE1 GLU A 135 2.868 2.005 12.330 1.00 0.00 O ATOM 1740 OE2 GLU A 135 3.386 -0.081 12.484 1.00 0.00 O ATOM 0 H GLU A 135 -0.871 3.331 9.348 1.00 0.00 H new ATOM 0 HA GLU A 135 0.511 0.815 8.550 1.00 0.00 H new ATOM 0 HB2 GLU A 135 1.848 2.475 9.939 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.646 2.315 11.204 1.00 0.00 H new ATOM 0 HG2 GLU A 135 1.043 -0.197 11.196 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.326 0.043 10.027 1.00 0.00 H new ATOM 1747 N TYR A 136 -1.278 -0.567 9.594 1.00 0.00 N ATOM 1748 CA TYR A 136 -2.357 -1.376 10.155 1.00 0.00 C ATOM 1749 C TYR A 136 -1.992 -2.857 10.141 1.00 0.00 C ATOM 1750 O TYR A 136 -1.068 -3.269 9.441 1.00 0.00 O ATOM 1751 CB TYR A 136 -3.642 -1.146 9.346 1.00 0.00 C ATOM 1752 CG TYR A 136 -3.510 -1.757 7.970 1.00 0.00 C ATOM 1753 CD1 TYR A 136 -2.999 -0.996 6.911 1.00 0.00 C ATOM 1754 CD2 TYR A 136 -3.907 -3.082 7.752 1.00 0.00 C ATOM 1755 CE1 TYR A 136 -2.886 -1.561 5.635 1.00 0.00 C ATOM 1756 CE2 TYR A 136 -3.792 -3.647 6.475 1.00 0.00 C ATOM 1757 CZ TYR A 136 -3.281 -2.885 5.417 1.00 0.00 C ATOM 1758 OH TYR A 136 -3.169 -3.440 4.158 1.00 0.00 O ATOM 0 H TYR A 136 -0.701 -1.047 8.903 1.00 0.00 H new ATOM 0 HA TYR A 136 -2.516 -1.075 11.191 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -4.492 -1.586 9.867 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -3.840 -0.078 9.260 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -2.692 0.026 7.079 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -4.302 -3.669 8.568 1.00 0.00 H new ATOM 0 HE1 TYR A 136 -2.493 -0.974 4.818 1.00 0.00 H new ATOM 0 HE2 TYR A 136 -4.097 -4.669 6.307 1.00 0.00 H new ATOM 0 HH TYR A 136 -2.232 -3.419 3.873 1.00 0.00 H new ATOM 1768 N ARG A 137 -2.733 -3.659 10.913 1.00 0.00 N ATOM 1769 CA ARG A 137 -2.489 -5.103 10.975 1.00 0.00 C ATOM 1770 C ARG A 137 -3.776 -5.864 10.683 1.00 0.00 C ATOM 1771 O ARG A 137 -4.873 -5.330 10.840 1.00 0.00 O ATOM 1772 CB ARG A 137 -1.957 -5.494 12.357 1.00 0.00 C ATOM 1773 CG ARG A 137 -3.022 -5.219 13.419 1.00 0.00 C ATOM 1774 CD ARG A 137 -2.419 -5.423 14.810 1.00 0.00 C ATOM 1775 NE ARG A 137 -3.455 -5.314 15.830 1.00 0.00 N ATOM 1776 CZ ARG A 137 -3.177 -5.514 17.116 1.00 0.00 C ATOM 1777 NH1 ARG A 137 -1.959 -5.809 17.483 1.00 0.00 N ATOM 1778 NH2 ARG A 137 -4.122 -5.415 18.010 1.00 0.00 N ATOM 0 H ARG A 137 -3.502 -3.335 11.500 1.00 0.00 H new ATOM 0 HA ARG A 137 -1.743 -5.362 10.224 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -1.685 -6.549 12.367 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -1.052 -4.929 12.582 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -3.396 -4.200 13.319 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -3.872 -5.886 13.278 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -1.943 -6.402 14.868 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -1.642 -4.680 14.990 1.00 0.00 H new ATOM 0 HE ARG A 137 -4.409 -5.081 15.553 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -1.220 -5.886 16.784 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -1.746 -5.962 18.469 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -5.073 -5.184 17.723 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -3.910 -5.568 18.996 1.00 0.00 H new ATOM 1792 N VAL A 138 -3.632 -7.113 10.241 1.00 0.00 N ATOM 1793 CA VAL A 138 -4.787 -7.946 9.908 1.00 0.00 C ATOM 1794 C VAL A 138 -5.031 -8.997 10.984 1.00 0.00 C ATOM 1795 O VAL A 138 -4.114 -9.708 11.394 1.00 0.00 O ATOM 1796 CB VAL A 138 -4.537 -8.644 8.573 1.00 0.00 C ATOM 1797 CG1 VAL A 138 -5.777 -9.442 8.174 1.00 0.00 C ATOM 1798 CG2 VAL A 138 -4.234 -7.594 7.502 1.00 0.00 C ATOM 0 H VAL A 138 -2.730 -7.569 10.106 1.00 0.00 H new ATOM 0 HA VAL A 138 -5.667 -7.306 9.842 1.00 0.00 H new ATOM 0 HB VAL A 138 -3.689 -9.322 8.668 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -5.598 -9.940 7.221 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -5.991 -10.188 8.939 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -6.628 -8.768 8.077 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -4.055 -8.089 6.548 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -5.083 -6.917 7.406 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -3.348 -7.027 7.788 1.00 0.00 H new ATOM 1808 N LEU A 139 -6.283 -9.091 11.435 1.00 0.00 N ATOM 1809 CA LEU A 139 -6.665 -10.062 12.465 1.00 0.00 C ATOM 1810 C LEU A 139 -7.586 -11.131 11.889 1.00 0.00 C ATOM 1811 O LEU A 139 -8.642 -10.827 11.335 1.00 0.00 O ATOM 1812 CB LEU A 139 -7.381 -9.340 13.620 1.00 0.00 C ATOM 1813 CG LEU A 139 -6.347 -8.705 14.579 1.00 0.00 C ATOM 1814 CD1 LEU A 139 -6.937 -7.458 15.242 1.00 0.00 C ATOM 1815 CD2 LEU A 139 -5.971 -9.714 15.672 1.00 0.00 C ATOM 0 H LEU A 139 -7.051 -8.507 11.104 1.00 0.00 H new ATOM 0 HA LEU A 139 -5.759 -10.543 12.834 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -8.040 -8.568 13.222 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -8.008 -10.045 14.166 1.00 0.00 H new ATOM 0 HG LEU A 139 -5.463 -8.428 14.005 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.200 -7.020 15.915 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -7.206 -6.731 14.476 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -7.826 -7.734 15.809 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -5.242 -9.265 16.347 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -6.863 -9.991 16.234 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.540 -10.604 15.213 1.00 0.00 H new ATOM 1827 N VAL A 140 -7.190 -12.386 12.064 1.00 0.00 N ATOM 1828 CA VAL A 140 -7.986 -13.522 11.607 1.00 0.00 C ATOM 1829 C VAL A 140 -8.260 -14.424 12.798 1.00 0.00 C ATOM 1830 O VAL A 140 -7.345 -14.773 13.543 1.00 0.00 O ATOM 1831 CB VAL A 140 -7.239 -14.302 10.523 1.00 0.00 C ATOM 1832 CG1 VAL A 140 -8.035 -15.561 10.164 1.00 0.00 C ATOM 1833 CG2 VAL A 140 -7.092 -13.424 9.276 1.00 0.00 C ATOM 0 H VAL A 140 -6.316 -12.645 12.522 1.00 0.00 H new ATOM 0 HA VAL A 140 -8.923 -13.164 11.180 1.00 0.00 H new ATOM 0 HB VAL A 140 -6.253 -14.584 10.891 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -7.505 -16.119 9.392 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -8.147 -16.186 11.050 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -9.020 -15.276 9.794 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -6.560 -13.977 8.502 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -8.080 -13.145 8.909 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -6.531 -12.524 9.529 1.00 0.00 H new ATOM 1843 N GLY A 141 -9.517 -14.781 12.992 1.00 0.00 N ATOM 1844 CA GLY A 141 -9.875 -15.621 14.124 1.00 0.00 C ATOM 1845 C GLY A 141 -9.659 -14.858 15.428 1.00 0.00 C ATOM 1846 O GLY A 141 -10.245 -13.796 15.637 1.00 0.00 O ATOM 0 H GLY A 141 -10.296 -14.509 12.393 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -10.917 -15.931 14.043 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -9.271 -16.528 14.120 1.00 0.00 H new ATOM 1850 N ASP A 142 -8.816 -15.406 16.306 1.00 0.00 N ATOM 1851 CA ASP A 142 -8.526 -14.771 17.599 1.00 0.00 C ATOM 1852 C ASP A 142 -7.053 -14.362 17.715 1.00 0.00 C ATOM 1853 O ASP A 142 -6.539 -14.214 18.824 1.00 0.00 O ATOM 1854 CB ASP A 142 -8.870 -15.739 18.733 1.00 0.00 C ATOM 1855 CG ASP A 142 -10.375 -15.985 18.768 1.00 0.00 C ATOM 1856 OD1 ASP A 142 -11.089 -15.261 18.094 1.00 0.00 O ATOM 1857 OD2 ASP A 142 -10.790 -16.894 19.467 1.00 0.00 O ATOM 0 H ASP A 142 -8.323 -16.285 16.149 1.00 0.00 H new ATOM 0 HA ASP A 142 -9.134 -13.869 17.670 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -8.342 -16.682 18.591 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -8.538 -15.328 19.686 1.00 0.00 H new ATOM 1862 N ASN A 143 -6.368 -14.187 16.581 1.00 0.00 N ATOM 1863 CA ASN A 143 -4.949 -13.802 16.612 1.00 0.00 C ATOM 1864 C ASN A 143 -4.577 -12.940 15.408 1.00 0.00 C ATOM 1865 O ASN A 143 -5.284 -12.921 14.400 1.00 0.00 O ATOM 1866 CB ASN A 143 -4.071 -15.055 16.624 1.00 0.00 C ATOM 1867 CG ASN A 143 -4.375 -15.894 17.861 1.00 0.00 C ATOM 1868 OD1 ASN A 143 -4.274 -15.356 19.045 1.00 0.00 O flip ATOM 1869 ND2 ASN A 143 -4.709 -17.073 17.745 1.00 0.00 N flip ATOM 0 H ASN A 143 -6.761 -14.302 15.647 1.00 0.00 H new ATOM 0 HA ASN A 143 -4.782 -13.219 17.518 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -4.249 -15.642 15.723 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -3.019 -14.772 16.617 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -4.787 -17.492 16.818 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -4.907 -17.631 18.576 1.00 0.00 H new ATOM 1876 N VAL A 144 -3.454 -12.230 15.523 1.00 0.00 N ATOM 1877 CA VAL A 144 -2.983 -11.370 14.440 1.00 0.00 C ATOM 1878 C VAL A 144 -2.467 -12.215 13.281 1.00 0.00 C ATOM 1879 O VAL A 144 -1.592 -13.060 13.463 1.00 0.00 O ATOM 1880 CB VAL A 144 -1.847 -10.471 14.942 1.00 0.00 C ATOM 1881 CG1 VAL A 144 -1.401 -9.537 13.814 1.00 0.00 C ATOM 1882 CG2 VAL A 144 -2.320 -9.636 16.143 1.00 0.00 C ATOM 0 H VAL A 144 -2.858 -12.234 16.350 1.00 0.00 H new ATOM 0 HA VAL A 144 -3.817 -10.756 14.100 1.00 0.00 H new ATOM 0 HB VAL A 144 -1.011 -11.097 15.254 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -0.593 -8.897 14.169 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -1.050 -10.129 12.969 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -2.242 -8.919 13.500 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -1.504 -9.002 16.490 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -3.162 -9.012 15.843 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -2.630 -10.301 16.949 1.00 0.00 H new ATOM 1892 N GLU A 145 -3.000 -11.976 12.087 1.00 0.00 N ATOM 1893 CA GLU A 145 -2.563 -12.724 10.915 1.00 0.00 C ATOM 1894 C GLU A 145 -1.182 -12.249 10.478 1.00 0.00 C ATOM 1895 O GLU A 145 -0.259 -13.047 10.321 1.00 0.00 O ATOM 1896 CB GLU A 145 -3.562 -12.534 9.773 1.00 0.00 C ATOM 1897 CG GLU A 145 -3.197 -13.456 8.606 1.00 0.00 C ATOM 1898 CD GLU A 145 -4.124 -13.187 7.425 1.00 0.00 C ATOM 1899 OE1 GLU A 145 -4.934 -12.281 7.529 1.00 0.00 O ATOM 1900 OE2 GLU A 145 -4.012 -13.891 6.435 1.00 0.00 O ATOM 0 H GLU A 145 -3.724 -11.281 11.907 1.00 0.00 H new ATOM 0 HA GLU A 145 -2.510 -13.782 11.171 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -4.572 -12.754 10.120 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -3.558 -11.495 9.443 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -2.161 -13.292 8.311 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -3.279 -14.498 8.915 1.00 0.00 H new ATOM 1907 N ARG A 146 -1.049 -10.939 10.290 1.00 0.00 N ATOM 1908 CA ARG A 146 0.224 -10.363 9.878 1.00 0.00 C ATOM 1909 C ARG A 146 0.161 -8.840 9.915 1.00 0.00 C ATOM 1910 O ARG A 146 -0.910 -8.257 10.077 1.00 0.00 O ATOM 1911 CB ARG A 146 0.588 -10.832 8.467 1.00 0.00 C ATOM 1912 CG ARG A 146 -0.463 -10.341 7.468 1.00 0.00 C ATOM 1913 CD ARG A 146 -0.156 -10.917 6.086 1.00 0.00 C ATOM 1914 NE ARG A 146 -0.363 -12.364 6.081 1.00 0.00 N ATOM 1915 CZ ARG A 146 -1.550 -12.897 5.800 1.00 0.00 C ATOM 1916 NH1 ARG A 146 -2.567 -12.125 5.526 1.00 0.00 N ATOM 1917 NH2 ARG A 146 -1.697 -14.193 5.800 1.00 0.00 N ATOM 0 H ARG A 146 -1.802 -10.262 10.416 1.00 0.00 H new ATOM 0 HA ARG A 146 0.992 -10.700 10.575 1.00 0.00 H new ATOM 0 HB2 ARG A 146 1.571 -10.452 8.190 1.00 0.00 H new ATOM 0 HB3 ARG A 146 0.648 -11.920 8.440 1.00 0.00 H new ATOM 0 HG2 ARG A 146 -1.458 -10.648 7.790 1.00 0.00 H new ATOM 0 HG3 ARG A 146 -0.463 -9.252 7.429 1.00 0.00 H new ATOM 0 HD2 ARG A 146 -0.797 -10.449 5.339 1.00 0.00 H new ATOM 0 HD3 ARG A 146 0.874 -10.689 5.810 1.00 0.00 H new ATOM 0 HE ARG A 146 0.421 -12.980 6.298 1.00 0.00 H new ATOM 0 HH11 ARG A 146 -2.453 -11.111 5.527 1.00 0.00 H new ATOM 0 HH12 ARG A 146 -3.476 -12.536 5.311 1.00 0.00 H new ATOM 0 HH21 ARG A 146 -0.903 -14.796 6.015 1.00 0.00 H new ATOM 0 HH22 ARG A 146 -2.606 -14.603 5.585 1.00 0.00 H new ATOM 1931 N HIS A 147 1.318 -8.202 9.751 1.00 0.00 N ATOM 1932 CA HIS A 147 1.400 -6.741 9.753 1.00 0.00 C ATOM 1933 C HIS A 147 1.594 -6.228 8.332 1.00 0.00 C ATOM 1934 O HIS A 147 2.350 -6.807 7.552 1.00 0.00 O ATOM 1935 CB HIS A 147 2.573 -6.284 10.622 1.00 0.00 C ATOM 1936 CG HIS A 147 2.262 -6.551 12.068 1.00 0.00 C ATOM 1937 ND1 HIS A 147 2.561 -7.759 12.679 1.00 0.00 N ATOM 1938 CD2 HIS A 147 1.679 -5.774 13.039 1.00 0.00 C ATOM 1939 CE1 HIS A 147 2.161 -7.675 13.961 1.00 0.00 C ATOM 1940 NE2 HIS A 147 1.617 -6.485 14.233 1.00 0.00 N ATOM 0 H HIS A 147 2.212 -8.673 9.615 1.00 0.00 H new ATOM 0 HA HIS A 147 0.472 -6.339 10.159 1.00 0.00 H new ATOM 0 HB2 HIS A 147 3.481 -6.812 10.331 1.00 0.00 H new ATOM 0 HB3 HIS A 147 2.759 -5.221 10.470 1.00 0.00 H new ATOM 0 HD2 HIS A 147 1.323 -4.764 12.897 1.00 0.00 H new ATOM 0 HE1 HIS A 147 2.267 -8.472 14.682 1.00 0.00 H new ATOM 0 HE2 HIS A 147 1.238 -6.166 15.125 1.00 0.00 H new ATOM 1949 N ASP A 148 0.904 -5.139 7.997 1.00 0.00 N ATOM 1950 CA ASP A 148 1.004 -4.555 6.659 1.00 0.00 C ATOM 1951 C ASP A 148 1.138 -3.042 6.745 1.00 0.00 C ATOM 1952 O ASP A 148 0.588 -2.404 7.643 1.00 0.00 O ATOM 1953 CB ASP A 148 -0.241 -4.896 5.841 1.00 0.00 C ATOM 1954 CG ASP A 148 -0.006 -4.581 4.367 1.00 0.00 C ATOM 1955 OD1 ASP A 148 -0.235 -3.446 3.981 1.00 0.00 O ATOM 1956 OD2 ASP A 148 0.399 -5.478 3.647 1.00 0.00 O ATOM 0 H ASP A 148 0.273 -4.645 8.629 1.00 0.00 H new ATOM 0 HA ASP A 148 1.888 -4.969 6.174 1.00 0.00 H new ATOM 0 HB2 ASP A 148 -0.485 -5.952 5.960 1.00 0.00 H new ATOM 0 HB3 ASP A 148 -1.095 -4.327 6.210 1.00 0.00 H new ATOM 1961 N LEU A 149 1.867 -2.479 5.792 1.00 0.00 N ATOM 1962 CA LEU A 149 2.083 -1.031 5.723 1.00 0.00 C ATOM 1963 C LEU A 149 1.615 -0.510 4.372 1.00 0.00 C ATOM 1964 O LEU A 149 2.061 -0.986 3.328 1.00 0.00 O ATOM 1965 CB LEU A 149 3.576 -0.722 5.919 1.00 0.00 C ATOM 1966 CG LEU A 149 3.841 0.794 5.897 1.00 0.00 C ATOM 1967 CD1 LEU A 149 3.361 1.443 7.202 1.00 0.00 C ATOM 1968 CD2 LEU A 149 5.345 1.035 5.741 1.00 0.00 C ATOM 0 H LEU A 149 2.325 -3.004 5.047 1.00 0.00 H new ATOM 0 HA LEU A 149 1.512 -0.540 6.511 1.00 0.00 H new ATOM 0 HB2 LEU A 149 3.914 -1.139 6.868 1.00 0.00 H new ATOM 0 HB3 LEU A 149 4.156 -1.206 5.133 1.00 0.00 H new ATOM 0 HG LEU A 149 3.297 1.237 5.063 1.00 0.00 H new ATOM 0 HD11 LEU A 149 3.556 2.515 7.169 1.00 0.00 H new ATOM 0 HD12 LEU A 149 2.291 1.273 7.321 1.00 0.00 H new ATOM 0 HD13 LEU A 149 3.894 1.003 8.045 1.00 0.00 H new ATOM 0 HD21 LEU A 149 5.542 2.107 5.724 1.00 0.00 H new ATOM 0 HD22 LEU A 149 5.875 0.582 6.579 1.00 0.00 H new ATOM 0 HD23 LEU A 149 5.690 0.588 4.809 1.00 0.00 H new ATOM 1980 N ALA A 150 0.722 0.476 4.397 1.00 0.00 N ATOM 1981 CA ALA A 150 0.204 1.069 3.163 1.00 0.00 C ATOM 1982 C ALA A 150 0.444 2.571 3.160 1.00 0.00 C ATOM 1983 O ALA A 150 0.195 3.253 4.154 1.00 0.00 O ATOM 1984 CB ALA A 150 -1.295 0.796 3.036 1.00 0.00 C ATOM 0 H ALA A 150 0.342 0.881 5.253 1.00 0.00 H new ATOM 0 HA ALA A 150 0.726 0.619 2.319 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -1.669 1.242 2.114 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -1.468 -0.280 3.015 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -1.818 1.231 3.888 1.00 0.00 H new ATOM 1990 N SER A 151 0.922 3.080 2.029 1.00 0.00 N ATOM 1991 CA SER A 151 1.191 4.509 1.879 1.00 0.00 C ATOM 1992 C SER A 151 0.399 5.047 0.699 1.00 0.00 C ATOM 1993 O SER A 151 0.369 4.428 -0.360 1.00 0.00 O ATOM 1994 CB SER A 151 2.684 4.734 1.644 1.00 0.00 C ATOM 1995 OG SER A 151 2.945 6.130 1.571 1.00 0.00 O ATOM 0 H SER A 151 1.132 2.524 1.200 1.00 0.00 H new ATOM 0 HA SER A 151 0.893 5.032 2.788 1.00 0.00 H new ATOM 0 HB2 SER A 151 3.262 4.286 2.452 1.00 0.00 H new ATOM 0 HB3 SER A 151 2.996 4.246 0.721 1.00 0.00 H new ATOM 0 HG SER A 151 2.249 6.619 2.058 1.00 0.00 H new ATOM 2001 N VAL A 152 -0.252 6.194 0.889 1.00 0.00 N ATOM 2002 CA VAL A 152 -1.057 6.801 -0.175 1.00 0.00 C ATOM 2003 C VAL A 152 -0.455 8.126 -0.621 1.00 0.00 C ATOM 2004 O VAL A 152 -0.147 8.992 0.196 1.00 0.00 O ATOM 2005 CB VAL A 152 -2.483 7.029 0.329 1.00 0.00 C ATOM 2006 CG1 VAL A 152 -3.328 7.637 -0.792 1.00 0.00 C ATOM 2007 CG2 VAL A 152 -3.089 5.691 0.757 1.00 0.00 C ATOM 0 H VAL A 152 -0.240 6.720 1.763 1.00 0.00 H new ATOM 0 HA VAL A 152 -1.071 6.123 -1.029 1.00 0.00 H new ATOM 0 HB VAL A 152 -2.465 7.710 1.180 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -4.345 7.800 -0.434 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -2.895 8.589 -1.099 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -3.348 6.956 -1.643 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -4.105 5.850 1.117 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -3.108 5.011 -0.095 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -2.486 5.257 1.554 1.00 0.00 H new ATOM 2017 N THR A 153 -0.292 8.275 -1.933 1.00 0.00 N ATOM 2018 CA THR A 153 0.272 9.495 -2.505 1.00 0.00 C ATOM 2019 C THR A 153 -0.412 9.818 -3.828 1.00 0.00 C ATOM 2020 O THR A 153 -0.730 8.918 -4.606 1.00 0.00 O ATOM 2021 CB THR A 153 1.774 9.311 -2.729 1.00 0.00 C ATOM 2022 OG1 THR A 153 2.365 8.828 -1.531 1.00 0.00 O ATOM 2023 CG2 THR A 153 2.412 10.650 -3.110 1.00 0.00 C ATOM 0 H THR A 153 -0.543 7.565 -2.621 1.00 0.00 H new ATOM 0 HA THR A 153 0.109 10.321 -1.813 1.00 0.00 H new ATOM 0 HB THR A 153 1.937 8.597 -3.537 1.00 0.00 H new ATOM 0 HG1 THR A 153 2.644 7.897 -1.656 1.00 0.00 H new ATOM 0 HG21 THR A 153 3.482 10.512 -3.268 1.00 0.00 H new ATOM 0 HG22 THR A 153 1.955 11.023 -4.027 1.00 0.00 H new ATOM 0 HG23 THR A 153 2.254 11.370 -2.307 1.00 0.00 H new ATOM 2031 N THR A 154 -0.627 11.107 -4.087 1.00 0.00 N ATOM 2032 CA THR A 154 -1.267 11.541 -5.331 1.00 0.00 C ATOM 2033 C THR A 154 -0.246 12.209 -6.243 1.00 0.00 C ATOM 2034 O THR A 154 0.715 12.819 -5.773 1.00 0.00 O ATOM 2035 CB THR A 154 -2.398 12.526 -5.022 1.00 0.00 C ATOM 2036 OG1 THR A 154 -1.945 13.486 -4.078 1.00 0.00 O ATOM 2037 CG2 THR A 154 -3.597 11.768 -4.457 1.00 0.00 C ATOM 0 H THR A 154 -0.370 11.867 -3.457 1.00 0.00 H new ATOM 0 HA THR A 154 -1.678 10.666 -5.835 1.00 0.00 H new ATOM 0 HB THR A 154 -2.697 13.036 -5.938 1.00 0.00 H new ATOM 0 HG1 THR A 154 -2.668 14.118 -3.881 1.00 0.00 H new ATOM 0 HG21 THR A 154 -4.401 12.470 -4.238 1.00 0.00 H new ATOM 0 HG22 THR A 154 -3.943 11.037 -5.188 1.00 0.00 H new ATOM 0 HG23 THR A 154 -3.304 11.254 -3.541 1.00 0.00 H new ATOM 2045 N ASN A 155 -0.461 12.090 -7.551 1.00 0.00 N ATOM 2046 CA ASN A 155 0.449 12.687 -8.528 1.00 0.00 C ATOM 2047 C ASN A 155 -0.311 13.129 -9.774 1.00 0.00 C ATOM 2048 O ASN A 155 -0.724 12.301 -10.585 1.00 0.00 O ATOM 2049 CB ASN A 155 1.529 11.676 -8.922 1.00 0.00 C ATOM 2050 CG ASN A 155 2.673 12.386 -9.639 1.00 0.00 C ATOM 2051 OD1 ASN A 155 3.479 11.699 -10.402 1.00 0.00 O flip ATOM 2052 ND2 ASN A 155 2.837 13.599 -9.499 1.00 0.00 N flip ATOM 0 H ASN A 155 -1.251 11.590 -7.958 1.00 0.00 H new ATOM 0 HA ASN A 155 0.915 13.561 -8.072 1.00 0.00 H new ATOM 0 HB2 ASN A 155 1.905 11.169 -8.034 1.00 0.00 H new ATOM 0 HB3 ASN A 155 1.103 10.910 -9.570 1.00 0.00 H new ATOM 0 HD21 ASN A 155 2.206 14.133 -8.902 1.00 0.00 H new ATOM 0 HD22 ASN A 155 3.604 14.069 -9.980 1.00 0.00 H new ATOM 2059 N ARG A 156 -0.481 14.437 -9.923 1.00 0.00 N ATOM 2060 CA ARG A 156 -1.183 14.984 -11.080 1.00 0.00 C ATOM 2061 C ARG A 156 -2.595 14.410 -11.182 1.00 0.00 C ATOM 2062 O ARG A 156 -3.131 14.255 -12.279 1.00 0.00 O ATOM 2063 CB ARG A 156 -0.409 14.663 -12.367 1.00 0.00 C ATOM 2064 CG ARG A 156 1.044 15.156 -12.260 1.00 0.00 C ATOM 2065 CD ARG A 156 1.120 16.655 -12.567 1.00 0.00 C ATOM 2066 NE ARG A 156 0.581 16.925 -13.895 1.00 0.00 N ATOM 2067 CZ ARG A 156 0.283 18.162 -14.280 1.00 0.00 C ATOM 2068 NH1 ARG A 156 0.471 19.164 -13.465 1.00 0.00 N ATOM 2069 NH2 ARG A 156 -0.196 18.374 -15.475 1.00 0.00 N ATOM 0 H ARG A 156 -0.145 15.137 -9.261 1.00 0.00 H new ATOM 0 HA ARG A 156 -1.251 16.065 -10.954 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -0.422 13.588 -12.547 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -0.897 15.135 -13.219 1.00 0.00 H new ATOM 0 HG2 ARG A 156 1.428 14.963 -11.258 1.00 0.00 H new ATOM 0 HG3 ARG A 156 1.675 14.603 -12.955 1.00 0.00 H new ATOM 0 HD2 ARG A 156 0.560 17.216 -11.818 1.00 0.00 H new ATOM 0 HD3 ARG A 156 2.155 16.993 -12.511 1.00 0.00 H new ATOM 0 HE ARG A 156 0.430 16.150 -14.541 1.00 0.00 H new ATOM 0 HH11 ARG A 156 0.847 18.998 -12.531 1.00 0.00 H new ATOM 0 HH12 ARG A 156 0.242 20.113 -13.762 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -0.341 17.591 -16.112 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -0.425 19.323 -15.772 1.00 0.00 H new ATOM 2083 N GLY A 157 -3.194 14.106 -10.032 1.00 0.00 N ATOM 2084 CA GLY A 157 -4.551 13.560 -10.003 1.00 0.00 C ATOM 2085 C GLY A 157 -4.539 12.037 -10.075 1.00 0.00 C ATOM 2086 O GLY A 157 -5.592 11.404 -10.149 1.00 0.00 O ATOM 0 H GLY A 157 -2.766 14.227 -9.114 1.00 0.00 H new ATOM 0 HA2 GLY A 157 -5.054 13.879 -9.090 1.00 0.00 H new ATOM 0 HA3 GLY A 157 -5.124 13.961 -10.839 1.00 0.00 H new ATOM 2090 N LYS A 158 -3.345 11.449 -10.049 1.00 0.00 N ATOM 2091 CA LYS A 158 -3.213 9.992 -10.108 1.00 0.00 C ATOM 2092 C LYS A 158 -3.078 9.426 -8.699 1.00 0.00 C ATOM 2093 O LYS A 158 -2.189 9.824 -7.950 1.00 0.00 O ATOM 2094 CB LYS A 158 -1.970 9.613 -10.919 1.00 0.00 C ATOM 2095 CG LYS A 158 -2.011 10.284 -12.299 1.00 0.00 C ATOM 2096 CD LYS A 158 -3.145 9.694 -13.145 1.00 0.00 C ATOM 2097 CE LYS A 158 -2.923 10.055 -14.616 1.00 0.00 C ATOM 2098 NZ LYS A 158 -1.654 9.434 -15.092 1.00 0.00 N ATOM 0 H LYS A 158 -2.460 11.953 -9.988 1.00 0.00 H new ATOM 0 HA LYS A 158 -4.102 9.579 -10.585 1.00 0.00 H new ATOM 0 HB2 LYS A 158 -1.071 9.919 -10.384 1.00 0.00 H new ATOM 0 HB3 LYS A 158 -1.919 8.530 -11.035 1.00 0.00 H new ATOM 0 HG2 LYS A 158 -2.155 11.358 -12.184 1.00 0.00 H new ATOM 0 HG3 LYS A 158 -1.057 10.143 -12.808 1.00 0.00 H new ATOM 0 HD2 LYS A 158 -3.177 8.611 -13.026 1.00 0.00 H new ATOM 0 HD3 LYS A 158 -4.106 10.080 -12.805 1.00 0.00 H new ATOM 0 HE2 LYS A 158 -3.761 9.704 -15.218 1.00 0.00 H new ATOM 0 HE3 LYS A 158 -2.877 11.138 -14.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 -1.008 10.177 -15.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 -1.207 8.914 -14.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 -1.860 8.777 -15.871 1.00 0.00 H new ATOM 2112 N LEU A 159 -3.965 8.500 -8.338 1.00 0.00 N ATOM 2113 CA LEU A 159 -3.927 7.897 -7.008 1.00 0.00 C ATOM 2114 C LEU A 159 -3.027 6.660 -7.015 1.00 0.00 C ATOM 2115 O LEU A 159 -3.337 5.662 -7.666 1.00 0.00 O ATOM 2116 CB LEU A 159 -5.361 7.503 -6.578 1.00 0.00 C ATOM 2117 CG LEU A 159 -5.553 7.748 -5.073 1.00 0.00 C ATOM 2118 CD1 LEU A 159 -6.986 7.355 -4.639 1.00 0.00 C ATOM 2119 CD2 LEU A 159 -4.519 6.926 -4.284 1.00 0.00 C ATOM 0 H LEU A 159 -4.711 8.154 -8.941 1.00 0.00 H new ATOM 0 HA LEU A 159 -3.522 8.620 -6.300 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -6.090 8.083 -7.144 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -5.541 6.453 -6.808 1.00 0.00 H new ATOM 0 HG LEU A 159 -5.409 8.808 -4.865 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -7.105 7.535 -3.571 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -7.710 7.954 -5.191 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -7.153 6.299 -4.850 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -4.654 7.099 -3.216 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -4.655 5.866 -4.500 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -3.514 7.229 -4.576 1.00 0.00 H new ATOM 2131 N ILE A 160 -1.916 6.731 -6.282 1.00 0.00 N ATOM 2132 CA ILE A 160 -0.977 5.609 -6.199 1.00 0.00 C ATOM 2133 C ILE A 160 -0.805 5.177 -4.750 1.00 0.00 C ATOM 2134 O ILE A 160 -0.500 5.998 -3.884 1.00 0.00 O ATOM 2135 CB ILE A 160 0.384 6.021 -6.766 1.00 0.00 C ATOM 2136 CG1 ILE A 160 0.209 6.541 -8.197 1.00 0.00 C ATOM 2137 CG2 ILE A 160 1.317 4.809 -6.780 1.00 0.00 C ATOM 2138 CD1 ILE A 160 1.504 7.213 -8.663 1.00 0.00 C ATOM 0 H ILE A 160 -1.643 7.550 -5.738 1.00 0.00 H new ATOM 0 HA ILE A 160 -1.377 4.778 -6.780 1.00 0.00 H new ATOM 0 HB ILE A 160 0.812 6.807 -6.143 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -0.046 5.718 -8.865 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -0.616 7.252 -8.238 1.00 0.00 H new ATOM 0 HG21 ILE A 160 2.287 5.101 -7.184 1.00 0.00 H new ATOM 0 HG22 ILE A 160 1.444 4.436 -5.764 1.00 0.00 H new ATOM 0 HG23 ILE A 160 0.886 4.025 -7.403 1.00 0.00 H new ATOM 0 HD11 ILE A 160 1.377 7.582 -9.681 1.00 0.00 H new ATOM 0 HD12 ILE A 160 1.740 8.047 -8.002 1.00 0.00 H new ATOM 0 HD13 ILE A 160 2.319 6.489 -8.639 1.00 0.00 H new ATOM 2150 N THR A 161 -0.993 3.884 -4.491 1.00 0.00 N ATOM 2151 CA THR A 161 -0.846 3.345 -3.137 1.00 0.00 C ATOM 2152 C THR A 161 0.180 2.219 -3.132 1.00 0.00 C ATOM 2153 O THR A 161 0.180 1.362 -4.017 1.00 0.00 O ATOM 2154 CB THR A 161 -2.187 2.819 -2.628 1.00 0.00 C ATOM 2155 OG1 THR A 161 -3.174 3.831 -2.765 1.00 0.00 O ATOM 2156 CG2 THR A 161 -2.058 2.429 -1.154 1.00 0.00 C ATOM 0 H THR A 161 -1.246 3.192 -5.196 1.00 0.00 H new ATOM 0 HA THR A 161 -0.505 4.145 -2.480 1.00 0.00 H new ATOM 0 HB THR A 161 -2.478 1.945 -3.210 1.00 0.00 H new ATOM 0 HG1 THR A 161 -4.035 3.494 -2.440 1.00 0.00 H new ATOM 0 HG21 THR A 161 -3.015 2.054 -0.792 1.00 0.00 H new ATOM 0 HG22 THR A 161 -1.300 1.653 -1.048 1.00 0.00 H new ATOM 0 HG23 THR A 161 -1.766 3.302 -0.571 1.00 0.00 H new ATOM 2164 N PHE A 162 1.059 2.231 -2.134 1.00 0.00 N ATOM 2165 CA PHE A 162 2.105 1.211 -2.015 1.00 0.00 C ATOM 2166 C PHE A 162 1.772 0.255 -0.866 1.00 0.00 C ATOM 2167 O PHE A 162 1.908 0.612 0.303 1.00 0.00 O ATOM 2168 CB PHE A 162 3.454 1.925 -1.754 1.00 0.00 C ATOM 2169 CG PHE A 162 4.560 1.322 -2.596 1.00 0.00 C ATOM 2170 CD1 PHE A 162 4.511 1.428 -3.990 1.00 0.00 C ATOM 2171 CD2 PHE A 162 5.636 0.672 -1.983 1.00 0.00 C ATOM 2172 CE1 PHE A 162 5.535 0.879 -4.771 1.00 0.00 C ATOM 2173 CE2 PHE A 162 6.659 0.125 -2.762 1.00 0.00 C ATOM 2174 CZ PHE A 162 6.609 0.228 -4.156 1.00 0.00 C ATOM 0 H PHE A 162 1.071 2.934 -1.395 1.00 0.00 H new ATOM 0 HA PHE A 162 2.171 0.627 -2.933 1.00 0.00 H new ATOM 0 HB2 PHE A 162 3.357 2.987 -1.981 1.00 0.00 H new ATOM 0 HB3 PHE A 162 3.712 1.847 -0.698 1.00 0.00 H new ATOM 0 HD1 PHE A 162 3.683 1.934 -4.464 1.00 0.00 H new ATOM 0 HD2 PHE A 162 5.676 0.593 -0.907 1.00 0.00 H new ATOM 0 HE1 PHE A 162 5.496 0.958 -5.847 1.00 0.00 H new ATOM 0 HE2 PHE A 162 7.489 -0.378 -2.287 1.00 0.00 H new ATOM 0 HZ PHE A 162 7.400 -0.195 -4.757 1.00 0.00 H new ATOM 2184 N ASP A 163 1.333 -0.958 -1.205 1.00 0.00 N ATOM 2185 CA ASP A 163 0.978 -1.954 -0.189 1.00 0.00 C ATOM 2186 C ASP A 163 2.108 -2.957 0.029 1.00 0.00 C ATOM 2187 O ASP A 163 2.509 -3.667 -0.893 1.00 0.00 O ATOM 2188 CB ASP A 163 -0.289 -2.699 -0.614 1.00 0.00 C ATOM 2189 CG ASP A 163 -0.741 -3.639 0.499 1.00 0.00 C ATOM 2190 OD1 ASP A 163 -1.429 -3.177 1.394 1.00 0.00 O ATOM 2191 OD2 ASP A 163 -0.390 -4.806 0.441 1.00 0.00 O ATOM 0 H ASP A 163 1.215 -1.274 -2.167 1.00 0.00 H new ATOM 0 HA ASP A 163 0.803 -1.427 0.749 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -1.081 -1.985 -0.842 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -0.099 -3.266 -1.525 1.00 0.00 H new ATOM 2196 N LEU A 164 2.609 -3.014 1.263 1.00 0.00 N ATOM 2197 CA LEU A 164 3.691 -3.936 1.621 1.00 0.00 C ATOM 2198 C LEU A 164 3.209 -4.924 2.680 1.00 0.00 C ATOM 2199 O LEU A 164 2.558 -4.535 3.648 1.00 0.00 O ATOM 2200 CB LEU A 164 4.880 -3.141 2.171 1.00 0.00 C ATOM 2201 CG LEU A 164 5.330 -2.085 1.146 1.00 0.00 C ATOM 2202 CD1 LEU A 164 6.170 -1.017 1.850 1.00 0.00 C ATOM 2203 CD2 LEU A 164 6.181 -2.741 0.051 1.00 0.00 C ATOM 0 H LEU A 164 2.283 -2.432 2.034 1.00 0.00 H new ATOM 0 HA LEU A 164 3.997 -4.487 0.731 1.00 0.00 H new ATOM 0 HB2 LEU A 164 4.601 -2.656 3.106 1.00 0.00 H new ATOM 0 HB3 LEU A 164 5.706 -3.816 2.396 1.00 0.00 H new ATOM 0 HG LEU A 164 4.446 -1.632 0.697 1.00 0.00 H new ATOM 0 HD11 LEU A 164 6.489 -0.269 1.125 1.00 0.00 H new ATOM 0 HD12 LEU A 164 5.573 -0.538 2.627 1.00 0.00 H new ATOM 0 HD13 LEU A 164 7.047 -1.482 2.301 1.00 0.00 H new ATOM 0 HD21 LEU A 164 6.494 -1.985 -0.669 1.00 0.00 H new ATOM 0 HD22 LEU A 164 7.061 -3.200 0.501 1.00 0.00 H new ATOM 0 HD23 LEU A 164 5.593 -3.505 -0.458 1.00 0.00 H new ATOM 2215 N SER A 165 3.535 -6.207 2.498 1.00 0.00 N ATOM 2216 CA SER A 165 3.127 -7.244 3.454 1.00 0.00 C ATOM 2217 C SER A 165 4.297 -8.163 3.792 1.00 0.00 C ATOM 2218 O SER A 165 5.021 -8.617 2.906 1.00 0.00 O ATOM 2219 CB SER A 165 1.985 -8.072 2.862 1.00 0.00 C ATOM 2220 OG SER A 165 1.519 -8.993 3.839 1.00 0.00 O ATOM 0 H SER A 165 4.076 -6.552 1.705 1.00 0.00 H new ATOM 0 HA SER A 165 2.793 -6.754 4.369 1.00 0.00 H new ATOM 0 HB2 SER A 165 1.173 -7.418 2.545 1.00 0.00 H new ATOM 0 HB3 SER A 165 2.329 -8.606 1.976 1.00 0.00 H new ATOM 0 HG SER A 165 0.786 -9.524 3.464 1.00 0.00 H new ATOM 2226 N THR A 166 4.470 -8.436 5.084 1.00 0.00 N ATOM 2227 CA THR A 166 5.549 -9.308 5.548 1.00 0.00 C ATOM 2228 C THR A 166 5.155 -9.987 6.861 1.00 0.00 C ATOM 2229 O THR A 166 4.265 -9.520 7.571 1.00 0.00 O ATOM 2230 CB THR A 166 6.839 -8.493 5.716 1.00 0.00 C ATOM 2231 OG1 THR A 166 7.350 -8.172 4.431 1.00 0.00 O ATOM 2232 CG2 THR A 166 7.887 -9.297 6.493 1.00 0.00 C ATOM 0 H THR A 166 3.878 -8.067 5.828 1.00 0.00 H new ATOM 0 HA THR A 166 5.726 -10.087 4.806 1.00 0.00 H new ATOM 0 HB THR A 166 6.616 -7.583 6.273 1.00 0.00 H new ATOM 0 HG1 THR A 166 8.300 -7.944 4.505 1.00 0.00 H new ATOM 0 HG21 THR A 166 8.794 -8.703 6.602 1.00 0.00 H new ATOM 0 HG22 THR A 166 7.496 -9.547 7.479 1.00 0.00 H new ATOM 0 HG23 THR A 166 8.117 -10.214 5.951 1.00 0.00 H new ATOM 2240 N ALA A 167 5.815 -11.102 7.170 1.00 0.00 N ATOM 2241 CA ALA A 167 5.518 -11.851 8.391 1.00 0.00 C ATOM 2242 C ALA A 167 5.721 -10.991 9.636 1.00 0.00 C ATOM 2243 O ALA A 167 6.626 -10.157 9.692 1.00 0.00 O ATOM 2244 CB ALA A 167 6.416 -13.086 8.473 1.00 0.00 C ATOM 0 H ALA A 167 6.555 -11.505 6.596 1.00 0.00 H new ATOM 0 HA ALA A 167 4.472 -12.154 8.352 1.00 0.00 H new ATOM 0 HB1 ALA A 167 6.191 -13.640 9.384 1.00 0.00 H new ATOM 0 HB2 ALA A 167 6.238 -13.724 7.607 1.00 0.00 H new ATOM 0 HB3 ALA A 167 7.461 -12.776 8.486 1.00 0.00 H new ATOM 2250 N GLU A 168 4.867 -11.209 10.634 1.00 0.00 N ATOM 2251 CA GLU A 168 4.944 -10.464 11.888 1.00 0.00 C ATOM 2252 C GLU A 168 6.117 -10.942 12.739 1.00 0.00 C ATOM 2253 O GLU A 168 6.541 -10.258 13.671 1.00 0.00 O ATOM 2254 CB GLU A 168 3.635 -10.629 12.668 1.00 0.00 C ATOM 2255 CG GLU A 168 3.488 -12.079 13.143 1.00 0.00 C ATOM 2256 CD GLU A 168 2.109 -12.283 13.760 1.00 0.00 C ATOM 2257 OE1 GLU A 168 1.396 -11.305 13.907 1.00 0.00 O ATOM 2258 OE2 GLU A 168 1.786 -13.416 14.079 1.00 0.00 O ATOM 0 H GLU A 168 4.114 -11.896 10.598 1.00 0.00 H new ATOM 0 HA GLU A 168 5.100 -9.411 11.653 1.00 0.00 H new ATOM 0 HB2 GLU A 168 3.624 -9.954 13.524 1.00 0.00 H new ATOM 0 HB3 GLU A 168 2.789 -10.357 12.037 1.00 0.00 H new ATOM 0 HG2 GLU A 168 3.626 -12.762 12.305 1.00 0.00 H new ATOM 0 HG3 GLU A 168 4.262 -12.312 13.874 1.00 0.00 H new ATOM 2265 N ASP A 169 6.620 -12.129 12.422 1.00 0.00 N ATOM 2266 CA ASP A 169 7.730 -12.709 13.173 1.00 0.00 C ATOM 2267 C ASP A 169 9.069 -12.086 12.783 1.00 0.00 C ATOM 2268 O ASP A 169 10.081 -12.320 13.443 1.00 0.00 O ATOM 2269 CB ASP A 169 7.779 -14.219 12.933 1.00 0.00 C ATOM 2270 CG ASP A 169 8.011 -14.504 11.453 1.00 0.00 C ATOM 2271 OD1 ASP A 169 8.245 -13.560 10.717 1.00 0.00 O ATOM 2272 OD2 ASP A 169 7.941 -15.662 11.076 1.00 0.00 O ATOM 0 H ASP A 169 6.280 -12.708 11.654 1.00 0.00 H new ATOM 0 HA ASP A 169 7.561 -12.501 14.230 1.00 0.00 H new ATOM 0 HB2 ASP A 169 8.577 -14.664 13.527 1.00 0.00 H new ATOM 0 HB3 ASP A 169 6.845 -14.678 13.258 1.00 0.00 H new ATOM 2277 N ARG A 170 9.075 -11.287 11.717 1.00 0.00 N ATOM 2278 CA ARG A 170 10.307 -10.630 11.261 1.00 0.00 C ATOM 2279 C ARG A 170 10.055 -9.158 10.964 1.00 0.00 C ATOM 2280 O ARG A 170 10.987 -8.403 10.695 1.00 0.00 O ATOM 2281 CB ARG A 170 10.837 -11.320 10.001 1.00 0.00 C ATOM 2282 CG ARG A 170 11.373 -12.707 10.361 1.00 0.00 C ATOM 2283 CD ARG A 170 11.953 -13.368 9.109 1.00 0.00 C ATOM 2284 NE ARG A 170 13.161 -12.669 8.685 1.00 0.00 N ATOM 2285 CZ ARG A 170 13.858 -13.080 7.631 1.00 0.00 C ATOM 2286 NH1 ARG A 170 13.463 -14.125 6.956 1.00 0.00 N ATOM 2287 NH2 ARG A 170 14.935 -12.438 7.269 1.00 0.00 N ATOM 0 H ARG A 170 8.250 -11.078 11.155 1.00 0.00 H new ATOM 0 HA ARG A 170 11.048 -10.707 12.057 1.00 0.00 H new ATOM 0 HB2 ARG A 170 10.042 -11.407 9.261 1.00 0.00 H new ATOM 0 HB3 ARG A 170 11.627 -10.719 9.551 1.00 0.00 H new ATOM 0 HG2 ARG A 170 12.140 -12.624 11.131 1.00 0.00 H new ATOM 0 HG3 ARG A 170 10.573 -13.322 10.773 1.00 0.00 H new ATOM 0 HD2 ARG A 170 12.182 -14.414 9.314 1.00 0.00 H new ATOM 0 HD3 ARG A 170 11.215 -13.354 8.307 1.00 0.00 H new ATOM 0 HE ARG A 170 13.476 -11.851 9.206 1.00 0.00 H new ATOM 0 HH11 ARG A 170 12.620 -14.625 7.238 1.00 0.00 H new ATOM 0 HH12 ARG A 170 13.997 -14.441 6.147 1.00 0.00 H new ATOM 0 HH21 ARG A 170 15.242 -11.620 7.795 1.00 0.00 H new ATOM 0 HH22 ARG A 170 15.469 -12.754 6.460 1.00 0.00 H new ATOM 2301 N TRP A 171 8.793 -8.755 11.021 1.00 0.00 N ATOM 2302 CA TRP A 171 8.434 -7.369 10.754 1.00 0.00 C ATOM 2303 C TRP A 171 9.322 -6.420 11.554 1.00 0.00 C ATOM 2304 O TRP A 171 9.732 -5.371 11.056 1.00 0.00 O ATOM 2305 CB TRP A 171 6.967 -7.145 11.121 1.00 0.00 C ATOM 2306 CG TRP A 171 6.554 -5.766 10.733 1.00 0.00 C ATOM 2307 CD1 TRP A 171 6.714 -4.660 11.495 1.00 0.00 C ATOM 2308 CD2 TRP A 171 5.908 -5.330 9.503 1.00 0.00 C ATOM 2309 NE1 TRP A 171 6.216 -3.569 10.806 1.00 0.00 N ATOM 2310 CE2 TRP A 171 5.707 -3.932 9.574 1.00 0.00 C ATOM 2311 CE3 TRP A 171 5.486 -6.005 8.345 1.00 0.00 C ATOM 2312 CZ2 TRP A 171 5.111 -3.228 8.531 1.00 0.00 C ATOM 2313 CZ3 TRP A 171 4.884 -5.299 7.291 1.00 0.00 C ATOM 2314 CH2 TRP A 171 4.696 -3.913 7.383 1.00 0.00 C ATOM 0 H TRP A 171 8.006 -9.363 11.248 1.00 0.00 H new ATOM 0 HA TRP A 171 8.581 -7.164 9.694 1.00 0.00 H new ATOM 0 HB2 TRP A 171 6.340 -7.878 10.614 1.00 0.00 H new ATOM 0 HB3 TRP A 171 6.824 -7.289 12.192 1.00 0.00 H new ATOM 0 HD1 TRP A 171 7.158 -4.633 12.479 1.00 0.00 H new ATOM 0 HE1 TRP A 171 6.224 -2.614 11.164 1.00 0.00 H new ATOM 0 HE3 TRP A 171 5.625 -7.073 8.265 1.00 0.00 H new ATOM 0 HZ2 TRP A 171 4.970 -2.160 8.607 1.00 0.00 H new ATOM 0 HZ3 TRP A 171 4.564 -5.827 6.405 1.00 0.00 H new ATOM 0 HH2 TRP A 171 4.232 -3.375 6.570 1.00 0.00 H new ATOM 2325 N ASP A 172 9.619 -6.797 12.792 1.00 0.00 N ATOM 2326 CA ASP A 172 10.463 -5.974 13.651 1.00 0.00 C ATOM 2327 C ASP A 172 11.873 -5.843 13.074 1.00 0.00 C ATOM 2328 O ASP A 172 12.464 -4.764 13.094 1.00 0.00 O ATOM 2329 CB ASP A 172 10.538 -6.599 15.048 1.00 0.00 C ATOM 2330 CG ASP A 172 11.214 -5.639 16.021 1.00 0.00 C ATOM 2331 OD1 ASP A 172 11.434 -4.500 15.645 1.00 0.00 O ATOM 2332 OD2 ASP A 172 11.500 -6.056 17.131 1.00 0.00 O ATOM 0 H ASP A 172 9.291 -7.662 13.222 1.00 0.00 H new ATOM 0 HA ASP A 172 10.022 -4.979 13.712 1.00 0.00 H new ATOM 0 HB2 ASP A 172 9.535 -6.839 15.401 1.00 0.00 H new ATOM 0 HB3 ASP A 172 11.094 -7.536 15.006 1.00 0.00 H new ATOM 2337 N THR A 173 12.411 -6.953 12.571 1.00 0.00 N ATOM 2338 CA THR A 173 13.758 -6.957 12.003 1.00 0.00 C ATOM 2339 C THR A 173 13.839 -6.092 10.746 1.00 0.00 C ATOM 2340 O THR A 173 14.818 -5.375 10.538 1.00 0.00 O ATOM 2341 CB THR A 173 14.172 -8.391 11.663 1.00 0.00 C ATOM 2342 OG1 THR A 173 14.053 -9.203 12.823 1.00 0.00 O ATOM 2343 CG2 THR A 173 15.621 -8.403 11.175 1.00 0.00 C ATOM 0 H THR A 173 11.938 -7.856 12.545 1.00 0.00 H new ATOM 0 HA THR A 173 14.436 -6.540 12.747 1.00 0.00 H new ATOM 0 HB THR A 173 13.524 -8.781 10.878 1.00 0.00 H new ATOM 0 HG1 THR A 173 14.316 -10.122 12.607 1.00 0.00 H new ATOM 0 HG21 THR A 173 15.915 -9.424 10.933 1.00 0.00 H new ATOM 0 HG22 THR A 173 15.711 -7.779 10.286 1.00 0.00 H new ATOM 0 HG23 THR A 173 16.272 -8.014 11.958 1.00 0.00 H new ATOM 2351 N VAL A 174 12.807 -6.171 9.908 1.00 0.00 N ATOM 2352 CA VAL A 174 12.765 -5.400 8.661 1.00 0.00 C ATOM 2353 C VAL A 174 11.797 -4.228 8.780 1.00 0.00 C ATOM 2354 O VAL A 174 11.316 -3.704 7.775 1.00 0.00 O ATOM 2355 CB VAL A 174 12.337 -6.306 7.498 1.00 0.00 C ATOM 2356 CG1 VAL A 174 13.485 -7.252 7.140 1.00 0.00 C ATOM 2357 CG2 VAL A 174 11.104 -7.125 7.901 1.00 0.00 C ATOM 0 H VAL A 174 11.989 -6.759 10.067 1.00 0.00 H new ATOM 0 HA VAL A 174 13.764 -5.008 8.468 1.00 0.00 H new ATOM 0 HB VAL A 174 12.089 -5.689 6.634 1.00 0.00 H new ATOM 0 HG11 VAL A 174 13.182 -7.896 6.314 1.00 0.00 H new ATOM 0 HG12 VAL A 174 14.358 -6.670 6.845 1.00 0.00 H new ATOM 0 HG13 VAL A 174 13.734 -7.866 8.006 1.00 0.00 H new ATOM 0 HG21 VAL A 174 10.806 -7.766 7.071 1.00 0.00 H new ATOM 0 HG22 VAL A 174 11.344 -7.741 8.767 1.00 0.00 H new ATOM 0 HG23 VAL A 174 10.285 -6.451 8.151 1.00 0.00 H new ATOM 2367 N LYS A 175 11.509 -3.825 10.012 1.00 0.00 N ATOM 2368 CA LYS A 175 10.589 -2.718 10.241 1.00 0.00 C ATOM 2369 C LYS A 175 10.943 -1.516 9.368 1.00 0.00 C ATOM 2370 O LYS A 175 10.070 -0.918 8.738 1.00 0.00 O ATOM 2371 CB LYS A 175 10.614 -2.310 11.716 1.00 0.00 C ATOM 2372 CG LYS A 175 12.044 -1.963 12.139 1.00 0.00 C ATOM 2373 CD LYS A 175 12.114 -1.853 13.666 1.00 0.00 C ATOM 2374 CE LYS A 175 11.282 -0.657 14.145 1.00 0.00 C ATOM 2375 NZ LYS A 175 9.845 -1.046 14.223 1.00 0.00 N ATOM 0 H LYS A 175 11.894 -4.243 10.859 1.00 0.00 H new ATOM 0 HA LYS A 175 9.587 -3.053 9.973 1.00 0.00 H new ATOM 0 HB2 LYS A 175 9.960 -1.452 11.876 1.00 0.00 H new ATOM 0 HB3 LYS A 175 10.230 -3.122 12.333 1.00 0.00 H new ATOM 0 HG2 LYS A 175 12.735 -2.729 11.787 1.00 0.00 H new ATOM 0 HG3 LYS A 175 12.352 -1.023 11.682 1.00 0.00 H new ATOM 0 HD2 LYS A 175 11.743 -2.771 14.122 1.00 0.00 H new ATOM 0 HD3 LYS A 175 13.150 -1.736 13.983 1.00 0.00 H new ATOM 0 HE2 LYS A 175 11.633 -0.325 15.122 1.00 0.00 H new ATOM 0 HE3 LYS A 175 11.405 0.182 13.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 9.307 -0.535 13.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 9.754 -2.070 14.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 9.470 -0.804 15.163 1.00 0.00 H new ATOM 2389 N SER A 176 12.221 -1.158 9.345 1.00 0.00 N ATOM 2390 CA SER A 176 12.674 -0.016 8.556 1.00 0.00 C ATOM 2391 C SER A 176 12.534 -0.271 7.056 1.00 0.00 C ATOM 2392 O SER A 176 12.365 0.665 6.276 1.00 0.00 O ATOM 2393 CB SER A 176 14.134 0.294 8.885 1.00 0.00 C ATOM 2394 OG SER A 176 14.954 -0.774 8.427 1.00 0.00 O ATOM 0 H SER A 176 12.959 -1.638 9.860 1.00 0.00 H new ATOM 0 HA SER A 176 12.043 0.835 8.814 1.00 0.00 H new ATOM 0 HB2 SER A 176 14.435 1.228 8.412 1.00 0.00 H new ATOM 0 HB3 SER A 176 14.257 0.427 9.960 1.00 0.00 H new ATOM 0 HG SER A 176 15.892 -0.579 8.634 1.00 0.00 H new ATOM 2400 N LEU A 177 12.618 -1.536 6.653 1.00 0.00 N ATOM 2401 CA LEU A 177 12.510 -1.879 5.236 1.00 0.00 C ATOM 2402 C LEU A 177 11.204 -1.354 4.655 1.00 0.00 C ATOM 2403 O LEU A 177 11.178 -0.821 3.545 1.00 0.00 O ATOM 2404 CB LEU A 177 12.547 -3.401 5.063 1.00 0.00 C ATOM 2405 CG LEU A 177 12.690 -3.774 3.571 1.00 0.00 C ATOM 2406 CD1 LEU A 177 14.160 -3.688 3.135 1.00 0.00 C ATOM 2407 CD2 LEU A 177 12.186 -5.205 3.351 1.00 0.00 C ATOM 0 H LEU A 177 12.758 -2.331 7.276 1.00 0.00 H new ATOM 0 HA LEU A 177 13.349 -1.422 4.712 1.00 0.00 H new ATOM 0 HB2 LEU A 177 13.380 -3.817 5.629 1.00 0.00 H new ATOM 0 HB3 LEU A 177 11.636 -3.841 5.468 1.00 0.00 H new ATOM 0 HG LEU A 177 12.100 -3.074 2.979 1.00 0.00 H new ATOM 0 HD11 LEU A 177 14.243 -3.954 2.081 1.00 0.00 H new ATOM 0 HD12 LEU A 177 14.524 -2.671 3.283 1.00 0.00 H new ATOM 0 HD13 LEU A 177 14.757 -4.378 3.731 1.00 0.00 H new ATOM 0 HD21 LEU A 177 12.287 -5.468 2.298 1.00 0.00 H new ATOM 0 HD22 LEU A 177 12.775 -5.895 3.956 1.00 0.00 H new ATOM 0 HD23 LEU A 177 11.138 -5.270 3.643 1.00 0.00 H new ATOM 2419 N PHE A 178 10.117 -1.519 5.401 1.00 0.00 N ATOM 2420 CA PHE A 178 8.818 -1.065 4.925 1.00 0.00 C ATOM 2421 C PHE A 178 8.818 0.446 4.739 1.00 0.00 C ATOM 2422 O PHE A 178 8.415 0.952 3.696 1.00 0.00 O ATOM 2423 CB PHE A 178 7.718 -1.458 5.911 1.00 0.00 C ATOM 2424 CG PHE A 178 7.902 -2.902 6.314 1.00 0.00 C ATOM 2425 CD1 PHE A 178 7.902 -3.911 5.341 1.00 0.00 C ATOM 2426 CD2 PHE A 178 8.084 -3.233 7.660 1.00 0.00 C ATOM 2427 CE1 PHE A 178 8.088 -5.245 5.719 1.00 0.00 C ATOM 2428 CE2 PHE A 178 8.267 -4.568 8.037 1.00 0.00 C ATOM 2429 CZ PHE A 178 8.271 -5.574 7.066 1.00 0.00 C ATOM 0 H PHE A 178 10.109 -1.956 6.322 1.00 0.00 H new ATOM 0 HA PHE A 178 8.623 -1.543 3.965 1.00 0.00 H new ATOM 0 HB2 PHE A 178 7.755 -0.815 6.791 1.00 0.00 H new ATOM 0 HB3 PHE A 178 6.738 -1.318 5.455 1.00 0.00 H new ATOM 0 HD1 PHE A 178 7.759 -3.659 4.301 1.00 0.00 H new ATOM 0 HD2 PHE A 178 8.083 -2.456 8.411 1.00 0.00 H new ATOM 0 HE1 PHE A 178 8.090 -6.022 4.969 1.00 0.00 H new ATOM 0 HE2 PHE A 178 8.405 -4.821 9.078 1.00 0.00 H new ATOM 0 HZ PHE A 178 8.415 -6.604 7.356 1.00 0.00 H new ATOM 2439 N ASP A 179 9.278 1.162 5.758 1.00 0.00 N ATOM 2440 CA ASP A 179 9.328 2.616 5.690 1.00 0.00 C ATOM 2441 C ASP A 179 10.279 3.072 4.588 1.00 0.00 C ATOM 2442 O ASP A 179 9.993 4.025 3.863 1.00 0.00 O ATOM 2443 CB ASP A 179 9.787 3.184 7.033 1.00 0.00 C ATOM 2444 CG ASP A 179 9.636 4.702 7.039 1.00 0.00 C ATOM 2445 OD1 ASP A 179 9.089 5.227 6.083 1.00 0.00 O ATOM 2446 OD2 ASP A 179 10.068 5.316 8.000 1.00 0.00 O ATOM 0 H ASP A 179 9.619 0.764 6.633 1.00 0.00 H new ATOM 0 HA ASP A 179 8.328 2.985 5.462 1.00 0.00 H new ATOM 0 HB2 ASP A 179 9.199 2.749 7.841 1.00 0.00 H new ATOM 0 HB3 ASP A 179 10.827 2.913 7.215 1.00 0.00 H new ATOM 2451 N THR A 180 11.416 2.390 4.472 1.00 0.00 N ATOM 2452 CA THR A 180 12.404 2.741 3.460 1.00 0.00 C ATOM 2453 C THR A 180 11.889 2.447 2.053 1.00 0.00 C ATOM 2454 O THR A 180 11.934 3.310 1.176 1.00 0.00 O ATOM 2455 CB THR A 180 13.698 1.962 3.706 1.00 0.00 C ATOM 2456 OG1 THR A 180 14.166 2.231 5.020 1.00 0.00 O ATOM 2457 CG2 THR A 180 14.756 2.387 2.687 1.00 0.00 C ATOM 0 H THR A 180 11.673 1.598 5.061 1.00 0.00 H new ATOM 0 HA THR A 180 12.597 3.811 3.535 1.00 0.00 H new ATOM 0 HB THR A 180 13.506 0.894 3.599 1.00 0.00 H new ATOM 0 HG1 THR A 180 13.720 1.632 5.655 1.00 0.00 H new ATOM 0 HG21 THR A 180 15.676 1.831 2.865 1.00 0.00 H new ATOM 0 HG22 THR A 180 14.395 2.179 1.680 1.00 0.00 H new ATOM 0 HG23 THR A 180 14.952 3.454 2.789 1.00 0.00 H new ATOM 2465 N VAL A 181 11.406 1.226 1.837 1.00 0.00 N ATOM 2466 CA VAL A 181 10.893 0.848 0.525 1.00 0.00 C ATOM 2467 C VAL A 181 9.583 1.577 0.227 1.00 0.00 C ATOM 2468 O VAL A 181 9.288 1.896 -0.924 1.00 0.00 O ATOM 2469 CB VAL A 181 10.699 -0.678 0.447 1.00 0.00 C ATOM 2470 CG1 VAL A 181 9.408 -1.091 1.167 1.00 0.00 C ATOM 2471 CG2 VAL A 181 10.630 -1.111 -1.024 1.00 0.00 C ATOM 0 H VAL A 181 11.359 0.491 2.543 1.00 0.00 H new ATOM 0 HA VAL A 181 11.622 1.142 -0.230 1.00 0.00 H new ATOM 0 HB VAL A 181 11.543 -1.166 0.934 1.00 0.00 H new ATOM 0 HG11 VAL A 181 9.285 -2.172 1.103 1.00 0.00 H new ATOM 0 HG12 VAL A 181 9.464 -0.794 2.214 1.00 0.00 H new ATOM 0 HG13 VAL A 181 8.556 -0.601 0.696 1.00 0.00 H new ATOM 0 HG21 VAL A 181 10.493 -2.191 -1.079 1.00 0.00 H new ATOM 0 HG22 VAL A 181 9.791 -0.613 -1.511 1.00 0.00 H new ATOM 0 HG23 VAL A 181 11.557 -0.837 -1.528 1.00 0.00 H new ATOM 2481 N ALA A 182 8.798 1.839 1.268 1.00 0.00 N ATOM 2482 CA ALA A 182 7.531 2.533 1.082 1.00 0.00 C ATOM 2483 C ALA A 182 7.777 3.937 0.553 1.00 0.00 C ATOM 2484 O ALA A 182 7.050 4.418 -0.314 1.00 0.00 O ATOM 2485 CB ALA A 182 6.761 2.613 2.399 1.00 0.00 C ATOM 0 H ALA A 182 9.013 1.586 2.233 1.00 0.00 H new ATOM 0 HA ALA A 182 6.938 1.972 0.360 1.00 0.00 H new ATOM 0 HB1 ALA A 182 5.818 3.135 2.238 1.00 0.00 H new ATOM 0 HB2 ALA A 182 6.560 1.606 2.765 1.00 0.00 H new ATOM 0 HB3 ALA A 182 7.355 3.155 3.135 1.00 0.00 H new ATOM 2491 N SER A 183 8.808 4.586 1.082 1.00 0.00 N ATOM 2492 CA SER A 183 9.154 5.938 0.657 1.00 0.00 C ATOM 2493 C SER A 183 10.041 5.904 -0.584 1.00 0.00 C ATOM 2494 O SER A 183 10.214 6.917 -1.260 1.00 0.00 O ATOM 2495 CB SER A 183 9.883 6.662 1.788 1.00 0.00 C ATOM 2496 OG SER A 183 11.178 6.098 1.950 1.00 0.00 O ATOM 0 H SER A 183 9.417 4.200 1.803 1.00 0.00 H new ATOM 0 HA SER A 183 8.235 6.470 0.413 1.00 0.00 H new ATOM 0 HB2 SER A 183 9.963 7.725 1.562 1.00 0.00 H new ATOM 0 HB3 SER A 183 9.317 6.574 2.715 1.00 0.00 H new ATOM 0 HG SER A 183 11.164 5.159 1.669 1.00 0.00 H new ATOM 2502 N SER A 184 10.616 4.738 -0.870 1.00 0.00 N ATOM 2503 CA SER A 184 11.498 4.601 -2.025 1.00 0.00 C ATOM 2504 C SER A 184 10.744 4.816 -3.332 1.00 0.00 C ATOM 2505 O SER A 184 11.306 5.350 -4.288 1.00 0.00 O ATOM 2506 CB SER A 184 12.155 3.222 -2.034 1.00 0.00 C ATOM 2507 OG SER A 184 11.166 2.233 -2.270 1.00 0.00 O ATOM 0 H SER A 184 10.489 3.885 -0.325 1.00 0.00 H new ATOM 0 HA SER A 184 12.267 5.369 -1.942 1.00 0.00 H new ATOM 0 HB2 SER A 184 12.922 3.177 -2.807 1.00 0.00 H new ATOM 0 HB3 SER A 184 12.651 3.037 -1.081 1.00 0.00 H new ATOM 0 HG SER A 184 10.329 2.497 -1.834 1.00 0.00 H new ATOM 2513 N PHE A 185 9.476 4.409 -3.388 1.00 0.00 N ATOM 2514 CA PHE A 185 8.715 4.595 -4.616 1.00 0.00 C ATOM 2515 C PHE A 185 8.777 6.066 -5.040 1.00 0.00 C ATOM 2516 O PHE A 185 8.890 6.957 -4.198 1.00 0.00 O ATOM 2517 CB PHE A 185 7.253 4.133 -4.414 1.00 0.00 C ATOM 2518 CG PHE A 185 6.375 5.299 -3.992 1.00 0.00 C ATOM 2519 CD1 PHE A 185 6.664 5.994 -2.815 1.00 0.00 C ATOM 2520 CD2 PHE A 185 5.289 5.690 -4.789 1.00 0.00 C ATOM 2521 CE1 PHE A 185 5.868 7.077 -2.428 1.00 0.00 C ATOM 2522 CE2 PHE A 185 4.493 6.776 -4.403 1.00 0.00 C ATOM 2523 CZ PHE A 185 4.784 7.469 -3.221 1.00 0.00 C ATOM 0 H PHE A 185 8.970 3.963 -2.623 1.00 0.00 H new ATOM 0 HA PHE A 185 9.150 3.987 -5.409 1.00 0.00 H new ATOM 0 HB2 PHE A 185 6.872 3.700 -5.339 1.00 0.00 H new ATOM 0 HB3 PHE A 185 7.215 3.350 -3.657 1.00 0.00 H new ATOM 0 HD1 PHE A 185 7.503 5.695 -2.204 1.00 0.00 H new ATOM 0 HD2 PHE A 185 5.067 5.154 -5.700 1.00 0.00 H new ATOM 0 HE1 PHE A 185 6.090 7.611 -1.516 1.00 0.00 H new ATOM 0 HE2 PHE A 185 3.657 7.078 -5.016 1.00 0.00 H new ATOM 0 HZ PHE A 185 4.171 8.306 -2.922 1.00 0.00 H new ATOM 2533 N HIS A 186 8.696 6.312 -6.344 1.00 0.00 N ATOM 2534 CA HIS A 186 8.738 7.678 -6.871 1.00 0.00 C ATOM 2535 C HIS A 186 7.589 7.887 -7.846 1.00 0.00 C ATOM 2536 O HIS A 186 7.146 6.944 -8.502 1.00 0.00 O ATOM 2537 CB HIS A 186 10.069 7.928 -7.580 1.00 0.00 C ATOM 2538 CG HIS A 186 10.212 9.398 -7.867 1.00 0.00 C ATOM 2539 ND1 HIS A 186 10.731 10.288 -6.936 1.00 0.00 N ATOM 2540 CD2 HIS A 186 9.897 10.152 -8.969 1.00 0.00 C ATOM 2541 CE1 HIS A 186 10.711 11.514 -7.493 1.00 0.00 C ATOM 2542 NE2 HIS A 186 10.212 11.487 -8.731 1.00 0.00 N ATOM 0 H HIS A 186 8.601 5.588 -7.056 1.00 0.00 H new ATOM 0 HA HIS A 186 8.642 8.380 -6.043 1.00 0.00 H new ATOM 0 HB2 HIS A 186 10.896 7.585 -6.958 1.00 0.00 H new ATOM 0 HB3 HIS A 186 10.112 7.359 -8.509 1.00 0.00 H new ATOM 0 HD2 HIS A 186 9.469 9.768 -9.883 1.00 0.00 H new ATOM 0 HE1 HIS A 186 11.057 12.410 -6.998 1.00 0.00 H new ATOM 0 HE2 HIS A 186 10.088 12.275 -9.366 1.00 0.00 H new ATOM 2551 N VAL A 187 7.102 9.126 -7.935 1.00 0.00 N ATOM 2552 CA VAL A 187 5.990 9.448 -8.835 1.00 0.00 C ATOM 2553 C VAL A 187 6.355 10.607 -9.753 1.00 0.00 C ATOM 2554 O VAL A 187 7.173 11.457 -9.400 1.00 0.00 O ATOM 2555 CB VAL A 187 4.751 9.816 -8.018 1.00 0.00 C ATOM 2556 CG1 VAL A 187 4.393 8.661 -7.082 1.00 0.00 C ATOM 2557 CG2 VAL A 187 5.043 11.070 -7.190 1.00 0.00 C ATOM 0 H VAL A 187 7.456 9.919 -7.400 1.00 0.00 H new ATOM 0 HA VAL A 187 5.779 8.571 -9.447 1.00 0.00 H new ATOM 0 HB VAL A 187 3.916 10.009 -8.692 1.00 0.00 H new ATOM 0 HG11 VAL A 187 3.510 8.925 -6.500 1.00 0.00 H new ATOM 0 HG12 VAL A 187 4.187 7.767 -7.670 1.00 0.00 H new ATOM 0 HG13 VAL A 187 5.227 8.467 -6.408 1.00 0.00 H new ATOM 0 HG21 VAL A 187 4.161 11.334 -6.607 1.00 0.00 H new ATOM 0 HG22 VAL A 187 5.878 10.875 -6.517 1.00 0.00 H new ATOM 0 HG23 VAL A 187 5.298 11.894 -7.856 1.00 0.00 H new ATOM 2567 N TYR A 188 5.744 10.633 -10.936 1.00 0.00 N ATOM 2568 CA TYR A 188 6.015 11.692 -11.900 1.00 0.00 C ATOM 2569 C TYR A 188 5.057 11.599 -13.084 1.00 0.00 C ATOM 2570 O TYR A 188 4.334 12.555 -13.313 1.00 0.00 O ATOM 2571 CB TYR A 188 7.461 11.587 -12.393 1.00 0.00 C ATOM 2572 CG TYR A 188 7.625 10.325 -13.206 1.00 0.00 C ATOM 2573 CD1 TYR A 188 7.862 9.106 -12.561 1.00 0.00 C ATOM 2574 CD2 TYR A 188 7.541 10.374 -14.602 1.00 0.00 C ATOM 2575 CE1 TYR A 188 8.015 7.934 -13.310 1.00 0.00 C ATOM 2576 CE2 TYR A 188 7.695 9.200 -15.353 1.00 0.00 C ATOM 2577 CZ TYR A 188 7.932 7.981 -14.707 1.00 0.00 C ATOM 2578 OH TYR A 188 8.085 6.825 -15.447 1.00 0.00 O ATOM 2579 OXT TYR A 188 5.061 10.573 -13.744 1.00 0.00 O ATOM 0 H TYR A 188 5.064 9.939 -11.246 1.00 0.00 H new ATOM 0 HA TYR A 188 5.868 12.654 -11.409 1.00 0.00 H new ATOM 0 HB2 TYR A 188 7.714 12.458 -12.998 1.00 0.00 H new ATOM 0 HB3 TYR A 188 8.146 11.578 -11.545 1.00 0.00 H new ATOM 0 HD1 TYR A 188 7.927 9.070 -11.484 1.00 0.00 H new ATOM 0 HD2 TYR A 188 7.358 11.315 -15.100 1.00 0.00 H new ATOM 0 HE1 TYR A 188 8.197 6.994 -12.811 1.00 0.00 H new ATOM 0 HE2 TYR A 188 7.631 9.236 -16.430 1.00 0.00 H new ATOM 0 HH TYR A 188 7.998 7.033 -16.401 1.00 0.00 H new