USER MOD reduce.3.24.130724 H: found=0, std=0, add=1028, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1026 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 27 MET CE :methyl -161:sc= -0.422 (180deg=-1.09) USER MOD Set 1.2: A 105 CYS SG : rot -89:sc= 0.269 USER MOD Set 2.1: A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 115 ASN : amide:sc= -2.01! C(o=-2!,f=-3.9!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.173 K(o=-0.17,f=-2.5!) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= 0.068 X(o=0.068,f=-0.34) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 47:sc= -0.0606 USER MOD Single : A 47 ASN :FLIP amide:sc= -1.02 F(o=-1.6,f=-1) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS :FLIP no HD1:sc= -0.623 F(o=-1.9,f=-0.62) USER MOD Single : A 63 ASN : amide:sc= -0.65 K(o=-0.65,f=-1.2) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=-0.0072) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -1.15 K(o=-1.2,f=-13!) USER MOD Single : A 75 SER OG : rot 102:sc= 0.561 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 27:sc= 0.00361 USER MOD Single : A 94 SER OG : rot 27:sc= 0.0179 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl -137:sc= -0.266 (180deg=-1.14) USER MOD Single : A 104 TYR OH : rot 165:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HE2:sc= -4.02 K(o=-4,f=-5.8!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 HIS : no HE2:sc= -10.4! C(o=-10!,f=-15!) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0.00807 USER MOD Single : A 131 SER OG : rot 57:sc= -1.81 USER MOD Single : A 134 THR OG1 : rot 180:sc= -0.0589 USER MOD Single : A 138 ASN :FLIP amide:sc= -0.0598 F(o=-0.69,f=-0.06) USER MOD Single : A 142 HIS :FLIP no HD1:sc= -0.398 F(o=-1.2,f=-0.4) USER MOD Single : A 148 SER OG : rot 33:sc= 0.536 USER MOD ----------------------------------------------------------------- ATOM 165 N LEU A 15 12.226 -4.484 10.414 1.00 0.00 N ATOM 166 CA LEU A 15 11.590 -3.326 11.032 1.00 0.00 C ATOM 167 C LEU A 15 10.475 -3.758 11.979 1.00 0.00 C ATOM 168 O LEU A 15 10.171 -4.945 12.096 1.00 0.00 O ATOM 169 CB LEU A 15 11.029 -2.393 9.957 1.00 0.00 C ATOM 170 CG LEU A 15 12.041 -1.843 8.951 1.00 0.00 C ATOM 171 CD1 LEU A 15 11.340 -1.403 7.676 1.00 0.00 C ATOM 172 CD2 LEU A 15 12.822 -0.688 9.559 1.00 0.00 C ATOM 0 HA LEU A 15 12.345 -2.792 11.609 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.255 -2.929 9.407 1.00 0.00 H new ATOM 0 HB3 LEU A 15 10.544 -1.551 10.452 1.00 0.00 H new ATOM 0 HG LEU A 15 12.744 -2.637 8.699 1.00 0.00 H new ATOM 0 HD11 LEU A 15 12.076 -1.014 6.972 1.00 0.00 H new ATOM 0 HD12 LEU A 15 10.826 -2.255 7.231 1.00 0.00 H new ATOM 0 HD13 LEU A 15 10.615 -0.624 7.910 1.00 0.00 H new ATOM 0 HD21 LEU A 15 13.538 -0.309 8.830 1.00 0.00 H new ATOM 0 HD22 LEU A 15 12.133 0.109 9.840 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.355 -1.035 10.444 1.00 0.00 H new ATOM 184 N SER A 16 9.867 -2.786 12.652 1.00 0.00 N ATOM 185 CA SER A 16 8.786 -3.065 13.590 1.00 0.00 C ATOM 186 C SER A 16 7.578 -2.178 13.307 1.00 0.00 C ATOM 187 O SER A 16 7.707 -1.099 12.726 1.00 0.00 O ATOM 188 CB SER A 16 9.263 -2.854 15.028 1.00 0.00 C ATOM 189 OG SER A 16 9.260 -1.478 15.369 1.00 0.00 O ATOM 0 H SER A 16 10.105 -1.798 12.565 1.00 0.00 H new ATOM 0 HA SER A 16 8.488 -4.106 13.463 1.00 0.00 H new ATOM 0 HB2 SER A 16 8.617 -3.403 15.713 1.00 0.00 H new ATOM 0 HB3 SER A 16 10.268 -3.259 15.144 1.00 0.00 H new ATOM 0 HG SER A 16 9.567 -1.369 16.293 1.00 0.00 H new ATOM 195 N LEU A 17 6.403 -2.639 13.721 1.00 0.00 N ATOM 196 CA LEU A 17 5.170 -1.888 13.513 1.00 0.00 C ATOM 197 C LEU A 17 4.619 -1.369 14.837 1.00 0.00 C ATOM 198 O LEU A 17 4.839 -1.949 15.900 1.00 0.00 O ATOM 199 CB LEU A 17 4.125 -2.766 12.822 1.00 0.00 C ATOM 200 CG LEU A 17 4.539 -3.373 11.481 1.00 0.00 C ATOM 201 CD1 LEU A 17 3.488 -4.357 10.993 1.00 0.00 C ATOM 202 CD2 LEU A 17 4.768 -2.279 10.449 1.00 0.00 C ATOM 0 H LEU A 17 6.278 -3.529 14.203 1.00 0.00 H new ATOM 0 HA LEU A 17 5.397 -1.034 12.875 1.00 0.00 H new ATOM 0 HB2 LEU A 17 3.857 -3.578 13.498 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.225 -2.171 12.666 1.00 0.00 H new ATOM 0 HG LEU A 17 5.475 -3.914 11.622 1.00 0.00 H new ATOM 0 HD11 LEU A 17 3.800 -4.779 10.038 1.00 0.00 H new ATOM 0 HD12 LEU A 17 3.373 -5.158 11.723 1.00 0.00 H new ATOM 0 HD13 LEU A 17 2.536 -3.841 10.868 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.062 -2.729 9.501 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.848 -1.711 10.311 1.00 0.00 H new ATOM 0 HD23 LEU A 17 5.558 -1.612 10.795 1.00 0.00 H new ATOM 214 N PRO A 18 3.883 -0.249 14.774 1.00 0.00 N ATOM 215 CA PRO A 18 3.614 0.451 13.514 1.00 0.00 C ATOM 216 C PRO A 18 4.861 1.122 12.947 1.00 0.00 C ATOM 217 O PRO A 18 5.624 1.756 13.676 1.00 0.00 O ATOM 218 CB PRO A 18 2.574 1.503 13.908 1.00 0.00 C ATOM 219 CG PRO A 18 2.803 1.737 15.361 1.00 0.00 C ATOM 220 CD PRO A 18 3.256 0.419 15.926 1.00 0.00 C ATOM 0 HA PRO A 18 3.277 -0.230 12.733 1.00 0.00 H new ATOM 0 HB2 PRO A 18 2.702 2.421 13.334 1.00 0.00 H new ATOM 0 HB3 PRO A 18 1.561 1.148 13.719 1.00 0.00 H new ATOM 0 HG2 PRO A 18 3.557 2.509 15.518 1.00 0.00 H new ATOM 0 HG3 PRO A 18 1.891 2.078 15.850 1.00 0.00 H new ATOM 0 HD2 PRO A 18 3.962 0.554 16.745 1.00 0.00 H new ATOM 0 HD3 PRO A 18 2.419 -0.159 16.319 1.00 0.00 H new ATOM 228 N PHE A 19 5.062 0.978 11.641 1.00 0.00 N ATOM 229 CA PHE A 19 6.217 1.570 10.976 1.00 0.00 C ATOM 230 C PHE A 19 5.887 2.964 10.450 1.00 0.00 C ATOM 231 O PHE A 19 5.296 3.112 9.381 1.00 0.00 O ATOM 232 CB PHE A 19 6.683 0.676 9.825 1.00 0.00 C ATOM 233 CG PHE A 19 7.798 1.273 9.015 1.00 0.00 C ATOM 234 CD1 PHE A 19 9.079 1.363 9.537 1.00 0.00 C ATOM 235 CD2 PHE A 19 7.566 1.744 7.733 1.00 0.00 C ATOM 236 CE1 PHE A 19 10.107 1.912 8.794 1.00 0.00 C ATOM 237 CE2 PHE A 19 8.591 2.294 6.986 1.00 0.00 C ATOM 238 CZ PHE A 19 9.863 2.378 7.517 1.00 0.00 C ATOM 0 H PHE A 19 4.440 0.457 11.023 1.00 0.00 H new ATOM 0 HA PHE A 19 7.020 1.658 11.708 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.011 -0.282 10.229 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.837 0.472 9.169 1.00 0.00 H new ATOM 0 HD1 PHE A 19 9.276 1.000 10.535 1.00 0.00 H new ATOM 0 HD2 PHE A 19 6.573 1.681 7.312 1.00 0.00 H new ATOM 0 HE1 PHE A 19 11.101 1.977 9.212 1.00 0.00 H new ATOM 0 HE2 PHE A 19 8.397 2.658 5.988 1.00 0.00 H new ATOM 0 HZ PHE A 19 10.665 2.807 6.935 1.00 0.00 H new ATOM 248 N ALA A 20 6.272 3.983 11.211 1.00 0.00 N ATOM 249 CA ALA A 20 6.019 5.365 10.822 1.00 0.00 C ATOM 250 C ALA A 20 7.324 6.109 10.557 1.00 0.00 C ATOM 251 O ALA A 20 7.986 6.570 11.486 1.00 0.00 O ATOM 252 CB ALA A 20 5.213 6.077 11.898 1.00 0.00 C ATOM 0 H ALA A 20 6.760 3.878 12.100 1.00 0.00 H new ATOM 0 HA ALA A 20 5.442 5.356 9.897 1.00 0.00 H new ATOM 0 HB1 ALA A 20 5.031 7.108 11.594 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.260 5.566 12.036 1.00 0.00 H new ATOM 0 HB3 ALA A 20 5.769 6.068 12.835 1.00 0.00 H new ATOM 258 N ALA A 21 7.687 6.221 9.284 1.00 0.00 N ATOM 259 CA ALA A 21 8.912 6.910 8.897 1.00 0.00 C ATOM 260 C ALA A 21 8.712 7.707 7.612 1.00 0.00 C ATOM 261 O ALA A 21 8.007 7.269 6.703 1.00 0.00 O ATOM 262 CB ALA A 21 10.049 5.912 8.729 1.00 0.00 C ATOM 0 H ALA A 21 7.150 5.844 8.503 1.00 0.00 H new ATOM 0 HA ALA A 21 9.171 7.610 9.691 1.00 0.00 H new ATOM 0 HB1 ALA A 21 10.957 6.441 8.440 1.00 0.00 H new ATOM 0 HB2 ALA A 21 10.217 5.390 9.671 1.00 0.00 H new ATOM 0 HB3 ALA A 21 9.788 5.190 7.956 1.00 0.00 H new ATOM 268 N ARG A 22 9.335 8.879 7.545 1.00 0.00 N ATOM 269 CA ARG A 22 9.223 9.737 6.372 1.00 0.00 C ATOM 270 C ARG A 22 10.402 9.523 5.427 1.00 0.00 C ATOM 271 O ARG A 22 11.527 9.283 5.865 1.00 0.00 O ATOM 272 CB ARG A 22 9.155 11.206 6.794 1.00 0.00 C ATOM 273 CG ARG A 22 10.394 11.686 7.532 1.00 0.00 C ATOM 274 CD ARG A 22 10.183 13.067 8.134 1.00 0.00 C ATOM 275 NE ARG A 22 9.463 13.007 9.403 1.00 0.00 N ATOM 276 CZ ARG A 22 9.564 13.933 10.350 1.00 0.00 C ATOM 277 NH1 ARG A 22 10.350 14.986 10.171 1.00 0.00 N ATOM 278 NH2 ARG A 22 8.876 13.808 11.478 1.00 0.00 N ATOM 0 H ARG A 22 9.922 9.256 8.289 1.00 0.00 H new ATOM 0 HA ARG A 22 8.305 9.473 5.846 1.00 0.00 H new ATOM 0 HB2 ARG A 22 9.008 11.823 5.908 1.00 0.00 H new ATOM 0 HB3 ARG A 22 8.283 11.352 7.432 1.00 0.00 H new ATOM 0 HG2 ARG A 22 10.646 10.978 8.322 1.00 0.00 H new ATOM 0 HG3 ARG A 22 11.240 11.712 6.846 1.00 0.00 H new ATOM 0 HD2 ARG A 22 11.150 13.547 8.288 1.00 0.00 H new ATOM 0 HD3 ARG A 22 9.627 13.688 7.431 1.00 0.00 H new ATOM 0 HE ARG A 22 8.849 12.210 9.571 1.00 0.00 H new ATOM 0 HH11 ARG A 22 10.879 15.086 9.305 1.00 0.00 H new ATOM 0 HH12 ARG A 22 10.426 15.696 10.900 1.00 0.00 H new ATOM 0 HH21 ARG A 22 8.269 13.000 11.618 1.00 0.00 H new ATOM 0 HH22 ARG A 22 8.954 14.520 12.205 1.00 0.00 H new ATOM 292 N LEU A 23 10.135 9.610 4.128 1.00 0.00 N ATOM 293 CA LEU A 23 11.173 9.425 3.120 1.00 0.00 C ATOM 294 C LEU A 23 11.992 10.699 2.941 1.00 0.00 C ATOM 295 O LEU A 23 11.447 11.803 2.933 1.00 0.00 O ATOM 296 CB LEU A 23 10.548 9.015 1.785 1.00 0.00 C ATOM 297 CG LEU A 23 9.576 7.836 1.834 1.00 0.00 C ATOM 298 CD1 LEU A 23 8.874 7.668 0.495 1.00 0.00 C ATOM 299 CD2 LEU A 23 10.306 6.558 2.219 1.00 0.00 C ATOM 0 H LEU A 23 9.209 9.807 3.749 1.00 0.00 H new ATOM 0 HA LEU A 23 11.839 8.632 3.461 1.00 0.00 H new ATOM 0 HB2 LEU A 23 10.023 9.876 1.373 1.00 0.00 H new ATOM 0 HB3 LEU A 23 11.351 8.769 1.091 1.00 0.00 H new ATOM 0 HG LEU A 23 8.822 8.043 2.594 1.00 0.00 H new ATOM 0 HD11 LEU A 23 8.186 6.824 0.548 1.00 0.00 H new ATOM 0 HD12 LEU A 23 8.318 8.575 0.259 1.00 0.00 H new ATOM 0 HD13 LEU A 23 9.614 7.484 -0.283 1.00 0.00 H new ATOM 0 HD21 LEU A 23 9.598 5.730 2.249 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.082 6.346 1.483 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.762 6.681 3.201 1.00 0.00 H new ATOM 311 N ASN A 24 13.303 10.539 2.795 1.00 0.00 N ATOM 312 CA ASN A 24 14.197 11.677 2.614 1.00 0.00 C ATOM 313 C ASN A 24 13.574 12.716 1.687 1.00 0.00 C ATOM 314 O ASN A 24 13.653 13.918 1.941 1.00 0.00 O ATOM 315 CB ASN A 24 15.540 11.212 2.048 1.00 0.00 C ATOM 316 CG ASN A 24 16.209 10.171 2.926 1.00 0.00 C ATOM 317 OD1 ASN A 24 15.693 9.812 3.984 1.00 0.00 O ATOM 318 ND2 ASN A 24 17.364 9.683 2.489 1.00 0.00 N ATOM 0 H ASN A 24 13.770 9.632 2.798 1.00 0.00 H new ATOM 0 HA ASN A 24 14.361 12.137 3.588 1.00 0.00 H new ATOM 0 HB2 ASN A 24 15.387 10.799 1.051 1.00 0.00 H new ATOM 0 HB3 ASN A 24 16.202 12.071 1.939 1.00 0.00 H new ATOM 0 HD21 ASN A 24 17.861 8.981 3.037 1.00 0.00 H new ATOM 0 HD22 ASN A 24 17.754 10.010 1.605 1.00 0.00 H new ATOM 325 N THR A 25 12.953 12.244 0.610 1.00 0.00 N ATOM 326 CA THR A 25 12.317 13.131 -0.355 1.00 0.00 C ATOM 327 C THR A 25 10.860 12.744 -0.581 1.00 0.00 C ATOM 328 O THR A 25 10.470 11.586 -0.430 1.00 0.00 O ATOM 329 CB THR A 25 13.056 13.114 -1.707 1.00 0.00 C ATOM 330 OG1 THR A 25 13.092 11.781 -2.228 1.00 0.00 O ATOM 331 CG2 THR A 25 14.474 13.643 -1.555 1.00 0.00 C ATOM 0 H THR A 25 12.877 11.252 0.385 1.00 0.00 H new ATOM 0 HA THR A 25 12.363 14.137 0.063 1.00 0.00 H new ATOM 0 HB THR A 25 12.517 13.760 -2.400 1.00 0.00 H new ATOM 0 HG1 THR A 25 13.562 11.779 -3.088 1.00 0.00 H new ATOM 0 HG21 THR A 25 14.976 13.621 -2.522 1.00 0.00 H new ATOM 0 HG22 THR A 25 14.442 14.668 -1.185 1.00 0.00 H new ATOM 0 HG23 THR A 25 15.021 13.019 -0.848 1.00 0.00 H new ATOM 339 N PRO A 26 10.034 13.734 -0.952 1.00 0.00 N ATOM 340 CA PRO A 26 8.607 13.520 -1.208 1.00 0.00 C ATOM 341 C PRO A 26 8.360 12.707 -2.475 1.00 0.00 C ATOM 342 O PRO A 26 8.788 13.091 -3.563 1.00 0.00 O ATOM 343 CB PRO A 26 8.059 14.940 -1.369 1.00 0.00 C ATOM 344 CG PRO A 26 9.228 15.749 -1.815 1.00 0.00 C ATOM 345 CD PRO A 26 10.431 15.138 -1.152 1.00 0.00 C ATOM 0 HA PRO A 26 8.131 12.952 -0.409 1.00 0.00 H new ATOM 0 HB2 PRO A 26 7.253 14.972 -2.102 1.00 0.00 H new ATOM 0 HB3 PRO A 26 7.652 15.316 -0.430 1.00 0.00 H new ATOM 0 HG2 PRO A 26 9.327 15.727 -2.900 1.00 0.00 H new ATOM 0 HG3 PRO A 26 9.112 16.794 -1.527 1.00 0.00 H new ATOM 0 HD2 PRO A 26 11.319 15.219 -1.778 1.00 0.00 H new ATOM 0 HD3 PRO A 26 10.662 15.629 -0.207 1.00 0.00 H new ATOM 353 N MET A 27 7.668 11.583 -2.325 1.00 0.00 N ATOM 354 CA MET A 27 7.363 10.717 -3.458 1.00 0.00 C ATOM 355 C MET A 27 6.398 11.401 -4.421 1.00 0.00 C ATOM 356 O MET A 27 6.005 12.548 -4.211 1.00 0.00 O ATOM 357 CB MET A 27 6.765 9.395 -2.971 1.00 0.00 C ATOM 358 CG MET A 27 5.327 9.519 -2.493 1.00 0.00 C ATOM 359 SD MET A 27 4.399 7.984 -2.678 1.00 0.00 S ATOM 360 CE MET A 27 4.410 7.794 -4.459 1.00 0.00 C ATOM 0 H MET A 27 7.308 11.250 -1.431 1.00 0.00 H new ATOM 0 HA MET A 27 8.293 10.513 -3.988 1.00 0.00 H new ATOM 0 HB2 MET A 27 6.809 8.666 -3.780 1.00 0.00 H new ATOM 0 HB3 MET A 27 7.378 9.006 -2.158 1.00 0.00 H new ATOM 0 HG2 MET A 27 5.321 9.819 -1.445 1.00 0.00 H new ATOM 0 HG3 MET A 27 4.829 10.310 -3.053 1.00 0.00 H new ATOM 0 HE1 MET A 27 3.617 7.108 -4.757 1.00 0.00 H new ATOM 0 HE2 MET A 27 4.246 8.764 -4.929 1.00 0.00 H new ATOM 0 HE3 MET A 27 5.373 7.395 -4.776 1.00 0.00 H new ATOM 370 N GLY A 28 6.021 10.689 -5.479 1.00 0.00 N ATOM 371 CA GLY A 28 5.105 11.245 -6.459 1.00 0.00 C ATOM 372 C GLY A 28 5.110 10.470 -7.761 1.00 0.00 C ATOM 373 O GLY A 28 5.250 9.247 -7.780 1.00 0.00 O ATOM 0 H GLY A 28 6.333 9.738 -5.675 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.096 11.250 -6.047 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.374 12.283 -6.656 1.00 0.00 H new ATOM 377 N PRO A 29 4.951 11.189 -8.883 1.00 0.00 N ATOM 378 CA PRO A 29 4.932 10.581 -10.216 1.00 0.00 C ATOM 379 C PRO A 29 6.301 10.053 -10.632 1.00 0.00 C ATOM 380 O PRO A 29 7.324 10.690 -10.385 1.00 0.00 O ATOM 381 CB PRO A 29 4.505 11.736 -11.126 1.00 0.00 C ATOM 382 CG PRO A 29 4.922 12.966 -10.398 1.00 0.00 C ATOM 383 CD PRO A 29 4.777 12.650 -8.935 1.00 0.00 C ATOM 0 HA PRO A 29 4.269 9.717 -10.261 1.00 0.00 H new ATOM 0 HB2 PRO A 29 4.987 11.671 -12.101 1.00 0.00 H new ATOM 0 HB3 PRO A 29 3.429 11.725 -11.301 1.00 0.00 H new ATOM 0 HG2 PRO A 29 5.951 13.233 -10.640 1.00 0.00 H new ATOM 0 HG3 PRO A 29 4.299 13.815 -10.678 1.00 0.00 H new ATOM 0 HD2 PRO A 29 5.528 13.166 -8.336 1.00 0.00 H new ATOM 0 HD3 PRO A 29 3.802 12.952 -8.553 1.00 0.00 H new ATOM 391 N GLY A 30 6.312 8.884 -11.266 1.00 0.00 N ATOM 392 CA GLY A 30 7.561 8.291 -11.706 1.00 0.00 C ATOM 393 C GLY A 30 8.291 7.578 -10.585 1.00 0.00 C ATOM 394 O GLY A 30 9.156 6.739 -10.834 1.00 0.00 O ATOM 0 H GLY A 30 5.478 8.338 -11.482 1.00 0.00 H new ATOM 0 HA2 GLY A 30 7.360 7.585 -12.512 1.00 0.00 H new ATOM 0 HA3 GLY A 30 8.204 9.069 -12.117 1.00 0.00 H new ATOM 398 N ARG A 31 7.943 7.914 -9.347 1.00 0.00 N ATOM 399 CA ARG A 31 8.574 7.302 -8.184 1.00 0.00 C ATOM 400 C ARG A 31 7.927 5.959 -7.858 1.00 0.00 C ATOM 401 O ARG A 31 6.704 5.856 -7.754 1.00 0.00 O ATOM 402 CB ARG A 31 8.476 8.235 -6.975 1.00 0.00 C ATOM 403 CG ARG A 31 8.943 7.598 -5.676 1.00 0.00 C ATOM 404 CD ARG A 31 10.437 7.786 -5.468 1.00 0.00 C ATOM 405 NE ARG A 31 10.806 7.723 -4.056 1.00 0.00 N ATOM 406 CZ ARG A 31 11.802 8.423 -3.525 1.00 0.00 C ATOM 407 NH1 ARG A 31 12.525 9.235 -4.284 1.00 0.00 N ATOM 408 NH2 ARG A 31 12.076 8.312 -2.231 1.00 0.00 N ATOM 0 H ARG A 31 7.228 8.606 -9.124 1.00 0.00 H new ATOM 0 HA ARG A 31 9.625 7.132 -8.419 1.00 0.00 H new ATOM 0 HB2 ARG A 31 9.071 9.128 -7.167 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.442 8.559 -6.860 1.00 0.00 H new ATOM 0 HG2 ARG A 31 8.400 8.037 -4.839 1.00 0.00 H new ATOM 0 HG3 ARG A 31 8.707 6.534 -5.686 1.00 0.00 H new ATOM 0 HD2 ARG A 31 10.979 7.017 -6.019 1.00 0.00 H new ATOM 0 HD3 ARG A 31 10.742 8.748 -5.880 1.00 0.00 H new ATOM 0 HE ARG A 31 10.269 7.108 -3.444 1.00 0.00 H new ATOM 0 HH11 ARG A 31 12.317 9.323 -5.279 1.00 0.00 H new ATOM 0 HH12 ARG A 31 13.289 9.771 -3.873 1.00 0.00 H new ATOM 0 HH21 ARG A 31 11.522 7.689 -1.644 1.00 0.00 H new ATOM 0 HH22 ARG A 31 12.841 8.850 -1.824 1.00 0.00 H new ATOM 422 N THR A 32 8.756 4.932 -7.698 1.00 0.00 N ATOM 423 CA THR A 32 8.265 3.596 -7.385 1.00 0.00 C ATOM 424 C THR A 32 8.610 3.204 -5.953 1.00 0.00 C ATOM 425 O THR A 32 9.782 3.065 -5.602 1.00 0.00 O ATOM 426 CB THR A 32 8.848 2.544 -8.348 1.00 0.00 C ATOM 427 OG1 THR A 32 8.676 2.973 -9.704 1.00 0.00 O ATOM 428 CG2 THR A 32 8.174 1.195 -8.148 1.00 0.00 C ATOM 0 H THR A 32 9.770 5.000 -7.780 1.00 0.00 H new ATOM 0 HA THR A 32 7.181 3.623 -7.500 1.00 0.00 H new ATOM 0 HB THR A 32 9.911 2.436 -8.133 1.00 0.00 H new ATOM 0 HG1 THR A 32 9.051 2.300 -10.310 1.00 0.00 H new ATOM 0 HG21 THR A 32 8.602 0.468 -8.839 1.00 0.00 H new ATOM 0 HG22 THR A 32 8.331 0.858 -7.123 1.00 0.00 H new ATOM 0 HG23 THR A 32 7.105 1.291 -8.338 1.00 0.00 H new ATOM 436 N VAL A 33 7.583 3.026 -5.129 1.00 0.00 N ATOM 437 CA VAL A 33 7.778 2.648 -3.734 1.00 0.00 C ATOM 438 C VAL A 33 7.288 1.228 -3.476 1.00 0.00 C ATOM 439 O VAL A 33 6.085 0.965 -3.480 1.00 0.00 O ATOM 440 CB VAL A 33 7.046 3.614 -2.783 1.00 0.00 C ATOM 441 CG1 VAL A 33 7.146 3.126 -1.346 1.00 0.00 C ATOM 442 CG2 VAL A 33 7.607 5.021 -2.918 1.00 0.00 C ATOM 0 H VAL A 33 6.607 3.137 -5.403 1.00 0.00 H new ATOM 0 HA VAL A 33 8.849 2.700 -3.538 1.00 0.00 H new ATOM 0 HB VAL A 33 5.992 3.640 -3.060 1.00 0.00 H new ATOM 0 HG11 VAL A 33 6.623 3.821 -0.689 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.692 2.138 -1.265 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.194 3.069 -1.053 1.00 0.00 H new ATOM 0 HG21 VAL A 33 7.078 5.690 -2.239 1.00 0.00 H new ATOM 0 HG22 VAL A 33 8.668 5.015 -2.669 1.00 0.00 H new ATOM 0 HG23 VAL A 33 7.477 5.368 -3.943 1.00 0.00 H new ATOM 452 N VAL A 34 8.227 0.315 -3.251 1.00 0.00 N ATOM 453 CA VAL A 34 7.891 -1.079 -2.989 1.00 0.00 C ATOM 454 C VAL A 34 7.938 -1.385 -1.496 1.00 0.00 C ATOM 455 O VAL A 34 8.651 -0.726 -0.739 1.00 0.00 O ATOM 456 CB VAL A 34 8.846 -2.035 -3.728 1.00 0.00 C ATOM 457 CG1 VAL A 34 8.995 -1.622 -5.184 1.00 0.00 C ATOM 458 CG2 VAL A 34 10.200 -2.075 -3.036 1.00 0.00 C ATOM 0 H VAL A 34 9.227 0.516 -3.245 1.00 0.00 H new ATOM 0 HA VAL A 34 6.877 -1.234 -3.357 1.00 0.00 H new ATOM 0 HB VAL A 34 8.420 -3.038 -3.702 1.00 0.00 H new ATOM 0 HG11 VAL A 34 9.673 -2.309 -5.690 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.021 -1.650 -5.672 1.00 0.00 H new ATOM 0 HG13 VAL A 34 9.398 -0.611 -5.236 1.00 0.00 H new ATOM 0 HG21 VAL A 34 10.862 -2.755 -3.571 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.635 -1.076 -3.029 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.074 -2.423 -2.011 1.00 0.00 H new ATOM 468 N VAL A 35 7.174 -2.389 -1.079 1.00 0.00 N ATOM 469 CA VAL A 35 7.129 -2.784 0.324 1.00 0.00 C ATOM 470 C VAL A 35 7.336 -4.286 0.479 1.00 0.00 C ATOM 471 O VAL A 35 6.435 -5.080 0.206 1.00 0.00 O ATOM 472 CB VAL A 35 5.789 -2.391 0.975 1.00 0.00 C ATOM 473 CG1 VAL A 35 5.737 -2.868 2.419 1.00 0.00 C ATOM 474 CG2 VAL A 35 5.579 -0.887 0.894 1.00 0.00 C ATOM 0 H VAL A 35 6.578 -2.944 -1.693 1.00 0.00 H new ATOM 0 HA VAL A 35 7.938 -2.255 0.828 1.00 0.00 H new ATOM 0 HB VAL A 35 4.982 -2.878 0.427 1.00 0.00 H new ATOM 0 HG11 VAL A 35 4.783 -2.582 2.863 1.00 0.00 H new ATOM 0 HG12 VAL A 35 5.839 -3.953 2.448 1.00 0.00 H new ATOM 0 HG13 VAL A 35 6.551 -2.412 2.982 1.00 0.00 H new ATOM 0 HG21 VAL A 35 4.628 -0.627 1.358 1.00 0.00 H new ATOM 0 HG22 VAL A 35 6.389 -0.378 1.416 1.00 0.00 H new ATOM 0 HG23 VAL A 35 5.569 -0.577 -0.151 1.00 0.00 H new ATOM 484 N LYS A 36 8.529 -4.671 0.920 1.00 0.00 N ATOM 485 CA LYS A 36 8.856 -6.079 1.114 1.00 0.00 C ATOM 486 C LYS A 36 8.604 -6.502 2.557 1.00 0.00 C ATOM 487 O LYS A 36 9.092 -5.871 3.494 1.00 0.00 O ATOM 488 CB LYS A 36 10.317 -6.340 0.743 1.00 0.00 C ATOM 489 CG LYS A 36 10.627 -6.087 -0.723 1.00 0.00 C ATOM 490 CD LYS A 36 12.122 -5.958 -0.963 1.00 0.00 C ATOM 491 CE LYS A 36 12.417 -5.295 -2.299 1.00 0.00 C ATOM 492 NZ LYS A 36 12.054 -6.172 -3.446 1.00 0.00 N ATOM 0 H LYS A 36 9.286 -4.027 1.150 1.00 0.00 H new ATOM 0 HA LYS A 36 8.211 -6.669 0.463 1.00 0.00 H new ATOM 0 HB2 LYS A 36 10.958 -5.706 1.356 1.00 0.00 H new ATOM 0 HB3 LYS A 36 10.566 -7.373 0.985 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.230 -6.904 -1.326 1.00 0.00 H new ATOM 0 HG3 LYS A 36 10.125 -5.176 -1.050 1.00 0.00 H new ATOM 0 HD2 LYS A 36 12.572 -5.375 -0.159 1.00 0.00 H new ATOM 0 HD3 LYS A 36 12.582 -6.946 -0.936 1.00 0.00 H new ATOM 0 HE2 LYS A 36 11.864 -4.358 -2.369 1.00 0.00 H new ATOM 0 HE3 LYS A 36 13.477 -5.045 -2.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 12.270 -5.684 -4.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 12.600 -7.056 -3.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 11.038 -6.390 -3.408 1.00 0.00 H new ATOM 506 N GLY A 37 7.839 -7.576 2.730 1.00 0.00 N ATOM 507 CA GLY A 37 7.536 -8.065 4.062 1.00 0.00 C ATOM 508 C GLY A 37 6.954 -9.465 4.047 1.00 0.00 C ATOM 509 O GLY A 37 7.022 -10.161 3.035 1.00 0.00 O ATOM 0 H GLY A 37 7.424 -8.116 1.971 1.00 0.00 H new ATOM 0 HA2 GLY A 37 8.445 -8.059 4.663 1.00 0.00 H new ATOM 0 HA3 GLY A 37 6.831 -7.387 4.543 1.00 0.00 H new ATOM 513 N GLU A 38 6.381 -9.878 5.174 1.00 0.00 N ATOM 514 CA GLU A 38 5.788 -11.205 5.286 1.00 0.00 C ATOM 515 C GLU A 38 4.602 -11.190 6.246 1.00 0.00 C ATOM 516 O GLU A 38 4.481 -10.301 7.089 1.00 0.00 O ATOM 517 CB GLU A 38 6.832 -12.216 5.763 1.00 0.00 C ATOM 518 CG GLU A 38 7.816 -12.630 4.682 1.00 0.00 C ATOM 519 CD GLU A 38 8.755 -13.730 5.138 1.00 0.00 C ATOM 520 OE1 GLU A 38 8.258 -14.774 5.611 1.00 0.00 O ATOM 521 OE2 GLU A 38 9.984 -13.548 5.022 1.00 0.00 O ATOM 0 H GLU A 38 6.315 -9.313 6.021 1.00 0.00 H new ATOM 0 HA GLU A 38 5.432 -11.501 4.299 1.00 0.00 H new ATOM 0 HB2 GLU A 38 7.384 -11.788 6.600 1.00 0.00 H new ATOM 0 HB3 GLU A 38 6.322 -13.103 6.137 1.00 0.00 H new ATOM 0 HG2 GLU A 38 7.265 -12.968 3.805 1.00 0.00 H new ATOM 0 HG3 GLU A 38 8.400 -11.762 4.376 1.00 0.00 H new ATOM 528 N VAL A 39 3.727 -12.182 6.112 1.00 0.00 N ATOM 529 CA VAL A 39 2.550 -12.285 6.966 1.00 0.00 C ATOM 530 C VAL A 39 2.728 -13.376 8.016 1.00 0.00 C ATOM 531 O VAL A 39 3.356 -14.402 7.760 1.00 0.00 O ATOM 532 CB VAL A 39 1.283 -12.581 6.143 1.00 0.00 C ATOM 533 CG1 VAL A 39 0.046 -12.522 7.027 1.00 0.00 C ATOM 534 CG2 VAL A 39 1.164 -11.608 4.980 1.00 0.00 C ATOM 0 H VAL A 39 3.811 -12.926 5.419 1.00 0.00 H new ATOM 0 HA VAL A 39 2.434 -11.322 7.463 1.00 0.00 H new ATOM 0 HB VAL A 39 1.362 -13.589 5.737 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.840 -12.734 6.428 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.132 -13.262 7.822 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.041 -11.528 7.465 1.00 0.00 H new ATOM 0 HG21 VAL A 39 0.263 -11.832 4.409 1.00 0.00 H new ATOM 0 HG22 VAL A 39 1.107 -10.589 5.363 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.036 -11.705 4.334 1.00 0.00 H new ATOM 544 N ASN A 40 2.168 -13.147 9.200 1.00 0.00 N ATOM 545 CA ASN A 40 2.265 -14.111 10.290 1.00 0.00 C ATOM 546 C ASN A 40 1.226 -15.218 10.131 1.00 0.00 C ATOM 547 O ASN A 40 0.117 -14.978 9.656 1.00 0.00 O ATOM 548 CB ASN A 40 2.077 -13.410 11.637 1.00 0.00 C ATOM 549 CG ASN A 40 3.179 -12.409 11.926 1.00 0.00 C ATOM 550 OD1 ASN A 40 4.357 -12.682 11.693 1.00 0.00 O ATOM 551 ND2 ASN A 40 2.801 -11.243 12.436 1.00 0.00 N ATOM 0 H ASN A 40 1.643 -12.303 9.429 1.00 0.00 H new ATOM 0 HA ASN A 40 3.257 -14.560 10.257 1.00 0.00 H new ATOM 0 HB2 ASN A 40 1.114 -12.899 11.647 1.00 0.00 H new ATOM 0 HB3 ASN A 40 2.050 -14.156 12.431 1.00 0.00 H new ATOM 0 HD21 ASN A 40 3.498 -10.530 12.651 1.00 0.00 H new ATOM 0 HD22 ASN A 40 1.813 -11.060 12.613 1.00 0.00 H new ATOM 558 N ALA A 41 1.594 -16.430 10.533 1.00 0.00 N ATOM 559 CA ALA A 41 0.694 -17.572 10.438 1.00 0.00 C ATOM 560 C ALA A 41 -0.656 -17.262 11.074 1.00 0.00 C ATOM 561 O ALA A 41 -1.700 -17.668 10.566 1.00 0.00 O ATOM 562 CB ALA A 41 1.320 -18.794 11.095 1.00 0.00 C ATOM 0 H ALA A 41 2.509 -16.646 10.928 1.00 0.00 H new ATOM 0 HA ALA A 41 0.529 -17.785 9.382 1.00 0.00 H new ATOM 0 HB1 ALA A 41 0.637 -19.639 11.017 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.257 -19.037 10.594 1.00 0.00 H new ATOM 0 HB3 ALA A 41 1.516 -18.582 12.146 1.00 0.00 H new ATOM 568 N ASN A 42 -0.628 -16.539 12.189 1.00 0.00 N ATOM 569 CA ASN A 42 -1.851 -16.175 12.895 1.00 0.00 C ATOM 570 C ASN A 42 -2.148 -14.687 12.737 1.00 0.00 C ATOM 571 O ASN A 42 -2.645 -14.041 13.659 1.00 0.00 O ATOM 572 CB ASN A 42 -1.732 -16.527 14.379 1.00 0.00 C ATOM 573 CG ASN A 42 -1.216 -17.936 14.599 1.00 0.00 C ATOM 574 OD1 ASN A 42 -1.854 -18.912 14.203 1.00 0.00 O ATOM 575 ND2 ASN A 42 -0.055 -18.049 15.235 1.00 0.00 N ATOM 0 H ASN A 42 0.228 -16.194 12.623 1.00 0.00 H new ATOM 0 HA ASN A 42 -2.674 -16.741 12.459 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -1.062 -15.818 14.865 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -2.707 -16.422 14.854 1.00 0.00 H new ATOM 0 HD21 ASN A 42 0.342 -18.972 15.413 1.00 0.00 H new ATOM 0 HD22 ASN A 42 0.440 -17.213 15.546 1.00 0.00 H new ATOM 582 N ALA A 43 -1.842 -14.150 11.560 1.00 0.00 N ATOM 583 CA ALA A 43 -2.078 -12.739 11.280 1.00 0.00 C ATOM 584 C ALA A 43 -3.541 -12.487 10.932 1.00 0.00 C ATOM 585 O ALA A 43 -4.081 -13.084 10.001 1.00 0.00 O ATOM 586 CB ALA A 43 -1.176 -12.268 10.149 1.00 0.00 C ATOM 0 H ALA A 43 -1.430 -14.671 10.786 1.00 0.00 H new ATOM 0 HA ALA A 43 -1.842 -12.170 12.179 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.363 -11.213 9.950 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -0.133 -12.405 10.435 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -1.385 -12.849 9.251 1.00 0.00 H new ATOM 592 N LYS A 44 -4.179 -11.598 11.686 1.00 0.00 N ATOM 593 CA LYS A 44 -5.580 -11.265 11.458 1.00 0.00 C ATOM 594 C LYS A 44 -5.743 -10.443 10.183 1.00 0.00 C ATOM 595 O LYS A 44 -6.463 -10.839 9.267 1.00 0.00 O ATOM 596 CB LYS A 44 -6.142 -10.490 12.652 1.00 0.00 C ATOM 597 CG LYS A 44 -7.659 -10.517 12.735 1.00 0.00 C ATOM 598 CD LYS A 44 -8.161 -11.813 13.348 1.00 0.00 C ATOM 599 CE LYS A 44 -9.570 -12.142 12.880 1.00 0.00 C ATOM 600 NZ LYS A 44 -10.589 -11.283 13.545 1.00 0.00 N ATOM 0 H LYS A 44 -3.747 -11.095 12.461 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.135 -12.196 11.343 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.729 -10.905 13.571 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.808 -9.454 12.592 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -8.007 -9.673 13.331 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -8.081 -10.398 11.737 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -7.488 -12.628 13.081 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -8.147 -11.732 14.435 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -9.634 -12.011 11.800 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -9.787 -13.190 13.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -11.536 -11.538 13.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -10.545 -11.426 14.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -10.398 -10.284 13.326 1.00 0.00 H new ATOM 614 N SER A 45 -5.070 -9.299 10.132 1.00 0.00 N ATOM 615 CA SER A 45 -5.143 -8.420 8.970 1.00 0.00 C ATOM 616 C SER A 45 -4.171 -7.253 9.110 1.00 0.00 C ATOM 617 O SER A 45 -3.852 -6.824 10.219 1.00 0.00 O ATOM 618 CB SER A 45 -6.568 -7.894 8.790 1.00 0.00 C ATOM 619 OG SER A 45 -7.341 -8.776 7.995 1.00 0.00 O ATOM 0 H SER A 45 -4.468 -8.958 10.881 1.00 0.00 H new ATOM 0 HA SER A 45 -4.864 -8.999 8.089 1.00 0.00 H new ATOM 0 HB2 SER A 45 -7.039 -7.771 9.765 1.00 0.00 H new ATOM 0 HB3 SER A 45 -6.539 -6.909 8.323 1.00 0.00 H new ATOM 0 HG SER A 45 -7.210 -9.696 8.306 1.00 0.00 H new ATOM 625 N PHE A 46 -3.703 -6.742 7.976 1.00 0.00 N ATOM 626 CA PHE A 46 -2.766 -5.624 7.970 1.00 0.00 C ATOM 627 C PHE A 46 -3.308 -4.465 7.139 1.00 0.00 C ATOM 628 O PHE A 46 -4.347 -4.584 6.490 1.00 0.00 O ATOM 629 CB PHE A 46 -1.410 -6.070 7.421 1.00 0.00 C ATOM 630 CG PHE A 46 -1.486 -6.656 6.040 1.00 0.00 C ATOM 631 CD1 PHE A 46 -2.158 -7.846 5.814 1.00 0.00 C ATOM 632 CD2 PHE A 46 -0.885 -6.016 4.968 1.00 0.00 C ATOM 633 CE1 PHE A 46 -2.228 -8.387 4.544 1.00 0.00 C ATOM 634 CE2 PHE A 46 -0.952 -6.552 3.696 1.00 0.00 C ATOM 635 CZ PHE A 46 -1.626 -7.739 3.484 1.00 0.00 C ATOM 0 H PHE A 46 -3.957 -7.084 7.049 1.00 0.00 H new ATOM 0 HA PHE A 46 -2.639 -5.283 8.998 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -0.733 -5.215 7.408 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -0.978 -6.808 8.097 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -2.632 -8.357 6.639 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.358 -5.087 5.128 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -2.753 -9.316 4.381 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -0.478 -6.044 2.869 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.682 -8.159 2.491 1.00 0.00 H new ATOM 645 N ASN A 47 -2.596 -3.343 7.164 1.00 0.00 N ATOM 646 CA ASN A 47 -3.005 -2.161 6.413 1.00 0.00 C ATOM 647 C ASN A 47 -1.826 -1.216 6.202 1.00 0.00 C ATOM 648 O ASN A 47 -0.893 -1.180 7.005 1.00 0.00 O ATOM 649 CB ASN A 47 -4.132 -1.431 7.146 1.00 0.00 C ATOM 650 CG ASN A 47 -3.719 -0.970 8.530 1.00 0.00 C ATOM 651 OD1 ASN A 47 -3.043 0.172 8.595 1.00 0.00 O flip ATOM 652 ND2 ASN A 47 -4.005 -1.631 9.528 1.00 0.00 N flip ATOM 0 H ASN A 47 -1.733 -3.227 7.696 1.00 0.00 H new ATOM 0 HA ASN A 47 -3.366 -2.487 5.438 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -4.445 -0.569 6.558 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -4.995 -2.091 7.229 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -4.526 -2.503 9.430 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -3.721 -1.307 10.453 1.00 0.00 H new ATOM 659 N VAL A 48 -1.874 -0.452 5.115 1.00 0.00 N ATOM 660 CA VAL A 48 -0.812 0.495 4.798 1.00 0.00 C ATOM 661 C VAL A 48 -1.375 1.890 4.551 1.00 0.00 C ATOM 662 O VAL A 48 -1.892 2.180 3.472 1.00 0.00 O ATOM 663 CB VAL A 48 -0.014 0.048 3.559 1.00 0.00 C ATOM 664 CG1 VAL A 48 1.006 1.108 3.170 1.00 0.00 C ATOM 665 CG2 VAL A 48 0.665 -1.288 3.816 1.00 0.00 C ATOM 0 H VAL A 48 -2.638 -0.471 4.439 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.145 0.524 5.660 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.708 -0.077 2.727 1.00 0.00 H new ATOM 0 HG11 VAL A 48 1.560 0.775 2.293 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.492 2.041 2.941 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.698 1.268 3.997 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.224 -1.588 2.930 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.347 -1.193 4.661 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.089 -2.042 4.042 1.00 0.00 H new ATOM 675 N ASP A 49 -1.270 2.751 5.558 1.00 0.00 N ATOM 676 CA ASP A 49 -1.767 4.117 5.450 1.00 0.00 C ATOM 677 C ASP A 49 -0.683 5.049 4.917 1.00 0.00 C ATOM 678 O ASP A 49 0.300 5.332 5.604 1.00 0.00 O ATOM 679 CB ASP A 49 -2.259 4.612 6.811 1.00 0.00 C ATOM 680 CG ASP A 49 -3.057 3.560 7.556 1.00 0.00 C ATOM 681 OD1 ASP A 49 -4.241 3.358 7.211 1.00 0.00 O ATOM 682 OD2 ASP A 49 -2.499 2.939 8.483 1.00 0.00 O ATOM 0 H ASP A 49 -0.845 2.527 6.458 1.00 0.00 H new ATOM 0 HA ASP A 49 -2.601 4.120 4.748 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -1.403 4.911 7.416 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -2.876 5.500 6.670 1.00 0.00 H new ATOM 687 N LEU A 50 -0.868 5.523 3.690 1.00 0.00 N ATOM 688 CA LEU A 50 0.095 6.423 3.064 1.00 0.00 C ATOM 689 C LEU A 50 -0.426 7.856 3.055 1.00 0.00 C ATOM 690 O LEU A 50 -1.340 8.192 2.300 1.00 0.00 O ATOM 691 CB LEU A 50 0.393 5.967 1.634 1.00 0.00 C ATOM 692 CG LEU A 50 1.312 6.877 0.818 1.00 0.00 C ATOM 693 CD1 LEU A 50 2.771 6.574 1.122 1.00 0.00 C ATOM 694 CD2 LEU A 50 1.031 6.722 -0.669 1.00 0.00 C ATOM 0 H LEU A 50 -1.676 5.299 3.109 1.00 0.00 H new ATOM 0 HA LEU A 50 1.015 6.394 3.647 1.00 0.00 H new ATOM 0 HB2 LEU A 50 0.842 4.975 1.676 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -0.553 5.867 1.101 1.00 0.00 H new ATOM 0 HG LEU A 50 1.112 7.911 1.099 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.410 7.231 0.532 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.963 6.737 2.182 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.987 5.536 0.870 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.694 7.377 -1.235 1.00 0.00 H new ATOM 0 HD22 LEU A 50 1.203 5.687 -0.966 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.005 6.991 -0.873 1.00 0.00 H new ATOM 706 N LEU A 51 0.162 8.699 3.897 1.00 0.00 N ATOM 707 CA LEU A 51 -0.241 10.098 3.985 1.00 0.00 C ATOM 708 C LEU A 51 0.947 11.023 3.738 1.00 0.00 C ATOM 709 O LEU A 51 2.079 10.567 3.579 1.00 0.00 O ATOM 710 CB LEU A 51 -0.850 10.389 5.358 1.00 0.00 C ATOM 711 CG LEU A 51 -0.268 9.600 6.531 1.00 0.00 C ATOM 712 CD1 LEU A 51 1.155 10.051 6.824 1.00 0.00 C ATOM 713 CD2 LEU A 51 -1.144 9.757 7.766 1.00 0.00 C ATOM 0 H LEU A 51 0.919 8.438 4.528 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.990 10.284 3.215 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.733 11.452 5.567 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.921 10.190 5.308 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.244 8.545 6.258 1.00 0.00 H new ATOM 0 HD11 LEU A 51 1.553 9.478 7.662 1.00 0.00 H new ATOM 0 HD12 LEU A 51 1.777 9.887 5.944 1.00 0.00 H new ATOM 0 HD13 LEU A 51 1.156 11.111 7.076 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -0.715 9.189 8.591 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.200 10.810 8.041 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -2.146 9.385 7.551 1.00 0.00 H new ATOM 725 N ALA A 52 0.680 12.325 3.708 1.00 0.00 N ATOM 726 CA ALA A 52 1.727 13.314 3.484 1.00 0.00 C ATOM 727 C ALA A 52 2.020 14.101 4.757 1.00 0.00 C ATOM 728 O ALA A 52 1.109 14.440 5.512 1.00 0.00 O ATOM 729 CB ALA A 52 1.330 14.257 2.358 1.00 0.00 C ATOM 0 H ALA A 52 -0.252 12.719 3.836 1.00 0.00 H new ATOM 0 HA ALA A 52 2.636 12.786 3.197 1.00 0.00 H new ATOM 0 HB1 ALA A 52 2.121 14.990 2.202 1.00 0.00 H new ATOM 0 HB2 ALA A 52 1.178 13.686 1.442 1.00 0.00 H new ATOM 0 HB3 ALA A 52 0.406 14.771 2.623 1.00 0.00 H new ATOM 735 N GLY A 53 3.297 14.388 4.990 1.00 0.00 N ATOM 736 CA GLY A 53 3.686 15.133 6.173 1.00 0.00 C ATOM 737 C GLY A 53 3.438 16.621 6.030 1.00 0.00 C ATOM 738 O GLY A 53 4.012 17.428 6.761 1.00 0.00 O ATOM 0 H GLY A 53 4.069 14.118 4.381 1.00 0.00 H new ATOM 0 HA2 GLY A 53 3.133 14.757 7.033 1.00 0.00 H new ATOM 0 HA3 GLY A 53 4.743 14.962 6.375 1.00 0.00 H new ATOM 742 N LYS A 54 2.580 16.988 5.083 1.00 0.00 N ATOM 743 CA LYS A 54 2.256 18.389 4.845 1.00 0.00 C ATOM 744 C LYS A 54 0.914 18.751 5.472 1.00 0.00 C ATOM 745 O LYS A 54 0.833 19.643 6.317 1.00 0.00 O ATOM 746 CB LYS A 54 2.223 18.678 3.342 1.00 0.00 C ATOM 747 CG LYS A 54 3.596 18.916 2.738 1.00 0.00 C ATOM 748 CD LYS A 54 3.500 19.323 1.277 1.00 0.00 C ATOM 749 CE LYS A 54 4.652 20.231 0.875 1.00 0.00 C ATOM 750 NZ LYS A 54 5.953 19.508 0.873 1.00 0.00 N ATOM 0 H LYS A 54 2.097 16.333 4.468 1.00 0.00 H new ATOM 0 HA LYS A 54 3.031 18.999 5.309 1.00 0.00 H new ATOM 0 HB2 LYS A 54 1.750 17.840 2.830 1.00 0.00 H new ATOM 0 HB3 LYS A 54 1.600 19.554 3.163 1.00 0.00 H new ATOM 0 HG2 LYS A 54 4.112 19.694 3.300 1.00 0.00 H new ATOM 0 HG3 LYS A 54 4.195 18.010 2.825 1.00 0.00 H new ATOM 0 HD2 LYS A 54 3.501 18.432 0.649 1.00 0.00 H new ATOM 0 HD3 LYS A 54 2.554 19.835 1.102 1.00 0.00 H new ATOM 0 HE2 LYS A 54 4.463 20.640 -0.117 1.00 0.00 H new ATOM 0 HE3 LYS A 54 4.706 21.075 1.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 6.713 20.161 0.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 6.146 19.139 1.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 5.910 18.718 0.198 1.00 0.00 H new ATOM 764 N SER A 55 -0.137 18.053 5.055 1.00 0.00 N ATOM 765 CA SER A 55 -1.477 18.303 5.575 1.00 0.00 C ATOM 766 C SER A 55 -2.061 17.041 6.200 1.00 0.00 C ATOM 767 O SER A 55 -3.278 16.857 6.237 1.00 0.00 O ATOM 768 CB SER A 55 -2.394 18.805 4.458 1.00 0.00 C ATOM 769 OG SER A 55 -2.006 20.096 4.020 1.00 0.00 O ATOM 0 H SER A 55 -0.087 17.310 4.358 1.00 0.00 H new ATOM 0 HA SER A 55 -1.404 19.069 6.347 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.365 18.109 3.619 1.00 0.00 H new ATOM 0 HB3 SER A 55 -3.424 18.833 4.814 1.00 0.00 H new ATOM 0 HG SER A 55 -2.607 20.393 3.305 1.00 0.00 H new ATOM 775 N LYS A 56 -1.185 16.171 6.692 1.00 0.00 N ATOM 776 CA LYS A 56 -1.611 14.925 7.317 1.00 0.00 C ATOM 777 C LYS A 56 -2.840 14.356 6.615 1.00 0.00 C ATOM 778 O LYS A 56 -3.818 13.981 7.262 1.00 0.00 O ATOM 779 CB LYS A 56 -1.917 15.153 8.799 1.00 0.00 C ATOM 780 CG LYS A 56 -0.695 15.052 9.695 1.00 0.00 C ATOM 781 CD LYS A 56 0.029 16.384 9.802 1.00 0.00 C ATOM 782 CE LYS A 56 -0.613 17.286 10.844 1.00 0.00 C ATOM 783 NZ LYS A 56 -0.417 18.727 10.527 1.00 0.00 N ATOM 0 H LYS A 56 -0.174 16.307 6.670 1.00 0.00 H new ATOM 0 HA LYS A 56 -0.797 14.205 7.226 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.366 16.139 8.921 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -2.658 14.423 9.125 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.997 14.720 10.688 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.015 14.298 9.300 1.00 0.00 H new ATOM 0 HD2 LYS A 56 1.073 16.212 10.063 1.00 0.00 H new ATOM 0 HD3 LYS A 56 0.020 16.883 8.833 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -1.680 17.069 10.904 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -0.188 17.069 11.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -0.869 19.309 11.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 0.600 18.940 10.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -0.845 18.941 9.604 1.00 0.00 H new ATOM 797 N ASP A 57 -2.783 14.294 5.289 1.00 0.00 N ATOM 798 CA ASP A 57 -3.890 13.769 4.500 1.00 0.00 C ATOM 799 C ASP A 57 -3.493 12.471 3.802 1.00 0.00 C ATOM 800 O ASP A 57 -2.518 12.432 3.051 1.00 0.00 O ATOM 801 CB ASP A 57 -4.342 14.801 3.465 1.00 0.00 C ATOM 802 CG ASP A 57 -5.358 15.776 4.026 1.00 0.00 C ATOM 803 OD1 ASP A 57 -6.268 15.331 4.756 1.00 0.00 O ATOM 804 OD2 ASP A 57 -5.244 16.985 3.733 1.00 0.00 O ATOM 0 H ASP A 57 -1.981 14.601 4.738 1.00 0.00 H new ATOM 0 HA ASP A 57 -4.718 13.558 5.177 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -3.474 15.353 3.103 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -4.773 14.286 2.606 1.00 0.00 H new ATOM 809 N ILE A 58 -4.254 11.412 4.057 1.00 0.00 N ATOM 810 CA ILE A 58 -3.981 10.113 3.454 1.00 0.00 C ATOM 811 C ILE A 58 -4.357 10.104 1.976 1.00 0.00 C ATOM 812 O ILE A 58 -5.513 10.325 1.618 1.00 0.00 O ATOM 813 CB ILE A 58 -4.745 8.987 4.174 1.00 0.00 C ATOM 814 CG1 ILE A 58 -4.297 8.889 5.634 1.00 0.00 C ATOM 815 CG2 ILE A 58 -4.530 7.661 3.459 1.00 0.00 C ATOM 816 CD1 ILE A 58 -5.224 8.061 6.496 1.00 0.00 C ATOM 0 H ILE A 58 -5.064 11.428 4.677 1.00 0.00 H new ATOM 0 HA ILE A 58 -2.910 9.936 3.555 1.00 0.00 H new ATOM 0 HB ILE A 58 -5.810 9.220 4.155 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -3.297 8.457 5.671 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.226 9.893 6.052 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -5.076 6.874 3.979 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -4.893 7.737 2.434 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.467 7.420 3.451 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.845 8.035 7.518 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -6.220 8.505 6.490 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -5.277 7.046 6.103 1.00 0.00 H new ATOM 828 N ALA A 59 -3.372 9.844 1.122 1.00 0.00 N ATOM 829 CA ALA A 59 -3.600 9.801 -0.317 1.00 0.00 C ATOM 830 C ALA A 59 -4.248 8.484 -0.731 1.00 0.00 C ATOM 831 O ALA A 59 -5.161 8.462 -1.557 1.00 0.00 O ATOM 832 CB ALA A 59 -2.291 10.006 -1.065 1.00 0.00 C ATOM 0 H ALA A 59 -2.409 9.660 1.402 1.00 0.00 H new ATOM 0 HA ALA A 59 -4.284 10.609 -0.576 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -2.476 9.971 -2.139 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.869 10.975 -0.801 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.589 9.218 -0.792 1.00 0.00 H new ATOM 838 N LEU A 60 -3.769 7.388 -0.154 1.00 0.00 N ATOM 839 CA LEU A 60 -4.301 6.065 -0.464 1.00 0.00 C ATOM 840 C LEU A 60 -4.367 5.197 0.789 1.00 0.00 C ATOM 841 O LEU A 60 -3.410 5.131 1.562 1.00 0.00 O ATOM 842 CB LEU A 60 -3.438 5.383 -1.526 1.00 0.00 C ATOM 843 CG LEU A 60 -3.692 3.890 -1.740 1.00 0.00 C ATOM 844 CD1 LEU A 60 -4.926 3.677 -2.602 1.00 0.00 C ATOM 845 CD2 LEU A 60 -2.476 3.228 -2.372 1.00 0.00 C ATOM 0 H LEU A 60 -3.013 7.389 0.531 1.00 0.00 H new ATOM 0 HA LEU A 60 -5.312 6.189 -0.851 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -3.591 5.897 -2.475 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -2.391 5.518 -1.256 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.869 3.428 -0.769 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.091 2.609 -2.744 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -5.794 4.116 -2.110 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.779 4.153 -3.572 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -2.674 2.166 -2.517 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.268 3.693 -3.336 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -1.614 3.350 -1.717 1.00 0.00 H new ATOM 857 N HIS A 61 -5.501 4.532 0.983 1.00 0.00 N ATOM 858 CA HIS A 61 -5.690 3.665 2.141 1.00 0.00 C ATOM 859 C HIS A 61 -6.050 2.248 1.705 1.00 0.00 C ATOM 860 O HIS A 61 -7.212 1.951 1.421 1.00 0.00 O ATOM 861 CB HIS A 61 -6.784 4.225 3.050 1.00 0.00 C ATOM 862 CG HIS A 61 -7.302 3.232 4.045 1.00 0.00 C ATOM 863 ND1 HIS A 61 -8.531 2.683 4.188 1.00 0.00 N flip ATOM 864 CD2 HIS A 61 -6.523 2.693 5.046 1.00 0.00 C flip ATOM 865 CE1 HIS A 61 -8.472 1.829 5.263 1.00 0.00 C flip ATOM 866 NE2 HIS A 61 -7.250 1.853 5.762 1.00 0.00 N flip ATOM 0 H HIS A 61 -6.303 4.577 0.354 1.00 0.00 H new ATOM 0 HA HIS A 61 -4.752 3.629 2.694 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -6.394 5.092 3.583 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -7.612 4.576 2.434 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -5.482 2.921 5.218 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -9.292 1.235 5.639 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -6.922 1.315 6.564 1.00 0.00 H new ATOM 874 N LEU A 62 -5.049 1.377 1.654 1.00 0.00 N ATOM 875 CA LEU A 62 -5.260 -0.010 1.252 1.00 0.00 C ATOM 876 C LEU A 62 -5.092 -0.952 2.440 1.00 0.00 C ATOM 877 O LEU A 62 -3.973 -1.268 2.841 1.00 0.00 O ATOM 878 CB LEU A 62 -4.282 -0.393 0.140 1.00 0.00 C ATOM 879 CG LEU A 62 -4.456 0.341 -1.189 1.00 0.00 C ATOM 880 CD1 LEU A 62 -3.343 -0.034 -2.156 1.00 0.00 C ATOM 881 CD2 LEU A 62 -5.817 0.033 -1.795 1.00 0.00 C ATOM 0 H LEU A 62 -4.083 1.606 1.886 1.00 0.00 H new ATOM 0 HA LEU A 62 -6.280 -0.104 0.879 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -3.268 -0.217 0.499 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.374 -1.463 -0.044 1.00 0.00 H new ATOM 0 HG LEU A 62 -4.399 1.413 -0.999 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.484 0.498 -3.097 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.380 0.239 -1.725 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.367 -1.108 -2.340 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.923 0.564 -2.741 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.903 -1.039 -1.970 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.601 0.353 -1.109 1.00 0.00 H new ATOM 893 N ASN A 63 -6.213 -1.399 2.997 1.00 0.00 N ATOM 894 CA ASN A 63 -6.191 -2.308 4.137 1.00 0.00 C ATOM 895 C ASN A 63 -6.769 -3.668 3.761 1.00 0.00 C ATOM 896 O ASN A 63 -7.983 -3.869 3.737 1.00 0.00 O ATOM 897 CB ASN A 63 -6.978 -1.712 5.306 1.00 0.00 C ATOM 898 CG ASN A 63 -7.628 -2.777 6.168 1.00 0.00 C ATOM 899 OD1 ASN A 63 -8.840 -2.760 6.386 1.00 0.00 O ATOM 900 ND2 ASN A 63 -6.823 -3.710 6.663 1.00 0.00 N ATOM 0 H ASN A 63 -7.148 -1.146 2.677 1.00 0.00 H new ATOM 0 HA ASN A 63 -5.153 -2.446 4.439 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -6.310 -1.109 5.921 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -7.746 -1.042 4.919 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -7.203 -4.452 7.250 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -5.825 -3.684 6.456 1.00 0.00 H new ATOM 907 N PRO A 64 -5.880 -4.627 3.460 1.00 0.00 N ATOM 908 CA PRO A 64 -6.279 -5.985 3.081 1.00 0.00 C ATOM 909 C PRO A 64 -6.869 -6.764 4.251 1.00 0.00 C ATOM 910 O PRO A 64 -6.554 -6.495 5.410 1.00 0.00 O ATOM 911 CB PRO A 64 -4.966 -6.625 2.621 1.00 0.00 C ATOM 912 CG PRO A 64 -3.903 -5.865 3.337 1.00 0.00 C ATOM 913 CD PRO A 64 -4.417 -4.458 3.468 1.00 0.00 C ATOM 0 HA PRO A 64 -7.059 -5.983 2.319 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -4.933 -7.685 2.873 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -4.846 -6.550 1.540 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -3.704 -6.301 4.316 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -2.965 -5.888 2.782 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -4.072 -3.988 4.389 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -4.081 -3.829 2.644 1.00 0.00 H new ATOM 921 N ARG A 65 -7.727 -7.731 3.939 1.00 0.00 N ATOM 922 CA ARG A 65 -8.363 -8.548 4.966 1.00 0.00 C ATOM 923 C ARG A 65 -8.326 -10.025 4.584 1.00 0.00 C ATOM 924 O ARG A 65 -8.667 -10.395 3.460 1.00 0.00 O ATOM 925 CB ARG A 65 -9.810 -8.101 5.180 1.00 0.00 C ATOM 926 CG ARG A 65 -9.943 -6.642 5.586 1.00 0.00 C ATOM 927 CD ARG A 65 -11.392 -6.269 5.855 1.00 0.00 C ATOM 928 NE ARG A 65 -11.506 -5.029 6.619 1.00 0.00 N ATOM 929 CZ ARG A 65 -12.499 -4.774 7.463 1.00 0.00 C ATOM 930 NH1 ARG A 65 -13.459 -5.669 7.651 1.00 0.00 N ATOM 931 NH2 ARG A 65 -12.532 -3.623 8.122 1.00 0.00 N ATOM 0 H ARG A 65 -7.997 -7.967 2.984 1.00 0.00 H new ATOM 0 HA ARG A 65 -7.809 -8.416 5.895 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -10.372 -8.266 4.261 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.265 -8.726 5.949 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -9.346 -6.456 6.479 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -9.543 -6.006 4.797 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -11.920 -6.161 4.908 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -11.879 -7.077 6.401 1.00 0.00 H new ATOM 0 HE ARG A 65 -10.783 -4.320 6.497 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -13.436 -6.555 7.147 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -14.221 -5.471 8.300 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -11.794 -2.933 7.981 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -13.295 -3.428 8.770 1.00 0.00 H new ATOM 945 N LEU A 66 -7.911 -10.864 5.527 1.00 0.00 N ATOM 946 CA LEU A 66 -7.830 -12.301 5.290 1.00 0.00 C ATOM 947 C LEU A 66 -9.108 -13.001 5.741 1.00 0.00 C ATOM 948 O LEU A 66 -9.739 -13.720 4.969 1.00 0.00 O ATOM 949 CB LEU A 66 -6.625 -12.892 6.024 1.00 0.00 C ATOM 950 CG LEU A 66 -5.257 -12.339 5.622 1.00 0.00 C ATOM 951 CD1 LEU A 66 -4.318 -12.315 6.818 1.00 0.00 C ATOM 952 CD2 LEU A 66 -4.660 -13.163 4.490 1.00 0.00 C ATOM 0 H LEU A 66 -7.626 -10.574 6.462 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.709 -12.461 4.219 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -6.761 -12.729 7.093 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -6.620 -13.970 5.864 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.390 -11.316 5.270 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.350 -11.919 6.512 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.739 -11.682 7.599 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.191 -13.327 7.201 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.687 -12.755 4.217 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.542 -14.197 4.815 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.323 -13.128 3.626 1.00 0.00 H new ATOM 964 N ASN A 67 -9.484 -12.782 6.997 1.00 0.00 N ATOM 965 CA ASN A 67 -10.688 -13.391 7.551 1.00 0.00 C ATOM 966 C ASN A 67 -11.748 -13.581 6.471 1.00 0.00 C ATOM 967 O ASN A 67 -12.082 -14.709 6.107 1.00 0.00 O ATOM 968 CB ASN A 67 -11.247 -12.526 8.683 1.00 0.00 C ATOM 969 CG ASN A 67 -12.274 -13.263 9.521 1.00 0.00 C ATOM 970 OD1 ASN A 67 -11.974 -14.292 10.127 1.00 0.00 O ATOM 971 ND2 ASN A 67 -13.493 -12.739 9.558 1.00 0.00 N ATOM 0 H ASN A 67 -8.973 -12.188 7.650 1.00 0.00 H new ATOM 0 HA ASN A 67 -10.420 -14.370 7.948 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -10.428 -12.197 9.323 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -11.702 -11.630 8.261 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -14.226 -13.191 10.105 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -13.697 -11.884 9.040 1.00 0.00 H new ATOM 978 N ILE A 68 -12.271 -12.472 5.961 1.00 0.00 N ATOM 979 CA ILE A 68 -13.292 -12.517 4.921 1.00 0.00 C ATOM 980 C ILE A 68 -12.661 -12.574 3.534 1.00 0.00 C ATOM 981 O ILE A 68 -13.312 -12.946 2.558 1.00 0.00 O ATOM 982 CB ILE A 68 -14.227 -11.296 4.997 1.00 0.00 C ATOM 983 CG1 ILE A 68 -13.533 -10.057 4.427 1.00 0.00 C ATOM 984 CG2 ILE A 68 -14.663 -11.051 6.434 1.00 0.00 C ATOM 985 CD1 ILE A 68 -12.436 -9.516 5.318 1.00 0.00 C ATOM 0 H ILE A 68 -12.005 -11.531 6.251 1.00 0.00 H new ATOM 0 HA ILE A 68 -13.875 -13.422 5.090 1.00 0.00 H new ATOM 0 HB ILE A 68 -15.115 -11.500 4.398 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -13.111 -10.303 3.453 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -14.276 -9.276 4.264 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -15.323 -10.185 6.471 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -15.193 -11.927 6.808 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -13.786 -10.865 7.054 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -11.988 -8.639 4.852 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -12.856 -9.239 6.285 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -11.672 -10.281 5.460 1.00 0.00 H new ATOM 997 N LYS A 69 -11.387 -12.205 3.454 1.00 0.00 N ATOM 998 CA LYS A 69 -10.664 -12.217 2.187 1.00 0.00 C ATOM 999 C LYS A 69 -11.198 -11.142 1.246 1.00 0.00 C ATOM 1000 O LYS A 69 -11.426 -11.396 0.064 1.00 0.00 O ATOM 1001 CB LYS A 69 -10.778 -13.592 1.525 1.00 0.00 C ATOM 1002 CG LYS A 69 -10.292 -14.732 2.403 1.00 0.00 C ATOM 1003 CD LYS A 69 -9.982 -15.973 1.584 1.00 0.00 C ATOM 1004 CE LYS A 69 -8.869 -16.795 2.216 1.00 0.00 C ATOM 1005 NZ LYS A 69 -7.522 -16.324 1.789 1.00 0.00 N ATOM 0 H LYS A 69 -10.833 -11.894 4.252 1.00 0.00 H new ATOM 0 HA LYS A 69 -9.615 -12.006 2.393 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -11.819 -13.771 1.255 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -10.204 -13.588 0.598 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -9.399 -14.420 2.945 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -11.051 -14.967 3.149 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -10.880 -16.584 1.493 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -9.692 -15.681 0.575 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -8.947 -16.738 3.302 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -8.991 -17.843 1.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.790 -16.909 2.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.438 -16.402 0.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.395 -15.331 2.072 1.00 0.00 H new ATOM 1019 N ALA A 70 -11.395 -9.940 1.779 1.00 0.00 N ATOM 1020 CA ALA A 70 -11.899 -8.826 0.985 1.00 0.00 C ATOM 1021 C ALA A 70 -10.944 -7.638 1.039 1.00 0.00 C ATOM 1022 O ALA A 70 -10.547 -7.196 2.118 1.00 0.00 O ATOM 1023 CB ALA A 70 -13.282 -8.416 1.469 1.00 0.00 C ATOM 0 H ALA A 70 -11.213 -9.713 2.757 1.00 0.00 H new ATOM 0 HA ALA A 70 -11.972 -9.154 -0.052 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -13.646 -7.583 0.867 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -13.966 -9.259 1.373 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -13.226 -8.111 2.514 1.00 0.00 H new ATOM 1029 N PHE A 71 -10.578 -7.125 -0.131 1.00 0.00 N ATOM 1030 CA PHE A 71 -9.668 -5.989 -0.217 1.00 0.00 C ATOM 1031 C PHE A 71 -10.425 -4.673 -0.057 1.00 0.00 C ATOM 1032 O PHE A 71 -11.280 -4.333 -0.875 1.00 0.00 O ATOM 1033 CB PHE A 71 -8.924 -6.004 -1.554 1.00 0.00 C ATOM 1034 CG PHE A 71 -7.567 -5.364 -1.492 1.00 0.00 C ATOM 1035 CD1 PHE A 71 -7.395 -4.131 -0.883 1.00 0.00 C ATOM 1036 CD2 PHE A 71 -6.463 -5.995 -2.042 1.00 0.00 C ATOM 1037 CE1 PHE A 71 -6.147 -3.539 -0.826 1.00 0.00 C ATOM 1038 CE2 PHE A 71 -5.213 -5.408 -1.987 1.00 0.00 C ATOM 1039 CZ PHE A 71 -5.054 -4.179 -1.377 1.00 0.00 C ATOM 0 H PHE A 71 -10.898 -7.478 -1.033 1.00 0.00 H new ATOM 0 HA PHE A 71 -8.944 -6.073 0.594 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -8.815 -7.036 -1.889 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -9.526 -5.488 -2.302 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -8.245 -3.627 -0.448 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -6.581 -6.957 -2.519 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.027 -2.577 -0.351 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.361 -5.910 -2.421 1.00 0.00 H new ATOM 0 HZ PHE A 71 -4.078 -3.720 -1.331 1.00 0.00 H new ATOM 1049 N VAL A 72 -10.103 -3.937 1.002 1.00 0.00 N ATOM 1050 CA VAL A 72 -10.751 -2.659 1.270 1.00 0.00 C ATOM 1051 C VAL A 72 -9.927 -1.500 0.721 1.00 0.00 C ATOM 1052 O VAL A 72 -8.783 -1.292 1.126 1.00 0.00 O ATOM 1053 CB VAL A 72 -10.973 -2.447 2.779 1.00 0.00 C ATOM 1054 CG1 VAL A 72 -11.634 -1.102 3.038 1.00 0.00 C ATOM 1055 CG2 VAL A 72 -11.807 -3.580 3.358 1.00 0.00 C ATOM 0 H VAL A 72 -9.397 -4.204 1.688 1.00 0.00 H new ATOM 0 HA VAL A 72 -11.718 -2.683 0.768 1.00 0.00 H new ATOM 0 HB VAL A 72 -10.003 -2.449 3.275 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -11.783 -0.970 4.110 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -10.995 -0.304 2.659 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -12.598 -1.067 2.531 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -11.954 -3.415 4.425 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -12.775 -3.611 2.858 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -11.290 -4.527 3.206 1.00 0.00 H new ATOM 1065 N ARG A 73 -10.516 -0.747 -0.203 1.00 0.00 N ATOM 1066 CA ARG A 73 -9.835 0.391 -0.808 1.00 0.00 C ATOM 1067 C ARG A 73 -10.612 1.682 -0.563 1.00 0.00 C ATOM 1068 O ARG A 73 -11.830 1.726 -0.729 1.00 0.00 O ATOM 1069 CB ARG A 73 -9.660 0.168 -2.311 1.00 0.00 C ATOM 1070 CG ARG A 73 -8.970 -1.143 -2.655 1.00 0.00 C ATOM 1071 CD ARG A 73 -9.413 -1.665 -4.013 1.00 0.00 C ATOM 1072 NE ARG A 73 -10.723 -2.306 -3.953 1.00 0.00 N ATOM 1073 CZ ARG A 73 -11.861 -1.682 -4.237 1.00 0.00 C ATOM 1074 NH1 ARG A 73 -11.848 -0.407 -4.600 1.00 0.00 N ATOM 1075 NH2 ARG A 73 -13.014 -2.333 -4.159 1.00 0.00 N ATOM 0 H ARG A 73 -11.463 -0.905 -0.548 1.00 0.00 H new ATOM 0 HA ARG A 73 -8.853 0.483 -0.344 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -10.639 0.190 -2.790 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -9.083 0.993 -2.728 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -7.890 -0.998 -2.654 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.193 -1.885 -1.888 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -9.445 -0.840 -4.725 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -8.677 -2.378 -4.385 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.767 -3.287 -3.678 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.963 0.097 -4.662 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -12.723 0.070 -4.818 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -13.028 -3.314 -3.881 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -13.887 -1.852 -4.377 1.00 0.00 H new ATOM 1089 N ASN A 74 -9.898 2.730 -0.165 1.00 0.00 N ATOM 1090 CA ASN A 74 -10.520 4.021 0.104 1.00 0.00 C ATOM 1091 C ASN A 74 -9.462 5.099 0.321 1.00 0.00 C ATOM 1092 O ASN A 74 -8.265 4.814 0.346 1.00 0.00 O ATOM 1093 CB ASN A 74 -11.427 3.927 1.332 1.00 0.00 C ATOM 1094 CG ASN A 74 -12.572 4.920 1.283 1.00 0.00 C ATOM 1095 OD1 ASN A 74 -12.708 5.680 0.324 1.00 0.00 O ATOM 1096 ND2 ASN A 74 -13.402 4.919 2.319 1.00 0.00 N ATOM 0 H ASN A 74 -8.888 2.710 -0.022 1.00 0.00 H new ATOM 0 HA ASN A 74 -11.121 4.295 -0.763 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -11.829 2.917 1.407 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -10.836 4.102 2.231 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -14.190 5.566 2.341 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -13.251 4.271 3.093 1.00 0.00 H new ATOM 1103 N SER A 75 -9.914 6.340 0.478 1.00 0.00 N ATOM 1104 CA SER A 75 -9.007 7.462 0.689 1.00 0.00 C ATOM 1105 C SER A 75 -9.553 8.408 1.754 1.00 0.00 C ATOM 1106 O SER A 75 -10.734 8.758 1.744 1.00 0.00 O ATOM 1107 CB SER A 75 -8.788 8.222 -0.620 1.00 0.00 C ATOM 1108 OG SER A 75 -7.809 9.235 -0.465 1.00 0.00 O ATOM 0 H SER A 75 -10.902 6.593 0.463 1.00 0.00 H new ATOM 0 HA SER A 75 -8.052 7.065 1.034 1.00 0.00 H new ATOM 0 HB2 SER A 75 -8.476 7.527 -1.400 1.00 0.00 H new ATOM 0 HB3 SER A 75 -9.728 8.667 -0.947 1.00 0.00 H new ATOM 0 HG SER A 75 -6.957 8.927 -0.840 1.00 0.00 H new ATOM 1114 N PHE A 76 -8.685 8.820 2.672 1.00 0.00 N ATOM 1115 CA PHE A 76 -9.079 9.725 3.746 1.00 0.00 C ATOM 1116 C PHE A 76 -8.537 11.130 3.499 1.00 0.00 C ATOM 1117 O PHE A 76 -7.347 11.390 3.682 1.00 0.00 O ATOM 1118 CB PHE A 76 -8.577 9.202 5.093 1.00 0.00 C ATOM 1119 CG PHE A 76 -9.276 9.815 6.272 1.00 0.00 C ATOM 1120 CD1 PHE A 76 -10.626 9.588 6.488 1.00 0.00 C ATOM 1121 CD2 PHE A 76 -8.584 10.616 7.165 1.00 0.00 C ATOM 1122 CE1 PHE A 76 -11.272 10.151 7.573 1.00 0.00 C ATOM 1123 CE2 PHE A 76 -9.225 11.182 8.252 1.00 0.00 C ATOM 1124 CZ PHE A 76 -10.571 10.948 8.456 1.00 0.00 C ATOM 0 H PHE A 76 -7.704 8.542 2.694 1.00 0.00 H new ATOM 0 HA PHE A 76 -10.168 9.773 3.766 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -8.708 8.120 5.125 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -7.507 9.396 5.173 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -11.179 8.965 5.801 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -7.531 10.801 7.011 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -12.325 9.967 7.730 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.674 11.806 8.940 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.074 11.388 9.305 1.00 0.00 H new ATOM 1134 N LEU A 77 -9.418 12.032 3.082 1.00 0.00 N ATOM 1135 CA LEU A 77 -9.029 13.412 2.808 1.00 0.00 C ATOM 1136 C LEU A 77 -9.875 14.387 3.621 1.00 0.00 C ATOM 1137 O LEU A 77 -11.064 14.158 3.841 1.00 0.00 O ATOM 1138 CB LEU A 77 -9.171 13.717 1.316 1.00 0.00 C ATOM 1139 CG LEU A 77 -8.504 12.726 0.362 1.00 0.00 C ATOM 1140 CD1 LEU A 77 -9.068 12.874 -1.042 1.00 0.00 C ATOM 1141 CD2 LEU A 77 -6.995 12.924 0.357 1.00 0.00 C ATOM 0 H LEU A 77 -10.406 11.834 2.926 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.986 13.534 3.099 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -10.233 13.764 1.075 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.757 14.707 1.127 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.717 11.716 0.711 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -8.581 12.160 -1.707 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -10.141 12.681 -1.025 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -8.887 13.887 -1.402 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.537 12.210 -0.327 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.762 13.938 0.033 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.604 12.765 1.362 1.00 0.00 H new ATOM 1153 N GLN A 78 -9.253 15.476 4.063 1.00 0.00 N ATOM 1154 CA GLN A 78 -9.950 16.486 4.849 1.00 0.00 C ATOM 1155 C GLN A 78 -10.791 15.839 5.945 1.00 0.00 C ATOM 1156 O GLN A 78 -11.925 16.247 6.191 1.00 0.00 O ATOM 1157 CB GLN A 78 -10.839 17.343 3.946 1.00 0.00 C ATOM 1158 CG GLN A 78 -10.061 18.193 2.956 1.00 0.00 C ATOM 1159 CD GLN A 78 -10.912 19.276 2.321 1.00 0.00 C ATOM 1160 OE1 GLN A 78 -11.319 20.230 2.984 1.00 0.00 O ATOM 1161 NE2 GLN A 78 -11.185 19.133 1.029 1.00 0.00 N ATOM 0 H GLN A 78 -8.269 15.681 3.890 1.00 0.00 H new ATOM 0 HA GLN A 78 -9.201 17.123 5.320 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -11.520 16.692 3.397 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -11.453 17.995 4.568 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.214 18.653 3.465 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -9.653 17.552 2.175 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -10.827 18.326 0.518 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -11.753 19.830 0.548 1.00 0.00 H new ATOM 1170 N GLU A 79 -10.226 14.829 6.599 1.00 0.00 N ATOM 1171 CA GLU A 79 -10.926 14.125 7.667 1.00 0.00 C ATOM 1172 C GLU A 79 -12.222 13.505 7.153 1.00 0.00 C ATOM 1173 O GLU A 79 -13.244 13.519 7.839 1.00 0.00 O ATOM 1174 CB GLU A 79 -11.228 15.079 8.824 1.00 0.00 C ATOM 1175 CG GLU A 79 -10.022 15.374 9.701 1.00 0.00 C ATOM 1176 CD GLU A 79 -10.410 15.776 11.110 1.00 0.00 C ATOM 1177 OE1 GLU A 79 -10.690 16.973 11.330 1.00 0.00 O ATOM 1178 OE2 GLU A 79 -10.433 14.893 11.993 1.00 0.00 O ATOM 0 H GLU A 79 -9.287 14.480 6.408 1.00 0.00 H new ATOM 0 HA GLU A 79 -10.278 13.325 8.025 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -11.611 16.016 8.420 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -12.019 14.651 9.440 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -9.383 14.492 9.742 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -9.435 16.173 9.248 1.00 0.00 H new ATOM 1185 N SER A 80 -12.171 12.963 5.940 1.00 0.00 N ATOM 1186 CA SER A 80 -13.342 12.342 5.331 1.00 0.00 C ATOM 1187 C SER A 80 -12.943 11.121 4.508 1.00 0.00 C ATOM 1188 O SER A 80 -11.931 11.136 3.806 1.00 0.00 O ATOM 1189 CB SER A 80 -14.078 13.350 4.446 1.00 0.00 C ATOM 1190 OG SER A 80 -15.047 14.069 5.189 1.00 0.00 O ATOM 0 H SER A 80 -11.332 12.941 5.360 1.00 0.00 H new ATOM 0 HA SER A 80 -14.008 12.018 6.131 1.00 0.00 H new ATOM 0 HB2 SER A 80 -13.362 14.045 4.008 1.00 0.00 H new ATOM 0 HB3 SER A 80 -14.562 12.828 3.620 1.00 0.00 H new ATOM 0 HG SER A 80 -14.775 14.109 6.130 1.00 0.00 H new ATOM 1196 N TRP A 81 -13.744 10.066 4.599 1.00 0.00 N ATOM 1197 CA TRP A 81 -13.475 8.837 3.862 1.00 0.00 C ATOM 1198 C TRP A 81 -14.224 8.822 2.534 1.00 0.00 C ATOM 1199 O TRP A 81 -15.413 9.133 2.478 1.00 0.00 O ATOM 1200 CB TRP A 81 -13.873 7.619 4.699 1.00 0.00 C ATOM 1201 CG TRP A 81 -12.875 7.279 5.764 1.00 0.00 C ATOM 1202 CD1 TRP A 81 -12.980 7.541 7.100 1.00 0.00 C ATOM 1203 CD2 TRP A 81 -11.619 6.616 5.581 1.00 0.00 C ATOM 1204 NE1 TRP A 81 -11.866 7.080 7.759 1.00 0.00 N ATOM 1205 CE2 TRP A 81 -11.016 6.508 6.850 1.00 0.00 C ATOM 1206 CE3 TRP A 81 -10.946 6.101 4.470 1.00 0.00 C ATOM 1207 CZ2 TRP A 81 -9.774 5.908 7.034 1.00 0.00 C ATOM 1208 CZ3 TRP A 81 -9.713 5.506 4.655 1.00 0.00 C ATOM 1209 CH2 TRP A 81 -9.137 5.412 5.929 1.00 0.00 C ATOM 0 H TRP A 81 -14.585 10.037 5.176 1.00 0.00 H new ATOM 0 HA TRP A 81 -12.406 8.794 3.655 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -14.840 7.807 5.164 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -13.998 6.760 4.040 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -13.816 8.038 7.570 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -11.699 7.152 8.763 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -11.382 6.167 3.484 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 -9.328 5.836 8.015 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -9.184 5.106 3.803 1.00 0.00 H new ATOM 0 HH2 TRP A 81 -8.172 4.939 6.041 1.00 0.00 H new ATOM 1220 N GLY A 82 -13.520 8.459 1.466 1.00 0.00 N ATOM 1221 CA GLY A 82 -14.135 8.412 0.153 1.00 0.00 C ATOM 1222 C GLY A 82 -15.054 7.217 -0.014 1.00 0.00 C ATOM 1223 O GLY A 82 -15.847 6.908 0.874 1.00 0.00 O ATOM 0 H GLY A 82 -12.535 8.197 1.487 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -14.702 9.328 -0.013 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -13.356 8.377 -0.609 1.00 0.00 H new ATOM 1227 N GLU A 83 -14.947 6.546 -1.156 1.00 0.00 N ATOM 1228 CA GLU A 83 -15.777 5.380 -1.436 1.00 0.00 C ATOM 1229 C GLU A 83 -14.982 4.090 -1.257 1.00 0.00 C ATOM 1230 O GLU A 83 -13.820 4.005 -1.654 1.00 0.00 O ATOM 1231 CB GLU A 83 -16.335 5.454 -2.859 1.00 0.00 C ATOM 1232 CG GLU A 83 -17.023 4.177 -3.310 1.00 0.00 C ATOM 1233 CD GLU A 83 -18.234 3.836 -2.464 1.00 0.00 C ATOM 1234 OE1 GLU A 83 -19.214 4.609 -2.491 1.00 0.00 O ATOM 1235 OE2 GLU A 83 -18.202 2.794 -1.775 1.00 0.00 O ATOM 0 H GLU A 83 -14.295 6.789 -1.902 1.00 0.00 H new ATOM 0 HA GLU A 83 -16.605 5.377 -0.727 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -17.044 6.280 -2.920 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -15.521 5.681 -3.548 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -17.330 4.282 -4.351 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -16.312 3.352 -3.269 1.00 0.00 H new ATOM 1354 N PHE A 91 -8.175 -13.227 -3.523 1.00 0.00 N ATOM 1355 CA PHE A 91 -7.330 -12.655 -2.481 1.00 0.00 C ATOM 1356 C PHE A 91 -5.992 -13.384 -2.405 1.00 0.00 C ATOM 1357 O PHE A 91 -5.897 -14.511 -1.918 1.00 0.00 O ATOM 1358 CB PHE A 91 -8.038 -12.722 -1.126 1.00 0.00 C ATOM 1359 CG PHE A 91 -7.533 -11.713 -0.135 1.00 0.00 C ATOM 1360 CD1 PHE A 91 -7.429 -10.375 -0.481 1.00 0.00 C ATOM 1361 CD2 PHE A 91 -7.163 -12.102 1.142 1.00 0.00 C ATOM 1362 CE1 PHE A 91 -6.965 -9.444 0.429 1.00 0.00 C ATOM 1363 CE2 PHE A 91 -6.698 -11.175 2.056 1.00 0.00 C ATOM 1364 CZ PHE A 91 -6.598 -9.844 1.699 1.00 0.00 C ATOM 0 HA PHE A 91 -7.142 -11.611 -2.733 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -9.107 -12.569 -1.276 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -7.914 -13.722 -0.710 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -7.714 -10.056 -1.473 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.239 -13.141 1.427 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.889 -8.404 0.147 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.413 -11.491 3.049 1.00 0.00 H new ATOM 0 HZ PHE A 91 -6.234 -9.118 2.411 1.00 0.00 H new ATOM 1374 N PRO A 92 -4.932 -12.727 -2.898 1.00 0.00 N ATOM 1375 CA PRO A 92 -3.579 -13.293 -2.897 1.00 0.00 C ATOM 1376 C PRO A 92 -2.991 -13.388 -1.494 1.00 0.00 C ATOM 1377 O PRO A 92 -2.504 -14.442 -1.084 1.00 0.00 O ATOM 1378 CB PRO A 92 -2.780 -12.301 -3.746 1.00 0.00 C ATOM 1379 CG PRO A 92 -3.518 -11.014 -3.621 1.00 0.00 C ATOM 1380 CD PRO A 92 -4.971 -11.381 -3.493 1.00 0.00 C ATOM 0 HA PRO A 92 -3.563 -14.313 -3.280 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -1.756 -12.207 -3.385 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -2.723 -12.625 -4.785 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -3.179 -10.453 -2.750 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -3.350 -10.382 -4.493 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -5.509 -10.677 -2.858 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -5.471 -11.384 -4.461 1.00 0.00 H new ATOM 1388 N PHE A 93 -3.040 -12.281 -0.761 1.00 0.00 N ATOM 1389 CA PHE A 93 -2.511 -12.240 0.598 1.00 0.00 C ATOM 1390 C PHE A 93 -2.856 -13.519 1.355 1.00 0.00 C ATOM 1391 O PHE A 93 -3.998 -13.976 1.335 1.00 0.00 O ATOM 1392 CB PHE A 93 -3.064 -11.026 1.347 1.00 0.00 C ATOM 1393 CG PHE A 93 -2.528 -9.716 0.845 1.00 0.00 C ATOM 1394 CD1 PHE A 93 -1.169 -9.544 0.632 1.00 0.00 C ATOM 1395 CD2 PHE A 93 -3.382 -8.656 0.586 1.00 0.00 C ATOM 1396 CE1 PHE A 93 -0.672 -8.340 0.169 1.00 0.00 C ATOM 1397 CE2 PHE A 93 -2.891 -7.450 0.123 1.00 0.00 C ATOM 1398 CZ PHE A 93 -1.534 -7.291 -0.085 1.00 0.00 C ATOM 0 H PHE A 93 -3.440 -11.400 -1.085 1.00 0.00 H new ATOM 0 HA PHE A 93 -1.426 -12.157 0.536 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -4.151 -11.021 1.262 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.827 -11.124 2.406 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -0.490 -10.360 0.830 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -4.443 -8.774 0.748 1.00 0.00 H new ATOM 0 HE1 PHE A 93 0.389 -8.220 0.006 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -3.568 -6.632 -0.076 1.00 0.00 H new ATOM 0 HZ PHE A 93 -1.148 -6.349 -0.445 1.00 0.00 H new ATOM 1408 N SER A 94 -1.858 -14.093 2.021 1.00 0.00 N ATOM 1409 CA SER A 94 -2.054 -15.322 2.781 1.00 0.00 C ATOM 1410 C SER A 94 -1.188 -15.327 4.037 1.00 0.00 C ATOM 1411 O SER A 94 -0.095 -14.761 4.071 1.00 0.00 O ATOM 1412 CB SER A 94 -1.725 -16.539 1.915 1.00 0.00 C ATOM 1413 OG SER A 94 -2.866 -16.980 1.200 1.00 0.00 O ATOM 0 H SER A 94 -0.907 -13.727 2.049 1.00 0.00 H new ATOM 0 HA SER A 94 -3.100 -15.372 3.082 1.00 0.00 H new ATOM 0 HB2 SER A 94 -0.929 -16.286 1.215 1.00 0.00 H new ATOM 0 HB3 SER A 94 -1.352 -17.347 2.544 1.00 0.00 H new ATOM 0 HG SER A 94 -3.477 -16.226 1.062 1.00 0.00 H new ATOM 1419 N PRO A 95 -1.686 -15.983 5.095 1.00 0.00 N ATOM 1420 CA PRO A 95 -0.975 -16.080 6.373 1.00 0.00 C ATOM 1421 C PRO A 95 0.262 -16.967 6.283 1.00 0.00 C ATOM 1422 O PRO A 95 0.173 -18.137 5.914 1.00 0.00 O ATOM 1423 CB PRO A 95 -2.013 -16.703 7.310 1.00 0.00 C ATOM 1424 CG PRO A 95 -2.929 -17.459 6.411 1.00 0.00 C ATOM 1425 CD PRO A 95 -2.983 -16.681 5.125 1.00 0.00 C ATOM 0 HA PRO A 95 -0.605 -15.111 6.708 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -1.543 -17.361 8.040 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -2.550 -15.938 7.870 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -2.561 -18.471 6.240 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -3.921 -17.551 6.853 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -3.107 -17.337 4.263 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -3.817 -15.980 5.114 1.00 0.00 H new ATOM 1433 N GLY A 96 1.416 -16.401 6.623 1.00 0.00 N ATOM 1434 CA GLY A 96 2.655 -17.155 6.573 1.00 0.00 C ATOM 1435 C GLY A 96 3.241 -17.216 5.177 1.00 0.00 C ATOM 1436 O GLY A 96 3.714 -18.265 4.740 1.00 0.00 O ATOM 0 H GLY A 96 1.515 -15.434 6.932 1.00 0.00 H new ATOM 0 HA2 GLY A 96 3.380 -16.701 7.248 1.00 0.00 H new ATOM 0 HA3 GLY A 96 2.475 -18.168 6.933 1.00 0.00 H new ATOM 1440 N MET A 97 3.209 -16.089 4.473 1.00 0.00 N ATOM 1441 CA MET A 97 3.741 -16.019 3.117 1.00 0.00 C ATOM 1442 C MET A 97 4.440 -14.685 2.876 1.00 0.00 C ATOM 1443 O MET A 97 4.273 -13.737 3.644 1.00 0.00 O ATOM 1444 CB MET A 97 2.620 -16.213 2.096 1.00 0.00 C ATOM 1445 CG MET A 97 1.745 -14.983 1.913 1.00 0.00 C ATOM 1446 SD MET A 97 2.357 -13.880 0.625 1.00 0.00 S ATOM 1447 CE MET A 97 1.342 -14.384 -0.762 1.00 0.00 C ATOM 0 H MET A 97 2.820 -15.212 4.819 1.00 0.00 H new ATOM 0 HA MET A 97 4.472 -16.819 2.998 1.00 0.00 H new ATOM 0 HB2 MET A 97 3.058 -16.484 1.135 1.00 0.00 H new ATOM 0 HB3 MET A 97 1.996 -17.050 2.409 1.00 0.00 H new ATOM 0 HG2 MET A 97 0.731 -15.297 1.665 1.00 0.00 H new ATOM 0 HG3 MET A 97 1.689 -14.439 2.856 1.00 0.00 H new ATOM 0 HE1 MET A 97 1.603 -13.791 -1.638 1.00 0.00 H new ATOM 0 HE2 MET A 97 1.514 -15.439 -0.974 1.00 0.00 H new ATOM 0 HE3 MET A 97 0.291 -14.229 -0.519 1.00 0.00 H new ATOM 1457 N TYR A 98 5.223 -14.618 1.805 1.00 0.00 N ATOM 1458 CA TYR A 98 5.950 -13.400 1.465 1.00 0.00 C ATOM 1459 C TYR A 98 5.284 -12.677 0.298 1.00 0.00 C ATOM 1460 O TYR A 98 5.142 -13.231 -0.792 1.00 0.00 O ATOM 1461 CB TYR A 98 7.402 -13.729 1.113 1.00 0.00 C ATOM 1462 CG TYR A 98 8.134 -12.591 0.439 1.00 0.00 C ATOM 1463 CD1 TYR A 98 8.815 -11.637 1.187 1.00 0.00 C ATOM 1464 CD2 TYR A 98 8.147 -12.469 -0.945 1.00 0.00 C ATOM 1465 CE1 TYR A 98 9.484 -10.595 0.575 1.00 0.00 C ATOM 1466 CE2 TYR A 98 8.815 -11.432 -1.565 1.00 0.00 C ATOM 1467 CZ TYR A 98 9.482 -10.497 -0.801 1.00 0.00 C ATOM 1468 OH TYR A 98 10.149 -9.461 -1.414 1.00 0.00 O ATOM 0 H TYR A 98 5.371 -15.392 1.158 1.00 0.00 H new ATOM 0 HA TYR A 98 5.934 -12.743 2.334 1.00 0.00 H new ATOM 0 HB2 TYR A 98 7.934 -14.004 2.024 1.00 0.00 H new ATOM 0 HB3 TYR A 98 7.420 -14.600 0.458 1.00 0.00 H new ATOM 0 HD1 TYR A 98 8.821 -11.712 2.264 1.00 0.00 H new ATOM 0 HD2 TYR A 98 7.625 -13.199 -1.547 1.00 0.00 H new ATOM 0 HE1 TYR A 98 10.006 -9.861 1.171 1.00 0.00 H new ATOM 0 HE2 TYR A 98 8.815 -11.353 -2.642 1.00 0.00 H new ATOM 0 HH TYR A 98 10.050 -9.538 -2.386 1.00 0.00 H new ATOM 1478 N PHE A 99 4.877 -11.434 0.536 1.00 0.00 N ATOM 1479 CA PHE A 99 4.225 -10.633 -0.493 1.00 0.00 C ATOM 1480 C PHE A 99 4.991 -9.336 -0.740 1.00 0.00 C ATOM 1481 O PHE A 99 5.605 -8.784 0.172 1.00 0.00 O ATOM 1482 CB PHE A 99 2.784 -10.318 -0.088 1.00 0.00 C ATOM 1483 CG PHE A 99 2.678 -9.281 0.993 1.00 0.00 C ATOM 1484 CD1 PHE A 99 2.737 -7.931 0.686 1.00 0.00 C ATOM 1485 CD2 PHE A 99 2.519 -9.656 2.318 1.00 0.00 C ATOM 1486 CE1 PHE A 99 2.641 -6.975 1.679 1.00 0.00 C ATOM 1487 CE2 PHE A 99 2.422 -8.704 3.316 1.00 0.00 C ATOM 1488 CZ PHE A 99 2.482 -7.362 2.995 1.00 0.00 C ATOM 0 H PHE A 99 4.987 -10.960 1.432 1.00 0.00 H new ATOM 0 HA PHE A 99 4.217 -11.211 -1.417 1.00 0.00 H new ATOM 0 HB2 PHE A 99 2.235 -9.974 -0.965 1.00 0.00 H new ATOM 0 HB3 PHE A 99 2.302 -11.235 0.251 1.00 0.00 H new ATOM 0 HD1 PHE A 99 2.859 -7.622 -0.342 1.00 0.00 H new ATOM 0 HD2 PHE A 99 2.470 -10.704 2.574 1.00 0.00 H new ATOM 0 HE1 PHE A 99 2.690 -5.926 1.426 1.00 0.00 H new ATOM 0 HE2 PHE A 99 2.300 -9.009 4.345 1.00 0.00 H new ATOM 0 HZ PHE A 99 2.405 -6.616 3.772 1.00 0.00 H new ATOM 1498 N GLU A 100 4.949 -8.858 -1.979 1.00 0.00 N ATOM 1499 CA GLU A 100 5.640 -7.627 -2.346 1.00 0.00 C ATOM 1500 C GLU A 100 4.684 -6.645 -3.017 1.00 0.00 C ATOM 1501 O GLU A 100 4.119 -6.936 -4.071 1.00 0.00 O ATOM 1502 CB GLU A 100 6.813 -7.933 -3.279 1.00 0.00 C ATOM 1503 CG GLU A 100 7.952 -6.933 -3.175 1.00 0.00 C ATOM 1504 CD GLU A 100 7.464 -5.498 -3.116 1.00 0.00 C ATOM 1505 OE1 GLU A 100 6.702 -5.094 -4.019 1.00 0.00 O ATOM 1506 OE2 GLU A 100 7.845 -4.779 -2.169 1.00 0.00 O ATOM 0 H GLU A 100 4.444 -9.304 -2.745 1.00 0.00 H new ATOM 0 HA GLU A 100 6.021 -7.169 -1.433 1.00 0.00 H new ATOM 0 HB2 GLU A 100 7.194 -8.929 -3.055 1.00 0.00 H new ATOM 0 HB3 GLU A 100 6.452 -7.954 -4.307 1.00 0.00 H new ATOM 0 HG2 GLU A 100 8.541 -7.150 -2.284 1.00 0.00 H new ATOM 0 HG3 GLU A 100 8.615 -7.053 -4.032 1.00 0.00 H new ATOM 1513 N MET A 101 4.509 -5.482 -2.399 1.00 0.00 N ATOM 1514 CA MET A 101 3.622 -4.457 -2.937 1.00 0.00 C ATOM 1515 C MET A 101 4.412 -3.406 -3.710 1.00 0.00 C ATOM 1516 O MET A 101 5.366 -2.826 -3.190 1.00 0.00 O ATOM 1517 CB MET A 101 2.834 -3.790 -1.807 1.00 0.00 C ATOM 1518 CG MET A 101 1.855 -2.733 -2.292 1.00 0.00 C ATOM 1519 SD MET A 101 0.754 -2.157 -0.986 1.00 0.00 S ATOM 1520 CE MET A 101 -0.104 -3.673 -0.572 1.00 0.00 C ATOM 0 H MET A 101 4.969 -5.226 -1.526 1.00 0.00 H new ATOM 0 HA MET A 101 2.924 -4.939 -3.622 1.00 0.00 H new ATOM 0 HB2 MET A 101 2.287 -4.555 -1.256 1.00 0.00 H new ATOM 0 HB3 MET A 101 3.534 -3.332 -1.108 1.00 0.00 H new ATOM 0 HG2 MET A 101 2.410 -1.886 -2.694 1.00 0.00 H new ATOM 0 HG3 MET A 101 1.261 -3.141 -3.109 1.00 0.00 H new ATOM 0 HE1 MET A 101 -1.167 -3.467 -0.445 1.00 0.00 H new ATOM 0 HE2 MET A 101 0.032 -4.399 -1.374 1.00 0.00 H new ATOM 0 HE3 MET A 101 0.300 -4.078 0.356 1.00 0.00 H new ATOM 1530 N ILE A 102 4.010 -3.166 -4.954 1.00 0.00 N ATOM 1531 CA ILE A 102 4.680 -2.185 -5.797 1.00 0.00 C ATOM 1532 C ILE A 102 3.758 -1.012 -6.115 1.00 0.00 C ATOM 1533 O ILE A 102 2.740 -1.175 -6.787 1.00 0.00 O ATOM 1534 CB ILE A 102 5.166 -2.814 -7.116 1.00 0.00 C ATOM 1535 CG1 ILE A 102 6.096 -3.995 -6.831 1.00 0.00 C ATOM 1536 CG2 ILE A 102 5.870 -1.772 -7.972 1.00 0.00 C ATOM 1537 CD1 ILE A 102 6.325 -4.887 -8.031 1.00 0.00 C ATOM 0 H ILE A 102 3.223 -3.638 -5.400 1.00 0.00 H new ATOM 0 HA ILE A 102 5.543 -1.824 -5.237 1.00 0.00 H new ATOM 0 HB ILE A 102 4.300 -3.183 -7.666 1.00 0.00 H new ATOM 0 HG12 ILE A 102 7.056 -3.615 -6.482 1.00 0.00 H new ATOM 0 HG13 ILE A 102 5.676 -4.591 -6.021 1.00 0.00 H new ATOM 0 HG21 ILE A 102 6.208 -2.232 -8.901 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.179 -0.961 -8.199 1.00 0.00 H new ATOM 0 HG23 ILE A 102 6.729 -1.376 -7.430 1.00 0.00 H new ATOM 0 HD11 ILE A 102 6.994 -5.703 -7.756 1.00 0.00 H new ATOM 0 HD12 ILE A 102 5.372 -5.296 -8.367 1.00 0.00 H new ATOM 0 HD13 ILE A 102 6.774 -4.306 -8.836 1.00 0.00 H new ATOM 1549 N ILE A 103 4.124 0.169 -5.629 1.00 0.00 N ATOM 1550 CA ILE A 103 3.331 1.370 -5.865 1.00 0.00 C ATOM 1551 C ILE A 103 3.966 2.246 -6.939 1.00 0.00 C ATOM 1552 O ILE A 103 4.991 2.888 -6.706 1.00 0.00 O ATOM 1553 CB ILE A 103 3.165 2.196 -4.576 1.00 0.00 C ATOM 1554 CG1 ILE A 103 2.564 1.333 -3.465 1.00 0.00 C ATOM 1555 CG2 ILE A 103 2.294 3.416 -4.837 1.00 0.00 C ATOM 1556 CD1 ILE A 103 2.910 1.814 -2.073 1.00 0.00 C ATOM 0 H ILE A 103 4.964 0.320 -5.070 1.00 0.00 H new ATOM 0 HA ILE A 103 2.349 1.039 -6.204 1.00 0.00 H new ATOM 0 HB ILE A 103 4.148 2.538 -4.252 1.00 0.00 H new ATOM 0 HG12 ILE A 103 1.480 1.316 -3.576 1.00 0.00 H new ATOM 0 HG13 ILE A 103 2.913 0.307 -3.584 1.00 0.00 H new ATOM 0 HG21 ILE A 103 2.186 3.990 -3.916 1.00 0.00 H new ATOM 0 HG22 ILE A 103 2.760 4.039 -5.600 1.00 0.00 H new ATOM 0 HG23 ILE A 103 1.311 3.094 -5.181 1.00 0.00 H new ATOM 0 HD11 ILE A 103 2.451 1.155 -1.336 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.992 1.805 -1.943 1.00 0.00 H new ATOM 0 HD13 ILE A 103 2.537 2.829 -1.935 1.00 0.00 H new ATOM 1568 N TYR A 104 3.351 2.269 -8.116 1.00 0.00 N ATOM 1569 CA TYR A 104 3.856 3.066 -9.227 1.00 0.00 C ATOM 1570 C TYR A 104 2.912 4.223 -9.541 1.00 0.00 C ATOM 1571 O TYR A 104 1.692 4.059 -9.548 1.00 0.00 O ATOM 1572 CB TYR A 104 4.038 2.191 -10.469 1.00 0.00 C ATOM 1573 CG TYR A 104 4.342 2.977 -11.724 1.00 0.00 C ATOM 1574 CD1 TYR A 104 5.481 3.768 -11.814 1.00 0.00 C ATOM 1575 CD2 TYR A 104 3.491 2.928 -12.821 1.00 0.00 C ATOM 1576 CE1 TYR A 104 5.762 4.488 -12.958 1.00 0.00 C ATOM 1577 CE2 TYR A 104 3.765 3.644 -13.970 1.00 0.00 C ATOM 1578 CZ TYR A 104 4.902 4.423 -14.034 1.00 0.00 C ATOM 1579 OH TYR A 104 5.179 5.138 -15.177 1.00 0.00 O ATOM 0 H TYR A 104 2.502 1.745 -8.325 1.00 0.00 H new ATOM 0 HA TYR A 104 4.822 3.478 -8.936 1.00 0.00 H new ATOM 0 HB2 TYR A 104 4.847 1.483 -10.289 1.00 0.00 H new ATOM 0 HB3 TYR A 104 3.132 1.606 -10.627 1.00 0.00 H new ATOM 0 HD1 TYR A 104 6.158 3.820 -10.974 1.00 0.00 H new ATOM 0 HD2 TYR A 104 2.600 2.320 -12.775 1.00 0.00 H new ATOM 0 HE1 TYR A 104 6.651 5.099 -13.010 1.00 0.00 H new ATOM 0 HE2 TYR A 104 3.093 3.594 -14.814 1.00 0.00 H new ATOM 0 HH TYR A 104 4.623 4.806 -15.913 1.00 0.00 H new ATOM 1589 N CYS A 105 3.486 5.393 -9.800 1.00 0.00 N ATOM 1590 CA CYS A 105 2.698 6.579 -10.115 1.00 0.00 C ATOM 1591 C CYS A 105 2.913 7.006 -11.563 1.00 0.00 C ATOM 1592 O CYS A 105 3.947 7.580 -11.905 1.00 0.00 O ATOM 1593 CB CYS A 105 3.065 7.726 -9.172 1.00 0.00 C ATOM 1594 SG CYS A 105 2.500 7.492 -7.470 1.00 0.00 S ATOM 0 H CYS A 105 4.495 5.545 -9.798 1.00 0.00 H new ATOM 0 HA CYS A 105 1.645 6.331 -9.981 1.00 0.00 H new ATOM 0 HB2 CYS A 105 4.148 7.848 -9.170 1.00 0.00 H new ATOM 0 HB3 CYS A 105 2.640 8.652 -9.560 1.00 0.00 H new ATOM 0 HG CYS A 105 1.305 7.987 -7.338 1.00 0.00 H new ATOM 1600 N ASP A 106 1.930 6.721 -12.410 1.00 0.00 N ATOM 1601 CA ASP A 106 2.012 7.075 -13.823 1.00 0.00 C ATOM 1602 C ASP A 106 1.352 8.425 -14.083 1.00 0.00 C ATOM 1603 O ASP A 106 0.840 8.678 -15.174 1.00 0.00 O ATOM 1604 CB ASP A 106 1.349 5.995 -14.680 1.00 0.00 C ATOM 1605 CG ASP A 106 1.995 5.863 -16.045 1.00 0.00 C ATOM 1606 OD1 ASP A 106 2.284 6.905 -16.669 1.00 0.00 O ATOM 1607 OD2 ASP A 106 2.212 4.716 -16.489 1.00 0.00 O ATOM 0 H ASP A 106 1.068 6.246 -12.143 1.00 0.00 H new ATOM 0 HA ASP A 106 3.065 7.147 -14.095 1.00 0.00 H new ATOM 0 HB2 ASP A 106 1.404 5.038 -14.161 1.00 0.00 H new ATOM 0 HB3 ASP A 106 0.292 6.230 -14.803 1.00 0.00 H new ATOM 1612 N VAL A 107 1.366 9.290 -13.074 1.00 0.00 N ATOM 1613 CA VAL A 107 0.769 10.615 -13.193 1.00 0.00 C ATOM 1614 C VAL A 107 -0.642 10.532 -13.766 1.00 0.00 C ATOM 1615 O VAL A 107 -1.138 11.489 -14.362 1.00 0.00 O ATOM 1616 CB VAL A 107 1.621 11.536 -14.086 1.00 0.00 C ATOM 1617 CG1 VAL A 107 1.203 12.988 -13.908 1.00 0.00 C ATOM 1618 CG2 VAL A 107 3.100 11.356 -13.778 1.00 0.00 C ATOM 0 H VAL A 107 1.785 9.097 -12.164 1.00 0.00 H new ATOM 0 HA VAL A 107 0.726 11.035 -12.188 1.00 0.00 H new ATOM 0 HB VAL A 107 1.454 11.260 -15.127 1.00 0.00 H new ATOM 0 HG11 VAL A 107 1.816 13.624 -14.547 1.00 0.00 H new ATOM 0 HG12 VAL A 107 0.154 13.101 -14.183 1.00 0.00 H new ATOM 0 HG13 VAL A 107 1.339 13.281 -12.867 1.00 0.00 H new ATOM 0 HG21 VAL A 107 3.688 12.014 -14.418 1.00 0.00 H new ATOM 0 HG22 VAL A 107 3.287 11.604 -12.733 1.00 0.00 H new ATOM 0 HG23 VAL A 107 3.387 10.321 -13.962 1.00 0.00 H new ATOM 1628 N ARG A 108 -1.283 9.383 -13.583 1.00 0.00 N ATOM 1629 CA ARG A 108 -2.637 9.175 -14.082 1.00 0.00 C ATOM 1630 C ARG A 108 -3.511 8.510 -13.023 1.00 0.00 C ATOM 1631 O ARG A 108 -4.712 8.767 -12.946 1.00 0.00 O ATOM 1632 CB ARG A 108 -2.610 8.317 -15.349 1.00 0.00 C ATOM 1633 CG ARG A 108 -1.937 8.997 -16.530 1.00 0.00 C ATOM 1634 CD ARG A 108 -2.855 10.019 -17.182 1.00 0.00 C ATOM 1635 NE ARG A 108 -4.073 9.406 -17.705 1.00 0.00 N ATOM 1636 CZ ARG A 108 -5.219 10.061 -17.857 1.00 0.00 C ATOM 1637 NH1 ARG A 108 -5.302 11.342 -17.527 1.00 0.00 N ATOM 1638 NH2 ARG A 108 -6.284 9.434 -18.340 1.00 0.00 N ATOM 0 H ARG A 108 -0.887 8.581 -13.093 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.063 10.150 -14.320 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -2.091 7.383 -15.134 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -3.632 8.058 -15.624 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -1.023 9.488 -16.196 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -1.645 8.247 -17.265 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -3.119 10.786 -16.454 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -2.324 10.518 -17.992 1.00 0.00 H new ATOM 0 HE ARG A 108 -4.042 8.421 -17.968 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -4.485 11.827 -17.156 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -6.183 11.843 -17.645 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -6.223 8.448 -18.595 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -7.163 9.938 -18.456 1.00 0.00 H new ATOM 1652 N GLU A 109 -2.899 7.654 -12.210 1.00 0.00 N ATOM 1653 CA GLU A 109 -3.623 6.951 -11.157 1.00 0.00 C ATOM 1654 C GLU A 109 -2.663 6.168 -10.267 1.00 0.00 C ATOM 1655 O GLU A 109 -1.505 5.948 -10.625 1.00 0.00 O ATOM 1656 CB GLU A 109 -4.660 6.005 -11.765 1.00 0.00 C ATOM 1657 CG GLU A 109 -4.069 4.996 -12.735 1.00 0.00 C ATOM 1658 CD GLU A 109 -5.030 3.868 -13.061 1.00 0.00 C ATOM 1659 OE1 GLU A 109 -5.965 3.638 -12.266 1.00 0.00 O ATOM 1660 OE2 GLU A 109 -4.846 3.217 -14.110 1.00 0.00 O ATOM 0 H GLU A 109 -1.905 7.431 -12.260 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.135 7.693 -10.545 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -5.167 5.470 -10.962 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -5.417 6.594 -12.283 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -3.787 5.506 -13.656 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -3.156 4.579 -12.309 1.00 0.00 H new ATOM 1667 N PHE A 110 -3.152 5.748 -9.105 1.00 0.00 N ATOM 1668 CA PHE A 110 -2.338 4.990 -8.162 1.00 0.00 C ATOM 1669 C PHE A 110 -2.479 3.491 -8.404 1.00 0.00 C ATOM 1670 O PHE A 110 -3.513 2.895 -8.101 1.00 0.00 O ATOM 1671 CB PHE A 110 -2.739 5.326 -6.724 1.00 0.00 C ATOM 1672 CG PHE A 110 -1.911 6.418 -6.109 1.00 0.00 C ATOM 1673 CD1 PHE A 110 -1.614 7.567 -6.825 1.00 0.00 C ATOM 1674 CD2 PHE A 110 -1.428 6.295 -4.816 1.00 0.00 C ATOM 1675 CE1 PHE A 110 -0.852 8.574 -6.262 1.00 0.00 C ATOM 1676 CE2 PHE A 110 -0.666 7.299 -4.248 1.00 0.00 C ATOM 1677 CZ PHE A 110 -0.377 8.439 -4.973 1.00 0.00 C ATOM 0 H PHE A 110 -4.108 5.920 -8.794 1.00 0.00 H new ATOM 0 HA PHE A 110 -1.295 5.268 -8.315 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.787 5.624 -6.708 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -2.653 4.428 -6.112 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -1.982 7.677 -7.834 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -1.649 5.405 -4.246 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -0.629 9.465 -6.830 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -0.297 7.192 -3.239 1.00 0.00 H new ATOM 0 HZ PHE A 110 0.220 9.224 -4.532 1.00 0.00 H new ATOM 1687 N LYS A 111 -1.432 2.885 -8.954 1.00 0.00 N ATOM 1688 CA LYS A 111 -1.436 1.455 -9.238 1.00 0.00 C ATOM 1689 C LYS A 111 -0.848 0.667 -8.072 1.00 0.00 C ATOM 1690 O LYS A 111 -0.059 1.194 -7.288 1.00 0.00 O ATOM 1691 CB LYS A 111 -0.644 1.165 -10.515 1.00 0.00 C ATOM 1692 CG LYS A 111 -1.361 1.588 -11.785 1.00 0.00 C ATOM 1693 CD LYS A 111 -0.387 1.786 -12.935 1.00 0.00 C ATOM 1694 CE LYS A 111 -1.038 2.525 -14.095 1.00 0.00 C ATOM 1695 NZ LYS A 111 -1.765 1.598 -15.005 1.00 0.00 N ATOM 0 H LYS A 111 -0.569 3.363 -9.212 1.00 0.00 H new ATOM 0 HA LYS A 111 -2.470 1.141 -9.381 1.00 0.00 H new ATOM 0 HB2 LYS A 111 0.316 1.679 -10.462 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -0.432 0.097 -10.566 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.098 0.832 -12.057 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -1.906 2.515 -11.605 1.00 0.00 H new ATOM 0 HD2 LYS A 111 0.481 2.346 -12.586 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -0.024 0.817 -13.277 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.731 3.271 -13.707 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.274 3.062 -14.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -2.194 2.140 -15.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -1.099 0.901 -15.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -2.511 1.104 -14.474 1.00 0.00 H new ATOM 1709 N VAL A 112 -1.237 -0.600 -7.963 1.00 0.00 N ATOM 1710 CA VAL A 112 -0.746 -1.461 -6.894 1.00 0.00 C ATOM 1711 C VAL A 112 -0.703 -2.919 -7.339 1.00 0.00 C ATOM 1712 O VAL A 112 -1.715 -3.483 -7.753 1.00 0.00 O ATOM 1713 CB VAL A 112 -1.624 -1.347 -5.634 1.00 0.00 C ATOM 1714 CG1 VAL A 112 -3.078 -1.643 -5.967 1.00 0.00 C ATOM 1715 CG2 VAL A 112 -1.116 -2.280 -4.545 1.00 0.00 C ATOM 0 H VAL A 112 -1.891 -1.052 -8.602 1.00 0.00 H new ATOM 0 HA VAL A 112 0.264 -1.126 -6.656 1.00 0.00 H new ATOM 0 HB VAL A 112 -1.564 -0.324 -5.261 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.683 -1.557 -5.064 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -3.433 -0.930 -6.711 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -3.161 -2.654 -6.365 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -1.748 -2.187 -3.662 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -1.145 -3.309 -4.905 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -0.091 -2.014 -4.287 1.00 0.00 H new ATOM 1725 N ALA A 113 0.477 -3.523 -7.252 1.00 0.00 N ATOM 1726 CA ALA A 113 0.653 -4.916 -7.643 1.00 0.00 C ATOM 1727 C ALA A 113 1.128 -5.761 -6.466 1.00 0.00 C ATOM 1728 O ALA A 113 1.775 -5.257 -5.547 1.00 0.00 O ATOM 1729 CB ALA A 113 1.635 -5.020 -8.800 1.00 0.00 C ATOM 0 H ALA A 113 1.326 -3.069 -6.914 1.00 0.00 H new ATOM 0 HA ALA A 113 -0.314 -5.301 -7.966 1.00 0.00 H new ATOM 0 HB1 ALA A 113 1.757 -6.066 -9.081 1.00 0.00 H new ATOM 0 HB2 ALA A 113 1.254 -4.457 -9.652 1.00 0.00 H new ATOM 0 HB3 ALA A 113 2.599 -4.611 -8.497 1.00 0.00 H new ATOM 1735 N VAL A 114 0.804 -7.050 -6.499 1.00 0.00 N ATOM 1736 CA VAL A 114 1.198 -7.965 -5.435 1.00 0.00 C ATOM 1737 C VAL A 114 1.803 -9.243 -6.005 1.00 0.00 C ATOM 1738 O VAL A 114 1.219 -9.882 -6.879 1.00 0.00 O ATOM 1739 CB VAL A 114 0.001 -8.333 -4.539 1.00 0.00 C ATOM 1740 CG1 VAL A 114 0.430 -9.296 -3.442 1.00 0.00 C ATOM 1741 CG2 VAL A 114 -0.624 -7.080 -3.944 1.00 0.00 C ATOM 0 H VAL A 114 0.269 -7.484 -7.252 1.00 0.00 H new ATOM 0 HA VAL A 114 1.947 -7.448 -4.835 1.00 0.00 H new ATOM 0 HB VAL A 114 -0.750 -8.830 -5.153 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -0.429 -9.544 -2.819 1.00 0.00 H new ATOM 0 HG12 VAL A 114 0.827 -10.206 -3.892 1.00 0.00 H new ATOM 0 HG13 VAL A 114 1.200 -8.829 -2.828 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -1.468 -7.359 -3.314 1.00 0.00 H new ATOM 0 HG22 VAL A 114 0.118 -6.553 -3.344 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -0.970 -6.429 -4.747 1.00 0.00 H new ATOM 1751 N ASN A 115 2.979 -9.609 -5.504 1.00 0.00 N ATOM 1752 CA ASN A 115 3.664 -10.812 -5.964 1.00 0.00 C ATOM 1753 C ASN A 115 4.004 -10.710 -7.448 1.00 0.00 C ATOM 1754 O ASN A 115 3.953 -11.700 -8.177 1.00 0.00 O ATOM 1755 CB ASN A 115 2.797 -12.047 -5.712 1.00 0.00 C ATOM 1756 CG ASN A 115 2.632 -12.344 -4.234 1.00 0.00 C ATOM 1757 OD1 ASN A 115 1.560 -12.139 -3.664 1.00 0.00 O ATOM 1758 ND2 ASN A 115 3.696 -12.831 -3.606 1.00 0.00 N ATOM 0 H ASN A 115 3.477 -9.090 -4.780 1.00 0.00 H new ATOM 0 HA ASN A 115 4.593 -10.908 -5.402 1.00 0.00 H new ATOM 0 HB2 ASN A 115 1.816 -11.897 -6.162 1.00 0.00 H new ATOM 0 HB3 ASN A 115 3.245 -12.909 -6.206 1.00 0.00 H new ATOM 0 HD21 ASN A 115 3.645 -13.051 -2.611 1.00 0.00 H new ATOM 0 HD22 ASN A 115 4.564 -12.985 -4.118 1.00 0.00 H new ATOM 1765 N GLY A 116 4.352 -9.505 -7.889 1.00 0.00 N ATOM 1766 CA GLY A 116 4.696 -9.296 -9.284 1.00 0.00 C ATOM 1767 C GLY A 116 3.528 -9.556 -10.214 1.00 0.00 C ATOM 1768 O GLY A 116 3.701 -10.111 -11.299 1.00 0.00 O ATOM 0 H GLY A 116 4.402 -8.670 -7.306 1.00 0.00 H new ATOM 0 HA2 GLY A 116 5.044 -8.272 -9.420 1.00 0.00 H new ATOM 0 HA3 GLY A 116 5.524 -9.952 -9.553 1.00 0.00 H new ATOM 1772 N VAL A 117 2.333 -9.156 -9.788 1.00 0.00 N ATOM 1773 CA VAL A 117 1.132 -9.350 -10.590 1.00 0.00 C ATOM 1774 C VAL A 117 0.080 -8.294 -10.269 1.00 0.00 C ATOM 1775 O VAL A 117 -0.455 -8.251 -9.161 1.00 0.00 O ATOM 1776 CB VAL A 117 0.525 -10.747 -10.364 1.00 0.00 C ATOM 1777 CG1 VAL A 117 -0.744 -10.918 -11.186 1.00 0.00 C ATOM 1778 CG2 VAL A 117 1.539 -11.829 -10.704 1.00 0.00 C ATOM 0 H VAL A 117 2.172 -8.696 -8.892 1.00 0.00 H new ATOM 0 HA VAL A 117 1.431 -9.256 -11.634 1.00 0.00 H new ATOM 0 HB VAL A 117 0.263 -10.844 -9.310 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -1.158 -11.911 -11.013 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -1.473 -10.164 -10.890 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.510 -10.801 -12.244 1.00 0.00 H new ATOM 0 HG21 VAL A 117 1.094 -12.810 -10.539 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.834 -11.736 -11.749 1.00 0.00 H new ATOM 0 HG23 VAL A 117 2.417 -11.717 -10.068 1.00 0.00 H new ATOM 1788 N HIS A 118 -0.212 -7.441 -11.247 1.00 0.00 N ATOM 1789 CA HIS A 118 -1.201 -6.384 -11.069 1.00 0.00 C ATOM 1790 C HIS A 118 -2.558 -6.968 -10.689 1.00 0.00 C ATOM 1791 O HIS A 118 -3.038 -7.910 -11.319 1.00 0.00 O ATOM 1792 CB HIS A 118 -1.329 -5.556 -12.348 1.00 0.00 C ATOM 1793 CG HIS A 118 -1.800 -4.154 -12.109 1.00 0.00 C ATOM 1794 ND1 HIS A 118 -1.435 -3.091 -12.908 1.00 0.00 N ATOM 1795 CD2 HIS A 118 -2.613 -3.644 -11.155 1.00 0.00 C ATOM 1796 CE1 HIS A 118 -2.002 -1.988 -12.454 1.00 0.00 C ATOM 1797 NE2 HIS A 118 -2.722 -2.296 -11.391 1.00 0.00 N ATOM 0 H HIS A 118 0.222 -7.462 -12.170 1.00 0.00 H new ATOM 0 HA HIS A 118 -0.864 -5.738 -10.259 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -0.362 -5.525 -12.849 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -2.023 -6.053 -13.025 1.00 0.00 H new ATOM 0 HD1 HIS A 118 -0.823 -3.148 -13.722 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -3.088 -4.195 -10.357 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -1.895 -1.001 -12.880 1.00 0.00 H new ATOM 1805 N SER A 119 -3.171 -6.403 -9.653 1.00 0.00 N ATOM 1806 CA SER A 119 -4.471 -6.871 -9.186 1.00 0.00 C ATOM 1807 C SER A 119 -5.564 -5.862 -9.523 1.00 0.00 C ATOM 1808 O SER A 119 -6.452 -6.137 -10.331 1.00 0.00 O ATOM 1809 CB SER A 119 -4.436 -7.117 -7.677 1.00 0.00 C ATOM 1810 OG SER A 119 -3.955 -8.418 -7.384 1.00 0.00 O ATOM 0 H SER A 119 -2.788 -5.621 -9.122 1.00 0.00 H new ATOM 0 HA SER A 119 -4.696 -7.808 -9.694 1.00 0.00 H new ATOM 0 HB2 SER A 119 -3.798 -6.374 -7.199 1.00 0.00 H new ATOM 0 HB3 SER A 119 -5.436 -6.993 -7.262 1.00 0.00 H new ATOM 0 HG SER A 119 -3.940 -8.550 -6.413 1.00 0.00 H new ATOM 1816 N LEU A 120 -5.494 -4.692 -8.898 1.00 0.00 N ATOM 1817 CA LEU A 120 -6.477 -3.640 -9.130 1.00 0.00 C ATOM 1818 C LEU A 120 -5.820 -2.264 -9.097 1.00 0.00 C ATOM 1819 O LEU A 120 -4.801 -2.068 -8.436 1.00 0.00 O ATOM 1820 CB LEU A 120 -7.588 -3.712 -8.081 1.00 0.00 C ATOM 1821 CG LEU A 120 -7.274 -3.077 -6.726 1.00 0.00 C ATOM 1822 CD1 LEU A 120 -6.013 -3.683 -6.131 1.00 0.00 C ATOM 1823 CD2 LEU A 120 -7.129 -1.568 -6.865 1.00 0.00 C ATOM 0 H LEU A 120 -4.766 -4.448 -8.226 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.909 -3.793 -10.119 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -8.477 -3.230 -8.488 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -7.840 -4.760 -7.919 1.00 0.00 H new ATOM 0 HG LEU A 120 -8.104 -3.282 -6.050 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -5.806 -3.218 -5.167 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -6.154 -4.755 -5.994 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -5.174 -3.511 -6.805 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -6.906 -1.133 -5.891 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -6.318 -1.343 -7.558 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -8.059 -1.147 -7.246 1.00 0.00 H new ATOM 1835 N GLU A 121 -6.413 -1.313 -9.813 1.00 0.00 N ATOM 1836 CA GLU A 121 -5.885 0.045 -9.864 1.00 0.00 C ATOM 1837 C GLU A 121 -6.823 1.020 -9.158 1.00 0.00 C ATOM 1838 O GLU A 121 -7.950 0.670 -8.806 1.00 0.00 O ATOM 1839 CB GLU A 121 -5.676 0.481 -11.315 1.00 0.00 C ATOM 1840 CG GLU A 121 -4.828 -0.486 -12.125 1.00 0.00 C ATOM 1841 CD GLU A 121 -5.199 -0.496 -13.596 1.00 0.00 C ATOM 1842 OE1 GLU A 121 -5.755 0.514 -14.075 1.00 0.00 O ATOM 1843 OE2 GLU A 121 -4.932 -1.514 -14.267 1.00 0.00 O ATOM 0 H GLU A 121 -7.258 -1.458 -10.365 1.00 0.00 H new ATOM 0 HA GLU A 121 -4.925 0.054 -9.348 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -6.648 0.590 -11.796 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -5.203 1.463 -11.326 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -3.777 -0.217 -12.021 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -4.941 -1.491 -11.719 1.00 0.00 H new ATOM 1850 N TYR A 122 -6.350 2.245 -8.955 1.00 0.00 N ATOM 1851 CA TYR A 122 -7.144 3.270 -8.289 1.00 0.00 C ATOM 1852 C TYR A 122 -6.790 4.659 -8.812 1.00 0.00 C ATOM 1853 O TYR A 122 -5.695 5.167 -8.569 1.00 0.00 O ATOM 1854 CB TYR A 122 -6.926 3.212 -6.776 1.00 0.00 C ATOM 1855 CG TYR A 122 -8.083 3.765 -5.976 1.00 0.00 C ATOM 1856 CD1 TYR A 122 -8.613 5.018 -6.257 1.00 0.00 C ATOM 1857 CD2 TYR A 122 -8.648 3.033 -4.938 1.00 0.00 C ATOM 1858 CE1 TYR A 122 -9.670 5.527 -5.527 1.00 0.00 C ATOM 1859 CE2 TYR A 122 -9.706 3.533 -4.204 1.00 0.00 C ATOM 1860 CZ TYR A 122 -10.213 4.781 -4.502 1.00 0.00 C ATOM 1861 OH TYR A 122 -11.267 5.284 -3.774 1.00 0.00 O ATOM 0 H TYR A 122 -5.421 2.552 -9.242 1.00 0.00 H new ATOM 0 HA TYR A 122 -8.195 3.077 -8.505 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -6.754 2.177 -6.482 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -6.023 3.769 -6.526 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -8.192 5.604 -7.060 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -8.253 2.056 -4.701 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -10.069 6.504 -5.758 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -10.134 2.950 -3.402 1.00 0.00 H new ATOM 0 HH TYR A 122 -11.532 4.634 -3.090 1.00 0.00 H new ATOM 1871 N LYS A 123 -7.725 5.269 -9.532 1.00 0.00 N ATOM 1872 CA LYS A 123 -7.516 6.600 -10.090 1.00 0.00 C ATOM 1873 C LYS A 123 -6.814 7.507 -9.084 1.00 0.00 C ATOM 1874 O LYS A 123 -6.861 7.265 -7.877 1.00 0.00 O ATOM 1875 CB LYS A 123 -8.853 7.218 -10.504 1.00 0.00 C ATOM 1876 CG LYS A 123 -9.614 6.392 -11.527 1.00 0.00 C ATOM 1877 CD LYS A 123 -11.032 6.905 -11.714 1.00 0.00 C ATOM 1878 CE LYS A 123 -11.806 6.054 -12.709 1.00 0.00 C ATOM 1879 NZ LYS A 123 -13.217 6.510 -12.849 1.00 0.00 N ATOM 0 H LYS A 123 -8.636 4.862 -9.743 1.00 0.00 H new ATOM 0 HA LYS A 123 -6.880 6.502 -10.970 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -9.475 7.346 -9.618 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -8.673 8.212 -10.913 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -9.088 6.418 -12.481 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -9.642 5.350 -11.207 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -11.549 6.906 -10.755 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -11.004 7.938 -12.062 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -11.314 6.093 -13.681 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -11.791 5.013 -12.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -13.711 5.905 -13.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -13.695 6.449 -11.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -13.232 7.495 -13.182 1.00 0.00 H new ATOM 1893 N HIS A 124 -6.165 8.552 -9.588 1.00 0.00 N ATOM 1894 CA HIS A 124 -5.456 9.496 -8.732 1.00 0.00 C ATOM 1895 C HIS A 124 -6.413 10.167 -7.753 1.00 0.00 C ATOM 1896 O HIS A 124 -7.170 11.065 -8.126 1.00 0.00 O ATOM 1897 CB HIS A 124 -4.750 10.555 -9.581 1.00 0.00 C ATOM 1898 CG HIS A 124 -3.352 10.180 -9.965 1.00 0.00 C ATOM 1899 ND1 HIS A 124 -2.457 9.610 -9.086 1.00 0.00 N ATOM 1900 CD2 HIS A 124 -2.697 10.295 -11.145 1.00 0.00 C ATOM 1901 CE1 HIS A 124 -1.311 9.392 -9.706 1.00 0.00 C ATOM 1902 NE2 HIS A 124 -1.431 9.798 -10.957 1.00 0.00 N ATOM 0 H HIS A 124 -6.116 8.766 -10.584 1.00 0.00 H new ATOM 0 HA HIS A 124 -4.711 8.942 -8.161 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -5.332 10.731 -10.486 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -4.727 11.495 -9.029 1.00 0.00 H new ATOM 0 HD1 HIS A 124 -2.649 9.391 -8.109 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -3.096 10.702 -12.062 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -0.427 8.956 -9.265 1.00 0.00 H new ATOM 1910 N ARG A 125 -6.376 9.726 -6.500 1.00 0.00 N ATOM 1911 CA ARG A 125 -7.242 10.283 -5.467 1.00 0.00 C ATOM 1912 C ARG A 125 -6.683 11.603 -4.943 1.00 0.00 C ATOM 1913 O ARG A 125 -7.381 12.617 -4.915 1.00 0.00 O ATOM 1914 CB ARG A 125 -7.401 9.290 -4.315 1.00 0.00 C ATOM 1915 CG ARG A 125 -8.496 8.262 -4.544 1.00 0.00 C ATOM 1916 CD ARG A 125 -9.854 8.786 -4.104 1.00 0.00 C ATOM 1917 NE ARG A 125 -10.535 9.509 -5.175 1.00 0.00 N ATOM 1918 CZ ARG A 125 -11.801 9.903 -5.107 1.00 0.00 C ATOM 1919 NH1 ARG A 125 -12.521 9.646 -4.023 1.00 0.00 N ATOM 1920 NH2 ARG A 125 -12.350 10.556 -6.123 1.00 0.00 N ATOM 0 H ARG A 125 -5.756 8.984 -6.175 1.00 0.00 H new ATOM 0 HA ARG A 125 -8.219 10.473 -5.910 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.455 8.772 -4.160 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -7.617 9.840 -3.399 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -8.532 7.997 -5.601 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -8.261 7.350 -3.994 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -10.476 7.952 -3.777 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -9.727 9.445 -3.245 1.00 0.00 H new ATOM 0 HE ARG A 125 -10.009 9.723 -6.022 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -12.102 9.145 -3.240 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -13.493 9.950 -3.973 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -11.799 10.756 -6.958 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -13.323 10.858 -6.069 1.00 0.00 H new ATOM 1934 N PHE A 126 -5.421 11.582 -4.527 1.00 0.00 N ATOM 1935 CA PHE A 126 -4.769 12.775 -4.001 1.00 0.00 C ATOM 1936 C PHE A 126 -4.057 13.540 -5.113 1.00 0.00 C ATOM 1937 O PHE A 126 -3.101 13.043 -5.711 1.00 0.00 O ATOM 1938 CB PHE A 126 -3.770 12.397 -2.906 1.00 0.00 C ATOM 1939 CG PHE A 126 -3.390 13.546 -2.017 1.00 0.00 C ATOM 1940 CD1 PHE A 126 -4.357 14.411 -1.531 1.00 0.00 C ATOM 1941 CD2 PHE A 126 -2.067 13.762 -1.669 1.00 0.00 C ATOM 1942 CE1 PHE A 126 -4.011 15.470 -0.712 1.00 0.00 C ATOM 1943 CE2 PHE A 126 -1.715 14.818 -0.850 1.00 0.00 C ATOM 1944 CZ PHE A 126 -2.688 15.674 -0.372 1.00 0.00 C ATOM 0 H PHE A 126 -4.829 10.751 -4.544 1.00 0.00 H new ATOM 0 HA PHE A 126 -5.537 13.420 -3.574 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -4.197 11.601 -2.295 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -2.870 11.994 -3.370 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -5.393 14.256 -1.795 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -1.302 13.098 -2.042 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -4.774 16.137 -0.339 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -0.680 14.974 -0.584 1.00 0.00 H new ATOM 0 HZ PHE A 126 -2.415 16.501 0.266 1.00 0.00 H new ATOM 1954 N LYS A 127 -4.529 14.752 -5.387 1.00 0.00 N ATOM 1955 CA LYS A 127 -3.939 15.587 -6.426 1.00 0.00 C ATOM 1956 C LYS A 127 -2.446 15.786 -6.181 1.00 0.00 C ATOM 1957 O LYS A 127 -1.614 15.336 -6.968 1.00 0.00 O ATOM 1958 CB LYS A 127 -4.643 16.944 -6.479 1.00 0.00 C ATOM 1959 CG LYS A 127 -6.148 16.842 -6.654 1.00 0.00 C ATOM 1960 CD LYS A 127 -6.516 16.333 -8.038 1.00 0.00 C ATOM 1961 CE LYS A 127 -6.686 14.822 -8.049 1.00 0.00 C ATOM 1962 NZ LYS A 127 -7.623 14.377 -9.117 1.00 0.00 N ATOM 0 H LYS A 127 -5.319 15.178 -4.903 1.00 0.00 H new ATOM 0 HA LYS A 127 -4.068 15.080 -7.382 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -4.429 17.491 -5.561 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -4.229 17.527 -7.302 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -6.558 16.172 -5.898 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -6.601 17.820 -6.493 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -7.441 16.807 -8.367 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -5.741 16.618 -8.750 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -5.715 14.348 -8.197 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -7.057 14.491 -7.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -7.712 13.341 -9.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -8.556 14.809 -8.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -7.256 14.670 -10.045 1.00 0.00 H new ATOM 1976 N GLU A 128 -2.116 16.461 -5.085 1.00 0.00 N ATOM 1977 CA GLU A 128 -0.723 16.719 -4.738 1.00 0.00 C ATOM 1978 C GLU A 128 0.059 15.413 -4.624 1.00 0.00 C ATOM 1979 O GLU A 128 -0.062 14.687 -3.636 1.00 0.00 O ATOM 1980 CB GLU A 128 -0.637 17.494 -3.421 1.00 0.00 C ATOM 1981 CG GLU A 128 0.638 18.307 -3.276 1.00 0.00 C ATOM 1982 CD GLU A 128 0.757 19.398 -4.323 1.00 0.00 C ATOM 1983 OE1 GLU A 128 -0.252 20.089 -4.577 1.00 0.00 O ATOM 1984 OE2 GLU A 128 1.859 19.561 -4.887 1.00 0.00 O ATOM 0 H GLU A 128 -2.793 16.839 -4.422 1.00 0.00 H new ATOM 0 HA GLU A 128 -0.282 17.319 -5.534 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -1.495 18.162 -3.346 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -0.706 16.791 -2.590 1.00 0.00 H new ATOM 0 HG2 GLU A 128 0.667 18.757 -2.283 1.00 0.00 H new ATOM 0 HG3 GLU A 128 1.499 17.642 -3.350 1.00 0.00 H new ATOM 1991 N LEU A 129 0.862 15.121 -5.641 1.00 0.00 N ATOM 1992 CA LEU A 129 1.665 13.903 -5.657 1.00 0.00 C ATOM 1993 C LEU A 129 3.036 14.146 -5.035 1.00 0.00 C ATOM 1994 O LEU A 129 3.619 13.251 -4.423 1.00 0.00 O ATOM 1995 CB LEU A 129 1.825 13.393 -7.090 1.00 0.00 C ATOM 1996 CG LEU A 129 0.537 13.257 -7.902 1.00 0.00 C ATOM 1997 CD1 LEU A 129 0.851 12.869 -9.339 1.00 0.00 C ATOM 1998 CD2 LEU A 129 -0.391 12.234 -7.263 1.00 0.00 C ATOM 0 H LEU A 129 0.975 15.711 -6.465 1.00 0.00 H new ATOM 0 HA LEU A 129 1.147 13.148 -5.065 1.00 0.00 H new ATOM 0 HB2 LEU A 129 2.496 14.068 -7.622 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.313 12.419 -7.055 1.00 0.00 H new ATOM 0 HG LEU A 129 0.031 14.222 -7.909 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.078 12.777 -9.902 1.00 0.00 H new ATOM 0 HD12 LEU A 129 1.477 13.636 -9.795 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.379 11.916 -9.351 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.303 12.150 -7.854 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.107 11.265 -7.225 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -0.643 12.553 -6.252 1.00 0.00 H new ATOM 2010 N SER A 130 3.544 15.364 -5.193 1.00 0.00 N ATOM 2011 CA SER A 130 4.848 15.725 -4.649 1.00 0.00 C ATOM 2012 C SER A 130 4.722 16.191 -3.201 1.00 0.00 C ATOM 2013 O SER A 130 5.539 16.973 -2.716 1.00 0.00 O ATOM 2014 CB SER A 130 5.492 16.824 -5.496 1.00 0.00 C ATOM 2015 OG SER A 130 4.590 17.896 -5.712 1.00 0.00 O ATOM 0 H SER A 130 3.072 16.118 -5.693 1.00 0.00 H new ATOM 0 HA SER A 130 5.482 14.839 -4.674 1.00 0.00 H new ATOM 0 HB2 SER A 130 6.388 17.193 -4.998 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.807 16.411 -6.454 1.00 0.00 H new ATOM 0 HG SER A 130 5.026 18.586 -6.254 1.00 0.00 H new ATOM 2021 N SER A 131 3.691 15.705 -2.518 1.00 0.00 N ATOM 2022 CA SER A 131 3.454 16.074 -1.127 1.00 0.00 C ATOM 2023 C SER A 131 3.661 14.876 -0.204 1.00 0.00 C ATOM 2024 O SER A 131 4.167 15.018 0.910 1.00 0.00 O ATOM 2025 CB SER A 131 2.036 16.623 -0.957 1.00 0.00 C ATOM 2026 OG SER A 131 1.092 15.818 -1.642 1.00 0.00 O ATOM 0 H SER A 131 3.007 15.055 -2.905 1.00 0.00 H new ATOM 0 HA SER A 131 4.171 16.849 -0.856 1.00 0.00 H new ATOM 0 HB2 SER A 131 1.783 16.664 0.102 1.00 0.00 H new ATOM 0 HB3 SER A 131 1.990 17.644 -1.335 1.00 0.00 H new ATOM 0 HG SER A 131 1.154 14.895 -1.319 1.00 0.00 H new ATOM 2032 N ILE A 132 3.268 13.699 -0.677 1.00 0.00 N ATOM 2033 CA ILE A 132 3.411 12.476 0.104 1.00 0.00 C ATOM 2034 C ILE A 132 4.862 12.257 0.521 1.00 0.00 C ATOM 2035 O ILE A 132 5.670 11.744 -0.254 1.00 0.00 O ATOM 2036 CB ILE A 132 2.923 11.245 -0.682 1.00 0.00 C ATOM 2037 CG1 ILE A 132 1.468 11.435 -1.117 1.00 0.00 C ATOM 2038 CG2 ILE A 132 3.070 9.987 0.160 1.00 0.00 C ATOM 2039 CD1 ILE A 132 1.127 10.730 -2.411 1.00 0.00 C ATOM 0 H ILE A 132 2.848 13.566 -1.597 1.00 0.00 H new ATOM 0 HA ILE A 132 2.793 12.596 0.994 1.00 0.00 H new ATOM 0 HB ILE A 132 3.538 11.135 -1.575 1.00 0.00 H new ATOM 0 HG12 ILE A 132 0.811 11.068 -0.329 1.00 0.00 H new ATOM 0 HG13 ILE A 132 1.267 12.500 -1.229 1.00 0.00 H new ATOM 0 HG21 ILE A 132 2.721 9.125 -0.409 1.00 0.00 H new ATOM 0 HG22 ILE A 132 4.118 9.847 0.425 1.00 0.00 H new ATOM 0 HG23 ILE A 132 2.476 10.086 1.069 1.00 0.00 H new ATOM 0 HD11 ILE A 132 0.080 10.908 -2.658 1.00 0.00 H new ATOM 0 HD12 ILE A 132 1.759 11.114 -3.212 1.00 0.00 H new ATOM 0 HD13 ILE A 132 1.296 9.659 -2.297 1.00 0.00 H new ATOM 2051 N ASP A 133 5.184 12.647 1.749 1.00 0.00 N ATOM 2052 CA ASP A 133 6.537 12.490 2.270 1.00 0.00 C ATOM 2053 C ASP A 133 6.526 11.720 3.587 1.00 0.00 C ATOM 2054 O ASP A 133 7.382 11.928 4.448 1.00 0.00 O ATOM 2055 CB ASP A 133 7.191 13.858 2.470 1.00 0.00 C ATOM 2056 CG ASP A 133 8.702 13.771 2.555 1.00 0.00 C ATOM 2057 OD1 ASP A 133 9.333 13.418 1.537 1.00 0.00 O ATOM 2058 OD2 ASP A 133 9.253 14.055 3.639 1.00 0.00 O ATOM 0 H ASP A 133 4.527 13.074 2.402 1.00 0.00 H new ATOM 0 HA ASP A 133 7.117 11.922 1.543 1.00 0.00 H new ATOM 0 HB2 ASP A 133 6.914 14.514 1.645 1.00 0.00 H new ATOM 0 HB3 ASP A 133 6.804 14.312 3.382 1.00 0.00 H new ATOM 2063 N THR A 134 5.550 10.830 3.739 1.00 0.00 N ATOM 2064 CA THR A 134 5.426 10.031 4.951 1.00 0.00 C ATOM 2065 C THR A 134 4.807 8.670 4.651 1.00 0.00 C ATOM 2066 O THR A 134 3.932 8.550 3.793 1.00 0.00 O ATOM 2067 CB THR A 134 4.571 10.749 6.012 1.00 0.00 C ATOM 2068 OG1 THR A 134 5.037 12.091 6.191 1.00 0.00 O ATOM 2069 CG2 THR A 134 4.620 10.007 7.339 1.00 0.00 C ATOM 0 H THR A 134 4.834 10.645 3.037 1.00 0.00 H new ATOM 0 HA THR A 134 6.434 9.891 5.342 1.00 0.00 H new ATOM 0 HB THR A 134 3.539 10.768 5.663 1.00 0.00 H new ATOM 0 HG1 THR A 134 4.487 12.541 6.866 1.00 0.00 H new ATOM 0 HG21 THR A 134 4.009 10.533 8.073 1.00 0.00 H new ATOM 0 HG22 THR A 134 4.236 8.996 7.205 1.00 0.00 H new ATOM 0 HG23 THR A 134 5.650 9.960 7.692 1.00 0.00 H new ATOM 2077 N LEU A 135 5.266 7.647 5.364 1.00 0.00 N ATOM 2078 CA LEU A 135 4.757 6.293 5.175 1.00 0.00 C ATOM 2079 C LEU A 135 4.434 5.641 6.515 1.00 0.00 C ATOM 2080 O LEU A 135 5.333 5.311 7.287 1.00 0.00 O ATOM 2081 CB LEU A 135 5.777 5.445 4.414 1.00 0.00 C ATOM 2082 CG LEU A 135 5.542 3.934 4.434 1.00 0.00 C ATOM 2083 CD1 LEU A 135 4.226 3.590 3.754 1.00 0.00 C ATOM 2084 CD2 LEU A 135 6.698 3.206 3.763 1.00 0.00 C ATOM 0 H LEU A 135 5.990 7.729 6.078 1.00 0.00 H new ATOM 0 HA LEU A 135 3.838 6.355 4.592 1.00 0.00 H new ATOM 0 HB2 LEU A 135 5.793 5.776 3.376 1.00 0.00 H new ATOM 0 HB3 LEU A 135 6.766 5.644 4.827 1.00 0.00 H new ATOM 0 HG LEU A 135 5.487 3.607 5.472 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.075 2.511 3.778 1.00 0.00 H new ATOM 0 HD12 LEU A 135 3.406 4.082 4.277 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.252 3.930 2.719 1.00 0.00 H new ATOM 0 HD21 LEU A 135 6.514 2.132 3.786 1.00 0.00 H new ATOM 0 HD22 LEU A 135 6.785 3.537 2.728 1.00 0.00 H new ATOM 0 HD23 LEU A 135 7.624 3.427 4.293 1.00 0.00 H new ATOM 2096 N GLU A 136 3.145 5.457 6.783 1.00 0.00 N ATOM 2097 CA GLU A 136 2.705 4.842 8.029 1.00 0.00 C ATOM 2098 C GLU A 136 2.069 3.479 7.769 1.00 0.00 C ATOM 2099 O GLU A 136 1.036 3.381 7.107 1.00 0.00 O ATOM 2100 CB GLU A 136 1.708 5.753 8.749 1.00 0.00 C ATOM 2101 CG GLU A 136 2.363 6.904 9.493 1.00 0.00 C ATOM 2102 CD GLU A 136 1.571 7.337 10.711 1.00 0.00 C ATOM 2103 OE1 GLU A 136 0.327 7.405 10.618 1.00 0.00 O ATOM 2104 OE2 GLU A 136 2.195 7.608 11.759 1.00 0.00 O ATOM 0 H GLU A 136 2.388 5.725 6.154 1.00 0.00 H new ATOM 0 HA GLU A 136 3.580 4.700 8.663 1.00 0.00 H new ATOM 0 HB2 GLU A 136 1.005 6.156 8.020 1.00 0.00 H new ATOM 0 HB3 GLU A 136 1.129 5.158 9.455 1.00 0.00 H new ATOM 0 HG2 GLU A 136 3.365 6.608 9.802 1.00 0.00 H new ATOM 0 HG3 GLU A 136 2.475 7.752 8.817 1.00 0.00 H new ATOM 2111 N ILE A 137 2.694 2.431 8.295 1.00 0.00 N ATOM 2112 CA ILE A 137 2.190 1.075 8.121 1.00 0.00 C ATOM 2113 C ILE A 137 1.834 0.444 9.463 1.00 0.00 C ATOM 2114 O ILE A 137 2.564 0.591 10.442 1.00 0.00 O ATOM 2115 CB ILE A 137 3.217 0.181 7.402 1.00 0.00 C ATOM 2116 CG1 ILE A 137 3.510 0.727 6.003 1.00 0.00 C ATOM 2117 CG2 ILE A 137 2.708 -1.251 7.321 1.00 0.00 C ATOM 2118 CD1 ILE A 137 4.770 0.162 5.386 1.00 0.00 C ATOM 0 H ILE A 137 3.550 2.495 8.845 1.00 0.00 H new ATOM 0 HA ILE A 137 1.292 1.148 7.508 1.00 0.00 H new ATOM 0 HB ILE A 137 4.144 0.185 7.975 1.00 0.00 H new ATOM 0 HG12 ILE A 137 2.665 0.506 5.351 1.00 0.00 H new ATOM 0 HG13 ILE A 137 3.596 1.812 6.056 1.00 0.00 H new ATOM 0 HG21 ILE A 137 3.445 -1.871 6.810 1.00 0.00 H new ATOM 0 HG22 ILE A 137 2.545 -1.637 8.327 1.00 0.00 H new ATOM 0 HG23 ILE A 137 1.769 -1.273 6.767 1.00 0.00 H new ATOM 0 HD11 ILE A 137 4.915 0.593 4.395 1.00 0.00 H new ATOM 0 HD12 ILE A 137 5.625 0.406 6.017 1.00 0.00 H new ATOM 0 HD13 ILE A 137 4.679 -0.921 5.301 1.00 0.00 H new ATOM 2130 N ASN A 138 0.708 -0.261 9.499 1.00 0.00 N ATOM 2131 CA ASN A 138 0.256 -0.917 10.721 1.00 0.00 C ATOM 2132 C ASN A 138 -0.540 -2.178 10.399 1.00 0.00 C ATOM 2133 O ASN A 138 -1.319 -2.207 9.447 1.00 0.00 O ATOM 2134 CB ASN A 138 -0.601 0.041 11.551 1.00 0.00 C ATOM 2135 CG ASN A 138 -0.942 -0.524 12.916 1.00 0.00 C ATOM 2136 OD1 ASN A 138 0.083 -0.854 13.693 1.00 0.00 O flip ATOM 2137 ND2 ASN A 138 -2.114 -0.662 13.268 1.00 0.00 N flip ATOM 0 H ASN A 138 0.092 -0.393 8.697 1.00 0.00 H new ATOM 0 HA ASN A 138 1.136 -1.201 11.298 1.00 0.00 H new ATOM 0 HB2 ASN A 138 -0.070 0.985 11.674 1.00 0.00 H new ATOM 0 HB3 ASN A 138 -1.522 0.261 11.011 1.00 0.00 H new ATOM 0 HD21 ASN A 138 -2.871 -0.395 12.638 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -2.328 -1.043 14.189 1.00 0.00 H new ATOM 2144 N GLY A 139 -0.337 -3.220 11.199 1.00 0.00 N ATOM 2145 CA GLY A 139 -1.042 -4.470 10.984 1.00 0.00 C ATOM 2146 C GLY A 139 -0.456 -5.613 11.789 1.00 0.00 C ATOM 2147 O GLY A 139 0.301 -5.391 12.734 1.00 0.00 O ATOM 0 H GLY A 139 0.304 -3.221 11.993 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -2.091 -4.342 11.251 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -1.011 -4.723 9.924 1.00 0.00 H new ATOM 2151 N ASP A 140 -0.806 -6.838 11.415 1.00 0.00 N ATOM 2152 CA ASP A 140 -0.310 -8.021 12.110 1.00 0.00 C ATOM 2153 C ASP A 140 0.691 -8.779 11.244 1.00 0.00 C ATOM 2154 O ASP A 140 0.676 -10.010 11.195 1.00 0.00 O ATOM 2155 CB ASP A 140 -1.472 -8.939 12.492 1.00 0.00 C ATOM 2156 CG ASP A 140 -2.494 -8.245 13.370 1.00 0.00 C ATOM 2157 OD1 ASP A 140 -2.083 -7.527 14.306 1.00 0.00 O ATOM 2158 OD2 ASP A 140 -3.705 -8.418 13.121 1.00 0.00 O ATOM 0 H ASP A 140 -1.431 -7.039 10.634 1.00 0.00 H new ATOM 0 HA ASP A 140 0.197 -7.694 13.018 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -1.960 -9.298 11.586 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -1.084 -9.814 13.013 1.00 0.00 H new ATOM 2163 N ILE A 141 1.557 -8.038 10.563 1.00 0.00 N ATOM 2164 CA ILE A 141 2.565 -8.641 9.699 1.00 0.00 C ATOM 2165 C ILE A 141 3.967 -8.187 10.090 1.00 0.00 C ATOM 2166 O ILE A 141 4.133 -7.306 10.934 1.00 0.00 O ATOM 2167 CB ILE A 141 2.319 -8.293 8.219 1.00 0.00 C ATOM 2168 CG1 ILE A 141 2.192 -6.779 8.042 1.00 0.00 C ATOM 2169 CG2 ILE A 141 1.070 -8.998 7.710 1.00 0.00 C ATOM 2170 CD1 ILE A 141 3.506 -6.093 7.743 1.00 0.00 C ATOM 0 H ILE A 141 1.582 -7.019 10.592 1.00 0.00 H new ATOM 0 HA ILE A 141 2.486 -9.720 9.828 1.00 0.00 H new ATOM 0 HB ILE A 141 3.172 -8.637 7.634 1.00 0.00 H new ATOM 0 HG12 ILE A 141 1.492 -6.574 7.232 1.00 0.00 H new ATOM 0 HG13 ILE A 141 1.766 -6.350 8.949 1.00 0.00 H new ATOM 0 HG21 ILE A 141 0.909 -8.742 6.663 1.00 0.00 H new ATOM 0 HG22 ILE A 141 1.197 -10.076 7.805 1.00 0.00 H new ATOM 0 HG23 ILE A 141 0.208 -8.681 8.297 1.00 0.00 H new ATOM 0 HD11 ILE A 141 3.340 -5.022 7.630 1.00 0.00 H new ATOM 0 HD12 ILE A 141 4.202 -6.268 8.563 1.00 0.00 H new ATOM 0 HD13 ILE A 141 3.924 -6.495 6.820 1.00 0.00 H new ATOM 2182 N HIS A 142 4.974 -8.792 9.469 1.00 0.00 N ATOM 2183 CA HIS A 142 6.364 -8.448 9.749 1.00 0.00 C ATOM 2184 C HIS A 142 6.994 -7.723 8.565 1.00 0.00 C ATOM 2185 O HIS A 142 7.228 -8.317 7.512 1.00 0.00 O ATOM 2186 CB HIS A 142 7.167 -9.708 10.077 1.00 0.00 C ATOM 2187 CG HIS A 142 8.637 -9.461 10.214 1.00 0.00 C ATOM 2188 ND1 HIS A 142 9.566 -9.111 9.294 1.00 0.00 N flip ATOM 2189 CD2 HIS A 142 9.310 -9.570 11.413 1.00 0.00 C flip ATOM 2190 CE1 HIS A 142 10.770 -9.014 9.947 1.00 0.00 C flip ATOM 2191 NE2 HIS A 142 10.588 -9.296 11.225 1.00 0.00 N flip ATOM 0 H HIS A 142 4.854 -9.523 8.768 1.00 0.00 H new ATOM 0 HA HIS A 142 6.381 -7.781 10.611 1.00 0.00 H new ATOM 0 HB2 HIS A 142 6.791 -10.137 11.006 1.00 0.00 H new ATOM 0 HB3 HIS A 142 7.002 -10.448 9.294 1.00 0.00 H new ATOM 0 HD2 HIS A 142 8.862 -9.838 12.358 1.00 0.00 H new ATOM 0 HE1 HIS A 142 11.712 -8.750 9.490 1.00 0.00 H new ATOM 0 HE2 HIS A 142 11.312 -9.301 11.944 1.00 0.00 H new ATOM 2199 N LEU A 143 7.266 -6.435 8.743 1.00 0.00 N ATOM 2200 CA LEU A 143 7.869 -5.627 7.688 1.00 0.00 C ATOM 2201 C LEU A 143 9.383 -5.804 7.666 1.00 0.00 C ATOM 2202 O LEU A 143 10.082 -5.387 8.591 1.00 0.00 O ATOM 2203 CB LEU A 143 7.519 -4.151 7.887 1.00 0.00 C ATOM 2204 CG LEU A 143 8.092 -3.181 6.853 1.00 0.00 C ATOM 2205 CD1 LEU A 143 7.488 -3.442 5.482 1.00 0.00 C ATOM 2206 CD2 LEU A 143 7.848 -1.741 7.280 1.00 0.00 C ATOM 0 H LEU A 143 7.079 -5.927 9.608 1.00 0.00 H new ATOM 0 HA LEU A 143 7.469 -5.963 6.732 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.433 -4.052 7.886 1.00 0.00 H new ATOM 0 HB3 LEU A 143 7.866 -3.846 8.874 1.00 0.00 H new ATOM 0 HG LEU A 143 9.168 -3.343 6.789 1.00 0.00 H new ATOM 0 HD11 LEU A 143 7.908 -2.742 4.760 1.00 0.00 H new ATOM 0 HD12 LEU A 143 7.715 -4.462 5.173 1.00 0.00 H new ATOM 0 HD13 LEU A 143 6.407 -3.309 5.529 1.00 0.00 H new ATOM 0 HD21 LEU A 143 8.262 -1.065 6.532 1.00 0.00 H new ATOM 0 HD22 LEU A 143 6.776 -1.566 7.373 1.00 0.00 H new ATOM 0 HD23 LEU A 143 8.330 -1.560 8.240 1.00 0.00 H new ATOM 2218 N LEU A 144 9.886 -6.421 6.602 1.00 0.00 N ATOM 2219 CA LEU A 144 11.319 -6.652 6.457 1.00 0.00 C ATOM 2220 C LEU A 144 12.053 -5.347 6.162 1.00 0.00 C ATOM 2221 O LEU A 144 12.937 -4.939 6.913 1.00 0.00 O ATOM 2222 CB LEU A 144 11.582 -7.662 5.339 1.00 0.00 C ATOM 2223 CG LEU A 144 10.825 -8.987 5.440 1.00 0.00 C ATOM 2224 CD1 LEU A 144 10.575 -9.565 4.056 1.00 0.00 C ATOM 2225 CD2 LEU A 144 11.594 -9.977 6.303 1.00 0.00 C ATOM 0 H LEU A 144 9.322 -6.770 5.827 1.00 0.00 H new ATOM 0 HA LEU A 144 11.695 -7.055 7.398 1.00 0.00 H new ATOM 0 HB2 LEU A 144 11.330 -7.194 4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 144 12.650 -7.878 5.315 1.00 0.00 H new ATOM 0 HG LEU A 144 9.861 -8.798 5.912 1.00 0.00 H new ATOM 0 HD11 LEU A 144 10.035 -10.508 4.147 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.982 -8.863 3.470 1.00 0.00 H new ATOM 0 HD13 LEU A 144 11.528 -9.740 3.557 1.00 0.00 H new ATOM 0 HD21 LEU A 144 11.040 -10.914 6.363 1.00 0.00 H new ATOM 0 HD22 LEU A 144 12.573 -10.162 5.860 1.00 0.00 H new ATOM 0 HD23 LEU A 144 11.721 -9.565 7.304 1.00 0.00 H new ATOM 2237 N GLU A 145 11.677 -4.698 5.064 1.00 0.00 N ATOM 2238 CA GLU A 145 12.299 -3.439 4.672 1.00 0.00 C ATOM 2239 C GLU A 145 11.562 -2.813 3.491 1.00 0.00 C ATOM 2240 O GLU A 145 11.016 -3.517 2.641 1.00 0.00 O ATOM 2241 CB GLU A 145 13.769 -3.662 4.310 1.00 0.00 C ATOM 2242 CG GLU A 145 14.517 -2.380 3.984 1.00 0.00 C ATOM 2243 CD GLU A 145 15.635 -2.595 2.983 1.00 0.00 C ATOM 2244 OE1 GLU A 145 15.466 -3.436 2.076 1.00 0.00 O ATOM 2245 OE2 GLU A 145 16.680 -1.922 3.107 1.00 0.00 O ATOM 0 H GLU A 145 10.946 -5.023 4.431 1.00 0.00 H new ATOM 0 HA GLU A 145 12.241 -2.755 5.519 1.00 0.00 H new ATOM 0 HB2 GLU A 145 14.267 -4.162 5.141 1.00 0.00 H new ATOM 0 HB3 GLU A 145 13.826 -4.334 3.453 1.00 0.00 H new ATOM 0 HG2 GLU A 145 13.816 -1.646 3.588 1.00 0.00 H new ATOM 0 HG3 GLU A 145 14.931 -1.962 4.902 1.00 0.00 H new ATOM 2252 N VAL A 146 11.551 -1.485 3.445 1.00 0.00 N ATOM 2253 CA VAL A 146 10.882 -0.762 2.369 1.00 0.00 C ATOM 2254 C VAL A 146 11.894 -0.127 1.422 1.00 0.00 C ATOM 2255 O VAL A 146 12.895 0.442 1.858 1.00 0.00 O ATOM 2256 CB VAL A 146 9.954 0.335 2.922 1.00 0.00 C ATOM 2257 CG1 VAL A 146 9.297 1.102 1.785 1.00 0.00 C ATOM 2258 CG2 VAL A 146 8.905 -0.270 3.844 1.00 0.00 C ATOM 0 H VAL A 146 11.998 -0.887 4.140 1.00 0.00 H new ATOM 0 HA VAL A 146 10.284 -1.491 1.822 1.00 0.00 H new ATOM 0 HB VAL A 146 10.554 1.036 3.502 1.00 0.00 H new ATOM 0 HG11 VAL A 146 8.645 1.873 2.195 1.00 0.00 H new ATOM 0 HG12 VAL A 146 10.066 1.567 1.168 1.00 0.00 H new ATOM 0 HG13 VAL A 146 8.709 0.416 1.175 1.00 0.00 H new ATOM 0 HG21 VAL A 146 8.258 0.519 4.226 1.00 0.00 H new ATOM 0 HG22 VAL A 146 8.307 -0.993 3.290 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.398 -0.770 4.678 1.00 0.00 H new ATOM 2268 N ARG A 147 11.626 -0.227 0.125 1.00 0.00 N ATOM 2269 CA ARG A 147 12.513 0.337 -0.885 1.00 0.00 C ATOM 2270 C ARG A 147 11.751 1.277 -1.815 1.00 0.00 C ATOM 2271 O ARG A 147 10.559 1.091 -2.060 1.00 0.00 O ATOM 2272 CB ARG A 147 13.171 -0.779 -1.698 1.00 0.00 C ATOM 2273 CG ARG A 147 14.473 -1.284 -1.097 1.00 0.00 C ATOM 2274 CD ARG A 147 15.395 -1.853 -2.164 1.00 0.00 C ATOM 2275 NE ARG A 147 16.115 -0.804 -2.882 1.00 0.00 N ATOM 2276 CZ ARG A 147 17.043 -0.035 -2.323 1.00 0.00 C ATOM 2277 NH1 ARG A 147 17.363 -0.198 -1.047 1.00 0.00 N ATOM 2278 NH2 ARG A 147 17.654 0.898 -3.042 1.00 0.00 N ATOM 0 H ARG A 147 10.801 -0.694 -0.252 1.00 0.00 H new ATOM 0 HA ARG A 147 13.287 0.909 -0.373 1.00 0.00 H new ATOM 0 HB2 ARG A 147 12.474 -1.612 -1.786 1.00 0.00 H new ATOM 0 HB3 ARG A 147 13.363 -0.416 -2.708 1.00 0.00 H new ATOM 0 HG2 ARG A 147 14.976 -0.468 -0.577 1.00 0.00 H new ATOM 0 HG3 ARG A 147 14.258 -2.051 -0.353 1.00 0.00 H new ATOM 0 HD2 ARG A 147 16.111 -2.532 -1.700 1.00 0.00 H new ATOM 0 HD3 ARG A 147 14.811 -2.441 -2.872 1.00 0.00 H new ATOM 0 HE ARG A 147 15.893 -0.654 -3.866 1.00 0.00 H new ATOM 0 HH11 ARG A 147 16.896 -0.915 -0.492 1.00 0.00 H new ATOM 0 HH12 ARG A 147 18.076 0.394 -0.620 1.00 0.00 H new ATOM 0 HH21 ARG A 147 17.411 1.025 -4.025 1.00 0.00 H new ATOM 0 HH22 ARG A 147 18.366 1.488 -2.612 1.00 0.00 H new ATOM 2292 N SER A 148 12.447 2.285 -2.329 1.00 0.00 N ATOM 2293 CA SER A 148 11.835 3.256 -3.229 1.00 0.00 C ATOM 2294 C SER A 148 12.860 3.799 -4.220 1.00 0.00 C ATOM 2295 O SER A 148 13.823 4.462 -3.834 1.00 0.00 O ATOM 2296 CB SER A 148 11.222 4.407 -2.430 1.00 0.00 C ATOM 2297 OG SER A 148 12.206 5.074 -1.658 1.00 0.00 O ATOM 0 H SER A 148 13.435 2.451 -2.138 1.00 0.00 H new ATOM 0 HA SER A 148 11.047 2.751 -3.788 1.00 0.00 H new ATOM 0 HB2 SER A 148 10.748 5.114 -3.111 1.00 0.00 H new ATOM 0 HB3 SER A 148 10.440 4.023 -1.775 1.00 0.00 H new ATOM 0 HG SER A 148 13.065 5.049 -2.130 1.00 0.00 H new ATOM 2303 N TRP A 149 12.644 3.514 -5.499 1.00 0.00 N ATOM 2304 CA TRP A 149 13.549 3.974 -6.547 1.00 0.00 C ATOM 2305 C TRP A 149 12.769 4.489 -7.752 1.00 0.00 C ATOM 2306 O TRP A 149 12.126 3.716 -8.463 1.00 0.00 O ATOM 2307 CB TRP A 149 14.484 2.842 -6.975 1.00 0.00 C ATOM 2308 CG TRP A 149 13.767 1.684 -7.602 1.00 0.00 C ATOM 2309 CD1 TRP A 149 13.417 1.551 -8.915 1.00 0.00 C ATOM 2310 CD2 TRP A 149 13.311 0.499 -6.941 1.00 0.00 C ATOM 2311 NE1 TRP A 149 12.771 0.354 -9.110 1.00 0.00 N ATOM 2312 CE2 TRP A 149 12.694 -0.310 -7.915 1.00 0.00 C ATOM 2313 CE3 TRP A 149 13.365 0.042 -5.621 1.00 0.00 C ATOM 2314 CZ2 TRP A 149 12.136 -1.549 -7.608 1.00 0.00 C ATOM 2315 CZ3 TRP A 149 12.811 -1.187 -5.319 1.00 0.00 C ATOM 2316 CH2 TRP A 149 12.203 -1.972 -6.309 1.00 0.00 C ATOM 0 H TRP A 149 11.851 2.967 -5.836 1.00 0.00 H new ATOM 0 HA TRP A 149 14.144 4.794 -6.145 1.00 0.00 H new ATOM 0 HB2 TRP A 149 15.216 3.233 -7.682 1.00 0.00 H new ATOM 0 HB3 TRP A 149 15.038 2.489 -6.105 1.00 0.00 H new ATOM 0 HD1 TRP A 149 13.618 2.279 -9.687 1.00 0.00 H new ATOM 0 HE1 TRP A 149 12.408 0.015 -10.001 1.00 0.00 H new ATOM 0 HE3 TRP A 149 13.831 0.639 -4.851 1.00 0.00 H new ATOM 0 HZ2 TRP A 149 11.667 -2.155 -8.369 1.00 0.00 H new ATOM 0 HZ3 TRP A 149 12.847 -1.550 -4.302 1.00 0.00 H new ATOM 0 HH2 TRP A 149 11.780 -2.929 -6.041 1.00 0.00 H new