USER MOD reduce.3.24.130724 H: found=0, std=0, add=1234, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1236 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 144 TYR OH : rot 53:sc= 0.873 USER MOD Set 1.2: A 183 ASN : amide:sc= 0.729 K(o=1.6,f=-0.42) USER MOD Set 2.1: A 161 THR OG1 : rot 139:sc= 1.09 USER MOD Set 2.2: A 189 LYS NZ :NH3+ -163:sc= 0.454 (180deg=0.148) USER MOD Set 3.1: A 61 LYS NZ :NH3+ -158:sc= 0.563 (180deg=-0.444) USER MOD Set 3.2: A 119 SER OG : rot 72:sc= 1.79 USER MOD Single : A 19 GLN : amide:sc= -0.216 K(o=-0.22,f=-3.8!) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot -14:sc= 1.27 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot -160:sc= -1.68! USER MOD Single : A 40 LYS NZ :NH3+ -166:sc= -2.2! (180deg=-3.13!) USER MOD Single : A 43 THR OG1 : rot 44:sc= 0.858 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -136:sc= 1.31 (180deg=1.03) USER MOD Single : A 59 MET CE :methyl 139:sc= -2.7! (180deg=-5.32!) USER MOD Single : A 63 MET CE :methyl 167:sc= 0 (180deg=-0.276) USER MOD Single : A 64 LYS NZ :NH3+ 171:sc= 1.24 (180deg=1.18) USER MOD Single : A 65 TYR OH : rot 4:sc= 0.459 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= 1.87 K(o=1.9,f=-10!) USER MOD Single : A 72 LYS NZ :NH3+ 165:sc= -0.0192 (180deg=-0.199) USER MOD Single : A 76 MET CE :methyl 158:sc= -0.0201 (180deg=-0.84) USER MOD Single : A 78 MET CE :methyl 141:sc= -0.577 (180deg=-2.42!) USER MOD Single : A 79 THR OG1 : rot 39:sc= 0.223 USER MOD Single : A 83 SER OG : rot 180:sc= -0.247 USER MOD Single : A 89 ASN : amide:sc= 0.98 K(o=0.98,f=-0.037) USER MOD Single : A 93 SER OG : rot 101:sc= 1.18 USER MOD Single : A 95 GLN : amide:sc= -0.597 K(o=-0.6,f=-4.9!) USER MOD Single : A 96 LYS NZ :NH3+ 148:sc= 0.356 (180deg=0.0515) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ -128:sc= 0.507 (180deg=-0.541) USER MOD Single : A 106 ASN :FLIP amide:sc= -0.211 F(o=-0.79!,f=-0.21) USER MOD Single : A 107 GLN : amide:sc= -3.15! C(o=-3.1!,f=-4.1!) USER MOD Single : A 109 GLN : amide:sc= -4.25! C(o=-4.3!,f=-4.1!) USER MOD Single : A 111 SER OG : rot 180:sc=-0.00508 USER MOD Single : A 116 SER OG : rot 144:sc= -0.0963 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 30:sc= -0.897 USER MOD Single : A 132 SER OG : rot -81:sc= 0.482 USER MOD Single : A 133 THR OG1 : rot 40:sc= 1.2 USER MOD Single : A 134 GLN : amide:sc= 0.964 K(o=0.96,f=-0.014) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 LYS NZ :NH3+ 170:sc= 1.17 (180deg=1.13) USER MOD Single : A 147 HIS : +bothHN:sc= 0.821 K(o=0.82,f=-7.6!) USER MOD Single : A 149 THR OG1 : rot 73:sc= 1.22 USER MOD Single : A 150 GLN : amide:sc= 0.0693 X(o=0.069,f=-0.12) USER MOD Single : A 153 THR OG1 : rot 79:sc= 0.148 USER MOD Single : A 154 THR OG1 : rot 67:sc= 1.18 USER MOD Single : A 158 THR OG1 : rot -83:sc= 1.24 USER MOD Single : A 162 TYR OH : rot 180:sc= -0.157 USER MOD Single : A 163 GLN : amide:sc= -1.4 X(o=-1.4,f=-1) USER MOD Single : A 167 TYR OH : rot -80:sc= -1.7! USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 CYS SG : rot 180:sc= -0.0507 USER MOD ----------------------------------------------------------------- ATOM 166 N TRP A 18 -6.647 -12.551 -4.917 1.00 44.32 N ATOM 167 CA TRP A 18 -5.368 -12.238 -5.495 1.00 24.30 C ATOM 168 C TRP A 18 -4.629 -13.520 -5.744 1.00 33.32 C ATOM 169 O TRP A 18 -4.826 -14.508 -5.036 1.00 12.41 O ATOM 170 CB TRP A 18 -4.554 -11.286 -4.595 1.00 24.11 C ATOM 171 CG TRP A 18 -4.293 -11.798 -3.204 1.00 14.44 C ATOM 172 CD1 TRP A 18 -3.271 -12.614 -2.804 1.00 30.23 C ATOM 173 CD2 TRP A 18 -5.058 -11.509 -2.030 1.00 42.42 C ATOM 174 NE1 TRP A 18 -3.364 -12.856 -1.460 1.00 73.44 N ATOM 175 CE2 TRP A 18 -4.451 -12.187 -0.959 1.00 12.10 C ATOM 176 CE3 TRP A 18 -6.198 -10.742 -1.783 1.00 4.30 C ATOM 177 CZ2 TRP A 18 -4.948 -12.124 0.337 1.00 4.30 C ATOM 178 CZ3 TRP A 18 -6.689 -10.680 -0.494 1.00 44.10 C ATOM 179 CH2 TRP A 18 -6.064 -11.365 0.548 1.00 62.15 C ATOM 0 HA TRP A 18 -5.519 -11.714 -6.439 1.00 24.30 H new ATOM 0 HB2 TRP A 18 -3.598 -11.083 -5.077 1.00 24.11 H new ATOM 0 HB3 TRP A 18 -5.083 -10.336 -4.523 1.00 24.11 H new ATOM 0 HD1 TRP A 18 -2.504 -13.009 -3.453 1.00 30.23 H new ATOM 0 HE1 TRP A 18 -2.727 -13.440 -0.918 1.00 73.44 H new ATOM 0 HE3 TRP A 18 -6.686 -10.208 -2.584 1.00 4.30 H new ATOM 0 HZ2 TRP A 18 -4.470 -12.655 1.147 1.00 4.30 H new ATOM 0 HZ3 TRP A 18 -7.571 -10.092 -0.289 1.00 44.10 H new ATOM 0 HH2 TRP A 18 -6.472 -11.294 1.545 1.00 62.15 H new ATOM 190 N GLN A 19 -3.813 -13.528 -6.739 1.00 34.54 N ATOM 191 CA GLN A 19 -3.153 -14.734 -7.113 1.00 21.32 C ATOM 192 C GLN A 19 -1.706 -14.658 -6.682 1.00 24.41 C ATOM 193 O GLN A 19 -0.913 -13.871 -7.219 1.00 62.33 O ATOM 194 CB GLN A 19 -3.357 -14.920 -8.643 1.00 61.11 C ATOM 195 CG GLN A 19 -2.812 -16.191 -9.316 1.00 23.10 C ATOM 196 CD GLN A 19 -1.312 -16.201 -9.539 1.00 21.05 C ATOM 197 OE1 GLN A 19 -0.547 -16.677 -8.716 1.00 51.45 O ATOM 198 NE2 GLN A 19 -0.890 -15.664 -10.655 1.00 1.24 N ATOM 0 H GLN A 19 -3.585 -12.714 -7.310 1.00 34.54 H new ATOM 0 HA GLN A 19 -3.564 -15.614 -6.619 1.00 21.32 H new ATOM 0 HB2 GLN A 19 -4.428 -14.876 -8.840 1.00 61.11 H new ATOM 0 HB3 GLN A 19 -2.905 -14.063 -9.142 1.00 61.11 H new ATOM 0 HG2 GLN A 19 -3.080 -17.052 -8.704 1.00 23.10 H new ATOM 0 HG3 GLN A 19 -3.309 -16.317 -10.278 1.00 23.10 H new ATOM 0 HE21 GLN A 19 -1.560 -15.276 -11.319 1.00 1.24 H new ATOM 0 HE22 GLN A 19 0.109 -15.634 -10.861 1.00 1.24 H new ATOM 207 N VAL A 20 -1.397 -15.426 -5.664 1.00 43.41 N ATOM 208 CA VAL A 20 -0.065 -15.533 -5.136 1.00 12.32 C ATOM 209 C VAL A 20 0.635 -16.735 -5.750 1.00 32.12 C ATOM 210 O VAL A 20 0.217 -17.888 -5.567 1.00 3.42 O ATOM 211 CB VAL A 20 -0.040 -15.559 -3.571 1.00 32.21 C ATOM 212 CG1 VAL A 20 -0.923 -16.660 -3.011 1.00 64.03 C ATOM 213 CG2 VAL A 20 1.385 -15.685 -3.050 1.00 34.14 C ATOM 0 H VAL A 20 -2.080 -16.003 -5.173 1.00 43.41 H new ATOM 0 HA VAL A 20 0.487 -14.636 -5.416 1.00 12.32 H new ATOM 0 HB VAL A 20 -0.446 -14.609 -3.224 1.00 32.21 H new ATOM 0 HG11 VAL A 20 -0.878 -16.644 -1.922 1.00 64.03 H new ATOM 0 HG12 VAL A 20 -1.952 -16.501 -3.334 1.00 64.03 H new ATOM 0 HG13 VAL A 20 -0.574 -17.627 -3.375 1.00 64.03 H new ATOM 0 HG21 VAL A 20 1.374 -15.701 -1.960 1.00 34.14 H new ATOM 0 HG22 VAL A 20 1.828 -16.609 -3.422 1.00 34.14 H new ATOM 0 HG23 VAL A 20 1.975 -14.836 -3.395 1.00 34.14 H new ATOM 223 N LEU A 21 1.680 -16.482 -6.467 1.00 64.52 N ATOM 224 CA LEU A 21 2.328 -17.523 -7.218 1.00 30.20 C ATOM 225 C LEU A 21 3.420 -18.219 -6.417 1.00 11.55 C ATOM 226 O LEU A 21 3.677 -19.408 -6.619 1.00 34.45 O ATOM 227 CB LEU A 21 2.810 -16.963 -8.579 1.00 32.44 C ATOM 228 CG LEU A 21 3.839 -15.819 -8.563 1.00 12.31 C ATOM 229 CD1 LEU A 21 5.240 -16.345 -8.368 1.00 15.04 C ATOM 230 CD2 LEU A 21 3.737 -14.982 -9.821 1.00 3.42 C ATOM 0 H LEU A 21 2.110 -15.561 -6.553 1.00 64.52 H new ATOM 0 HA LEU A 21 1.604 -18.310 -7.430 1.00 30.20 H new ATOM 0 HB2 LEU A 21 3.237 -17.789 -9.148 1.00 32.44 H new ATOM 0 HB3 LEU A 21 1.934 -16.617 -9.128 1.00 32.44 H new ATOM 0 HG LEU A 21 3.610 -15.176 -7.714 1.00 12.31 H new ATOM 0 HD11 LEU A 21 5.944 -15.512 -8.361 1.00 15.04 H new ATOM 0 HD12 LEU A 21 5.300 -16.878 -7.419 1.00 15.04 H new ATOM 0 HD13 LEU A 21 5.490 -17.025 -9.183 1.00 15.04 H new ATOM 0 HD21 LEU A 21 4.475 -14.180 -9.785 1.00 3.42 H new ATOM 0 HD22 LEU A 21 3.925 -15.610 -10.692 1.00 3.42 H new ATOM 0 HD23 LEU A 21 2.738 -14.553 -9.892 1.00 3.42 H new ATOM 242 N SER A 22 4.032 -17.491 -5.493 1.00 2.11 N ATOM 243 CA SER A 22 5.072 -18.045 -4.655 1.00 21.31 C ATOM 244 C SER A 22 5.470 -17.038 -3.598 1.00 13.23 C ATOM 245 O SER A 22 5.277 -15.828 -3.765 1.00 20.13 O ATOM 246 CB SER A 22 6.302 -18.445 -5.497 1.00 3.23 C ATOM 247 OG SER A 22 7.314 -19.072 -4.718 1.00 22.33 O ATOM 0 H SER A 22 3.820 -16.510 -5.309 1.00 2.11 H new ATOM 0 HA SER A 22 4.685 -18.941 -4.171 1.00 21.31 H new ATOM 0 HB2 SER A 22 5.989 -19.121 -6.293 1.00 3.23 H new ATOM 0 HB3 SER A 22 6.715 -17.557 -5.976 1.00 3.23 H new ATOM 0 HG SER A 22 8.071 -19.308 -5.294 1.00 22.33 H new ATOM 253 N THR A 23 5.984 -17.542 -2.514 1.00 42.22 N ATOM 254 CA THR A 23 6.489 -16.746 -1.426 1.00 73.43 C ATOM 255 C THR A 23 7.859 -17.281 -1.038 1.00 61.20 C ATOM 256 O THR A 23 8.165 -18.444 -1.329 1.00 61.04 O ATOM 257 CB THR A 23 5.544 -16.789 -0.193 1.00 32.23 C ATOM 258 OG1 THR A 23 5.300 -18.151 0.209 1.00 54.13 O ATOM 259 CG2 THR A 23 4.221 -16.105 -0.481 1.00 71.51 C ATOM 0 H THR A 23 6.067 -18.546 -2.355 1.00 42.22 H new ATOM 0 HA THR A 23 6.554 -15.708 -1.752 1.00 73.43 H new ATOM 0 HB THR A 23 6.042 -16.253 0.615 1.00 32.23 H new ATOM 0 HG1 THR A 23 4.705 -18.161 0.987 1.00 54.13 H new ATOM 0 HG21 THR A 23 3.586 -16.154 0.403 1.00 71.51 H new ATOM 0 HG22 THR A 23 4.400 -15.062 -0.741 1.00 71.51 H new ATOM 0 HG23 THR A 23 3.725 -16.607 -1.312 1.00 71.51 H new ATOM 267 N GLY A 24 8.681 -16.474 -0.420 1.00 21.11 N ATOM 268 CA GLY A 24 9.968 -16.959 -0.001 1.00 63.23 C ATOM 269 C GLY A 24 11.030 -15.906 -0.037 1.00 34.04 C ATOM 270 O GLY A 24 10.736 -14.710 -0.014 1.00 51.43 O ATOM 0 H GLY A 24 8.488 -15.497 -0.199 1.00 21.11 H new ATOM 0 HA2 GLY A 24 9.889 -17.353 1.012 1.00 63.23 H new ATOM 0 HA3 GLY A 24 10.264 -17.788 -0.643 1.00 63.23 H new ATOM 274 N GLY A 25 12.260 -16.339 -0.094 1.00 60.32 N ATOM 275 CA GLY A 25 13.359 -15.429 -0.143 1.00 34.14 C ATOM 276 C GLY A 25 14.269 -15.604 1.039 1.00 60.42 C ATOM 277 O GLY A 25 14.817 -16.688 1.256 1.00 12.21 O ATOM 0 H GLY A 25 12.522 -17.325 -0.107 1.00 60.32 H new ATOM 0 HA2 GLY A 25 13.922 -15.585 -1.063 1.00 34.14 H new ATOM 0 HA3 GLY A 25 12.985 -14.405 -0.168 1.00 34.14 H new ATOM 281 N LYS A 26 14.418 -14.567 1.809 1.00 21.23 N ATOM 282 CA LYS A 26 15.277 -14.588 2.975 1.00 74.24 C ATOM 283 C LYS A 26 14.462 -14.384 4.222 1.00 34.34 C ATOM 284 O LYS A 26 13.270 -14.123 4.153 1.00 72.24 O ATOM 285 CB LYS A 26 16.284 -13.448 2.918 1.00 52.11 C ATOM 286 CG LYS A 26 17.202 -13.442 1.724 1.00 72.43 C ATOM 287 CD LYS A 26 18.149 -12.249 1.779 1.00 40.44 C ATOM 288 CE LYS A 26 19.009 -12.262 3.044 1.00 42.33 C ATOM 289 NZ LYS A 26 19.908 -11.098 3.117 1.00 52.11 N ATOM 0 H LYS A 26 13.949 -13.675 1.653 1.00 21.23 H new ATOM 0 HA LYS A 26 15.785 -15.552 2.989 1.00 74.24 H new ATOM 0 HB2 LYS A 26 15.738 -12.505 2.937 1.00 52.11 H new ATOM 0 HB3 LYS A 26 16.894 -13.482 3.821 1.00 52.11 H new ATOM 0 HG2 LYS A 26 17.777 -14.368 1.696 1.00 72.43 H new ATOM 0 HG3 LYS A 26 16.614 -13.404 0.807 1.00 72.43 H new ATOM 0 HD2 LYS A 26 18.795 -12.257 0.901 1.00 40.44 H new ATOM 0 HD3 LYS A 26 17.572 -11.325 1.742 1.00 40.44 H new ATOM 0 HE2 LYS A 26 18.362 -12.275 3.921 1.00 42.33 H new ATOM 0 HE3 LYS A 26 19.600 -13.178 3.070 1.00 42.33 H new ATOM 0 HZ1 LYS A 26 20.471 -11.148 3.990 1.00 52.11 H new ATOM 0 HZ2 LYS A 26 20.544 -11.098 2.294 1.00 52.11 H new ATOM 0 HZ3 LYS A 26 19.345 -10.224 3.119 1.00 52.11 H new ATOM 303 N GLU A 27 15.081 -14.555 5.353 1.00 54.32 N ATOM 304 CA GLU A 27 14.484 -14.117 6.576 1.00 14.13 C ATOM 305 C GLU A 27 14.844 -12.645 6.722 1.00 71.44 C ATOM 306 O GLU A 27 15.828 -12.194 6.099 1.00 65.44 O ATOM 307 CB GLU A 27 14.945 -14.944 7.762 1.00 11.44 C ATOM 308 CG GLU A 27 14.530 -16.396 7.662 1.00 4.13 C ATOM 309 CD GLU A 27 14.920 -17.189 8.868 1.00 51.21 C ATOM 310 OE1 GLU A 27 14.151 -17.212 9.850 1.00 70.20 O ATOM 311 OE2 GLU A 27 16.005 -17.814 8.856 1.00 72.13 O ATOM 0 H GLU A 27 15.997 -14.994 5.452 1.00 54.32 H new ATOM 0 HA GLU A 27 13.402 -14.248 6.551 1.00 14.13 H new ATOM 0 HB2 GLU A 27 16.031 -14.886 7.840 1.00 11.44 H new ATOM 0 HB3 GLU A 27 14.537 -14.517 8.678 1.00 11.44 H new ATOM 0 HG2 GLU A 27 13.450 -16.453 7.528 1.00 4.13 H new ATOM 0 HG3 GLU A 27 14.985 -16.840 6.777 1.00 4.13 H new ATOM 318 N ASP A 28 14.060 -11.894 7.486 1.00 33.02 N ATOM 319 CA ASP A 28 14.179 -10.411 7.581 1.00 45.45 C ATOM 320 C ASP A 28 13.547 -9.746 6.367 1.00 33.25 C ATOM 321 O ASP A 28 12.809 -8.788 6.496 1.00 12.24 O ATOM 322 CB ASP A 28 15.615 -9.899 7.841 1.00 23.32 C ATOM 323 CG ASP A 28 15.743 -8.398 7.667 1.00 32.21 C ATOM 324 OD1 ASP A 28 15.246 -7.625 8.521 1.00 73.42 O ATOM 325 OD2 ASP A 28 16.361 -7.961 6.670 1.00 41.31 O ATOM 0 H ASP A 28 13.315 -12.280 8.066 1.00 33.02 H new ATOM 0 HA ASP A 28 13.622 -10.120 8.472 1.00 45.45 H new ATOM 0 HB2 ASP A 28 15.915 -10.170 8.853 1.00 23.32 H new ATOM 0 HB3 ASP A 28 16.303 -10.399 7.160 1.00 23.32 H new ATOM 330 N VAL A 29 13.836 -10.261 5.196 1.00 62.11 N ATOM 331 CA VAL A 29 13.151 -9.827 4.016 1.00 2.20 C ATOM 332 C VAL A 29 12.593 -11.059 3.289 1.00 4.03 C ATOM 333 O VAL A 29 13.327 -11.851 2.695 1.00 45.24 O ATOM 334 CB VAL A 29 14.068 -8.947 3.083 1.00 33.53 C ATOM 335 CG1 VAL A 29 15.350 -9.670 2.674 1.00 62.33 C ATOM 336 CG2 VAL A 29 13.305 -8.457 1.857 1.00 42.24 C ATOM 0 H VAL A 29 14.542 -10.981 5.041 1.00 62.11 H new ATOM 0 HA VAL A 29 12.324 -9.177 4.302 1.00 2.20 H new ATOM 0 HB VAL A 29 14.365 -8.078 3.670 1.00 33.53 H new ATOM 0 HG11 VAL A 29 15.945 -9.020 2.032 1.00 62.33 H new ATOM 0 HG12 VAL A 29 15.924 -9.925 3.565 1.00 62.33 H new ATOM 0 HG13 VAL A 29 15.097 -10.581 2.132 1.00 62.33 H new ATOM 0 HG21 VAL A 29 13.966 -7.853 1.235 1.00 42.24 H new ATOM 0 HG22 VAL A 29 12.949 -9.313 1.284 1.00 42.24 H new ATOM 0 HG23 VAL A 29 12.455 -7.854 2.175 1.00 42.24 H new ATOM 346 N SER A 30 11.302 -11.195 3.334 1.00 72.43 N ATOM 347 CA SER A 30 10.624 -12.327 2.750 1.00 21.10 C ATOM 348 C SER A 30 9.603 -11.797 1.785 1.00 63.54 C ATOM 349 O SER A 30 8.876 -10.877 2.127 1.00 71.14 O ATOM 350 CB SER A 30 9.925 -13.114 3.861 1.00 60.34 C ATOM 351 OG SER A 30 10.842 -13.481 4.900 1.00 43.02 O ATOM 0 H SER A 30 10.679 -10.521 3.779 1.00 72.43 H new ATOM 0 HA SER A 30 11.326 -12.983 2.236 1.00 21.10 H new ATOM 0 HB2 SER A 30 9.118 -12.514 4.281 1.00 60.34 H new ATOM 0 HB3 SER A 30 9.470 -14.011 3.442 1.00 60.34 H new ATOM 0 HG SER A 30 11.761 -13.345 4.588 1.00 43.02 H new ATOM 357 N TYR A 31 9.527 -12.350 0.613 1.00 75.13 N ATOM 358 CA TYR A 31 8.649 -11.797 -0.372 1.00 51.34 C ATOM 359 C TYR A 31 7.498 -12.704 -0.723 1.00 13.23 C ATOM 360 O TYR A 31 7.529 -13.916 -0.483 1.00 25.30 O ATOM 361 CB TYR A 31 9.396 -11.339 -1.653 1.00 63.41 C ATOM 362 CG TYR A 31 10.133 -12.422 -2.450 1.00 33.52 C ATOM 363 CD1 TYR A 31 9.451 -13.506 -2.989 1.00 22.44 C ATOM 364 CD2 TYR A 31 11.503 -12.335 -2.684 1.00 32.30 C ATOM 365 CE1 TYR A 31 10.093 -14.468 -3.720 1.00 22.20 C ATOM 366 CE2 TYR A 31 12.163 -13.305 -3.434 1.00 65.24 C ATOM 367 CZ TYR A 31 11.444 -14.370 -3.947 1.00 22.41 C ATOM 368 OH TYR A 31 12.082 -15.338 -4.703 1.00 24.42 O ATOM 0 H TYR A 31 10.054 -13.172 0.318 1.00 75.13 H new ATOM 0 HA TYR A 31 8.226 -10.911 0.101 1.00 51.34 H new ATOM 0 HB2 TYR A 31 8.673 -10.863 -2.315 1.00 63.41 H new ATOM 0 HB3 TYR A 31 10.120 -10.575 -1.369 1.00 63.41 H new ATOM 0 HD1 TYR A 31 8.387 -13.591 -2.827 1.00 22.44 H new ATOM 0 HD2 TYR A 31 12.061 -11.504 -2.278 1.00 32.30 H new ATOM 0 HE1 TYR A 31 9.538 -15.304 -4.118 1.00 22.20 H new ATOM 0 HE2 TYR A 31 13.225 -13.227 -3.613 1.00 65.24 H new ATOM 0 HH TYR A 31 13.036 -15.123 -4.772 1.00 24.42 H new ATOM 378 N GLU A 32 6.518 -12.102 -1.302 1.00 20.51 N ATOM 379 CA GLU A 32 5.354 -12.742 -1.802 1.00 30.30 C ATOM 380 C GLU A 32 5.124 -12.190 -3.190 1.00 62.33 C ATOM 381 O GLU A 32 5.067 -10.963 -3.371 1.00 45.23 O ATOM 382 CB GLU A 32 4.166 -12.392 -0.888 1.00 21.10 C ATOM 383 CG GLU A 32 2.809 -12.877 -1.372 1.00 42.52 C ATOM 384 CD GLU A 32 1.688 -12.481 -0.439 1.00 0.51 C ATOM 385 OE1 GLU A 32 1.260 -11.314 -0.468 1.00 14.13 O ATOM 386 OE2 GLU A 32 1.221 -13.328 0.350 1.00 64.04 O ATOM 0 H GLU A 32 6.508 -11.092 -1.447 1.00 20.51 H new ATOM 0 HA GLU A 32 5.462 -13.826 -1.831 1.00 30.30 H new ATOM 0 HB2 GLU A 32 4.353 -12.813 0.100 1.00 21.10 H new ATOM 0 HB3 GLU A 32 4.126 -11.309 -0.771 1.00 21.10 H new ATOM 0 HG2 GLU A 32 2.613 -12.469 -2.364 1.00 42.52 H new ATOM 0 HG3 GLU A 32 2.829 -13.962 -1.472 1.00 42.52 H new ATOM 393 N GLU A 33 5.030 -13.065 -4.167 1.00 25.51 N ATOM 394 CA GLU A 33 4.814 -12.657 -5.515 1.00 75.20 C ATOM 395 C GLU A 33 3.339 -12.833 -5.799 1.00 4.42 C ATOM 396 O GLU A 33 2.828 -13.962 -5.805 1.00 53.33 O ATOM 397 CB GLU A 33 5.661 -13.534 -6.453 1.00 45.01 C ATOM 398 CG GLU A 33 7.168 -13.506 -6.156 1.00 24.01 C ATOM 399 CD GLU A 33 7.982 -14.412 -7.063 1.00 24.41 C ATOM 400 OE1 GLU A 33 8.202 -14.054 -8.241 1.00 21.52 O ATOM 401 OE2 GLU A 33 8.419 -15.502 -6.608 1.00 11.14 O ATOM 0 H GLU A 33 5.103 -14.074 -4.038 1.00 25.51 H new ATOM 0 HA GLU A 33 5.105 -11.619 -5.674 1.00 75.20 H new ATOM 0 HB2 GLU A 33 5.308 -14.563 -6.386 1.00 45.01 H new ATOM 0 HB3 GLU A 33 5.499 -13.208 -7.480 1.00 45.01 H new ATOM 0 HG2 GLU A 33 7.531 -12.483 -6.257 1.00 24.01 H new ATOM 0 HG3 GLU A 33 7.331 -13.801 -5.120 1.00 24.01 H new ATOM 408 N ARG A 34 2.654 -11.741 -6.020 1.00 75.53 N ATOM 409 CA ARG A 34 1.220 -11.772 -6.184 1.00 41.42 C ATOM 410 C ARG A 34 0.742 -10.814 -7.247 1.00 25.42 C ATOM 411 O ARG A 34 1.295 -9.724 -7.419 1.00 12.43 O ATOM 412 CB ARG A 34 0.507 -11.441 -4.854 1.00 13.12 C ATOM 413 CG ARG A 34 1.021 -10.172 -4.171 1.00 60.34 C ATOM 414 CD ARG A 34 0.125 -9.732 -3.020 1.00 63.43 C ATOM 415 NE ARG A 34 -1.162 -9.193 -3.506 1.00 4.03 N ATOM 416 CZ ARG A 34 -2.210 -8.857 -2.723 1.00 4.12 C ATOM 417 NH1 ARG A 34 -2.212 -9.165 -1.433 1.00 71.31 N ATOM 418 NH2 ARG A 34 -3.262 -8.240 -3.252 1.00 63.14 N ATOM 0 H ARG A 34 3.068 -10.812 -6.091 1.00 75.53 H new ATOM 0 HA ARG A 34 0.970 -12.785 -6.498 1.00 41.42 H new ATOM 0 HB2 ARG A 34 -0.561 -11.332 -5.043 1.00 13.12 H new ATOM 0 HB3 ARG A 34 0.625 -12.282 -4.171 1.00 13.12 H new ATOM 0 HG2 ARG A 34 2.030 -10.346 -3.797 1.00 60.34 H new ATOM 0 HG3 ARG A 34 1.087 -9.369 -4.905 1.00 60.34 H new ATOM 0 HD2 ARG A 34 -0.061 -10.579 -2.359 1.00 63.43 H new ATOM 0 HD3 ARG A 34 0.638 -8.973 -2.429 1.00 63.43 H new ATOM 0 HE ARG A 34 -1.267 -9.064 -4.512 1.00 4.03 H new ATOM 0 HH11 ARG A 34 -1.418 -9.659 -1.025 1.00 71.31 H new ATOM 0 HH12 ARG A 34 -3.007 -8.908 -0.848 1.00 71.31 H new ATOM 0 HH21 ARG A 34 -3.277 -8.021 -4.248 1.00 63.14 H new ATOM 0 HH22 ARG A 34 -4.054 -7.986 -2.662 1.00 63.14 H new ATOM 432 N ALA A 35 -0.270 -11.226 -7.950 1.00 45.22 N ATOM 433 CA ALA A 35 -0.946 -10.380 -8.882 1.00 13.54 C ATOM 434 C ALA A 35 -2.074 -9.725 -8.119 1.00 72.34 C ATOM 435 O ALA A 35 -2.746 -10.396 -7.316 1.00 42.44 O ATOM 436 CB ALA A 35 -1.481 -11.188 -10.054 1.00 32.42 C ATOM 0 H ALA A 35 -0.652 -12.170 -7.891 1.00 45.22 H new ATOM 0 HA ALA A 35 -0.270 -9.634 -9.300 1.00 13.54 H new ATOM 0 HB1 ALA A 35 -1.992 -10.524 -10.751 1.00 32.42 H new ATOM 0 HB2 ALA A 35 -0.653 -11.682 -10.564 1.00 32.42 H new ATOM 0 HB3 ALA A 35 -2.182 -11.939 -9.689 1.00 32.42 H new ATOM 442 N CYS A 36 -2.262 -8.444 -8.315 1.00 22.41 N ATOM 443 CA CYS A 36 -3.266 -7.709 -7.576 1.00 72.24 C ATOM 444 C CYS A 36 -4.685 -8.181 -7.863 1.00 1.33 C ATOM 445 O CYS A 36 -4.979 -8.739 -8.924 1.00 14.44 O ATOM 446 CB CYS A 36 -3.120 -6.213 -7.800 1.00 53.53 C ATOM 447 SG CYS A 36 -1.568 -5.548 -7.170 1.00 45.02 S ATOM 0 H CYS A 36 -1.732 -7.884 -8.982 1.00 22.41 H new ATOM 0 HA CYS A 36 -3.089 -7.917 -6.521 1.00 72.24 H new ATOM 0 HB2 CYS A 36 -3.191 -6.004 -8.867 1.00 53.53 H new ATOM 0 HB3 CYS A 36 -3.951 -5.697 -7.318 1.00 53.53 H new ATOM 0 HG CYS A 36 -1.681 -4.263 -7.007 1.00 45.02 H new ATOM 453 N GLU A 37 -5.541 -7.971 -6.908 1.00 1.11 N ATOM 454 CA GLU A 37 -6.908 -8.347 -6.997 1.00 72.45 C ATOM 455 C GLU A 37 -7.672 -7.405 -7.901 1.00 33.12 C ATOM 456 O GLU A 37 -8.571 -7.813 -8.634 1.00 31.11 O ATOM 457 CB GLU A 37 -7.576 -8.488 -5.600 1.00 10.14 C ATOM 458 CG GLU A 37 -7.448 -7.288 -4.634 1.00 51.32 C ATOM 459 CD GLU A 37 -6.057 -7.131 -4.022 1.00 72.02 C ATOM 460 OE1 GLU A 37 -5.143 -6.654 -4.719 1.00 33.23 O ATOM 461 OE2 GLU A 37 -5.862 -7.519 -2.843 1.00 12.14 O ATOM 0 H GLU A 37 -5.295 -7.522 -6.026 1.00 1.11 H new ATOM 0 HA GLU A 37 -6.942 -9.338 -7.449 1.00 72.45 H new ATOM 0 HB2 GLU A 37 -8.637 -8.689 -5.751 1.00 10.14 H new ATOM 0 HB3 GLU A 37 -7.152 -9.364 -5.109 1.00 10.14 H new ATOM 0 HG2 GLU A 37 -7.704 -6.374 -5.170 1.00 51.32 H new ATOM 0 HG3 GLU A 37 -8.177 -7.401 -3.831 1.00 51.32 H new ATOM 468 N GLY A 38 -7.303 -6.158 -7.880 1.00 74.21 N ATOM 469 CA GLY A 38 -7.985 -5.229 -8.734 1.00 25.34 C ATOM 470 C GLY A 38 -9.141 -4.577 -8.046 1.00 62.00 C ATOM 471 O GLY A 38 -9.968 -3.919 -8.692 1.00 32.45 O ATOM 0 H GLY A 38 -6.559 -5.769 -7.302 1.00 74.21 H new ATOM 0 HA2 GLY A 38 -7.285 -4.464 -9.069 1.00 25.34 H new ATOM 0 HA3 GLY A 38 -8.340 -5.749 -9.624 1.00 25.34 H new ATOM 475 N GLY A 39 -9.221 -4.766 -6.744 1.00 21.11 N ATOM 476 CA GLY A 39 -10.329 -4.258 -5.999 1.00 21.13 C ATOM 477 C GLY A 39 -10.279 -2.764 -5.912 1.00 14.22 C ATOM 478 O GLY A 39 -9.244 -2.149 -6.198 1.00 22.03 O ATOM 0 H GLY A 39 -8.527 -5.269 -6.191 1.00 21.11 H new ATOM 0 HA2 GLY A 39 -11.261 -4.567 -6.471 1.00 21.13 H new ATOM 0 HA3 GLY A 39 -10.323 -4.684 -4.996 1.00 21.13 H new ATOM 482 N LYS A 40 -11.369 -2.178 -5.548 1.00 52.52 N ATOM 483 CA LYS A 40 -11.442 -0.759 -5.473 1.00 23.35 C ATOM 484 C LYS A 40 -11.007 -0.318 -4.096 1.00 72.15 C ATOM 485 O LYS A 40 -11.450 -0.868 -3.092 1.00 65.24 O ATOM 486 CB LYS A 40 -12.851 -0.285 -5.855 1.00 72.34 C ATOM 487 CG LYS A 40 -13.973 -0.758 -4.934 1.00 24.44 C ATOM 488 CD LYS A 40 -15.368 -0.516 -5.529 1.00 54.13 C ATOM 489 CE LYS A 40 -15.761 -1.534 -6.632 1.00 74.21 C ATOM 490 NZ LYS A 40 -14.859 -1.550 -7.808 1.00 11.23 N ATOM 0 H LYS A 40 -12.229 -2.665 -5.296 1.00 52.52 H new ATOM 0 HA LYS A 40 -10.764 -0.294 -6.189 1.00 23.35 H new ATOM 0 HB2 LYS A 40 -12.856 0.805 -5.876 1.00 72.34 H new ATOM 0 HB3 LYS A 40 -13.068 -0.624 -6.868 1.00 72.34 H new ATOM 0 HG2 LYS A 40 -13.848 -1.822 -4.732 1.00 24.44 H new ATOM 0 HG3 LYS A 40 -13.895 -0.241 -3.978 1.00 24.44 H new ATOM 0 HD2 LYS A 40 -16.107 -0.558 -4.729 1.00 54.13 H new ATOM 0 HD3 LYS A 40 -15.406 0.490 -5.946 1.00 54.13 H new ATOM 0 HE2 LYS A 40 -15.784 -2.532 -6.195 1.00 74.21 H new ATOM 0 HE3 LYS A 40 -16.773 -1.311 -6.970 1.00 74.21 H new ATOM 0 HZ1 LYS A 40 -15.312 -2.070 -8.586 1.00 11.23 H new ATOM 0 HZ2 LYS A 40 -14.666 -0.574 -8.111 1.00 11.23 H new ATOM 0 HZ3 LYS A 40 -13.965 -2.017 -7.554 1.00 11.23 H new ATOM 504 N PHE A 41 -10.105 0.621 -4.065 1.00 32.21 N ATOM 505 CA PHE A 41 -9.480 1.083 -2.850 1.00 50.25 C ATOM 506 C PHE A 41 -9.608 2.579 -2.741 1.00 52.33 C ATOM 507 O PHE A 41 -9.915 3.242 -3.720 1.00 72.31 O ATOM 508 CB PHE A 41 -7.993 0.696 -2.851 1.00 31.42 C ATOM 509 CG PHE A 41 -7.753 -0.773 -3.025 1.00 54.23 C ATOM 510 CD1 PHE A 41 -8.311 -1.662 -2.151 1.00 2.23 C ATOM 511 CD2 PHE A 41 -6.965 -1.262 -4.061 1.00 14.33 C ATOM 512 CE1 PHE A 41 -8.112 -3.004 -2.283 1.00 20.21 C ATOM 513 CE2 PHE A 41 -6.757 -2.617 -4.203 1.00 32.11 C ATOM 514 CZ PHE A 41 -7.334 -3.493 -3.309 1.00 31.12 C ATOM 0 H PHE A 41 -9.773 1.101 -4.902 1.00 32.21 H new ATOM 0 HA PHE A 41 -9.976 0.617 -1.999 1.00 50.25 H new ATOM 0 HB2 PHE A 41 -7.487 1.235 -3.652 1.00 31.42 H new ATOM 0 HB3 PHE A 41 -7.542 1.020 -1.913 1.00 31.42 H new ATOM 0 HD1 PHE A 41 -8.922 -1.295 -1.340 1.00 2.23 H new ATOM 0 HD2 PHE A 41 -6.512 -0.574 -4.760 1.00 14.33 H new ATOM 0 HE1 PHE A 41 -8.566 -3.687 -1.580 1.00 20.21 H new ATOM 0 HE2 PHE A 41 -6.145 -2.990 -5.011 1.00 32.11 H new ATOM 0 HZ PHE A 41 -7.177 -4.557 -3.412 1.00 31.12 H new ATOM 524 N ALA A 42 -9.359 3.113 -1.578 1.00 75.03 N ATOM 525 CA ALA A 42 -9.448 4.542 -1.395 1.00 43.23 C ATOM 526 C ALA A 42 -8.070 5.097 -1.489 1.00 61.41 C ATOM 527 O ALA A 42 -7.209 4.773 -0.694 1.00 51.54 O ATOM 528 CB ALA A 42 -10.056 4.883 -0.038 1.00 34.51 C ATOM 0 H ALA A 42 -9.094 2.588 -0.745 1.00 75.03 H new ATOM 0 HA ALA A 42 -10.093 4.973 -2.161 1.00 43.23 H new ATOM 0 HB1 ALA A 42 -10.112 5.966 0.074 1.00 34.51 H new ATOM 0 HB2 ALA A 42 -11.058 4.459 0.028 1.00 34.51 H new ATOM 0 HB3 ALA A 42 -9.433 4.468 0.754 1.00 34.51 H new ATOM 534 N THR A 43 -7.853 5.904 -2.469 1.00 42.44 N ATOM 535 CA THR A 43 -6.559 6.412 -2.719 1.00 72.22 C ATOM 536 C THR A 43 -6.565 7.914 -2.926 1.00 24.53 C ATOM 537 O THR A 43 -7.524 8.493 -3.467 1.00 21.44 O ATOM 538 CB THR A 43 -5.876 5.667 -3.912 1.00 52.23 C ATOM 539 OG1 THR A 43 -4.586 6.224 -4.214 1.00 52.15 O ATOM 540 CG2 THR A 43 -6.746 5.686 -5.138 1.00 10.41 C ATOM 0 H THR A 43 -8.571 6.228 -3.117 1.00 42.44 H new ATOM 0 HA THR A 43 -5.962 6.221 -1.827 1.00 72.22 H new ATOM 0 HB THR A 43 -5.737 4.631 -3.602 1.00 52.23 H new ATOM 0 HG1 THR A 43 -4.095 6.383 -3.381 1.00 52.15 H new ATOM 0 HG21 THR A 43 -6.243 5.160 -5.949 1.00 10.41 H new ATOM 0 HG22 THR A 43 -7.694 5.194 -4.919 1.00 10.41 H new ATOM 0 HG23 THR A 43 -6.933 6.718 -5.435 1.00 10.41 H new ATOM 548 N VAL A 44 -5.503 8.524 -2.502 1.00 54.24 N ATOM 549 CA VAL A 44 -5.301 9.930 -2.605 1.00 72.44 C ATOM 550 C VAL A 44 -3.898 10.148 -3.141 1.00 2.05 C ATOM 551 O VAL A 44 -2.964 9.437 -2.749 1.00 21.12 O ATOM 552 CB VAL A 44 -5.482 10.654 -1.224 1.00 3.54 C ATOM 553 CG1 VAL A 44 -4.580 10.094 -0.174 1.00 73.25 C ATOM 554 CG2 VAL A 44 -5.290 12.144 -1.368 1.00 55.50 C ATOM 0 H VAL A 44 -4.725 8.035 -2.058 1.00 54.24 H new ATOM 0 HA VAL A 44 -6.047 10.358 -3.275 1.00 72.44 H new ATOM 0 HB VAL A 44 -6.505 10.471 -0.895 1.00 3.54 H new ATOM 0 HG11 VAL A 44 -4.740 10.625 0.764 1.00 73.25 H new ATOM 0 HG12 VAL A 44 -4.799 9.035 -0.033 1.00 73.25 H new ATOM 0 HG13 VAL A 44 -3.542 10.212 -0.485 1.00 73.25 H new ATOM 0 HG21 VAL A 44 -5.420 12.623 -0.398 1.00 55.50 H new ATOM 0 HG22 VAL A 44 -4.286 12.347 -1.741 1.00 55.50 H new ATOM 0 HG23 VAL A 44 -6.025 12.539 -2.070 1.00 55.50 H new ATOM 564 N GLU A 45 -3.741 11.069 -4.038 1.00 13.40 N ATOM 565 CA GLU A 45 -2.454 11.314 -4.598 1.00 62.32 C ATOM 566 C GLU A 45 -2.076 12.775 -4.482 1.00 12.50 C ATOM 567 O GLU A 45 -2.922 13.664 -4.629 1.00 34.53 O ATOM 568 CB GLU A 45 -2.383 10.802 -6.038 1.00 32.24 C ATOM 569 CG GLU A 45 -3.366 11.439 -7.003 1.00 54.23 C ATOM 570 CD GLU A 45 -3.271 10.826 -8.371 1.00 13.23 C ATOM 571 OE1 GLU A 45 -2.189 10.894 -8.985 1.00 14.34 O ATOM 572 OE2 GLU A 45 -4.258 10.225 -8.841 1.00 55.50 O ATOM 0 H GLU A 45 -4.489 11.663 -4.397 1.00 13.40 H new ATOM 0 HA GLU A 45 -1.715 10.756 -4.024 1.00 62.32 H new ATOM 0 HB2 GLU A 45 -1.373 10.964 -6.414 1.00 32.24 H new ATOM 0 HB3 GLU A 45 -2.552 9.725 -6.032 1.00 32.24 H new ATOM 0 HG2 GLU A 45 -4.380 11.322 -6.621 1.00 54.23 H new ATOM 0 HG3 GLU A 45 -3.171 12.509 -7.069 1.00 54.23 H new ATOM 579 N VAL A 46 -0.829 13.009 -4.153 1.00 4.33 N ATOM 580 CA VAL A 46 -0.285 14.347 -4.016 1.00 54.00 C ATOM 581 C VAL A 46 0.975 14.419 -4.881 1.00 55.11 C ATOM 582 O VAL A 46 1.745 13.443 -4.942 1.00 62.32 O ATOM 583 CB VAL A 46 0.070 14.668 -2.521 1.00 44.10 C ATOM 584 CG1 VAL A 46 0.586 16.090 -2.356 1.00 31.40 C ATOM 585 CG2 VAL A 46 -1.126 14.431 -1.604 1.00 62.32 C ATOM 0 H VAL A 46 -0.151 12.269 -3.970 1.00 4.33 H new ATOM 0 HA VAL A 46 -1.024 15.081 -4.336 1.00 54.00 H new ATOM 0 HB VAL A 46 0.868 13.984 -2.232 1.00 44.10 H new ATOM 0 HG11 VAL A 46 0.820 16.273 -1.307 1.00 31.40 H new ATOM 0 HG12 VAL A 46 1.485 16.223 -2.957 1.00 31.40 H new ATOM 0 HG13 VAL A 46 -0.178 16.795 -2.685 1.00 31.40 H new ATOM 0 HG21 VAL A 46 -0.848 14.662 -0.576 1.00 62.32 H new ATOM 0 HG22 VAL A 46 -1.952 15.073 -1.910 1.00 62.32 H new ATOM 0 HG23 VAL A 46 -1.434 13.388 -1.670 1.00 62.32 H new ATOM 595 N THR A 47 1.181 15.529 -5.559 1.00 64.34 N ATOM 596 CA THR A 47 2.303 15.654 -6.468 1.00 53.11 C ATOM 597 C THR A 47 3.179 16.867 -6.170 1.00 71.11 C ATOM 598 O THR A 47 2.777 17.772 -5.422 1.00 4.11 O ATOM 599 CB THR A 47 1.822 15.712 -7.932 1.00 72.13 C ATOM 600 OG1 THR A 47 0.757 16.678 -8.056 1.00 52.01 O ATOM 601 CG2 THR A 47 1.346 14.352 -8.413 1.00 30.23 C ATOM 0 H THR A 47 0.588 16.357 -5.499 1.00 64.34 H new ATOM 0 HA THR A 47 2.913 14.764 -6.317 1.00 53.11 H new ATOM 0 HB THR A 47 2.664 16.012 -8.555 1.00 72.13 H new ATOM 0 HG1 THR A 47 0.455 16.714 -8.988 1.00 52.01 H new ATOM 0 HG21 THR A 47 1.014 14.428 -9.448 1.00 30.23 H new ATOM 0 HG22 THR A 47 2.165 13.635 -8.346 1.00 30.23 H new ATOM 0 HG23 THR A 47 0.517 14.015 -7.790 1.00 30.23 H new ATOM 609 N ASP A 48 4.403 16.839 -6.736 1.00 20.04 N ATOM 610 CA ASP A 48 5.405 17.928 -6.655 1.00 2.33 C ATOM 611 C ASP A 48 5.963 18.109 -5.266 1.00 52.31 C ATOM 612 O ASP A 48 6.737 19.037 -5.003 1.00 51.04 O ATOM 613 CB ASP A 48 4.876 19.274 -7.201 1.00 5.34 C ATOM 614 CG ASP A 48 4.591 19.259 -8.683 1.00 64.42 C ATOM 615 OD1 ASP A 48 5.546 19.328 -9.484 1.00 50.22 O ATOM 616 OD2 ASP A 48 3.413 19.229 -9.077 1.00 74.44 O ATOM 0 H ASP A 48 4.733 16.039 -7.276 1.00 20.04 H new ATOM 0 HA ASP A 48 6.221 17.606 -7.301 1.00 2.33 H new ATOM 0 HB2 ASP A 48 3.963 19.539 -6.667 1.00 5.34 H new ATOM 0 HB3 ASP A 48 5.607 20.054 -6.989 1.00 5.34 H new ATOM 621 N LYS A 49 5.599 17.236 -4.377 1.00 12.33 N ATOM 622 CA LYS A 49 6.043 17.330 -3.023 1.00 10.22 C ATOM 623 C LYS A 49 6.713 16.051 -2.602 1.00 75.20 C ATOM 624 O LYS A 49 6.373 14.978 -3.111 1.00 61.14 O ATOM 625 CB LYS A 49 4.877 17.631 -2.086 1.00 15.02 C ATOM 626 CG LYS A 49 4.107 18.871 -2.449 1.00 0.24 C ATOM 627 CD LYS A 49 3.103 19.218 -1.386 1.00 4.12 C ATOM 628 CE LYS A 49 2.276 20.401 -1.808 1.00 23.45 C ATOM 629 NZ LYS A 49 1.415 20.882 -0.723 1.00 12.21 N ATOM 0 H LYS A 49 4.988 16.442 -4.570 1.00 12.33 H new ATOM 0 HA LYS A 49 6.760 18.149 -2.961 1.00 10.22 H new ATOM 0 HB2 LYS A 49 4.196 16.780 -2.084 1.00 15.02 H new ATOM 0 HB3 LYS A 49 5.258 17.736 -1.070 1.00 15.02 H new ATOM 0 HG2 LYS A 49 4.797 19.703 -2.587 1.00 0.24 H new ATOM 0 HG3 LYS A 49 3.596 18.720 -3.400 1.00 0.24 H new ATOM 0 HD2 LYS A 49 2.455 18.363 -1.197 1.00 4.12 H new ATOM 0 HD3 LYS A 49 3.617 19.441 -0.451 1.00 4.12 H new ATOM 0 HE2 LYS A 49 2.934 21.207 -2.133 1.00 23.45 H new ATOM 0 HE3 LYS A 49 1.661 20.127 -2.665 1.00 23.45 H new ATOM 0 HZ1 LYS A 49 0.465 21.081 -1.096 1.00 12.21 H new ATOM 0 HZ2 LYS A 49 1.351 20.155 0.018 1.00 12.21 H new ATOM 0 HZ3 LYS A 49 1.818 21.752 -0.320 1.00 12.21 H new ATOM 643 N PRO A 50 7.721 16.146 -1.722 1.00 63.22 N ATOM 644 CA PRO A 50 8.367 14.975 -1.132 1.00 64.32 C ATOM 645 C PRO A 50 7.351 14.117 -0.374 1.00 51.42 C ATOM 646 O PRO A 50 6.296 14.623 0.046 1.00 51.32 O ATOM 647 CB PRO A 50 9.377 15.581 -0.147 1.00 13.30 C ATOM 648 CG PRO A 50 9.620 16.955 -0.647 1.00 33.42 C ATOM 649 CD PRO A 50 8.327 17.406 -1.241 1.00 32.34 C ATOM 0 HA PRO A 50 8.824 14.327 -1.880 1.00 64.32 H new ATOM 0 HB2 PRO A 50 8.980 15.594 0.868 1.00 13.30 H new ATOM 0 HB3 PRO A 50 10.300 15.001 -0.121 1.00 13.30 H new ATOM 0 HG2 PRO A 50 9.930 17.616 0.162 1.00 33.42 H new ATOM 0 HG3 PRO A 50 10.417 16.965 -1.391 1.00 33.42 H new ATOM 0 HD2 PRO A 50 7.695 17.901 -0.503 1.00 32.34 H new ATOM 0 HD3 PRO A 50 8.483 18.115 -2.054 1.00 32.34 H new ATOM 657 N VAL A 51 7.663 12.844 -0.211 1.00 24.42 N ATOM 658 CA VAL A 51 6.814 11.886 0.504 1.00 1.44 C ATOM 659 C VAL A 51 6.329 12.407 1.856 1.00 71.23 C ATOM 660 O VAL A 51 5.161 12.279 2.169 1.00 11.33 O ATOM 661 CB VAL A 51 7.526 10.503 0.640 1.00 31.35 C ATOM 662 CG1 VAL A 51 6.872 9.600 1.691 1.00 63.30 C ATOM 663 CG2 VAL A 51 7.492 9.807 -0.707 1.00 3.13 C ATOM 0 H VAL A 51 8.523 12.433 -0.573 1.00 24.42 H new ATOM 0 HA VAL A 51 5.918 11.750 -0.101 1.00 1.44 H new ATOM 0 HB VAL A 51 8.549 10.687 0.967 1.00 31.35 H new ATOM 0 HG11 VAL A 51 7.409 8.653 1.742 1.00 63.30 H new ATOM 0 HG12 VAL A 51 6.907 10.090 2.664 1.00 63.30 H new ATOM 0 HG13 VAL A 51 5.834 9.414 1.416 1.00 63.30 H new ATOM 0 HG21 VAL A 51 7.986 8.839 -0.629 1.00 3.13 H new ATOM 0 HG22 VAL A 51 6.457 9.662 -1.016 1.00 3.13 H new ATOM 0 HG23 VAL A 51 8.009 10.419 -1.446 1.00 3.13 H new ATOM 673 N ASP A 52 7.206 13.031 2.617 1.00 1.24 N ATOM 674 CA ASP A 52 6.829 13.570 3.934 1.00 12.33 C ATOM 675 C ASP A 52 5.713 14.597 3.816 1.00 21.31 C ATOM 676 O ASP A 52 4.759 14.587 4.594 1.00 31.11 O ATOM 677 CB ASP A 52 8.029 14.191 4.658 1.00 34.12 C ATOM 678 CG ASP A 52 9.085 13.187 5.025 1.00 24.52 C ATOM 679 OD1 ASP A 52 8.942 12.509 6.071 1.00 31.10 O ATOM 680 OD2 ASP A 52 10.078 13.045 4.277 1.00 11.42 O ATOM 0 H ASP A 52 8.181 13.183 2.360 1.00 1.24 H new ATOM 0 HA ASP A 52 6.469 12.727 4.524 1.00 12.33 H new ATOM 0 HB2 ASP A 52 8.472 14.958 4.022 1.00 34.12 H new ATOM 0 HB3 ASP A 52 7.681 14.689 5.563 1.00 34.12 H new ATOM 685 N GLU A 53 5.819 15.440 2.816 1.00 33.44 N ATOM 686 CA GLU A 53 4.854 16.497 2.570 1.00 41.33 C ATOM 687 C GLU A 53 3.563 15.929 2.015 1.00 64.04 C ATOM 688 O GLU A 53 2.474 16.258 2.479 1.00 55.54 O ATOM 689 CB GLU A 53 5.445 17.506 1.596 1.00 33.21 C ATOM 690 CG GLU A 53 6.676 18.203 2.126 1.00 10.43 C ATOM 691 CD GLU A 53 6.373 19.000 3.354 1.00 62.11 C ATOM 692 OE1 GLU A 53 6.329 18.431 4.453 1.00 30.43 O ATOM 693 OE2 GLU A 53 6.157 20.213 3.241 1.00 4.10 O ATOM 0 H GLU A 53 6.583 15.415 2.141 1.00 33.44 H new ATOM 0 HA GLU A 53 4.627 16.993 3.514 1.00 41.33 H new ATOM 0 HB2 GLU A 53 5.697 16.997 0.666 1.00 33.21 H new ATOM 0 HB3 GLU A 53 4.689 18.253 1.355 1.00 33.21 H new ATOM 0 HG2 GLU A 53 7.444 17.464 2.352 1.00 10.43 H new ATOM 0 HG3 GLU A 53 7.082 18.860 1.357 1.00 10.43 H new ATOM 700 N ALA A 54 3.701 15.058 1.046 1.00 61.00 N ATOM 701 CA ALA A 54 2.571 14.446 0.384 1.00 22.15 C ATOM 702 C ALA A 54 1.763 13.590 1.356 1.00 41.14 C ATOM 703 O ALA A 54 0.531 13.661 1.398 1.00 62.30 O ATOM 704 CB ALA A 54 3.062 13.608 -0.785 1.00 21.21 C ATOM 0 H ALA A 54 4.606 14.750 0.691 1.00 61.00 H new ATOM 0 HA ALA A 54 1.914 15.232 0.012 1.00 22.15 H new ATOM 0 HB1 ALA A 54 2.210 13.146 -1.285 1.00 21.21 H new ATOM 0 HB2 ALA A 54 3.595 14.245 -1.491 1.00 21.21 H new ATOM 0 HB3 ALA A 54 3.733 12.831 -0.419 1.00 21.21 H new ATOM 710 N LEU A 55 2.462 12.819 2.158 1.00 71.11 N ATOM 711 CA LEU A 55 1.854 11.913 3.083 1.00 24.21 C ATOM 712 C LEU A 55 1.105 12.653 4.185 1.00 65.42 C ATOM 713 O LEU A 55 -0.004 12.271 4.539 1.00 34.20 O ATOM 714 CB LEU A 55 2.918 10.998 3.678 1.00 40.14 C ATOM 715 CG LEU A 55 2.443 9.926 4.628 1.00 12.11 C ATOM 716 CD1 LEU A 55 1.511 8.946 3.918 1.00 41.14 C ATOM 717 CD2 LEU A 55 3.625 9.205 5.239 1.00 63.32 C ATOM 0 H LEU A 55 3.482 12.810 2.180 1.00 71.11 H new ATOM 0 HA LEU A 55 1.122 11.312 2.542 1.00 24.21 H new ATOM 0 HB2 LEU A 55 3.447 10.514 2.857 1.00 40.14 H new ATOM 0 HB3 LEU A 55 3.644 11.619 4.203 1.00 40.14 H new ATOM 0 HG LEU A 55 1.878 10.400 5.431 1.00 12.11 H new ATOM 0 HD11 LEU A 55 1.181 8.182 4.622 1.00 41.14 H new ATOM 0 HD12 LEU A 55 0.644 9.483 3.532 1.00 41.14 H new ATOM 0 HD13 LEU A 55 2.042 8.473 3.092 1.00 41.14 H new ATOM 0 HD21 LEU A 55 3.268 8.434 5.922 1.00 63.32 H new ATOM 0 HD22 LEU A 55 4.217 8.743 4.449 1.00 63.32 H new ATOM 0 HD23 LEU A 55 4.242 9.917 5.786 1.00 63.32 H new ATOM 729 N ARG A 56 1.693 13.731 4.713 1.00 2.21 N ATOM 730 CA ARG A 56 1.056 14.459 5.813 1.00 74.45 C ATOM 731 C ARG A 56 -0.264 15.101 5.416 1.00 51.33 C ATOM 732 O ARG A 56 -1.135 15.298 6.256 1.00 0.34 O ATOM 733 CB ARG A 56 1.984 15.479 6.491 1.00 73.24 C ATOM 734 CG ARG A 56 2.521 16.584 5.606 1.00 22.11 C ATOM 735 CD ARG A 56 3.326 17.579 6.425 1.00 44.53 C ATOM 736 NE ARG A 56 3.895 18.654 5.608 1.00 74.12 N ATOM 737 CZ ARG A 56 3.431 19.907 5.547 1.00 13.11 C ATOM 738 NH1 ARG A 56 2.320 20.247 6.209 1.00 22.11 N ATOM 739 NH2 ARG A 56 4.070 20.812 4.820 1.00 12.40 N ATOM 0 H ARG A 56 2.588 14.112 4.405 1.00 2.21 H new ATOM 0 HA ARG A 56 0.834 13.693 6.556 1.00 74.45 H new ATOM 0 HB2 ARG A 56 1.444 15.936 7.320 1.00 73.24 H new ATOM 0 HB3 ARG A 56 2.830 14.941 6.919 1.00 73.24 H new ATOM 0 HG2 ARG A 56 3.148 16.158 4.822 1.00 22.11 H new ATOM 0 HG3 ARG A 56 1.695 17.095 5.111 1.00 22.11 H new ATOM 0 HD2 ARG A 56 2.686 18.012 7.194 1.00 44.53 H new ATOM 0 HD3 ARG A 56 4.131 17.054 6.939 1.00 44.53 H new ATOM 0 HE ARG A 56 4.711 18.428 5.040 1.00 74.12 H new ATOM 0 HH11 ARG A 56 1.823 19.550 6.763 1.00 22.11 H new ATOM 0 HH12 ARG A 56 1.970 21.204 6.160 1.00 22.11 H new ATOM 0 HH21 ARG A 56 4.914 20.552 4.309 1.00 12.40 H new ATOM 0 HH22 ARG A 56 3.718 21.768 4.772 1.00 12.40 H new ATOM 753 N GLU A 57 -0.406 15.439 4.154 1.00 60.24 N ATOM 754 CA GLU A 57 -1.666 15.987 3.668 1.00 4.03 C ATOM 755 C GLU A 57 -2.662 14.881 3.313 1.00 13.52 C ATOM 756 O GLU A 57 -3.858 15.036 3.481 1.00 72.25 O ATOM 757 CB GLU A 57 -1.454 16.907 2.477 1.00 14.54 C ATOM 758 CG GLU A 57 -0.642 18.148 2.789 1.00 63.33 C ATOM 759 CD GLU A 57 -0.523 19.059 1.602 1.00 14.03 C ATOM 760 OE1 GLU A 57 -1.461 19.849 1.343 1.00 2.42 O ATOM 761 OE2 GLU A 57 0.490 19.019 0.908 1.00 22.44 O ATOM 0 H GLU A 57 0.323 15.348 3.447 1.00 60.24 H new ATOM 0 HA GLU A 57 -2.088 16.576 4.482 1.00 4.03 H new ATOM 0 HB2 GLU A 57 -0.954 16.349 1.685 1.00 14.54 H new ATOM 0 HB3 GLU A 57 -2.426 17.210 2.089 1.00 14.54 H new ATOM 0 HG2 GLU A 57 -1.108 18.687 3.614 1.00 63.33 H new ATOM 0 HG3 GLU A 57 0.354 17.855 3.122 1.00 63.33 H new ATOM 768 N ALA A 58 -2.151 13.775 2.827 1.00 22.13 N ATOM 769 CA ALA A 58 -2.972 12.637 2.411 1.00 25.13 C ATOM 770 C ALA A 58 -3.509 11.833 3.601 1.00 31.22 C ATOM 771 O ALA A 58 -4.603 11.271 3.529 1.00 21.04 O ATOM 772 CB ALA A 58 -2.169 11.754 1.493 1.00 51.54 C ATOM 0 H ALA A 58 -1.149 13.627 2.704 1.00 22.13 H new ATOM 0 HA ALA A 58 -3.843 13.027 1.884 1.00 25.13 H new ATOM 0 HB1 ALA A 58 -2.777 10.905 1.181 1.00 51.54 H new ATOM 0 HB2 ALA A 58 -1.864 12.324 0.615 1.00 51.54 H new ATOM 0 HB3 ALA A 58 -1.284 11.393 2.017 1.00 51.54 H new ATOM 778 N MET A 59 -2.739 11.768 4.682 1.00 13.43 N ATOM 779 CA MET A 59 -3.151 11.026 5.889 1.00 51.33 C ATOM 780 C MET A 59 -4.528 11.414 6.427 1.00 70.43 C ATOM 781 O MET A 59 -5.385 10.542 6.545 1.00 32.00 O ATOM 782 CB MET A 59 -2.096 11.024 6.997 1.00 41.51 C ATOM 783 CG MET A 59 -0.840 10.194 6.734 1.00 73.33 C ATOM 784 SD MET A 59 -1.088 8.377 6.740 1.00 34.02 S ATOM 785 CE MET A 59 -2.041 8.024 5.258 1.00 11.32 C ATOM 0 H MET A 59 -1.826 12.216 4.756 1.00 13.43 H new ATOM 0 HA MET A 59 -3.243 9.998 5.538 1.00 51.33 H new ATOM 0 HB2 MET A 59 -1.793 12.054 7.182 1.00 41.51 H new ATOM 0 HB3 MET A 59 -2.562 10.659 7.912 1.00 41.51 H new ATOM 0 HG2 MET A 59 -0.428 10.485 5.768 1.00 73.33 H new ATOM 0 HG3 MET A 59 -0.094 10.445 7.488 1.00 73.33 H new ATOM 0 HE1 MET A 59 -1.659 7.118 4.787 1.00 11.32 H new ATOM 0 HE2 MET A 59 -3.088 7.880 5.524 1.00 11.32 H new ATOM 0 HE3 MET A 59 -1.955 8.859 4.563 1.00 11.32 H new ATOM 795 N PRO A 60 -4.787 12.714 6.758 1.00 22.03 N ATOM 796 CA PRO A 60 -6.099 13.149 7.249 1.00 72.12 C ATOM 797 C PRO A 60 -7.219 12.790 6.273 1.00 63.11 C ATOM 798 O PRO A 60 -8.327 12.489 6.684 1.00 41.45 O ATOM 799 CB PRO A 60 -5.964 14.672 7.387 1.00 13.41 C ATOM 800 CG PRO A 60 -4.750 15.028 6.611 1.00 10.13 C ATOM 801 CD PRO A 60 -3.846 13.846 6.706 1.00 60.34 C ATOM 0 HA PRO A 60 -6.364 12.660 8.187 1.00 72.12 H new ATOM 0 HB2 PRO A 60 -6.844 15.182 6.996 1.00 13.41 H new ATOM 0 HB3 PRO A 60 -5.863 14.965 8.432 1.00 13.41 H new ATOM 0 HG2 PRO A 60 -5.000 15.247 5.573 1.00 10.13 H new ATOM 0 HG3 PRO A 60 -4.273 15.919 7.019 1.00 10.13 H new ATOM 0 HD2 PRO A 60 -3.179 13.778 5.847 1.00 60.34 H new ATOM 0 HD3 PRO A 60 -3.217 13.889 7.595 1.00 60.34 H new ATOM 809 N LYS A 61 -6.894 12.783 4.988 1.00 54.13 N ATOM 810 CA LYS A 61 -7.853 12.472 3.943 1.00 25.32 C ATOM 811 C LYS A 61 -8.323 11.007 4.051 1.00 21.43 C ATOM 812 O LYS A 61 -9.508 10.712 3.898 1.00 63.15 O ATOM 813 CB LYS A 61 -7.246 12.785 2.567 1.00 53.20 C ATOM 814 CG LYS A 61 -6.770 14.234 2.454 1.00 62.32 C ATOM 815 CD LYS A 61 -6.213 14.564 1.086 1.00 43.31 C ATOM 816 CE LYS A 61 -5.788 16.024 0.999 1.00 2.14 C ATOM 817 NZ LYS A 61 -5.403 16.432 -0.383 1.00 60.21 N ATOM 0 H LYS A 61 -5.957 12.993 4.643 1.00 54.13 H new ATOM 0 HA LYS A 61 -8.737 13.098 4.068 1.00 25.32 H new ATOM 0 HB2 LYS A 61 -6.407 12.115 2.383 1.00 53.20 H new ATOM 0 HB3 LYS A 61 -7.988 12.588 1.793 1.00 53.20 H new ATOM 0 HG2 LYS A 61 -7.602 14.903 2.673 1.00 62.32 H new ATOM 0 HG3 LYS A 61 -6.004 14.420 3.207 1.00 62.32 H new ATOM 0 HD2 LYS A 61 -5.359 13.921 0.874 1.00 43.31 H new ATOM 0 HD3 LYS A 61 -6.965 14.356 0.325 1.00 43.31 H new ATOM 0 HE2 LYS A 61 -6.605 16.657 1.346 1.00 2.14 H new ATOM 0 HE3 LYS A 61 -4.947 16.193 1.671 1.00 2.14 H new ATOM 0 HZ1 LYS A 61 -4.789 17.270 -0.339 1.00 60.21 H new ATOM 0 HZ2 LYS A 61 -4.892 15.653 -0.845 1.00 60.21 H new ATOM 0 HZ3 LYS A 61 -6.259 16.658 -0.929 1.00 60.21 H new ATOM 831 N ILE A 62 -7.398 10.100 4.337 1.00 73.44 N ATOM 832 CA ILE A 62 -7.768 8.700 4.565 1.00 54.45 C ATOM 833 C ILE A 62 -8.396 8.542 5.961 1.00 13.43 C ATOM 834 O ILE A 62 -9.381 7.813 6.146 1.00 52.12 O ATOM 835 CB ILE A 62 -6.554 7.707 4.414 1.00 55.12 C ATOM 836 CG1 ILE A 62 -6.006 7.677 2.974 1.00 64.11 C ATOM 837 CG2 ILE A 62 -6.915 6.298 4.875 1.00 53.52 C ATOM 838 CD1 ILE A 62 -7.042 7.347 1.913 1.00 4.00 C ATOM 0 H ILE A 62 -6.401 10.299 4.417 1.00 73.44 H new ATOM 0 HA ILE A 62 -8.492 8.438 3.793 1.00 54.45 H new ATOM 0 HB ILE A 62 -5.765 8.086 5.064 1.00 55.12 H new ATOM 0 HG12 ILE A 62 -5.567 8.648 2.745 1.00 64.11 H new ATOM 0 HG13 ILE A 62 -5.202 6.943 2.920 1.00 64.11 H new ATOM 0 HG21 ILE A 62 -6.052 5.644 4.755 1.00 53.52 H new ATOM 0 HG22 ILE A 62 -7.209 6.323 5.924 1.00 53.52 H new ATOM 0 HG23 ILE A 62 -7.743 5.920 4.275 1.00 53.52 H new ATOM 0 HD11 ILE A 62 -6.570 7.348 0.931 1.00 4.00 H new ATOM 0 HD12 ILE A 62 -7.465 6.362 2.112 1.00 4.00 H new ATOM 0 HD13 ILE A 62 -7.836 8.094 1.935 1.00 4.00 H new ATOM 850 N MET A 63 -7.843 9.259 6.925 1.00 33.43 N ATOM 851 CA MET A 63 -8.289 9.176 8.317 1.00 21.22 C ATOM 852 C MET A 63 -9.709 9.702 8.527 1.00 43.10 C ATOM 853 O MET A 63 -10.412 9.230 9.404 1.00 5.34 O ATOM 854 CB MET A 63 -7.295 9.856 9.265 1.00 21.01 C ATOM 855 CG MET A 63 -5.930 9.181 9.309 1.00 4.51 C ATOM 856 SD MET A 63 -4.750 10.037 10.373 1.00 14.40 S ATOM 857 CE MET A 63 -3.311 8.977 10.191 1.00 31.04 C ATOM 0 H MET A 63 -7.076 9.914 6.772 1.00 33.43 H new ATOM 0 HA MET A 63 -8.320 8.114 8.562 1.00 21.22 H new ATOM 0 HB2 MET A 63 -7.167 10.894 8.959 1.00 21.01 H new ATOM 0 HB3 MET A 63 -7.716 9.869 10.270 1.00 21.01 H new ATOM 0 HG2 MET A 63 -6.049 8.156 9.660 1.00 4.51 H new ATOM 0 HG3 MET A 63 -5.526 9.127 8.298 1.00 4.51 H new ATOM 0 HE1 MET A 63 -2.433 9.483 10.594 1.00 31.04 H new ATOM 0 HE2 MET A 63 -3.474 8.046 10.734 1.00 31.04 H new ATOM 0 HE3 MET A 63 -3.151 8.758 9.135 1.00 31.04 H new ATOM 867 N LYS A 64 -10.130 10.672 7.730 1.00 4.01 N ATOM 868 CA LYS A 64 -11.498 11.183 7.833 1.00 24.24 C ATOM 869 C LYS A 64 -12.478 10.179 7.218 1.00 11.35 C ATOM 870 O LYS A 64 -13.632 10.061 7.651 1.00 3.22 O ATOM 871 CB LYS A 64 -11.632 12.573 7.163 1.00 15.33 C ATOM 872 CG LYS A 64 -11.318 12.585 5.672 1.00 43.11 C ATOM 873 CD LYS A 64 -11.361 13.989 5.071 1.00 61.43 C ATOM 874 CE LYS A 64 -12.744 14.618 5.150 1.00 13.35 C ATOM 875 NZ LYS A 64 -12.762 15.956 4.526 1.00 24.30 N ATOM 0 H LYS A 64 -9.558 11.119 7.013 1.00 4.01 H new ATOM 0 HA LYS A 64 -11.741 11.308 8.888 1.00 24.24 H new ATOM 0 HB2 LYS A 64 -12.648 12.938 7.311 1.00 15.33 H new ATOM 0 HB3 LYS A 64 -10.966 13.272 7.668 1.00 15.33 H new ATOM 0 HG2 LYS A 64 -10.330 12.155 5.510 1.00 43.11 H new ATOM 0 HG3 LYS A 64 -12.032 11.949 5.149 1.00 43.11 H new ATOM 0 HD2 LYS A 64 -10.646 14.625 5.593 1.00 61.43 H new ATOM 0 HD3 LYS A 64 -11.046 13.944 4.029 1.00 61.43 H new ATOM 0 HE2 LYS A 64 -13.468 13.973 4.653 1.00 13.35 H new ATOM 0 HE3 LYS A 64 -13.051 14.697 6.193 1.00 13.35 H new ATOM 0 HZ1 LYS A 64 -13.743 16.294 4.458 1.00 24.30 H new ATOM 0 HZ2 LYS A 64 -12.207 16.617 5.106 1.00 24.30 H new ATOM 0 HZ3 LYS A 64 -12.349 15.900 3.573 1.00 24.30 H new ATOM 889 N TYR A 65 -11.992 9.436 6.232 1.00 2.32 N ATOM 890 CA TYR A 65 -12.784 8.435 5.538 1.00 74.01 C ATOM 891 C TYR A 65 -13.190 7.303 6.487 1.00 44.33 C ATOM 892 O TYR A 65 -14.378 7.108 6.745 1.00 64.04 O ATOM 893 CB TYR A 65 -12.003 7.910 4.317 1.00 2.31 C ATOM 894 CG TYR A 65 -12.672 6.787 3.556 1.00 52.12 C ATOM 895 CD1 TYR A 65 -13.843 7.000 2.847 1.00 3.53 C ATOM 896 CD2 TYR A 65 -12.123 5.508 3.555 1.00 42.24 C ATOM 897 CE1 TYR A 65 -14.451 5.972 2.157 1.00 70.04 C ATOM 898 CE2 TYR A 65 -12.723 4.477 2.867 1.00 64.01 C ATOM 899 CZ TYR A 65 -13.884 4.713 2.168 1.00 34.44 C ATOM 900 OH TYR A 65 -14.487 3.686 1.488 1.00 50.22 O ATOM 0 H TYR A 65 -11.034 9.513 5.892 1.00 2.32 H new ATOM 0 HA TYR A 65 -13.706 8.893 5.180 1.00 74.01 H new ATOM 0 HB2 TYR A 65 -11.832 8.740 3.631 1.00 2.31 H new ATOM 0 HB3 TYR A 65 -11.024 7.567 4.652 1.00 2.31 H new ATOM 0 HD1 TYR A 65 -14.286 7.985 2.834 1.00 3.53 H new ATOM 0 HD2 TYR A 65 -11.211 5.321 4.103 1.00 42.24 H new ATOM 0 HE1 TYR A 65 -15.366 6.151 1.611 1.00 70.04 H new ATOM 0 HE2 TYR A 65 -12.285 3.490 2.876 1.00 64.01 H new ATOM 0 HH TYR A 65 -15.266 4.028 1.002 1.00 50.22 H new ATOM 910 N VAL A 66 -12.206 6.607 7.044 1.00 14.41 N ATOM 911 CA VAL A 66 -12.468 5.523 7.979 1.00 41.33 C ATOM 912 C VAL A 66 -12.883 6.087 9.360 1.00 32.23 C ATOM 913 O VAL A 66 -13.479 5.400 10.176 1.00 64.23 O ATOM 914 CB VAL A 66 -11.230 4.560 8.090 1.00 44.20 C ATOM 915 CG1 VAL A 66 -9.956 5.319 8.433 1.00 4.11 C ATOM 916 CG2 VAL A 66 -11.467 3.483 9.116 1.00 22.03 C ATOM 0 H VAL A 66 -11.217 6.776 6.863 1.00 14.41 H new ATOM 0 HA VAL A 66 -13.301 4.932 7.598 1.00 41.33 H new ATOM 0 HB VAL A 66 -11.104 4.096 7.112 1.00 44.20 H new ATOM 0 HG11 VAL A 66 -9.123 4.619 8.501 1.00 4.11 H new ATOM 0 HG12 VAL A 66 -9.750 6.054 7.655 1.00 4.11 H new ATOM 0 HG13 VAL A 66 -10.082 5.828 9.389 1.00 4.11 H new ATOM 0 HG21 VAL A 66 -10.594 2.833 9.170 1.00 22.03 H new ATOM 0 HG22 VAL A 66 -11.640 3.940 10.090 1.00 22.03 H new ATOM 0 HG23 VAL A 66 -12.340 2.895 8.831 1.00 22.03 H new ATOM 926 N GLY A 67 -12.582 7.358 9.582 1.00 30.31 N ATOM 927 CA GLY A 67 -12.923 8.013 10.830 1.00 11.10 C ATOM 928 C GLY A 67 -14.420 8.118 11.059 1.00 25.42 C ATOM 929 O GLY A 67 -14.875 8.146 12.206 1.00 13.32 O ATOM 0 H GLY A 67 -12.101 7.955 8.910 1.00 30.31 H new ATOM 0 HA2 GLY A 67 -12.473 7.463 11.657 1.00 11.10 H new ATOM 0 HA3 GLY A 67 -12.489 9.013 10.839 1.00 11.10 H new ATOM 933 N GLY A 68 -15.182 8.176 9.983 1.00 13.41 N ATOM 934 CA GLY A 68 -16.624 8.252 10.114 1.00 5.40 C ATOM 935 C GLY A 68 -17.222 9.397 9.340 1.00 21.32 C ATOM 936 O GLY A 68 -18.428 9.623 9.373 1.00 73.10 O ATOM 0 H GLY A 68 -14.834 8.172 9.024 1.00 13.41 H new ATOM 0 HA2 GLY A 68 -17.065 7.317 9.769 1.00 5.40 H new ATOM 0 HA3 GLY A 68 -16.883 8.357 11.167 1.00 5.40 H new ATOM 940 N THR A 69 -16.397 10.109 8.618 1.00 40.32 N ATOM 941 CA THR A 69 -16.854 11.254 7.861 1.00 3.55 C ATOM 942 C THR A 69 -17.156 10.835 6.398 1.00 31.31 C ATOM 943 O THR A 69 -17.214 11.653 5.493 1.00 13.24 O ATOM 944 CB THR A 69 -15.765 12.356 7.922 1.00 51.15 C ATOM 945 OG1 THR A 69 -15.371 12.507 9.295 1.00 12.13 O ATOM 946 CG2 THR A 69 -16.289 13.705 7.432 1.00 34.40 C ATOM 0 H THR A 69 -15.398 9.918 8.535 1.00 40.32 H new ATOM 0 HA THR A 69 -17.777 11.647 8.287 1.00 3.55 H new ATOM 0 HB THR A 69 -14.935 12.058 7.281 1.00 51.15 H new ATOM 0 HG1 THR A 69 -14.680 13.198 9.363 1.00 12.13 H new ATOM 0 HG21 THR A 69 -15.494 14.448 7.492 1.00 34.40 H new ATOM 0 HG22 THR A 69 -16.622 13.612 6.398 1.00 34.40 H new ATOM 0 HG23 THR A 69 -17.126 14.019 8.056 1.00 34.40 H new ATOM 954 N ASN A 70 -17.403 9.555 6.211 1.00 2.34 N ATOM 955 CA ASN A 70 -17.683 8.995 4.883 1.00 74.42 C ATOM 956 C ASN A 70 -19.168 9.072 4.566 1.00 30.55 C ATOM 957 O ASN A 70 -19.981 9.390 5.434 1.00 1.55 O ATOM 958 CB ASN A 70 -17.191 7.543 4.750 1.00 21.45 C ATOM 959 CG ASN A 70 -17.766 6.633 5.809 1.00 44.34 C ATOM 960 OD1 ASN A 70 -18.861 6.089 5.656 1.00 54.42 O ATOM 961 ND2 ASN A 70 -17.016 6.420 6.850 1.00 52.12 N ATOM 0 H ASN A 70 -17.418 8.867 6.964 1.00 2.34 H new ATOM 0 HA ASN A 70 -17.132 9.599 4.163 1.00 74.42 H new ATOM 0 HB2 ASN A 70 -17.459 7.162 3.765 1.00 21.45 H new ATOM 0 HB3 ASN A 70 -16.103 7.525 4.813 1.00 21.45 H new ATOM 0 HD21 ASN A 70 -17.328 5.781 7.581 1.00 52.12 H new ATOM 0 HD22 ASN A 70 -16.116 6.892 6.935 1.00 52.12 H new ATOM 968 N ASP A 71 -19.514 8.733 3.336 1.00 10.05 N ATOM 969 CA ASP A 71 -20.898 8.835 2.837 1.00 11.22 C ATOM 970 C ASP A 71 -21.830 7.853 3.510 1.00 13.13 C ATOM 971 O ASP A 71 -22.995 8.166 3.775 1.00 51.02 O ATOM 972 CB ASP A 71 -20.919 8.592 1.332 1.00 21.24 C ATOM 973 CG ASP A 71 -22.316 8.564 0.735 1.00 2.03 C ATOM 974 OD1 ASP A 71 -22.952 7.492 0.740 1.00 3.30 O ATOM 975 OD2 ASP A 71 -22.787 9.602 0.239 1.00 32.43 O ATOM 0 H ASP A 71 -18.852 8.378 2.646 1.00 10.05 H new ATOM 0 HA ASP A 71 -21.251 9.840 3.070 1.00 11.22 H new ATOM 0 HB2 ASP A 71 -20.339 9.372 0.839 1.00 21.24 H new ATOM 0 HB3 ASP A 71 -20.424 7.644 1.119 1.00 21.24 H new ATOM 980 N LYS A 72 -21.307 6.693 3.833 1.00 32.23 N ATOM 981 CA LYS A 72 -22.098 5.644 4.433 1.00 55.22 C ATOM 982 C LYS A 72 -22.294 5.934 5.921 1.00 52.31 C ATOM 983 O LYS A 72 -23.117 5.319 6.589 1.00 41.15 O ATOM 984 CB LYS A 72 -21.396 4.313 4.237 1.00 12.23 C ATOM 985 CG LYS A 72 -22.309 3.167 4.503 1.00 65.03 C ATOM 986 CD LYS A 72 -21.627 1.846 4.374 1.00 20.34 C ATOM 987 CE LYS A 72 -22.611 0.768 4.687 1.00 42.04 C ATOM 988 NZ LYS A 72 -23.626 0.598 3.628 1.00 1.41 N ATOM 0 H LYS A 72 -20.327 6.451 3.688 1.00 32.23 H new ATOM 0 HA LYS A 72 -23.078 5.601 3.957 1.00 55.22 H new ATOM 0 HB2 LYS A 72 -21.017 4.248 3.217 1.00 12.23 H new ATOM 0 HB3 LYS A 72 -20.534 4.254 4.902 1.00 12.23 H new ATOM 0 HG2 LYS A 72 -22.722 3.262 5.507 1.00 65.03 H new ATOM 0 HG3 LYS A 72 -23.148 3.207 3.809 1.00 65.03 H new ATOM 0 HD2 LYS A 72 -21.236 1.719 3.364 1.00 20.34 H new ATOM 0 HD3 LYS A 72 -20.777 1.791 5.054 1.00 20.34 H new ATOM 0 HE2 LYS A 72 -22.080 -0.173 4.830 1.00 42.04 H new ATOM 0 HE3 LYS A 72 -23.109 0.999 5.629 1.00 42.04 H new ATOM 0 HZ1 LYS A 72 -24.120 -0.307 3.763 1.00 1.41 H new ATOM 0 HZ2 LYS A 72 -24.313 1.378 3.677 1.00 1.41 H new ATOM 0 HZ3 LYS A 72 -23.161 0.604 2.698 1.00 1.41 H new ATOM 1002 N GLY A 73 -21.525 6.892 6.421 1.00 43.44 N ATOM 1003 CA GLY A 73 -21.620 7.311 7.801 1.00 64.52 C ATOM 1004 C GLY A 73 -21.115 6.265 8.761 1.00 35.45 C ATOM 1005 O GLY A 73 -21.508 6.243 9.928 1.00 74.40 O ATOM 0 H GLY A 73 -20.822 7.395 5.879 1.00 43.44 H new ATOM 0 HA2 GLY A 73 -21.050 8.230 7.938 1.00 64.52 H new ATOM 0 HA3 GLY A 73 -22.659 7.543 8.036 1.00 64.52 H new ATOM 1009 N VAL A 74 -20.235 5.407 8.292 1.00 43.53 N ATOM 1010 CA VAL A 74 -19.719 4.352 9.148 1.00 65.31 C ATOM 1011 C VAL A 74 -18.486 4.826 9.854 1.00 74.13 C ATOM 1012 O VAL A 74 -17.734 5.623 9.311 1.00 14.03 O ATOM 1013 CB VAL A 74 -19.413 3.026 8.386 1.00 74.40 C ATOM 1014 CG1 VAL A 74 -20.665 2.471 7.751 1.00 14.14 C ATOM 1015 CG2 VAL A 74 -18.311 3.213 7.343 1.00 42.01 C ATOM 0 H VAL A 74 -19.865 5.414 7.341 1.00 43.53 H new ATOM 0 HA VAL A 74 -20.506 4.124 9.866 1.00 65.31 H new ATOM 0 HB VAL A 74 -19.050 2.305 9.118 1.00 74.40 H new ATOM 0 HG11 VAL A 74 -20.427 1.546 7.225 1.00 14.14 H new ATOM 0 HG12 VAL A 74 -21.406 2.268 8.524 1.00 14.14 H new ATOM 0 HG13 VAL A 74 -21.067 3.197 7.044 1.00 14.14 H new ATOM 0 HG21 VAL A 74 -18.127 2.267 6.834 1.00 42.01 H new ATOM 0 HG22 VAL A 74 -18.622 3.962 6.615 1.00 42.01 H new ATOM 0 HG23 VAL A 74 -17.396 3.544 7.835 1.00 42.01 H new ATOM 1025 N GLY A 75 -18.291 4.362 11.049 1.00 62.33 N ATOM 1026 CA GLY A 75 -17.128 4.731 11.793 1.00 2.12 C ATOM 1027 C GLY A 75 -15.964 3.848 11.443 1.00 33.43 C ATOM 1028 O GLY A 75 -15.908 3.268 10.342 1.00 64.50 O ATOM 0 H GLY A 75 -18.925 3.725 11.531 1.00 62.33 H new ATOM 0 HA2 GLY A 75 -16.875 5.771 11.587 1.00 2.12 H new ATOM 0 HA3 GLY A 75 -17.336 4.659 12.860 1.00 2.12 H new ATOM 1032 N MET A 76 -15.054 3.702 12.364 1.00 25.44 N ATOM 1033 CA MET A 76 -13.880 2.893 12.132 1.00 10.35 C ATOM 1034 C MET A 76 -14.211 1.416 12.326 1.00 32.52 C ATOM 1035 O MET A 76 -13.877 0.800 13.338 1.00 41.22 O ATOM 1036 CB MET A 76 -12.681 3.353 12.999 1.00 0.44 C ATOM 1037 CG MET A 76 -11.375 2.603 12.740 1.00 14.14 C ATOM 1038 SD MET A 76 -9.994 3.240 13.725 1.00 13.03 S ATOM 1039 CE MET A 76 -8.660 2.184 13.156 1.00 74.14 C ATOM 0 H MET A 76 -15.098 4.132 13.288 1.00 25.44 H new ATOM 0 HA MET A 76 -13.567 3.029 11.097 1.00 10.35 H new ATOM 0 HB2 MET A 76 -12.513 4.416 12.826 1.00 0.44 H new ATOM 0 HB3 MET A 76 -12.946 3.239 14.050 1.00 0.44 H new ATOM 0 HG2 MET A 76 -11.518 1.546 12.963 1.00 14.14 H new ATOM 0 HG3 MET A 76 -11.124 2.674 11.682 1.00 14.14 H new ATOM 0 HE1 MET A 76 -7.704 2.671 13.347 1.00 74.14 H new ATOM 0 HE2 MET A 76 -8.696 1.233 13.688 1.00 74.14 H new ATOM 0 HE3 MET A 76 -8.769 2.005 12.086 1.00 74.14 H new ATOM 1049 N GLY A 77 -14.951 0.890 11.378 1.00 14.03 N ATOM 1050 CA GLY A 77 -15.337 -0.495 11.401 1.00 60.30 C ATOM 1051 C GLY A 77 -14.546 -1.288 10.409 1.00 71.35 C ATOM 1052 O GLY A 77 -14.768 -2.489 10.226 1.00 62.31 O ATOM 0 H GLY A 77 -15.300 1.411 10.573 1.00 14.03 H new ATOM 0 HA2 GLY A 77 -15.186 -0.902 12.401 1.00 60.30 H new ATOM 0 HA3 GLY A 77 -16.400 -0.584 11.178 1.00 60.30 H new ATOM 1056 N MET A 78 -13.623 -0.621 9.756 1.00 43.23 N ATOM 1057 CA MET A 78 -12.780 -1.260 8.809 1.00 4.11 C ATOM 1058 C MET A 78 -11.331 -0.998 9.192 1.00 14.43 C ATOM 1059 O MET A 78 -10.912 0.149 9.309 1.00 62.41 O ATOM 1060 CB MET A 78 -13.156 -0.708 7.399 1.00 71.35 C ATOM 1061 CG MET A 78 -13.253 0.827 7.331 1.00 32.04 C ATOM 1062 SD MET A 78 -14.046 1.458 5.822 1.00 13.13 S ATOM 1063 CE MET A 78 -12.886 0.998 4.558 1.00 0.21 C ATOM 0 H MET A 78 -13.446 0.376 9.875 1.00 43.23 H new ATOM 0 HA MET A 78 -12.910 -2.342 8.792 1.00 4.11 H new ATOM 0 HB2 MET A 78 -12.412 -1.047 6.678 1.00 71.35 H new ATOM 0 HB3 MET A 78 -14.112 -1.136 7.096 1.00 71.35 H new ATOM 0 HG2 MET A 78 -13.811 1.183 8.197 1.00 32.04 H new ATOM 0 HG3 MET A 78 -12.250 1.247 7.403 1.00 32.04 H new ATOM 0 HE1 MET A 78 -13.426 0.669 3.671 1.00 0.21 H new ATOM 0 HE2 MET A 78 -12.263 1.856 4.306 1.00 0.21 H new ATOM 0 HE3 MET A 78 -12.256 0.186 4.921 1.00 0.21 H new ATOM 1073 N THR A 79 -10.585 -2.063 9.413 1.00 35.43 N ATOM 1074 CA THR A 79 -9.194 -1.956 9.787 1.00 5.03 C ATOM 1075 C THR A 79 -8.305 -2.772 8.880 1.00 0.32 C ATOM 1076 O THR A 79 -8.405 -4.004 8.842 1.00 2.45 O ATOM 1077 CB THR A 79 -8.953 -2.357 11.271 1.00 32.43 C ATOM 1078 OG1 THR A 79 -9.485 -3.675 11.535 1.00 64.54 O ATOM 1079 CG2 THR A 79 -9.586 -1.351 12.222 1.00 24.24 C ATOM 0 H THR A 79 -10.927 -3.021 9.338 1.00 35.43 H new ATOM 0 HA THR A 79 -8.930 -0.905 9.674 1.00 5.03 H new ATOM 0 HB THR A 79 -7.876 -2.365 11.439 1.00 32.43 H new ATOM 0 HG1 THR A 79 -9.314 -4.257 10.765 1.00 64.54 H new ATOM 0 HG21 THR A 79 -9.401 -1.657 13.252 1.00 24.24 H new ATOM 0 HG22 THR A 79 -9.150 -0.366 12.053 1.00 24.24 H new ATOM 0 HG23 THR A 79 -10.660 -1.308 12.044 1.00 24.24 H new ATOM 1087 N VAL A 80 -7.449 -2.100 8.170 1.00 71.54 N ATOM 1088 CA VAL A 80 -6.479 -2.719 7.290 1.00 1.31 C ATOM 1089 C VAL A 80 -5.295 -1.775 7.264 1.00 50.10 C ATOM 1090 O VAL A 80 -5.509 -0.552 7.292 1.00 42.53 O ATOM 1091 CB VAL A 80 -7.023 -2.881 5.816 1.00 34.24 C ATOM 1092 CG1 VAL A 80 -5.998 -3.541 4.919 1.00 23.10 C ATOM 1093 CG2 VAL A 80 -8.328 -3.664 5.757 1.00 3.51 C ATOM 0 H VAL A 80 -7.397 -1.081 8.180 1.00 71.54 H new ATOM 0 HA VAL A 80 -6.234 -3.718 7.651 1.00 1.31 H new ATOM 0 HB VAL A 80 -7.219 -1.871 5.456 1.00 34.24 H new ATOM 0 HG11 VAL A 80 -6.404 -3.637 3.912 1.00 23.10 H new ATOM 0 HG12 VAL A 80 -5.095 -2.932 4.889 1.00 23.10 H new ATOM 0 HG13 VAL A 80 -5.756 -4.530 5.309 1.00 23.10 H new ATOM 0 HG21 VAL A 80 -8.657 -3.745 4.721 1.00 3.51 H new ATOM 0 HG22 VAL A 80 -8.173 -4.662 6.168 1.00 3.51 H new ATOM 0 HG23 VAL A 80 -9.090 -3.146 6.340 1.00 3.51 H new ATOM 1103 N PRO A 81 -4.041 -2.279 7.291 1.00 23.31 N ATOM 1104 CA PRO A 81 -2.876 -1.415 7.185 1.00 5.41 C ATOM 1105 C PRO A 81 -2.937 -0.596 5.904 1.00 71.12 C ATOM 1106 O PRO A 81 -3.288 -1.114 4.824 1.00 3.13 O ATOM 1107 CB PRO A 81 -1.702 -2.395 7.126 1.00 41.31 C ATOM 1108 CG PRO A 81 -2.207 -3.616 7.800 1.00 63.12 C ATOM 1109 CD PRO A 81 -3.666 -3.696 7.463 1.00 44.11 C ATOM 0 HA PRO A 81 -2.800 -0.705 8.009 1.00 5.41 H new ATOM 0 HB2 PRO A 81 -1.408 -2.602 6.097 1.00 41.31 H new ATOM 0 HB3 PRO A 81 -0.824 -1.995 7.634 1.00 41.31 H new ATOM 0 HG2 PRO A 81 -1.676 -4.502 7.452 1.00 63.12 H new ATOM 0 HG3 PRO A 81 -2.057 -3.558 8.878 1.00 63.12 H new ATOM 0 HD2 PRO A 81 -3.840 -4.273 6.555 1.00 44.11 H new ATOM 0 HD3 PRO A 81 -4.239 -4.172 8.258 1.00 44.11 H new ATOM 1117 N VAL A 82 -2.572 0.639 6.008 1.00 22.55 N ATOM 1118 CA VAL A 82 -2.629 1.528 4.892 1.00 24.43 C ATOM 1119 C VAL A 82 -1.303 1.485 4.160 1.00 52.10 C ATOM 1120 O VAL A 82 -0.242 1.382 4.782 1.00 41.11 O ATOM 1121 CB VAL A 82 -3.018 2.988 5.327 1.00 21.23 C ATOM 1122 CG1 VAL A 82 -2.022 3.581 6.312 1.00 43.33 C ATOM 1123 CG2 VAL A 82 -3.204 3.902 4.127 1.00 71.31 C ATOM 0 H VAL A 82 -2.225 1.062 6.869 1.00 22.55 H new ATOM 0 HA VAL A 82 -3.417 1.200 4.213 1.00 24.43 H new ATOM 0 HB VAL A 82 -3.976 2.911 5.841 1.00 21.23 H new ATOM 0 HG11 VAL A 82 -2.334 4.590 6.582 1.00 43.33 H new ATOM 0 HG12 VAL A 82 -1.983 2.961 7.208 1.00 43.33 H new ATOM 0 HG13 VAL A 82 -1.034 3.618 5.853 1.00 43.33 H new ATOM 0 HG21 VAL A 82 -3.472 4.902 4.469 1.00 71.31 H new ATOM 0 HG22 VAL A 82 -2.275 3.950 3.559 1.00 71.31 H new ATOM 0 HG23 VAL A 82 -3.998 3.511 3.491 1.00 71.31 H new ATOM 1133 N SER A 83 -1.359 1.502 2.861 1.00 53.11 N ATOM 1134 CA SER A 83 -0.178 1.428 2.072 1.00 2.21 C ATOM 1135 C SER A 83 -0.069 2.680 1.239 1.00 74.35 C ATOM 1136 O SER A 83 -1.064 3.227 0.818 1.00 22.31 O ATOM 1137 CB SER A 83 -0.272 0.202 1.163 1.00 45.54 C ATOM 1138 OG SER A 83 -0.539 -0.963 1.931 1.00 23.13 O ATOM 0 H SER A 83 -2.225 1.567 2.325 1.00 53.11 H new ATOM 0 HA SER A 83 0.703 1.341 2.708 1.00 2.21 H new ATOM 0 HB2 SER A 83 -1.061 0.348 0.425 1.00 45.54 H new ATOM 0 HB3 SER A 83 0.660 0.077 0.612 1.00 45.54 H new ATOM 0 HG SER A 83 -0.598 -1.740 1.337 1.00 23.13 H new ATOM 1144 N PHE A 84 1.100 3.143 1.019 1.00 50.13 N ATOM 1145 CA PHE A 84 1.269 4.264 0.165 1.00 32.34 C ATOM 1146 C PHE A 84 2.367 3.990 -0.814 1.00 13.25 C ATOM 1147 O PHE A 84 3.399 3.421 -0.455 1.00 70.41 O ATOM 1148 CB PHE A 84 1.469 5.589 0.946 1.00 62.31 C ATOM 1149 CG PHE A 84 2.685 5.659 1.830 1.00 71.42 C ATOM 1150 CD1 PHE A 84 2.649 5.186 3.131 1.00 35.42 C ATOM 1151 CD2 PHE A 84 3.854 6.211 1.360 1.00 62.13 C ATOM 1152 CE1 PHE A 84 3.769 5.263 3.938 1.00 72.12 C ATOM 1153 CE2 PHE A 84 4.971 6.293 2.157 1.00 32.03 C ATOM 1154 CZ PHE A 84 4.934 5.820 3.444 1.00 21.14 C ATOM 0 H PHE A 84 1.960 2.766 1.417 1.00 50.13 H new ATOM 0 HA PHE A 84 0.346 4.411 -0.395 1.00 32.34 H new ATOM 0 HB2 PHE A 84 1.520 6.407 0.227 1.00 62.31 H new ATOM 0 HB3 PHE A 84 0.586 5.761 1.562 1.00 62.31 H new ATOM 0 HD1 PHE A 84 1.738 4.753 3.519 1.00 35.42 H new ATOM 0 HD2 PHE A 84 3.895 6.586 0.348 1.00 62.13 H new ATOM 0 HE1 PHE A 84 3.734 4.889 4.951 1.00 72.12 H new ATOM 0 HE2 PHE A 84 5.879 6.731 1.769 1.00 32.03 H new ATOM 0 HZ PHE A 84 5.812 5.882 4.070 1.00 21.14 H new ATOM 1164 N ALA A 85 2.130 4.352 -2.031 1.00 43.52 N ATOM 1165 CA ALA A 85 3.059 4.137 -3.084 1.00 52.31 C ATOM 1166 C ALA A 85 3.913 5.346 -3.231 1.00 43.21 C ATOM 1167 O ALA A 85 3.411 6.483 -3.225 1.00 1.03 O ATOM 1168 CB ALA A 85 2.329 3.863 -4.385 1.00 4.23 C ATOM 0 H ALA A 85 1.269 4.814 -2.324 1.00 43.52 H new ATOM 0 HA ALA A 85 3.678 3.272 -2.846 1.00 52.31 H new ATOM 0 HB1 ALA A 85 3.055 3.700 -5.182 1.00 4.23 H new ATOM 0 HB2 ALA A 85 1.707 2.975 -4.273 1.00 4.23 H new ATOM 0 HB3 ALA A 85 1.700 4.717 -4.636 1.00 4.23 H new ATOM 1174 N VAL A 86 5.170 5.121 -3.367 1.00 52.24 N ATOM 1175 CA VAL A 86 6.117 6.170 -3.499 1.00 2.45 C ATOM 1176 C VAL A 86 6.846 5.972 -4.807 1.00 54.52 C ATOM 1177 O VAL A 86 7.007 4.834 -5.277 1.00 53.25 O ATOM 1178 CB VAL A 86 7.154 6.146 -2.325 1.00 5.41 C ATOM 1179 CG1 VAL A 86 6.476 6.306 -0.983 1.00 2.23 C ATOM 1180 CG2 VAL A 86 7.940 4.861 -2.325 1.00 40.22 C ATOM 0 H VAL A 86 5.577 4.186 -3.390 1.00 52.24 H new ATOM 0 HA VAL A 86 5.600 7.129 -3.473 1.00 2.45 H new ATOM 0 HB VAL A 86 7.830 6.986 -2.484 1.00 5.41 H new ATOM 0 HG11 VAL A 86 7.225 6.285 -0.192 1.00 2.23 H new ATOM 0 HG12 VAL A 86 5.945 7.258 -0.955 1.00 2.23 H new ATOM 0 HG13 VAL A 86 5.768 5.491 -0.834 1.00 2.23 H new ATOM 0 HG21 VAL A 86 8.653 4.870 -1.500 1.00 40.22 H new ATOM 0 HG22 VAL A 86 7.259 4.018 -2.207 1.00 40.22 H new ATOM 0 HG23 VAL A 86 8.478 4.763 -3.268 1.00 40.22 H new ATOM 1190 N PHE A 87 7.268 7.035 -5.396 1.00 43.34 N ATOM 1191 CA PHE A 87 7.994 6.946 -6.629 1.00 54.43 C ATOM 1192 C PHE A 87 9.373 7.552 -6.385 1.00 74.45 C ATOM 1193 O PHE A 87 9.522 8.769 -6.339 1.00 24.13 O ATOM 1194 CB PHE A 87 7.227 7.693 -7.763 1.00 11.22 C ATOM 1195 CG PHE A 87 5.779 7.225 -7.944 1.00 45.25 C ATOM 1196 CD1 PHE A 87 5.496 6.034 -8.568 1.00 52.23 C ATOM 1197 CD2 PHE A 87 4.709 7.972 -7.461 1.00 53.33 C ATOM 1198 CE1 PHE A 87 4.195 5.592 -8.714 1.00 21.44 C ATOM 1199 CE2 PHE A 87 3.419 7.527 -7.598 1.00 33.33 C ATOM 1200 CZ PHE A 87 3.159 6.340 -8.227 1.00 63.24 C ATOM 0 H PHE A 87 7.126 7.983 -5.048 1.00 43.34 H new ATOM 0 HA PHE A 87 8.098 5.910 -6.952 1.00 54.43 H new ATOM 0 HB2 PHE A 87 7.229 8.761 -7.547 1.00 11.22 H new ATOM 0 HB3 PHE A 87 7.763 7.556 -8.702 1.00 11.22 H new ATOM 0 HD1 PHE A 87 6.306 5.432 -8.952 1.00 52.23 H new ATOM 0 HD2 PHE A 87 4.897 8.916 -6.971 1.00 53.33 H new ATOM 0 HE1 PHE A 87 3.996 4.655 -9.213 1.00 21.44 H new ATOM 0 HE2 PHE A 87 2.603 8.117 -7.207 1.00 33.33 H new ATOM 0 HZ PHE A 87 2.141 5.996 -8.338 1.00 63.24 H new ATOM 1210 N PRO A 88 10.387 6.708 -6.163 1.00 3.45 N ATOM 1211 CA PRO A 88 11.726 7.166 -5.808 1.00 63.43 C ATOM 1212 C PRO A 88 12.499 7.811 -6.953 1.00 12.33 C ATOM 1213 O PRO A 88 12.195 7.619 -8.144 1.00 30.43 O ATOM 1214 CB PRO A 88 12.432 5.882 -5.366 1.00 43.24 C ATOM 1215 CG PRO A 88 11.748 4.807 -6.124 1.00 60.51 C ATOM 1216 CD PRO A 88 10.313 5.224 -6.219 1.00 60.31 C ATOM 0 HA PRO A 88 11.672 7.949 -5.051 1.00 63.43 H new ATOM 0 HB2 PRO A 88 13.497 5.915 -5.596 1.00 43.24 H new ATOM 0 HB3 PRO A 88 12.342 5.729 -4.291 1.00 43.24 H new ATOM 0 HG2 PRO A 88 12.187 4.687 -7.115 1.00 60.51 H new ATOM 0 HG3 PRO A 88 11.844 3.848 -5.615 1.00 60.51 H new ATOM 0 HD2 PRO A 88 9.853 4.878 -7.145 1.00 60.31 H new ATOM 0 HD3 PRO A 88 9.721 4.819 -5.399 1.00 60.31 H new ATOM 1224 N ASN A 89 13.479 8.593 -6.577 1.00 15.44 N ATOM 1225 CA ASN A 89 14.408 9.182 -7.507 1.00 11.22 C ATOM 1226 C ASN A 89 15.688 8.393 -7.398 1.00 31.35 C ATOM 1227 O ASN A 89 15.906 7.731 -6.377 1.00 24.51 O ATOM 1228 CB ASN A 89 14.677 10.665 -7.176 1.00 5.20 C ATOM 1229 CG ASN A 89 13.446 11.548 -7.291 1.00 73.44 C ATOM 1230 OD1 ASN A 89 13.145 12.073 -8.357 1.00 20.14 O ATOM 1231 ND2 ASN A 89 12.750 11.746 -6.202 1.00 74.23 N ATOM 0 H ASN A 89 13.656 8.842 -5.604 1.00 15.44 H new ATOM 0 HA ASN A 89 13.998 9.151 -8.517 1.00 11.22 H new ATOM 0 HB2 ASN A 89 15.071 10.736 -6.162 1.00 5.20 H new ATOM 0 HB3 ASN A 89 15.449 11.044 -7.846 1.00 5.20 H new ATOM 0 HD21 ASN A 89 11.930 12.352 -6.224 1.00 74.23 H new ATOM 0 HD22 ASN A 89 13.027 11.294 -5.331 1.00 74.23 H new ATOM 1238 N GLU A 90 16.545 8.464 -8.400 1.00 73.11 N ATOM 1239 CA GLU A 90 17.792 7.685 -8.394 1.00 11.01 C ATOM 1240 C GLU A 90 18.739 8.132 -7.268 1.00 1.31 C ATOM 1241 O GLU A 90 19.669 7.414 -6.897 1.00 12.32 O ATOM 1242 CB GLU A 90 18.500 7.722 -9.754 1.00 70.43 C ATOM 1243 CG GLU A 90 18.888 9.108 -10.216 1.00 62.33 C ATOM 1244 CD GLU A 90 19.710 9.089 -11.470 1.00 0.10 C ATOM 1245 OE1 GLU A 90 20.931 8.864 -11.370 1.00 70.41 O ATOM 1246 OE2 GLU A 90 19.165 9.308 -12.564 1.00 43.01 O ATOM 0 H GLU A 90 16.412 9.046 -9.227 1.00 73.11 H new ATOM 0 HA GLU A 90 17.511 6.650 -8.200 1.00 11.01 H new ATOM 0 HB2 GLU A 90 19.397 7.105 -9.700 1.00 70.43 H new ATOM 0 HB3 GLU A 90 17.848 7.272 -10.502 1.00 70.43 H new ATOM 0 HG2 GLU A 90 17.986 9.696 -10.386 1.00 62.33 H new ATOM 0 HG3 GLU A 90 19.449 9.607 -9.426 1.00 62.33 H new ATOM 1253 N ASP A 91 18.488 9.321 -6.736 1.00 32.53 N ATOM 1254 CA ASP A 91 19.256 9.868 -5.614 1.00 42.23 C ATOM 1255 C ASP A 91 18.823 9.224 -4.283 1.00 23.05 C ATOM 1256 O ASP A 91 19.457 9.410 -3.250 1.00 53.12 O ATOM 1257 CB ASP A 91 19.038 11.397 -5.566 1.00 22.14 C ATOM 1258 CG ASP A 91 19.704 12.096 -4.399 1.00 14.24 C ATOM 1259 OD1 ASP A 91 20.933 12.330 -4.444 1.00 14.31 O ATOM 1260 OD2 ASP A 91 19.008 12.437 -3.420 1.00 43.41 O ATOM 0 H ASP A 91 17.746 9.938 -7.067 1.00 32.53 H new ATOM 0 HA ASP A 91 20.313 9.646 -5.759 1.00 42.23 H new ATOM 0 HB2 ASP A 91 19.411 11.832 -6.493 1.00 22.14 H new ATOM 0 HB3 ASP A 91 17.967 11.596 -5.528 1.00 22.14 H new ATOM 1265 N GLY A 92 17.766 8.426 -4.330 1.00 54.22 N ATOM 1266 CA GLY A 92 17.278 7.765 -3.125 1.00 11.15 C ATOM 1267 C GLY A 92 16.272 8.611 -2.373 1.00 72.30 C ATOM 1268 O GLY A 92 15.670 8.164 -1.388 1.00 52.44 O ATOM 0 H GLY A 92 17.235 8.221 -5.176 1.00 54.22 H new ATOM 0 HA2 GLY A 92 16.820 6.814 -3.395 1.00 11.15 H new ATOM 0 HA3 GLY A 92 18.120 7.539 -2.471 1.00 11.15 H new ATOM 1272 N SER A 93 16.087 9.821 -2.827 1.00 34.54 N ATOM 1273 CA SER A 93 15.159 10.717 -2.210 1.00 52.42 C ATOM 1274 C SER A 93 13.747 10.464 -2.736 1.00 62.32 C ATOM 1275 O SER A 93 13.537 10.261 -3.953 1.00 0.40 O ATOM 1276 CB SER A 93 15.600 12.158 -2.436 1.00 13.13 C ATOM 1277 OG SER A 93 16.890 12.376 -1.870 1.00 33.52 O ATOM 0 H SER A 93 16.576 10.209 -3.634 1.00 34.54 H new ATOM 0 HA SER A 93 15.142 10.538 -1.135 1.00 52.42 H new ATOM 0 HB2 SER A 93 15.623 12.375 -3.504 1.00 13.13 H new ATOM 0 HB3 SER A 93 14.879 12.841 -1.987 1.00 13.13 H new ATOM 0 HG SER A 93 17.566 12.352 -2.579 1.00 33.52 H new ATOM 1283 N LEU A 94 12.796 10.448 -1.836 1.00 1.53 N ATOM 1284 CA LEU A 94 11.421 10.188 -2.177 1.00 21.32 C ATOM 1285 C LEU A 94 10.663 11.479 -2.421 1.00 43.35 C ATOM 1286 O LEU A 94 10.237 12.169 -1.488 1.00 32.34 O ATOM 1287 CB LEU A 94 10.753 9.366 -1.098 1.00 74.01 C ATOM 1288 CG LEU A 94 11.353 7.993 -0.823 1.00 43.30 C ATOM 1289 CD1 LEU A 94 10.592 7.291 0.291 1.00 15.32 C ATOM 1290 CD2 LEU A 94 11.344 7.156 -2.088 1.00 60.44 C ATOM 0 H LEU A 94 12.955 10.616 -0.843 1.00 1.53 H new ATOM 0 HA LEU A 94 11.406 9.615 -3.104 1.00 21.32 H new ATOM 0 HB2 LEU A 94 10.772 9.939 -0.171 1.00 74.01 H new ATOM 0 HB3 LEU A 94 9.706 9.233 -1.369 1.00 74.01 H new ATOM 0 HG LEU A 94 12.386 8.122 -0.499 1.00 43.30 H new ATOM 0 HD11 LEU A 94 11.035 6.312 0.473 1.00 15.32 H new ATOM 0 HD12 LEU A 94 10.646 7.889 1.201 1.00 15.32 H new ATOM 0 HD13 LEU A 94 9.549 7.169 -0.002 1.00 15.32 H new ATOM 0 HD21 LEU A 94 11.775 6.177 -1.879 1.00 60.44 H new ATOM 0 HD22 LEU A 94 10.318 7.034 -2.436 1.00 60.44 H new ATOM 0 HD23 LEU A 94 11.932 7.655 -2.858 1.00 60.44 H new ATOM 1302 N GLN A 95 10.533 11.804 -3.664 1.00 50.10 N ATOM 1303 CA GLN A 95 9.907 13.020 -4.102 1.00 43.53 C ATOM 1304 C GLN A 95 9.235 12.742 -5.434 1.00 32.04 C ATOM 1305 O GLN A 95 9.451 11.667 -5.979 1.00 13.33 O ATOM 1306 CB GLN A 95 10.961 14.140 -4.175 1.00 30.21 C ATOM 1307 CG GLN A 95 10.444 15.529 -4.508 1.00 33.32 C ATOM 1308 CD GLN A 95 11.527 16.572 -4.373 1.00 31.11 C ATOM 1309 OE1 GLN A 95 11.709 17.150 -3.298 1.00 73.11 O ATOM 1310 NE2 GLN A 95 12.261 16.806 -5.421 1.00 42.10 N ATOM 0 H GLN A 95 10.867 11.218 -4.430 1.00 50.10 H new ATOM 0 HA GLN A 95 9.143 13.361 -3.403 1.00 43.53 H new ATOM 0 HB2 GLN A 95 11.477 14.188 -3.216 1.00 30.21 H new ATOM 0 HB3 GLN A 95 11.704 13.863 -4.923 1.00 30.21 H new ATOM 0 HG2 GLN A 95 10.054 15.538 -5.526 1.00 33.32 H new ATOM 0 HG3 GLN A 95 9.614 15.777 -3.846 1.00 33.32 H new ATOM 0 HE21 GLN A 95 12.080 16.308 -6.292 1.00 42.10 H new ATOM 0 HE22 GLN A 95 13.018 17.488 -5.371 1.00 42.10 H new ATOM 1319 N LYS A 96 8.421 13.703 -5.922 1.00 73.31 N ATOM 1320 CA LYS A 96 7.648 13.655 -7.203 1.00 2.41 C ATOM 1321 C LYS A 96 6.185 13.416 -6.975 1.00 61.43 C ATOM 1322 O LYS A 96 5.355 14.293 -7.245 1.00 53.42 O ATOM 1323 CB LYS A 96 8.196 12.679 -8.286 1.00 63.42 C ATOM 1324 CG LYS A 96 9.595 12.978 -8.821 1.00 71.35 C ATOM 1325 CD LYS A 96 10.059 11.892 -9.802 1.00 63.41 C ATOM 1326 CE LYS A 96 10.177 10.517 -9.121 1.00 44.21 C ATOM 1327 NZ LYS A 96 10.609 9.458 -10.060 1.00 3.23 N ATOM 0 H LYS A 96 8.271 14.577 -5.418 1.00 73.31 H new ATOM 0 HA LYS A 96 7.790 14.653 -7.617 1.00 2.41 H new ATOM 0 HB2 LYS A 96 8.197 11.672 -7.870 1.00 63.42 H new ATOM 0 HB3 LYS A 96 7.502 12.676 -9.126 1.00 63.42 H new ATOM 0 HG2 LYS A 96 9.597 13.947 -9.320 1.00 71.35 H new ATOM 0 HG3 LYS A 96 10.298 13.046 -7.991 1.00 71.35 H new ATOM 0 HD2 LYS A 96 9.355 11.827 -10.632 1.00 63.41 H new ATOM 0 HD3 LYS A 96 11.024 12.172 -10.224 1.00 63.41 H new ATOM 0 HE2 LYS A 96 10.889 10.582 -8.298 1.00 44.21 H new ATOM 0 HE3 LYS A 96 9.214 10.245 -8.689 1.00 44.21 H new ATOM 0 HZ1 LYS A 96 11.176 8.751 -9.549 1.00 3.23 H new ATOM 0 HZ2 LYS A 96 9.773 8.998 -10.473 1.00 3.23 H new ATOM 0 HZ3 LYS A 96 11.183 9.879 -10.818 1.00 3.23 H new ATOM 1341 N LYS A 97 5.857 12.261 -6.473 1.00 50.44 N ATOM 1342 CA LYS A 97 4.482 11.885 -6.315 1.00 2.13 C ATOM 1343 C LYS A 97 4.345 10.783 -5.288 1.00 15.10 C ATOM 1344 O LYS A 97 5.269 9.982 -5.095 1.00 74.31 O ATOM 1345 CB LYS A 97 3.928 11.441 -7.680 1.00 25.12 C ATOM 1346 CG LYS A 97 2.518 10.905 -7.674 1.00 65.23 C ATOM 1347 CD LYS A 97 2.027 10.620 -9.088 1.00 31.31 C ATOM 1348 CE LYS A 97 3.011 9.800 -9.915 1.00 31.11 C ATOM 1349 NZ LYS A 97 2.524 9.552 -11.287 1.00 11.10 N ATOM 0 H LYS A 97 6.529 11.558 -6.164 1.00 50.44 H new ATOM 0 HA LYS A 97 3.908 12.739 -5.955 1.00 2.13 H new ATOM 0 HB2 LYS A 97 3.971 12.290 -8.362 1.00 25.12 H new ATOM 0 HB3 LYS A 97 4.587 10.673 -8.086 1.00 25.12 H new ATOM 0 HG2 LYS A 97 2.477 9.991 -7.082 1.00 65.23 H new ATOM 0 HG3 LYS A 97 1.855 11.625 -7.195 1.00 65.23 H new ATOM 0 HD2 LYS A 97 1.077 10.089 -9.035 1.00 31.31 H new ATOM 0 HD3 LYS A 97 1.836 11.565 -9.596 1.00 31.31 H new ATOM 0 HE2 LYS A 97 3.967 10.322 -9.961 1.00 31.11 H new ATOM 0 HE3 LYS A 97 3.192 8.847 -9.419 1.00 31.11 H new ATOM 0 HZ1 LYS A 97 3.227 8.991 -11.809 1.00 11.10 H new ATOM 0 HZ2 LYS A 97 1.625 9.030 -11.247 1.00 11.10 H new ATOM 0 HZ3 LYS A 97 2.376 10.460 -11.772 1.00 11.10 H new ATOM 1363 N LEU A 98 3.220 10.769 -4.621 1.00 13.35 N ATOM 1364 CA LEU A 98 2.901 9.769 -3.652 1.00 51.23 C ATOM 1365 C LEU A 98 1.408 9.459 -3.766 1.00 71.41 C ATOM 1366 O LEU A 98 0.587 10.376 -3.923 1.00 65.32 O ATOM 1367 CB LEU A 98 3.301 10.280 -2.231 1.00 44.53 C ATOM 1368 CG LEU A 98 3.084 9.352 -1.004 1.00 63.54 C ATOM 1369 CD1 LEU A 98 3.763 9.939 0.187 1.00 41.23 C ATOM 1370 CD2 LEU A 98 1.629 9.221 -0.658 1.00 65.53 C ATOM 0 H LEU A 98 2.489 11.470 -4.744 1.00 13.35 H new ATOM 0 HA LEU A 98 3.456 8.848 -3.827 1.00 51.23 H new ATOM 0 HB2 LEU A 98 4.359 10.541 -2.262 1.00 44.53 H new ATOM 0 HB3 LEU A 98 2.750 11.202 -2.047 1.00 44.53 H new ATOM 0 HG LEU A 98 3.489 8.374 -1.263 1.00 63.54 H new ATOM 0 HD11 LEU A 98 3.612 9.289 1.049 1.00 41.23 H new ATOM 0 HD12 LEU A 98 4.830 10.034 -0.013 1.00 41.23 H new ATOM 0 HD13 LEU A 98 3.344 10.923 0.397 1.00 41.23 H new ATOM 0 HD21 LEU A 98 1.518 8.564 0.205 1.00 65.53 H new ATOM 0 HD22 LEU A 98 1.221 10.204 -0.421 1.00 65.53 H new ATOM 0 HD23 LEU A 98 1.090 8.800 -1.506 1.00 65.53 H new ATOM 1382 N LYS A 99 1.073 8.190 -3.722 1.00 52.21 N ATOM 1383 CA LYS A 99 -0.311 7.741 -3.755 1.00 65.45 C ATOM 1384 C LYS A 99 -0.604 6.923 -2.521 1.00 42.12 C ATOM 1385 O LYS A 99 -0.025 5.867 -2.336 1.00 75.13 O ATOM 1386 CB LYS A 99 -0.589 6.859 -4.982 1.00 51.22 C ATOM 1387 CG LYS A 99 -0.557 7.547 -6.329 1.00 63.51 C ATOM 1388 CD LYS A 99 -0.744 6.516 -7.443 1.00 51.05 C ATOM 1389 CE LYS A 99 -0.781 7.137 -8.834 1.00 63.12 C ATOM 1390 NZ LYS A 99 -1.962 8.001 -9.044 1.00 51.22 N ATOM 0 H LYS A 99 1.752 7.432 -3.662 1.00 52.21 H new ATOM 0 HA LYS A 99 -0.943 8.628 -3.801 1.00 65.45 H new ATOM 0 HB2 LYS A 99 0.143 6.051 -4.994 1.00 51.22 H new ATOM 0 HB3 LYS A 99 -1.569 6.399 -4.857 1.00 51.22 H new ATOM 0 HG2 LYS A 99 -1.344 8.299 -6.382 1.00 63.51 H new ATOM 0 HG3 LYS A 99 0.392 8.068 -6.459 1.00 63.51 H new ATOM 0 HD2 LYS A 99 0.068 5.790 -7.398 1.00 51.05 H new ATOM 0 HD3 LYS A 99 -1.671 5.969 -7.271 1.00 51.05 H new ATOM 0 HE2 LYS A 99 0.125 7.723 -8.989 1.00 63.12 H new ATOM 0 HE3 LYS A 99 -0.779 6.344 -9.581 1.00 63.12 H new ATOM 0 HZ1 LYS A 99 -2.451 7.714 -9.916 1.00 51.22 H new ATOM 0 HZ2 LYS A 99 -2.610 7.906 -8.236 1.00 51.22 H new ATOM 0 HZ3 LYS A 99 -1.657 8.992 -9.128 1.00 51.22 H new ATOM 1404 N VAL A 100 -1.478 7.392 -1.690 1.00 31.43 N ATOM 1405 CA VAL A 100 -1.869 6.630 -0.528 1.00 63.03 C ATOM 1406 C VAL A 100 -3.017 5.743 -0.922 1.00 33.51 C ATOM 1407 O VAL A 100 -3.973 6.217 -1.505 1.00 23.42 O ATOM 1408 CB VAL A 100 -2.308 7.528 0.663 1.00 50.51 C ATOM 1409 CG1 VAL A 100 -2.734 6.676 1.847 1.00 13.21 C ATOM 1410 CG2 VAL A 100 -1.187 8.443 1.082 1.00 54.52 C ATOM 0 H VAL A 100 -1.939 8.297 -1.786 1.00 31.43 H new ATOM 0 HA VAL A 100 -1.005 6.056 -0.193 1.00 63.03 H new ATOM 0 HB VAL A 100 -3.154 8.130 0.333 1.00 50.51 H new ATOM 0 HG11 VAL A 100 -3.038 7.323 2.670 1.00 13.21 H new ATOM 0 HG12 VAL A 100 -3.571 6.042 1.556 1.00 13.21 H new ATOM 0 HG13 VAL A 100 -1.899 6.052 2.165 1.00 13.21 H new ATOM 0 HG21 VAL A 100 -1.516 9.062 1.917 1.00 54.52 H new ATOM 0 HG22 VAL A 100 -0.327 7.848 1.388 1.00 54.52 H new ATOM 0 HG23 VAL A 100 -0.906 9.082 0.245 1.00 54.52 H new ATOM 1420 N TRP A 101 -2.903 4.485 -0.645 1.00 71.03 N ATOM 1421 CA TRP A 101 -3.920 3.522 -0.956 1.00 1.15 C ATOM 1422 C TRP A 101 -4.428 2.897 0.329 1.00 54.15 C ATOM 1423 O TRP A 101 -3.652 2.329 1.108 1.00 40.41 O ATOM 1424 CB TRP A 101 -3.349 2.403 -1.850 1.00 34.15 C ATOM 1425 CG TRP A 101 -2.921 2.832 -3.226 1.00 31.10 C ATOM 1426 CD1 TRP A 101 -1.724 3.382 -3.588 1.00 1.41 C ATOM 1427 CD2 TRP A 101 -3.688 2.717 -4.428 1.00 31.15 C ATOM 1428 NE1 TRP A 101 -1.706 3.621 -4.941 1.00 2.22 N ATOM 1429 CE2 TRP A 101 -2.902 3.223 -5.478 1.00 60.23 C ATOM 1430 CE3 TRP A 101 -4.969 2.237 -4.717 1.00 2.13 C ATOM 1431 CZ2 TRP A 101 -3.353 3.263 -6.792 1.00 73.45 C ATOM 1432 CZ3 TRP A 101 -5.417 2.276 -6.022 1.00 44.40 C ATOM 1433 CH2 TRP A 101 -4.611 2.786 -7.046 1.00 30.21 C ATOM 0 H TRP A 101 -2.084 4.085 -0.186 1.00 71.03 H new ATOM 0 HA TRP A 101 -4.729 4.029 -1.482 1.00 1.15 H new ATOM 0 HB2 TRP A 101 -2.492 1.958 -1.344 1.00 34.15 H new ATOM 0 HB3 TRP A 101 -4.102 1.621 -1.949 1.00 34.15 H new ATOM 0 HD1 TRP A 101 -0.911 3.597 -2.910 1.00 1.41 H new ATOM 0 HE1 TRP A 101 -0.929 4.028 -5.461 1.00 2.22 H new ATOM 0 HE3 TRP A 101 -5.597 1.842 -3.932 1.00 2.13 H new ATOM 0 HZ2 TRP A 101 -2.733 3.656 -7.584 1.00 73.45 H new ATOM 0 HZ3 TRP A 101 -6.405 1.907 -6.256 1.00 44.40 H new ATOM 0 HH2 TRP A 101 -4.989 2.804 -8.058 1.00 30.21 H new ATOM 1444 N PHE A 102 -5.695 2.974 0.555 1.00 11.31 N ATOM 1445 CA PHE A 102 -6.241 2.332 1.693 1.00 33.54 C ATOM 1446 C PHE A 102 -6.905 1.081 1.198 1.00 31.13 C ATOM 1447 O PHE A 102 -7.891 1.143 0.446 1.00 64.22 O ATOM 1448 CB PHE A 102 -7.269 3.208 2.429 1.00 44.43 C ATOM 1449 CG PHE A 102 -7.729 2.580 3.733 1.00 62.15 C ATOM 1450 CD1 PHE A 102 -6.977 2.731 4.897 1.00 52.34 C ATOM 1451 CD2 PHE A 102 -8.895 1.825 3.793 1.00 33.31 C ATOM 1452 CE1 PHE A 102 -7.381 2.147 6.083 1.00 33.21 C ATOM 1453 CE2 PHE A 102 -9.297 1.237 4.980 1.00 52.25 C ATOM 1454 CZ PHE A 102 -8.542 1.400 6.124 1.00 35.11 C ATOM 0 H PHE A 102 -6.365 3.472 -0.031 1.00 11.31 H new ATOM 0 HA PHE A 102 -5.447 2.125 2.410 1.00 33.54 H new ATOM 0 HB2 PHE A 102 -6.831 4.185 2.633 1.00 44.43 H new ATOM 0 HB3 PHE A 102 -8.131 3.373 1.783 1.00 44.43 H new ATOM 0 HD1 PHE A 102 -6.067 3.312 4.872 1.00 52.34 H new ATOM 0 HD2 PHE A 102 -9.494 1.696 2.904 1.00 33.31 H new ATOM 0 HE1 PHE A 102 -6.789 2.275 6.977 1.00 33.21 H new ATOM 0 HE2 PHE A 102 -10.203 0.650 5.011 1.00 52.25 H new ATOM 0 HZ PHE A 102 -8.859 0.944 7.050 1.00 35.11 H new ATOM 1464 N ARG A 103 -6.349 -0.040 1.572 1.00 60.04 N ATOM 1465 CA ARG A 103 -6.838 -1.311 1.128 1.00 13.14 C ATOM 1466 C ARG A 103 -8.095 -1.610 1.935 1.00 33.03 C ATOM 1467 O ARG A 103 -8.041 -1.754 3.139 1.00 24.40 O ATOM 1468 CB ARG A 103 -5.731 -2.377 1.354 1.00 4.13 C ATOM 1469 CG ARG A 103 -5.814 -3.664 0.503 1.00 23.54 C ATOM 1470 CD ARG A 103 -7.061 -4.510 0.733 1.00 70.23 C ATOM 1471 NE ARG A 103 -7.059 -5.685 -0.161 1.00 33.22 N ATOM 1472 CZ ARG A 103 -8.056 -6.575 -0.289 1.00 33.33 C ATOM 1473 NH1 ARG A 103 -9.193 -6.408 0.356 1.00 31.43 N ATOM 1474 NH2 ARG A 103 -7.920 -7.606 -1.116 1.00 1.02 N ATOM 0 H ARG A 103 -5.543 -0.094 2.194 1.00 60.04 H new ATOM 0 HA ARG A 103 -7.085 -1.316 0.066 1.00 13.14 H new ATOM 0 HB2 ARG A 103 -4.765 -1.908 1.166 1.00 4.13 H new ATOM 0 HB3 ARG A 103 -5.747 -2.664 2.405 1.00 4.13 H new ATOM 0 HG2 ARG A 103 -5.770 -3.388 -0.551 1.00 23.54 H new ATOM 0 HG3 ARG A 103 -4.936 -4.275 0.710 1.00 23.54 H new ATOM 0 HD2 ARG A 103 -7.100 -4.836 1.772 1.00 70.23 H new ATOM 0 HD3 ARG A 103 -7.953 -3.910 0.553 1.00 70.23 H new ATOM 0 HE ARG A 103 -6.227 -5.834 -0.732 1.00 33.22 H new ATOM 0 HH11 ARG A 103 -9.322 -5.596 0.960 1.00 31.43 H new ATOM 0 HH12 ARG A 103 -9.944 -7.091 0.251 1.00 31.43 H new ATOM 0 HH21 ARG A 103 -7.060 -7.720 -1.652 1.00 1.02 H new ATOM 0 HH22 ARG A 103 -8.676 -8.284 -1.215 1.00 1.02 H new ATOM 1488 N ILE A 104 -9.207 -1.628 1.267 1.00 44.53 N ATOM 1489 CA ILE A 104 -10.488 -1.855 1.885 1.00 33.43 C ATOM 1490 C ILE A 104 -10.642 -3.338 2.284 1.00 11.10 C ATOM 1491 O ILE A 104 -10.212 -4.218 1.557 1.00 2.42 O ATOM 1492 CB ILE A 104 -11.591 -1.424 0.885 1.00 60.04 C ATOM 1493 CG1 ILE A 104 -11.398 0.057 0.542 1.00 32.24 C ATOM 1494 CG2 ILE A 104 -12.987 -1.668 1.437 1.00 52.32 C ATOM 1495 CD1 ILE A 104 -12.337 0.568 -0.508 1.00 14.31 C ATOM 0 H ILE A 104 -9.257 -1.483 0.259 1.00 44.53 H new ATOM 0 HA ILE A 104 -10.575 -1.267 2.799 1.00 33.43 H new ATOM 0 HB ILE A 104 -11.499 -2.030 -0.016 1.00 60.04 H new ATOM 0 HG12 ILE A 104 -11.526 0.649 1.448 1.00 32.24 H new ATOM 0 HG13 ILE A 104 -10.373 0.210 0.204 1.00 32.24 H new ATOM 0 HG21 ILE A 104 -13.729 -1.352 0.704 1.00 52.32 H new ATOM 0 HG22 ILE A 104 -13.115 -2.730 1.647 1.00 52.32 H new ATOM 0 HG23 ILE A 104 -13.120 -1.098 2.356 1.00 52.32 H new ATOM 0 HD11 ILE A 104 -12.136 1.623 -0.693 1.00 14.31 H new ATOM 0 HD12 ILE A 104 -12.194 0.004 -1.430 1.00 14.31 H new ATOM 0 HD13 ILE A 104 -13.365 0.449 -0.166 1.00 14.31 H new ATOM 1507 N PRO A 105 -11.208 -3.626 3.472 1.00 14.11 N ATOM 1508 CA PRO A 105 -11.427 -4.999 3.926 1.00 41.21 C ATOM 1509 C PRO A 105 -12.500 -5.713 3.098 1.00 72.31 C ATOM 1510 O PRO A 105 -13.338 -5.067 2.445 1.00 23.53 O ATOM 1511 CB PRO A 105 -11.898 -4.829 5.371 1.00 4.24 C ATOM 1512 CG PRO A 105 -12.489 -3.477 5.403 1.00 73.32 C ATOM 1513 CD PRO A 105 -11.655 -2.649 4.473 1.00 64.54 C ATOM 0 HA PRO A 105 -10.529 -5.609 3.828 1.00 41.21 H new ATOM 0 HB2 PRO A 105 -12.629 -5.590 5.643 1.00 4.24 H new ATOM 0 HB3 PRO A 105 -11.069 -4.918 6.073 1.00 4.24 H new ATOM 0 HG2 PRO A 105 -13.531 -3.497 5.082 1.00 73.32 H new ATOM 0 HG3 PRO A 105 -12.474 -3.067 6.413 1.00 73.32 H new ATOM 0 HD2 PRO A 105 -12.234 -1.844 4.021 1.00 64.54 H new ATOM 0 HD3 PRO A 105 -10.814 -2.186 4.989 1.00 64.54 H new ATOM 1521 N ASN A 106 -12.487 -7.035 3.178 1.00 74.22 N ATOM 1522 CA ASN A 106 -13.377 -7.949 2.419 1.00 44.00 C ATOM 1523 C ASN A 106 -14.858 -7.525 2.557 1.00 33.05 C ATOM 1524 O ASN A 106 -15.640 -7.640 1.612 1.00 20.24 O ATOM 1525 CB ASN A 106 -13.160 -9.395 2.980 1.00 51.40 C ATOM 1526 CG ASN A 106 -13.865 -10.565 2.239 1.00 45.54 C ATOM 1527 OD1 ASN A 106 -14.997 -10.341 1.637 1.00 11.23 O flip ATOM 1528 ND2 ASN A 106 -13.354 -11.687 2.233 1.00 74.24 N flip ATOM 0 H ASN A 106 -11.841 -7.534 3.789 1.00 74.22 H new ATOM 0 HA ASN A 106 -13.134 -7.912 1.357 1.00 44.00 H new ATOM 0 HB2 ASN A 106 -12.089 -9.597 2.985 1.00 51.40 H new ATOM 0 HB3 ASN A 106 -13.491 -9.406 4.018 1.00 51.40 H new ATOM 0 HD21 ASN A 106 -12.466 -11.846 2.710 1.00 74.24 H new ATOM 0 HD22 ASN A 106 -13.819 -12.457 1.751 1.00 74.24 H new ATOM 1535 N GLN A 107 -15.206 -7.025 3.722 1.00 15.41 N ATOM 1536 CA GLN A 107 -16.578 -6.618 4.050 1.00 72.52 C ATOM 1537 C GLN A 107 -17.081 -5.501 3.129 1.00 22.04 C ATOM 1538 O GLN A 107 -18.214 -5.531 2.661 1.00 20.12 O ATOM 1539 CB GLN A 107 -16.687 -6.128 5.513 1.00 22.52 C ATOM 1540 CG GLN A 107 -16.325 -7.141 6.611 1.00 31.00 C ATOM 1541 CD GLN A 107 -14.869 -7.572 6.588 1.00 72.20 C ATOM 1542 OE1 GLN A 107 -14.513 -8.549 5.944 1.00 63.53 O ATOM 1543 NE2 GLN A 107 -14.022 -6.835 7.246 1.00 13.00 N ATOM 0 H GLN A 107 -14.545 -6.883 4.486 1.00 15.41 H new ATOM 0 HA GLN A 107 -17.196 -7.505 3.910 1.00 72.52 H new ATOM 0 HB2 GLN A 107 -16.042 -5.257 5.629 1.00 22.52 H new ATOM 0 HB3 GLN A 107 -17.710 -5.793 5.684 1.00 22.52 H new ATOM 0 HG2 GLN A 107 -16.550 -6.705 7.584 1.00 31.00 H new ATOM 0 HG3 GLN A 107 -16.957 -8.022 6.503 1.00 31.00 H new ATOM 0 HE21 GLN A 107 -14.352 -6.027 7.773 1.00 13.00 H new ATOM 0 HE22 GLN A 107 -13.029 -7.066 7.234 1.00 13.00 H new ATOM 1552 N PHE A 108 -16.235 -4.531 2.872 1.00 2.14 N ATOM 1553 CA PHE A 108 -16.628 -3.362 2.099 1.00 63.11 C ATOM 1554 C PHE A 108 -16.199 -3.412 0.638 1.00 73.44 C ATOM 1555 O PHE A 108 -16.490 -2.503 -0.104 1.00 13.43 O ATOM 1556 CB PHE A 108 -16.158 -2.057 2.756 1.00 51.43 C ATOM 1557 CG PHE A 108 -16.835 -1.718 4.055 1.00 3.30 C ATOM 1558 CD1 PHE A 108 -18.092 -1.131 4.058 1.00 14.14 C ATOM 1559 CD2 PHE A 108 -16.217 -1.963 5.269 1.00 44.22 C ATOM 1560 CE1 PHE A 108 -18.717 -0.798 5.243 1.00 13.40 C ATOM 1561 CE2 PHE A 108 -16.838 -1.632 6.458 1.00 2.31 C ATOM 1562 CZ PHE A 108 -18.089 -1.049 6.444 1.00 62.30 C ATOM 0 H PHE A 108 -15.264 -4.523 3.186 1.00 2.14 H new ATOM 0 HA PHE A 108 -17.718 -3.380 2.099 1.00 63.11 H new ATOM 0 HB2 PHE A 108 -15.084 -2.122 2.930 1.00 51.43 H new ATOM 0 HB3 PHE A 108 -16.318 -1.237 2.056 1.00 51.43 H new ATOM 0 HD1 PHE A 108 -18.589 -0.932 3.120 1.00 14.14 H new ATOM 0 HD2 PHE A 108 -15.238 -2.418 5.287 1.00 44.22 H new ATOM 0 HE1 PHE A 108 -19.696 -0.342 5.229 1.00 13.40 H new ATOM 0 HE2 PHE A 108 -16.345 -1.829 7.398 1.00 2.31 H new ATOM 0 HZ PHE A 108 -18.575 -0.790 7.373 1.00 62.30 H new ATOM 1572 N GLN A 109 -15.504 -4.455 0.228 1.00 52.41 N ATOM 1573 CA GLN A 109 -15.023 -4.521 -1.161 1.00 33.43 C ATOM 1574 C GLN A 109 -16.134 -4.555 -2.215 1.00 55.34 C ATOM 1575 O GLN A 109 -15.929 -4.091 -3.344 1.00 10.35 O ATOM 1576 CB GLN A 109 -13.995 -5.627 -1.386 1.00 63.12 C ATOM 1577 CG GLN A 109 -12.632 -5.391 -0.736 1.00 33.22 C ATOM 1578 CD GLN A 109 -11.753 -4.318 -1.415 1.00 2.03 C ATOM 1579 OE1 GLN A 109 -10.552 -4.406 -1.362 1.00 61.00 O ATOM 1580 NE2 GLN A 109 -12.334 -3.337 -2.079 1.00 53.05 N ATOM 0 H GLN A 109 -15.258 -5.255 0.810 1.00 52.41 H new ATOM 0 HA GLN A 109 -14.510 -3.571 -1.308 1.00 33.43 H new ATOM 0 HB2 GLN A 109 -14.404 -6.563 -1.006 1.00 63.12 H new ATOM 0 HB3 GLN A 109 -13.851 -5.754 -2.459 1.00 63.12 H new ATOM 0 HG2 GLN A 109 -12.789 -5.104 0.304 1.00 33.22 H new ATOM 0 HG3 GLN A 109 -12.084 -6.333 -0.727 1.00 33.22 H new ATOM 0 HE21 GLN A 109 -13.352 -3.277 -2.114 1.00 53.05 H new ATOM 0 HE22 GLN A 109 -11.765 -2.638 -2.558 1.00 53.05 H new ATOM 1589 N GLY A 110 -17.288 -5.091 -1.865 1.00 52.54 N ATOM 1590 CA GLY A 110 -18.382 -5.133 -2.814 1.00 11.13 C ATOM 1591 C GLY A 110 -19.044 -3.785 -2.972 1.00 21.24 C ATOM 1592 O GLY A 110 -19.401 -3.378 -4.082 1.00 3.01 O ATOM 0 H GLY A 110 -17.490 -5.495 -0.950 1.00 52.54 H new ATOM 0 HA2 GLY A 110 -18.010 -5.470 -3.782 1.00 11.13 H new ATOM 0 HA3 GLY A 110 -19.121 -5.864 -2.484 1.00 11.13 H new ATOM 1596 N SER A 111 -19.188 -3.088 -1.879 1.00 52.52 N ATOM 1597 CA SER A 111 -19.767 -1.772 -1.861 1.00 74.31 C ATOM 1598 C SER A 111 -19.136 -0.959 -0.730 1.00 62.13 C ATOM 1599 O SER A 111 -19.541 -1.071 0.430 1.00 63.23 O ATOM 1600 CB SER A 111 -21.295 -1.863 -1.697 1.00 43.04 C ATOM 1601 OG SER A 111 -21.882 -2.604 -2.776 1.00 14.33 O ATOM 0 H SER A 111 -18.901 -3.424 -0.959 1.00 52.52 H new ATOM 0 HA SER A 111 -19.566 -1.270 -2.807 1.00 74.31 H new ATOM 0 HB2 SER A 111 -21.535 -2.343 -0.748 1.00 43.04 H new ATOM 0 HB3 SER A 111 -21.722 -0.861 -1.664 1.00 43.04 H new ATOM 0 HG SER A 111 -22.853 -2.651 -2.651 1.00 14.33 H new ATOM 1607 N PRO A 112 -18.098 -0.184 -1.039 1.00 53.42 N ATOM 1608 CA PRO A 112 -17.392 0.604 -0.045 1.00 51.23 C ATOM 1609 C PRO A 112 -18.074 1.939 0.199 1.00 13.30 C ATOM 1610 O PRO A 112 -18.861 2.399 -0.644 1.00 74.23 O ATOM 1611 CB PRO A 112 -16.025 0.813 -0.695 1.00 65.31 C ATOM 1612 CG PRO A 112 -16.309 0.857 -2.158 1.00 74.20 C ATOM 1613 CD PRO A 112 -17.521 -0.014 -2.390 1.00 22.45 C ATOM 0 HA PRO A 112 -17.350 0.118 0.930 1.00 51.23 H new ATOM 0 HB2 PRO A 112 -15.560 1.738 -0.353 1.00 65.31 H new ATOM 0 HB3 PRO A 112 -15.340 0.002 -0.448 1.00 65.31 H new ATOM 0 HG2 PRO A 112 -16.499 1.879 -2.485 1.00 74.20 H new ATOM 0 HG3 PRO A 112 -15.455 0.493 -2.729 1.00 74.20 H new ATOM 0 HD2 PRO A 112 -18.229 0.459 -3.071 1.00 22.45 H new ATOM 0 HD3 PRO A 112 -17.246 -0.972 -2.831 1.00 22.45 H new ATOM 1621 N PRO A 113 -17.829 2.568 1.362 1.00 13.21 N ATOM 1622 CA PRO A 113 -18.352 3.890 1.645 1.00 55.33 C ATOM 1623 C PRO A 113 -17.887 4.870 0.581 1.00 42.42 C ATOM 1624 O PRO A 113 -16.696 4.903 0.224 1.00 11.43 O ATOM 1625 CB PRO A 113 -17.733 4.245 3.002 1.00 12.14 C ATOM 1626 CG PRO A 113 -17.409 2.934 3.622 1.00 15.03 C ATOM 1627 CD PRO A 113 -17.034 2.035 2.488 1.00 0.22 C ATOM 0 HA PRO A 113 -19.441 3.926 1.656 1.00 55.33 H new ATOM 0 HB2 PRO A 113 -16.840 4.858 2.882 1.00 12.14 H new ATOM 0 HB3 PRO A 113 -18.429 4.814 3.619 1.00 12.14 H new ATOM 0 HG2 PRO A 113 -16.590 3.029 4.334 1.00 15.03 H new ATOM 0 HG3 PRO A 113 -18.264 2.538 4.170 1.00 15.03 H new ATOM 0 HD2 PRO A 113 -15.965 2.073 2.280 1.00 0.22 H new ATOM 0 HD3 PRO A 113 -17.281 0.995 2.699 1.00 0.22 H new ATOM 1635 N ALA A 114 -18.806 5.637 0.059 1.00 32.41 N ATOM 1636 CA ALA A 114 -18.483 6.583 -0.989 1.00 73.24 C ATOM 1637 C ALA A 114 -17.562 7.677 -0.452 1.00 0.24 C ATOM 1638 O ALA A 114 -17.718 8.126 0.708 1.00 10.35 O ATOM 1639 CB ALA A 114 -19.747 7.167 -1.618 1.00 41.34 C ATOM 0 H ALA A 114 -19.787 5.630 0.339 1.00 32.41 H new ATOM 0 HA ALA A 114 -17.950 6.053 -1.779 1.00 73.24 H new ATOM 0 HB1 ALA A 114 -19.471 7.873 -2.401 1.00 41.34 H new ATOM 0 HB2 ALA A 114 -20.344 6.363 -2.049 1.00 41.34 H new ATOM 0 HB3 ALA A 114 -20.329 7.682 -0.854 1.00 41.34 H new ATOM 1645 N PRO A 115 -16.569 8.093 -1.258 1.00 33.33 N ATOM 1646 CA PRO A 115 -15.617 9.104 -0.857 1.00 63.32 C ATOM 1647 C PRO A 115 -16.254 10.487 -0.777 1.00 42.51 C ATOM 1648 O PRO A 115 -16.483 11.150 -1.787 1.00 12.44 O ATOM 1649 CB PRO A 115 -14.530 9.048 -1.930 1.00 24.14 C ATOM 1650 CG PRO A 115 -15.206 8.487 -3.136 1.00 21.32 C ATOM 1651 CD PRO A 115 -16.313 7.601 -2.632 1.00 70.33 C ATOM 0 HA PRO A 115 -15.223 8.920 0.143 1.00 63.32 H new ATOM 0 HB2 PRO A 115 -14.123 10.039 -2.131 1.00 24.14 H new ATOM 0 HB3 PRO A 115 -13.697 8.419 -1.616 1.00 24.14 H new ATOM 0 HG2 PRO A 115 -15.603 9.284 -3.764 1.00 21.32 H new ATOM 0 HG3 PRO A 115 -14.503 7.920 -3.746 1.00 21.32 H new ATOM 0 HD2 PRO A 115 -17.203 7.680 -3.256 1.00 70.33 H new ATOM 0 HD3 PRO A 115 -16.016 6.552 -2.632 1.00 70.33 H new ATOM 1659 N SER A 116 -16.545 10.889 0.429 1.00 41.23 N ATOM 1660 CA SER A 116 -17.203 12.134 0.741 1.00 14.12 C ATOM 1661 C SER A 116 -16.223 13.316 0.737 1.00 72.43 C ATOM 1662 O SER A 116 -16.594 14.466 1.024 1.00 41.50 O ATOM 1663 CB SER A 116 -17.818 11.949 2.097 1.00 4.30 C ATOM 1664 OG SER A 116 -16.852 11.366 2.957 1.00 71.53 O ATOM 0 H SER A 116 -16.322 10.338 1.258 1.00 41.23 H new ATOM 0 HA SER A 116 -17.955 12.372 -0.011 1.00 14.12 H new ATOM 0 HB2 SER A 116 -18.150 12.908 2.496 1.00 4.30 H new ATOM 0 HB3 SER A 116 -18.698 11.310 2.029 1.00 4.30 H new ATOM 0 HG SER A 116 -16.953 11.734 3.859 1.00 71.53 H new ATOM 1670 N ASP A 117 -14.992 13.024 0.416 1.00 73.22 N ATOM 1671 CA ASP A 117 -13.944 14.008 0.348 1.00 31.32 C ATOM 1672 C ASP A 117 -13.507 14.143 -1.097 1.00 54.12 C ATOM 1673 O ASP A 117 -13.641 13.193 -1.873 1.00 52.22 O ATOM 1674 CB ASP A 117 -12.779 13.595 1.241 1.00 61.12 C ATOM 1675 CG ASP A 117 -11.633 14.564 1.200 1.00 34.33 C ATOM 1676 OD1 ASP A 117 -10.757 14.433 0.323 1.00 74.51 O ATOM 1677 OD2 ASP A 117 -11.607 15.494 2.034 1.00 22.35 O ATOM 0 H ASP A 117 -14.683 12.079 0.190 1.00 73.22 H new ATOM 0 HA ASP A 117 -14.305 14.972 0.705 1.00 31.32 H new ATOM 0 HB2 ASP A 117 -13.132 13.502 2.268 1.00 61.12 H new ATOM 0 HB3 ASP A 117 -12.426 12.610 0.935 1.00 61.12 H new ATOM 1682 N GLU A 118 -13.002 15.297 -1.471 1.00 44.41 N ATOM 1683 CA GLU A 118 -12.669 15.541 -2.856 1.00 64.15 C ATOM 1684 C GLU A 118 -11.262 15.096 -3.283 1.00 51.41 C ATOM 1685 O GLU A 118 -10.975 15.030 -4.480 1.00 30.43 O ATOM 1686 CB GLU A 118 -13.015 16.988 -3.282 1.00 70.44 C ATOM 1687 CG GLU A 118 -12.364 18.118 -2.460 1.00 33.02 C ATOM 1688 CD GLU A 118 -10.865 18.189 -2.602 1.00 2.32 C ATOM 1689 OE1 GLU A 118 -10.386 18.649 -3.659 1.00 32.42 O ATOM 1690 OE2 GLU A 118 -10.142 17.794 -1.667 1.00 15.21 O ATOM 0 H GLU A 118 -12.814 16.076 -0.840 1.00 44.41 H new ATOM 0 HA GLU A 118 -13.317 14.873 -3.424 1.00 64.15 H new ATOM 0 HB2 GLU A 118 -12.727 17.115 -4.326 1.00 70.44 H new ATOM 0 HB3 GLU A 118 -14.097 17.109 -3.233 1.00 70.44 H new ATOM 0 HG2 GLU A 118 -12.794 19.071 -2.767 1.00 33.02 H new ATOM 0 HG3 GLU A 118 -12.614 17.979 -1.408 1.00 33.02 H new ATOM 1697 N SER A 119 -10.402 14.790 -2.348 1.00 54.14 N ATOM 1698 CA SER A 119 -9.065 14.358 -2.702 1.00 53.25 C ATOM 1699 C SER A 119 -8.936 12.847 -2.686 1.00 73.45 C ATOM 1700 O SER A 119 -8.126 12.284 -3.423 1.00 72.11 O ATOM 1701 CB SER A 119 -8.027 14.971 -1.797 1.00 54.35 C ATOM 1702 OG SER A 119 -7.924 16.380 -1.959 1.00 62.12 O ATOM 0 H SER A 119 -10.594 14.829 -1.347 1.00 54.14 H new ATOM 0 HA SER A 119 -8.888 14.705 -3.720 1.00 53.25 H new ATOM 0 HB2 SER A 119 -8.276 14.745 -0.760 1.00 54.35 H new ATOM 0 HB3 SER A 119 -7.058 14.514 -1.999 1.00 54.35 H new ATOM 0 HG SER A 119 -8.714 16.812 -1.573 1.00 62.12 H new ATOM 1708 N VAL A 120 -9.715 12.190 -1.866 1.00 63.13 N ATOM 1709 CA VAL A 120 -9.648 10.747 -1.811 1.00 13.11 C ATOM 1710 C VAL A 120 -10.700 10.159 -2.721 1.00 60.42 C ATOM 1711 O VAL A 120 -11.870 10.536 -2.671 1.00 53.40 O ATOM 1712 CB VAL A 120 -9.735 10.166 -0.355 1.00 11.21 C ATOM 1713 CG1 VAL A 120 -10.978 10.632 0.362 1.00 12.13 C ATOM 1714 CG2 VAL A 120 -9.662 8.646 -0.363 1.00 22.15 C ATOM 0 H VAL A 120 -10.393 12.619 -1.236 1.00 63.13 H new ATOM 0 HA VAL A 120 -8.661 10.452 -2.166 1.00 13.11 H new ATOM 0 HB VAL A 120 -8.873 10.549 0.192 1.00 11.21 H new ATOM 0 HG11 VAL A 120 -11.000 10.208 1.366 1.00 12.13 H new ATOM 0 HG12 VAL A 120 -10.974 11.720 0.428 1.00 12.13 H new ATOM 0 HG13 VAL A 120 -11.860 10.306 -0.189 1.00 12.13 H new ATOM 0 HG21 VAL A 120 -9.725 8.273 0.659 1.00 22.15 H new ATOM 0 HG22 VAL A 120 -10.490 8.245 -0.947 1.00 22.15 H new ATOM 0 HG23 VAL A 120 -8.718 8.329 -0.807 1.00 22.15 H new ATOM 1724 N LYS A 121 -10.277 9.276 -3.576 1.00 64.33 N ATOM 1725 CA LYS A 121 -11.152 8.677 -4.551 1.00 22.15 C ATOM 1726 C LYS A 121 -11.092 7.181 -4.409 1.00 62.01 C ATOM 1727 O LYS A 121 -10.086 6.645 -3.936 1.00 23.54 O ATOM 1728 CB LYS A 121 -10.688 9.054 -5.973 1.00 4.05 C ATOM 1729 CG LYS A 121 -10.529 10.556 -6.228 1.00 32.13 C ATOM 1730 CD LYS A 121 -11.824 11.332 -6.037 1.00 61.22 C ATOM 1731 CE LYS A 121 -12.892 10.929 -7.043 1.00 51.03 C ATOM 1732 NZ LYS A 121 -14.134 11.706 -6.863 1.00 31.30 N ATOM 0 H LYS A 121 -9.313 8.947 -3.621 1.00 64.33 H new ATOM 0 HA LYS A 121 -12.169 9.036 -4.390 1.00 22.15 H new ATOM 0 HB2 LYS A 121 -9.734 8.565 -6.169 1.00 4.05 H new ATOM 0 HB3 LYS A 121 -11.404 8.653 -6.690 1.00 4.05 H new ATOM 0 HG2 LYS A 121 -9.770 10.955 -5.555 1.00 32.13 H new ATOM 0 HG3 LYS A 121 -10.166 10.710 -7.244 1.00 32.13 H new ATOM 0 HD2 LYS A 121 -12.199 11.167 -5.027 1.00 61.22 H new ATOM 0 HD3 LYS A 121 -11.623 12.399 -6.132 1.00 61.22 H new ATOM 0 HE2 LYS A 121 -12.514 11.077 -8.054 1.00 51.03 H new ATOM 0 HE3 LYS A 121 -13.109 9.866 -6.937 1.00 51.03 H new ATOM 0 HZ1 LYS A 121 -14.838 11.403 -7.566 1.00 31.30 H new ATOM 0 HZ2 LYS A 121 -14.509 11.545 -5.906 1.00 31.30 H new ATOM 0 HZ3 LYS A 121 -13.932 12.718 -6.989 1.00 31.30 H new ATOM 1746 N ILE A 122 -12.143 6.509 -4.787 1.00 0.10 N ATOM 1747 CA ILE A 122 -12.125 5.077 -4.791 1.00 72.33 C ATOM 1748 C ILE A 122 -11.693 4.621 -6.178 1.00 32.24 C ATOM 1749 O ILE A 122 -12.412 4.803 -7.159 1.00 15.31 O ATOM 1750 CB ILE A 122 -13.512 4.462 -4.404 1.00 63.41 C ATOM 1751 CG1 ILE A 122 -13.878 4.755 -2.930 1.00 24.14 C ATOM 1752 CG2 ILE A 122 -13.543 2.965 -4.668 1.00 43.31 C ATOM 1753 CD1 ILE A 122 -12.954 4.098 -1.902 1.00 1.32 C ATOM 0 H ILE A 122 -13.019 6.930 -5.095 1.00 0.10 H new ATOM 0 HA ILE A 122 -11.422 4.725 -4.035 1.00 72.33 H new ATOM 0 HB ILE A 122 -14.260 4.940 -5.037 1.00 63.41 H new ATOM 0 HG12 ILE A 122 -13.865 5.834 -2.774 1.00 24.14 H new ATOM 0 HG13 ILE A 122 -14.899 4.419 -2.749 1.00 24.14 H new ATOM 0 HG21 ILE A 122 -14.519 2.567 -4.389 1.00 43.31 H new ATOM 0 HG22 ILE A 122 -13.364 2.778 -5.727 1.00 43.31 H new ATOM 0 HG23 ILE A 122 -12.769 2.475 -4.077 1.00 43.31 H new ATOM 0 HD11 ILE A 122 -13.285 4.358 -0.897 1.00 1.32 H new ATOM 0 HD12 ILE A 122 -12.984 3.015 -2.026 1.00 1.32 H new ATOM 0 HD13 ILE A 122 -11.934 4.452 -2.051 1.00 1.32 H new ATOM 1765 N GLU A 123 -10.530 4.054 -6.242 1.00 14.41 N ATOM 1766 CA GLU A 123 -9.930 3.618 -7.475 1.00 53.04 C ATOM 1767 C GLU A 123 -9.525 2.184 -7.364 1.00 22.04 C ATOM 1768 O GLU A 123 -9.127 1.728 -6.304 1.00 34.41 O ATOM 1769 CB GLU A 123 -8.693 4.459 -7.795 1.00 0.01 C ATOM 1770 CG GLU A 123 -8.972 5.908 -8.155 1.00 3.43 C ATOM 1771 CD GLU A 123 -9.676 6.033 -9.477 1.00 50.44 C ATOM 1772 OE1 GLU A 123 -8.994 5.966 -10.527 1.00 20.24 O ATOM 1773 OE2 GLU A 123 -10.906 6.203 -9.509 1.00 31.44 O ATOM 0 H GLU A 123 -9.952 3.874 -5.421 1.00 14.41 H new ATOM 0 HA GLU A 123 -10.663 3.736 -8.273 1.00 53.04 H new ATOM 0 HB2 GLU A 123 -8.026 4.437 -6.933 1.00 0.01 H new ATOM 0 HB3 GLU A 123 -8.160 3.992 -8.623 1.00 0.01 H new ATOM 0 HG2 GLU A 123 -9.581 6.365 -7.375 1.00 3.43 H new ATOM 0 HG3 GLU A 123 -8.033 6.460 -8.190 1.00 3.43 H new ATOM 1780 N GLU A 124 -9.628 1.490 -8.437 1.00 2.25 N ATOM 1781 CA GLU A 124 -9.258 0.112 -8.494 1.00 3.31 C ATOM 1782 C GLU A 124 -7.977 -0.016 -9.277 1.00 55.45 C ATOM 1783 O GLU A 124 -7.744 0.748 -10.207 1.00 33.41 O ATOM 1784 CB GLU A 124 -10.380 -0.705 -9.141 1.00 41.33 C ATOM 1785 CG GLU A 124 -10.831 -0.175 -10.493 1.00 4.32 C ATOM 1786 CD GLU A 124 -11.882 -1.034 -11.131 1.00 25.25 C ATOM 1787 OE1 GLU A 124 -13.046 -0.998 -10.694 1.00 33.41 O ATOM 1788 OE2 GLU A 124 -11.563 -1.768 -12.075 1.00 11.43 O ATOM 0 H GLU A 124 -9.977 1.864 -9.319 1.00 2.25 H new ATOM 0 HA GLU A 124 -9.100 -0.275 -7.487 1.00 3.31 H new ATOM 0 HB2 GLU A 124 -10.043 -1.735 -9.260 1.00 41.33 H new ATOM 0 HB3 GLU A 124 -11.236 -0.725 -8.466 1.00 41.33 H new ATOM 0 HG2 GLU A 124 -11.219 0.836 -10.371 1.00 4.32 H new ATOM 0 HG3 GLU A 124 -9.970 -0.108 -11.158 1.00 4.32 H new ATOM 1795 N ARG A 125 -7.130 -0.935 -8.903 1.00 45.03 N ATOM 1796 CA ARG A 125 -5.909 -1.115 -9.643 1.00 14.13 C ATOM 1797 C ARG A 125 -5.666 -2.586 -9.884 1.00 44.34 C ATOM 1798 O ARG A 125 -5.595 -3.372 -8.942 1.00 43.51 O ATOM 1799 CB ARG A 125 -4.716 -0.465 -8.919 1.00 1.05 C ATOM 1800 CG ARG A 125 -3.414 -0.498 -9.718 1.00 4.53 C ATOM 1801 CD ARG A 125 -3.577 0.227 -11.049 1.00 42.12 C ATOM 1802 NE ARG A 125 -2.369 0.186 -11.875 1.00 21.43 N ATOM 1803 CZ ARG A 125 -2.363 0.362 -13.211 1.00 50.44 C ATOM 1804 NH1 ARG A 125 -3.515 0.537 -13.872 1.00 63.13 N ATOM 1805 NH2 ARG A 125 -1.211 0.349 -13.879 1.00 1.50 N ATOM 0 H ARG A 125 -7.257 -1.560 -8.107 1.00 45.03 H new ATOM 0 HA ARG A 125 -6.011 -0.616 -10.607 1.00 14.13 H new ATOM 0 HB2 ARG A 125 -4.964 0.571 -8.689 1.00 1.05 H new ATOM 0 HB3 ARG A 125 -4.560 -0.974 -7.968 1.00 1.05 H new ATOM 0 HG2 ARG A 125 -2.616 -0.032 -9.140 1.00 4.53 H new ATOM 0 HG3 ARG A 125 -3.117 -1.532 -9.896 1.00 4.53 H new ATOM 0 HD2 ARG A 125 -4.403 -0.221 -11.601 1.00 42.12 H new ATOM 0 HD3 ARG A 125 -3.846 1.266 -10.860 1.00 42.12 H new ATOM 0 HE ARG A 125 -1.477 0.014 -11.411 1.00 21.43 H new ATOM 0 HH11 ARG A 125 -4.400 0.537 -13.364 1.00 63.13 H new ATOM 0 HH12 ARG A 125 -3.508 0.670 -14.883 1.00 63.13 H new ATOM 0 HH21 ARG A 125 -0.333 0.206 -13.379 1.00 1.50 H new ATOM 0 HH22 ARG A 125 -1.206 0.482 -14.890 1.00 1.50 H new ATOM 1819 N GLU A 126 -5.536 -2.950 -11.134 1.00 24.14 N ATOM 1820 CA GLU A 126 -5.330 -4.326 -11.514 1.00 63.14 C ATOM 1821 C GLU A 126 -4.296 -4.397 -12.613 1.00 33.32 C ATOM 1822 O GLU A 126 -3.839 -3.360 -13.116 1.00 64.13 O ATOM 1823 CB GLU A 126 -6.644 -4.931 -12.024 1.00 3.41 C ATOM 1824 CG GLU A 126 -7.166 -4.261 -13.283 1.00 22.41 C ATOM 1825 CD GLU A 126 -8.452 -4.849 -13.778 1.00 32.20 C ATOM 1826 OE1 GLU A 126 -8.409 -5.867 -14.482 1.00 32.42 O ATOM 1827 OE2 GLU A 126 -9.529 -4.293 -13.474 1.00 42.21 O ATOM 0 H GLU A 126 -5.570 -2.300 -11.919 1.00 24.14 H new ATOM 0 HA GLU A 126 -4.986 -4.886 -10.644 1.00 63.14 H new ATOM 0 HB2 GLU A 126 -6.495 -5.993 -12.221 1.00 3.41 H new ATOM 0 HB3 GLU A 126 -7.399 -4.855 -11.241 1.00 3.41 H new ATOM 0 HG2 GLU A 126 -7.312 -3.199 -13.087 1.00 22.41 H new ATOM 0 HG3 GLU A 126 -6.413 -4.340 -14.067 1.00 22.41 H new ATOM 1834 N GLY A 127 -3.919 -5.605 -12.967 1.00 23.24 N ATOM 1835 CA GLY A 127 -3.014 -5.811 -14.062 1.00 24.11 C ATOM 1836 C GLY A 127 -1.585 -5.581 -13.679 1.00 5.44 C ATOM 1837 O GLY A 127 -0.729 -5.364 -14.543 1.00 51.14 O ATOM 0 H GLY A 127 -4.230 -6.460 -12.506 1.00 23.24 H new ATOM 0 HA2 GLY A 127 -3.127 -6.829 -14.435 1.00 24.11 H new ATOM 0 HA3 GLY A 127 -3.280 -5.140 -14.879 1.00 24.11 H new ATOM 1841 N ILE A 128 -1.310 -5.616 -12.402 1.00 52.42 N ATOM 1842 CA ILE A 128 0.028 -5.420 -11.936 1.00 44.25 C ATOM 1843 C ILE A 128 0.444 -6.529 -11.006 1.00 4.50 C ATOM 1844 O ILE A 128 -0.384 -7.092 -10.261 1.00 64.40 O ATOM 1845 CB ILE A 128 0.244 -4.052 -11.231 1.00 24.24 C ATOM 1846 CG1 ILE A 128 -0.681 -3.892 -10.026 1.00 73.50 C ATOM 1847 CG2 ILE A 128 0.059 -2.899 -12.216 1.00 73.12 C ATOM 1848 CD1 ILE A 128 -0.408 -2.644 -9.233 1.00 15.41 C ATOM 0 H ILE A 128 -2.000 -5.779 -11.668 1.00 52.42 H new ATOM 0 HA ILE A 128 0.652 -5.428 -12.830 1.00 44.25 H new ATOM 0 HB ILE A 128 1.270 -4.027 -10.864 1.00 24.24 H new ATOM 0 HG12 ILE A 128 -1.715 -3.878 -10.369 1.00 73.50 H new ATOM 0 HG13 ILE A 128 -0.573 -4.760 -9.375 1.00 73.50 H new ATOM 0 HG21 ILE A 128 0.215 -1.951 -11.700 1.00 73.12 H new ATOM 0 HG22 ILE A 128 0.781 -2.994 -13.027 1.00 73.12 H new ATOM 0 HG23 ILE A 128 -0.951 -2.928 -12.624 1.00 73.12 H new ATOM 0 HD11 ILE A 128 -1.098 -2.589 -8.391 1.00 15.41 H new ATOM 0 HD12 ILE A 128 0.616 -2.666 -8.861 1.00 15.41 H new ATOM 0 HD13 ILE A 128 -0.544 -1.771 -9.871 1.00 15.41 H new ATOM 1860 N THR A 129 1.688 -6.869 -11.070 1.00 3.03 N ATOM 1861 CA THR A 129 2.254 -7.826 -10.187 1.00 62.11 C ATOM 1862 C THR A 129 3.070 -7.072 -9.165 1.00 43.35 C ATOM 1863 O THR A 129 3.883 -6.212 -9.520 1.00 54.23 O ATOM 1864 CB THR A 129 3.165 -8.801 -10.957 1.00 53.21 C ATOM 1865 OG1 THR A 129 2.412 -9.411 -12.009 1.00 62.13 O ATOM 1866 CG2 THR A 129 3.716 -9.888 -10.036 1.00 60.54 C ATOM 0 H THR A 129 2.346 -6.483 -11.747 1.00 3.03 H new ATOM 0 HA THR A 129 1.466 -8.407 -9.709 1.00 62.11 H new ATOM 0 HB THR A 129 4.006 -8.240 -11.365 1.00 53.21 H new ATOM 0 HG1 THR A 129 2.986 -10.032 -12.505 1.00 62.13 H new ATOM 0 HG21 THR A 129 4.355 -10.560 -10.608 1.00 60.54 H new ATOM 0 HG22 THR A 129 4.297 -9.428 -9.237 1.00 60.54 H new ATOM 0 HG23 THR A 129 2.890 -10.453 -9.605 1.00 60.54 H new ATOM 1874 N VAL A 130 2.853 -7.357 -7.929 1.00 22.44 N ATOM 1875 CA VAL A 130 3.572 -6.695 -6.896 1.00 4.04 C ATOM 1876 C VAL A 130 4.252 -7.707 -6.038 1.00 43.04 C ATOM 1877 O VAL A 130 3.805 -8.863 -5.931 1.00 62.50 O ATOM 1878 CB VAL A 130 2.676 -5.763 -6.015 1.00 32.02 C ATOM 1879 CG1 VAL A 130 2.095 -4.622 -6.838 1.00 23.33 C ATOM 1880 CG2 VAL A 130 1.560 -6.549 -5.329 1.00 31.21 C ATOM 0 H VAL A 130 2.178 -8.050 -7.606 1.00 22.44 H new ATOM 0 HA VAL A 130 4.304 -6.049 -7.381 1.00 4.04 H new ATOM 0 HB VAL A 130 3.314 -5.337 -5.241 1.00 32.02 H new ATOM 0 HG11 VAL A 130 1.477 -3.991 -6.200 1.00 23.33 H new ATOM 0 HG12 VAL A 130 2.906 -4.028 -7.260 1.00 23.33 H new ATOM 0 HG13 VAL A 130 1.486 -5.029 -7.645 1.00 23.33 H new ATOM 0 HG21 VAL A 130 0.956 -5.872 -4.725 1.00 31.21 H new ATOM 0 HG22 VAL A 130 0.931 -7.021 -6.083 1.00 31.21 H new ATOM 0 HG23 VAL A 130 1.996 -7.316 -4.688 1.00 31.21 H new ATOM 1890 N TYR A 131 5.325 -7.309 -5.462 1.00 21.21 N ATOM 1891 CA TYR A 131 6.040 -8.157 -4.592 1.00 42.34 C ATOM 1892 C TYR A 131 5.940 -7.550 -3.244 1.00 14.12 C ATOM 1893 O TYR A 131 6.343 -6.423 -3.044 1.00 31.44 O ATOM 1894 CB TYR A 131 7.501 -8.226 -5.047 1.00 11.04 C ATOM 1895 CG TYR A 131 7.638 -8.664 -6.485 1.00 23.10 C ATOM 1896 CD1 TYR A 131 7.454 -9.980 -6.822 1.00 64.44 C ATOM 1897 CD2 TYR A 131 7.939 -7.755 -7.502 1.00 31.13 C ATOM 1898 CE1 TYR A 131 7.552 -10.408 -8.121 1.00 24.14 C ATOM 1899 CE2 TYR A 131 8.048 -8.171 -8.818 1.00 64.22 C ATOM 1900 CZ TYR A 131 7.849 -9.511 -9.117 1.00 51.23 C ATOM 1901 OH TYR A 131 7.929 -9.953 -10.417 1.00 25.52 O ATOM 0 H TYR A 131 5.732 -6.381 -5.583 1.00 21.21 H new ATOM 0 HA TYR A 131 5.642 -9.172 -4.587 1.00 42.34 H new ATOM 0 HB2 TYR A 131 7.963 -7.247 -4.923 1.00 11.04 H new ATOM 0 HB3 TYR A 131 8.046 -8.919 -4.406 1.00 11.04 H new ATOM 0 HD1 TYR A 131 7.227 -10.696 -6.046 1.00 64.44 H new ATOM 0 HD2 TYR A 131 8.089 -6.714 -7.258 1.00 31.13 H new ATOM 0 HE1 TYR A 131 7.396 -11.449 -8.360 1.00 24.14 H new ATOM 0 HE2 TYR A 131 8.284 -7.464 -9.599 1.00 64.22 H new ATOM 0 HH TYR A 131 7.326 -10.716 -10.541 1.00 25.52 H new ATOM 1911 N SER A 132 5.416 -8.276 -2.335 1.00 23.32 N ATOM 1912 CA SER A 132 5.178 -7.761 -1.031 1.00 70.45 C ATOM 1913 C SER A 132 6.096 -8.416 -0.051 1.00 10.44 C ATOM 1914 O SER A 132 6.175 -9.634 0.003 1.00 42.52 O ATOM 1915 CB SER A 132 3.730 -8.019 -0.654 1.00 2.11 C ATOM 1916 OG SER A 132 2.856 -7.490 -1.642 1.00 64.20 O ATOM 0 H SER A 132 5.136 -9.248 -2.467 1.00 23.32 H new ATOM 0 HA SER A 132 5.368 -6.688 -1.017 1.00 70.45 H new ATOM 0 HB2 SER A 132 3.561 -9.091 -0.547 1.00 2.11 H new ATOM 0 HB3 SER A 132 3.513 -7.564 0.313 1.00 2.11 H new ATOM 0 HG SER A 132 2.749 -6.526 -1.501 1.00 64.20 H new ATOM 1922 N THR A 133 6.812 -7.634 0.684 1.00 41.42 N ATOM 1923 CA THR A 133 7.661 -8.167 1.677 1.00 35.34 C ATOM 1924 C THR A 133 7.237 -7.669 3.047 1.00 5.22 C ATOM 1925 O THR A 133 6.956 -6.473 3.229 1.00 23.10 O ATOM 1926 CB THR A 133 9.176 -7.850 1.401 1.00 35.34 C ATOM 1927 OG1 THR A 133 10.001 -8.486 2.379 1.00 71.35 O ATOM 1928 CG2 THR A 133 9.457 -6.356 1.404 1.00 52.33 C ATOM 0 H THR A 133 6.821 -6.617 0.610 1.00 41.42 H new ATOM 0 HA THR A 133 7.562 -9.252 1.649 1.00 35.34 H new ATOM 0 HB THR A 133 9.408 -8.237 0.409 1.00 35.34 H new ATOM 0 HG1 THR A 133 9.647 -9.379 2.575 1.00 71.35 H new ATOM 0 HG21 THR A 133 10.516 -6.185 1.209 1.00 52.33 H new ATOM 0 HG22 THR A 133 8.862 -5.872 0.629 1.00 52.33 H new ATOM 0 HG23 THR A 133 9.195 -5.938 2.376 1.00 52.33 H new ATOM 1936 N GLN A 134 7.117 -8.583 3.978 1.00 73.12 N ATOM 1937 CA GLN A 134 6.864 -8.225 5.343 1.00 24.14 C ATOM 1938 C GLN A 134 8.071 -8.534 6.128 1.00 64.11 C ATOM 1939 O GLN A 134 8.614 -9.650 6.047 1.00 13.12 O ATOM 1940 CB GLN A 134 5.675 -8.950 5.949 1.00 54.43 C ATOM 1941 CG GLN A 134 4.388 -8.688 5.249 1.00 31.41 C ATOM 1942 CD GLN A 134 3.214 -9.314 5.953 1.00 4.21 C ATOM 1943 OE1 GLN A 134 2.875 -10.478 5.712 1.00 34.31 O ATOM 1944 NE2 GLN A 134 2.555 -8.553 6.784 1.00 74.00 N ATOM 0 H GLN A 134 7.192 -9.586 3.809 1.00 73.12 H new ATOM 0 HA GLN A 134 6.622 -7.162 5.366 1.00 24.14 H new ATOM 0 HB2 GLN A 134 5.872 -10.022 5.938 1.00 54.43 H new ATOM 0 HB3 GLN A 134 5.576 -8.655 6.994 1.00 54.43 H new ATOM 0 HG2 GLN A 134 4.231 -7.612 5.173 1.00 31.41 H new ATOM 0 HG3 GLN A 134 4.446 -9.074 4.231 1.00 31.41 H new ATOM 0 HE21 GLN A 134 2.866 -7.597 6.957 1.00 74.00 H new ATOM 0 HE22 GLN A 134 1.729 -8.914 7.261 1.00 74.00 H new ATOM 1953 N PHE A 135 8.510 -7.580 6.851 1.00 51.45 N ATOM 1954 CA PHE A 135 9.678 -7.724 7.647 1.00 24.02 C ATOM 1955 C PHE A 135 9.337 -7.635 9.102 1.00 74.40 C ATOM 1956 O PHE A 135 8.518 -6.796 9.508 1.00 62.22 O ATOM 1957 CB PHE A 135 10.751 -6.699 7.250 1.00 55.11 C ATOM 1958 CG PHE A 135 10.332 -5.250 7.302 1.00 74.55 C ATOM 1959 CD1 PHE A 135 9.778 -4.637 6.188 1.00 73.24 C ATOM 1960 CD2 PHE A 135 10.515 -4.500 8.451 1.00 64.04 C ATOM 1961 CE1 PHE A 135 9.413 -3.311 6.224 1.00 63.51 C ATOM 1962 CE2 PHE A 135 10.153 -3.177 8.491 1.00 41.03 C ATOM 1963 CZ PHE A 135 9.601 -2.579 7.373 1.00 11.23 C ATOM 0 H PHE A 135 8.068 -6.663 6.913 1.00 51.45 H new ATOM 0 HA PHE A 135 10.098 -8.713 7.464 1.00 24.02 H new ATOM 0 HB2 PHE A 135 11.612 -6.832 7.905 1.00 55.11 H new ATOM 0 HB3 PHE A 135 11.084 -6.924 6.237 1.00 55.11 H new ATOM 0 HD1 PHE A 135 9.632 -5.207 5.282 1.00 73.24 H new ATOM 0 HD2 PHE A 135 10.948 -4.962 9.326 1.00 64.04 H new ATOM 0 HE1 PHE A 135 8.979 -2.846 5.351 1.00 63.51 H new ATOM 0 HE2 PHE A 135 10.299 -2.604 9.394 1.00 41.03 H new ATOM 0 HZ PHE A 135 9.318 -1.537 7.402 1.00 11.23 H new ATOM 1973 N GLY A 136 9.903 -8.525 9.875 1.00 4.03 N ATOM 1974 CA GLY A 136 9.711 -8.498 11.291 1.00 31.12 C ATOM 1975 C GLY A 136 10.706 -7.581 11.936 1.00 33.53 C ATOM 1976 O GLY A 136 11.880 -7.934 12.083 1.00 55.15 O ATOM 0 H GLY A 136 10.503 -9.279 9.540 1.00 4.03 H new ATOM 0 HA2 GLY A 136 8.699 -8.166 11.521 1.00 31.12 H new ATOM 0 HA3 GLY A 136 9.817 -9.504 11.698 1.00 31.12 H new ATOM 1980 N GLY A 137 10.264 -6.405 12.277 1.00 32.31 N ATOM 1981 CA GLY A 137 11.121 -5.452 12.906 1.00 2.31 C ATOM 1982 C GLY A 137 10.509 -4.084 12.899 1.00 61.52 C ATOM 1983 O GLY A 137 9.507 -3.857 12.208 1.00 51.14 O ATOM 0 H GLY A 137 9.307 -6.085 12.127 1.00 32.31 H new ATOM 0 HA2 GLY A 137 11.319 -5.759 13.933 1.00 2.31 H new ATOM 0 HA3 GLY A 137 12.081 -5.426 12.390 1.00 2.31 H new ATOM 1987 N TYR A 138 11.089 -3.171 13.667 1.00 72.32 N ATOM 1988 CA TYR A 138 10.574 -1.815 13.741 1.00 4.03 C ATOM 1989 C TYR A 138 10.944 -1.046 12.484 1.00 70.25 C ATOM 1990 O TYR A 138 12.079 -1.165 11.973 1.00 41.34 O ATOM 1991 CB TYR A 138 11.040 -1.079 15.022 1.00 63.42 C ATOM 1992 CG TYR A 138 12.523 -0.844 15.133 1.00 14.35 C ATOM 1993 CD1 TYR A 138 13.347 -1.790 15.692 1.00 24.24 C ATOM 1994 CD2 TYR A 138 13.088 0.334 14.677 1.00 24.32 C ATOM 1995 CE1 TYR A 138 14.702 -1.578 15.795 1.00 30.14 C ATOM 1996 CE2 TYR A 138 14.440 0.560 14.773 1.00 22.22 C ATOM 1997 CZ TYR A 138 15.245 -0.401 15.334 1.00 5.44 C ATOM 1998 OH TYR A 138 16.605 -0.186 15.432 1.00 11.41 O ATOM 0 H TYR A 138 11.912 -3.346 14.244 1.00 72.32 H new ATOM 0 HA TYR A 138 9.487 -1.873 13.803 1.00 4.03 H new ATOM 0 HB2 TYR A 138 10.533 -0.115 15.071 1.00 63.42 H new ATOM 0 HB3 TYR A 138 10.715 -1.655 15.889 1.00 63.42 H new ATOM 0 HD1 TYR A 138 12.924 -2.715 16.056 1.00 24.24 H new ATOM 0 HD2 TYR A 138 12.454 1.090 14.237 1.00 24.32 H new ATOM 0 HE1 TYR A 138 15.337 -2.332 16.236 1.00 30.14 H new ATOM 0 HE2 TYR A 138 14.865 1.484 14.411 1.00 22.22 H new ATOM 0 HH TYR A 138 16.825 0.693 15.059 1.00 11.41 H new ATOM 2008 N ALA A 139 10.030 -0.260 11.997 1.00 14.51 N ATOM 2009 CA ALA A 139 10.222 0.413 10.752 1.00 32.22 C ATOM 2010 C ALA A 139 10.259 1.902 10.912 1.00 34.22 C ATOM 2011 O ALA A 139 9.348 2.512 11.468 1.00 3.14 O ATOM 2012 CB ALA A 139 9.141 0.036 9.773 1.00 24.44 C ATOM 0 H ALA A 139 9.136 -0.070 12.450 1.00 14.51 H new ATOM 0 HA ALA A 139 11.191 0.094 10.367 1.00 32.22 H new ATOM 0 HB1 ALA A 139 9.305 0.559 8.831 1.00 24.44 H new ATOM 0 HB2 ALA A 139 9.166 -1.040 9.600 1.00 24.44 H new ATOM 0 HB3 ALA A 139 8.169 0.316 10.179 1.00 24.44 H new ATOM 2018 N LYS A 140 11.319 2.472 10.460 1.00 65.43 N ATOM 2019 CA LYS A 140 11.449 3.884 10.400 1.00 53.23 C ATOM 2020 C LYS A 140 11.551 4.203 8.902 1.00 34.51 C ATOM 2021 O LYS A 140 11.688 3.263 8.106 1.00 45.24 O ATOM 2022 CB LYS A 140 12.689 4.309 11.202 1.00 41.23 C ATOM 2023 CG LYS A 140 12.761 5.790 11.557 1.00 74.54 C ATOM 2024 CD LYS A 140 13.883 6.071 12.562 1.00 50.14 C ATOM 2025 CE LYS A 140 15.273 5.767 12.011 1.00 75.20 C ATOM 2026 NZ LYS A 140 15.669 6.694 10.934 1.00 13.04 N ATOM 0 H LYS A 140 12.133 1.962 10.116 1.00 65.43 H new ATOM 0 HA LYS A 140 10.614 4.429 10.840 1.00 53.23 H new ATOM 0 HB2 LYS A 140 12.720 3.729 12.125 1.00 41.23 H new ATOM 0 HB3 LYS A 140 13.579 4.046 10.630 1.00 41.23 H new ATOM 0 HG2 LYS A 140 12.926 6.375 10.652 1.00 74.54 H new ATOM 0 HG3 LYS A 140 11.807 6.112 11.975 1.00 74.54 H new ATOM 0 HD2 LYS A 140 13.839 7.118 12.862 1.00 50.14 H new ATOM 0 HD3 LYS A 140 13.716 5.475 13.459 1.00 50.14 H new ATOM 0 HE2 LYS A 140 16.001 5.823 12.820 1.00 75.20 H new ATOM 0 HE3 LYS A 140 15.295 4.745 11.633 1.00 75.20 H new ATOM 0 HZ1 LYS A 140 16.675 6.557 10.711 1.00 13.04 H new ATOM 0 HZ2 LYS A 140 15.097 6.505 10.086 1.00 13.04 H new ATOM 0 HZ3 LYS A 140 15.514 7.674 11.245 1.00 13.04 H new ATOM 2040 N GLU A 141 11.492 5.468 8.511 1.00 73.43 N ATOM 2041 CA GLU A 141 11.473 5.849 7.073 1.00 14.11 C ATOM 2042 C GLU A 141 12.620 5.200 6.258 1.00 25.52 C ATOM 2043 O GLU A 141 12.407 4.712 5.141 1.00 12.13 O ATOM 2044 CB GLU A 141 11.486 7.388 6.880 1.00 14.21 C ATOM 2045 CG GLU A 141 12.799 8.108 7.236 1.00 65.01 C ATOM 2046 CD GLU A 141 13.225 7.923 8.655 1.00 65.03 C ATOM 2047 OE1 GLU A 141 12.788 8.704 9.514 1.00 23.43 O ATOM 2048 OE2 GLU A 141 13.991 6.979 8.934 1.00 52.45 O ATOM 0 H GLU A 141 11.456 6.259 9.154 1.00 73.43 H new ATOM 0 HA GLU A 141 10.534 5.458 6.683 1.00 14.11 H new ATOM 0 HB2 GLU A 141 11.249 7.604 5.838 1.00 14.21 H new ATOM 0 HB3 GLU A 141 10.686 7.816 7.485 1.00 14.21 H new ATOM 0 HG2 GLU A 141 13.590 7.746 6.579 1.00 65.01 H new ATOM 0 HG3 GLU A 141 12.683 9.174 7.038 1.00 65.01 H new ATOM 2055 N ALA A 142 13.813 5.189 6.826 1.00 42.45 N ATOM 2056 CA ALA A 142 14.978 4.634 6.172 1.00 15.33 C ATOM 2057 C ALA A 142 14.903 3.113 6.074 1.00 21.35 C ATOM 2058 O ALA A 142 15.407 2.521 5.122 1.00 64.33 O ATOM 2059 CB ALA A 142 16.249 5.064 6.895 1.00 44.43 C ATOM 0 H ALA A 142 13.998 5.566 7.755 1.00 42.45 H new ATOM 0 HA ALA A 142 15.002 5.025 5.155 1.00 15.33 H new ATOM 0 HB1 ALA A 142 17.116 4.638 6.391 1.00 44.43 H new ATOM 0 HB2 ALA A 142 16.322 6.152 6.887 1.00 44.43 H new ATOM 0 HB3 ALA A 142 16.219 4.710 7.926 1.00 44.43 H new ATOM 2065 N ASP A 143 14.245 2.485 7.037 1.00 34.21 N ATOM 2066 CA ASP A 143 14.172 1.024 7.070 1.00 62.33 C ATOM 2067 C ASP A 143 13.319 0.493 5.931 1.00 51.15 C ATOM 2068 O ASP A 143 13.637 -0.554 5.337 1.00 41.10 O ATOM 2069 CB ASP A 143 13.649 0.511 8.400 1.00 62.25 C ATOM 2070 CG ASP A 143 13.711 -0.991 8.488 1.00 70.14 C ATOM 2071 OD1 ASP A 143 12.796 -1.647 8.000 1.00 30.41 O ATOM 2072 OD2 ASP A 143 14.711 -1.531 9.043 1.00 3.34 O ATOM 0 H ASP A 143 13.757 2.954 7.800 1.00 34.21 H new ATOM 0 HA ASP A 143 15.190 0.654 6.947 1.00 62.33 H new ATOM 0 HB2 ASP A 143 14.232 0.946 9.211 1.00 62.25 H new ATOM 0 HB3 ASP A 143 12.619 0.840 8.536 1.00 62.25 H new ATOM 2077 N TYR A 144 12.241 1.215 5.603 1.00 72.51 N ATOM 2078 CA TYR A 144 11.400 0.839 4.467 1.00 14.24 C ATOM 2079 C TYR A 144 12.235 0.816 3.198 1.00 51.43 C ATOM 2080 O TYR A 144 12.140 -0.107 2.392 1.00 2.15 O ATOM 2081 CB TYR A 144 10.208 1.793 4.273 1.00 22.21 C ATOM 2082 CG TYR A 144 9.116 1.724 5.330 1.00 51.44 C ATOM 2083 CD1 TYR A 144 8.090 0.789 5.227 1.00 33.44 C ATOM 2084 CD2 TYR A 144 9.092 2.600 6.405 1.00 64.03 C ATOM 2085 CE1 TYR A 144 7.075 0.728 6.162 1.00 20.44 C ATOM 2086 CE2 TYR A 144 8.077 2.550 7.344 1.00 60.32 C ATOM 2087 CZ TYR A 144 7.071 1.611 7.218 1.00 73.33 C ATOM 2088 OH TYR A 144 6.052 1.567 8.150 1.00 13.42 O ATOM 0 H TYR A 144 11.936 2.051 6.102 1.00 72.51 H new ATOM 0 HA TYR A 144 10.998 -0.152 4.679 1.00 14.24 H new ATOM 0 HB2 TYR A 144 10.588 2.814 4.239 1.00 22.21 H new ATOM 0 HB3 TYR A 144 9.759 1.587 3.302 1.00 22.21 H new ATOM 0 HD1 TYR A 144 8.087 0.096 4.398 1.00 33.44 H new ATOM 0 HD2 TYR A 144 9.878 3.333 6.511 1.00 64.03 H new ATOM 0 HE1 TYR A 144 6.290 -0.007 6.065 1.00 20.44 H new ATOM 0 HE2 TYR A 144 8.071 3.243 8.173 1.00 60.32 H new ATOM 0 HH TYR A 144 5.970 0.656 8.502 1.00 13.42 H new ATOM 2098 N VAL A 145 13.084 1.822 3.058 1.00 74.41 N ATOM 2099 CA VAL A 145 13.956 1.947 1.907 1.00 34.13 C ATOM 2100 C VAL A 145 15.002 0.824 1.923 1.00 64.32 C ATOM 2101 O VAL A 145 15.311 0.226 0.885 1.00 61.32 O ATOM 2102 CB VAL A 145 14.675 3.329 1.890 1.00 34.54 C ATOM 2103 CG1 VAL A 145 15.523 3.494 0.637 1.00 14.14 C ATOM 2104 CG2 VAL A 145 13.672 4.467 2.010 1.00 21.21 C ATOM 0 H VAL A 145 13.186 2.573 3.740 1.00 74.41 H new ATOM 0 HA VAL A 145 13.343 1.869 1.009 1.00 34.13 H new ATOM 0 HB VAL A 145 15.339 3.365 2.754 1.00 34.54 H new ATOM 0 HG11 VAL A 145 16.012 4.468 0.654 1.00 14.14 H new ATOM 0 HG12 VAL A 145 16.279 2.709 0.603 1.00 14.14 H new ATOM 0 HG13 VAL A 145 14.887 3.423 -0.245 1.00 14.14 H new ATOM 0 HG21 VAL A 145 14.200 5.420 1.996 1.00 21.21 H new ATOM 0 HG22 VAL A 145 12.974 4.426 1.174 1.00 21.21 H new ATOM 0 HG23 VAL A 145 13.123 4.371 2.947 1.00 21.21 H new ATOM 2114 N ALA A 146 15.524 0.528 3.111 1.00 14.01 N ATOM 2115 CA ALA A 146 16.521 -0.522 3.275 1.00 1.33 C ATOM 2116 C ALA A 146 15.961 -1.884 2.873 1.00 31.23 C ATOM 2117 O ALA A 146 16.578 -2.603 2.095 1.00 21.05 O ATOM 2118 CB ALA A 146 17.028 -0.557 4.711 1.00 74.33 C ATOM 0 H ALA A 146 15.270 1.004 3.977 1.00 14.01 H new ATOM 0 HA ALA A 146 17.358 -0.295 2.615 1.00 1.33 H new ATOM 0 HB1 ALA A 146 17.772 -1.347 4.815 1.00 74.33 H new ATOM 0 HB2 ALA A 146 17.481 0.403 4.961 1.00 74.33 H new ATOM 0 HB3 ALA A 146 16.195 -0.752 5.386 1.00 74.33 H new ATOM 2124 N HIS A 147 14.767 -2.214 3.356 1.00 72.20 N ATOM 2125 CA HIS A 147 14.145 -3.490 2.997 1.00 3.11 C ATOM 2126 C HIS A 147 13.729 -3.533 1.557 1.00 74.31 C ATOM 2127 O HIS A 147 13.788 -4.578 0.938 1.00 2.40 O ATOM 2128 CB HIS A 147 13.004 -3.908 3.929 1.00 53.21 C ATOM 2129 CG HIS A 147 13.471 -4.417 5.256 1.00 33.11 C ATOM 2130 ND1 HIS A 147 13.419 -3.688 6.404 1.00 12.51 N ATOM 2131 CD2 HIS A 147 13.988 -5.625 5.606 1.00 21.21 C ATOM 2132 CE1 HIS A 147 13.884 -4.416 7.409 1.00 12.14 C ATOM 2133 NE2 HIS A 147 14.231 -5.592 6.945 1.00 13.14 N ATOM 0 H HIS A 147 14.217 -1.630 3.986 1.00 72.20 H new ATOM 0 HA HIS A 147 14.927 -4.236 3.136 1.00 3.11 H new ATOM 0 HB2 HIS A 147 12.345 -3.055 4.088 1.00 53.21 H new ATOM 0 HB3 HIS A 147 12.412 -4.682 3.440 1.00 53.21 H new ATOM 0 HD1 HIS A 147 13.076 -2.730 6.479 1.00 12.51 H new ATOM 0 HD2 HIS A 147 14.172 -6.458 4.943 1.00 21.21 H new ATOM 0 HE1 HIS A 147 13.964 -4.095 8.437 1.00 12.14 H new ATOM 0 HE2 HIS A 147 14.619 -6.357 7.497 1.00 13.14 H new ATOM 2142 N ALA A 148 13.320 -2.397 1.022 1.00 3.50 N ATOM 2143 CA ALA A 148 12.991 -2.297 -0.410 1.00 53.14 C ATOM 2144 C ALA A 148 14.213 -2.666 -1.254 1.00 73.52 C ATOM 2145 O ALA A 148 14.116 -3.428 -2.219 1.00 11.45 O ATOM 2146 CB ALA A 148 12.517 -0.890 -0.760 1.00 51.45 C ATOM 0 H ALA A 148 13.204 -1.529 1.544 1.00 3.50 H new ATOM 0 HA ALA A 148 12.182 -2.995 -0.628 1.00 53.14 H new ATOM 0 HB1 ALA A 148 12.280 -0.840 -1.823 1.00 51.45 H new ATOM 0 HB2 ALA A 148 11.627 -0.650 -0.178 1.00 51.45 H new ATOM 0 HB3 ALA A 148 13.305 -0.173 -0.530 1.00 51.45 H new ATOM 2152 N THR A 149 15.359 -2.145 -0.859 1.00 61.01 N ATOM 2153 CA THR A 149 16.600 -2.415 -1.499 1.00 32.32 C ATOM 2154 C THR A 149 16.942 -3.916 -1.383 1.00 64.42 C ATOM 2155 O THR A 149 17.290 -4.564 -2.380 1.00 12.42 O ATOM 2156 CB THR A 149 17.691 -1.555 -0.838 1.00 55.21 C ATOM 2157 OG1 THR A 149 17.319 -0.162 -0.922 1.00 32.21 O ATOM 2158 CG2 THR A 149 19.007 -1.751 -1.517 1.00 42.22 C ATOM 0 H THR A 149 15.438 -1.510 -0.065 1.00 61.01 H new ATOM 0 HA THR A 149 16.536 -2.167 -2.558 1.00 32.32 H new ATOM 0 HB THR A 149 17.786 -1.858 0.205 1.00 55.21 H new ATOM 0 HG1 THR A 149 16.585 0.019 -0.299 1.00 32.21 H new ATOM 0 HG21 THR A 149 19.762 -1.133 -1.032 1.00 42.22 H new ATOM 0 HG22 THR A 149 19.298 -2.799 -1.450 1.00 42.22 H new ATOM 0 HG23 THR A 149 18.922 -1.464 -2.565 1.00 42.22 H new ATOM 2166 N GLN A 150 16.799 -4.460 -0.170 1.00 32.53 N ATOM 2167 CA GLN A 150 17.058 -5.883 0.092 1.00 44.32 C ATOM 2168 C GLN A 150 16.142 -6.754 -0.759 1.00 30.12 C ATOM 2169 O GLN A 150 16.552 -7.800 -1.258 1.00 21.32 O ATOM 2170 CB GLN A 150 16.811 -6.218 1.558 1.00 54.32 C ATOM 2171 CG GLN A 150 17.651 -5.444 2.552 1.00 42.03 C ATOM 2172 CD GLN A 150 17.310 -5.805 3.984 1.00 12.11 C ATOM 2173 OE1 GLN A 150 17.410 -4.982 4.886 1.00 55.14 O ATOM 2174 NE2 GLN A 150 16.929 -7.030 4.209 1.00 32.13 N ATOM 0 H GLN A 150 16.503 -3.934 0.652 1.00 32.53 H new ATOM 0 HA GLN A 150 18.101 -6.079 -0.158 1.00 44.32 H new ATOM 0 HB2 GLN A 150 15.759 -6.041 1.781 1.00 54.32 H new ATOM 0 HB3 GLN A 150 16.993 -7.283 1.705 1.00 54.32 H new ATOM 0 HG2 GLN A 150 18.707 -5.645 2.369 1.00 42.03 H new ATOM 0 HG3 GLN A 150 17.499 -4.375 2.401 1.00 42.03 H new ATOM 0 HE21 GLN A 150 16.856 -7.691 3.436 1.00 32.13 H new ATOM 0 HE22 GLN A 150 16.704 -7.328 5.158 1.00 32.13 H new ATOM 2183 N LEU A 151 14.906 -6.311 -0.914 1.00 20.50 N ATOM 2184 CA LEU A 151 13.906 -7.017 -1.695 1.00 41.12 C ATOM 2185 C LEU A 151 14.349 -7.165 -3.140 1.00 54.55 C ATOM 2186 O LEU A 151 14.226 -8.242 -3.720 1.00 20.20 O ATOM 2187 CB LEU A 151 12.555 -6.300 -1.614 1.00 23.33 C ATOM 2188 CG LEU A 151 11.401 -6.920 -2.406 1.00 71.53 C ATOM 2189 CD1 LEU A 151 11.149 -8.344 -1.956 1.00 32.31 C ATOM 2190 CD2 LEU A 151 10.145 -6.084 -2.250 1.00 64.43 C ATOM 0 H LEU A 151 14.566 -5.444 -0.498 1.00 20.50 H new ATOM 0 HA LEU A 151 13.791 -8.016 -1.274 1.00 41.12 H new ATOM 0 HB2 LEU A 151 12.259 -6.248 -0.566 1.00 23.33 H new ATOM 0 HB3 LEU A 151 12.692 -5.275 -1.958 1.00 23.33 H new ATOM 0 HG LEU A 151 11.677 -6.938 -3.460 1.00 71.53 H new ATOM 0 HD11 LEU A 151 10.325 -8.767 -2.531 1.00 32.31 H new ATOM 0 HD12 LEU A 151 12.047 -8.941 -2.116 1.00 32.31 H new ATOM 0 HD13 LEU A 151 10.893 -8.351 -0.896 1.00 32.31 H new ATOM 0 HD21 LEU A 151 9.333 -6.537 -2.819 1.00 64.43 H new ATOM 0 HD22 LEU A 151 9.868 -6.037 -1.197 1.00 64.43 H new ATOM 0 HD23 LEU A 151 10.330 -5.076 -2.622 1.00 64.43 H new ATOM 2202 N ARG A 152 14.893 -6.095 -3.706 1.00 53.21 N ATOM 2203 CA ARG A 152 15.367 -6.118 -5.090 1.00 35.13 C ATOM 2204 C ARG A 152 16.506 -7.113 -5.222 1.00 14.02 C ATOM 2205 O ARG A 152 16.605 -7.839 -6.201 1.00 65.14 O ATOM 2206 CB ARG A 152 15.872 -4.746 -5.525 1.00 33.12 C ATOM 2207 CG ARG A 152 14.874 -3.620 -5.403 1.00 20.41 C ATOM 2208 CD ARG A 152 15.445 -2.337 -5.981 1.00 2.42 C ATOM 2209 NE ARG A 152 16.746 -1.973 -5.375 1.00 43.24 N ATOM 2210 CZ ARG A 152 17.227 -0.725 -5.260 1.00 31.42 C ATOM 2211 NH1 ARG A 152 16.512 0.320 -5.675 1.00 52.51 N ATOM 2212 NH2 ARG A 152 18.432 -0.536 -4.734 1.00 12.02 N ATOM 0 H ARG A 152 15.018 -5.201 -3.232 1.00 53.21 H new ATOM 0 HA ARG A 152 14.529 -6.405 -5.725 1.00 35.13 H new ATOM 0 HB2 ARG A 152 16.751 -4.496 -4.931 1.00 33.12 H new ATOM 0 HB3 ARG A 152 16.197 -4.810 -6.563 1.00 33.12 H new ATOM 0 HG2 ARG A 152 13.954 -3.883 -5.926 1.00 20.41 H new ATOM 0 HG3 ARG A 152 14.613 -3.469 -4.355 1.00 20.41 H new ATOM 0 HD2 ARG A 152 15.568 -2.451 -7.058 1.00 2.42 H new ATOM 0 HD3 ARG A 152 14.735 -1.525 -5.825 1.00 2.42 H new ATOM 0 HE ARG A 152 17.324 -2.733 -5.016 1.00 43.24 H new ATOM 0 HH11 ARG A 152 15.589 0.176 -6.085 1.00 52.51 H new ATOM 0 HH12 ARG A 152 16.887 1.264 -5.583 1.00 52.51 H new ATOM 0 HH21 ARG A 152 18.983 -1.335 -4.422 1.00 12.02 H new ATOM 0 HH22 ARG A 152 18.806 0.409 -4.642 1.00 12.02 H new ATOM 2226 N THR A 153 17.345 -7.136 -4.218 1.00 44.04 N ATOM 2227 CA THR A 153 18.482 -8.013 -4.170 1.00 55.24 C ATOM 2228 C THR A 153 18.045 -9.483 -3.937 1.00 1.43 C ATOM 2229 O THR A 153 18.685 -10.418 -4.413 1.00 73.12 O ATOM 2230 CB THR A 153 19.450 -7.531 -3.073 1.00 74.21 C ATOM 2231 OG1 THR A 153 19.826 -6.168 -3.357 1.00 14.12 O ATOM 2232 CG2 THR A 153 20.697 -8.388 -3.027 1.00 52.21 C ATOM 0 H THR A 153 17.254 -6.535 -3.399 1.00 44.04 H new ATOM 0 HA THR A 153 18.997 -7.985 -5.130 1.00 55.24 H new ATOM 0 HB THR A 153 18.949 -7.604 -2.108 1.00 74.21 H new ATOM 0 HG1 THR A 153 19.106 -5.565 -3.077 1.00 14.12 H new ATOM 0 HG21 THR A 153 21.361 -8.023 -2.243 1.00 52.21 H new ATOM 0 HG22 THR A 153 20.421 -9.421 -2.817 1.00 52.21 H new ATOM 0 HG23 THR A 153 21.209 -8.338 -3.988 1.00 52.21 H new ATOM 2240 N THR A 154 16.951 -9.672 -3.231 1.00 4.51 N ATOM 2241 CA THR A 154 16.442 -11.004 -3.003 1.00 22.33 C ATOM 2242 C THR A 154 15.733 -11.516 -4.279 1.00 23.34 C ATOM 2243 O THR A 154 15.820 -12.688 -4.629 1.00 52.25 O ATOM 2244 CB THR A 154 15.501 -11.055 -1.768 1.00 21.33 C ATOM 2245 OG1 THR A 154 16.182 -10.478 -0.645 1.00 2.44 O ATOM 2246 CG2 THR A 154 15.165 -12.497 -1.421 1.00 44.10 C ATOM 0 H THR A 154 16.401 -8.924 -2.808 1.00 4.51 H new ATOM 0 HA THR A 154 17.281 -11.663 -2.781 1.00 22.33 H new ATOM 0 HB THR A 154 14.586 -10.509 -1.998 1.00 21.33 H new ATOM 0 HG1 THR A 154 16.311 -9.519 -0.799 1.00 2.44 H new ATOM 0 HG21 THR A 154 14.505 -12.518 -0.554 1.00 44.10 H new ATOM 0 HG22 THR A 154 14.667 -12.968 -2.268 1.00 44.10 H new ATOM 0 HG23 THR A 154 16.082 -13.039 -1.192 1.00 44.10 H new ATOM 2254 N LEU A 155 15.085 -10.598 -4.993 1.00 2.25 N ATOM 2255 CA LEU A 155 14.423 -10.896 -6.272 1.00 54.24 C ATOM 2256 C LEU A 155 15.427 -10.891 -7.423 1.00 44.22 C ATOM 2257 O LEU A 155 15.049 -10.987 -8.598 1.00 40.42 O ATOM 2258 CB LEU A 155 13.337 -9.858 -6.561 1.00 10.13 C ATOM 2259 CG LEU A 155 12.095 -9.877 -5.679 1.00 62.51 C ATOM 2260 CD1 LEU A 155 11.258 -8.645 -5.950 1.00 32.35 C ATOM 2261 CD2 LEU A 155 11.270 -11.118 -5.979 1.00 14.20 C ATOM 0 H LEU A 155 15.001 -9.623 -4.705 1.00 2.25 H new ATOM 0 HA LEU A 155 13.977 -11.887 -6.190 1.00 54.24 H new ATOM 0 HB2 LEU A 155 13.788 -8.869 -6.485 1.00 10.13 H new ATOM 0 HB3 LEU A 155 13.017 -9.984 -7.595 1.00 10.13 H new ATOM 0 HG LEU A 155 12.402 -9.888 -4.633 1.00 62.51 H new ATOM 0 HD11 LEU A 155 10.370 -8.662 -5.318 1.00 32.35 H new ATOM 0 HD12 LEU A 155 11.843 -7.752 -5.730 1.00 32.35 H new ATOM 0 HD13 LEU A 155 10.957 -8.633 -6.998 1.00 32.35 H new ATOM 0 HD21 LEU A 155 10.383 -11.127 -5.346 1.00 14.20 H new ATOM 0 HD22 LEU A 155 10.968 -11.110 -7.026 1.00 14.20 H new ATOM 0 HD23 LEU A 155 11.867 -12.008 -5.780 1.00 14.20 H new ATOM 2273 N GLU A 156 16.679 -10.790 -7.100 1.00 51.30 N ATOM 2274 CA GLU A 156 17.719 -10.757 -8.101 1.00 62.23 C ATOM 2275 C GLU A 156 17.914 -12.156 -8.672 1.00 55.20 C ATOM 2276 O GLU A 156 18.033 -13.132 -7.919 1.00 61.12 O ATOM 2277 CB GLU A 156 19.012 -10.232 -7.486 1.00 33.52 C ATOM 2278 CG GLU A 156 20.178 -10.108 -8.440 1.00 64.53 C ATOM 2279 CD GLU A 156 21.417 -9.632 -7.739 1.00 13.43 C ATOM 2280 OE1 GLU A 156 22.142 -10.471 -7.172 1.00 34.03 O ATOM 2281 OE2 GLU A 156 21.690 -8.416 -7.738 1.00 61.20 O ATOM 0 H GLU A 156 17.016 -10.728 -6.139 1.00 51.30 H new ATOM 0 HA GLU A 156 17.432 -10.087 -8.911 1.00 62.23 H new ATOM 0 HB2 GLU A 156 18.816 -9.253 -7.049 1.00 33.52 H new ATOM 0 HB3 GLU A 156 19.301 -10.893 -6.669 1.00 33.52 H new ATOM 0 HG2 GLU A 156 20.372 -11.074 -8.907 1.00 64.53 H new ATOM 0 HG3 GLU A 156 19.922 -9.413 -9.240 1.00 64.53 H new ATOM 2288 N GLY A 157 17.929 -12.256 -9.985 1.00 52.52 N ATOM 2289 CA GLY A 157 18.077 -13.537 -10.629 1.00 42.22 C ATOM 2290 C GLY A 157 16.743 -14.124 -11.046 1.00 34.32 C ATOM 2291 O GLY A 157 16.679 -15.241 -11.546 1.00 44.33 O ATOM 0 H GLY A 157 17.840 -11.465 -10.623 1.00 52.52 H new ATOM 0 HA2 GLY A 157 18.715 -13.430 -11.506 1.00 42.22 H new ATOM 0 HA3 GLY A 157 18.580 -14.227 -9.951 1.00 42.22 H new ATOM 2295 N THR A 158 15.677 -13.380 -10.837 1.00 34.52 N ATOM 2296 CA THR A 158 14.358 -13.837 -11.227 1.00 33.41 C ATOM 2297 C THR A 158 13.852 -12.959 -12.376 1.00 54.41 C ATOM 2298 O THR A 158 14.422 -11.886 -12.622 1.00 13.45 O ATOM 2299 CB THR A 158 13.349 -13.764 -10.044 1.00 73.32 C ATOM 2300 OG1 THR A 158 13.126 -12.405 -9.654 1.00 11.11 O ATOM 2301 CG2 THR A 158 13.859 -14.543 -8.850 1.00 64.32 C ATOM 0 H THR A 158 15.697 -12.458 -10.400 1.00 34.52 H new ATOM 0 HA THR A 158 14.434 -14.879 -11.538 1.00 33.41 H new ATOM 0 HB THR A 158 12.411 -14.203 -10.384 1.00 73.32 H new ATOM 0 HG1 THR A 158 13.839 -12.118 -9.045 1.00 11.11 H new ATOM 0 HG21 THR A 158 13.136 -14.477 -8.037 1.00 64.32 H new ATOM 0 HG22 THR A 158 13.997 -15.588 -9.129 1.00 64.32 H new ATOM 0 HG23 THR A 158 14.812 -14.126 -8.524 1.00 64.32 H new ATOM 2309 N PRO A 159 12.784 -13.373 -13.094 1.00 54.42 N ATOM 2310 CA PRO A 159 12.202 -12.577 -14.188 1.00 4.30 C ATOM 2311 C PRO A 159 11.410 -11.348 -13.682 1.00 21.43 C ATOM 2312 O PRO A 159 10.634 -10.742 -14.445 1.00 53.13 O ATOM 2313 CB PRO A 159 11.248 -13.567 -14.895 1.00 2.41 C ATOM 2314 CG PRO A 159 11.557 -14.908 -14.312 1.00 40.24 C ATOM 2315 CD PRO A 159 12.072 -14.650 -12.934 1.00 71.44 C ATOM 0 HA PRO A 159 12.978 -12.168 -14.836 1.00 4.30 H new ATOM 0 HB2 PRO A 159 10.206 -13.296 -14.725 1.00 2.41 H new ATOM 0 HB3 PRO A 159 11.407 -13.562 -15.973 1.00 2.41 H new ATOM 0 HG2 PRO A 159 10.666 -15.536 -14.284 1.00 40.24 H new ATOM 0 HG3 PRO A 159 12.299 -15.433 -14.914 1.00 40.24 H new ATOM 0 HD2 PRO A 159 11.264 -14.576 -12.206 1.00 71.44 H new ATOM 0 HD3 PRO A 159 12.736 -15.445 -12.593 1.00 71.44 H new ATOM 2323 N ALA A 160 11.601 -10.989 -12.413 1.00 1.51 N ATOM 2324 CA ALA A 160 10.945 -9.830 -11.835 1.00 23.14 C ATOM 2325 C ALA A 160 11.488 -8.555 -12.441 1.00 42.25 C ATOM 2326 O ALA A 160 12.639 -8.180 -12.209 1.00 34.41 O ATOM 2327 CB ALA A 160 11.116 -9.789 -10.327 1.00 44.51 C ATOM 0 H ALA A 160 12.210 -11.491 -11.767 1.00 1.51 H new ATOM 0 HA ALA A 160 9.881 -9.913 -12.059 1.00 23.14 H new ATOM 0 HB1 ALA A 160 10.613 -8.909 -9.928 1.00 44.51 H new ATOM 0 HB2 ALA A 160 10.681 -10.687 -9.887 1.00 44.51 H new ATOM 0 HB3 ALA A 160 12.177 -9.742 -10.082 1.00 44.51 H new ATOM 2333 N THR A 161 10.683 -7.914 -13.218 1.00 11.31 N ATOM 2334 CA THR A 161 11.038 -6.680 -13.837 1.00 53.43 C ATOM 2335 C THR A 161 10.502 -5.560 -12.980 1.00 70.31 C ATOM 2336 O THR A 161 9.574 -5.779 -12.223 1.00 74.13 O ATOM 2337 CB THR A 161 10.437 -6.629 -15.252 1.00 64.34 C ATOM 2338 OG1 THR A 161 9.036 -6.971 -15.189 1.00 22.24 O ATOM 2339 CG2 THR A 161 11.150 -7.611 -16.161 1.00 72.33 C ATOM 0 H THR A 161 9.743 -8.237 -13.446 1.00 11.31 H new ATOM 0 HA THR A 161 12.120 -6.582 -13.927 1.00 53.43 H new ATOM 0 HB THR A 161 10.557 -5.622 -15.651 1.00 64.34 H new ATOM 0 HG1 THR A 161 8.527 -6.376 -15.779 1.00 22.24 H new ATOM 0 HG21 THR A 161 10.715 -7.565 -17.159 1.00 72.33 H new ATOM 0 HG22 THR A 161 12.208 -7.355 -16.214 1.00 72.33 H new ATOM 0 HG23 THR A 161 11.040 -8.620 -15.764 1.00 72.33 H new ATOM 2347 N TYR A 162 11.060 -4.382 -13.055 1.00 71.53 N ATOM 2348 CA TYR A 162 10.578 -3.300 -12.201 1.00 2.45 C ATOM 2349 C TYR A 162 10.382 -2.061 -13.032 1.00 2.11 C ATOM 2350 O TYR A 162 11.059 -1.885 -14.057 1.00 52.32 O ATOM 2351 CB TYR A 162 11.585 -2.980 -11.104 1.00 62.14 C ATOM 2352 CG TYR A 162 12.150 -4.185 -10.385 1.00 74.14 C ATOM 2353 CD1 TYR A 162 11.335 -5.083 -9.708 1.00 32.22 C ATOM 2354 CD2 TYR A 162 13.515 -4.422 -10.399 1.00 31.13 C ATOM 2355 CE1 TYR A 162 11.870 -6.184 -9.075 1.00 14.53 C ATOM 2356 CE2 TYR A 162 14.055 -5.510 -9.765 1.00 23.05 C ATOM 2357 CZ TYR A 162 13.233 -6.391 -9.106 1.00 14.33 C ATOM 2358 OH TYR A 162 13.767 -7.485 -8.491 1.00 33.34 O ATOM 0 H TYR A 162 11.830 -4.138 -13.678 1.00 71.53 H new ATOM 0 HA TYR A 162 9.640 -3.619 -11.747 1.00 2.45 H new ATOM 0 HB2 TYR A 162 12.409 -2.417 -11.541 1.00 62.14 H new ATOM 0 HB3 TYR A 162 11.107 -2.329 -10.371 1.00 62.14 H new ATOM 0 HD1 TYR A 162 10.268 -4.916 -9.677 1.00 32.22 H new ATOM 0 HD2 TYR A 162 14.166 -3.736 -10.920 1.00 31.13 H new ATOM 0 HE1 TYR A 162 11.226 -6.880 -8.558 1.00 14.53 H new ATOM 0 HE2 TYR A 162 15.122 -5.674 -9.783 1.00 23.05 H new ATOM 0 HH TYR A 162 14.740 -7.483 -8.607 1.00 33.34 H new ATOM 2368 N GLN A 163 9.463 -1.216 -12.632 1.00 62.43 N ATOM 2369 CA GLN A 163 9.240 0.025 -13.335 1.00 42.40 C ATOM 2370 C GLN A 163 9.289 1.207 -12.393 1.00 14.45 C ATOM 2371 O GLN A 163 8.600 1.234 -11.373 1.00 22.14 O ATOM 2372 CB GLN A 163 7.973 -0.020 -14.247 1.00 52.40 C ATOM 2373 CG GLN A 163 6.624 -0.339 -13.579 1.00 65.12 C ATOM 2374 CD GLN A 163 6.034 0.787 -12.773 1.00 2.24 C ATOM 2375 OE1 GLN A 163 6.244 1.963 -13.057 1.00 74.41 O ATOM 2376 NE2 GLN A 163 5.267 0.432 -11.795 1.00 32.13 N ATOM 0 H GLN A 163 8.858 -1.364 -11.824 1.00 62.43 H new ATOM 0 HA GLN A 163 10.067 0.166 -14.031 1.00 42.40 H new ATOM 0 HB2 GLN A 163 7.882 0.946 -14.743 1.00 52.40 H new ATOM 0 HB3 GLN A 163 8.146 -0.763 -15.026 1.00 52.40 H new ATOM 0 HG2 GLN A 163 5.911 -0.625 -14.352 1.00 65.12 H new ATOM 0 HG3 GLN A 163 6.753 -1.204 -12.928 1.00 65.12 H new ATOM 0 HE21 GLN A 163 5.121 -0.557 -11.595 1.00 32.13 H new ATOM 0 HE22 GLN A 163 4.808 1.141 -11.224 1.00 32.13 H new ATOM 2385 N GLY A 164 10.189 2.134 -12.692 1.00 72.53 N ATOM 2386 CA GLY A 164 10.350 3.346 -11.909 1.00 74.30 C ATOM 2387 C GLY A 164 10.971 3.102 -10.539 1.00 50.45 C ATOM 2388 O GLY A 164 11.156 4.051 -9.768 1.00 74.30 O ATOM 0 H GLY A 164 10.827 2.064 -13.485 1.00 72.53 H new ATOM 0 HA2 GLY A 164 10.974 4.048 -12.463 1.00 74.30 H new ATOM 0 HA3 GLY A 164 9.376 3.818 -11.780 1.00 74.30 H new ATOM 2392 N ASP A 165 11.297 1.822 -10.246 1.00 3.42 N ATOM 2393 CA ASP A 165 11.842 1.368 -8.933 1.00 14.10 C ATOM 2394 C ASP A 165 10.796 1.633 -7.824 1.00 24.12 C ATOM 2395 O ASP A 165 11.076 1.597 -6.630 1.00 24.11 O ATOM 2396 CB ASP A 165 13.206 2.063 -8.659 1.00 31.31 C ATOM 2397 CG ASP A 165 13.923 1.607 -7.391 1.00 4.31 C ATOM 2398 OD1 ASP A 165 14.328 0.414 -7.301 1.00 52.43 O ATOM 2399 OD2 ASP A 165 14.167 2.438 -6.501 1.00 53.44 O ATOM 0 H ASP A 165 11.190 1.062 -10.918 1.00 3.42 H new ATOM 0 HA ASP A 165 12.033 0.295 -8.948 1.00 14.10 H new ATOM 0 HB2 ASP A 165 13.863 1.889 -9.511 1.00 31.31 H new ATOM 0 HB3 ASP A 165 13.042 3.139 -8.598 1.00 31.31 H new ATOM 2404 N VAL A 166 9.565 1.816 -8.284 1.00 74.22 N ATOM 2405 CA VAL A 166 8.415 2.176 -7.473 1.00 63.22 C ATOM 2406 C VAL A 166 8.045 1.086 -6.484 1.00 33.42 C ATOM 2407 O VAL A 166 8.041 -0.111 -6.816 1.00 65.45 O ATOM 2408 CB VAL A 166 7.202 2.479 -8.382 1.00 11.21 C ATOM 2409 CG1 VAL A 166 5.963 2.854 -7.589 1.00 22.23 C ATOM 2410 CG2 VAL A 166 7.557 3.544 -9.400 1.00 63.42 C ATOM 0 H VAL A 166 9.334 1.713 -9.272 1.00 74.22 H new ATOM 0 HA VAL A 166 8.688 3.064 -6.903 1.00 63.22 H new ATOM 0 HB VAL A 166 6.955 1.561 -8.916 1.00 11.21 H new ATOM 0 HG11 VAL A 166 5.140 3.057 -8.274 1.00 22.23 H new ATOM 0 HG12 VAL A 166 5.691 2.031 -6.929 1.00 22.23 H new ATOM 0 HG13 VAL A 166 6.167 3.744 -6.994 1.00 22.23 H new ATOM 0 HG21 VAL A 166 6.692 3.746 -10.032 1.00 63.42 H new ATOM 0 HG22 VAL A 166 7.850 4.458 -8.883 1.00 63.42 H new ATOM 0 HG23 VAL A 166 8.385 3.195 -10.018 1.00 63.42 H new ATOM 2420 N TYR A 167 7.701 1.508 -5.291 1.00 22.33 N ATOM 2421 CA TYR A 167 7.354 0.613 -4.233 1.00 60.13 C ATOM 2422 C TYR A 167 6.335 1.254 -3.295 1.00 2.42 C ATOM 2423 O TYR A 167 6.067 2.452 -3.374 1.00 15.45 O ATOM 2424 CB TYR A 167 8.614 0.153 -3.460 1.00 62.13 C ATOM 2425 CG TYR A 167 9.411 1.267 -2.804 1.00 24.42 C ATOM 2426 CD1 TYR A 167 10.160 2.175 -3.561 1.00 11.11 C ATOM 2427 CD2 TYR A 167 9.413 1.410 -1.422 1.00 61.23 C ATOM 2428 CE1 TYR A 167 10.876 3.175 -2.957 1.00 65.33 C ATOM 2429 CE2 TYR A 167 10.135 2.410 -0.814 1.00 24.02 C ATOM 2430 CZ TYR A 167 10.863 3.286 -1.578 1.00 13.03 C ATOM 2431 OH TYR A 167 11.583 4.271 -0.965 1.00 41.11 O ATOM 0 H TYR A 167 7.656 2.494 -5.033 1.00 22.33 H new ATOM 0 HA TYR A 167 6.895 -0.272 -4.674 1.00 60.13 H new ATOM 0 HB2 TYR A 167 8.310 -0.557 -2.691 1.00 62.13 H new ATOM 0 HB3 TYR A 167 9.267 -0.383 -4.148 1.00 62.13 H new ATOM 0 HD1 TYR A 167 10.174 2.086 -4.637 1.00 11.11 H new ATOM 0 HD2 TYR A 167 8.839 0.725 -0.816 1.00 61.23 H new ATOM 0 HE1 TYR A 167 11.447 3.872 -3.553 1.00 65.33 H new ATOM 0 HE2 TYR A 167 10.129 2.505 0.262 1.00 24.02 H new ATOM 0 HH TYR A 167 12.524 4.002 -0.909 1.00 41.11 H new ATOM 2441 N TYR A 168 5.764 0.448 -2.447 1.00 62.23 N ATOM 2442 CA TYR A 168 4.798 0.879 -1.458 1.00 42.41 C ATOM 2443 C TYR A 168 5.350 0.652 -0.087 1.00 32.32 C ATOM 2444 O TYR A 168 6.185 -0.228 0.112 1.00 23.04 O ATOM 2445 CB TYR A 168 3.496 0.065 -1.543 1.00 35.43 C ATOM 2446 CG TYR A 168 2.636 0.242 -2.777 1.00 60.13 C ATOM 2447 CD1 TYR A 168 3.129 0.025 -4.058 1.00 71.11 C ATOM 2448 CD2 TYR A 168 1.309 0.617 -2.645 1.00 22.14 C ATOM 2449 CE1 TYR A 168 2.315 0.181 -5.166 1.00 51.40 C ATOM 2450 CE2 TYR A 168 0.493 0.768 -3.739 1.00 31.43 C ATOM 2451 CZ TYR A 168 0.996 0.550 -4.996 1.00 42.44 C ATOM 2452 OH TYR A 168 0.178 0.708 -6.087 1.00 42.52 O ATOM 0 H TYR A 168 5.957 -0.553 -2.417 1.00 62.23 H new ATOM 0 HA TYR A 168 4.594 1.932 -1.650 1.00 42.41 H new ATOM 0 HB2 TYR A 168 3.754 -0.991 -1.463 1.00 35.43 H new ATOM 0 HB3 TYR A 168 2.888 0.312 -0.672 1.00 35.43 H new ATOM 0 HD1 TYR A 168 4.160 -0.269 -4.190 1.00 71.11 H new ATOM 0 HD2 TYR A 168 0.907 0.795 -1.659 1.00 22.14 H new ATOM 0 HE1 TYR A 168 2.709 0.015 -6.158 1.00 51.40 H new ATOM 0 HE2 TYR A 168 -0.540 1.057 -3.610 1.00 31.43 H new ATOM 0 HH TYR A 168 -0.718 0.968 -5.789 1.00 42.52 H new ATOM 2462 N CYS A 169 4.893 1.426 0.837 1.00 35.41 N ATOM 2463 CA CYS A 169 5.208 1.256 2.223 1.00 21.44 C ATOM 2464 C CYS A 169 3.890 1.128 2.973 1.00 63.35 C ATOM 2465 O CYS A 169 2.969 1.912 2.736 1.00 5.43 O ATOM 2466 CB CYS A 169 6.011 2.452 2.726 1.00 14.44 C ATOM 2467 SG CYS A 169 7.548 2.723 1.813 1.00 43.53 S ATOM 0 H CYS A 169 4.274 2.215 0.650 1.00 35.41 H new ATOM 0 HA CYS A 169 5.817 0.366 2.382 1.00 21.44 H new ATOM 0 HB2 CYS A 169 5.394 3.348 2.658 1.00 14.44 H new ATOM 0 HB3 CYS A 169 6.245 2.305 3.780 1.00 14.44 H new ATOM 0 HG CYS A 169 8.167 3.756 2.302 1.00 43.53 H new ATOM 2473 N ALA A 170 3.775 0.135 3.822 1.00 32.05 N ATOM 2474 CA ALA A 170 2.538 -0.108 4.529 1.00 23.54 C ATOM 2475 C ALA A 170 2.742 -0.263 6.013 1.00 4.14 C ATOM 2476 O ALA A 170 3.779 -0.759 6.464 1.00 74.32 O ATOM 2477 CB ALA A 170 1.857 -1.337 3.985 1.00 44.02 C ATOM 0 H ALA A 170 4.525 -0.520 4.041 1.00 32.05 H new ATOM 0 HA ALA A 170 1.909 0.768 4.371 1.00 23.54 H new ATOM 0 HB1 ALA A 170 0.927 -1.508 4.527 1.00 44.02 H new ATOM 0 HB2 ALA A 170 1.639 -1.194 2.927 1.00 44.02 H new ATOM 0 HB3 ALA A 170 2.512 -2.200 4.107 1.00 44.02 H new ATOM 2483 N GLY A 171 1.747 0.158 6.749 1.00 14.35 N ATOM 2484 CA GLY A 171 1.742 0.089 8.178 1.00 73.41 C ATOM 2485 C GLY A 171 0.367 0.447 8.672 1.00 5.00 C ATOM 2486 O GLY A 171 -0.446 0.938 7.878 1.00 70.34 O ATOM 0 H GLY A 171 0.899 0.568 6.357 1.00 14.35 H new ATOM 0 HA2 GLY A 171 2.014 -0.913 8.509 1.00 73.41 H new ATOM 0 HA3 GLY A 171 2.483 0.773 8.592 1.00 73.41 H new ATOM 2632 N ARG A 181 5.854 -4.162 14.638 1.00 24.41 N ATOM 2633 CA ARG A 181 6.614 -5.323 14.179 1.00 14.42 C ATOM 2634 C ARG A 181 6.357 -5.755 12.741 1.00 72.01 C ATOM 2635 O ARG A 181 7.245 -6.322 12.122 1.00 52.23 O ATOM 2636 CB ARG A 181 6.574 -6.508 15.146 1.00 61.20 C ATOM 2637 CG ARG A 181 5.202 -7.085 15.432 1.00 4.24 C ATOM 2638 CD ARG A 181 5.329 -8.309 16.326 1.00 72.22 C ATOM 2639 NE ARG A 181 6.125 -9.370 15.675 1.00 75.24 N ATOM 2640 CZ ARG A 181 7.079 -10.111 16.279 1.00 23.32 C ATOM 2641 NH1 ARG A 181 7.390 -9.903 17.562 1.00 61.32 N ATOM 2642 NH2 ARG A 181 7.740 -11.046 15.591 1.00 12.33 N ATOM 0 HA ARG A 181 7.637 -4.946 14.176 1.00 14.42 H new ATOM 0 HB2 ARG A 181 7.204 -7.302 14.743 1.00 61.20 H new ATOM 0 HB3 ARG A 181 7.019 -6.196 16.091 1.00 61.20 H new ATOM 0 HG2 ARG A 181 4.576 -6.335 15.915 1.00 4.24 H new ATOM 0 HG3 ARG A 181 4.710 -7.356 14.498 1.00 4.24 H new ATOM 0 HD2 ARG A 181 5.798 -8.026 17.268 1.00 72.22 H new ATOM 0 HD3 ARG A 181 4.337 -8.691 16.566 1.00 72.22 H new ATOM 0 HE ARG A 181 5.939 -9.558 14.690 1.00 75.24 H new ATOM 0 HH11 ARG A 181 6.905 -9.180 18.093 1.00 61.32 H new ATOM 0 HH12 ARG A 181 8.112 -10.468 18.010 1.00 61.32 H new ATOM 0 HH21 ARG A 181 7.525 -11.202 14.606 1.00 12.33 H new ATOM 0 HH22 ARG A 181 8.460 -11.604 16.050 1.00 12.33 H new ATOM 2656 N ARG A 182 5.173 -5.510 12.199 1.00 73.10 N ATOM 2657 CA ARG A 182 4.946 -5.929 10.820 1.00 5.43 C ATOM 2658 C ARG A 182 4.684 -4.733 9.949 1.00 11.53 C ATOM 2659 O ARG A 182 3.883 -3.861 10.301 1.00 34.44 O ATOM 2660 CB ARG A 182 3.802 -6.982 10.645 1.00 30.14 C ATOM 2661 CG ARG A 182 2.357 -6.478 10.826 1.00 73.42 C ATOM 2662 CD ARG A 182 2.028 -6.089 12.246 1.00 44.14 C ATOM 2663 NE ARG A 182 2.042 -7.233 13.161 1.00 24.43 N ATOM 2664 CZ ARG A 182 1.745 -7.158 14.462 1.00 71.30 C ATOM 2665 NH1 ARG A 182 1.506 -5.974 15.020 1.00 23.24 N ATOM 2666 NH2 ARG A 182 1.705 -8.261 15.209 1.00 30.44 N ATOM 0 H ARG A 182 4.390 -5.048 12.662 1.00 73.10 H new ATOM 0 HA ARG A 182 5.863 -6.430 10.510 1.00 5.43 H new ATOM 0 HB2 ARG A 182 3.888 -7.414 9.648 1.00 30.14 H new ATOM 0 HB3 ARG A 182 3.972 -7.789 11.358 1.00 30.14 H new ATOM 0 HG2 ARG A 182 2.197 -5.618 10.176 1.00 73.42 H new ATOM 0 HG3 ARG A 182 1.666 -7.256 10.502 1.00 73.42 H new ATOM 0 HD2 ARG A 182 2.746 -5.344 12.590 1.00 44.14 H new ATOM 0 HD3 ARG A 182 1.044 -5.620 12.272 1.00 44.14 H new ATOM 0 HE ARG A 182 2.295 -8.145 12.781 1.00 24.43 H new ATOM 0 HH11 ARG A 182 1.550 -5.126 14.455 1.00 23.24 H new ATOM 0 HH12 ARG A 182 1.279 -5.915 16.013 1.00 23.24 H new ATOM 0 HH21 ARG A 182 1.902 -9.169 14.788 1.00 30.44 H new ATOM 0 HH22 ARG A 182 1.478 -8.197 16.201 1.00 30.44 H new ATOM 2680 N ASN A 183 5.383 -4.668 8.854 1.00 1.34 N ATOM 2681 CA ASN A 183 5.215 -3.619 7.873 1.00 3.40 C ATOM 2682 C ASN A 183 5.417 -4.227 6.506 1.00 51.42 C ATOM 2683 O ASN A 183 6.209 -5.176 6.371 1.00 74.13 O ATOM 2684 CB ASN A 183 6.222 -2.466 8.099 1.00 10.11 C ATOM 2685 CG ASN A 183 6.052 -1.740 9.437 1.00 70.00 C ATOM 2686 OD1 ASN A 183 5.300 -0.761 9.544 1.00 74.15 O ATOM 2687 ND2 ASN A 183 6.762 -2.196 10.461 1.00 64.31 N ATOM 0 H ASN A 183 6.100 -5.351 8.607 1.00 1.34 H new ATOM 0 HA ASN A 183 4.215 -3.194 7.963 1.00 3.40 H new ATOM 0 HB2 ASN A 183 7.234 -2.866 8.041 1.00 10.11 H new ATOM 0 HB3 ASN A 183 6.118 -1.743 7.290 1.00 10.11 H new ATOM 0 HD21 ASN A 183 6.698 -1.738 11.370 1.00 64.31 H new ATOM 0 HD22 ASN A 183 7.372 -3.005 10.339 1.00 64.31 H new ATOM 2694 N GLU A 184 4.729 -3.716 5.499 1.00 51.13 N ATOM 2695 CA GLU A 184 4.861 -4.261 4.153 1.00 14.42 C ATOM 2696 C GLU A 184 5.537 -3.270 3.235 1.00 20.13 C ATOM 2697 O GLU A 184 5.356 -2.060 3.362 1.00 2.24 O ATOM 2698 CB GLU A 184 3.505 -4.641 3.484 1.00 0.11 C ATOM 2699 CG GLU A 184 2.654 -5.726 4.137 1.00 52.42 C ATOM 2700 CD GLU A 184 2.109 -5.362 5.491 1.00 41.21 C ATOM 2701 OE1 GLU A 184 1.088 -4.635 5.543 1.00 5.22 O ATOM 2702 OE2 GLU A 184 2.665 -5.803 6.519 1.00 71.11 O ATOM 0 H GLU A 184 4.080 -2.934 5.583 1.00 51.13 H new ATOM 0 HA GLU A 184 5.452 -5.167 4.284 1.00 14.42 H new ATOM 0 HB2 GLU A 184 2.900 -3.736 3.422 1.00 0.11 H new ATOM 0 HB3 GLU A 184 3.715 -4.954 2.461 1.00 0.11 H new ATOM 0 HG2 GLU A 184 1.821 -5.963 3.476 1.00 52.42 H new ATOM 0 HG3 GLU A 184 3.253 -6.632 4.232 1.00 52.42 H new ATOM 2709 N VAL A 185 6.324 -3.788 2.343 1.00 30.14 N ATOM 2710 CA VAL A 185 6.913 -3.029 1.266 1.00 23.02 C ATOM 2711 C VAL A 185 6.537 -3.749 -0.022 1.00 34.04 C ATOM 2712 O VAL A 185 6.860 -4.930 -0.187 1.00 44.41 O ATOM 2713 CB VAL A 185 8.469 -2.960 1.386 1.00 3.23 C ATOM 2714 CG1 VAL A 185 9.069 -2.123 0.274 1.00 73.14 C ATOM 2715 CG2 VAL A 185 8.893 -2.416 2.743 1.00 24.10 C ATOM 0 H VAL A 185 6.585 -4.774 2.337 1.00 30.14 H new ATOM 0 HA VAL A 185 6.546 -2.003 1.291 1.00 23.02 H new ATOM 0 HB VAL A 185 8.847 -3.978 1.291 1.00 3.23 H new ATOM 0 HG11 VAL A 185 10.153 -2.094 0.385 1.00 73.14 H new ATOM 0 HG12 VAL A 185 8.814 -2.563 -0.690 1.00 73.14 H new ATOM 0 HG13 VAL A 185 8.672 -1.109 0.327 1.00 73.14 H new ATOM 0 HG21 VAL A 185 9.981 -2.380 2.797 1.00 24.10 H new ATOM 0 HG22 VAL A 185 8.490 -1.412 2.875 1.00 24.10 H new ATOM 0 HG23 VAL A 185 8.512 -3.066 3.531 1.00 24.10 H new ATOM 2725 N TRP A 186 5.816 -3.083 -0.902 1.00 71.13 N ATOM 2726 CA TRP A 186 5.407 -3.712 -2.158 1.00 13.15 C ATOM 2727 C TRP A 186 6.219 -3.137 -3.284 1.00 2.34 C ATOM 2728 O TRP A 186 6.176 -1.958 -3.511 1.00 14.03 O ATOM 2729 CB TRP A 186 3.916 -3.470 -2.494 1.00 25.14 C ATOM 2730 CG TRP A 186 2.892 -3.941 -1.491 1.00 44.24 C ATOM 2731 CD1 TRP A 186 3.105 -4.498 -0.260 1.00 54.15 C ATOM 2732 CD2 TRP A 186 1.467 -3.881 -1.658 1.00 33.41 C ATOM 2733 NE1 TRP A 186 1.905 -4.779 0.344 1.00 15.01 N ATOM 2734 CE2 TRP A 186 0.886 -4.412 -0.492 1.00 34.51 C ATOM 2735 CE3 TRP A 186 0.623 -3.427 -2.688 1.00 72.34 C ATOM 2736 CZ2 TRP A 186 -0.494 -4.503 -0.320 1.00 74.33 C ATOM 2737 CZ3 TRP A 186 -0.744 -3.517 -2.512 1.00 2.42 C ATOM 2738 CH2 TRP A 186 -1.290 -4.052 -1.337 1.00 62.53 C ATOM 0 H TRP A 186 5.501 -2.120 -0.781 1.00 71.13 H new ATOM 0 HA TRP A 186 5.566 -4.784 -2.039 1.00 13.15 H new ATOM 0 HB2 TRP A 186 3.774 -2.400 -2.643 1.00 25.14 H new ATOM 0 HB3 TRP A 186 3.702 -3.955 -3.446 1.00 25.14 H new ATOM 0 HD1 TRP A 186 4.076 -4.689 0.173 1.00 54.15 H new ATOM 0 HE1 TRP A 186 1.791 -5.195 1.268 1.00 15.01 H new ATOM 0 HE3 TRP A 186 1.036 -3.016 -3.598 1.00 72.34 H new ATOM 0 HZ2 TRP A 186 -0.919 -4.915 0.583 1.00 74.33 H new ATOM 0 HZ3 TRP A 186 -1.404 -3.169 -3.293 1.00 2.42 H new ATOM 0 HH2 TRP A 186 -2.363 -4.109 -1.232 1.00 62.53 H new ATOM 2749 N LEU A 187 6.931 -3.953 -3.975 1.00 4.41 N ATOM 2750 CA LEU A 187 7.699 -3.509 -5.113 1.00 33.31 C ATOM 2751 C LEU A 187 6.893 -3.832 -6.357 1.00 40.42 C ATOM 2752 O LEU A 187 6.343 -4.933 -6.462 1.00 62.22 O ATOM 2753 CB LEU A 187 9.056 -4.214 -5.124 1.00 34.40 C ATOM 2754 CG LEU A 187 10.054 -3.804 -6.206 1.00 2.33 C ATOM 2755 CD1 LEU A 187 10.382 -2.321 -6.106 1.00 53.31 C ATOM 2756 CD2 LEU A 187 11.319 -4.624 -6.065 1.00 22.02 C ATOM 0 H LEU A 187 7.007 -4.951 -3.778 1.00 4.41 H new ATOM 0 HA LEU A 187 7.891 -2.437 -5.071 1.00 33.31 H new ATOM 0 HB2 LEU A 187 9.526 -4.054 -4.154 1.00 34.40 H new ATOM 0 HB3 LEU A 187 8.878 -5.285 -5.219 1.00 34.40 H new ATOM 0 HG LEU A 187 9.606 -3.989 -7.182 1.00 2.33 H new ATOM 0 HD11 LEU A 187 11.094 -2.052 -6.886 1.00 53.31 H new ATOM 0 HD12 LEU A 187 9.470 -1.737 -6.231 1.00 53.31 H new ATOM 0 HD13 LEU A 187 10.817 -2.110 -5.129 1.00 53.31 H new ATOM 0 HD21 LEU A 187 12.030 -4.331 -6.837 1.00 22.02 H new ATOM 0 HD22 LEU A 187 11.758 -4.450 -5.082 1.00 22.02 H new ATOM 0 HD23 LEU A 187 11.081 -5.682 -6.174 1.00 22.02 H new ATOM 2768 N VAL A 188 6.786 -2.896 -7.271 1.00 32.00 N ATOM 2769 CA VAL A 188 5.937 -3.099 -8.434 1.00 71.12 C ATOM 2770 C VAL A 188 6.727 -3.662 -9.603 1.00 51.41 C ATOM 2771 O VAL A 188 7.758 -3.097 -10.005 1.00 3.53 O ATOM 2772 CB VAL A 188 5.256 -1.788 -8.898 1.00 10.14 C ATOM 2773 CG1 VAL A 188 4.225 -2.067 -9.983 1.00 60.20 C ATOM 2774 CG2 VAL A 188 4.625 -1.047 -7.743 1.00 22.42 C ATOM 0 H VAL A 188 7.266 -1.997 -7.239 1.00 32.00 H new ATOM 0 HA VAL A 188 5.171 -3.809 -8.123 1.00 71.12 H new ATOM 0 HB VAL A 188 6.033 -1.148 -9.315 1.00 10.14 H new ATOM 0 HG11 VAL A 188 3.760 -1.131 -10.293 1.00 60.20 H new ATOM 0 HG12 VAL A 188 4.715 -2.530 -10.840 1.00 60.20 H new ATOM 0 HG13 VAL A 188 3.461 -2.740 -9.594 1.00 60.20 H new ATOM 0 HG21 VAL A 188 4.158 -0.133 -8.109 1.00 22.42 H new ATOM 0 HG22 VAL A 188 3.870 -1.678 -7.275 1.00 22.42 H new ATOM 0 HG23 VAL A 188 5.392 -0.794 -7.011 1.00 22.42 H new ATOM 2784 N LYS A 189 6.245 -4.757 -10.147 1.00 12.41 N ATOM 2785 CA LYS A 189 6.846 -5.340 -11.308 1.00 14.42 C ATOM 2786 C LYS A 189 6.494 -4.523 -12.533 1.00 14.01 C ATOM 2787 O LYS A 189 5.351 -4.054 -12.678 1.00 74.54 O ATOM 2788 CB LYS A 189 6.391 -6.801 -11.516 1.00 23.31 C ATOM 2789 CG LYS A 189 6.902 -7.428 -12.804 1.00 74.23 C ATOM 2790 CD LYS A 189 6.352 -8.820 -13.026 1.00 62.32 C ATOM 2791 CE LYS A 189 6.839 -9.386 -14.350 1.00 43.22 C ATOM 2792 NZ LYS A 189 6.413 -8.548 -15.507 1.00 2.43 N ATOM 0 H LYS A 189 5.431 -5.260 -9.794 1.00 12.41 H new ATOM 0 HA LYS A 189 7.925 -5.341 -11.157 1.00 14.42 H new ATOM 0 HB2 LYS A 189 6.731 -7.401 -10.672 1.00 23.31 H new ATOM 0 HB3 LYS A 189 5.302 -6.836 -11.514 1.00 23.31 H new ATOM 0 HG2 LYS A 189 6.629 -6.794 -13.647 1.00 74.23 H new ATOM 0 HG3 LYS A 189 7.991 -7.471 -12.777 1.00 74.23 H new ATOM 0 HD2 LYS A 189 6.662 -9.473 -12.210 1.00 62.32 H new ATOM 0 HD3 LYS A 189 5.262 -8.792 -13.016 1.00 62.32 H new ATOM 0 HE2 LYS A 189 7.927 -9.458 -14.335 1.00 43.22 H new ATOM 0 HE3 LYS A 189 6.455 -10.398 -14.475 1.00 43.22 H new ATOM 0 HZ1 LYS A 189 6.505 -9.097 -16.386 1.00 2.43 H new ATOM 0 HZ2 LYS A 189 5.422 -8.260 -15.381 1.00 2.43 H new ATOM 0 HZ3 LYS A 189 7.015 -7.701 -15.563 1.00 2.43 H new ATOM 2806 N ALA A 190 7.465 -4.322 -13.375 1.00 24.55 N ATOM 2807 CA ALA A 190 7.236 -3.683 -14.656 1.00 73.52 C ATOM 2808 C ALA A 190 6.347 -4.573 -15.494 1.00 33.25 C ATOM 2809 O ALA A 190 6.817 -5.658 -15.911 1.00 37.17 O ATOM 2810 CB ALA A 190 8.531 -3.427 -15.398 1.00 4.13 C ATOM 2811 OXT ALA A 190 5.196 -4.197 -15.766 1.00 37.17 O ATOM 0 H ALA A 190 8.434 -4.591 -13.204 1.00 24.55 H new ATOM 0 HA ALA A 190 6.760 -2.719 -14.476 1.00 73.52 H new ATOM 0 HB1 ALA A 190 8.315 -2.947 -16.353 1.00 4.13 H new ATOM 0 HB2 ALA A 190 9.170 -2.776 -14.801 1.00 4.13 H new ATOM 0 HB3 ALA A 190 9.042 -4.373 -15.575 1.00 4.13 H new