USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 765 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 76 GLN : amide:sc= -0.97 X(o=-2.4,f=-2.5) USER MOD Set 1.2: A 79 GLN : amide:sc= -1.43 K(o=-2.4,f=-6.7!) USER MOD Set 2.1: A 64 LYS NZ :NH3+ -119:sc= -0.506 (180deg=-3.58!) USER MOD Set 2.2: A 91 ASN : amide:sc= -0.739 K(o=-1.2,f=-8.5!) USER MOD Set 3.1: A 38 HIS : no HD1:sc= -0.418 K(o=0.79,f=-7.9!) USER MOD Set 3.2: A 78 SER OG : rot -149:sc= 1.21 USER MOD Single : A 19 SER OG : rot -45:sc= 0.98 USER MOD Single : A 23 GLN : amide:sc= -0.111 X(o=-0.11,f=-0.0089) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 14:sc= 1.07 USER MOD Single : A 31 ASN : amide:sc= -0.0188 X(o=-0.019,f=-0.26) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 139:sc= -1.62 (180deg=-3.79!) USER MOD Single : A 34 SER OG : rot 180:sc= -0.671 USER MOD Single : A 36 MET CE :methyl 168:sc= -4.84! (180deg=-5.34!) USER MOD Single : A 40 GLN : amide:sc= -0.129 X(o=-0.13,f=-0.55) USER MOD Single : A 46 THR OG1 : rot -9:sc= 0.441 USER MOD Single : A 47 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 48 ASN : amide:sc= -0.828 K(o=-0.83,f=-1.4!) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot 180:sc= -1.63! USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 180:sc=-0.00629 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -19:sc= 0.839 USER MOD Single : A 88 THR OG1 : rot 71:sc= 0.778 USER MOD Single : A 90 TYR OH : rot 70:sc= -0.14 USER MOD Single : A 98 THR OG1 : rot 129:sc= -0.375 USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 90:sc= 0.877 USER MOD Single : A 110 SER OG : rot 133:sc= 0.295 USER MOD Single : A 113 THR OG1 : rot -139:sc= 0.0634 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 200 N VAL A 17 -3.732 12.658 -4.015 1.00 0.00 N ATOM 201 CA VAL A 17 -3.450 11.228 -4.001 1.00 0.00 C ATOM 202 C VAL A 17 -2.803 10.782 -5.307 1.00 0.00 C ATOM 203 O VAL A 17 -3.033 11.358 -6.371 1.00 0.00 O ATOM 204 CB VAL A 17 -4.732 10.405 -3.770 1.00 0.00 C ATOM 205 CG1 VAL A 17 -5.194 10.531 -2.326 1.00 0.00 C ATOM 206 CG2 VAL A 17 -5.827 10.846 -4.729 1.00 0.00 C ATOM 0 HA VAL A 17 -2.759 11.051 -3.177 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.510 9.356 -3.965 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -6.101 9.943 -2.181 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.413 10.163 -1.661 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.400 11.577 -2.100 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -6.725 10.255 -4.552 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.049 11.901 -4.567 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.492 10.699 -5.756 1.00 0.00 H new ATOM 216 N PRO A 18 -1.972 9.732 -5.228 1.00 0.00 N ATOM 217 CA PRO A 18 -1.274 9.185 -6.395 1.00 0.00 C ATOM 218 C PRO A 18 -2.223 8.486 -7.363 1.00 0.00 C ATOM 219 O PRO A 18 -3.223 7.899 -6.951 1.00 0.00 O ATOM 220 CB PRO A 18 -0.296 8.178 -5.784 1.00 0.00 C ATOM 221 CG PRO A 18 -0.920 7.781 -4.491 1.00 0.00 C ATOM 222 CD PRO A 18 -1.650 8.998 -3.993 1.00 0.00 C ATOM 0 HA PRO A 18 -0.791 9.965 -6.984 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -0.155 7.316 -6.437 1.00 0.00 H new ATOM 0 HB3 PRO A 18 0.686 8.624 -5.629 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -1.605 6.944 -4.629 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -0.164 7.459 -3.775 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -2.550 8.728 -3.440 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -1.029 9.592 -3.322 1.00 0.00 H new ATOM 230 N SER A 19 -1.902 8.553 -8.651 1.00 0.00 N ATOM 231 CA SER A 19 -2.728 7.929 -9.678 1.00 0.00 C ATOM 232 C SER A 19 -1.953 6.837 -10.409 1.00 0.00 C ATOM 233 O SER A 19 -2.148 6.617 -11.604 1.00 0.00 O ATOM 234 CB SER A 19 -3.218 8.979 -10.677 1.00 0.00 C ATOM 235 OG SER A 19 -4.069 8.400 -11.650 1.00 0.00 O ATOM 0 H SER A 19 -1.076 9.033 -9.008 1.00 0.00 H new ATOM 0 HA SER A 19 -3.589 7.474 -9.189 1.00 0.00 H new ATOM 0 HB2 SER A 19 -3.751 9.769 -10.147 1.00 0.00 H new ATOM 0 HB3 SER A 19 -2.364 9.445 -11.168 1.00 0.00 H new ATOM 0 HG SER A 19 -3.676 7.562 -11.971 1.00 0.00 H new ATOM 241 N ALA A 20 -1.073 6.157 -9.682 1.00 0.00 N ATOM 242 CA ALA A 20 -0.269 5.087 -10.260 1.00 0.00 C ATOM 243 C ALA A 20 -0.357 3.819 -9.418 1.00 0.00 C ATOM 244 O ALA A 20 -0.260 3.868 -8.192 1.00 0.00 O ATOM 245 CB ALA A 20 1.179 5.531 -10.400 1.00 0.00 C ATOM 0 H ALA A 20 -0.899 6.328 -8.692 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.665 4.863 -11.250 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.767 4.722 -10.833 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.230 6.405 -11.050 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.578 5.785 -9.418 1.00 0.00 H new ATOM 251 N ALA A 21 -0.541 2.683 -10.084 1.00 0.00 N ATOM 252 CA ALA A 21 -0.640 1.402 -9.396 1.00 0.00 C ATOM 253 C ALA A 21 0.514 0.482 -9.780 1.00 0.00 C ATOM 254 O ALA A 21 1.212 0.702 -10.770 1.00 0.00 O ATOM 255 CB ALA A 21 -1.973 0.737 -9.708 1.00 0.00 C ATOM 0 H ALA A 21 -0.624 2.624 -11.099 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.581 1.588 -8.324 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -2.033 -0.219 -9.188 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.787 1.382 -9.378 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -2.054 0.571 -10.782 1.00 0.00 H new ATOM 261 N PRO A 22 0.722 -0.573 -8.979 1.00 0.00 N ATOM 262 CA PRO A 22 1.792 -1.547 -9.214 1.00 0.00 C ATOM 263 C PRO A 22 1.531 -2.409 -10.445 1.00 0.00 C ATOM 264 O PRO A 22 0.392 -2.787 -10.717 1.00 0.00 O ATOM 265 CB PRO A 22 1.776 -2.406 -7.947 1.00 0.00 C ATOM 266 CG PRO A 22 0.385 -2.285 -7.426 1.00 0.00 C ATOM 267 CD PRO A 22 -0.071 -0.897 -7.781 1.00 0.00 C ATOM 0 HA PRO A 22 2.749 -1.062 -9.404 1.00 0.00 H new ATOM 0 HB2 PRO A 22 2.027 -3.443 -8.169 1.00 0.00 H new ATOM 0 HB3 PRO A 22 2.504 -2.050 -7.218 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.266 -3.036 -7.874 1.00 0.00 H new ATOM 0 HG3 PRO A 22 0.357 -2.441 -6.348 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -1.141 -0.866 -7.987 1.00 0.00 H new ATOM 0 HD3 PRO A 22 0.118 -0.192 -6.971 1.00 0.00 H new ATOM 275 N GLN A 23 2.592 -2.715 -11.184 1.00 0.00 N ATOM 276 CA GLN A 23 2.476 -3.533 -12.385 1.00 0.00 C ATOM 277 C GLN A 23 3.110 -4.903 -12.175 1.00 0.00 C ATOM 278 O GLN A 23 3.558 -5.229 -11.076 1.00 0.00 O ATOM 279 CB GLN A 23 3.136 -2.829 -13.572 1.00 0.00 C ATOM 280 CG GLN A 23 3.053 -1.312 -13.503 1.00 0.00 C ATOM 281 CD GLN A 23 3.840 -0.634 -14.607 1.00 0.00 C ATOM 282 OE1 GLN A 23 3.704 -0.976 -15.782 1.00 0.00 O ATOM 283 NE2 GLN A 23 4.668 0.335 -14.235 1.00 0.00 N ATOM 0 H GLN A 23 3.542 -2.409 -10.972 1.00 0.00 H new ATOM 0 HA GLN A 23 1.416 -3.673 -12.597 1.00 0.00 H new ATOM 0 HB2 GLN A 23 4.184 -3.125 -13.623 1.00 0.00 H new ATOM 0 HB3 GLN A 23 2.664 -3.169 -14.494 1.00 0.00 H new ATOM 0 HG2 GLN A 23 2.009 -1.006 -13.566 1.00 0.00 H new ATOM 0 HG3 GLN A 23 3.427 -0.975 -12.536 1.00 0.00 H new ATOM 0 HE21 GLN A 23 4.749 0.586 -13.250 1.00 0.00 H new ATOM 0 HE22 GLN A 23 5.223 0.828 -14.935 1.00 0.00 H new ATOM 292 N ASN A 24 3.145 -5.703 -13.236 1.00 0.00 N ATOM 293 CA ASN A 24 3.724 -7.040 -13.167 1.00 0.00 C ATOM 294 C ASN A 24 3.093 -7.848 -12.037 1.00 0.00 C ATOM 295 O ASN A 24 3.730 -8.730 -11.460 1.00 0.00 O ATOM 296 CB ASN A 24 5.238 -6.953 -12.964 1.00 0.00 C ATOM 297 CG ASN A 24 5.994 -6.888 -14.277 1.00 0.00 C ATOM 298 OD1 ASN A 24 6.589 -7.874 -14.712 1.00 0.00 O ATOM 299 ND2 ASN A 24 5.975 -5.723 -14.914 1.00 0.00 N ATOM 0 H ASN A 24 2.779 -5.449 -14.154 1.00 0.00 H new ATOM 0 HA ASN A 24 3.520 -7.547 -14.110 1.00 0.00 H new ATOM 0 HB2 ASN A 24 5.472 -6.070 -12.369 1.00 0.00 H new ATOM 0 HB3 ASN A 24 5.576 -7.819 -12.396 1.00 0.00 H new ATOM 0 HD21 ASN A 24 6.467 -5.619 -15.801 1.00 0.00 H new ATOM 0 HD22 ASN A 24 5.468 -4.932 -14.516 1.00 0.00 H new ATOM 306 N LEU A 25 1.839 -7.542 -11.727 1.00 0.00 N ATOM 307 CA LEU A 25 1.121 -8.240 -10.666 1.00 0.00 C ATOM 308 C LEU A 25 1.027 -9.733 -10.963 1.00 0.00 C ATOM 309 O LEU A 25 1.103 -10.152 -12.118 1.00 0.00 O ATOM 310 CB LEU A 25 -0.282 -7.652 -10.500 1.00 0.00 C ATOM 311 CG LEU A 25 -1.169 -8.318 -9.447 1.00 0.00 C ATOM 312 CD1 LEU A 25 -0.671 -7.993 -8.047 1.00 0.00 C ATOM 313 CD2 LEU A 25 -2.616 -7.881 -9.616 1.00 0.00 C ATOM 0 H LEU A 25 1.298 -6.815 -12.195 1.00 0.00 H new ATOM 0 HA LEU A 25 1.676 -8.107 -9.737 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.184 -6.596 -10.248 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -0.792 -7.704 -11.462 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.118 -9.398 -9.586 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.314 -8.475 -7.311 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.350 -8.357 -7.930 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.691 -6.914 -7.895 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.233 -8.364 -8.859 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.685 -6.799 -9.504 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.969 -8.166 -10.607 1.00 0.00 H new ATOM 325 N SER A 26 0.858 -10.531 -9.914 1.00 0.00 N ATOM 326 CA SER A 26 0.755 -11.978 -10.062 1.00 0.00 C ATOM 327 C SER A 26 0.395 -12.635 -8.733 1.00 0.00 C ATOM 328 O SER A 26 0.553 -12.037 -7.668 1.00 0.00 O ATOM 329 CB SER A 26 2.071 -12.553 -10.589 1.00 0.00 C ATOM 330 OG SER A 26 2.191 -12.351 -11.987 1.00 0.00 O ATOM 0 H SER A 26 0.789 -10.200 -8.952 1.00 0.00 H new ATOM 0 HA SER A 26 -0.038 -12.190 -10.779 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.909 -12.081 -10.077 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.121 -13.619 -10.367 1.00 0.00 H new ATOM 0 HG SER A 26 1.518 -11.703 -12.283 1.00 0.00 H new ATOM 336 N LEU A 27 -0.088 -13.871 -8.804 1.00 0.00 N ATOM 337 CA LEU A 27 -0.470 -14.612 -7.607 1.00 0.00 C ATOM 338 C LEU A 27 0.080 -16.034 -7.649 1.00 0.00 C ATOM 339 O LEU A 27 -0.457 -16.897 -8.343 1.00 0.00 O ATOM 340 CB LEU A 27 -1.993 -14.646 -7.469 1.00 0.00 C ATOM 341 CG LEU A 27 -2.722 -13.332 -7.752 1.00 0.00 C ATOM 342 CD1 LEU A 27 -4.174 -13.596 -8.121 1.00 0.00 C ATOM 343 CD2 LEU A 27 -2.636 -12.404 -6.549 1.00 0.00 C ATOM 0 H LEU A 27 -0.224 -14.381 -9.677 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.044 -14.103 -6.742 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.382 -15.407 -8.145 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.239 -14.964 -6.456 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.236 -12.844 -8.597 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.677 -12.649 -8.319 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -4.215 -14.222 -9.012 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -4.672 -14.106 -7.296 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.160 -11.474 -6.769 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -3.096 -12.884 -5.685 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.590 -12.188 -6.330 1.00 0.00 H new ATOM 355 N GLU A 28 1.152 -16.271 -6.899 1.00 0.00 N ATOM 356 CA GLU A 28 1.773 -17.590 -6.850 1.00 0.00 C ATOM 357 C GLU A 28 1.123 -18.458 -5.777 1.00 0.00 C ATOM 358 O GLU A 28 1.574 -18.491 -4.632 1.00 0.00 O ATOM 359 CB GLU A 28 3.273 -17.461 -6.578 1.00 0.00 C ATOM 360 CG GLU A 28 4.048 -18.745 -6.823 1.00 0.00 C ATOM 361 CD GLU A 28 4.072 -19.142 -8.286 1.00 0.00 C ATOM 362 OE1 GLU A 28 4.232 -18.247 -9.142 1.00 0.00 O ATOM 363 OE2 GLU A 28 3.932 -20.349 -8.576 1.00 0.00 O ATOM 0 H GLU A 28 1.608 -15.568 -6.318 1.00 0.00 H new ATOM 0 HA GLU A 28 1.626 -18.069 -7.818 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.682 -16.673 -7.211 1.00 0.00 H new ATOM 0 HB3 GLU A 28 3.421 -17.149 -5.544 1.00 0.00 H new ATOM 0 HG2 GLU A 28 5.071 -18.621 -6.467 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.603 -19.551 -6.239 1.00 0.00 H new ATOM 370 N VAL A 29 0.059 -19.159 -6.156 1.00 0.00 N ATOM 371 CA VAL A 29 -0.654 -20.028 -5.227 1.00 0.00 C ATOM 372 C VAL A 29 0.298 -21.006 -4.548 1.00 0.00 C ATOM 373 O VAL A 29 0.755 -21.971 -5.161 1.00 0.00 O ATOM 374 CB VAL A 29 -1.764 -20.822 -5.941 1.00 0.00 C ATOM 375 CG1 VAL A 29 -2.549 -21.659 -4.942 1.00 0.00 C ATOM 376 CG2 VAL A 29 -2.686 -19.882 -6.703 1.00 0.00 C ATOM 0 H VAL A 29 -0.328 -19.142 -7.100 1.00 0.00 H new ATOM 0 HA VAL A 29 -1.106 -19.383 -4.474 1.00 0.00 H new ATOM 0 HB VAL A 29 -1.299 -21.498 -6.659 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.329 -22.213 -5.465 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -1.877 -22.359 -4.446 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -3.005 -21.005 -4.198 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.464 -20.460 -7.201 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.145 -19.180 -6.007 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.110 -19.332 -7.447 1.00 0.00 H new ATOM 386 N ARG A 30 0.594 -20.749 -3.278 1.00 0.00 N ATOM 387 CA ARG A 30 1.493 -21.606 -2.514 1.00 0.00 C ATOM 388 C ARG A 30 0.774 -22.867 -2.044 1.00 0.00 C ATOM 389 O ARG A 30 1.304 -23.972 -2.148 1.00 0.00 O ATOM 390 CB ARG A 30 2.056 -20.848 -1.311 1.00 0.00 C ATOM 391 CG ARG A 30 2.517 -19.437 -1.641 1.00 0.00 C ATOM 392 CD ARG A 30 3.974 -19.415 -2.076 1.00 0.00 C ATOM 393 NE ARG A 30 4.830 -20.166 -1.161 1.00 0.00 N ATOM 394 CZ ARG A 30 6.082 -20.510 -1.442 1.00 0.00 C ATOM 395 NH1 ARG A 30 6.621 -20.172 -2.605 1.00 0.00 N ATOM 396 NH2 ARG A 30 6.797 -21.194 -0.558 1.00 0.00 N ATOM 0 H ARG A 30 0.224 -19.954 -2.756 1.00 0.00 H new ATOM 0 HA ARG A 30 2.315 -21.900 -3.166 1.00 0.00 H new ATOM 0 HB2 ARG A 30 1.293 -20.799 -0.534 1.00 0.00 H new ATOM 0 HB3 ARG A 30 2.895 -21.408 -0.900 1.00 0.00 H new ATOM 0 HG2 ARG A 30 1.893 -19.025 -2.434 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.387 -18.797 -0.768 1.00 0.00 H new ATOM 0 HD2 ARG A 30 4.059 -19.834 -3.079 1.00 0.00 H new ATOM 0 HD3 ARG A 30 4.320 -18.383 -2.131 1.00 0.00 H new ATOM 0 HE ARG A 30 4.445 -20.441 -0.257 1.00 0.00 H new ATOM 0 HH11 ARG A 30 6.074 -19.646 -3.287 1.00 0.00 H new ATOM 0 HH12 ARG A 30 7.583 -20.438 -2.818 1.00 0.00 H new ATOM 0 HH21 ARG A 30 6.385 -21.456 0.338 1.00 0.00 H new ATOM 0 HH22 ARG A 30 7.758 -21.458 -0.774 1.00 0.00 H new ATOM 410 N ASN A 31 -0.437 -22.692 -1.524 1.00 0.00 N ATOM 411 CA ASN A 31 -1.229 -23.815 -1.036 1.00 0.00 C ATOM 412 C ASN A 31 -2.686 -23.681 -1.468 1.00 0.00 C ATOM 413 O ASN A 31 -3.045 -22.762 -2.204 1.00 0.00 O ATOM 414 CB ASN A 31 -1.143 -23.902 0.489 1.00 0.00 C ATOM 415 CG ASN A 31 0.027 -24.747 0.954 1.00 0.00 C ATOM 416 OD1 ASN A 31 0.221 -25.870 0.488 1.00 0.00 O ATOM 417 ND2 ASN A 31 0.814 -24.209 1.879 1.00 0.00 N ATOM 0 H ASN A 31 -0.891 -21.783 -1.430 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.823 -24.729 -1.469 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -1.050 -22.898 0.903 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -2.070 -24.323 0.879 1.00 0.00 H new ATOM 0 HD21 ASN A 31 1.617 -24.730 2.231 1.00 0.00 H new ATOM 0 HD22 ASN A 31 0.615 -23.275 2.237 1.00 0.00 H new ATOM 424 N SER A 32 -3.522 -24.605 -1.004 1.00 0.00 N ATOM 425 CA SER A 32 -4.940 -24.592 -1.344 1.00 0.00 C ATOM 426 C SER A 32 -5.703 -23.614 -0.457 1.00 0.00 C ATOM 427 O SER A 32 -6.833 -23.232 -0.761 1.00 0.00 O ATOM 428 CB SER A 32 -5.533 -25.996 -1.203 1.00 0.00 C ATOM 429 OG SER A 32 -5.612 -26.381 0.158 1.00 0.00 O ATOM 0 H SER A 32 -3.242 -25.371 -0.392 1.00 0.00 H new ATOM 0 HA SER A 32 -5.037 -24.267 -2.380 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.527 -26.021 -1.650 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.919 -26.710 -1.751 1.00 0.00 H new ATOM 0 HG SER A 32 -5.996 -27.281 0.222 1.00 0.00 H new ATOM 435 N LYS A 33 -5.077 -23.212 0.644 1.00 0.00 N ATOM 436 CA LYS A 33 -5.694 -22.278 1.578 1.00 0.00 C ATOM 437 C LYS A 33 -4.889 -20.985 1.666 1.00 0.00 C ATOM 438 O LYS A 33 -5.342 -19.999 2.248 1.00 0.00 O ATOM 439 CB LYS A 33 -5.811 -22.913 2.966 1.00 0.00 C ATOM 440 CG LYS A 33 -4.489 -23.418 3.517 1.00 0.00 C ATOM 441 CD LYS A 33 -3.755 -22.332 4.287 1.00 0.00 C ATOM 442 CE LYS A 33 -4.094 -22.376 5.769 1.00 0.00 C ATOM 443 NZ LYS A 33 -5.233 -21.477 6.105 1.00 0.00 N ATOM 0 H LYS A 33 -4.142 -23.519 0.911 1.00 0.00 H new ATOM 0 HA LYS A 33 -6.692 -22.041 1.209 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.227 -22.180 3.658 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.516 -23.743 2.918 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.668 -24.271 4.171 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.863 -23.771 2.697 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.680 -22.453 4.155 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.018 -21.355 3.881 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -4.342 -23.398 6.055 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -3.219 -22.086 6.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -5.861 -21.952 6.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.869 -20.598 6.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -5.765 -21.253 5.240 1.00 0.00 H new ATOM 457 N SER A 34 -3.695 -20.996 1.082 1.00 0.00 N ATOM 458 CA SER A 34 -2.827 -19.825 1.096 1.00 0.00 C ATOM 459 C SER A 34 -2.441 -19.417 -0.322 1.00 0.00 C ATOM 460 O SER A 34 -2.218 -20.267 -1.185 1.00 0.00 O ATOM 461 CB SER A 34 -1.568 -20.108 1.918 1.00 0.00 C ATOM 462 OG SER A 34 -0.539 -20.647 1.106 1.00 0.00 O ATOM 0 H SER A 34 -3.307 -21.803 0.593 1.00 0.00 H new ATOM 0 HA SER A 34 -3.375 -19.002 1.555 1.00 0.00 H new ATOM 0 HB2 SER A 34 -1.221 -19.187 2.386 1.00 0.00 H new ATOM 0 HB3 SER A 34 -1.804 -20.805 2.722 1.00 0.00 H new ATOM 0 HG SER A 34 0.255 -20.817 1.654 1.00 0.00 H new ATOM 468 N ILE A 35 -2.365 -18.111 -0.556 1.00 0.00 N ATOM 469 CA ILE A 35 -2.005 -17.590 -1.869 1.00 0.00 C ATOM 470 C ILE A 35 -0.974 -16.473 -1.753 1.00 0.00 C ATOM 471 O ILE A 35 -1.156 -15.524 -0.991 1.00 0.00 O ATOM 472 CB ILE A 35 -3.240 -17.059 -2.621 1.00 0.00 C ATOM 473 CG1 ILE A 35 -4.207 -18.204 -2.930 1.00 0.00 C ATOM 474 CG2 ILE A 35 -2.817 -16.356 -3.902 1.00 0.00 C ATOM 475 CD1 ILE A 35 -5.544 -17.737 -3.463 1.00 0.00 C ATOM 0 H ILE A 35 -2.548 -17.394 0.147 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.576 -18.419 -2.432 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.752 -16.337 -1.985 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.747 -18.871 -3.659 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.370 -18.787 -2.023 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.700 -15.986 -4.423 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.162 -15.519 -3.659 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.285 -17.058 -4.544 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.179 -18.601 -3.660 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.025 -17.094 -2.726 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.393 -17.180 -4.387 1.00 0.00 H new ATOM 487 N MET A 36 0.107 -16.591 -2.517 1.00 0.00 N ATOM 488 CA MET A 36 1.166 -15.588 -2.502 1.00 0.00 C ATOM 489 C MET A 36 0.892 -14.494 -3.529 1.00 0.00 C ATOM 490 O MET A 36 0.476 -14.775 -4.653 1.00 0.00 O ATOM 491 CB MET A 36 2.520 -16.242 -2.784 1.00 0.00 C ATOM 492 CG MET A 36 3.700 -15.305 -2.583 1.00 0.00 C ATOM 493 SD MET A 36 4.351 -15.358 -0.902 1.00 0.00 S ATOM 494 CE MET A 36 3.817 -13.765 -0.282 1.00 0.00 C ATOM 0 H MET A 36 0.273 -17.370 -3.154 1.00 0.00 H new ATOM 0 HA MET A 36 1.190 -15.134 -1.511 1.00 0.00 H new ATOM 0 HB2 MET A 36 2.639 -17.108 -2.133 1.00 0.00 H new ATOM 0 HB3 MET A 36 2.530 -16.611 -3.810 1.00 0.00 H new ATOM 0 HG2 MET A 36 4.492 -15.569 -3.284 1.00 0.00 H new ATOM 0 HG3 MET A 36 3.394 -14.286 -2.818 1.00 0.00 H new ATOM 0 HE1 MET A 36 3.953 -13.731 0.799 1.00 0.00 H new ATOM 0 HE2 MET A 36 4.409 -12.977 -0.747 1.00 0.00 H new ATOM 0 HE3 MET A 36 2.764 -13.616 -0.520 1.00 0.00 H new ATOM 504 N ILE A 37 1.129 -13.247 -3.135 1.00 0.00 N ATOM 505 CA ILE A 37 0.908 -12.112 -4.022 1.00 0.00 C ATOM 506 C ILE A 37 2.222 -11.415 -4.360 1.00 0.00 C ATOM 507 O ILE A 37 2.945 -10.965 -3.470 1.00 0.00 O ATOM 508 CB ILE A 37 -0.057 -11.088 -3.397 1.00 0.00 C ATOM 509 CG1 ILE A 37 -1.153 -11.805 -2.605 1.00 0.00 C ATOM 510 CG2 ILE A 37 -0.667 -10.206 -4.476 1.00 0.00 C ATOM 511 CD1 ILE A 37 -2.104 -10.863 -1.900 1.00 0.00 C ATOM 0 H ILE A 37 1.474 -12.998 -2.208 1.00 0.00 H new ATOM 0 HA ILE A 37 0.463 -12.507 -4.935 1.00 0.00 H new ATOM 0 HB ILE A 37 0.505 -10.453 -2.712 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.721 -12.442 -3.282 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.688 -12.459 -1.867 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.347 -9.488 -4.018 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.125 -9.672 -5.001 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.217 -10.825 -5.184 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -2.854 -11.440 -1.359 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.548 -10.243 -1.197 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.597 -10.226 -2.635 1.00 0.00 H new ATOM 523 N HIS A 38 2.524 -11.326 -5.651 1.00 0.00 N ATOM 524 CA HIS A 38 3.750 -10.681 -6.107 1.00 0.00 C ATOM 525 C HIS A 38 3.436 -9.509 -7.032 1.00 0.00 C ATOM 526 O HIS A 38 2.809 -9.682 -8.077 1.00 0.00 O ATOM 527 CB HIS A 38 4.644 -11.690 -6.829 1.00 0.00 C ATOM 528 CG HIS A 38 5.251 -12.712 -5.918 1.00 0.00 C ATOM 529 ND1 HIS A 38 6.148 -12.393 -4.921 1.00 0.00 N ATOM 530 CD2 HIS A 38 5.083 -14.054 -5.856 1.00 0.00 C ATOM 531 CE1 HIS A 38 6.508 -13.495 -4.286 1.00 0.00 C ATOM 532 NE2 HIS A 38 5.875 -14.516 -4.833 1.00 0.00 N ATOM 0 H HIS A 38 1.937 -11.692 -6.400 1.00 0.00 H new ATOM 0 HA HIS A 38 4.277 -10.300 -5.233 1.00 0.00 H new ATOM 0 HB2 HIS A 38 4.058 -12.200 -7.594 1.00 0.00 H new ATOM 0 HB3 HIS A 38 5.442 -11.154 -7.343 1.00 0.00 H new ATOM 0 HD2 HIS A 38 4.445 -14.650 -6.492 1.00 0.00 H new ATOM 0 HE1 HIS A 38 7.202 -13.551 -3.460 1.00 0.00 H new ATOM 0 HE2 HIS A 38 5.960 -15.490 -4.543 1.00 0.00 H new ATOM 541 N TRP A 39 3.875 -8.319 -6.640 1.00 0.00 N ATOM 542 CA TRP A 39 3.639 -7.118 -7.434 1.00 0.00 C ATOM 543 C TRP A 39 4.896 -6.259 -7.508 1.00 0.00 C ATOM 544 O TRP A 39 5.850 -6.474 -6.761 1.00 0.00 O ATOM 545 CB TRP A 39 2.486 -6.307 -6.840 1.00 0.00 C ATOM 546 CG TRP A 39 2.806 -5.715 -5.501 1.00 0.00 C ATOM 547 CD1 TRP A 39 3.393 -4.506 -5.258 1.00 0.00 C ATOM 548 CD2 TRP A 39 2.556 -6.306 -4.221 1.00 0.00 C ATOM 549 NE1 TRP A 39 3.524 -4.310 -3.905 1.00 0.00 N ATOM 550 CE2 TRP A 39 3.018 -5.399 -3.246 1.00 0.00 C ATOM 551 CE3 TRP A 39 1.987 -7.512 -3.803 1.00 0.00 C ATOM 552 CZ2 TRP A 39 2.927 -5.663 -1.882 1.00 0.00 C ATOM 553 CZ3 TRP A 39 1.898 -7.772 -2.449 1.00 0.00 C ATOM 554 CH2 TRP A 39 2.365 -6.851 -1.502 1.00 0.00 C ATOM 0 H TRP A 39 4.396 -8.159 -5.778 1.00 0.00 H new ATOM 0 HA TRP A 39 3.373 -7.427 -8.445 1.00 0.00 H new ATOM 0 HB2 TRP A 39 2.221 -5.506 -7.530 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.610 -6.949 -6.746 1.00 0.00 H new ATOM 0 HD1 TRP A 39 3.708 -3.807 -6.018 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.932 -3.487 -3.462 1.00 0.00 H new ATOM 0 HE3 TRP A 39 1.623 -8.228 -4.525 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 3.287 -4.955 -1.150 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 1.461 -8.701 -2.115 1.00 0.00 H new ATOM 0 HH2 TRP A 39 2.280 -7.084 -0.451 1.00 0.00 H new ATOM 565 N GLN A 40 4.891 -5.286 -8.414 1.00 0.00 N ATOM 566 CA GLN A 40 6.032 -4.396 -8.585 1.00 0.00 C ATOM 567 C GLN A 40 5.607 -2.936 -8.463 1.00 0.00 C ATOM 568 O GLN A 40 4.462 -2.573 -8.733 1.00 0.00 O ATOM 569 CB GLN A 40 6.694 -4.635 -9.943 1.00 0.00 C ATOM 570 CG GLN A 40 7.366 -5.994 -10.061 1.00 0.00 C ATOM 571 CD GLN A 40 8.520 -6.160 -9.092 1.00 0.00 C ATOM 572 OE1 GLN A 40 9.405 -5.309 -9.010 1.00 0.00 O ATOM 573 NE2 GLN A 40 8.516 -7.262 -8.350 1.00 0.00 N ATOM 0 H GLN A 40 4.109 -5.095 -9.040 1.00 0.00 H new ATOM 0 HA GLN A 40 6.751 -4.613 -7.795 1.00 0.00 H new ATOM 0 HB2 GLN A 40 5.942 -4.542 -10.726 1.00 0.00 H new ATOM 0 HB3 GLN A 40 7.436 -3.856 -10.119 1.00 0.00 H new ATOM 0 HG2 GLN A 40 6.629 -6.776 -9.880 1.00 0.00 H new ATOM 0 HG3 GLN A 40 7.730 -6.128 -11.080 1.00 0.00 H new ATOM 0 HE21 GLN A 40 7.762 -7.942 -8.450 1.00 0.00 H new ATOM 0 HE22 GLN A 40 9.267 -7.428 -7.680 1.00 0.00 H new ATOM 582 N PRO A 41 6.550 -2.077 -8.048 1.00 0.00 N ATOM 583 CA PRO A 41 6.296 -0.643 -7.881 1.00 0.00 C ATOM 584 C PRO A 41 6.097 0.069 -9.214 1.00 0.00 C ATOM 585 O PRO A 41 6.726 -0.258 -10.221 1.00 0.00 O ATOM 586 CB PRO A 41 7.564 -0.137 -7.189 1.00 0.00 C ATOM 587 CG PRO A 41 8.623 -1.109 -7.580 1.00 0.00 C ATOM 588 CD PRO A 41 7.936 -2.440 -7.709 1.00 0.00 C ATOM 0 HA PRO A 41 5.382 -0.454 -7.318 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.815 0.873 -7.512 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.438 -0.103 -6.107 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.091 -0.819 -8.521 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.413 -1.149 -6.830 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.392 -3.054 -8.486 1.00 0.00 H new ATOM 0 HD3 PRO A 41 7.987 -3.010 -6.781 1.00 0.00 H new ATOM 596 N PRO A 42 5.200 1.066 -9.225 1.00 0.00 N ATOM 597 CA PRO A 42 4.897 1.846 -10.429 1.00 0.00 C ATOM 598 C PRO A 42 6.054 2.751 -10.840 1.00 0.00 C ATOM 599 O PRO A 42 7.028 2.903 -10.102 1.00 0.00 O ATOM 600 CB PRO A 42 3.685 2.684 -10.014 1.00 0.00 C ATOM 601 CG PRO A 42 3.792 2.797 -8.532 1.00 0.00 C ATOM 602 CD PRO A 42 4.412 1.510 -8.063 1.00 0.00 C ATOM 0 HA PRO A 42 4.715 1.207 -11.293 1.00 0.00 H new ATOM 0 HB2 PRO A 42 3.701 3.665 -10.488 1.00 0.00 H new ATOM 0 HB3 PRO A 42 2.752 2.203 -10.308 1.00 0.00 H new ATOM 0 HG2 PRO A 42 4.406 3.652 -8.249 1.00 0.00 H new ATOM 0 HG3 PRO A 42 2.811 2.945 -8.080 1.00 0.00 H new ATOM 0 HD2 PRO A 42 5.041 1.663 -7.186 1.00 0.00 H new ATOM 0 HD3 PRO A 42 3.654 0.776 -7.787 1.00 0.00 H new ATOM 610 N ALA A 43 5.941 3.349 -12.021 1.00 0.00 N ATOM 611 CA ALA A 43 6.977 4.241 -12.528 1.00 0.00 C ATOM 612 C ALA A 43 7.230 5.393 -11.562 1.00 0.00 C ATOM 613 O ALA A 43 6.319 5.895 -10.904 1.00 0.00 O ATOM 614 CB ALA A 43 6.589 4.774 -13.899 1.00 0.00 C ATOM 0 H ALA A 43 5.143 3.232 -12.645 1.00 0.00 H new ATOM 0 HA ALA A 43 7.901 3.670 -12.621 1.00 0.00 H new ATOM 0 HB1 ALA A 43 7.371 5.439 -14.266 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.466 3.941 -14.592 1.00 0.00 H new ATOM 0 HB3 ALA A 43 5.651 5.324 -13.823 1.00 0.00 H new ATOM 620 N PRO A 44 8.497 5.824 -11.473 1.00 0.00 N ATOM 621 CA PRO A 44 8.899 6.923 -10.590 1.00 0.00 C ATOM 622 C PRO A 44 8.370 8.272 -11.065 1.00 0.00 C ATOM 623 O PRO A 44 8.082 9.155 -10.258 1.00 0.00 O ATOM 624 CB PRO A 44 10.428 6.893 -10.660 1.00 0.00 C ATOM 625 CG PRO A 44 10.735 6.267 -11.976 1.00 0.00 C ATOM 626 CD PRO A 44 9.635 5.273 -12.228 1.00 0.00 C ATOM 0 HA PRO A 44 8.502 6.802 -9.582 1.00 0.00 H new ATOM 0 HB2 PRO A 44 10.847 7.897 -10.592 1.00 0.00 H new ATOM 0 HB3 PRO A 44 10.851 6.315 -9.838 1.00 0.00 H new ATOM 0 HG2 PRO A 44 10.772 7.017 -12.766 1.00 0.00 H new ATOM 0 HG3 PRO A 44 11.708 5.776 -11.957 1.00 0.00 H new ATOM 0 HD2 PRO A 44 9.408 5.186 -13.291 1.00 0.00 H new ATOM 0 HD3 PRO A 44 9.905 4.277 -11.877 1.00 0.00 H new ATOM 634 N ALA A 45 8.245 8.424 -12.379 1.00 0.00 N ATOM 635 CA ALA A 45 7.748 9.664 -12.961 1.00 0.00 C ATOM 636 C ALA A 45 6.285 9.894 -12.598 1.00 0.00 C ATOM 637 O ALA A 45 5.841 11.034 -12.454 1.00 0.00 O ATOM 638 CB ALA A 45 7.922 9.645 -14.473 1.00 0.00 C ATOM 0 H ALA A 45 8.481 7.703 -13.061 1.00 0.00 H new ATOM 0 HA ALA A 45 8.331 10.488 -12.549 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.546 10.578 -14.894 1.00 0.00 H new ATOM 0 HB2 ALA A 45 8.979 9.537 -14.716 1.00 0.00 H new ATOM 0 HB3 ALA A 45 7.365 8.807 -14.893 1.00 0.00 H new ATOM 644 N THR A 46 5.539 8.804 -12.451 1.00 0.00 N ATOM 645 CA THR A 46 4.125 8.887 -12.106 1.00 0.00 C ATOM 646 C THR A 46 3.936 9.115 -10.611 1.00 0.00 C ATOM 647 O THR A 46 3.145 9.963 -10.199 1.00 0.00 O ATOM 648 CB THR A 46 3.371 7.608 -12.519 1.00 0.00 C ATOM 649 OG1 THR A 46 4.042 6.455 -12.000 1.00 0.00 O ATOM 650 CG2 THR A 46 3.269 7.504 -14.033 1.00 0.00 C ATOM 0 H THR A 46 5.890 7.853 -12.565 1.00 0.00 H new ATOM 0 HA THR A 46 3.715 9.735 -12.654 1.00 0.00 H new ATOM 0 HB THR A 46 2.363 7.658 -12.106 1.00 0.00 H new ATOM 0 HG1 THR A 46 4.908 6.721 -11.626 1.00 0.00 H new ATOM 0 HG21 THR A 46 2.733 6.593 -14.300 1.00 0.00 H new ATOM 0 HG22 THR A 46 2.731 8.369 -14.422 1.00 0.00 H new ATOM 0 HG23 THR A 46 4.270 7.475 -14.464 1.00 0.00 H new ATOM 658 N GLN A 47 4.667 8.352 -9.804 1.00 0.00 N ATOM 659 CA GLN A 47 4.578 8.473 -8.353 1.00 0.00 C ATOM 660 C GLN A 47 4.445 9.933 -7.935 1.00 0.00 C ATOM 661 O GLN A 47 5.036 10.821 -8.549 1.00 0.00 O ATOM 662 CB GLN A 47 5.810 7.851 -7.693 1.00 0.00 C ATOM 663 CG GLN A 47 5.723 6.341 -7.541 1.00 0.00 C ATOM 664 CD GLN A 47 6.950 5.749 -6.878 1.00 0.00 C ATOM 665 OE1 GLN A 47 7.602 6.399 -6.060 1.00 0.00 O ATOM 666 NE2 GLN A 47 7.272 4.509 -7.227 1.00 0.00 N ATOM 0 H GLN A 47 5.326 7.645 -10.129 1.00 0.00 H new ATOM 0 HA GLN A 47 3.688 7.938 -8.023 1.00 0.00 H new ATOM 0 HB2 GLN A 47 6.692 8.098 -8.284 1.00 0.00 H new ATOM 0 HB3 GLN A 47 5.950 8.299 -6.709 1.00 0.00 H new ATOM 0 HG2 GLN A 47 4.840 6.089 -6.953 1.00 0.00 H new ATOM 0 HG3 GLN A 47 5.592 5.888 -8.524 1.00 0.00 H new ATOM 0 HE21 GLN A 47 6.703 4.007 -7.909 1.00 0.00 H new ATOM 0 HE22 GLN A 47 8.088 4.058 -6.813 1.00 0.00 H new ATOM 675 N ASN A 48 3.665 10.175 -6.887 1.00 0.00 N ATOM 676 CA ASN A 48 3.453 11.529 -6.388 1.00 0.00 C ATOM 677 C ASN A 48 3.991 11.675 -4.967 1.00 0.00 C ATOM 678 O ASN A 48 4.189 12.786 -4.479 1.00 0.00 O ATOM 679 CB ASN A 48 1.964 11.879 -6.419 1.00 0.00 C ATOM 680 CG ASN A 48 1.452 12.103 -7.829 1.00 0.00 C ATOM 681 OD1 ASN A 48 2.231 12.328 -8.756 1.00 0.00 O ATOM 682 ND2 ASN A 48 0.137 12.041 -7.998 1.00 0.00 N ATOM 0 H ASN A 48 3.169 9.451 -6.367 1.00 0.00 H new ATOM 0 HA ASN A 48 3.995 12.218 -7.036 1.00 0.00 H new ATOM 0 HB2 ASN A 48 1.395 11.075 -5.952 1.00 0.00 H new ATOM 0 HB3 ASN A 48 1.792 12.777 -5.826 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -0.265 12.182 -8.925 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -0.471 11.852 -7.201 1.00 0.00 H new ATOM 689 N GLY A 49 4.227 10.543 -4.310 1.00 0.00 N ATOM 690 CA GLY A 49 4.740 10.567 -2.953 1.00 0.00 C ATOM 691 C GLY A 49 5.312 9.229 -2.526 1.00 0.00 C ATOM 692 O GLY A 49 4.947 8.189 -3.072 1.00 0.00 O ATOM 0 H GLY A 49 4.072 9.611 -4.693 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.513 11.331 -2.873 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.939 10.851 -2.270 1.00 0.00 H new ATOM 696 N GLN A 50 6.212 9.257 -1.549 1.00 0.00 N ATOM 697 CA GLN A 50 6.837 8.037 -1.051 1.00 0.00 C ATOM 698 C GLN A 50 5.784 7.032 -0.598 1.00 0.00 C ATOM 699 O GLN A 50 4.838 7.385 0.106 1.00 0.00 O ATOM 700 CB GLN A 50 7.784 8.360 0.106 1.00 0.00 C ATOM 701 CG GLN A 50 7.070 8.837 1.361 1.00 0.00 C ATOM 702 CD GLN A 50 8.031 9.209 2.473 1.00 0.00 C ATOM 703 OE1 GLN A 50 8.633 10.283 2.455 1.00 0.00 O ATOM 704 NE2 GLN A 50 8.180 8.321 3.449 1.00 0.00 N ATOM 0 H GLN A 50 6.525 10.111 -1.086 1.00 0.00 H new ATOM 0 HA GLN A 50 7.409 7.593 -1.865 1.00 0.00 H new ATOM 0 HB2 GLN A 50 8.368 7.471 0.346 1.00 0.00 H new ATOM 0 HB3 GLN A 50 8.488 9.127 -0.215 1.00 0.00 H new ATOM 0 HG2 GLN A 50 6.451 9.700 1.117 1.00 0.00 H new ATOM 0 HG3 GLN A 50 6.399 8.053 1.713 1.00 0.00 H new ATOM 0 HE21 GLN A 50 7.661 7.443 3.424 1.00 0.00 H new ATOM 0 HE22 GLN A 50 8.813 8.517 4.224 1.00 0.00 H new ATOM 713 N ILE A 51 5.955 5.779 -1.006 1.00 0.00 N ATOM 714 CA ILE A 51 5.019 4.723 -0.641 1.00 0.00 C ATOM 715 C ILE A 51 5.254 4.251 0.790 1.00 0.00 C ATOM 716 O ILE A 51 6.351 3.813 1.139 1.00 0.00 O ATOM 717 CB ILE A 51 5.131 3.517 -1.592 1.00 0.00 C ATOM 718 CG1 ILE A 51 4.618 3.889 -2.985 1.00 0.00 C ATOM 719 CG2 ILE A 51 4.359 2.330 -1.037 1.00 0.00 C ATOM 720 CD1 ILE A 51 5.091 2.951 -4.074 1.00 0.00 C ATOM 0 H ILE A 51 6.733 5.470 -1.589 1.00 0.00 H new ATOM 0 HA ILE A 51 4.018 5.147 -0.722 1.00 0.00 H new ATOM 0 HB ILE A 51 6.181 3.235 -1.675 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.528 3.897 -2.972 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.941 4.902 -3.224 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.448 1.486 -1.721 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.766 2.054 -0.064 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.308 2.598 -0.927 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.689 3.276 -5.034 1.00 0.00 H new ATOM 0 HD12 ILE A 51 6.180 2.961 -4.115 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.745 1.940 -3.859 1.00 0.00 H new ATOM 732 N THR A 52 4.216 4.342 1.616 1.00 0.00 N ATOM 733 CA THR A 52 4.308 3.923 3.009 1.00 0.00 C ATOM 734 C THR A 52 3.879 2.470 3.176 1.00 0.00 C ATOM 735 O THR A 52 4.359 1.770 4.066 1.00 0.00 O ATOM 736 CB THR A 52 3.441 4.812 3.921 1.00 0.00 C ATOM 737 OG1 THR A 52 2.063 4.700 3.546 1.00 0.00 O ATOM 738 CG2 THR A 52 3.879 6.266 3.835 1.00 0.00 C ATOM 0 H THR A 52 3.301 4.702 1.344 1.00 0.00 H new ATOM 0 HA THR A 52 5.353 4.025 3.302 1.00 0.00 H new ATOM 0 HB THR A 52 3.567 4.472 4.949 1.00 0.00 H new ATOM 0 HG1 THR A 52 1.518 5.267 4.131 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.252 6.874 4.487 1.00 0.00 H new ATOM 0 HG22 THR A 52 4.919 6.352 4.148 1.00 0.00 H new ATOM 0 HG23 THR A 52 3.780 6.616 2.807 1.00 0.00 H new ATOM 746 N GLY A 53 2.971 2.023 2.313 1.00 0.00 N ATOM 747 CA GLY A 53 2.493 0.654 2.383 1.00 0.00 C ATOM 748 C GLY A 53 1.475 0.341 1.305 1.00 0.00 C ATOM 749 O GLY A 53 1.000 1.239 0.609 1.00 0.00 O ATOM 0 H GLY A 53 2.558 2.584 1.568 1.00 0.00 H new ATOM 0 HA2 GLY A 53 3.338 -0.028 2.290 1.00 0.00 H new ATOM 0 HA3 GLY A 53 2.047 0.477 3.362 1.00 0.00 H new ATOM 753 N TYR A 54 1.140 -0.937 1.164 1.00 0.00 N ATOM 754 CA TYR A 54 0.175 -1.368 0.159 1.00 0.00 C ATOM 755 C TYR A 54 -1.063 -1.971 0.816 1.00 0.00 C ATOM 756 O TYR A 54 -0.972 -2.631 1.852 1.00 0.00 O ATOM 757 CB TYR A 54 0.812 -2.387 -0.786 1.00 0.00 C ATOM 758 CG TYR A 54 1.872 -1.796 -1.688 1.00 0.00 C ATOM 759 CD1 TYR A 54 3.122 -1.450 -1.190 1.00 0.00 C ATOM 760 CD2 TYR A 54 1.624 -1.584 -3.039 1.00 0.00 C ATOM 761 CE1 TYR A 54 4.093 -0.909 -2.010 1.00 0.00 C ATOM 762 CE2 TYR A 54 2.590 -1.045 -3.866 1.00 0.00 C ATOM 763 CZ TYR A 54 3.823 -0.709 -3.347 1.00 0.00 C ATOM 764 OH TYR A 54 4.787 -0.171 -4.168 1.00 0.00 O ATOM 0 H TYR A 54 1.522 -1.692 1.733 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.130 -0.492 -0.414 1.00 0.00 H new ATOM 0 HB2 TYR A 54 1.255 -3.190 -0.196 1.00 0.00 H new ATOM 0 HB3 TYR A 54 0.032 -2.836 -1.401 1.00 0.00 H new ATOM 0 HD1 TYR A 54 3.338 -1.607 -0.144 1.00 0.00 H new ATOM 0 HD2 TYR A 54 0.660 -1.845 -3.449 1.00 0.00 H new ATOM 0 HE1 TYR A 54 5.059 -0.644 -1.606 1.00 0.00 H new ATOM 0 HE2 TYR A 54 2.381 -0.887 -4.914 1.00 0.00 H new ATOM 0 HH TYR A 54 4.436 -0.097 -5.080 1.00 0.00 H new ATOM 774 N LYS A 55 -2.221 -1.739 0.207 1.00 0.00 N ATOM 775 CA LYS A 55 -3.478 -2.260 0.729 1.00 0.00 C ATOM 776 C LYS A 55 -3.995 -3.404 -0.138 1.00 0.00 C ATOM 777 O LYS A 55 -4.598 -3.177 -1.187 1.00 0.00 O ATOM 778 CB LYS A 55 -4.525 -1.146 0.799 1.00 0.00 C ATOM 779 CG LYS A 55 -5.545 -1.339 1.908 1.00 0.00 C ATOM 780 CD LYS A 55 -6.408 -0.102 2.094 1.00 0.00 C ATOM 781 CE LYS A 55 -6.873 0.043 3.535 1.00 0.00 C ATOM 782 NZ LYS A 55 -7.469 1.383 3.794 1.00 0.00 N ATOM 0 H LYS A 55 -2.315 -1.193 -0.649 1.00 0.00 H new ATOM 0 HA LYS A 55 -3.295 -2.643 1.733 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -4.019 -0.192 0.944 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -5.046 -1.088 -0.157 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -6.179 -2.194 1.675 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -5.030 -1.568 2.841 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -5.844 0.784 1.802 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -7.274 -0.159 1.435 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -7.608 -0.730 3.759 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -6.029 -0.115 4.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -7.773 1.442 4.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -6.761 2.120 3.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -8.290 1.524 3.171 1.00 0.00 H new ATOM 796 N ILE A 56 -3.757 -4.633 0.309 1.00 0.00 N ATOM 797 CA ILE A 56 -4.201 -5.811 -0.425 1.00 0.00 C ATOM 798 C ILE A 56 -5.558 -6.292 0.076 1.00 0.00 C ATOM 799 O ILE A 56 -5.697 -6.694 1.232 1.00 0.00 O ATOM 800 CB ILE A 56 -3.185 -6.963 -0.309 1.00 0.00 C ATOM 801 CG1 ILE A 56 -1.801 -6.499 -0.767 1.00 0.00 C ATOM 802 CG2 ILE A 56 -3.646 -8.160 -1.126 1.00 0.00 C ATOM 803 CD1 ILE A 56 -0.680 -7.411 -0.321 1.00 0.00 C ATOM 0 H ILE A 56 -3.259 -4.838 1.175 1.00 0.00 H new ATOM 0 HA ILE A 56 -4.286 -5.517 -1.471 1.00 0.00 H new ATOM 0 HB ILE A 56 -3.118 -7.266 0.736 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.791 -6.430 -1.855 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -1.617 -5.496 -0.382 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -2.918 -8.966 -1.034 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -4.613 -8.501 -0.757 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.738 -7.872 -2.173 1.00 0.00 H new ATOM 0 HD11 ILE A 56 0.272 -7.021 -0.681 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.663 -7.461 0.768 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -0.840 -8.410 -0.728 1.00 0.00 H new ATOM 815 N ARG A 57 -6.556 -6.250 -0.800 1.00 0.00 N ATOM 816 CA ARG A 57 -7.903 -6.682 -0.447 1.00 0.00 C ATOM 817 C ARG A 57 -8.360 -7.826 -1.347 1.00 0.00 C ATOM 818 O ARG A 57 -8.001 -7.886 -2.523 1.00 0.00 O ATOM 819 CB ARG A 57 -8.882 -5.512 -0.553 1.00 0.00 C ATOM 820 CG ARG A 57 -8.963 -4.668 0.708 1.00 0.00 C ATOM 821 CD ARG A 57 -9.393 -3.243 0.399 1.00 0.00 C ATOM 822 NE ARG A 57 -9.459 -2.418 1.602 1.00 0.00 N ATOM 823 CZ ARG A 57 -10.424 -2.516 2.510 1.00 0.00 C ATOM 824 NH1 ARG A 57 -11.399 -3.400 2.352 1.00 0.00 N ATOM 825 NH2 ARG A 57 -10.414 -1.730 3.578 1.00 0.00 N ATOM 0 H ARG A 57 -6.457 -5.921 -1.760 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.885 -7.038 0.583 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.585 -4.876 -1.387 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -9.874 -5.900 -0.785 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -9.670 -5.119 1.404 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.992 -4.657 1.202 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.692 -2.798 -0.308 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -10.369 -3.256 -0.086 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.723 -1.728 1.754 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -11.409 -4.007 1.532 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -12.139 -3.474 3.050 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -9.665 -1.049 3.703 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -11.155 -1.806 4.274 1.00 0.00 H new ATOM 839 N TYR A 58 -9.154 -8.732 -0.786 1.00 0.00 N ATOM 840 CA TYR A 58 -9.658 -9.876 -1.537 1.00 0.00 C ATOM 841 C TYR A 58 -11.049 -10.275 -1.052 1.00 0.00 C ATOM 842 O TYR A 58 -11.435 -9.975 0.078 1.00 0.00 O ATOM 843 CB TYR A 58 -8.701 -11.061 -1.406 1.00 0.00 C ATOM 844 CG TYR A 58 -8.335 -11.389 0.024 1.00 0.00 C ATOM 845 CD1 TYR A 58 -7.582 -10.506 0.789 1.00 0.00 C ATOM 846 CD2 TYR A 58 -8.741 -12.581 0.610 1.00 0.00 C ATOM 847 CE1 TYR A 58 -7.245 -10.802 2.096 1.00 0.00 C ATOM 848 CE2 TYR A 58 -8.410 -12.885 1.916 1.00 0.00 C ATOM 849 CZ TYR A 58 -7.662 -11.992 2.655 1.00 0.00 C ATOM 850 OH TYR A 58 -7.329 -12.291 3.956 1.00 0.00 O ATOM 0 H TYR A 58 -9.462 -8.696 0.186 1.00 0.00 H new ATOM 0 HA TYR A 58 -9.727 -9.588 -2.586 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -9.157 -11.938 -1.866 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -7.790 -10.845 -1.965 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -7.255 -9.573 0.355 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -9.326 -13.283 0.034 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -6.658 -10.105 2.677 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -8.735 -13.816 2.356 1.00 0.00 H new ATOM 0 HH TYR A 58 -7.701 -13.165 4.196 1.00 0.00 H new ATOM 860 N ARG A 59 -11.797 -10.954 -1.915 1.00 0.00 N ATOM 861 CA ARG A 59 -13.144 -11.395 -1.577 1.00 0.00 C ATOM 862 C ARG A 59 -13.430 -12.773 -2.167 1.00 0.00 C ATOM 863 O ARG A 59 -12.585 -13.358 -2.845 1.00 0.00 O ATOM 864 CB ARG A 59 -14.177 -10.387 -2.086 1.00 0.00 C ATOM 865 CG ARG A 59 -13.980 -9.996 -3.541 1.00 0.00 C ATOM 866 CD ARG A 59 -14.815 -8.780 -3.909 1.00 0.00 C ATOM 867 NE ARG A 59 -14.104 -7.530 -3.650 1.00 0.00 N ATOM 868 CZ ARG A 59 -14.710 -6.357 -3.500 1.00 0.00 C ATOM 869 NH1 ARG A 59 -16.031 -6.275 -3.582 1.00 0.00 N ATOM 870 NH2 ARG A 59 -13.995 -5.265 -3.267 1.00 0.00 N ATOM 0 H ARG A 59 -11.493 -11.211 -2.854 1.00 0.00 H new ATOM 0 HA ARG A 59 -13.215 -11.462 -0.491 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -15.175 -10.809 -1.964 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -14.132 -9.490 -1.468 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -12.926 -9.784 -3.722 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -14.252 -10.833 -4.184 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -15.086 -8.832 -4.964 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -15.745 -8.793 -3.340 1.00 0.00 H new ATOM 0 HE ARG A 59 -13.087 -7.559 -3.581 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -16.584 -7.113 -3.761 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -16.494 -5.374 -3.467 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -12.979 -5.325 -3.203 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -14.461 -4.365 -3.152 1.00 0.00 H new ATOM 884 N LYS A 60 -14.627 -13.287 -1.904 1.00 0.00 N ATOM 885 CA LYS A 60 -15.025 -14.596 -2.409 1.00 0.00 C ATOM 886 C LYS A 60 -15.899 -14.457 -3.651 1.00 0.00 C ATOM 887 O LYS A 60 -16.854 -13.681 -3.666 1.00 0.00 O ATOM 888 CB LYS A 60 -15.778 -15.374 -1.327 1.00 0.00 C ATOM 889 CG LYS A 60 -14.872 -16.199 -0.429 1.00 0.00 C ATOM 890 CD LYS A 60 -15.635 -16.783 0.748 1.00 0.00 C ATOM 891 CE LYS A 60 -16.480 -17.976 0.327 1.00 0.00 C ATOM 892 NZ LYS A 60 -17.400 -18.415 1.413 1.00 0.00 N ATOM 0 H LYS A 60 -15.338 -12.817 -1.344 1.00 0.00 H new ATOM 0 HA LYS A 60 -14.123 -15.143 -2.681 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -16.343 -14.672 -0.713 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -16.502 -16.035 -1.804 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -14.421 -17.005 -1.008 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -14.057 -15.576 -0.062 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -14.932 -17.089 1.523 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -16.276 -16.017 1.184 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -17.061 -17.715 -0.558 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -15.827 -18.803 0.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -17.958 -19.230 1.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -16.845 -18.688 2.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -18.040 -17.634 1.662 1.00 0.00 H new ATOM 906 N ALA A 61 -15.566 -15.215 -4.691 1.00 0.00 N ATOM 907 CA ALA A 61 -16.323 -15.178 -5.936 1.00 0.00 C ATOM 908 C ALA A 61 -17.820 -15.295 -5.672 1.00 0.00 C ATOM 909 O ALA A 61 -18.615 -14.512 -6.192 1.00 0.00 O ATOM 910 CB ALA A 61 -15.860 -16.288 -6.868 1.00 0.00 C ATOM 0 H ALA A 61 -14.777 -15.862 -4.696 1.00 0.00 H new ATOM 0 HA ALA A 61 -16.140 -14.216 -6.416 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -16.434 -16.249 -7.794 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.801 -16.158 -7.091 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -16.013 -17.254 -6.387 1.00 0.00 H new ATOM 916 N SER A 62 -18.199 -16.279 -4.863 1.00 0.00 N ATOM 917 CA SER A 62 -19.602 -16.502 -4.534 1.00 0.00 C ATOM 918 C SER A 62 -20.140 -15.374 -3.658 1.00 0.00 C ATOM 919 O SER A 62 -21.276 -14.932 -3.826 1.00 0.00 O ATOM 920 CB SER A 62 -19.773 -17.844 -3.819 1.00 0.00 C ATOM 921 OG SER A 62 -21.056 -17.945 -3.225 1.00 0.00 O ATOM 0 H SER A 62 -17.554 -16.935 -4.423 1.00 0.00 H new ATOM 0 HA SER A 62 -20.170 -16.519 -5.464 1.00 0.00 H new ATOM 0 HB2 SER A 62 -19.632 -18.659 -4.529 1.00 0.00 H new ATOM 0 HB3 SER A 62 -19.005 -17.952 -3.053 1.00 0.00 H new ATOM 0 HG SER A 62 -21.141 -18.812 -2.776 1.00 0.00 H new ATOM 927 N ARG A 63 -19.315 -14.914 -2.724 1.00 0.00 N ATOM 928 CA ARG A 63 -19.707 -13.839 -1.820 1.00 0.00 C ATOM 929 C ARG A 63 -18.696 -12.697 -1.863 1.00 0.00 C ATOM 930 O ARG A 63 -17.789 -12.625 -1.034 1.00 0.00 O ATOM 931 CB ARG A 63 -19.836 -14.367 -0.390 1.00 0.00 C ATOM 932 CG ARG A 63 -20.151 -13.287 0.632 1.00 0.00 C ATOM 933 CD ARG A 63 -21.651 -13.094 0.793 1.00 0.00 C ATOM 934 NE ARG A 63 -22.247 -14.121 1.644 1.00 0.00 N ATOM 935 CZ ARG A 63 -23.538 -14.161 1.952 1.00 0.00 C ATOM 936 NH1 ARG A 63 -24.365 -13.237 1.481 1.00 0.00 N ATOM 937 NH2 ARG A 63 -24.006 -15.127 2.732 1.00 0.00 N ATOM 0 H ARG A 63 -18.371 -15.269 -2.573 1.00 0.00 H new ATOM 0 HA ARG A 63 -20.674 -13.458 -2.147 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -20.620 -15.123 -0.360 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -18.906 -14.861 -0.109 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -19.712 -13.555 1.593 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -19.693 -12.347 0.323 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -21.846 -12.111 1.221 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -22.126 -13.115 -0.188 1.00 0.00 H new ATOM 0 HE ARG A 63 -21.638 -14.847 2.022 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -24.010 -12.493 0.880 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -25.356 -13.270 1.719 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -23.374 -15.840 3.096 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -24.998 -15.157 2.968 1.00 0.00 H new ATOM 951 N LYS A 64 -18.859 -11.806 -2.835 1.00 0.00 N ATOM 952 CA LYS A 64 -17.962 -10.666 -2.986 1.00 0.00 C ATOM 953 C LYS A 64 -18.062 -9.731 -1.785 1.00 0.00 C ATOM 954 O LYS A 64 -17.048 -9.306 -1.232 1.00 0.00 O ATOM 955 CB LYS A 64 -18.290 -9.900 -4.270 1.00 0.00 C ATOM 956 CG LYS A 64 -17.524 -10.394 -5.485 1.00 0.00 C ATOM 957 CD LYS A 64 -18.277 -11.496 -6.209 1.00 0.00 C ATOM 958 CE LYS A 64 -17.757 -11.690 -7.625 1.00 0.00 C ATOM 959 NZ LYS A 64 -16.313 -12.053 -7.641 1.00 0.00 N ATOM 0 H LYS A 64 -19.604 -11.851 -3.530 1.00 0.00 H new ATOM 0 HA LYS A 64 -16.941 -11.044 -3.045 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -19.359 -9.980 -4.468 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -18.072 -8.843 -4.118 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -17.348 -9.563 -6.168 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -16.547 -10.763 -5.174 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -18.181 -12.429 -5.654 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -19.339 -11.252 -6.241 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -18.333 -12.472 -8.120 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -17.907 -10.774 -8.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -15.778 -11.326 -8.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -15.960 -12.116 -6.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -16.191 -12.972 -8.113 1.00 0.00 H new ATOM 973 N SER A 65 -19.290 -9.417 -1.385 1.00 0.00 N ATOM 974 CA SER A 65 -19.522 -8.531 -0.251 1.00 0.00 C ATOM 975 C SER A 65 -18.451 -8.727 0.819 1.00 0.00 C ATOM 976 O SER A 65 -17.813 -7.769 1.256 1.00 0.00 O ATOM 977 CB SER A 65 -20.907 -8.784 0.346 1.00 0.00 C ATOM 978 OG SER A 65 -21.904 -8.061 -0.354 1.00 0.00 O ATOM 0 H SER A 65 -20.140 -9.763 -1.830 1.00 0.00 H new ATOM 0 HA SER A 65 -19.471 -7.503 -0.608 1.00 0.00 H new ATOM 0 HB2 SER A 65 -21.133 -9.850 0.309 1.00 0.00 H new ATOM 0 HB3 SER A 65 -20.912 -8.493 1.396 1.00 0.00 H new ATOM 0 HG SER A 65 -22.780 -8.241 0.046 1.00 0.00 H new ATOM 984 N ASP A 66 -18.261 -9.974 1.235 1.00 0.00 N ATOM 985 CA ASP A 66 -17.268 -10.297 2.253 1.00 0.00 C ATOM 986 C ASP A 66 -15.855 -10.065 1.726 1.00 0.00 C ATOM 987 O ASP A 66 -15.357 -10.828 0.898 1.00 0.00 O ATOM 988 CB ASP A 66 -17.424 -11.750 2.706 1.00 0.00 C ATOM 989 CG ASP A 66 -16.908 -11.976 4.113 1.00 0.00 C ATOM 990 OD1 ASP A 66 -17.365 -11.267 5.034 1.00 0.00 O ATOM 991 OD2 ASP A 66 -16.048 -12.863 4.293 1.00 0.00 O ATOM 0 H ASP A 66 -18.781 -10.778 0.883 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.432 -9.639 3.106 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -18.476 -12.031 2.658 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -16.888 -12.402 2.016 1.00 0.00 H new ATOM 996 N VAL A 67 -15.215 -9.006 2.211 1.00 0.00 N ATOM 997 CA VAL A 67 -13.859 -8.673 1.789 1.00 0.00 C ATOM 998 C VAL A 67 -12.942 -8.480 2.991 1.00 0.00 C ATOM 999 O VAL A 67 -13.350 -7.937 4.018 1.00 0.00 O ATOM 1000 CB VAL A 67 -13.837 -7.396 0.929 1.00 0.00 C ATOM 1001 CG1 VAL A 67 -12.596 -7.366 0.049 1.00 0.00 C ATOM 1002 CG2 VAL A 67 -15.100 -7.298 0.088 1.00 0.00 C ATOM 0 H VAL A 67 -15.613 -8.364 2.896 1.00 0.00 H new ATOM 0 HA VAL A 67 -13.498 -9.510 1.191 1.00 0.00 H new ATOM 0 HB VAL A 67 -13.803 -6.532 1.593 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -12.598 -6.456 -0.552 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -11.705 -7.385 0.676 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -12.595 -8.235 -0.609 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -15.067 -6.389 -0.513 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -15.168 -8.165 -0.569 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -15.971 -7.269 0.742 1.00 0.00 H new ATOM 1012 N THR A 68 -11.697 -8.927 2.857 1.00 0.00 N ATOM 1013 CA THR A 68 -10.720 -8.804 3.932 1.00 0.00 C ATOM 1014 C THR A 68 -9.614 -7.824 3.559 1.00 0.00 C ATOM 1015 O THR A 68 -8.958 -7.977 2.529 1.00 0.00 O ATOM 1016 CB THR A 68 -10.089 -10.167 4.276 1.00 0.00 C ATOM 1017 OG1 THR A 68 -11.115 -11.115 4.593 1.00 0.00 O ATOM 1018 CG2 THR A 68 -9.131 -10.038 5.450 1.00 0.00 C ATOM 0 H THR A 68 -11.341 -9.378 2.014 1.00 0.00 H new ATOM 0 HA THR A 68 -11.255 -8.429 4.805 1.00 0.00 H new ATOM 0 HB THR A 68 -9.530 -10.514 3.407 1.00 0.00 H new ATOM 0 HG1 THR A 68 -10.706 -11.979 4.809 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.698 -11.013 5.675 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.336 -9.337 5.195 1.00 0.00 H new ATOM 0 HG23 THR A 68 -9.672 -9.671 6.322 1.00 0.00 H new ATOM 1026 N GLU A 69 -9.411 -6.819 4.405 1.00 0.00 N ATOM 1027 CA GLU A 69 -8.382 -5.814 4.163 1.00 0.00 C ATOM 1028 C GLU A 69 -7.054 -6.234 4.785 1.00 0.00 C ATOM 1029 O GLU A 69 -6.991 -6.592 5.962 1.00 0.00 O ATOM 1030 CB GLU A 69 -8.817 -4.460 4.729 1.00 0.00 C ATOM 1031 CG GLU A 69 -7.734 -3.397 4.664 1.00 0.00 C ATOM 1032 CD GLU A 69 -6.811 -3.431 5.867 1.00 0.00 C ATOM 1033 OE1 GLU A 69 -7.313 -3.307 7.003 1.00 0.00 O ATOM 1034 OE2 GLU A 69 -5.586 -3.581 5.671 1.00 0.00 O ATOM 0 H GLU A 69 -9.945 -6.679 5.263 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.246 -5.723 3.085 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.691 -4.110 4.180 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.124 -4.591 5.767 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.147 -3.537 3.756 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -8.199 -2.414 4.595 1.00 0.00 H new ATOM 1041 N THR A 70 -5.992 -6.189 3.986 1.00 0.00 N ATOM 1042 CA THR A 70 -4.665 -6.566 4.456 1.00 0.00 C ATOM 1043 C THR A 70 -3.645 -5.473 4.158 1.00 0.00 C ATOM 1044 O THR A 70 -3.530 -5.011 3.023 1.00 0.00 O ATOM 1045 CB THR A 70 -4.194 -7.883 3.810 1.00 0.00 C ATOM 1046 OG1 THR A 70 -5.098 -8.942 4.140 1.00 0.00 O ATOM 1047 CG2 THR A 70 -2.791 -8.243 4.276 1.00 0.00 C ATOM 0 H THR A 70 -6.026 -5.895 3.010 1.00 0.00 H new ATOM 0 HA THR A 70 -4.739 -6.705 5.535 1.00 0.00 H new ATOM 0 HB THR A 70 -4.177 -7.745 2.729 1.00 0.00 H new ATOM 0 HG1 THR A 70 -4.792 -9.775 3.724 1.00 0.00 H new ATOM 0 HG21 THR A 70 -2.480 -9.176 3.807 1.00 0.00 H new ATOM 0 HG22 THR A 70 -2.100 -7.448 3.996 1.00 0.00 H new ATOM 0 HG23 THR A 70 -2.787 -8.363 5.359 1.00 0.00 H new ATOM 1055 N LEU A 71 -2.907 -5.065 5.184 1.00 0.00 N ATOM 1056 CA LEU A 71 -1.894 -4.026 5.032 1.00 0.00 C ATOM 1057 C LEU A 71 -0.490 -4.618 5.108 1.00 0.00 C ATOM 1058 O LEU A 71 -0.229 -5.523 5.900 1.00 0.00 O ATOM 1059 CB LEU A 71 -2.068 -2.955 6.111 1.00 0.00 C ATOM 1060 CG LEU A 71 -1.337 -1.634 5.869 1.00 0.00 C ATOM 1061 CD1 LEU A 71 -1.690 -1.072 4.501 1.00 0.00 C ATOM 1062 CD2 LEU A 71 -1.674 -0.631 6.963 1.00 0.00 C ATOM 0 H LEU A 71 -2.991 -5.437 6.130 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.022 -3.569 4.051 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -3.132 -2.744 6.217 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -1.728 -3.367 7.061 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.264 -1.824 5.895 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.161 -0.132 4.346 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.398 -1.784 3.729 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -2.764 -0.897 4.446 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.145 0.304 6.775 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -2.748 -0.446 6.968 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.370 -1.032 7.930 1.00 0.00 H new ATOM 1074 N VAL A 72 0.411 -4.099 4.280 1.00 0.00 N ATOM 1075 CA VAL A 72 1.789 -4.573 4.256 1.00 0.00 C ATOM 1076 C VAL A 72 2.771 -3.416 4.398 1.00 0.00 C ATOM 1077 O VAL A 72 2.370 -2.261 4.543 1.00 0.00 O ATOM 1078 CB VAL A 72 2.097 -5.336 2.954 1.00 0.00 C ATOM 1079 CG1 VAL A 72 1.420 -6.698 2.960 1.00 0.00 C ATOM 1080 CG2 VAL A 72 1.663 -4.522 1.744 1.00 0.00 C ATOM 0 H VAL A 72 0.211 -3.350 3.617 1.00 0.00 H new ATOM 0 HA VAL A 72 1.905 -5.250 5.102 1.00 0.00 H new ATOM 0 HB VAL A 72 3.174 -5.492 2.891 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.649 -7.222 2.032 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.784 -7.281 3.806 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.341 -6.568 3.046 1.00 0.00 H new ATOM 0 HG21 VAL A 72 1.888 -5.076 0.833 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.591 -4.333 1.798 1.00 0.00 H new ATOM 0 HG23 VAL A 72 2.199 -3.573 1.733 1.00 0.00 H new ATOM 1090 N SER A 73 4.062 -3.733 4.355 1.00 0.00 N ATOM 1091 CA SER A 73 5.102 -2.720 4.483 1.00 0.00 C ATOM 1092 C SER A 73 5.384 -2.058 3.137 1.00 0.00 C ATOM 1093 O SER A 73 5.089 -2.619 2.083 1.00 0.00 O ATOM 1094 CB SER A 73 6.386 -3.344 5.036 1.00 0.00 C ATOM 1095 OG SER A 73 6.393 -3.323 6.453 1.00 0.00 O ATOM 0 H SER A 73 4.412 -4.683 4.233 1.00 0.00 H new ATOM 0 HA SER A 73 4.749 -1.957 5.177 1.00 0.00 H new ATOM 0 HB2 SER A 73 6.476 -4.372 4.684 1.00 0.00 H new ATOM 0 HB3 SER A 73 7.251 -2.800 4.657 1.00 0.00 H new ATOM 0 HG SER A 73 7.222 -3.728 6.782 1.00 0.00 H new ATOM 1101 N GLY A 74 5.958 -0.860 3.183 1.00 0.00 N ATOM 1102 CA GLY A 74 6.270 -0.140 1.962 1.00 0.00 C ATOM 1103 C GLY A 74 7.283 -0.869 1.102 1.00 0.00 C ATOM 1104 O GLY A 74 7.051 -1.096 -0.086 1.00 0.00 O ATOM 0 H GLY A 74 6.213 -0.375 4.044 1.00 0.00 H new ATOM 0 HA2 GLY A 74 5.355 0.012 1.390 1.00 0.00 H new ATOM 0 HA3 GLY A 74 6.656 0.847 2.215 1.00 0.00 H new ATOM 1108 N THR A 75 8.411 -1.237 1.701 1.00 0.00 N ATOM 1109 CA THR A 75 9.464 -1.943 0.982 1.00 0.00 C ATOM 1110 C THR A 75 9.020 -3.349 0.597 1.00 0.00 C ATOM 1111 O THR A 75 9.731 -4.063 -0.110 1.00 0.00 O ATOM 1112 CB THR A 75 10.753 -2.035 1.820 1.00 0.00 C ATOM 1113 OG1 THR A 75 11.732 -2.819 1.129 1.00 0.00 O ATOM 1114 CG2 THR A 75 10.470 -2.652 3.181 1.00 0.00 C ATOM 0 H THR A 75 8.619 -1.058 2.683 1.00 0.00 H new ATOM 0 HA THR A 75 9.668 -1.369 0.078 1.00 0.00 H new ATOM 0 HB THR A 75 11.136 -1.026 1.969 1.00 0.00 H new ATOM 0 HG1 THR A 75 11.290 -3.368 0.448 1.00 0.00 H new ATOM 0 HG21 THR A 75 11.395 -2.707 3.755 1.00 0.00 H new ATOM 0 HG22 THR A 75 9.747 -2.037 3.716 1.00 0.00 H new ATOM 0 HG23 THR A 75 10.065 -3.655 3.049 1.00 0.00 H new ATOM 1122 N GLN A 76 7.840 -3.741 1.066 1.00 0.00 N ATOM 1123 CA GLN A 76 7.301 -5.064 0.771 1.00 0.00 C ATOM 1124 C GLN A 76 6.524 -5.054 -0.541 1.00 0.00 C ATOM 1125 O GLN A 76 5.536 -4.333 -0.684 1.00 0.00 O ATOM 1126 CB GLN A 76 6.397 -5.536 1.910 1.00 0.00 C ATOM 1127 CG GLN A 76 5.809 -6.920 1.687 1.00 0.00 C ATOM 1128 CD GLN A 76 5.557 -7.664 2.983 1.00 0.00 C ATOM 1129 OE1 GLN A 76 6.349 -7.582 3.923 1.00 0.00 O ATOM 1130 NE2 GLN A 76 4.450 -8.395 3.042 1.00 0.00 N ATOM 0 H GLN A 76 7.239 -3.162 1.652 1.00 0.00 H new ATOM 0 HA GLN A 76 8.138 -5.756 0.672 1.00 0.00 H new ATOM 0 HB2 GLN A 76 6.968 -5.538 2.839 1.00 0.00 H new ATOM 0 HB3 GLN A 76 5.584 -4.821 2.037 1.00 0.00 H new ATOM 0 HG2 GLN A 76 4.872 -6.828 1.138 1.00 0.00 H new ATOM 0 HG3 GLN A 76 6.488 -7.503 1.064 1.00 0.00 H new ATOM 0 HE21 GLN A 76 3.822 -8.435 2.240 1.00 0.00 H new ATOM 0 HE22 GLN A 76 4.228 -8.917 3.890 1.00 0.00 H new ATOM 1139 N LEU A 77 6.976 -5.859 -1.497 1.00 0.00 N ATOM 1140 CA LEU A 77 6.322 -5.943 -2.798 1.00 0.00 C ATOM 1141 C LEU A 77 5.575 -7.265 -2.948 1.00 0.00 C ATOM 1142 O LEU A 77 5.170 -7.639 -4.049 1.00 0.00 O ATOM 1143 CB LEU A 77 7.353 -5.797 -3.919 1.00 0.00 C ATOM 1144 CG LEU A 77 8.050 -4.439 -4.017 1.00 0.00 C ATOM 1145 CD1 LEU A 77 9.091 -4.452 -5.125 1.00 0.00 C ATOM 1146 CD2 LEU A 77 7.032 -3.333 -4.252 1.00 0.00 C ATOM 0 H LEU A 77 7.792 -6.462 -1.395 1.00 0.00 H new ATOM 0 HA LEU A 77 5.600 -5.129 -2.868 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.115 -6.565 -3.787 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.858 -5.998 -4.869 1.00 0.00 H new ATOM 0 HG LEU A 77 8.558 -4.244 -3.072 1.00 0.00 H new ATOM 0 HD11 LEU A 77 9.576 -3.478 -5.180 1.00 0.00 H new ATOM 0 HD12 LEU A 77 9.837 -5.218 -4.914 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.607 -4.670 -6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.546 -2.374 -4.319 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.496 -3.523 -5.182 1.00 0.00 H new ATOM 0 HD23 LEU A 77 6.324 -3.308 -3.424 1.00 0.00 H new ATOM 1158 N SER A 78 5.396 -7.967 -1.834 1.00 0.00 N ATOM 1159 CA SER A 78 4.699 -9.248 -1.841 1.00 0.00 C ATOM 1160 C SER A 78 4.043 -9.517 -0.491 1.00 0.00 C ATOM 1161 O SER A 78 4.502 -9.030 0.542 1.00 0.00 O ATOM 1162 CB SER A 78 5.671 -10.379 -2.184 1.00 0.00 C ATOM 1163 OG SER A 78 6.368 -10.106 -3.387 1.00 0.00 O ATOM 0 H SER A 78 5.724 -7.670 -0.915 1.00 0.00 H new ATOM 0 HA SER A 78 3.919 -9.206 -2.601 1.00 0.00 H new ATOM 0 HB2 SER A 78 6.383 -10.510 -1.369 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.123 -11.316 -2.282 1.00 0.00 H new ATOM 0 HG SER A 78 6.575 -10.948 -3.844 1.00 0.00 H new ATOM 1169 N GLN A 79 2.967 -10.297 -0.508 1.00 0.00 N ATOM 1170 CA GLN A 79 2.247 -10.631 0.716 1.00 0.00 C ATOM 1171 C GLN A 79 1.556 -11.985 0.588 1.00 0.00 C ATOM 1172 O GLN A 79 1.006 -12.316 -0.463 1.00 0.00 O ATOM 1173 CB GLN A 79 1.217 -9.548 1.038 1.00 0.00 C ATOM 1174 CG GLN A 79 0.300 -9.905 2.197 1.00 0.00 C ATOM 1175 CD GLN A 79 1.023 -9.918 3.530 1.00 0.00 C ATOM 1176 OE1 GLN A 79 2.250 -9.832 3.584 1.00 0.00 O ATOM 1177 NE2 GLN A 79 0.264 -10.024 4.614 1.00 0.00 N ATOM 0 H GLN A 79 2.575 -10.709 -1.355 1.00 0.00 H new ATOM 0 HA GLN A 79 2.970 -10.688 1.530 1.00 0.00 H new ATOM 0 HB2 GLN A 79 1.739 -8.620 1.271 1.00 0.00 H new ATOM 0 HB3 GLN A 79 0.612 -9.359 0.152 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -0.521 -9.189 2.240 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -0.141 -10.885 2.018 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -0.750 -10.093 4.522 1.00 0.00 H new ATOM 0 HE22 GLN A 79 0.694 -10.037 5.539 1.00 0.00 H new ATOM 1186 N LEU A 80 1.588 -12.763 1.664 1.00 0.00 N ATOM 1187 CA LEU A 80 0.965 -14.082 1.673 1.00 0.00 C ATOM 1188 C LEU A 80 -0.389 -14.040 2.373 1.00 0.00 C ATOM 1189 O LEU A 80 -0.493 -13.598 3.518 1.00 0.00 O ATOM 1190 CB LEU A 80 1.879 -15.095 2.365 1.00 0.00 C ATOM 1191 CG LEU A 80 1.338 -16.521 2.475 1.00 0.00 C ATOM 1192 CD1 LEU A 80 1.266 -17.172 1.102 1.00 0.00 C ATOM 1193 CD2 LEU A 80 2.204 -17.349 3.414 1.00 0.00 C ATOM 0 H LEU A 80 2.039 -12.504 2.542 1.00 0.00 H new ATOM 0 HA LEU A 80 0.809 -14.390 0.639 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.826 -15.128 1.826 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.096 -14.732 3.369 1.00 0.00 H new ATOM 0 HG LEU A 80 0.330 -16.476 2.887 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.879 -18.186 1.200 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.605 -16.592 0.458 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.263 -17.205 0.662 1.00 0.00 H new ATOM 0 HD21 LEU A 80 1.804 -18.361 3.480 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.224 -17.386 3.031 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.205 -16.894 4.404 1.00 0.00 H new ATOM 1205 N ILE A 81 -1.423 -14.504 1.679 1.00 0.00 N ATOM 1206 CA ILE A 81 -2.770 -14.522 2.236 1.00 0.00 C ATOM 1207 C ILE A 81 -3.196 -15.941 2.597 1.00 0.00 C ATOM 1208 O ILE A 81 -3.434 -16.770 1.720 1.00 0.00 O ATOM 1209 CB ILE A 81 -3.794 -13.925 1.253 1.00 0.00 C ATOM 1210 CG1 ILE A 81 -3.284 -12.592 0.700 1.00 0.00 C ATOM 1211 CG2 ILE A 81 -5.140 -13.741 1.937 1.00 0.00 C ATOM 1212 CD1 ILE A 81 -3.291 -11.473 1.718 1.00 0.00 C ATOM 0 H ILE A 81 -1.354 -14.872 0.730 1.00 0.00 H new ATOM 0 HA ILE A 81 -2.747 -13.911 3.138 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.924 -14.617 0.421 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.269 -12.727 0.328 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.900 -12.302 -0.151 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.853 -13.318 1.229 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -5.505 -14.706 2.287 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.028 -13.066 2.786 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -2.917 -10.559 1.257 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.309 -11.310 2.073 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.652 -11.742 2.559 1.00 0.00 H new ATOM 1224 N GLU A 82 -3.293 -16.212 3.895 1.00 0.00 N ATOM 1225 CA GLU A 82 -3.692 -17.531 4.372 1.00 0.00 C ATOM 1226 C GLU A 82 -5.139 -17.519 4.857 1.00 0.00 C ATOM 1227 O GLU A 82 -5.735 -16.459 5.040 1.00 0.00 O ATOM 1228 CB GLU A 82 -2.767 -17.992 5.500 1.00 0.00 C ATOM 1229 CG GLU A 82 -1.401 -18.451 5.019 1.00 0.00 C ATOM 1230 CD GLU A 82 -0.468 -18.801 6.161 1.00 0.00 C ATOM 1231 OE1 GLU A 82 0.136 -17.874 6.740 1.00 0.00 O ATOM 1232 OE2 GLU A 82 -0.341 -20.003 6.476 1.00 0.00 O ATOM 0 H GLU A 82 -3.101 -15.536 4.634 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.612 -18.230 3.539 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -2.637 -17.174 6.209 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -3.246 -18.809 6.040 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -1.521 -19.321 4.373 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -0.950 -17.664 4.414 1.00 0.00 H new ATOM 1239 N GLY A 83 -5.697 -18.708 5.064 1.00 0.00 N ATOM 1240 CA GLY A 83 -7.069 -18.813 5.526 1.00 0.00 C ATOM 1241 C GLY A 83 -8.060 -18.913 4.383 1.00 0.00 C ATOM 1242 O GLY A 83 -9.152 -18.346 4.446 1.00 0.00 O ATOM 0 H GLY A 83 -5.224 -19.600 4.920 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -7.167 -19.690 6.166 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.311 -17.944 6.137 1.00 0.00 H new ATOM 1246 N LEU A 84 -7.679 -19.635 3.334 1.00 0.00 N ATOM 1247 CA LEU A 84 -8.541 -19.806 2.170 1.00 0.00 C ATOM 1248 C LEU A 84 -8.963 -21.264 2.016 1.00 0.00 C ATOM 1249 O LEU A 84 -8.413 -22.152 2.667 1.00 0.00 O ATOM 1250 CB LEU A 84 -7.823 -19.334 0.905 1.00 0.00 C ATOM 1251 CG LEU A 84 -7.040 -18.026 1.026 1.00 0.00 C ATOM 1252 CD1 LEU A 84 -5.892 -17.998 0.030 1.00 0.00 C ATOM 1253 CD2 LEU A 84 -7.961 -16.833 0.816 1.00 0.00 C ATOM 0 H LEU A 84 -6.779 -20.111 3.266 1.00 0.00 H new ATOM 0 HA LEU A 84 -9.436 -19.201 2.318 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -7.135 -20.118 0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -8.563 -19.219 0.113 1.00 0.00 H new ATOM 0 HG LEU A 84 -6.623 -17.965 2.031 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.346 -17.060 0.130 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.219 -18.833 0.227 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.287 -18.081 -0.983 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.388 -15.910 0.906 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -8.407 -16.888 -0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.749 -16.845 1.569 1.00 0.00 H new ATOM 1265 N ASP A 85 -9.940 -21.503 1.148 1.00 0.00 N ATOM 1266 CA ASP A 85 -10.434 -22.853 0.905 1.00 0.00 C ATOM 1267 C ASP A 85 -9.940 -23.378 -0.439 1.00 0.00 C ATOM 1268 O ASP A 85 -9.550 -22.604 -1.314 1.00 0.00 O ATOM 1269 CB ASP A 85 -11.963 -22.875 0.945 1.00 0.00 C ATOM 1270 CG ASP A 85 -12.524 -22.060 2.093 1.00 0.00 C ATOM 1271 OD1 ASP A 85 -12.368 -22.488 3.256 1.00 0.00 O ATOM 1272 OD2 ASP A 85 -13.118 -20.995 1.829 1.00 0.00 O ATOM 0 H ASP A 85 -10.406 -20.779 0.601 1.00 0.00 H new ATOM 0 HA ASP A 85 -10.049 -23.502 1.692 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -12.354 -22.488 0.004 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -12.306 -23.906 1.033 1.00 0.00 H new ATOM 1277 N ARG A 86 -9.959 -24.698 -0.597 1.00 0.00 N ATOM 1278 CA ARG A 86 -9.511 -25.326 -1.833 1.00 0.00 C ATOM 1279 C ARG A 86 -10.602 -25.269 -2.899 1.00 0.00 C ATOM 1280 O ARG A 86 -11.761 -24.984 -2.600 1.00 0.00 O ATOM 1281 CB ARG A 86 -9.111 -26.780 -1.576 1.00 0.00 C ATOM 1282 CG ARG A 86 -10.197 -27.600 -0.898 1.00 0.00 C ATOM 1283 CD ARG A 86 -10.031 -29.085 -1.179 1.00 0.00 C ATOM 1284 NE ARG A 86 -10.915 -29.901 -0.350 1.00 0.00 N ATOM 1285 CZ ARG A 86 -11.150 -31.189 -0.574 1.00 0.00 C ATOM 1286 NH1 ARG A 86 -10.570 -31.805 -1.595 1.00 0.00 N ATOM 1287 NH2 ARG A 86 -11.967 -31.864 0.224 1.00 0.00 N ATOM 0 H ARG A 86 -10.280 -25.353 0.116 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.643 -24.776 -2.196 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -8.852 -27.250 -2.525 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -8.214 -26.797 -0.956 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -10.167 -27.427 0.178 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -11.175 -27.270 -1.247 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -10.238 -29.280 -2.231 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -8.996 -29.375 -0.999 1.00 0.00 H new ATOM 0 HE ARG A 86 -11.377 -29.457 0.444 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -9.941 -31.290 -2.211 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -10.753 -32.794 -1.764 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -12.415 -31.394 1.010 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -12.147 -32.853 0.051 1.00 0.00 H new ATOM 1301 N GLY A 87 -10.221 -25.541 -4.144 1.00 0.00 N ATOM 1302 CA GLY A 87 -11.178 -25.514 -5.234 1.00 0.00 C ATOM 1303 C GLY A 87 -12.170 -24.375 -5.107 1.00 0.00 C ATOM 1304 O GLY A 87 -13.382 -24.585 -5.176 1.00 0.00 O ATOM 0 H GLY A 87 -9.267 -25.779 -4.416 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -10.644 -25.423 -6.180 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -11.718 -26.460 -5.263 1.00 0.00 H new ATOM 1308 N THR A 88 -11.656 -23.163 -4.919 1.00 0.00 N ATOM 1309 CA THR A 88 -12.505 -21.987 -4.780 1.00 0.00 C ATOM 1310 C THR A 88 -11.824 -20.747 -5.348 1.00 0.00 C ATOM 1311 O THR A 88 -10.737 -20.370 -4.912 1.00 0.00 O ATOM 1312 CB THR A 88 -12.869 -21.728 -3.305 1.00 0.00 C ATOM 1313 OG1 THR A 88 -13.654 -22.813 -2.797 1.00 0.00 O ATOM 1314 CG2 THR A 88 -13.640 -20.425 -3.158 1.00 0.00 C ATOM 0 H THR A 88 -10.656 -22.971 -4.860 1.00 0.00 H new ATOM 0 HA THR A 88 -13.417 -22.187 -5.342 1.00 0.00 H new ATOM 0 HB THR A 88 -11.944 -21.650 -2.734 1.00 0.00 H new ATOM 0 HG1 THR A 88 -13.088 -23.607 -2.697 1.00 0.00 H new ATOM 0 HG21 THR A 88 -13.886 -20.264 -2.108 1.00 0.00 H new ATOM 0 HG22 THR A 88 -13.029 -19.598 -3.519 1.00 0.00 H new ATOM 0 HG23 THR A 88 -14.559 -20.478 -3.742 1.00 0.00 H new ATOM 1322 N GLU A 89 -12.472 -20.116 -6.322 1.00 0.00 N ATOM 1323 CA GLU A 89 -11.927 -18.917 -6.950 1.00 0.00 C ATOM 1324 C GLU A 89 -11.923 -17.745 -5.973 1.00 0.00 C ATOM 1325 O GLU A 89 -12.865 -17.565 -5.199 1.00 0.00 O ATOM 1326 CB GLU A 89 -12.736 -18.554 -8.196 1.00 0.00 C ATOM 1327 CG GLU A 89 -12.152 -17.394 -8.985 1.00 0.00 C ATOM 1328 CD GLU A 89 -12.531 -17.437 -10.452 1.00 0.00 C ATOM 1329 OE1 GLU A 89 -13.687 -17.797 -10.757 1.00 0.00 O ATOM 1330 OE2 GLU A 89 -11.671 -17.110 -11.297 1.00 0.00 O ATOM 0 H GLU A 89 -13.374 -20.414 -6.693 1.00 0.00 H new ATOM 0 HA GLU A 89 -10.898 -19.127 -7.243 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -12.800 -19.428 -8.845 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -13.754 -18.303 -7.898 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -12.497 -16.455 -8.552 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -11.066 -17.408 -8.894 1.00 0.00 H new ATOM 1337 N TYR A 90 -10.859 -16.952 -6.013 1.00 0.00 N ATOM 1338 CA TYR A 90 -10.731 -15.799 -5.130 1.00 0.00 C ATOM 1339 C TYR A 90 -10.224 -14.580 -5.895 1.00 0.00 C ATOM 1340 O TYR A 90 -9.456 -14.707 -6.848 1.00 0.00 O ATOM 1341 CB TYR A 90 -9.782 -16.119 -3.973 1.00 0.00 C ATOM 1342 CG TYR A 90 -10.385 -17.035 -2.932 1.00 0.00 C ATOM 1343 CD1 TYR A 90 -11.180 -16.530 -1.910 1.00 0.00 C ATOM 1344 CD2 TYR A 90 -10.160 -18.406 -2.970 1.00 0.00 C ATOM 1345 CE1 TYR A 90 -11.732 -17.364 -0.957 1.00 0.00 C ATOM 1346 CE2 TYR A 90 -10.709 -19.247 -2.022 1.00 0.00 C ATOM 1347 CZ TYR A 90 -11.494 -18.721 -1.017 1.00 0.00 C ATOM 1348 OH TYR A 90 -12.043 -19.554 -0.069 1.00 0.00 O ATOM 0 H TYR A 90 -10.072 -17.086 -6.648 1.00 0.00 H new ATOM 0 HA TYR A 90 -11.718 -15.569 -4.729 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -8.879 -16.581 -4.372 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -9.479 -15.188 -3.494 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -11.369 -15.468 -1.860 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -9.545 -18.821 -3.755 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -12.347 -16.955 -0.169 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -10.525 -20.310 -2.067 1.00 0.00 H new ATOM 0 HH TYR A 90 -13.013 -19.604 -0.200 1.00 0.00 H new ATOM 1358 N ASN A 91 -10.660 -13.399 -5.469 1.00 0.00 N ATOM 1359 CA ASN A 91 -10.251 -12.156 -6.113 1.00 0.00 C ATOM 1360 C ASN A 91 -9.283 -11.377 -5.228 1.00 0.00 C ATOM 1361 O ASN A 91 -9.507 -11.229 -4.026 1.00 0.00 O ATOM 1362 CB ASN A 91 -11.476 -11.295 -6.430 1.00 0.00 C ATOM 1363 CG ASN A 91 -12.705 -12.129 -6.736 1.00 0.00 C ATOM 1364 OD1 ASN A 91 -13.718 -12.039 -6.042 1.00 0.00 O ATOM 1365 ND2 ASN A 91 -12.621 -12.947 -7.779 1.00 0.00 N ATOM 0 H ASN A 91 -11.296 -13.277 -4.681 1.00 0.00 H new ATOM 0 HA ASN A 91 -9.742 -12.408 -7.043 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -11.686 -10.641 -5.584 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -11.255 -10.653 -7.282 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.416 -13.533 -8.033 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -11.761 -12.989 -8.326 1.00 0.00 H new ATOM 1372 N PHE A 92 -8.208 -10.881 -5.830 1.00 0.00 N ATOM 1373 CA PHE A 92 -7.205 -10.117 -5.096 1.00 0.00 C ATOM 1374 C PHE A 92 -6.855 -8.829 -5.835 1.00 0.00 C ATOM 1375 O PHE A 92 -6.917 -8.768 -7.063 1.00 0.00 O ATOM 1376 CB PHE A 92 -5.944 -10.958 -4.889 1.00 0.00 C ATOM 1377 CG PHE A 92 -6.180 -12.205 -4.086 1.00 0.00 C ATOM 1378 CD1 PHE A 92 -6.594 -13.374 -4.703 1.00 0.00 C ATOM 1379 CD2 PHE A 92 -5.988 -12.208 -2.713 1.00 0.00 C ATOM 1380 CE1 PHE A 92 -6.812 -14.524 -3.966 1.00 0.00 C ATOM 1381 CE2 PHE A 92 -6.203 -13.354 -1.972 1.00 0.00 C ATOM 1382 CZ PHE A 92 -6.617 -14.513 -2.599 1.00 0.00 C ATOM 0 H PHE A 92 -8.008 -10.994 -6.824 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.623 -9.856 -4.124 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.537 -11.234 -5.862 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.190 -10.351 -4.389 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -6.748 -13.388 -5.772 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.667 -11.304 -2.217 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -7.134 -15.429 -4.459 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.047 -13.344 -0.903 1.00 0.00 H new ATOM 0 HZ PHE A 92 -6.788 -15.409 -2.021 1.00 0.00 H new ATOM 1392 N ARG A 93 -6.489 -7.800 -5.077 1.00 0.00 N ATOM 1393 CA ARG A 93 -6.131 -6.512 -5.659 1.00 0.00 C ATOM 1394 C ARG A 93 -5.183 -5.746 -4.741 1.00 0.00 C ATOM 1395 O ARG A 93 -5.422 -5.633 -3.538 1.00 0.00 O ATOM 1396 CB ARG A 93 -7.387 -5.680 -5.921 1.00 0.00 C ATOM 1397 CG ARG A 93 -7.943 -5.006 -4.677 1.00 0.00 C ATOM 1398 CD ARG A 93 -9.133 -4.119 -5.008 1.00 0.00 C ATOM 1399 NE ARG A 93 -9.729 -3.535 -3.810 1.00 0.00 N ATOM 1400 CZ ARG A 93 -10.828 -2.789 -3.826 1.00 0.00 C ATOM 1401 NH1 ARG A 93 -11.448 -2.539 -4.971 1.00 0.00 N ATOM 1402 NH2 ARG A 93 -11.310 -2.292 -2.694 1.00 0.00 N ATOM 0 H ARG A 93 -6.433 -7.833 -4.059 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.623 -6.698 -6.605 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -7.158 -4.917 -6.665 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -8.156 -6.323 -6.349 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -8.243 -5.765 -3.954 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.162 -4.409 -4.206 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -8.815 -3.322 -5.680 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.884 -4.703 -5.539 1.00 0.00 H new ATOM 0 HE ARG A 93 -9.277 -3.709 -2.912 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -11.081 -2.920 -5.843 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -12.292 -1.966 -4.980 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -10.837 -2.483 -1.811 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -12.154 -1.719 -2.707 1.00 0.00 H new ATOM 1416 N VAL A 94 -4.105 -5.221 -5.316 1.00 0.00 N ATOM 1417 CA VAL A 94 -3.122 -4.465 -4.550 1.00 0.00 C ATOM 1418 C VAL A 94 -3.222 -2.973 -4.848 1.00 0.00 C ATOM 1419 O VAL A 94 -3.568 -2.574 -5.959 1.00 0.00 O ATOM 1420 CB VAL A 94 -1.689 -4.942 -4.852 1.00 0.00 C ATOM 1421 CG1 VAL A 94 -0.698 -4.296 -3.895 1.00 0.00 C ATOM 1422 CG2 VAL A 94 -1.605 -6.459 -4.774 1.00 0.00 C ATOM 0 H VAL A 94 -3.891 -5.306 -6.310 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.341 -4.638 -3.496 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.430 -4.638 -5.866 1.00 0.00 H new ATOM 0 HG11 VAL A 94 0.309 -4.645 -4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -0.740 -3.212 -4.004 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -0.952 -4.567 -2.870 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -0.586 -6.779 -4.990 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -1.884 -6.788 -3.773 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.285 -6.899 -5.503 1.00 0.00 H new ATOM 1432 N ALA A 95 -2.916 -2.154 -3.848 1.00 0.00 N ATOM 1433 CA ALA A 95 -2.969 -0.705 -4.003 1.00 0.00 C ATOM 1434 C ALA A 95 -1.867 -0.026 -3.197 1.00 0.00 C ATOM 1435 O ALA A 95 -1.530 -0.463 -2.097 1.00 0.00 O ATOM 1436 CB ALA A 95 -4.333 -0.179 -3.583 1.00 0.00 C ATOM 0 H ALA A 95 -2.629 -2.469 -2.921 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.810 -0.471 -5.056 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.358 0.904 -3.704 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -5.105 -0.632 -4.205 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.515 -0.432 -2.538 1.00 0.00 H new ATOM 1442 N ALA A 96 -1.308 1.044 -3.752 1.00 0.00 N ATOM 1443 CA ALA A 96 -0.245 1.784 -3.084 1.00 0.00 C ATOM 1444 C ALA A 96 -0.816 2.868 -2.177 1.00 0.00 C ATOM 1445 O ALA A 96 -1.805 3.519 -2.517 1.00 0.00 O ATOM 1446 CB ALA A 96 0.698 2.395 -4.110 1.00 0.00 C ATOM 0 H ALA A 96 -1.574 1.418 -4.663 1.00 0.00 H new ATOM 0 HA ALA A 96 0.315 1.085 -2.463 1.00 0.00 H new ATOM 0 HB1 ALA A 96 1.487 2.945 -3.597 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.141 1.603 -4.714 1.00 0.00 H new ATOM 0 HB3 ALA A 96 0.142 3.075 -4.755 1.00 0.00 H new ATOM 1452 N LEU A 97 -0.190 3.056 -1.021 1.00 0.00 N ATOM 1453 CA LEU A 97 -0.637 4.062 -0.063 1.00 0.00 C ATOM 1454 C LEU A 97 0.460 5.087 0.203 1.00 0.00 C ATOM 1455 O LEU A 97 1.616 4.731 0.436 1.00 0.00 O ATOM 1456 CB LEU A 97 -1.055 3.395 1.249 1.00 0.00 C ATOM 1457 CG LEU A 97 -2.082 2.267 1.130 1.00 0.00 C ATOM 1458 CD1 LEU A 97 -2.007 1.348 2.340 1.00 0.00 C ATOM 1459 CD2 LEU A 97 -3.484 2.837 0.977 1.00 0.00 C ATOM 0 H LEU A 97 0.629 2.525 -0.724 1.00 0.00 H new ATOM 0 HA LEU A 97 -1.496 4.579 -0.491 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.162 2.998 1.732 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.461 4.161 1.910 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.850 1.682 0.240 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -2.744 0.552 2.238 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -1.010 0.913 2.405 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -2.213 1.920 3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -4.202 2.021 0.894 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.726 3.446 1.848 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -3.530 3.454 0.079 1.00 0.00 H new ATOM 1471 N THR A 98 0.092 6.364 0.167 1.00 0.00 N ATOM 1472 CA THR A 98 1.044 7.441 0.405 1.00 0.00 C ATOM 1473 C THR A 98 0.475 8.474 1.371 1.00 0.00 C ATOM 1474 O THR A 98 -0.697 8.410 1.744 1.00 0.00 O ATOM 1475 CB THR A 98 1.435 8.145 -0.908 1.00 0.00 C ATOM 1476 OG1 THR A 98 0.265 8.645 -1.565 1.00 0.00 O ATOM 1477 CG2 THR A 98 2.173 7.190 -1.835 1.00 0.00 C ATOM 0 H THR A 98 -0.860 6.677 -0.025 1.00 0.00 H new ATOM 0 HA THR A 98 1.932 6.987 0.844 1.00 0.00 H new ATOM 0 HB THR A 98 2.097 8.976 -0.665 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.395 9.590 -1.791 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.439 7.709 -2.756 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.079 6.834 -1.344 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.530 6.341 -2.070 1.00 0.00 H new ATOM 1485 N ILE A 99 1.311 9.426 1.772 1.00 0.00 N ATOM 1486 CA ILE A 99 0.890 10.473 2.694 1.00 0.00 C ATOM 1487 C ILE A 99 -0.362 11.181 2.187 1.00 0.00 C ATOM 1488 O ILE A 99 -1.220 11.584 2.971 1.00 0.00 O ATOM 1489 CB ILE A 99 2.004 11.515 2.908 1.00 0.00 C ATOM 1490 CG1 ILE A 99 1.609 12.496 4.014 1.00 0.00 C ATOM 1491 CG2 ILE A 99 2.291 12.258 1.612 1.00 0.00 C ATOM 1492 CD1 ILE A 99 2.032 12.051 5.397 1.00 0.00 C ATOM 0 H ILE A 99 2.284 9.494 1.473 1.00 0.00 H new ATOM 0 HA ILE A 99 0.670 9.987 3.645 1.00 0.00 H new ATOM 0 HB ILE A 99 2.912 10.996 3.215 1.00 0.00 H new ATOM 0 HG12 ILE A 99 2.054 13.468 3.802 1.00 0.00 H new ATOM 0 HG13 ILE A 99 0.527 12.631 4.000 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.080 12.991 1.780 1.00 0.00 H new ATOM 0 HG22 ILE A 99 2.611 11.548 0.849 1.00 0.00 H new ATOM 0 HG23 ILE A 99 1.388 12.768 1.277 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.719 12.795 6.130 1.00 0.00 H new ATOM 0 HD12 ILE A 99 1.566 11.094 5.630 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.116 11.944 5.429 1.00 0.00 H new ATOM 1504 N ASN A 100 -0.460 11.327 0.870 1.00 0.00 N ATOM 1505 CA ASN A 100 -1.608 11.985 0.257 1.00 0.00 C ATOM 1506 C ASN A 100 -2.897 11.230 0.568 1.00 0.00 C ATOM 1507 O ASN A 100 -3.988 11.798 0.525 1.00 0.00 O ATOM 1508 CB ASN A 100 -1.416 12.087 -1.257 1.00 0.00 C ATOM 1509 CG ASN A 100 -0.409 13.153 -1.642 1.00 0.00 C ATOM 1510 OD1 ASN A 100 -0.744 14.333 -1.741 1.00 0.00 O ATOM 1511 ND2 ASN A 100 0.835 12.740 -1.860 1.00 0.00 N ATOM 0 H ASN A 100 0.242 10.999 0.207 1.00 0.00 H new ATOM 0 HA ASN A 100 -1.686 12.989 0.674 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -1.086 11.123 -1.644 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -2.374 12.309 -1.728 1.00 0.00 H new ATOM 0 HD21 ASN A 100 1.557 13.412 -2.121 1.00 0.00 H new ATOM 0 HD22 ASN A 100 1.068 11.751 -1.766 1.00 0.00 H new ATOM 1518 N GLY A 101 -2.763 9.945 0.882 1.00 0.00 N ATOM 1519 CA GLY A 101 -3.924 9.133 1.196 1.00 0.00 C ATOM 1520 C GLY A 101 -3.842 7.745 0.592 1.00 0.00 C ATOM 1521 O GLY A 101 -2.865 7.024 0.803 1.00 0.00 O ATOM 0 H GLY A 101 -1.871 9.452 0.924 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -4.023 9.050 2.278 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -4.822 9.632 0.831 1.00 0.00 H new ATOM 1525 N THR A 102 -4.870 7.366 -0.161 1.00 0.00 N ATOM 1526 CA THR A 102 -4.911 6.054 -0.794 1.00 0.00 C ATOM 1527 C THR A 102 -4.587 6.151 -2.281 1.00 0.00 C ATOM 1528 O THR A 102 -4.887 7.154 -2.927 1.00 0.00 O ATOM 1529 CB THR A 102 -6.290 5.391 -0.623 1.00 0.00 C ATOM 1530 OG1 THR A 102 -6.888 5.814 0.607 1.00 0.00 O ATOM 1531 CG2 THR A 102 -6.167 3.874 -0.637 1.00 0.00 C ATOM 0 H THR A 102 -5.686 7.950 -0.347 1.00 0.00 H new ATOM 0 HA THR A 102 -4.158 5.441 -0.300 1.00 0.00 H new ATOM 0 HB THR A 102 -6.921 5.697 -1.458 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.765 5.389 0.707 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.154 3.428 -0.515 1.00 0.00 H new ATOM 0 HG22 THR A 102 -5.739 3.552 -1.586 1.00 0.00 H new ATOM 0 HG23 THR A 102 -5.520 3.554 0.180 1.00 0.00 H new ATOM 1539 N GLY A 103 -3.973 5.101 -2.818 1.00 0.00 N ATOM 1540 CA GLY A 103 -3.620 5.088 -4.225 1.00 0.00 C ATOM 1541 C GLY A 103 -4.522 4.184 -5.041 1.00 0.00 C ATOM 1542 O GLY A 103 -5.517 3.654 -4.547 1.00 0.00 O ATOM 0 H GLY A 103 -3.714 4.259 -2.303 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -3.675 6.103 -4.619 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -2.587 4.759 -4.334 1.00 0.00 H new ATOM 1546 N PRO A 104 -4.178 4.000 -6.325 1.00 0.00 N ATOM 1547 CA PRO A 104 -4.952 3.155 -7.239 1.00 0.00 C ATOM 1548 C PRO A 104 -4.841 1.674 -6.894 1.00 0.00 C ATOM 1549 O PRO A 104 -3.944 1.264 -6.158 1.00 0.00 O ATOM 1550 CB PRO A 104 -4.318 3.436 -8.604 1.00 0.00 C ATOM 1551 CG PRO A 104 -2.927 3.870 -8.293 1.00 0.00 C ATOM 1552 CD PRO A 104 -3.005 4.601 -6.981 1.00 0.00 C ATOM 0 HA PRO A 104 -6.018 3.377 -7.195 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -4.324 2.546 -9.234 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -4.864 4.211 -9.142 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.257 3.013 -8.223 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -2.535 4.517 -9.078 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -2.100 4.463 -6.390 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -3.131 5.674 -7.126 1.00 0.00 H new ATOM 1560 N ALA A 105 -5.758 0.876 -7.431 1.00 0.00 N ATOM 1561 CA ALA A 105 -5.761 -0.560 -7.182 1.00 0.00 C ATOM 1562 C ALA A 105 -5.431 -1.338 -8.451 1.00 0.00 C ATOM 1563 O ALA A 105 -5.440 -0.785 -9.552 1.00 0.00 O ATOM 1564 CB ALA A 105 -7.109 -0.997 -6.628 1.00 0.00 C ATOM 0 H ALA A 105 -6.508 1.200 -8.041 1.00 0.00 H new ATOM 0 HA ALA A 105 -4.989 -0.777 -6.443 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.097 -2.072 -6.447 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.305 -0.473 -5.692 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -7.892 -0.759 -7.348 1.00 0.00 H new ATOM 1570 N THR A 106 -5.140 -2.626 -8.292 1.00 0.00 N ATOM 1571 CA THR A 106 -4.805 -3.479 -9.425 1.00 0.00 C ATOM 1572 C THR A 106 -6.028 -4.249 -9.913 1.00 0.00 C ATOM 1573 O THR A 106 -6.749 -4.855 -9.121 1.00 0.00 O ATOM 1574 CB THR A 106 -3.693 -4.482 -9.064 1.00 0.00 C ATOM 1575 OG1 THR A 106 -4.159 -5.393 -8.064 1.00 0.00 O ATOM 1576 CG2 THR A 106 -2.454 -3.756 -8.559 1.00 0.00 C ATOM 0 H THR A 106 -5.130 -3.101 -7.389 1.00 0.00 H new ATOM 0 HA THR A 106 -4.449 -2.824 -10.220 1.00 0.00 H new ATOM 0 HB THR A 106 -3.429 -5.037 -9.964 1.00 0.00 H new ATOM 0 HG1 THR A 106 -4.568 -6.172 -8.496 1.00 0.00 H new ATOM 0 HG21 THR A 106 -1.682 -4.484 -8.310 1.00 0.00 H new ATOM 0 HG22 THR A 106 -2.084 -3.085 -9.334 1.00 0.00 H new ATOM 0 HG23 THR A 106 -2.708 -3.178 -7.670 1.00 0.00 H new ATOM 1584 N ASP A 107 -6.254 -4.221 -11.222 1.00 0.00 N ATOM 1585 CA ASP A 107 -7.389 -4.918 -11.816 1.00 0.00 C ATOM 1586 C ASP A 107 -7.708 -6.194 -11.044 1.00 0.00 C ATOM 1587 O ASP A 107 -6.808 -6.950 -10.677 1.00 0.00 O ATOM 1588 CB ASP A 107 -7.100 -5.251 -13.281 1.00 0.00 C ATOM 1589 CG ASP A 107 -5.618 -5.401 -13.559 1.00 0.00 C ATOM 1590 OD1 ASP A 107 -5.056 -6.464 -13.224 1.00 0.00 O ATOM 1591 OD2 ASP A 107 -5.019 -4.454 -14.111 1.00 0.00 O ATOM 0 H ASP A 107 -5.667 -3.724 -11.891 1.00 0.00 H new ATOM 0 HA ASP A 107 -8.256 -4.259 -11.766 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.612 -6.175 -13.548 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -7.508 -4.465 -13.917 1.00 0.00 H new ATOM 1596 N TRP A 108 -8.992 -6.428 -10.802 1.00 0.00 N ATOM 1597 CA TRP A 108 -9.429 -7.613 -10.072 1.00 0.00 C ATOM 1598 C TRP A 108 -8.909 -8.883 -10.736 1.00 0.00 C ATOM 1599 O TRP A 108 -9.416 -9.305 -11.776 1.00 0.00 O ATOM 1600 CB TRP A 108 -10.956 -7.654 -9.992 1.00 0.00 C ATOM 1601 CG TRP A 108 -11.519 -6.759 -8.929 1.00 0.00 C ATOM 1602 CD1 TRP A 108 -12.309 -5.661 -9.117 1.00 0.00 C ATOM 1603 CD2 TRP A 108 -11.334 -6.886 -7.516 1.00 0.00 C ATOM 1604 NE1 TRP A 108 -12.625 -5.097 -7.904 1.00 0.00 N ATOM 1605 CE2 TRP A 108 -12.040 -5.831 -6.906 1.00 0.00 C ATOM 1606 CE3 TRP A 108 -10.642 -7.790 -6.705 1.00 0.00 C ATOM 1607 CZ2 TRP A 108 -12.072 -5.656 -5.525 1.00 0.00 C ATOM 1608 CZ3 TRP A 108 -10.674 -7.615 -5.334 1.00 0.00 C ATOM 1609 CH2 TRP A 108 -11.385 -6.555 -4.756 1.00 0.00 C ATOM 0 H TRP A 108 -9.749 -5.813 -11.100 1.00 0.00 H new ATOM 0 HA TRP A 108 -9.021 -7.559 -9.063 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.371 -7.365 -10.958 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -11.275 -8.679 -9.801 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -12.637 -5.291 -10.077 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -13.202 -4.267 -7.769 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -10.092 -8.611 -7.142 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -12.619 -4.840 -5.077 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -10.142 -8.307 -4.698 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -11.391 -6.445 -3.682 1.00 0.00 H new ATOM 1620 N LEU A 109 -7.894 -9.489 -10.129 1.00 0.00 N ATOM 1621 CA LEU A 109 -7.305 -10.713 -10.661 1.00 0.00 C ATOM 1622 C LEU A 109 -7.822 -11.937 -9.913 1.00 0.00 C ATOM 1623 O LEU A 109 -7.628 -12.066 -8.704 1.00 0.00 O ATOM 1624 CB LEU A 109 -5.779 -10.650 -10.567 1.00 0.00 C ATOM 1625 CG LEU A 109 -5.009 -11.401 -11.654 1.00 0.00 C ATOM 1626 CD1 LEU A 109 -5.509 -11.004 -13.034 1.00 0.00 C ATOM 1627 CD2 LEU A 109 -3.516 -11.135 -11.529 1.00 0.00 C ATOM 0 H LEU A 109 -7.462 -9.153 -9.268 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.596 -10.801 -11.708 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -5.476 -9.603 -10.592 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -5.478 -11.046 -9.597 1.00 0.00 H new ATOM 0 HG LEU A 109 -5.180 -12.469 -11.522 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.949 -11.549 -13.794 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -6.568 -11.246 -13.121 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -5.368 -9.933 -13.178 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.983 -11.677 -12.310 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -3.327 -10.067 -11.635 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.167 -11.470 -10.552 1.00 0.00 H new ATOM 1639 N SER A 110 -8.480 -12.834 -10.640 1.00 0.00 N ATOM 1640 CA SER A 110 -9.027 -14.048 -10.044 1.00 0.00 C ATOM 1641 C SER A 110 -7.990 -15.167 -10.042 1.00 0.00 C ATOM 1642 O SER A 110 -7.145 -15.247 -10.933 1.00 0.00 O ATOM 1643 CB SER A 110 -10.276 -14.497 -10.805 1.00 0.00 C ATOM 1644 OG SER A 110 -9.949 -14.922 -12.116 1.00 0.00 O ATOM 0 H SER A 110 -8.647 -12.743 -11.642 1.00 0.00 H new ATOM 0 HA SER A 110 -9.299 -13.826 -9.012 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.761 -15.311 -10.266 1.00 0.00 H new ATOM 0 HB3 SER A 110 -10.991 -13.676 -10.853 1.00 0.00 H new ATOM 0 HG SER A 110 -10.391 -15.776 -12.303 1.00 0.00 H new ATOM 1650 N ALA A 111 -8.062 -16.029 -9.033 1.00 0.00 N ATOM 1651 CA ALA A 111 -7.131 -17.145 -8.915 1.00 0.00 C ATOM 1652 C ALA A 111 -7.811 -18.363 -8.299 1.00 0.00 C ATOM 1653 O ALA A 111 -8.438 -18.268 -7.245 1.00 0.00 O ATOM 1654 CB ALA A 111 -5.922 -16.738 -8.086 1.00 0.00 C ATOM 0 H ALA A 111 -8.755 -15.976 -8.286 1.00 0.00 H new ATOM 0 HA ALA A 111 -6.797 -17.415 -9.917 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -5.235 -17.581 -8.006 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -5.415 -15.902 -8.568 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -6.248 -16.440 -7.090 1.00 0.00 H new ATOM 1660 N GLU A 112 -7.681 -19.507 -8.964 1.00 0.00 N ATOM 1661 CA GLU A 112 -8.285 -20.744 -8.481 1.00 0.00 C ATOM 1662 C GLU A 112 -7.250 -21.615 -7.777 1.00 0.00 C ATOM 1663 O GLU A 112 -6.296 -22.090 -8.395 1.00 0.00 O ATOM 1664 CB GLU A 112 -8.914 -21.517 -9.642 1.00 0.00 C ATOM 1665 CG GLU A 112 -9.987 -22.501 -9.207 1.00 0.00 C ATOM 1666 CD GLU A 112 -10.274 -23.554 -10.259 1.00 0.00 C ATOM 1667 OE1 GLU A 112 -9.313 -24.190 -10.739 1.00 0.00 O ATOM 1668 OE2 GLU A 112 -11.460 -23.742 -10.604 1.00 0.00 O ATOM 0 H GLU A 112 -7.163 -19.603 -9.838 1.00 0.00 H new ATOM 0 HA GLU A 112 -9.063 -20.483 -7.764 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -9.347 -20.808 -10.347 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -8.131 -22.058 -10.174 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -9.674 -22.990 -8.285 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -10.905 -21.957 -8.983 1.00 0.00 H new ATOM 1675 N THR A 113 -7.444 -21.823 -6.478 1.00 0.00 N ATOM 1676 CA THR A 113 -6.528 -22.635 -5.688 1.00 0.00 C ATOM 1677 C THR A 113 -6.492 -24.073 -6.194 1.00 0.00 C ATOM 1678 O THR A 113 -7.302 -24.467 -7.033 1.00 0.00 O ATOM 1679 CB THR A 113 -6.921 -22.637 -4.198 1.00 0.00 C ATOM 1680 OG1 THR A 113 -8.346 -22.652 -4.067 1.00 0.00 O ATOM 1681 CG2 THR A 113 -6.354 -21.417 -3.488 1.00 0.00 C ATOM 0 H THR A 113 -8.229 -21.439 -5.951 1.00 0.00 H new ATOM 0 HA THR A 113 -5.539 -22.190 -5.795 1.00 0.00 H new ATOM 0 HB THR A 113 -6.505 -23.533 -3.736 1.00 0.00 H new ATOM 0 HG1 THR A 113 -8.614 -22.049 -3.343 1.00 0.00 H new ATOM 0 HG21 THR A 113 -6.644 -21.440 -2.438 1.00 0.00 H new ATOM 0 HG22 THR A 113 -5.267 -21.424 -3.564 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.744 -20.512 -3.953 1.00 0.00 H new ATOM 1689 N PHE A 114 -5.548 -24.853 -5.678 1.00 0.00 N ATOM 1690 CA PHE A 114 -5.407 -26.248 -6.079 1.00 0.00 C ATOM 1691 C PHE A 114 -6.402 -27.132 -5.332 1.00 0.00 C ATOM 1692 O PHE A 114 -6.463 -27.114 -4.103 1.00 0.00 O ATOM 1693 CB PHE A 114 -3.980 -26.734 -5.816 1.00 0.00 C ATOM 1694 CG PHE A 114 -2.929 -25.903 -6.496 1.00 0.00 C ATOM 1695 CD1 PHE A 114 -2.785 -25.936 -7.873 1.00 0.00 C ATOM 1696 CD2 PHE A 114 -2.086 -25.089 -5.757 1.00 0.00 C ATOM 1697 CE1 PHE A 114 -1.820 -25.172 -8.502 1.00 0.00 C ATOM 1698 CE2 PHE A 114 -1.119 -24.323 -6.379 1.00 0.00 C ATOM 1699 CZ PHE A 114 -0.985 -24.365 -7.754 1.00 0.00 C ATOM 0 H PHE A 114 -4.870 -24.543 -4.982 1.00 0.00 H new ATOM 0 HA PHE A 114 -5.617 -26.316 -7.146 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -3.796 -26.731 -4.742 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -3.889 -27.767 -6.152 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -3.434 -26.566 -8.462 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -2.186 -25.053 -4.682 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -1.719 -25.206 -9.577 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -0.469 -23.692 -5.791 1.00 0.00 H new ATOM 0 HZ PHE A 114 -0.229 -23.768 -8.243 1.00 0.00 H new ATOM 1709 N GLU A 115 -7.180 -27.904 -6.085 1.00 0.00 N ATOM 1710 CA GLU A 115 -8.173 -28.793 -5.495 1.00 0.00 C ATOM 1711 C GLU A 115 -7.612 -29.494 -4.261 1.00 0.00 C ATOM 1712 O GLU A 115 -8.331 -29.741 -3.293 1.00 0.00 O ATOM 1713 CB GLU A 115 -8.634 -29.832 -6.520 1.00 0.00 C ATOM 1714 CG GLU A 115 -9.831 -29.386 -7.343 1.00 0.00 C ATOM 1715 CD GLU A 115 -10.284 -30.442 -8.332 1.00 0.00 C ATOM 1716 OE1 GLU A 115 -10.789 -31.494 -7.887 1.00 0.00 O ATOM 1717 OE2 GLU A 115 -10.133 -30.217 -9.551 1.00 0.00 O ATOM 0 H GLU A 115 -7.141 -27.931 -7.104 1.00 0.00 H new ATOM 0 HA GLU A 115 -9.028 -28.189 -5.191 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -7.806 -30.059 -7.192 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.885 -30.756 -6.000 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -10.656 -29.142 -6.674 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -9.577 -28.473 -7.882 1.00 0.00 H new ATOM 1724 N SER A 116 -6.322 -29.812 -4.304 1.00 0.00 N ATOM 1725 CA SER A 116 -5.664 -30.488 -3.193 1.00 0.00 C ATOM 1726 C SER A 116 -4.187 -30.108 -3.123 1.00 0.00 C ATOM 1727 O SER A 116 -3.682 -29.379 -3.977 1.00 0.00 O ATOM 1728 CB SER A 116 -5.806 -32.005 -3.335 1.00 0.00 C ATOM 1729 OG SER A 116 -5.413 -32.667 -2.145 1.00 0.00 O ATOM 0 H SER A 116 -5.712 -29.612 -5.097 1.00 0.00 H new ATOM 0 HA SER A 116 -6.147 -30.170 -2.269 1.00 0.00 H new ATOM 0 HB2 SER A 116 -6.840 -32.256 -3.570 1.00 0.00 H new ATOM 0 HB3 SER A 116 -5.196 -32.354 -4.168 1.00 0.00 H new ATOM 0 HG SER A 116 -5.514 -33.635 -2.260 1.00 0.00 H new