USER MOD reduce.3.24.130724 H: found=0, std=0, add=1119, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1121 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 87 SER OG : rot 128:sc= 0.648 USER MOD Set 1.2: A 143 HIS : no HE2:sc= 0.934 K(o=1.6,f=-4.1!) USER MOD Set 2.1: A 76 ASN : amide:sc= 0.521 K(o=-0.28,f=-1.1) USER MOD Set 2.2: A 78 ASN :FLIP amide:sc= -0.798 F(o=-1.2,f=-0.28) USER MOD Set 2.3: A 103 GLN :FLIP amide:sc=-0.00297 F(o=-2.4!,f=-0.28) USER MOD Set 3.1: A 75 HIS : no HE2:sc= 0.0267 X(o=-1.7,f=-1.9) USER MOD Set 3.2: A 135 THR OG1 : rot 117:sc= 0.00515 USER MOD Set 3.3: A 136 GLN : amide:sc= -1.69! X(o=-1.7!,f=-1.9) USER MOD Set 4.1: A 69 THR OG1 : rot 6:sc= 0.4 USER MOD Set 4.2: A 149 THR OG1 : rot 38:sc= 0.112 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -33:sc= 0.0833 USER MOD Single : A 24 THR OG1 : rot 59:sc= 0.389 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -135:sc= -1.54 (180deg=-4.17!) USER MOD Single : A 33 ASN : amide:sc= -0.126 K(o=-0.13,f=-4.4!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN :FLIP amide:sc= -1.96! C(o=-2.7!,f=-2!) USER MOD Single : A 39 ASN : amide:sc= 0.749 K(o=0.75,f=0) USER MOD Single : A 40 ASN : amide:sc= -0.0645 K(o=-0.064,f=-1.4) USER MOD Single : A 44 THR OG1 : rot -65:sc= 0.912 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.0899 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.0137 K(o=-0.014,f=-1.7) USER MOD Single : A 62 SER OG : rot 180:sc= 0.109 USER MOD Single : A 65 LYS NZ :NH3+ 170:sc=-0.00518 (180deg=-0.0974) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= -0.303 K(o=-0.3,f=-3!) USER MOD Single : A 98 ASN :FLIP amide:sc= -0.332 F(o=-0.92,f=-0.33) USER MOD Single : A 100 GLN : amide:sc= -0.284 X(o=-0.28,f=0) USER MOD Single : A 101 GLN : amide:sc= -0.0346 X(o=-0.035,f=-0.25) USER MOD Single : A 102 ASN : amide:sc= 0.102 K(o=0.1,f=-3.4!) USER MOD Single : A 107 ASN :FLIP amide:sc= -0.434 F(o=-3.1!,f=-0.43) USER MOD Single : A 110 SER OG : rot 180:sc= 0.00526 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.0445 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0.0109 USER MOD Single : A 122 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0105) USER MOD Single : A 124 ASN : amide:sc= 0.228 K(o=0.23,f=-2) USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -164:sc= -3.25! (180deg=-5.61!) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 ASN : amide:sc= 0.481 K(o=0.48,f=-5.5!) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 THR OG1 : rot -31:sc= 0.333 USER MOD Single : A 154 TYR OH : rot -119:sc= 1.11 USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 THR OG1 : rot -43:sc= 1.24 USER MOD Single : A 171 THR OG1 : rot 180:sc= 0 USER MOD Single : A 175 TYR OH : rot 180:sc= 0 USER MOD Single : A 179 ASN :FLIP amide:sc= -0.111 F(o=-1.5,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 235 N GLY A 16 -9.953 18.988 1.103 1.00 0.00 N ATOM 236 CA GLY A 16 -8.992 18.140 1.773 1.00 0.00 C ATOM 237 C GLY A 16 -9.723 17.335 2.831 1.00 0.00 C ATOM 238 O GLY A 16 -10.356 17.916 3.711 1.00 0.00 O ATOM 0 HA2 GLY A 16 -8.508 17.475 1.057 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -8.207 18.743 2.230 1.00 0.00 H new ATOM 242 N CYS A 17 -9.663 16.009 2.726 1.00 0.00 N ATOM 243 CA CYS A 17 -10.027 15.132 3.823 1.00 0.00 C ATOM 244 C CYS A 17 -8.921 15.207 4.856 1.00 0.00 C ATOM 245 O CYS A 17 -7.744 15.042 4.518 1.00 0.00 O ATOM 246 CB CYS A 17 -10.189 13.700 3.330 1.00 0.00 C ATOM 247 SG CYS A 17 -11.693 13.452 2.363 1.00 0.00 S ATOM 0 H CYS A 17 -9.362 15.521 1.882 1.00 0.00 H new ATOM 0 HA CYS A 17 -10.978 15.443 4.256 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -9.325 13.431 2.723 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -10.199 13.026 4.186 1.00 0.00 H new ATOM 252 N SER A 18 -9.290 15.395 6.116 1.00 0.00 N ATOM 253 CA SER A 18 -8.360 15.108 7.184 1.00 0.00 C ATOM 254 C SER A 18 -8.025 13.622 7.119 1.00 0.00 C ATOM 255 O SER A 18 -8.876 12.775 6.837 1.00 0.00 O ATOM 256 CB SER A 18 -8.952 15.532 8.522 1.00 0.00 C ATOM 257 OG SER A 18 -9.119 16.937 8.468 1.00 0.00 O ATOM 0 H SER A 18 -10.204 15.736 6.413 1.00 0.00 H new ATOM 0 HA SER A 18 -7.435 15.674 7.074 1.00 0.00 H new ATOM 0 HB2 SER A 18 -9.906 15.036 8.697 1.00 0.00 H new ATOM 0 HB3 SER A 18 -8.292 15.252 9.343 1.00 0.00 H new ATOM 0 HG SER A 18 -9.501 17.254 9.313 1.00 0.00 H new ATOM 263 N VAL A 19 -6.749 13.316 7.302 1.00 0.00 N ATOM 264 CA VAL A 19 -6.298 11.951 7.433 1.00 0.00 C ATOM 265 C VAL A 19 -6.769 11.438 8.791 1.00 0.00 C ATOM 266 O VAL A 19 -6.729 12.169 9.789 1.00 0.00 O ATOM 267 CB VAL A 19 -4.765 11.920 7.280 1.00 0.00 C ATOM 268 CG1 VAL A 19 -4.242 10.502 7.109 1.00 0.00 C ATOM 269 CG2 VAL A 19 -4.230 12.692 6.060 1.00 0.00 C ATOM 0 H VAL A 19 -6.004 14.010 7.363 1.00 0.00 H new ATOM 0 HA VAL A 19 -6.710 11.301 6.661 1.00 0.00 H new ATOM 0 HB VAL A 19 -4.418 12.389 8.201 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.157 10.524 7.004 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -4.510 9.907 7.982 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -4.683 10.056 6.217 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.143 12.617 6.030 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -4.648 12.266 5.148 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.520 13.740 6.137 1.00 0.00 H new ATOM 279 N ALA A 20 -7.195 10.175 8.827 1.00 0.00 N ATOM 280 CA ALA A 20 -7.374 9.496 10.096 1.00 0.00 C ATOM 281 C ALA A 20 -6.010 9.248 10.744 1.00 0.00 C ATOM 282 O ALA A 20 -5.018 8.938 10.074 1.00 0.00 O ATOM 283 CB ALA A 20 -8.102 8.175 9.889 1.00 0.00 C ATOM 0 H ALA A 20 -7.417 9.615 8.004 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.975 10.125 10.754 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -8.230 7.676 10.849 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.080 8.364 9.445 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -7.519 7.538 9.224 1.00 0.00 H new ATOM 289 N ALA A 21 -5.976 9.276 12.071 1.00 0.00 N ATOM 290 CA ALA A 21 -4.784 8.951 12.838 1.00 0.00 C ATOM 291 C ALA A 21 -4.296 7.534 12.511 1.00 0.00 C ATOM 292 O ALA A 21 -3.110 7.333 12.253 1.00 0.00 O ATOM 293 CB ALA A 21 -5.120 9.102 14.312 1.00 0.00 C ATOM 0 H ALA A 21 -6.780 9.526 12.646 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.970 9.628 12.579 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -4.242 8.864 14.912 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.428 10.128 14.512 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.932 8.422 14.572 1.00 0.00 H new ATOM 299 N GLU A 22 -5.219 6.569 12.421 1.00 0.00 N ATOM 300 CA GLU A 22 -4.966 5.183 12.010 1.00 0.00 C ATOM 301 C GLU A 22 -4.537 5.033 10.538 1.00 0.00 C ATOM 302 O GLU A 22 -4.528 3.914 10.024 1.00 0.00 O ATOM 303 CB GLU A 22 -6.199 4.310 12.311 1.00 0.00 C ATOM 304 CG GLU A 22 -7.405 4.614 11.404 1.00 0.00 C ATOM 305 CD GLU A 22 -8.686 4.781 12.215 1.00 0.00 C ATOM 306 OE1 GLU A 22 -8.967 5.918 12.663 1.00 0.00 O ATOM 307 OE2 GLU A 22 -9.415 3.782 12.410 1.00 0.00 O ATOM 0 H GLU A 22 -6.200 6.739 12.641 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.115 4.839 12.598 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.927 3.260 12.200 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.491 4.455 13.351 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.213 5.523 10.834 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -7.532 3.806 10.683 1.00 0.00 H new ATOM 314 N SER A 23 -4.212 6.125 9.845 1.00 0.00 N ATOM 315 CA SER A 23 -3.591 6.139 8.529 1.00 0.00 C ATOM 316 C SER A 23 -2.342 7.032 8.516 1.00 0.00 C ATOM 317 O SER A 23 -1.443 6.799 7.711 1.00 0.00 O ATOM 318 CB SER A 23 -4.630 6.597 7.496 1.00 0.00 C ATOM 319 OG SER A 23 -4.246 6.225 6.186 1.00 0.00 O ATOM 0 H SER A 23 -4.384 7.063 10.206 1.00 0.00 H new ATOM 0 HA SER A 23 -3.256 5.134 8.272 1.00 0.00 H new ATOM 0 HB2 SER A 23 -5.600 6.158 7.732 1.00 0.00 H new ATOM 0 HB3 SER A 23 -4.748 7.679 7.550 1.00 0.00 H new ATOM 0 HG SER A 23 -3.269 6.247 6.113 1.00 0.00 H new ATOM 325 N THR A 24 -2.256 8.061 9.362 1.00 0.00 N ATOM 326 CA THR A 24 -1.130 8.985 9.355 1.00 0.00 C ATOM 327 C THR A 24 0.148 8.291 9.846 1.00 0.00 C ATOM 328 O THR A 24 1.212 8.502 9.281 1.00 0.00 O ATOM 329 CB THR A 24 -1.461 10.222 10.202 1.00 0.00 C ATOM 330 OG1 THR A 24 -2.788 10.691 9.992 1.00 0.00 O ATOM 331 CG2 THR A 24 -0.540 11.381 9.827 1.00 0.00 C ATOM 0 H THR A 24 -2.963 8.273 10.066 1.00 0.00 H new ATOM 0 HA THR A 24 -0.948 9.313 8.332 1.00 0.00 H new ATOM 0 HB THR A 24 -1.336 9.911 11.239 1.00 0.00 H new ATOM 0 HG1 THR A 24 -3.425 9.980 10.213 1.00 0.00 H new ATOM 0 HG21 THR A 24 -0.785 12.252 10.435 1.00 0.00 H new ATOM 0 HG22 THR A 24 0.496 11.094 10.005 1.00 0.00 H new ATOM 0 HG23 THR A 24 -0.673 11.625 8.773 1.00 0.00 H new ATOM 339 N ASN A 25 0.061 7.439 10.866 1.00 0.00 N ATOM 340 CA ASN A 25 1.184 6.632 11.332 1.00 0.00 C ATOM 341 C ASN A 25 0.582 5.356 11.874 1.00 0.00 C ATOM 342 O ASN A 25 0.075 5.273 12.996 1.00 0.00 O ATOM 343 CB ASN A 25 2.108 7.334 12.344 1.00 0.00 C ATOM 344 CG ASN A 25 1.501 8.565 12.986 1.00 0.00 C ATOM 345 OD1 ASN A 25 0.644 8.460 13.859 1.00 0.00 O ATOM 346 ND2 ASN A 25 1.906 9.738 12.531 1.00 0.00 N ATOM 0 H ASN A 25 -0.798 7.289 11.395 1.00 0.00 H new ATOM 0 HA ASN A 25 1.861 6.436 10.501 1.00 0.00 H new ATOM 0 HB2 ASN A 25 2.377 6.625 13.127 1.00 0.00 H new ATOM 0 HB3 ASN A 25 3.032 7.618 11.840 1.00 0.00 H new ATOM 0 HD21 ASN A 25 1.504 10.597 12.906 1.00 0.00 H new ATOM 0 HD22 ASN A 25 2.621 9.784 11.805 1.00 0.00 H new ATOM 353 N PHE A 26 0.588 4.339 11.030 1.00 0.00 N ATOM 354 CA PHE A 26 -0.058 3.068 11.262 1.00 0.00 C ATOM 355 C PHE A 26 0.845 1.974 10.714 1.00 0.00 C ATOM 356 O PHE A 26 1.863 2.266 10.083 1.00 0.00 O ATOM 357 CB PHE A 26 -1.468 3.090 10.649 1.00 0.00 C ATOM 358 CG PHE A 26 -1.586 2.982 9.134 1.00 0.00 C ATOM 359 CD1 PHE A 26 -0.874 3.837 8.268 1.00 0.00 C ATOM 360 CD2 PHE A 26 -2.442 2.012 8.577 1.00 0.00 C ATOM 361 CE1 PHE A 26 -1.025 3.719 6.877 1.00 0.00 C ATOM 362 CE2 PHE A 26 -2.594 1.889 7.186 1.00 0.00 C ATOM 363 CZ PHE A 26 -1.892 2.760 6.334 1.00 0.00 C ATOM 0 H PHE A 26 1.064 4.383 10.129 1.00 0.00 H new ATOM 0 HA PHE A 26 -0.201 2.866 12.324 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -2.037 2.271 11.088 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -1.953 4.016 10.957 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -0.210 4.585 8.676 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -2.991 1.351 9.231 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -0.469 4.372 6.220 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.245 1.132 6.774 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.020 2.690 5.264 1.00 0.00 H new ATOM 373 N THR A 27 0.461 0.727 10.952 1.00 0.00 N ATOM 374 CA THR A 27 1.304 -0.414 10.667 1.00 0.00 C ATOM 375 C THR A 27 0.499 -1.376 9.804 1.00 0.00 C ATOM 376 O THR A 27 -0.702 -1.560 10.027 1.00 0.00 O ATOM 377 CB THR A 27 1.767 -1.022 11.999 1.00 0.00 C ATOM 378 OG1 THR A 27 2.328 -0.012 12.820 1.00 0.00 O ATOM 379 CG2 THR A 27 2.819 -2.093 11.739 1.00 0.00 C ATOM 0 H THR A 27 -0.446 0.483 11.349 1.00 0.00 H new ATOM 0 HA THR A 27 2.205 -0.148 10.114 1.00 0.00 H new ATOM 0 HB THR A 27 0.908 -1.466 12.501 1.00 0.00 H new ATOM 0 HG1 THR A 27 2.620 -0.405 13.669 1.00 0.00 H new ATOM 0 HG21 THR A 27 3.144 -2.521 12.687 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.393 -2.877 11.114 1.00 0.00 H new ATOM 0 HG23 THR A 27 3.674 -1.648 11.230 1.00 0.00 H new ATOM 387 N VAL A 28 1.144 -1.969 8.807 1.00 0.00 N ATOM 388 CA VAL A 28 0.539 -2.884 7.857 1.00 0.00 C ATOM 389 C VAL A 28 1.412 -4.102 7.864 1.00 0.00 C ATOM 390 O VAL A 28 2.491 -4.182 7.285 1.00 0.00 O ATOM 391 CB VAL A 28 0.314 -2.156 6.516 1.00 0.00 C ATOM 392 CG1 VAL A 28 0.358 -2.990 5.238 1.00 0.00 C ATOM 393 CG2 VAL A 28 -1.042 -1.447 6.541 1.00 0.00 C ATOM 0 H VAL A 28 2.138 -1.818 8.635 1.00 0.00 H new ATOM 0 HA VAL A 28 -0.466 -3.225 8.104 1.00 0.00 H new ATOM 0 HB VAL A 28 1.172 -1.486 6.457 1.00 0.00 H new ATOM 0 HG11 VAL A 28 0.183 -2.345 4.377 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.336 -3.463 5.145 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.414 -3.758 5.278 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.201 -0.932 5.593 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -1.834 -2.181 6.693 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.059 -0.722 7.355 1.00 0.00 H new ATOM 403 N ASP A 29 0.918 -5.043 8.634 1.00 0.00 N ATOM 404 CA ASP A 29 1.277 -6.414 8.561 1.00 0.00 C ATOM 405 C ASP A 29 0.529 -7.045 7.397 1.00 0.00 C ATOM 406 O ASP A 29 -0.623 -6.719 7.098 1.00 0.00 O ATOM 407 CB ASP A 29 0.895 -7.077 9.869 1.00 0.00 C ATOM 408 CG ASP A 29 -0.600 -7.132 10.189 1.00 0.00 C ATOM 409 OD1 ASP A 29 -1.307 -6.114 10.003 1.00 0.00 O ATOM 410 OD2 ASP A 29 -1.040 -8.186 10.704 1.00 0.00 O ATOM 0 H ASP A 29 0.224 -4.850 9.357 1.00 0.00 H new ATOM 0 HA ASP A 29 2.348 -6.536 8.401 1.00 0.00 H new ATOM 0 HB2 ASP A 29 1.281 -8.096 9.862 1.00 0.00 H new ATOM 0 HB3 ASP A 29 1.399 -6.551 10.680 1.00 0.00 H new ATOM 415 N LEU A 30 1.246 -7.929 6.714 1.00 0.00 N ATOM 416 CA LEU A 30 0.778 -8.677 5.565 1.00 0.00 C ATOM 417 C LEU A 30 0.670 -10.130 6.004 1.00 0.00 C ATOM 418 O LEU A 30 -0.437 -10.646 6.075 1.00 0.00 O ATOM 419 CB LEU A 30 1.652 -8.504 4.293 1.00 0.00 C ATOM 420 CG LEU A 30 2.323 -7.139 4.044 1.00 0.00 C ATOM 421 CD1 LEU A 30 2.878 -6.942 2.642 1.00 0.00 C ATOM 422 CD2 LEU A 30 1.445 -5.914 4.296 1.00 0.00 C ATOM 0 H LEU A 30 2.211 -8.150 6.961 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.191 -8.288 5.253 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.438 -9.259 4.325 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.028 -8.730 3.428 1.00 0.00 H new ATOM 0 HG LEU A 30 3.123 -7.196 4.782 1.00 0.00 H new ATOM 0 HD11 LEU A 30 3.329 -5.953 2.565 1.00 0.00 H new ATOM 0 HD12 LEU A 30 3.633 -7.702 2.439 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.070 -7.030 1.915 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.016 -5.009 4.090 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.574 -5.950 3.642 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.118 -5.908 5.336 1.00 0.00 H new ATOM 434 N MET A 31 1.794 -10.779 6.327 1.00 0.00 N ATOM 435 CA MET A 31 1.945 -12.231 6.468 1.00 0.00 C ATOM 436 C MET A 31 3.427 -12.565 6.644 1.00 0.00 C ATOM 437 O MET A 31 4.308 -11.719 6.457 1.00 0.00 O ATOM 438 CB MET A 31 1.449 -12.950 5.203 1.00 0.00 C ATOM 439 CG MET A 31 0.112 -13.676 5.341 1.00 0.00 C ATOM 440 SD MET A 31 -0.439 -14.339 3.755 1.00 0.00 S ATOM 441 CE MET A 31 -0.448 -12.807 2.799 1.00 0.00 C ATOM 0 H MET A 31 2.666 -10.281 6.506 1.00 0.00 H new ATOM 0 HA MET A 31 1.362 -12.557 7.330 1.00 0.00 H new ATOM 0 HB2 MET A 31 1.364 -12.218 4.400 1.00 0.00 H new ATOM 0 HB3 MET A 31 2.205 -13.673 4.897 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.209 -14.487 6.063 1.00 0.00 H new ATOM 0 HG3 MET A 31 -0.639 -12.989 5.731 1.00 0.00 H new ATOM 0 HE1 MET A 31 -1.365 -12.750 2.212 1.00 0.00 H new ATOM 0 HE2 MET A 31 -0.397 -11.955 3.477 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.412 -12.791 2.130 1.00 0.00 H new ATOM 451 N GLU A 32 3.709 -13.841 6.886 1.00 0.00 N ATOM 452 CA GLU A 32 5.070 -14.350 7.032 1.00 0.00 C ATOM 453 C GLU A 32 5.573 -14.817 5.673 1.00 0.00 C ATOM 454 O GLU A 32 5.164 -15.843 5.125 1.00 0.00 O ATOM 455 CB GLU A 32 5.189 -15.403 8.147 1.00 0.00 C ATOM 456 CG GLU A 32 5.788 -14.732 9.387 1.00 0.00 C ATOM 457 CD GLU A 32 5.591 -15.509 10.687 1.00 0.00 C ATOM 458 OE1 GLU A 32 5.950 -16.705 10.744 1.00 0.00 O ATOM 459 OE2 GLU A 32 5.142 -14.891 11.684 1.00 0.00 O ATOM 0 H GLU A 32 2.992 -14.559 6.988 1.00 0.00 H new ATOM 0 HA GLU A 32 5.726 -13.546 7.367 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.210 -15.822 8.379 1.00 0.00 H new ATOM 0 HB3 GLU A 32 5.820 -16.230 7.821 1.00 0.00 H new ATOM 0 HG2 GLU A 32 6.856 -14.585 9.225 1.00 0.00 H new ATOM 0 HG3 GLU A 32 5.344 -13.743 9.499 1.00 0.00 H new ATOM 466 N ASN A 33 6.441 -13.991 5.098 1.00 0.00 N ATOM 467 CA ASN A 33 7.292 -14.335 3.977 1.00 0.00 C ATOM 468 C ASN A 33 8.133 -15.567 4.314 1.00 0.00 C ATOM 469 O ASN A 33 8.277 -15.953 5.473 1.00 0.00 O ATOM 470 CB ASN A 33 8.132 -13.103 3.611 1.00 0.00 C ATOM 471 CG ASN A 33 7.254 -11.946 3.167 1.00 0.00 C ATOM 472 OD1 ASN A 33 7.038 -10.969 3.878 1.00 0.00 O ATOM 473 ND2 ASN A 33 6.673 -12.072 1.993 1.00 0.00 N ATOM 0 H ASN A 33 6.572 -13.030 5.415 1.00 0.00 H new ATOM 0 HA ASN A 33 6.702 -14.606 3.102 1.00 0.00 H new ATOM 0 HB2 ASN A 33 8.729 -12.799 4.471 1.00 0.00 H new ATOM 0 HB3 ASN A 33 8.829 -13.360 2.813 1.00 0.00 H new ATOM 0 HD21 ASN A 33 6.032 -11.351 1.661 1.00 0.00 H new ATOM 0 HD22 ASN A 33 6.864 -12.890 1.415 1.00 0.00 H new ATOM 480 N ALA A 34 8.773 -16.146 3.307 1.00 0.00 N ATOM 481 CA ALA A 34 9.880 -17.061 3.492 1.00 0.00 C ATOM 482 C ALA A 34 10.980 -16.558 2.586 1.00 0.00 C ATOM 483 O ALA A 34 10.703 -16.044 1.506 1.00 0.00 O ATOM 484 CB ALA A 34 9.485 -18.504 3.173 1.00 0.00 C ATOM 0 H ALA A 34 8.531 -15.988 2.329 1.00 0.00 H new ATOM 0 HA ALA A 34 10.207 -17.085 4.531 1.00 0.00 H new ATOM 0 HB1 ALA A 34 10.344 -19.158 3.324 1.00 0.00 H new ATOM 0 HB2 ALA A 34 8.673 -18.813 3.831 1.00 0.00 H new ATOM 0 HB3 ALA A 34 9.157 -18.571 2.136 1.00 0.00 H new ATOM 490 N ALA A 35 12.217 -16.679 3.037 1.00 0.00 N ATOM 491 CA ALA A 35 13.388 -16.310 2.273 1.00 0.00 C ATOM 492 C ALA A 35 13.447 -17.172 1.012 1.00 0.00 C ATOM 493 O ALA A 35 13.643 -16.663 -0.088 1.00 0.00 O ATOM 494 CB ALA A 35 14.630 -16.510 3.147 1.00 0.00 C ATOM 0 H ALA A 35 12.436 -17.044 3.964 1.00 0.00 H new ATOM 0 HA ALA A 35 13.344 -15.264 1.971 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.521 -16.235 2.582 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.555 -15.882 4.035 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.699 -17.556 3.447 1.00 0.00 H new ATOM 500 N LYS A 36 13.262 -18.486 1.169 1.00 0.00 N ATOM 501 CA LYS A 36 13.717 -19.444 0.162 1.00 0.00 C ATOM 502 C LYS A 36 12.908 -19.437 -1.129 1.00 0.00 C ATOM 503 O LYS A 36 13.436 -19.851 -2.164 1.00 0.00 O ATOM 504 CB LYS A 36 13.743 -20.855 0.756 1.00 0.00 C ATOM 505 CG LYS A 36 15.104 -21.179 1.388 1.00 0.00 C ATOM 506 CD LYS A 36 15.279 -22.692 1.550 1.00 0.00 C ATOM 507 CE LYS A 36 15.474 -23.347 0.171 1.00 0.00 C ATOM 508 NZ LYS A 36 15.528 -24.815 0.265 1.00 0.00 N ATOM 0 H LYS A 36 12.804 -18.906 1.978 1.00 0.00 H new ATOM 0 HA LYS A 36 14.721 -19.125 -0.117 1.00 0.00 H new ATOM 0 HB2 LYS A 36 12.961 -20.947 1.509 1.00 0.00 H new ATOM 0 HB3 LYS A 36 13.522 -21.583 -0.025 1.00 0.00 H new ATOM 0 HG2 LYS A 36 15.904 -20.780 0.765 1.00 0.00 H new ATOM 0 HG3 LYS A 36 15.184 -20.692 2.360 1.00 0.00 H new ATOM 0 HD2 LYS A 36 16.139 -22.901 2.187 1.00 0.00 H new ATOM 0 HD3 LYS A 36 14.405 -23.117 2.044 1.00 0.00 H new ATOM 0 HE2 LYS A 36 14.657 -23.055 -0.489 1.00 0.00 H new ATOM 0 HE3 LYS A 36 16.395 -22.978 -0.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 15.660 -25.219 -0.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 16.323 -25.095 0.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 14.639 -25.170 0.672 1.00 0.00 H new ATOM 522 N GLN A 37 11.655 -18.989 -1.085 1.00 0.00 N ATOM 523 CA GLN A 37 10.792 -18.941 -2.258 1.00 0.00 C ATOM 524 C GLN A 37 11.333 -17.990 -3.326 1.00 0.00 C ATOM 525 O GLN A 37 11.134 -18.229 -4.515 1.00 0.00 O ATOM 526 CB GLN A 37 9.374 -18.505 -1.857 1.00 0.00 C ATOM 527 CG GLN A 37 9.354 -17.251 -0.968 1.00 0.00 C ATOM 528 CD GLN A 37 8.208 -16.311 -1.291 1.00 0.00 C ATOM 529 OE1 GLN A 37 7.423 -15.967 -0.290 1.00 0.00 O flip ATOM 530 NE2 GLN A 37 8.021 -15.886 -2.421 1.00 0.00 N flip ATOM 0 H GLN A 37 11.211 -18.649 -0.232 1.00 0.00 H new ATOM 0 HA GLN A 37 10.765 -19.945 -2.681 1.00 0.00 H new ATOM 0 HB2 GLN A 37 8.792 -18.313 -2.758 1.00 0.00 H new ATOM 0 HB3 GLN A 37 8.885 -19.324 -1.330 1.00 0.00 H new ATOM 0 HG2 GLN A 37 9.284 -17.554 0.077 1.00 0.00 H new ATOM 0 HG3 GLN A 37 10.297 -16.717 -1.082 1.00 0.00 H new ATOM 0 HE21 GLN A 37 8.642 -16.166 -3.180 1.00 0.00 H new ATOM 0 HE22 GLN A 37 7.244 -15.251 -2.605 1.00 0.00 H new ATOM 539 N PHE A 38 11.988 -16.904 -2.915 1.00 0.00 N ATOM 540 CA PHE A 38 12.292 -15.766 -3.759 1.00 0.00 C ATOM 541 C PHE A 38 13.560 -16.065 -4.558 1.00 0.00 C ATOM 542 O PHE A 38 14.637 -15.537 -4.281 1.00 0.00 O ATOM 543 CB PHE A 38 12.446 -14.541 -2.861 1.00 0.00 C ATOM 544 CG PHE A 38 11.174 -13.995 -2.225 1.00 0.00 C ATOM 545 CD1 PHE A 38 10.150 -13.405 -2.998 1.00 0.00 C ATOM 546 CD2 PHE A 38 11.062 -13.976 -0.823 1.00 0.00 C ATOM 547 CE1 PHE A 38 9.082 -12.740 -2.382 1.00 0.00 C ATOM 548 CE2 PHE A 38 9.963 -13.358 -0.205 1.00 0.00 C ATOM 549 CZ PHE A 38 8.988 -12.715 -0.985 1.00 0.00 C ATOM 0 H PHE A 38 12.327 -16.796 -1.959 1.00 0.00 H new ATOM 0 HA PHE A 38 11.495 -15.568 -4.476 1.00 0.00 H new ATOM 0 HB2 PHE A 38 13.146 -14.790 -2.063 1.00 0.00 H new ATOM 0 HB3 PHE A 38 12.902 -13.744 -3.448 1.00 0.00 H new ATOM 0 HD1 PHE A 38 10.191 -13.467 -4.075 1.00 0.00 H new ATOM 0 HD2 PHE A 38 11.827 -14.440 -0.218 1.00 0.00 H new ATOM 0 HE1 PHE A 38 8.332 -12.247 -2.983 1.00 0.00 H new ATOM 0 HE2 PHE A 38 9.867 -13.377 0.871 1.00 0.00 H new ATOM 0 HZ PHE A 38 8.166 -12.202 -0.508 1.00 0.00 H new ATOM 559 N ASN A 39 13.430 -16.951 -5.543 1.00 0.00 N ATOM 560 CA ASN A 39 14.544 -17.613 -6.212 1.00 0.00 C ATOM 561 C ASN A 39 14.598 -17.286 -7.709 1.00 0.00 C ATOM 562 O ASN A 39 15.275 -17.973 -8.474 1.00 0.00 O ATOM 563 CB ASN A 39 14.510 -19.132 -5.944 1.00 0.00 C ATOM 564 CG ASN A 39 13.540 -19.907 -6.838 1.00 0.00 C ATOM 565 OD1 ASN A 39 13.938 -20.753 -7.637 1.00 0.00 O ATOM 566 ND2 ASN A 39 12.247 -19.688 -6.703 1.00 0.00 N ATOM 0 H ASN A 39 12.520 -17.235 -5.907 1.00 0.00 H new ATOM 0 HA ASN A 39 15.469 -17.222 -5.788 1.00 0.00 H new ATOM 0 HB2 ASN A 39 15.513 -19.536 -6.080 1.00 0.00 H new ATOM 0 HB3 ASN A 39 14.238 -19.299 -4.902 1.00 0.00 H new ATOM 0 HD21 ASN A 39 11.579 -20.220 -7.261 1.00 0.00 H new ATOM 0 HD22 ASN A 39 11.915 -18.987 -6.041 1.00 0.00 H new ATOM 573 N ASN A 40 13.954 -16.189 -8.103 1.00 0.00 N ATOM 574 CA ASN A 40 14.009 -15.498 -9.390 1.00 0.00 C ATOM 575 C ASN A 40 13.234 -14.185 -9.275 1.00 0.00 C ATOM 576 O ASN A 40 12.630 -13.898 -8.240 1.00 0.00 O ATOM 577 CB ASN A 40 13.423 -16.354 -10.522 1.00 0.00 C ATOM 578 CG ASN A 40 12.070 -16.975 -10.194 1.00 0.00 C ATOM 579 OD1 ASN A 40 11.130 -16.286 -9.805 1.00 0.00 O ATOM 580 ND2 ASN A 40 11.949 -18.288 -10.319 1.00 0.00 N ATOM 0 H ASN A 40 13.316 -15.714 -7.464 1.00 0.00 H new ATOM 0 HA ASN A 40 15.053 -15.305 -9.636 1.00 0.00 H new ATOM 0 HB2 ASN A 40 13.321 -15.737 -11.415 1.00 0.00 H new ATOM 0 HB3 ASN A 40 14.127 -17.150 -10.764 1.00 0.00 H new ATOM 0 HD21 ASN A 40 11.065 -18.743 -10.091 1.00 0.00 H new ATOM 0 HD22 ASN A 40 12.740 -18.844 -10.643 1.00 0.00 H new ATOM 587 N ILE A 41 13.321 -13.352 -10.312 1.00 0.00 N ATOM 588 CA ILE A 41 12.869 -11.961 -10.317 1.00 0.00 C ATOM 589 C ILE A 41 11.375 -11.857 -10.682 1.00 0.00 C ATOM 590 O ILE A 41 10.766 -10.796 -10.522 1.00 0.00 O ATOM 591 CB ILE A 41 13.833 -11.148 -11.226 1.00 0.00 C ATOM 592 CG1 ILE A 41 15.245 -11.037 -10.591 1.00 0.00 C ATOM 593 CG2 ILE A 41 13.351 -9.711 -11.482 1.00 0.00 C ATOM 594 CD1 ILE A 41 16.212 -12.185 -10.911 1.00 0.00 C ATOM 0 H ILE A 41 13.723 -13.638 -11.205 1.00 0.00 H new ATOM 0 HA ILE A 41 12.918 -11.522 -9.321 1.00 0.00 H new ATOM 0 HB ILE A 41 13.860 -11.698 -12.167 1.00 0.00 H new ATOM 0 HG12 ILE A 41 15.699 -10.102 -10.920 1.00 0.00 H new ATOM 0 HG13 ILE A 41 15.132 -10.973 -9.509 1.00 0.00 H new ATOM 0 HG21 ILE A 41 14.067 -9.196 -12.123 1.00 0.00 H new ATOM 0 HG22 ILE A 41 12.378 -9.736 -11.972 1.00 0.00 H new ATOM 0 HG23 ILE A 41 13.266 -9.181 -10.533 1.00 0.00 H new ATOM 0 HD11 ILE A 41 17.167 -12.005 -10.417 1.00 0.00 H new ATOM 0 HD12 ILE A 41 15.791 -13.125 -10.555 1.00 0.00 H new ATOM 0 HD13 ILE A 41 16.366 -12.241 -11.989 1.00 0.00 H new ATOM 606 N GLY A 42 10.734 -12.946 -11.115 1.00 0.00 N ATOM 607 CA GLY A 42 9.282 -12.986 -11.236 1.00 0.00 C ATOM 608 C GLY A 42 8.589 -13.060 -9.877 1.00 0.00 C ATOM 609 O GLY A 42 7.400 -12.746 -9.800 1.00 0.00 O ATOM 0 H GLY A 42 11.202 -13.810 -11.387 1.00 0.00 H new ATOM 0 HA2 GLY A 42 8.939 -12.099 -11.768 1.00 0.00 H new ATOM 0 HA3 GLY A 42 8.993 -13.849 -11.836 1.00 0.00 H new ATOM 613 N ALA A 43 9.307 -13.471 -8.821 1.00 0.00 N ATOM 614 CA ALA A 43 8.738 -13.860 -7.537 1.00 0.00 C ATOM 615 C ALA A 43 7.948 -12.733 -6.856 1.00 0.00 C ATOM 616 O ALA A 43 8.501 -11.923 -6.106 1.00 0.00 O ATOM 617 CB ALA A 43 9.829 -14.438 -6.632 1.00 0.00 C ATOM 0 H ALA A 43 10.324 -13.541 -8.845 1.00 0.00 H new ATOM 0 HA ALA A 43 8.001 -14.640 -7.729 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.393 -14.726 -5.675 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.270 -15.314 -7.108 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.601 -13.687 -6.468 1.00 0.00 H new ATOM 623 N THR A 44 6.645 -12.716 -7.120 1.00 0.00 N ATOM 624 CA THR A 44 5.635 -11.792 -6.639 1.00 0.00 C ATOM 625 C THR A 44 4.755 -12.601 -5.681 1.00 0.00 C ATOM 626 O THR A 44 4.133 -13.587 -6.087 1.00 0.00 O ATOM 627 CB THR A 44 4.834 -11.211 -7.830 1.00 0.00 C ATOM 628 OG1 THR A 44 4.788 -12.097 -8.942 1.00 0.00 O ATOM 629 CG2 THR A 44 5.385 -9.888 -8.363 1.00 0.00 C ATOM 0 H THR A 44 6.235 -13.418 -7.736 1.00 0.00 H new ATOM 0 HA THR A 44 6.065 -10.934 -6.123 1.00 0.00 H new ATOM 0 HB THR A 44 3.842 -11.055 -7.406 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.690 -12.210 -9.308 1.00 0.00 H new ATOM 0 HG21 THR A 44 4.770 -9.547 -9.195 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.369 -9.141 -7.569 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.410 -10.032 -8.705 1.00 0.00 H new ATOM 637 N THR A 45 4.777 -12.253 -4.395 1.00 0.00 N ATOM 638 CA THR A 45 4.111 -13.020 -3.343 1.00 0.00 C ATOM 639 C THR A 45 2.571 -12.889 -3.411 1.00 0.00 C ATOM 640 O THR A 45 2.061 -12.094 -4.209 1.00 0.00 O ATOM 641 CB THR A 45 4.730 -12.649 -1.973 1.00 0.00 C ATOM 642 OG1 THR A 45 5.342 -11.368 -1.869 1.00 0.00 O ATOM 643 CG2 THR A 45 5.779 -13.677 -1.590 1.00 0.00 C ATOM 0 H THR A 45 5.262 -11.424 -4.051 1.00 0.00 H new ATOM 0 HA THR A 45 4.287 -14.085 -3.495 1.00 0.00 H new ATOM 0 HB THR A 45 3.869 -12.629 -1.305 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.694 -11.246 -0.963 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.212 -13.413 -0.625 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.316 -14.661 -1.522 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.563 -13.696 -2.347 1.00 0.00 H new ATOM 651 N PRO A 46 1.784 -13.651 -2.617 1.00 0.00 N ATOM 652 CA PRO A 46 0.340 -13.459 -2.551 1.00 0.00 C ATOM 653 C PRO A 46 0.084 -12.104 -1.906 1.00 0.00 C ATOM 654 O PRO A 46 0.427 -11.899 -0.740 1.00 0.00 O ATOM 655 CB PRO A 46 -0.226 -14.619 -1.730 1.00 0.00 C ATOM 656 CG PRO A 46 0.938 -15.007 -0.827 1.00 0.00 C ATOM 657 CD PRO A 46 2.165 -14.711 -1.687 1.00 0.00 C ATOM 0 HA PRO A 46 -0.143 -13.459 -3.528 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -1.099 -14.315 -1.153 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -0.536 -15.448 -2.366 1.00 0.00 H new ATOM 0 HG2 PRO A 46 0.943 -14.425 0.095 1.00 0.00 H new ATOM 0 HG3 PRO A 46 0.892 -16.058 -0.540 1.00 0.00 H new ATOM 0 HD2 PRO A 46 3.005 -14.398 -1.067 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.483 -15.603 -2.227 1.00 0.00 H new ATOM 665 N VAL A 47 -0.415 -11.155 -2.694 1.00 0.00 N ATOM 666 CA VAL A 47 -0.657 -9.804 -2.222 1.00 0.00 C ATOM 667 C VAL A 47 -1.702 -9.791 -1.102 1.00 0.00 C ATOM 668 O VAL A 47 -2.541 -10.692 -1.004 1.00 0.00 O ATOM 669 CB VAL A 47 -0.986 -8.858 -3.394 1.00 0.00 C ATOM 670 CG1 VAL A 47 -0.020 -8.993 -4.586 1.00 0.00 C ATOM 671 CG2 VAL A 47 -2.416 -9.057 -3.901 1.00 0.00 C ATOM 0 H VAL A 47 -0.660 -11.305 -3.673 1.00 0.00 H new ATOM 0 HA VAL A 47 0.259 -9.416 -1.777 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.873 -7.857 -2.978 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -0.313 -8.297 -5.372 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.995 -8.765 -4.260 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.057 -10.012 -4.971 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -2.608 -8.372 -4.727 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -2.540 -10.084 -4.245 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -3.120 -8.857 -3.093 1.00 0.00 H new ATOM 681 N VAL A 48 -1.658 -8.751 -0.271 1.00 0.00 N ATOM 682 CA VAL A 48 -2.579 -8.564 0.838 1.00 0.00 C ATOM 683 C VAL A 48 -3.459 -7.347 0.538 1.00 0.00 C ATOM 684 O VAL A 48 -2.932 -6.361 0.011 1.00 0.00 O ATOM 685 CB VAL A 48 -1.764 -8.476 2.152 1.00 0.00 C ATOM 686 CG1 VAL A 48 -1.845 -7.135 2.888 1.00 0.00 C ATOM 687 CG2 VAL A 48 -2.216 -9.589 3.090 1.00 0.00 C ATOM 0 H VAL A 48 -0.968 -8.005 -0.355 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.260 -9.405 0.966 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.720 -8.581 1.857 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.240 -7.180 3.793 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.472 -6.342 2.241 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.882 -6.928 3.154 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -1.648 -9.535 4.019 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.278 -9.473 3.307 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.046 -10.556 2.616 1.00 0.00 H new ATOM 697 N PRO A 49 -4.768 -7.388 0.854 1.00 0.00 N ATOM 698 CA PRO A 49 -5.679 -6.273 0.654 1.00 0.00 C ATOM 699 C PRO A 49 -5.305 -5.148 1.611 1.00 0.00 C ATOM 700 O PRO A 49 -5.171 -5.370 2.818 1.00 0.00 O ATOM 701 CB PRO A 49 -7.081 -6.829 0.918 1.00 0.00 C ATOM 702 CG PRO A 49 -6.837 -7.972 1.896 1.00 0.00 C ATOM 703 CD PRO A 49 -5.476 -8.504 1.464 1.00 0.00 C ATOM 0 HA PRO A 49 -5.632 -5.853 -0.351 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.739 -6.071 1.344 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -7.552 -7.181 0.000 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -6.826 -7.624 2.929 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.611 -8.736 1.825 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -4.923 -8.893 2.319 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.588 -9.325 0.756 1.00 0.00 H new ATOM 711 N PHE A 50 -5.144 -3.944 1.069 1.00 0.00 N ATOM 712 CA PHE A 50 -4.646 -2.782 1.782 1.00 0.00 C ATOM 713 C PHE A 50 -5.426 -1.537 1.330 1.00 0.00 C ATOM 714 O PHE A 50 -6.062 -1.547 0.275 1.00 0.00 O ATOM 715 CB PHE A 50 -3.133 -2.683 1.507 1.00 0.00 C ATOM 716 CG PHE A 50 -2.524 -1.386 1.974 1.00 0.00 C ATOM 717 CD1 PHE A 50 -2.637 -1.034 3.329 1.00 0.00 C ATOM 718 CD2 PHE A 50 -1.993 -0.470 1.047 1.00 0.00 C ATOM 719 CE1 PHE A 50 -2.310 0.264 3.736 1.00 0.00 C ATOM 720 CE2 PHE A 50 -1.612 0.811 1.480 1.00 0.00 C ATOM 721 CZ PHE A 50 -1.797 1.187 2.816 1.00 0.00 C ATOM 0 H PHE A 50 -5.364 -3.749 0.092 1.00 0.00 H new ATOM 0 HA PHE A 50 -4.793 -2.864 2.859 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.626 -3.512 2.001 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -2.958 -2.794 0.437 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.974 -1.761 4.053 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.879 -0.750 0.010 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -2.454 0.556 4.766 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -1.175 1.508 0.780 1.00 0.00 H new ATOM 0 HZ PHE A 50 -1.545 2.187 3.136 1.00 0.00 H new ATOM 731 N ARG A 51 -5.392 -0.457 2.122 1.00 0.00 N ATOM 732 CA ARG A 51 -5.898 0.863 1.753 1.00 0.00 C ATOM 733 C ARG A 51 -5.399 1.926 2.715 1.00 0.00 C ATOM 734 O ARG A 51 -5.163 1.666 3.897 1.00 0.00 O ATOM 735 CB ARG A 51 -7.438 0.895 1.707 1.00 0.00 C ATOM 736 CG ARG A 51 -8.150 0.294 2.939 1.00 0.00 C ATOM 737 CD ARG A 51 -8.282 1.236 4.158 1.00 0.00 C ATOM 738 NE ARG A 51 -7.525 0.758 5.324 1.00 0.00 N ATOM 739 CZ ARG A 51 -7.977 -0.062 6.282 1.00 0.00 C ATOM 740 NH1 ARG A 51 -9.119 -0.723 6.113 1.00 0.00 N ATOM 741 NH2 ARG A 51 -7.295 -0.192 7.413 1.00 0.00 N ATOM 0 H ARG A 51 -5.000 -0.483 3.063 1.00 0.00 H new ATOM 0 HA ARG A 51 -5.519 1.076 0.753 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -7.760 1.930 1.592 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -7.769 0.357 0.819 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -9.148 -0.026 2.640 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -7.609 -0.600 3.250 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -7.931 2.231 3.884 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -9.334 1.332 4.426 1.00 0.00 H new ATOM 0 HE ARG A 51 -6.562 1.082 5.412 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -9.653 -0.606 5.252 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -9.460 -1.347 6.844 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -6.430 0.331 7.550 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -7.636 -0.815 8.145 1.00 0.00 H new ATOM 755 N ILE A 52 -5.390 3.150 2.205 1.00 0.00 N ATOM 756 CA ILE A 52 -5.374 4.400 2.945 1.00 0.00 C ATOM 757 C ILE A 52 -6.787 4.593 3.513 1.00 0.00 C ATOM 758 O ILE A 52 -7.761 4.239 2.843 1.00 0.00 O ATOM 759 CB ILE A 52 -4.983 5.522 1.949 1.00 0.00 C ATOM 760 CG1 ILE A 52 -3.534 5.345 1.453 1.00 0.00 C ATOM 761 CG2 ILE A 52 -5.181 6.912 2.566 1.00 0.00 C ATOM 762 CD1 ILE A 52 -3.255 6.042 0.117 1.00 0.00 C ATOM 0 H ILE A 52 -5.394 3.304 1.197 1.00 0.00 H new ATOM 0 HA ILE A 52 -4.659 4.412 3.768 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.648 5.441 1.089 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -2.850 5.735 2.207 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -3.321 4.281 1.350 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -4.898 7.675 1.841 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.228 7.043 2.840 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.558 7.007 3.456 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -2.217 5.875 -0.171 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.914 5.635 -0.650 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -3.436 7.112 0.220 1.00 0.00 H new ATOM 774 N LEU A 53 -6.929 5.192 4.694 1.00 0.00 N ATOM 775 CA LEU A 53 -8.208 5.587 5.277 1.00 0.00 C ATOM 776 C LEU A 53 -8.140 7.100 5.438 1.00 0.00 C ATOM 777 O LEU A 53 -7.211 7.612 6.067 1.00 0.00 O ATOM 778 CB LEU A 53 -8.420 4.859 6.620 1.00 0.00 C ATOM 779 CG LEU A 53 -9.791 5.054 7.310 1.00 0.00 C ATOM 780 CD1 LEU A 53 -10.235 6.501 7.508 1.00 0.00 C ATOM 781 CD2 LEU A 53 -10.849 4.235 6.580 1.00 0.00 C ATOM 0 H LEU A 53 -6.133 5.422 5.289 1.00 0.00 H new ATOM 0 HA LEU A 53 -9.058 5.315 4.651 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.271 3.792 6.455 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.643 5.186 7.310 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.664 4.689 8.329 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.208 6.519 8.000 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -9.506 7.024 8.127 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -10.309 6.995 6.539 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -11.815 4.372 7.066 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -10.914 4.566 5.543 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.576 3.180 6.608 1.00 0.00 H new ATOM 793 N LEU A 54 -9.112 7.814 4.879 1.00 0.00 N ATOM 794 CA LEU A 54 -9.172 9.267 4.886 1.00 0.00 C ATOM 795 C LEU A 54 -10.549 9.657 5.400 1.00 0.00 C ATOM 796 O LEU A 54 -11.550 9.348 4.759 1.00 0.00 O ATOM 797 CB LEU A 54 -8.902 9.779 3.459 1.00 0.00 C ATOM 798 CG LEU A 54 -7.590 10.542 3.226 1.00 0.00 C ATOM 799 CD1 LEU A 54 -6.372 10.054 4.004 1.00 0.00 C ATOM 800 CD2 LEU A 54 -7.222 10.447 1.745 1.00 0.00 C ATOM 0 H LEU A 54 -9.900 7.383 4.396 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.419 9.715 5.534 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -8.920 8.924 2.784 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -9.728 10.430 3.171 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.802 11.551 3.578 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.509 10.672 3.754 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.571 10.124 5.073 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.164 9.017 3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.291 10.985 1.566 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.095 9.400 1.468 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -8.017 10.887 1.144 1.00 0.00 H new ATOM 812 N SER A 55 -10.610 10.254 6.588 1.00 0.00 N ATOM 813 CA SER A 55 -11.830 10.777 7.175 1.00 0.00 C ATOM 814 C SER A 55 -11.424 11.645 8.377 1.00 0.00 C ATOM 815 O SER A 55 -10.400 11.316 8.987 1.00 0.00 O ATOM 816 CB SER A 55 -12.724 9.587 7.582 1.00 0.00 C ATOM 817 OG SER A 55 -12.363 8.963 8.810 1.00 0.00 O ATOM 0 H SER A 55 -9.790 10.388 7.179 1.00 0.00 H new ATOM 0 HA SER A 55 -12.400 11.392 6.479 1.00 0.00 H new ATOM 0 HB2 SER A 55 -13.755 9.933 7.656 1.00 0.00 H new ATOM 0 HB3 SER A 55 -12.695 8.840 6.789 1.00 0.00 H new ATOM 0 HG SER A 55 -12.978 8.223 8.994 1.00 0.00 H new ATOM 823 N PRO A 56 -12.224 12.629 8.825 1.00 0.00 N ATOM 824 CA PRO A 56 -13.437 13.156 8.200 1.00 0.00 C ATOM 825 C PRO A 56 -13.123 14.078 7.004 1.00 0.00 C ATOM 826 O PRO A 56 -11.965 14.404 6.735 1.00 0.00 O ATOM 827 CB PRO A 56 -14.145 13.915 9.332 1.00 0.00 C ATOM 828 CG PRO A 56 -12.982 14.438 10.172 1.00 0.00 C ATOM 829 CD PRO A 56 -11.974 13.299 10.091 1.00 0.00 C ATOM 0 HA PRO A 56 -14.056 12.364 7.779 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -14.764 14.727 8.949 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -14.799 13.261 9.910 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -12.577 15.367 9.770 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -13.283 14.640 11.200 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -10.953 13.678 10.136 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -12.096 12.610 10.927 1.00 0.00 H new ATOM 837 N CYS A 57 -14.163 14.515 6.286 1.00 0.00 N ATOM 838 CA CYS A 57 -14.066 15.314 5.063 1.00 0.00 C ATOM 839 C CYS A 57 -15.158 16.397 5.031 1.00 0.00 C ATOM 840 O CYS A 57 -15.828 16.649 6.038 1.00 0.00 O ATOM 841 CB CYS A 57 -14.200 14.390 3.838 1.00 0.00 C ATOM 842 SG CYS A 57 -13.110 12.952 3.751 1.00 0.00 S ATOM 0 H CYS A 57 -15.127 14.315 6.551 1.00 0.00 H new ATOM 0 HA CYS A 57 -13.096 15.810 5.041 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -15.229 14.034 3.797 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -14.035 14.991 2.944 1.00 0.00 H new ATOM 847 N GLY A 58 -15.385 16.987 3.853 1.00 0.00 N ATOM 848 CA GLY A 58 -16.570 17.756 3.502 1.00 0.00 C ATOM 849 C GLY A 58 -17.235 17.166 2.256 1.00 0.00 C ATOM 850 O GLY A 58 -16.941 16.037 1.847 1.00 0.00 O ATOM 0 H GLY A 58 -14.713 16.935 3.087 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -17.274 17.753 4.334 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -16.297 18.795 3.319 1.00 0.00 H new ATOM 854 N ASN A 59 -18.144 17.934 1.653 1.00 0.00 N ATOM 855 CA ASN A 59 -18.926 17.552 0.477 1.00 0.00 C ATOM 856 C ASN A 59 -18.279 18.160 -0.767 1.00 0.00 C ATOM 857 O ASN A 59 -18.795 19.099 -1.378 1.00 0.00 O ATOM 858 CB ASN A 59 -20.394 17.936 0.645 1.00 0.00 C ATOM 859 CG ASN A 59 -21.221 17.469 -0.544 1.00 0.00 C ATOM 860 OD1 ASN A 59 -20.958 16.426 -1.136 1.00 0.00 O ATOM 861 ND2 ASN A 59 -22.253 18.216 -0.892 1.00 0.00 N ATOM 0 H ASN A 59 -18.364 18.874 1.983 1.00 0.00 H new ATOM 0 HA ASN A 59 -18.922 16.469 0.358 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -20.786 17.494 1.561 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -20.481 19.017 0.750 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -22.851 17.930 -1.667 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -22.452 19.079 -0.385 1.00 0.00 H new ATOM 868 N ALA A 60 -17.038 17.743 -0.973 1.00 0.00 N ATOM 869 CA ALA A 60 -16.022 18.282 -1.853 1.00 0.00 C ATOM 870 C ALA A 60 -15.143 17.112 -2.256 1.00 0.00 C ATOM 871 O ALA A 60 -15.623 16.019 -2.546 1.00 0.00 O ATOM 872 CB ALA A 60 -15.303 19.426 -1.111 1.00 0.00 C ATOM 0 H ALA A 60 -16.685 16.929 -0.470 1.00 0.00 H new ATOM 0 HA ALA A 60 -16.405 18.729 -2.770 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -14.532 19.849 -1.755 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -16.024 20.201 -0.851 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -14.844 19.038 -0.202 1.00 0.00 H new ATOM 878 N VAL A 61 -13.858 17.401 -2.290 1.00 0.00 N ATOM 879 CA VAL A 61 -12.730 16.579 -2.627 1.00 0.00 C ATOM 880 C VAL A 61 -12.819 15.788 -3.934 1.00 0.00 C ATOM 881 O VAL A 61 -12.234 14.719 -4.037 1.00 0.00 O ATOM 882 CB VAL A 61 -12.282 15.708 -1.432 1.00 0.00 C ATOM 883 CG1 VAL A 61 -11.818 16.488 -0.219 1.00 0.00 C ATOM 884 CG2 VAL A 61 -13.344 14.699 -0.940 1.00 0.00 C ATOM 0 H VAL A 61 -13.549 18.343 -2.049 1.00 0.00 H new ATOM 0 HA VAL A 61 -11.943 17.301 -2.846 1.00 0.00 H new ATOM 0 HB VAL A 61 -11.438 15.173 -1.867 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -11.523 15.795 0.569 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -10.966 17.111 -0.491 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -12.630 17.120 0.139 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.944 14.131 -0.100 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -14.237 15.237 -0.622 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -13.600 14.017 -1.750 1.00 0.00 H new ATOM 894 N SER A 62 -13.512 16.274 -4.959 1.00 0.00 N ATOM 895 CA SER A 62 -13.959 15.441 -6.080 1.00 0.00 C ATOM 896 C SER A 62 -12.892 14.585 -6.811 1.00 0.00 C ATOM 897 O SER A 62 -13.260 13.576 -7.418 1.00 0.00 O ATOM 898 CB SER A 62 -14.789 16.305 -7.032 1.00 0.00 C ATOM 899 OG SER A 62 -14.418 17.669 -6.995 1.00 0.00 O ATOM 0 H SER A 62 -13.781 17.254 -5.040 1.00 0.00 H new ATOM 0 HA SER A 62 -14.569 14.655 -5.635 1.00 0.00 H new ATOM 0 HB2 SER A 62 -14.676 15.929 -8.049 1.00 0.00 H new ATOM 0 HB3 SER A 62 -15.844 16.213 -6.774 1.00 0.00 H new ATOM 0 HG SER A 62 -14.976 18.177 -7.621 1.00 0.00 H new ATOM 905 N ALA A 63 -11.596 14.927 -6.752 1.00 0.00 N ATOM 906 CA ALA A 63 -10.447 14.041 -6.969 1.00 0.00 C ATOM 907 C ALA A 63 -9.177 14.746 -6.480 1.00 0.00 C ATOM 908 O ALA A 63 -9.267 15.849 -5.940 1.00 0.00 O ATOM 909 CB ALA A 63 -10.285 13.632 -8.430 1.00 0.00 C ATOM 0 H ALA A 63 -11.308 15.882 -6.540 1.00 0.00 H new ATOM 0 HA ALA A 63 -10.621 13.125 -6.404 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -9.420 12.977 -8.531 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -11.180 13.105 -8.762 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -10.140 14.522 -9.043 1.00 0.00 H new ATOM 915 N VAL A 64 -8.000 14.117 -6.622 1.00 0.00 N ATOM 916 CA VAL A 64 -6.821 14.421 -5.804 1.00 0.00 C ATOM 917 C VAL A 64 -5.577 13.869 -6.528 1.00 0.00 C ATOM 918 O VAL A 64 -5.730 13.138 -7.506 1.00 0.00 O ATOM 919 CB VAL A 64 -7.096 13.807 -4.402 1.00 0.00 C ATOM 920 CG1 VAL A 64 -7.810 12.439 -4.497 1.00 0.00 C ATOM 921 CG2 VAL A 64 -5.907 13.744 -3.431 1.00 0.00 C ATOM 0 H VAL A 64 -7.841 13.381 -7.310 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.629 15.485 -5.665 1.00 0.00 H new ATOM 0 HB VAL A 64 -7.767 14.536 -3.948 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -7.982 12.048 -3.494 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -8.765 12.562 -5.007 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -7.187 11.741 -5.057 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -6.229 13.296 -2.491 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -5.112 13.139 -3.868 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.536 14.752 -3.245 1.00 0.00 H new ATOM 931 N LYS A 65 -4.354 14.158 -6.062 1.00 0.00 N ATOM 932 CA LYS A 65 -3.101 13.571 -6.567 1.00 0.00 C ATOM 933 C LYS A 65 -2.447 12.780 -5.453 1.00 0.00 C ATOM 934 O LYS A 65 -2.052 13.353 -4.441 1.00 0.00 O ATOM 935 CB LYS A 65 -2.161 14.685 -7.058 1.00 0.00 C ATOM 936 CG LYS A 65 -2.737 15.547 -8.189 1.00 0.00 C ATOM 937 CD LYS A 65 -3.096 14.746 -9.449 1.00 0.00 C ATOM 938 CE LYS A 65 -3.669 15.637 -10.555 1.00 0.00 C ATOM 939 NZ LYS A 65 -2.712 16.661 -11.017 1.00 0.00 N ATOM 0 H LYS A 65 -4.203 14.823 -5.304 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.313 12.908 -7.405 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.912 15.331 -6.216 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.230 14.233 -7.400 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -3.629 16.058 -7.827 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.013 16.318 -8.452 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.207 14.236 -9.819 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -3.822 13.975 -9.193 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -3.965 15.015 -11.400 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -4.571 16.128 -10.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -3.083 17.122 -11.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -2.578 17.373 -10.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.800 16.211 -11.234 1.00 0.00 H new ATOM 953 N VAL A 66 -2.358 11.465 -5.624 1.00 0.00 N ATOM 954 CA VAL A 66 -1.542 10.629 -4.766 1.00 0.00 C ATOM 955 C VAL A 66 -0.102 10.785 -5.262 1.00 0.00 C ATOM 956 O VAL A 66 0.125 10.944 -6.466 1.00 0.00 O ATOM 957 CB VAL A 66 -2.077 9.174 -4.767 1.00 0.00 C ATOM 958 CG1 VAL A 66 -2.176 8.532 -6.158 1.00 0.00 C ATOM 959 CG2 VAL A 66 -1.277 8.266 -3.827 1.00 0.00 C ATOM 0 H VAL A 66 -2.849 10.956 -6.359 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.579 10.926 -3.718 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.098 9.266 -4.396 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.559 7.516 -6.063 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.851 9.118 -6.782 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.188 8.506 -6.618 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.687 7.257 -3.860 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.234 8.244 -4.143 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.340 8.650 -2.809 1.00 0.00 H new ATOM 969 N GLY A 67 0.848 10.750 -4.335 1.00 0.00 N ATOM 970 CA GLY A 67 2.276 10.634 -4.558 1.00 0.00 C ATOM 971 C GLY A 67 2.795 9.635 -3.534 1.00 0.00 C ATOM 972 O GLY A 67 2.947 9.984 -2.361 1.00 0.00 O ATOM 0 H GLY A 67 0.621 10.806 -3.342 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.484 10.293 -5.572 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.767 11.600 -4.440 1.00 0.00 H new ATOM 976 N PHE A 68 2.945 8.374 -3.940 1.00 0.00 N ATOM 977 CA PHE A 68 3.573 7.312 -3.164 1.00 0.00 C ATOM 978 C PHE A 68 5.072 7.449 -3.354 1.00 0.00 C ATOM 979 O PHE A 68 5.537 7.153 -4.442 1.00 0.00 O ATOM 980 CB PHE A 68 3.118 5.941 -3.683 1.00 0.00 C ATOM 981 CG PHE A 68 1.870 5.423 -3.011 1.00 0.00 C ATOM 982 CD1 PHE A 68 1.974 4.949 -1.694 1.00 0.00 C ATOM 983 CD2 PHE A 68 0.629 5.394 -3.672 1.00 0.00 C ATOM 984 CE1 PHE A 68 0.847 4.459 -1.023 1.00 0.00 C ATOM 985 CE2 PHE A 68 -0.510 4.923 -2.993 1.00 0.00 C ATOM 986 CZ PHE A 68 -0.402 4.475 -1.664 1.00 0.00 C ATOM 0 H PHE A 68 2.619 8.056 -4.853 1.00 0.00 H new ATOM 0 HA PHE A 68 3.298 7.390 -2.112 1.00 0.00 H new ATOM 0 HB2 PHE A 68 2.941 6.009 -4.756 1.00 0.00 H new ATOM 0 HB3 PHE A 68 3.924 5.221 -3.538 1.00 0.00 H new ATOM 0 HD1 PHE A 68 2.931 4.962 -1.194 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.551 5.731 -4.695 1.00 0.00 H new ATOM 0 HE1 PHE A 68 0.938 4.071 -0.019 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -1.467 4.905 -3.492 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.283 4.142 -1.135 1.00 0.00 H new ATOM 996 N THR A 69 5.828 7.898 -2.353 1.00 0.00 N ATOM 997 CA THR A 69 7.251 8.180 -2.532 1.00 0.00 C ATOM 998 C THR A 69 8.038 7.589 -1.361 1.00 0.00 C ATOM 999 O THR A 69 7.633 7.755 -0.208 1.00 0.00 O ATOM 1000 CB THR A 69 7.446 9.697 -2.707 1.00 0.00 C ATOM 1001 OG1 THR A 69 6.759 10.455 -1.711 1.00 0.00 O ATOM 1002 CG2 THR A 69 6.967 10.184 -4.085 1.00 0.00 C ATOM 0 H THR A 69 5.479 8.074 -1.411 1.00 0.00 H new ATOM 0 HA THR A 69 7.638 7.707 -3.434 1.00 0.00 H new ATOM 0 HB THR A 69 8.519 9.858 -2.608 1.00 0.00 H new ATOM 0 HG1 THR A 69 6.373 9.847 -1.046 1.00 0.00 H new ATOM 0 HG21 THR A 69 7.123 11.260 -4.165 1.00 0.00 H new ATOM 0 HG22 THR A 69 7.532 9.676 -4.867 1.00 0.00 H new ATOM 0 HG23 THR A 69 5.906 9.962 -4.201 1.00 0.00 H new ATOM 1010 N GLY A 70 9.120 6.866 -1.644 1.00 0.00 N ATOM 1011 CA GLY A 70 9.970 6.208 -0.666 1.00 0.00 C ATOM 1012 C GLY A 70 11.275 5.809 -1.342 1.00 0.00 C ATOM 1013 O GLY A 70 11.440 6.045 -2.545 1.00 0.00 O ATOM 0 H GLY A 70 9.438 6.719 -2.602 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.168 6.876 0.173 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.470 5.328 -0.262 1.00 0.00 H new ATOM 1017 N VAL A 71 12.188 5.226 -0.566 1.00 0.00 N ATOM 1018 CA VAL A 71 13.543 4.987 -1.026 1.00 0.00 C ATOM 1019 C VAL A 71 13.566 3.879 -2.093 1.00 0.00 C ATOM 1020 O VAL A 71 13.024 2.781 -1.924 1.00 0.00 O ATOM 1021 CB VAL A 71 14.510 4.734 0.150 1.00 0.00 C ATOM 1022 CG1 VAL A 71 14.319 5.697 1.330 1.00 0.00 C ATOM 1023 CG2 VAL A 71 14.454 3.297 0.660 1.00 0.00 C ATOM 0 H VAL A 71 12.006 4.912 0.387 1.00 0.00 H new ATOM 0 HA VAL A 71 13.911 5.891 -1.511 1.00 0.00 H new ATOM 0 HB VAL A 71 15.495 4.922 -0.277 1.00 0.00 H new ATOM 0 HG11 VAL A 71 15.034 5.456 2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 71 14.481 6.721 0.994 1.00 0.00 H new ATOM 0 HG13 VAL A 71 13.306 5.599 1.719 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.154 3.177 1.487 1.00 0.00 H new ATOM 0 HG22 VAL A 71 13.444 3.072 1.004 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.723 2.614 -0.146 1.00 0.00 H new ATOM 1033 N ALA A 72 14.213 4.182 -3.206 1.00 0.00 N ATOM 1034 CA ALA A 72 14.397 3.313 -4.349 1.00 0.00 C ATOM 1035 C ALA A 72 15.513 2.283 -4.189 1.00 0.00 C ATOM 1036 O ALA A 72 16.621 2.617 -3.761 1.00 0.00 O ATOM 1037 CB ALA A 72 14.738 4.232 -5.500 1.00 0.00 C ATOM 0 H ALA A 72 14.648 5.095 -3.340 1.00 0.00 H new ATOM 0 HA ALA A 72 13.489 2.728 -4.495 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.892 3.642 -6.403 1.00 0.00 H new ATOM 0 HB2 ALA A 72 13.920 4.934 -5.660 1.00 0.00 H new ATOM 0 HB3 ALA A 72 15.649 4.784 -5.268 1.00 0.00 H new ATOM 1043 N ASP A 73 15.256 1.051 -4.631 1.00 0.00 N ATOM 1044 CA ASP A 73 16.232 -0.037 -4.658 1.00 0.00 C ATOM 1045 C ASP A 73 17.103 -0.041 -5.931 1.00 0.00 C ATOM 1046 O ASP A 73 16.671 0.287 -7.035 1.00 0.00 O ATOM 1047 CB ASP A 73 15.483 -1.370 -4.532 1.00 0.00 C ATOM 1048 CG ASP A 73 16.394 -2.554 -4.838 1.00 0.00 C ATOM 1049 OD1 ASP A 73 17.397 -2.784 -4.133 1.00 0.00 O ATOM 1050 OD2 ASP A 73 16.146 -3.244 -5.850 1.00 0.00 O ATOM 0 H ASP A 73 14.341 0.777 -4.989 1.00 0.00 H new ATOM 0 HA ASP A 73 16.915 0.110 -3.821 1.00 0.00 H new ATOM 0 HB2 ASP A 73 15.082 -1.469 -3.523 1.00 0.00 H new ATOM 0 HB3 ASP A 73 14.633 -1.377 -5.215 1.00 0.00 H new ATOM 1055 N SER A 74 18.336 -0.512 -5.793 1.00 0.00 N ATOM 1056 CA SER A 74 19.353 -0.663 -6.827 1.00 0.00 C ATOM 1057 C SER A 74 19.027 -1.630 -7.967 1.00 0.00 C ATOM 1058 O SER A 74 19.723 -1.597 -8.979 1.00 0.00 O ATOM 1059 CB SER A 74 20.617 -1.205 -6.165 1.00 0.00 C ATOM 1060 OG SER A 74 21.061 -0.369 -5.120 1.00 0.00 O ATOM 0 H SER A 74 18.678 -0.823 -4.884 1.00 0.00 H new ATOM 0 HA SER A 74 19.445 0.327 -7.273 1.00 0.00 H new ATOM 0 HB2 SER A 74 20.423 -2.204 -5.774 1.00 0.00 H new ATOM 0 HB3 SER A 74 21.405 -1.303 -6.912 1.00 0.00 H new ATOM 0 HG SER A 74 21.871 -0.749 -4.719 1.00 0.00 H new ATOM 1066 N HIS A 75 18.047 -2.523 -7.833 1.00 0.00 N ATOM 1067 CA HIS A 75 17.763 -3.553 -8.835 1.00 0.00 C ATOM 1068 C HIS A 75 16.477 -3.251 -9.573 1.00 0.00 C ATOM 1069 O HIS A 75 16.317 -3.659 -10.724 1.00 0.00 O ATOM 1070 CB HIS A 75 17.644 -4.920 -8.161 1.00 0.00 C ATOM 1071 CG HIS A 75 18.651 -5.182 -7.075 1.00 0.00 C ATOM 1072 ND1 HIS A 75 18.426 -4.975 -5.727 1.00 0.00 N ATOM 1073 CD2 HIS A 75 19.942 -5.594 -7.244 1.00 0.00 C ATOM 1074 CE1 HIS A 75 19.557 -5.294 -5.079 1.00 0.00 C ATOM 1075 NE2 HIS A 75 20.495 -5.659 -5.979 1.00 0.00 N ATOM 0 H HIS A 75 17.425 -2.554 -7.025 1.00 0.00 H new ATOM 0 HA HIS A 75 18.586 -3.563 -9.550 1.00 0.00 H new ATOM 0 HB2 HIS A 75 16.644 -5.015 -7.739 1.00 0.00 H new ATOM 0 HB3 HIS A 75 17.743 -5.694 -8.922 1.00 0.00 H new ATOM 0 HD1 HIS A 75 17.560 -4.641 -5.303 1.00 0.00 H new ATOM 0 HD2 HIS A 75 20.432 -5.823 -8.179 1.00 0.00 H new ATOM 0 HE1 HIS A 75 19.695 -5.264 -4.008 1.00 0.00 H new ATOM 1084 N ASN A 76 15.539 -2.581 -8.913 1.00 0.00 N ATOM 1085 CA ASN A 76 14.345 -2.082 -9.552 1.00 0.00 C ATOM 1086 C ASN A 76 13.928 -0.861 -8.761 1.00 0.00 C ATOM 1087 O ASN A 76 13.327 -0.990 -7.702 1.00 0.00 O ATOM 1088 CB ASN A 76 13.271 -3.185 -9.631 1.00 0.00 C ATOM 1089 CG ASN A 76 12.787 -3.333 -11.061 1.00 0.00 C ATOM 1090 OD1 ASN A 76 11.657 -2.990 -11.400 1.00 0.00 O ATOM 1091 ND2 ASN A 76 13.670 -3.807 -11.924 1.00 0.00 N ATOM 0 H ASN A 76 15.593 -2.372 -7.916 1.00 0.00 H new ATOM 0 HA ASN A 76 14.510 -1.793 -10.590 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.682 -4.131 -9.277 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.434 -2.937 -8.978 1.00 0.00 H new ATOM 0 HD21 ASN A 76 13.422 -3.898 -12.909 1.00 0.00 H new ATOM 0 HD22 ASN A 76 14.599 -4.081 -11.604 1.00 0.00 H new ATOM 1098 N ALA A 77 14.307 0.329 -9.218 1.00 0.00 N ATOM 1099 CA ALA A 77 14.173 1.554 -8.437 1.00 0.00 C ATOM 1100 C ALA A 77 12.706 1.933 -8.183 1.00 0.00 C ATOM 1101 O ALA A 77 12.437 2.779 -7.332 1.00 0.00 O ATOM 1102 CB ALA A 77 14.921 2.680 -9.156 1.00 0.00 C ATOM 0 H ALA A 77 14.716 0.471 -10.141 1.00 0.00 H new ATOM 0 HA ALA A 77 14.612 1.387 -7.453 1.00 0.00 H new ATOM 0 HB1 ALA A 77 14.829 3.602 -8.582 1.00 0.00 H new ATOM 0 HB2 ALA A 77 15.974 2.415 -9.250 1.00 0.00 H new ATOM 0 HB3 ALA A 77 14.493 2.825 -10.148 1.00 0.00 H new ATOM 1108 N ASN A 78 11.744 1.311 -8.872 1.00 0.00 N ATOM 1109 CA ASN A 78 10.315 1.446 -8.580 1.00 0.00 C ATOM 1110 C ASN A 78 9.897 0.674 -7.325 1.00 0.00 C ATOM 1111 O ASN A 78 8.814 0.920 -6.800 1.00 0.00 O ATOM 1112 CB ASN A 78 9.484 0.907 -9.752 1.00 0.00 C ATOM 1113 CG ASN A 78 9.588 1.752 -11.009 1.00 0.00 C ATOM 1114 OD1 ASN A 78 9.397 1.138 -12.162 1.00 0.00 O flip ATOM 1115 ND2 ASN A 78 9.817 2.960 -10.957 1.00 0.00 N flip ATOM 0 H ASN A 78 11.940 0.692 -9.658 1.00 0.00 H new ATOM 0 HA ASN A 78 10.134 2.509 -8.419 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.807 -0.109 -9.979 1.00 0.00 H new ATOM 0 HB3 ASN A 78 8.439 0.848 -9.449 1.00 0.00 H new ATOM 0 HD21 ASN A 78 9.961 3.413 -10.055 1.00 0.00 H new ATOM 0 HD22 ASN A 78 9.862 3.508 -11.816 1.00 0.00 H new ATOM 1122 N LEU A 79 10.706 -0.289 -6.877 1.00 0.00 N ATOM 1123 CA LEU A 79 10.411 -1.158 -5.747 1.00 0.00 C ATOM 1124 C LEU A 79 10.984 -0.500 -4.502 1.00 0.00 C ATOM 1125 O LEU A 79 12.131 -0.036 -4.506 1.00 0.00 O ATOM 1126 CB LEU A 79 10.966 -2.575 -5.979 1.00 0.00 C ATOM 1127 CG LEU A 79 10.073 -3.470 -6.861 1.00 0.00 C ATOM 1128 CD1 LEU A 79 8.801 -3.884 -6.127 1.00 0.00 C ATOM 1129 CD2 LEU A 79 9.611 -2.867 -8.191 1.00 0.00 C ATOM 0 H LEU A 79 11.610 -0.487 -7.307 1.00 0.00 H new ATOM 0 HA LEU A 79 9.335 -1.283 -5.623 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.950 -2.496 -6.441 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.106 -3.060 -5.013 1.00 0.00 H new ATOM 0 HG LEU A 79 10.735 -4.307 -7.081 1.00 0.00 H new ATOM 0 HD11 LEU A 79 8.194 -4.514 -6.777 1.00 0.00 H new ATOM 0 HD12 LEU A 79 9.065 -4.439 -5.227 1.00 0.00 H new ATOM 0 HD13 LEU A 79 8.234 -2.995 -5.852 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.991 -3.589 -8.722 1.00 0.00 H new ATOM 0 HD22 LEU A 79 9.033 -1.963 -7.999 1.00 0.00 H new ATOM 0 HD23 LEU A 79 10.481 -2.619 -8.800 1.00 0.00 H new ATOM 1141 N LEU A 80 10.160 -0.391 -3.465 1.00 0.00 N ATOM 1142 CA LEU A 80 10.501 0.247 -2.204 1.00 0.00 C ATOM 1143 C LEU A 80 11.553 -0.603 -1.499 1.00 0.00 C ATOM 1144 O LEU A 80 11.284 -1.757 -1.148 1.00 0.00 O ATOM 1145 CB LEU A 80 9.214 0.411 -1.378 1.00 0.00 C ATOM 1146 CG LEU A 80 9.423 0.828 0.091 1.00 0.00 C ATOM 1147 CD1 LEU A 80 10.275 2.087 0.269 1.00 0.00 C ATOM 1148 CD2 LEU A 80 8.052 1.095 0.720 1.00 0.00 C ATOM 0 H LEU A 80 9.208 -0.756 -3.482 1.00 0.00 H new ATOM 0 HA LEU A 80 10.927 1.240 -2.351 1.00 0.00 H new ATOM 0 HB2 LEU A 80 8.583 1.155 -1.863 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.667 -0.532 -1.397 1.00 0.00 H new ATOM 0 HG LEU A 80 9.958 0.009 0.572 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.374 2.312 1.331 1.00 0.00 H new ATOM 0 HD12 LEU A 80 11.263 1.921 -0.160 1.00 0.00 H new ATOM 0 HD13 LEU A 80 9.796 2.925 -0.237 1.00 0.00 H new ATOM 0 HD21 LEU A 80 8.181 1.392 1.761 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.551 1.894 0.174 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.448 0.189 0.673 1.00 0.00 H new ATOM 1160 N ALA A 81 12.756 -0.065 -1.301 1.00 0.00 N ATOM 1161 CA ALA A 81 13.743 -0.752 -0.483 1.00 0.00 C ATOM 1162 C ALA A 81 13.313 -0.669 0.977 1.00 0.00 C ATOM 1163 O ALA A 81 12.699 0.293 1.437 1.00 0.00 O ATOM 1164 CB ALA A 81 15.161 -0.207 -0.692 1.00 0.00 C ATOM 0 H ALA A 81 13.063 0.827 -1.689 1.00 0.00 H new ATOM 0 HA ALA A 81 13.786 -1.797 -0.790 1.00 0.00 H new ATOM 0 HB1 ALA A 81 15.858 -0.754 -0.058 1.00 0.00 H new ATOM 0 HB2 ALA A 81 15.448 -0.329 -1.737 1.00 0.00 H new ATOM 0 HB3 ALA A 81 15.186 0.851 -0.430 1.00 0.00 H new ATOM 1170 N LEU A 82 13.654 -1.722 1.699 1.00 0.00 N ATOM 1171 CA LEU A 82 13.583 -1.841 3.145 1.00 0.00 C ATOM 1172 C LEU A 82 14.762 -1.092 3.761 1.00 0.00 C ATOM 1173 O LEU A 82 15.618 -0.575 3.049 1.00 0.00 O ATOM 1174 CB LEU A 82 13.483 -3.327 3.572 1.00 0.00 C ATOM 1175 CG LEU A 82 13.908 -4.379 2.538 1.00 0.00 C ATOM 1176 CD1 LEU A 82 15.426 -4.333 2.304 1.00 0.00 C ATOM 1177 CD2 LEU A 82 13.446 -5.777 2.959 1.00 0.00 C ATOM 0 H LEU A 82 14.011 -2.572 1.262 1.00 0.00 H new ATOM 0 HA LEU A 82 12.673 -1.376 3.525 1.00 0.00 H new ATOM 0 HB2 LEU A 82 14.092 -3.465 4.465 1.00 0.00 H new ATOM 0 HB3 LEU A 82 12.450 -3.529 3.856 1.00 0.00 H new ATOM 0 HG LEU A 82 13.421 -4.144 1.591 1.00 0.00 H new ATOM 0 HD11 LEU A 82 15.704 -5.087 1.568 1.00 0.00 H new ATOM 0 HD12 LEU A 82 15.708 -3.346 1.937 1.00 0.00 H new ATOM 0 HD13 LEU A 82 15.945 -4.533 3.241 1.00 0.00 H new ATOM 0 HD21 LEU A 82 13.759 -6.505 2.210 1.00 0.00 H new ATOM 0 HD22 LEU A 82 13.890 -6.033 3.921 1.00 0.00 H new ATOM 0 HD23 LEU A 82 12.360 -5.790 3.046 1.00 0.00 H new ATOM 1189 N GLU A 83 14.809 -1.055 5.092 1.00 0.00 N ATOM 1190 CA GLU A 83 15.689 -0.218 5.899 1.00 0.00 C ATOM 1191 C GLU A 83 17.193 -0.466 5.678 1.00 0.00 C ATOM 1192 O GLU A 83 18.013 0.268 6.229 1.00 0.00 O ATOM 1193 CB GLU A 83 15.312 -0.382 7.379 1.00 0.00 C ATOM 1194 CG GLU A 83 15.518 -1.817 7.899 1.00 0.00 C ATOM 1195 CD GLU A 83 15.448 -1.937 9.428 1.00 0.00 C ATOM 1196 OE1 GLU A 83 15.690 -0.946 10.156 1.00 0.00 O ATOM 1197 OE2 GLU A 83 15.141 -3.043 9.923 1.00 0.00 O ATOM 0 H GLU A 83 14.201 -1.640 5.665 1.00 0.00 H new ATOM 0 HA GLU A 83 15.533 0.810 5.573 1.00 0.00 H new ATOM 0 HB2 GLU A 83 15.910 0.305 7.978 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.268 -0.099 7.516 1.00 0.00 H new ATOM 0 HG2 GLU A 83 14.761 -2.466 7.458 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.488 -2.181 7.559 1.00 0.00 H new ATOM 1204 N ASN A 84 17.555 -1.462 4.860 1.00 0.00 N ATOM 1205 CA ASN A 84 18.905 -1.737 4.378 1.00 0.00 C ATOM 1206 C ASN A 84 19.870 -1.918 5.555 1.00 0.00 C ATOM 1207 O ASN A 84 20.876 -1.220 5.680 1.00 0.00 O ATOM 1208 CB ASN A 84 19.313 -0.651 3.369 1.00 0.00 C ATOM 1209 CG ASN A 84 20.511 -1.059 2.529 1.00 0.00 C ATOM 1210 OD1 ASN A 84 21.653 -0.736 2.849 1.00 0.00 O ATOM 1211 ND2 ASN A 84 20.286 -1.749 1.422 1.00 0.00 N ATOM 0 H ASN A 84 16.874 -2.131 4.500 1.00 0.00 H new ATOM 0 HA ASN A 84 18.942 -2.684 3.839 1.00 0.00 H new ATOM 0 HB2 ASN A 84 18.470 -0.434 2.713 1.00 0.00 H new ATOM 0 HB3 ASN A 84 19.545 0.269 3.905 1.00 0.00 H new ATOM 0 HD21 ASN A 84 21.066 -2.019 0.822 1.00 0.00 H new ATOM 0 HD22 ASN A 84 19.333 -2.010 1.169 1.00 0.00 H new ATOM 1218 N THR A 85 19.532 -2.857 6.440 1.00 0.00 N ATOM 1219 CA THR A 85 20.292 -3.185 7.638 1.00 0.00 C ATOM 1220 C THR A 85 20.644 -4.675 7.600 1.00 0.00 C ATOM 1221 O THR A 85 20.074 -5.433 6.807 1.00 0.00 O ATOM 1222 CB THR A 85 19.469 -2.758 8.874 1.00 0.00 C ATOM 1223 OG1 THR A 85 20.283 -2.562 10.008 1.00 0.00 O ATOM 1224 CG2 THR A 85 18.415 -3.773 9.309 1.00 0.00 C ATOM 0 H THR A 85 18.693 -3.427 6.335 1.00 0.00 H new ATOM 0 HA THR A 85 21.237 -2.645 7.693 1.00 0.00 H new ATOM 0 HB THR A 85 18.988 -1.838 8.542 1.00 0.00 H new ATOM 0 HG1 THR A 85 19.726 -2.291 10.768 1.00 0.00 H new ATOM 0 HG21 THR A 85 17.884 -3.394 10.182 1.00 0.00 H new ATOM 0 HG22 THR A 85 17.707 -3.934 8.496 1.00 0.00 H new ATOM 0 HG23 THR A 85 18.900 -4.716 9.560 1.00 0.00 H new ATOM 1232 N VAL A 86 21.519 -5.118 8.499 1.00 0.00 N ATOM 1233 CA VAL A 86 21.951 -6.509 8.628 1.00 0.00 C ATOM 1234 C VAL A 86 20.755 -7.448 8.803 1.00 0.00 C ATOM 1235 O VAL A 86 20.685 -8.497 8.166 1.00 0.00 O ATOM 1236 CB VAL A 86 22.947 -6.645 9.801 1.00 0.00 C ATOM 1237 CG1 VAL A 86 24.193 -5.783 9.579 1.00 0.00 C ATOM 1238 CG2 VAL A 86 22.330 -6.242 11.149 1.00 0.00 C ATOM 0 H VAL A 86 21.961 -4.500 9.180 1.00 0.00 H new ATOM 0 HA VAL A 86 22.457 -6.802 7.708 1.00 0.00 H new ATOM 0 HB VAL A 86 23.216 -7.701 9.832 1.00 0.00 H new ATOM 0 HG11 VAL A 86 24.873 -5.902 10.423 1.00 0.00 H new ATOM 0 HG12 VAL A 86 24.693 -6.096 8.663 1.00 0.00 H new ATOM 0 HG13 VAL A 86 23.901 -4.736 9.493 1.00 0.00 H new ATOM 0 HG21 VAL A 86 23.073 -6.357 11.938 1.00 0.00 H new ATOM 0 HG22 VAL A 86 22.006 -5.202 11.104 1.00 0.00 H new ATOM 0 HG23 VAL A 86 21.473 -6.881 11.362 1.00 0.00 H new ATOM 1248 N SER A 87 19.811 -7.077 9.669 1.00 0.00 N ATOM 1249 CA SER A 87 18.698 -7.918 10.067 1.00 0.00 C ATOM 1250 C SER A 87 17.506 -7.802 9.108 1.00 0.00 C ATOM 1251 O SER A 87 16.501 -8.494 9.291 1.00 0.00 O ATOM 1252 CB SER A 87 18.344 -7.588 11.523 1.00 0.00 C ATOM 1253 OG SER A 87 17.952 -6.240 11.704 1.00 0.00 O ATOM 0 H SER A 87 19.805 -6.162 10.119 1.00 0.00 H new ATOM 0 HA SER A 87 18.988 -8.967 10.007 1.00 0.00 H new ATOM 0 HB2 SER A 87 17.537 -8.243 11.853 1.00 0.00 H new ATOM 0 HB3 SER A 87 19.205 -7.799 12.157 1.00 0.00 H new ATOM 0 HG SER A 87 17.091 -6.210 12.172 1.00 0.00 H new ATOM 1259 N ALA A 88 17.578 -6.931 8.092 1.00 0.00 N ATOM 1260 CA ALA A 88 16.635 -6.912 6.984 1.00 0.00 C ATOM 1261 C ALA A 88 17.172 -7.811 5.873 1.00 0.00 C ATOM 1262 O ALA A 88 18.375 -8.069 5.794 1.00 0.00 O ATOM 1263 CB ALA A 88 16.430 -5.479 6.482 1.00 0.00 C ATOM 0 H ALA A 88 18.302 -6.216 8.023 1.00 0.00 H new ATOM 0 HA ALA A 88 15.665 -7.285 7.313 1.00 0.00 H new ATOM 0 HB1 ALA A 88 15.722 -5.482 5.653 1.00 0.00 H new ATOM 0 HB2 ALA A 88 16.039 -4.862 7.291 1.00 0.00 H new ATOM 0 HB3 ALA A 88 17.383 -5.072 6.144 1.00 0.00 H new ATOM 1269 N ALA A 89 16.283 -8.299 5.009 1.00 0.00 N ATOM 1270 CA ALA A 89 16.701 -9.149 3.907 1.00 0.00 C ATOM 1271 C ALA A 89 17.568 -8.362 2.911 1.00 0.00 C ATOM 1272 O ALA A 89 17.598 -7.124 2.915 1.00 0.00 O ATOM 1273 CB ALA A 89 15.479 -9.794 3.237 1.00 0.00 C ATOM 0 H ALA A 89 15.280 -8.120 5.053 1.00 0.00 H new ATOM 0 HA ALA A 89 17.321 -9.957 4.296 1.00 0.00 H new ATOM 0 HB1 ALA A 89 15.808 -10.428 2.413 1.00 0.00 H new ATOM 0 HB2 ALA A 89 14.940 -10.398 3.967 1.00 0.00 H new ATOM 0 HB3 ALA A 89 14.820 -9.015 2.854 1.00 0.00 H new ATOM 1279 N SER A 90 18.213 -9.105 2.017 1.00 0.00 N ATOM 1280 CA SER A 90 18.755 -8.612 0.762 1.00 0.00 C ATOM 1281 C SER A 90 17.864 -9.120 -0.374 1.00 0.00 C ATOM 1282 O SER A 90 17.212 -10.157 -0.233 1.00 0.00 O ATOM 1283 CB SER A 90 20.180 -9.143 0.593 1.00 0.00 C ATOM 1284 OG SER A 90 21.123 -8.297 1.227 1.00 0.00 O ATOM 0 H SER A 90 18.377 -10.102 2.155 1.00 0.00 H new ATOM 0 HA SER A 90 18.780 -7.522 0.750 1.00 0.00 H new ATOM 0 HB2 SER A 90 20.249 -10.147 1.013 1.00 0.00 H new ATOM 0 HB3 SER A 90 20.417 -9.224 -0.468 1.00 0.00 H new ATOM 0 HG SER A 90 22.024 -8.662 1.104 1.00 0.00 H new ATOM 1290 N GLY A 91 17.910 -8.438 -1.518 1.00 0.00 N ATOM 1291 CA GLY A 91 17.335 -8.879 -2.784 1.00 0.00 C ATOM 1292 C GLY A 91 15.810 -8.909 -2.815 1.00 0.00 C ATOM 1293 O GLY A 91 15.250 -9.462 -3.762 1.00 0.00 O ATOM 0 H GLY A 91 18.367 -7.529 -1.589 1.00 0.00 H new ATOM 0 HA2 GLY A 91 17.688 -8.220 -3.577 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.709 -9.878 -3.009 1.00 0.00 H new ATOM 1297 N LEU A 92 15.142 -8.353 -1.803 1.00 0.00 N ATOM 1298 CA LEU A 92 13.693 -8.298 -1.642 1.00 0.00 C ATOM 1299 C LEU A 92 13.292 -6.841 -1.445 1.00 0.00 C ATOM 1300 O LEU A 92 13.652 -6.240 -0.428 1.00 0.00 O ATOM 1301 CB LEU A 92 13.238 -9.130 -0.424 1.00 0.00 C ATOM 1302 CG LEU A 92 13.627 -10.613 -0.464 1.00 0.00 C ATOM 1303 CD1 LEU A 92 13.137 -11.350 0.786 1.00 0.00 C ATOM 1304 CD2 LEU A 92 13.049 -11.317 -1.686 1.00 0.00 C ATOM 0 H LEU A 92 15.630 -7.903 -1.029 1.00 0.00 H new ATOM 0 HA LEU A 92 13.215 -8.714 -2.529 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.659 -8.685 0.478 1.00 0.00 H new ATOM 0 HB3 LEU A 92 12.154 -9.057 -0.339 1.00 0.00 H new ATOM 0 HG LEU A 92 14.716 -10.640 -0.510 1.00 0.00 H new ATOM 0 HD11 LEU A 92 13.428 -12.399 0.728 1.00 0.00 H new ATOM 0 HD12 LEU A 92 13.582 -10.899 1.673 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.051 -11.278 0.849 1.00 0.00 H new ATOM 0 HD21 LEU A 92 13.348 -12.365 -1.677 1.00 0.00 H new ATOM 0 HD22 LEU A 92 11.961 -11.249 -1.664 1.00 0.00 H new ATOM 0 HD23 LEU A 92 13.424 -10.841 -2.592 1.00 0.00 H new ATOM 1316 N GLY A 93 12.546 -6.275 -2.387 1.00 0.00 N ATOM 1317 CA GLY A 93 11.921 -4.977 -2.213 1.00 0.00 C ATOM 1318 C GLY A 93 10.457 -5.172 -1.851 1.00 0.00 C ATOM 1319 O GLY A 93 9.832 -6.167 -2.221 1.00 0.00 O ATOM 0 H GLY A 93 12.360 -6.707 -3.292 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.430 -4.417 -1.429 1.00 0.00 H new ATOM 0 HA3 GLY A 93 12.007 -4.393 -3.129 1.00 0.00 H new ATOM 1323 N ILE A 94 9.894 -4.210 -1.137 1.00 0.00 N ATOM 1324 CA ILE A 94 8.461 -4.059 -0.973 1.00 0.00 C ATOM 1325 C ILE A 94 7.885 -3.683 -2.348 1.00 0.00 C ATOM 1326 O ILE A 94 8.526 -2.958 -3.107 1.00 0.00 O ATOM 1327 CB ILE A 94 8.237 -2.985 0.109 1.00 0.00 C ATOM 1328 CG1 ILE A 94 8.616 -3.403 1.542 1.00 0.00 C ATOM 1329 CG2 ILE A 94 6.805 -2.470 0.080 1.00 0.00 C ATOM 1330 CD1 ILE A 94 7.587 -4.270 2.271 1.00 0.00 C ATOM 0 H ILE A 94 10.434 -3.498 -0.646 1.00 0.00 H new ATOM 0 HA ILE A 94 7.954 -4.966 -0.643 1.00 0.00 H new ATOM 0 HB ILE A 94 8.932 -2.188 -0.156 1.00 0.00 H new ATOM 0 HG12 ILE A 94 9.561 -3.945 1.505 1.00 0.00 H new ATOM 0 HG13 ILE A 94 8.788 -2.502 2.131 1.00 0.00 H new ATOM 0 HG21 ILE A 94 6.675 -1.713 0.854 1.00 0.00 H new ATOM 0 HG22 ILE A 94 6.596 -2.031 -0.896 1.00 0.00 H new ATOM 0 HG23 ILE A 94 6.117 -3.296 0.261 1.00 0.00 H new ATOM 0 HD11 ILE A 94 7.953 -4.507 3.270 1.00 0.00 H new ATOM 0 HD12 ILE A 94 6.645 -3.728 2.349 1.00 0.00 H new ATOM 0 HD13 ILE A 94 7.429 -5.194 1.714 1.00 0.00 H new ATOM 1342 N GLN A 95 6.673 -4.159 -2.649 1.00 0.00 N ATOM 1343 CA GLN A 95 5.930 -3.903 -3.874 1.00 0.00 C ATOM 1344 C GLN A 95 4.500 -3.538 -3.487 1.00 0.00 C ATOM 1345 O GLN A 95 3.774 -4.388 -2.961 1.00 0.00 O ATOM 1346 CB GLN A 95 5.963 -5.167 -4.771 1.00 0.00 C ATOM 1347 CG GLN A 95 5.306 -4.918 -6.140 1.00 0.00 C ATOM 1348 CD GLN A 95 5.217 -6.205 -6.957 1.00 0.00 C ATOM 1349 OE1 GLN A 95 4.542 -7.147 -6.551 1.00 0.00 O ATOM 1350 NE2 GLN A 95 5.870 -6.288 -8.107 1.00 0.00 N ATOM 0 H GLN A 95 6.162 -4.765 -2.007 1.00 0.00 H new ATOM 0 HA GLN A 95 6.373 -3.082 -4.438 1.00 0.00 H new ATOM 0 HB2 GLN A 95 6.996 -5.482 -4.916 1.00 0.00 H new ATOM 0 HB3 GLN A 95 5.449 -5.984 -4.265 1.00 0.00 H new ATOM 0 HG2 GLN A 95 4.307 -4.506 -5.996 1.00 0.00 H new ATOM 0 HG3 GLN A 95 5.881 -4.174 -6.691 1.00 0.00 H new ATOM 0 HE21 GLN A 95 6.428 -5.499 -8.435 1.00 0.00 H new ATOM 0 HE22 GLN A 95 5.815 -7.140 -8.664 1.00 0.00 H new ATOM 1359 N LEU A 96 4.095 -2.280 -3.693 1.00 0.00 N ATOM 1360 CA LEU A 96 2.746 -1.803 -3.381 1.00 0.00 C ATOM 1361 C LEU A 96 2.067 -1.443 -4.691 1.00 0.00 C ATOM 1362 O LEU A 96 2.717 -0.974 -5.631 1.00 0.00 O ATOM 1363 CB LEU A 96 2.717 -0.580 -2.450 1.00 0.00 C ATOM 1364 CG LEU A 96 3.649 -0.549 -1.226 1.00 0.00 C ATOM 1365 CD1 LEU A 96 3.686 -1.888 -0.511 1.00 0.00 C ATOM 1366 CD2 LEU A 96 5.034 0.007 -1.575 1.00 0.00 C ATOM 0 H LEU A 96 4.701 -1.559 -4.085 1.00 0.00 H new ATOM 0 HA LEU A 96 2.231 -2.603 -2.849 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.940 0.299 -3.055 1.00 0.00 H new ATOM 0 HB3 LEU A 96 1.695 -0.467 -2.088 1.00 0.00 H new ATOM 0 HG LEU A 96 3.229 0.154 -0.506 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.355 -1.824 0.347 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.683 -2.147 -0.171 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.046 -2.656 -1.195 1.00 0.00 H new ATOM 0 HD21 LEU A 96 5.660 0.011 -0.683 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.495 -0.619 -2.339 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.933 1.025 -1.952 1.00 0.00 H new ATOM 1378 N LEU A 97 0.768 -1.705 -4.770 1.00 0.00 N ATOM 1379 CA LEU A 97 0.064 -1.799 -6.033 1.00 0.00 C ATOM 1380 C LEU A 97 -1.306 -1.166 -5.832 1.00 0.00 C ATOM 1381 O LEU A 97 -1.946 -1.354 -4.795 1.00 0.00 O ATOM 1382 CB LEU A 97 -0.087 -3.281 -6.444 1.00 0.00 C ATOM 1383 CG LEU A 97 1.219 -4.122 -6.473 1.00 0.00 C ATOM 1384 CD1 LEU A 97 1.006 -5.495 -5.853 1.00 0.00 C ATOM 1385 CD2 LEU A 97 1.819 -4.281 -7.870 1.00 0.00 C ATOM 0 H LEU A 97 0.175 -1.858 -3.954 1.00 0.00 H new ATOM 0 HA LEU A 97 0.612 -1.286 -6.823 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.786 -3.757 -5.757 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.540 -3.317 -7.435 1.00 0.00 H new ATOM 0 HG LEU A 97 1.936 -3.555 -5.879 1.00 0.00 H new ATOM 0 HD11 LEU A 97 1.938 -6.059 -5.889 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.690 -5.381 -4.816 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.237 -6.030 -6.410 1.00 0.00 H new ATOM 0 HD21 LEU A 97 2.728 -4.880 -7.810 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.100 -4.778 -8.521 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.058 -3.299 -8.277 1.00 0.00 H new ATOM 1397 N ASN A 98 -1.807 -0.518 -6.877 1.00 0.00 N ATOM 1398 CA ASN A 98 -3.206 -0.097 -6.968 1.00 0.00 C ATOM 1399 C ASN A 98 -4.018 -1.340 -7.326 1.00 0.00 C ATOM 1400 O ASN A 98 -3.439 -2.323 -7.792 1.00 0.00 O ATOM 1401 CB ASN A 98 -3.378 1.001 -8.046 1.00 0.00 C ATOM 1402 CG ASN A 98 -2.557 0.807 -9.324 1.00 0.00 C ATOM 1403 OD1 ASN A 98 -2.341 -0.420 -9.774 1.00 0.00 O flip ATOM 1404 ND2 ASN A 98 -2.054 1.764 -9.902 1.00 0.00 N flip ATOM 0 H ASN A 98 -1.251 -0.266 -7.694 1.00 0.00 H new ATOM 0 HA ASN A 98 -3.546 0.329 -6.024 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -4.432 1.057 -8.318 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -3.111 1.962 -7.606 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -2.218 2.711 -9.559 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -1.472 1.614 -10.726 1.00 0.00 H new ATOM 1411 N GLU A 99 -5.337 -1.321 -7.126 1.00 0.00 N ATOM 1412 CA GLU A 99 -6.212 -2.488 -7.303 1.00 0.00 C ATOM 1413 C GLU A 99 -6.143 -3.117 -8.701 1.00 0.00 C ATOM 1414 O GLU A 99 -6.475 -4.289 -8.861 1.00 0.00 O ATOM 1415 CB GLU A 99 -7.665 -2.170 -6.905 1.00 0.00 C ATOM 1416 CG GLU A 99 -8.218 -0.819 -7.390 1.00 0.00 C ATOM 1417 CD GLU A 99 -7.979 -0.568 -8.863 1.00 0.00 C ATOM 1418 OE1 GLU A 99 -8.680 -1.197 -9.679 1.00 0.00 O ATOM 1419 OE2 GLU A 99 -7.048 0.214 -9.152 1.00 0.00 O ATOM 0 H GLU A 99 -5.838 -0.483 -6.832 1.00 0.00 H new ATOM 0 HA GLU A 99 -5.824 -3.245 -6.621 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -8.308 -2.962 -7.290 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -7.738 -2.200 -5.818 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -9.289 -0.780 -7.191 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -7.757 -0.017 -6.813 1.00 0.00 H new ATOM 1426 N GLN A 100 -5.627 -2.383 -9.683 1.00 0.00 N ATOM 1427 CA GLN A 100 -5.275 -2.843 -11.022 1.00 0.00 C ATOM 1428 C GLN A 100 -4.153 -3.891 -11.031 1.00 0.00 C ATOM 1429 O GLN A 100 -3.812 -4.415 -12.091 1.00 0.00 O ATOM 1430 CB GLN A 100 -4.818 -1.671 -11.922 1.00 0.00 C ATOM 1431 CG GLN A 100 -5.326 -0.283 -11.522 1.00 0.00 C ATOM 1432 CD GLN A 100 -4.712 0.877 -12.321 1.00 0.00 C ATOM 1433 OE1 GLN A 100 -4.682 2.020 -11.870 1.00 0.00 O ATOM 1434 NE2 GLN A 100 -4.221 0.639 -13.532 1.00 0.00 N ATOM 0 H GLN A 100 -5.432 -1.390 -9.557 1.00 0.00 H new ATOM 0 HA GLN A 100 -6.188 -3.297 -11.406 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -3.728 -1.649 -11.931 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -5.141 -1.875 -12.943 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -6.409 -0.258 -11.644 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -5.121 -0.126 -10.463 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -4.242 -0.307 -13.914 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -3.823 1.402 -14.080 1.00 0.00 H new ATOM 1443 N GLN A 101 -3.551 -4.131 -9.868 1.00 0.00 N ATOM 1444 CA GLN A 101 -2.452 -5.024 -9.565 1.00 0.00 C ATOM 1445 C GLN A 101 -1.269 -4.770 -10.494 1.00 0.00 C ATOM 1446 O GLN A 101 -0.761 -5.693 -11.130 1.00 0.00 O ATOM 1447 CB GLN A 101 -2.927 -6.488 -9.517 1.00 0.00 C ATOM 1448 CG GLN A 101 -4.314 -6.653 -8.860 1.00 0.00 C ATOM 1449 CD GLN A 101 -4.450 -8.000 -8.136 1.00 0.00 C ATOM 1450 OE1 GLN A 101 -3.577 -8.397 -7.363 1.00 0.00 O ATOM 1451 NE2 GLN A 101 -5.512 -8.759 -8.342 1.00 0.00 N ATOM 0 H GLN A 101 -3.862 -3.646 -9.026 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.080 -4.811 -8.563 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -2.962 -6.886 -10.531 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -2.198 -7.083 -8.967 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -4.478 -5.842 -8.151 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -5.089 -6.571 -9.623 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -6.246 -8.448 -8.978 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -5.598 -9.656 -7.864 1.00 0.00 H new ATOM 1460 N ASN A 102 -0.821 -3.513 -10.586 1.00 0.00 N ATOM 1461 CA ASN A 102 0.386 -3.150 -11.308 1.00 0.00 C ATOM 1462 C ASN A 102 1.301 -2.253 -10.498 1.00 0.00 C ATOM 1463 O ASN A 102 0.860 -1.624 -9.534 1.00 0.00 O ATOM 1464 CB ASN A 102 0.057 -2.503 -12.658 1.00 0.00 C ATOM 1465 CG ASN A 102 0.776 -3.313 -13.713 1.00 0.00 C ATOM 1466 OD1 ASN A 102 1.977 -3.553 -13.623 1.00 0.00 O ATOM 1467 ND2 ASN A 102 0.033 -3.889 -14.628 1.00 0.00 N ATOM 0 H ASN A 102 -1.295 -2.719 -10.156 1.00 0.00 H new ATOM 0 HA ASN A 102 0.924 -4.080 -11.491 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -1.018 -2.503 -12.836 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.383 -1.463 -12.679 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.451 -4.551 -15.282 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.963 -3.675 -14.685 1.00 0.00 H new ATOM 1474 N GLN A 103 2.570 -2.235 -10.909 1.00 0.00 N ATOM 1475 CA GLN A 103 3.691 -1.569 -10.267 1.00 0.00 C ATOM 1476 C GLN A 103 3.471 -0.056 -10.285 1.00 0.00 C ATOM 1477 O GLN A 103 3.752 0.598 -11.292 1.00 0.00 O ATOM 1478 CB GLN A 103 4.975 -1.977 -11.014 1.00 0.00 C ATOM 1479 CG GLN A 103 6.264 -1.315 -10.498 1.00 0.00 C ATOM 1480 CD GLN A 103 7.426 -1.561 -11.460 1.00 0.00 C ATOM 1481 OE1 GLN A 103 8.485 -2.207 -11.017 1.00 0.00 O flip ATOM 1482 NE2 GLN A 103 7.409 -1.136 -12.613 1.00 0.00 N flip ATOM 0 H GLN A 103 2.855 -2.721 -11.759 1.00 0.00 H new ATOM 0 HA GLN A 103 3.782 -1.866 -9.222 1.00 0.00 H new ATOM 0 HB2 GLN A 103 5.088 -3.059 -10.947 1.00 0.00 H new ATOM 0 HB3 GLN A 103 4.856 -1.733 -12.070 1.00 0.00 H new ATOM 0 HG2 GLN A 103 6.105 -0.243 -10.380 1.00 0.00 H new ATOM 0 HG3 GLN A 103 6.512 -1.711 -9.513 1.00 0.00 H new ATOM 0 HE21 GLN A 103 6.591 -0.635 -12.960 1.00 0.00 H new ATOM 0 HE22 GLN A 103 8.213 -1.284 -13.223 1.00 0.00 H new ATOM 1491 N ILE A 104 3.013 0.497 -9.165 1.00 0.00 N ATOM 1492 CA ILE A 104 3.162 1.917 -8.890 1.00 0.00 C ATOM 1493 C ILE A 104 4.668 2.183 -8.718 1.00 0.00 C ATOM 1494 O ILE A 104 5.327 1.421 -8.007 1.00 0.00 O ATOM 1495 CB ILE A 104 2.279 2.284 -7.667 1.00 0.00 C ATOM 1496 CG1 ILE A 104 0.997 2.943 -8.211 1.00 0.00 C ATOM 1497 CG2 ILE A 104 2.923 3.191 -6.604 1.00 0.00 C ATOM 1498 CD1 ILE A 104 -0.121 3.042 -7.169 1.00 0.00 C ATOM 0 H ILE A 104 2.533 -0.024 -8.431 1.00 0.00 H new ATOM 0 HA ILE A 104 2.813 2.561 -9.697 1.00 0.00 H new ATOM 0 HB ILE A 104 2.094 1.353 -7.131 1.00 0.00 H new ATOM 0 HG12 ILE A 104 1.236 3.943 -8.574 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.638 2.371 -9.067 1.00 0.00 H new ATOM 0 HG21 ILE A 104 2.208 3.375 -5.802 1.00 0.00 H new ATOM 0 HG22 ILE A 104 3.808 2.702 -6.196 1.00 0.00 H new ATOM 0 HG23 ILE A 104 3.209 4.139 -7.060 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.995 3.515 -7.617 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -0.386 2.043 -6.824 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.221 3.639 -6.323 1.00 0.00 H new ATOM 1510 N PRO A 105 5.237 3.211 -9.367 1.00 0.00 N ATOM 1511 CA PRO A 105 6.581 3.684 -9.065 1.00 0.00 C ATOM 1512 C PRO A 105 6.564 4.571 -7.814 1.00 0.00 C ATOM 1513 O PRO A 105 5.500 4.982 -7.352 1.00 0.00 O ATOM 1514 CB PRO A 105 6.973 4.460 -10.319 1.00 0.00 C ATOM 1515 CG PRO A 105 5.657 5.115 -10.743 1.00 0.00 C ATOM 1516 CD PRO A 105 4.623 4.045 -10.394 1.00 0.00 C ATOM 0 HA PRO A 105 7.289 2.886 -8.842 1.00 0.00 H new ATOM 0 HB2 PRO A 105 7.744 5.202 -10.110 1.00 0.00 H new ATOM 0 HB3 PRO A 105 7.365 3.802 -11.095 1.00 0.00 H new ATOM 0 HG2 PRO A 105 5.475 6.045 -10.204 1.00 0.00 H new ATOM 0 HG3 PRO A 105 5.648 5.355 -11.806 1.00 0.00 H new ATOM 0 HD2 PRO A 105 3.701 4.498 -10.029 1.00 0.00 H new ATOM 0 HD3 PRO A 105 4.362 3.454 -11.272 1.00 0.00 H new ATOM 1524 N LEU A 106 7.752 4.898 -7.294 1.00 0.00 N ATOM 1525 CA LEU A 106 7.905 5.647 -6.047 1.00 0.00 C ATOM 1526 C LEU A 106 8.376 7.062 -6.329 1.00 0.00 C ATOM 1527 O LEU A 106 7.633 8.029 -6.281 1.00 0.00 O ATOM 1528 CB LEU A 106 8.838 4.881 -5.079 1.00 0.00 C ATOM 1529 CG LEU A 106 8.038 4.296 -3.904 1.00 0.00 C ATOM 1530 CD1 LEU A 106 6.907 3.346 -4.322 1.00 0.00 C ATOM 1531 CD2 LEU A 106 8.982 3.535 -2.984 1.00 0.00 C ATOM 0 H LEU A 106 8.639 4.648 -7.731 1.00 0.00 H new ATOM 0 HA LEU A 106 6.937 5.737 -5.553 1.00 0.00 H new ATOM 0 HB2 LEU A 106 9.347 4.079 -5.614 1.00 0.00 H new ATOM 0 HB3 LEU A 106 9.610 5.552 -4.702 1.00 0.00 H new ATOM 0 HG LEU A 106 7.573 5.147 -3.406 1.00 0.00 H new ATOM 0 HD11 LEU A 106 6.394 2.978 -3.434 1.00 0.00 H new ATOM 0 HD12 LEU A 106 6.199 3.880 -4.956 1.00 0.00 H new ATOM 0 HD13 LEU A 106 7.324 2.504 -4.874 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.419 3.118 -2.149 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.459 2.727 -3.539 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.745 4.214 -2.604 1.00 0.00 H new ATOM 1543 N ASN A 107 9.659 7.163 -6.627 1.00 0.00 N ATOM 1544 CA ASN A 107 10.471 8.328 -6.944 1.00 0.00 C ATOM 1545 C ASN A 107 10.087 8.853 -8.330 1.00 0.00 C ATOM 1546 O ASN A 107 10.917 8.924 -9.240 1.00 0.00 O ATOM 1547 CB ASN A 107 11.959 7.926 -6.829 1.00 0.00 C ATOM 1548 CG ASN A 107 12.235 6.536 -7.395 1.00 0.00 C ATOM 1549 OD1 ASN A 107 11.933 5.515 -6.607 1.00 0.00 O flip ATOM 1550 ND2 ASN A 107 12.629 6.355 -8.544 1.00 0.00 N flip ATOM 0 H ASN A 107 10.231 6.319 -6.656 1.00 0.00 H new ATOM 0 HA ASN A 107 10.296 9.146 -6.245 1.00 0.00 H new ATOM 0 HB2 ASN A 107 12.571 8.657 -7.356 1.00 0.00 H new ATOM 0 HB3 ASN A 107 12.260 7.954 -5.782 1.00 0.00 H new ATOM 0 HD21 ASN A 107 12.857 7.153 -9.137 1.00 0.00 H new ATOM 0 HD22 ASN A 107 12.728 5.406 -8.906 1.00 0.00 H new ATOM 1557 N ALA A 108 8.811 9.203 -8.475 1.00 0.00 N ATOM 1558 CA ALA A 108 8.081 9.463 -9.700 1.00 0.00 C ATOM 1559 C ALA A 108 7.395 10.834 -9.594 1.00 0.00 C ATOM 1560 O ALA A 108 7.182 11.332 -8.479 1.00 0.00 O ATOM 1561 CB ALA A 108 7.047 8.338 -9.860 1.00 0.00 C ATOM 0 H ALA A 108 8.212 9.321 -7.658 1.00 0.00 H new ATOM 0 HA ALA A 108 8.741 9.484 -10.568 1.00 0.00 H new ATOM 0 HB1 ALA A 108 6.474 8.497 -10.774 1.00 0.00 H new ATOM 0 HB2 ALA A 108 7.560 7.378 -9.916 1.00 0.00 H new ATOM 0 HB3 ALA A 108 6.372 8.340 -9.004 1.00 0.00 H new ATOM 1567 N PRO A 109 7.050 11.475 -10.720 1.00 0.00 N ATOM 1568 CA PRO A 109 6.304 12.722 -10.729 1.00 0.00 C ATOM 1569 C PRO A 109 4.820 12.436 -10.494 1.00 0.00 C ATOM 1570 O PRO A 109 4.359 11.298 -10.622 1.00 0.00 O ATOM 1571 CB PRO A 109 6.551 13.296 -12.123 1.00 0.00 C ATOM 1572 CG PRO A 109 6.589 12.045 -12.989 1.00 0.00 C ATOM 1573 CD PRO A 109 7.241 11.005 -12.082 1.00 0.00 C ATOM 0 HA PRO A 109 6.611 13.417 -9.947 1.00 0.00 H new ATOM 0 HB2 PRO A 109 5.757 13.978 -12.428 1.00 0.00 H new ATOM 0 HB3 PRO A 109 7.486 13.853 -12.173 1.00 0.00 H new ATOM 0 HG2 PRO A 109 5.589 11.739 -13.297 1.00 0.00 H new ATOM 0 HG3 PRO A 109 7.168 12.204 -13.899 1.00 0.00 H new ATOM 0 HD2 PRO A 109 6.785 10.025 -12.223 1.00 0.00 H new ATOM 0 HD3 PRO A 109 8.301 10.899 -12.312 1.00 0.00 H new ATOM 1581 N SER A 110 4.038 13.485 -10.257 1.00 0.00 N ATOM 1582 CA SER A 110 2.600 13.370 -10.042 1.00 0.00 C ATOM 1583 C SER A 110 1.845 12.837 -11.272 1.00 0.00 C ATOM 1584 O SER A 110 0.663 12.499 -11.164 1.00 0.00 O ATOM 1585 CB SER A 110 2.078 14.746 -9.622 1.00 0.00 C ATOM 1586 OG SER A 110 2.456 15.719 -10.576 1.00 0.00 O ATOM 0 H SER A 110 4.386 14.443 -10.209 1.00 0.00 H new ATOM 0 HA SER A 110 2.420 12.634 -9.258 1.00 0.00 H new ATOM 0 HB2 SER A 110 0.992 14.719 -9.529 1.00 0.00 H new ATOM 0 HB3 SER A 110 2.476 15.011 -8.643 1.00 0.00 H new ATOM 0 HG SER A 110 2.117 16.596 -10.301 1.00 0.00 H new ATOM 1592 N SER A 111 2.507 12.789 -12.431 1.00 0.00 N ATOM 1593 CA SER A 111 1.996 12.410 -13.740 1.00 0.00 C ATOM 1594 C SER A 111 2.109 10.904 -14.034 1.00 0.00 C ATOM 1595 O SER A 111 1.770 10.500 -15.150 1.00 0.00 O ATOM 1596 CB SER A 111 2.785 13.210 -14.790 1.00 0.00 C ATOM 1597 OG SER A 111 2.819 14.582 -14.437 1.00 0.00 O ATOM 0 H SER A 111 3.496 13.036 -12.475 1.00 0.00 H new ATOM 0 HA SER A 111 0.930 12.635 -13.769 1.00 0.00 H new ATOM 0 HB2 SER A 111 3.801 12.821 -14.866 1.00 0.00 H new ATOM 0 HB3 SER A 111 2.324 13.091 -15.770 1.00 0.00 H new ATOM 0 HG SER A 111 3.325 15.081 -15.112 1.00 0.00 H new ATOM 1603 N ALA A 112 2.608 10.087 -13.095 1.00 0.00 N ATOM 1604 CA ALA A 112 2.856 8.652 -13.293 1.00 0.00 C ATOM 1605 C ALA A 112 1.849 7.738 -12.579 1.00 0.00 C ATOM 1606 O ALA A 112 1.863 6.523 -12.802 1.00 0.00 O ATOM 1607 CB ALA A 112 4.259 8.331 -12.774 1.00 0.00 C ATOM 0 H ALA A 112 2.855 10.411 -12.160 1.00 0.00 H new ATOM 0 HA ALA A 112 2.751 8.457 -14.360 1.00 0.00 H new ATOM 0 HB1 ALA A 112 4.464 7.269 -12.912 1.00 0.00 H new ATOM 0 HB2 ALA A 112 4.994 8.917 -13.326 1.00 0.00 H new ATOM 0 HB3 ALA A 112 4.320 8.578 -11.714 1.00 0.00 H new ATOM 1613 N LEU A 113 1.020 8.299 -11.697 1.00 0.00 N ATOM 1614 CA LEU A 113 0.099 7.588 -10.824 1.00 0.00 C ATOM 1615 C LEU A 113 -1.288 8.192 -10.992 1.00 0.00 C ATOM 1616 O LEU A 113 -1.427 9.367 -11.345 1.00 0.00 O ATOM 1617 CB LEU A 113 0.510 7.572 -9.326 1.00 0.00 C ATOM 1618 CG LEU A 113 1.657 8.420 -8.737 1.00 0.00 C ATOM 1619 CD1 LEU A 113 3.035 7.815 -9.019 1.00 0.00 C ATOM 1620 CD2 LEU A 113 1.592 9.901 -9.113 1.00 0.00 C ATOM 0 H LEU A 113 0.974 9.310 -11.570 1.00 0.00 H new ATOM 0 HA LEU A 113 0.115 6.541 -11.127 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.385 7.836 -8.762 1.00 0.00 H new ATOM 0 HB3 LEU A 113 0.744 6.535 -9.085 1.00 0.00 H new ATOM 0 HG LEU A 113 1.505 8.388 -7.658 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.807 8.450 -8.584 1.00 0.00 H new ATOM 0 HD12 LEU A 113 3.092 6.820 -8.578 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.188 7.744 -10.096 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.432 10.428 -8.661 1.00 0.00 H new ATOM 0 HD22 LEU A 113 1.640 10.004 -10.197 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.657 10.328 -8.750 1.00 0.00 H new ATOM 1632 N SER A 114 -2.310 7.400 -10.691 1.00 0.00 N ATOM 1633 CA SER A 114 -3.706 7.666 -11.005 1.00 0.00 C ATOM 1634 C SER A 114 -4.496 7.604 -9.710 1.00 0.00 C ATOM 1635 O SER A 114 -4.541 6.547 -9.070 1.00 0.00 O ATOM 1636 CB SER A 114 -4.252 6.655 -12.027 1.00 0.00 C ATOM 1637 OG SER A 114 -3.262 5.754 -12.503 1.00 0.00 O ATOM 0 H SER A 114 -2.181 6.516 -10.199 1.00 0.00 H new ATOM 0 HA SER A 114 -3.800 8.653 -11.458 1.00 0.00 H new ATOM 0 HB2 SER A 114 -5.062 6.087 -11.570 1.00 0.00 H new ATOM 0 HB3 SER A 114 -4.679 7.196 -12.872 1.00 0.00 H new ATOM 0 HG SER A 114 -3.665 5.135 -13.147 1.00 0.00 H new ATOM 1643 N TRP A 115 -5.075 8.729 -9.293 1.00 0.00 N ATOM 1644 CA TRP A 115 -5.999 8.717 -8.175 1.00 0.00 C ATOM 1645 C TRP A 115 -7.392 8.285 -8.647 1.00 0.00 C ATOM 1646 O TRP A 115 -7.601 7.917 -9.805 1.00 0.00 O ATOM 1647 CB TRP A 115 -5.945 10.005 -7.355 1.00 0.00 C ATOM 1648 CG TRP A 115 -5.793 9.807 -5.866 1.00 0.00 C ATOM 1649 CD1 TRP A 115 -5.276 10.737 -5.045 1.00 0.00 C ATOM 1650 CD2 TRP A 115 -6.101 8.677 -4.982 1.00 0.00 C ATOM 1651 NE1 TRP A 115 -5.348 10.328 -3.735 1.00 0.00 N ATOM 1652 CE2 TRP A 115 -5.780 9.035 -3.639 1.00 0.00 C ATOM 1653 CE3 TRP A 115 -6.596 7.372 -5.154 1.00 0.00 C ATOM 1654 CZ2 TRP A 115 -5.934 8.168 -2.546 1.00 0.00 C ATOM 1655 CZ3 TRP A 115 -6.741 6.494 -4.076 1.00 0.00 C ATOM 1656 CH2 TRP A 115 -6.418 6.875 -2.766 1.00 0.00 C ATOM 0 H TRP A 115 -4.919 9.647 -9.711 1.00 0.00 H new ATOM 0 HA TRP A 115 -5.685 7.961 -7.455 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -5.113 10.611 -7.713 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -6.856 10.574 -7.540 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -4.860 11.679 -5.371 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -5.109 10.915 -2.936 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -6.871 7.040 -6.144 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -5.682 8.495 -1.548 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -7.112 5.496 -4.257 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -6.540 6.185 -1.945 1.00 0.00 H new ATOM 1667 N THR A 116 -8.355 8.291 -7.737 1.00 0.00 N ATOM 1668 CA THR A 116 -9.734 7.890 -7.953 1.00 0.00 C ATOM 1669 C THR A 116 -10.597 8.841 -7.124 1.00 0.00 C ATOM 1670 O THR A 116 -10.101 9.416 -6.147 1.00 0.00 O ATOM 1671 CB THR A 116 -9.869 6.407 -7.550 1.00 0.00 C ATOM 1672 OG1 THR A 116 -9.275 5.579 -8.529 1.00 0.00 O ATOM 1673 CG2 THR A 116 -11.305 5.904 -7.380 1.00 0.00 C ATOM 0 H THR A 116 -8.184 8.592 -6.778 1.00 0.00 H new ATOM 0 HA THR A 116 -10.058 7.959 -8.991 1.00 0.00 H new ATOM 0 HB THR A 116 -9.374 6.353 -6.580 1.00 0.00 H new ATOM 0 HG1 THR A 116 -9.365 4.640 -8.262 1.00 0.00 H new ATOM 0 HG21 THR A 116 -11.291 4.852 -7.097 1.00 0.00 H new ATOM 0 HG22 THR A 116 -11.803 6.482 -6.602 1.00 0.00 H new ATOM 0 HG23 THR A 116 -11.845 6.019 -8.320 1.00 0.00 H new ATOM 1681 N THR A 117 -11.874 8.975 -7.501 1.00 0.00 N ATOM 1682 CA THR A 117 -12.915 9.745 -6.829 1.00 0.00 C ATOM 1683 C THR A 117 -12.830 9.580 -5.310 1.00 0.00 C ATOM 1684 O THR A 117 -13.239 8.556 -4.746 1.00 0.00 O ATOM 1685 CB THR A 117 -14.306 9.369 -7.364 1.00 0.00 C ATOM 1686 OG1 THR A 117 -14.290 9.267 -8.776 1.00 0.00 O ATOM 1687 CG2 THR A 117 -15.364 10.406 -6.974 1.00 0.00 C ATOM 0 H THR A 117 -12.226 8.515 -8.341 1.00 0.00 H new ATOM 0 HA THR A 117 -12.752 10.800 -7.049 1.00 0.00 H new ATOM 0 HB THR A 117 -14.561 8.408 -6.918 1.00 0.00 H new ATOM 0 HG1 THR A 117 -15.184 9.025 -9.097 1.00 0.00 H new ATOM 0 HG21 THR A 117 -16.333 10.104 -7.371 1.00 0.00 H new ATOM 0 HG22 THR A 117 -15.422 10.475 -5.888 1.00 0.00 H new ATOM 0 HG23 THR A 117 -15.090 11.378 -7.385 1.00 0.00 H new ATOM 1695 N LEU A 118 -12.249 10.589 -4.666 1.00 0.00 N ATOM 1696 CA LEU A 118 -12.364 10.821 -3.244 1.00 0.00 C ATOM 1697 C LEU A 118 -13.851 11.013 -2.989 1.00 0.00 C ATOM 1698 O LEU A 118 -14.467 11.939 -3.507 1.00 0.00 O ATOM 1699 CB LEU A 118 -11.554 12.070 -2.864 1.00 0.00 C ATOM 1700 CG LEU A 118 -10.276 11.814 -2.073 1.00 0.00 C ATOM 1701 CD1 LEU A 118 -9.566 13.154 -1.867 1.00 0.00 C ATOM 1702 CD2 LEU A 118 -10.571 11.165 -0.726 1.00 0.00 C ATOM 0 H LEU A 118 -11.671 11.283 -5.140 1.00 0.00 H new ATOM 0 HA LEU A 118 -11.973 10.000 -2.644 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.293 12.603 -3.778 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -12.194 12.732 -2.281 1.00 0.00 H new ATOM 0 HG LEU A 118 -9.642 11.125 -2.631 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -8.647 12.996 -1.302 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -9.326 13.591 -2.836 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -10.219 13.831 -1.316 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -9.637 10.998 -0.190 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.213 11.821 -0.139 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -11.074 10.211 -0.884 1.00 0.00 H new ATOM 1714 N THR A 119 -14.460 10.049 -2.311 1.00 0.00 N ATOM 1715 CA THR A 119 -15.886 10.059 -2.044 1.00 0.00 C ATOM 1716 C THR A 119 -16.178 11.196 -1.047 1.00 0.00 C ATOM 1717 O THR A 119 -15.576 11.182 0.031 1.00 0.00 O ATOM 1718 CB THR A 119 -16.292 8.687 -1.484 1.00 0.00 C ATOM 1719 OG1 THR A 119 -15.544 7.622 -2.064 1.00 0.00 O ATOM 1720 CG2 THR A 119 -17.784 8.441 -1.689 1.00 0.00 C ATOM 0 H THR A 119 -13.974 9.237 -1.931 1.00 0.00 H new ATOM 0 HA THR A 119 -16.465 10.236 -2.950 1.00 0.00 H new ATOM 0 HB THR A 119 -16.070 8.706 -0.417 1.00 0.00 H new ATOM 0 HG1 THR A 119 -15.834 6.770 -1.677 1.00 0.00 H new ATOM 0 HG21 THR A 119 -18.051 7.464 -1.285 1.00 0.00 H new ATOM 0 HG22 THR A 119 -18.354 9.214 -1.174 1.00 0.00 H new ATOM 0 HG23 THR A 119 -18.014 8.469 -2.754 1.00 0.00 H new ATOM 1728 N PRO A 120 -17.051 12.172 -1.352 1.00 0.00 N ATOM 1729 CA PRO A 120 -17.396 13.197 -0.378 1.00 0.00 C ATOM 1730 C PRO A 120 -18.004 12.546 0.875 1.00 0.00 C ATOM 1731 O PRO A 120 -18.683 11.523 0.768 1.00 0.00 O ATOM 1732 CB PRO A 120 -18.352 14.161 -1.087 1.00 0.00 C ATOM 1733 CG PRO A 120 -18.557 13.634 -2.509 1.00 0.00 C ATOM 1734 CD PRO A 120 -17.806 12.307 -2.586 1.00 0.00 C ATOM 0 HA PRO A 120 -16.526 13.751 -0.026 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -19.303 14.218 -0.557 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -17.937 15.169 -1.107 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -19.617 13.494 -2.723 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -18.174 14.341 -3.245 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -18.502 11.477 -2.705 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -17.140 12.291 -3.449 1.00 0.00 H new ATOM 1742 N GLY A 121 -17.757 13.137 2.051 1.00 0.00 N ATOM 1743 CA GLY A 121 -18.164 12.669 3.381 1.00 0.00 C ATOM 1744 C GLY A 121 -18.269 11.149 3.532 1.00 0.00 C ATOM 1745 O GLY A 121 -19.356 10.614 3.757 1.00 0.00 O ATOM 0 H GLY A 121 -17.234 14.011 2.101 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -17.450 13.043 4.115 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -19.131 13.110 3.624 1.00 0.00 H new ATOM 1749 N LYS A 122 -17.138 10.440 3.455 1.00 0.00 N ATOM 1750 CA LYS A 122 -17.068 8.973 3.545 1.00 0.00 C ATOM 1751 C LYS A 122 -15.808 8.567 4.343 1.00 0.00 C ATOM 1752 O LYS A 122 -15.135 9.460 4.850 1.00 0.00 O ATOM 1753 CB LYS A 122 -17.122 8.405 2.105 1.00 0.00 C ATOM 1754 CG LYS A 122 -18.335 7.497 1.823 1.00 0.00 C ATOM 1755 CD LYS A 122 -19.649 8.258 1.638 1.00 0.00 C ATOM 1756 CE LYS A 122 -20.680 7.443 0.852 1.00 0.00 C ATOM 1757 NZ LYS A 122 -21.050 6.192 1.543 1.00 0.00 N ATOM 0 H LYS A 122 -16.225 10.877 3.326 1.00 0.00 H new ATOM 0 HA LYS A 122 -17.911 8.550 4.091 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -17.134 9.236 1.400 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -16.209 7.840 1.916 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -18.137 6.911 0.926 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -18.448 6.792 2.646 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -20.059 8.516 2.615 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -19.454 9.195 1.117 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -21.574 8.047 0.695 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -20.278 7.206 -0.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -21.799 5.708 1.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -20.217 5.573 1.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -21.395 6.412 2.499 1.00 0.00 H new ATOM 1771 N PRO A 123 -15.498 7.265 4.532 1.00 0.00 N ATOM 1772 CA PRO A 123 -14.234 6.792 5.116 1.00 0.00 C ATOM 1773 C PRO A 123 -13.095 6.710 4.083 1.00 0.00 C ATOM 1774 O PRO A 123 -11.977 6.352 4.437 1.00 0.00 O ATOM 1775 CB PRO A 123 -14.565 5.406 5.674 1.00 0.00 C ATOM 1776 CG PRO A 123 -15.599 4.873 4.692 1.00 0.00 C ATOM 1777 CD PRO A 123 -16.366 6.123 4.266 1.00 0.00 C ATOM 0 HA PRO A 123 -13.870 7.482 5.877 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -13.683 4.767 5.716 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -14.964 5.464 6.687 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -15.128 4.382 3.841 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -16.256 4.139 5.160 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -16.627 6.074 3.209 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -17.300 6.211 4.821 1.00 0.00 H new ATOM 1785 N ASN A 124 -13.374 6.969 2.796 1.00 0.00 N ATOM 1786 CA ASN A 124 -12.420 6.932 1.678 1.00 0.00 C ATOM 1787 C ASN A 124 -11.483 5.730 1.725 1.00 0.00 C ATOM 1788 O ASN A 124 -10.291 5.827 1.435 1.00 0.00 O ATOM 1789 CB ASN A 124 -11.641 8.249 1.588 1.00 0.00 C ATOM 1790 CG ASN A 124 -12.527 9.455 1.377 1.00 0.00 C ATOM 1791 OD1 ASN A 124 -12.249 10.511 1.899 1.00 0.00 O ATOM 1792 ND2 ASN A 124 -13.591 9.345 0.599 1.00 0.00 N ATOM 0 H ASN A 124 -14.315 7.222 2.493 1.00 0.00 H new ATOM 0 HA ASN A 124 -13.008 6.813 0.768 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -11.065 8.386 2.503 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -10.926 8.185 0.768 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -14.188 10.156 0.433 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -13.815 8.450 0.165 1.00 0.00 H new ATOM 1799 N THR A 125 -12.034 4.571 2.059 1.00 0.00 N ATOM 1800 CA THR A 125 -11.385 3.296 1.855 1.00 0.00 C ATOM 1801 C THR A 125 -11.481 3.000 0.352 1.00 0.00 C ATOM 1802 O THR A 125 -12.574 2.780 -0.179 1.00 0.00 O ATOM 1803 CB THR A 125 -12.130 2.269 2.726 1.00 0.00 C ATOM 1804 OG1 THR A 125 -11.989 2.610 4.087 1.00 0.00 O ATOM 1805 CG2 THR A 125 -11.659 0.827 2.571 1.00 0.00 C ATOM 0 H THR A 125 -12.958 4.496 2.485 1.00 0.00 H new ATOM 0 HA THR A 125 -10.334 3.273 2.142 1.00 0.00 H new ATOM 0 HB THR A 125 -13.163 2.311 2.382 1.00 0.00 H new ATOM 0 HG1 THR A 125 -12.466 1.956 4.639 1.00 0.00 H new ATOM 0 HG21 THR A 125 -12.244 0.181 3.225 1.00 0.00 H new ATOM 0 HG22 THR A 125 -11.790 0.511 1.536 1.00 0.00 H new ATOM 0 HG23 THR A 125 -10.605 0.757 2.841 1.00 0.00 H new ATOM 1813 N LEU A 126 -10.359 3.081 -0.355 1.00 0.00 N ATOM 1814 CA LEU A 126 -10.236 2.653 -1.746 1.00 0.00 C ATOM 1815 C LEU A 126 -9.806 1.180 -1.724 1.00 0.00 C ATOM 1816 O LEU A 126 -10.028 0.486 -0.725 1.00 0.00 O ATOM 1817 CB LEU A 126 -9.258 3.588 -2.477 1.00 0.00 C ATOM 1818 CG LEU A 126 -9.814 4.974 -2.877 1.00 0.00 C ATOM 1819 CD1 LEU A 126 -10.523 4.906 -4.230 1.00 0.00 C ATOM 1820 CD2 LEU A 126 -10.730 5.700 -1.890 1.00 0.00 C ATOM 0 H LEU A 126 -9.491 3.454 0.030 1.00 0.00 H new ATOM 0 HA LEU A 126 -11.173 2.719 -2.299 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -8.386 3.739 -1.840 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -8.911 3.084 -3.379 1.00 0.00 H new ATOM 0 HG LEU A 126 -8.906 5.577 -2.902 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -10.906 5.893 -4.490 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -9.818 4.577 -4.994 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -11.351 4.200 -4.172 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -11.036 6.656 -2.314 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.612 5.090 -1.696 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -10.195 5.872 -0.956 1.00 0.00 H new ATOM 1832 N ASN A 127 -9.280 0.645 -2.823 1.00 0.00 N ATOM 1833 CA ASN A 127 -8.851 -0.744 -2.950 1.00 0.00 C ATOM 1834 C ASN A 127 -7.399 -0.698 -3.427 1.00 0.00 C ATOM 1835 O ASN A 127 -7.140 -0.112 -4.477 1.00 0.00 O ATOM 1836 CB ASN A 127 -9.730 -1.498 -3.973 1.00 0.00 C ATOM 1837 CG ASN A 127 -11.241 -1.567 -3.742 1.00 0.00 C ATOM 1838 OD1 ASN A 127 -11.776 -1.076 -2.636 1.00 0.00 O flip ATOM 1839 ND2 ASN A 127 -11.963 -2.077 -4.589 1.00 0.00 N flip ATOM 0 H ASN A 127 -9.136 1.184 -3.677 1.00 0.00 H new ATOM 0 HA ASN A 127 -8.944 -1.272 -2.001 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -9.567 -1.040 -4.949 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -9.359 -2.521 -4.035 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -11.556 -2.457 -5.444 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -12.971 -2.122 -4.440 1.00 0.00 H new ATOM 1846 N PHE A 128 -6.445 -1.234 -2.665 1.00 0.00 N ATOM 1847 CA PHE A 128 -5.032 -1.358 -3.034 1.00 0.00 C ATOM 1848 C PHE A 128 -4.521 -2.706 -2.521 1.00 0.00 C ATOM 1849 O PHE A 128 -5.251 -3.437 -1.838 1.00 0.00 O ATOM 1850 CB PHE A 128 -4.197 -0.201 -2.444 1.00 0.00 C ATOM 1851 CG PHE A 128 -4.235 1.097 -3.227 1.00 0.00 C ATOM 1852 CD1 PHE A 128 -5.385 1.900 -3.188 1.00 0.00 C ATOM 1853 CD2 PHE A 128 -3.106 1.550 -3.942 1.00 0.00 C ATOM 1854 CE1 PHE A 128 -5.430 3.102 -3.904 1.00 0.00 C ATOM 1855 CE2 PHE A 128 -3.148 2.767 -4.647 1.00 0.00 C ATOM 1856 CZ PHE A 128 -4.319 3.540 -4.641 1.00 0.00 C ATOM 0 H PHE A 128 -6.642 -1.609 -1.737 1.00 0.00 H new ATOM 0 HA PHE A 128 -4.932 -1.305 -4.118 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -4.546 -0.004 -1.431 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -3.160 -0.528 -2.366 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -6.238 1.590 -2.603 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -2.203 0.958 -3.948 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -6.330 3.699 -3.889 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -2.280 3.106 -5.192 1.00 0.00 H new ATOM 0 HZ PHE A 128 -4.365 4.464 -5.199 1.00 0.00 H new ATOM 1866 N TYR A 129 -3.263 -3.027 -2.826 1.00 0.00 N ATOM 1867 CA TYR A 129 -2.597 -4.224 -2.349 1.00 0.00 C ATOM 1868 C TYR A 129 -1.133 -3.930 -2.002 1.00 0.00 C ATOM 1869 O TYR A 129 -0.551 -2.966 -2.505 1.00 0.00 O ATOM 1870 CB TYR A 129 -2.698 -5.317 -3.419 1.00 0.00 C ATOM 1871 CG TYR A 129 -4.114 -5.717 -3.804 1.00 0.00 C ATOM 1872 CD1 TYR A 129 -4.831 -6.498 -2.882 1.00 0.00 C ATOM 1873 CD2 TYR A 129 -4.736 -5.310 -5.011 1.00 0.00 C ATOM 1874 CE1 TYR A 129 -6.178 -6.810 -3.091 1.00 0.00 C ATOM 1875 CE2 TYR A 129 -6.086 -5.654 -5.243 1.00 0.00 C ATOM 1876 CZ TYR A 129 -6.814 -6.375 -4.266 1.00 0.00 C ATOM 1877 OH TYR A 129 -8.143 -6.620 -4.400 1.00 0.00 O ATOM 0 H TYR A 129 -2.674 -2.447 -3.423 1.00 0.00 H new ATOM 0 HA TYR A 129 -3.086 -4.570 -1.438 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -2.178 -4.976 -4.314 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -2.172 -6.202 -3.062 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -4.333 -6.864 -1.996 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -4.183 -4.743 -5.745 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -6.725 -7.381 -2.355 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -6.564 -5.366 -6.168 1.00 0.00 H new ATOM 0 HH TYR A 129 -8.456 -6.265 -5.258 1.00 0.00 H new ATOM 1887 N ALA A 130 -0.517 -4.779 -1.174 1.00 0.00 N ATOM 1888 CA ALA A 130 0.895 -4.703 -0.801 1.00 0.00 C ATOM 1889 C ALA A 130 1.478 -6.116 -0.719 1.00 0.00 C ATOM 1890 O ALA A 130 0.794 -7.018 -0.222 1.00 0.00 O ATOM 1891 CB ALA A 130 1.016 -3.995 0.562 1.00 0.00 C ATOM 0 H ALA A 130 -1.003 -5.560 -0.733 1.00 0.00 H new ATOM 0 HA ALA A 130 1.450 -4.138 -1.550 1.00 0.00 H new ATOM 0 HB1 ALA A 130 2.066 -3.934 0.848 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.601 -2.990 0.488 1.00 0.00 H new ATOM 0 HB3 ALA A 130 0.467 -4.560 1.315 1.00 0.00 H new ATOM 1897 N ARG A 131 2.743 -6.310 -1.131 1.00 0.00 N ATOM 1898 CA ARG A 131 3.583 -7.451 -0.745 1.00 0.00 C ATOM 1899 C ARG A 131 5.073 -7.201 -1.021 1.00 0.00 C ATOM 1900 O ARG A 131 5.525 -6.067 -0.881 1.00 0.00 O ATOM 1901 CB ARG A 131 3.053 -8.779 -1.304 1.00 0.00 C ATOM 1902 CG ARG A 131 3.205 -9.896 -0.256 1.00 0.00 C ATOM 1903 CD ARG A 131 2.239 -9.968 0.923 1.00 0.00 C ATOM 1904 NE ARG A 131 2.627 -11.086 1.810 1.00 0.00 N ATOM 1905 CZ ARG A 131 3.647 -11.134 2.681 1.00 0.00 C ATOM 1906 NH1 ARG A 131 4.462 -10.097 2.868 1.00 0.00 N ATOM 1907 NH2 ARG A 131 3.894 -12.236 3.367 1.00 0.00 N ATOM 0 H ARG A 131 3.219 -5.660 -1.757 1.00 0.00 H new ATOM 0 HA ARG A 131 3.512 -7.551 0.338 1.00 0.00 H new ATOM 0 HB2 ARG A 131 2.005 -8.672 -1.583 1.00 0.00 H new ATOM 0 HB3 ARG A 131 3.598 -9.044 -2.210 1.00 0.00 H new ATOM 0 HG2 ARG A 131 3.144 -10.848 -0.784 1.00 0.00 H new ATOM 0 HG3 ARG A 131 4.212 -9.822 0.153 1.00 0.00 H new ATOM 0 HD2 ARG A 131 2.253 -9.029 1.476 1.00 0.00 H new ATOM 0 HD3 ARG A 131 1.220 -10.111 0.564 1.00 0.00 H new ATOM 0 HE ARG A 131 2.048 -11.924 1.753 1.00 0.00 H new ATOM 0 HH11 ARG A 131 4.320 -9.235 2.342 1.00 0.00 H new ATOM 0 HH12 ARG A 131 5.228 -10.165 3.538 1.00 0.00 H new ATOM 0 HH21 ARG A 131 3.307 -13.060 3.237 1.00 0.00 H new ATOM 0 HH22 ARG A 131 4.672 -12.263 4.027 1.00 0.00 H new ATOM 1921 N LEU A 132 5.859 -8.256 -1.274 1.00 0.00 N ATOM 1922 CA LEU A 132 7.274 -8.201 -1.626 1.00 0.00 C ATOM 1923 C LEU A 132 7.436 -8.664 -3.069 1.00 0.00 C ATOM 1924 O LEU A 132 6.751 -9.591 -3.512 1.00 0.00 O ATOM 1925 CB LEU A 132 8.112 -9.177 -0.784 1.00 0.00 C ATOM 1926 CG LEU A 132 8.569 -8.765 0.623 1.00 0.00 C ATOM 1927 CD1 LEU A 132 9.444 -9.907 1.149 1.00 0.00 C ATOM 1928 CD2 LEU A 132 9.410 -7.489 0.656 1.00 0.00 C ATOM 0 H LEU A 132 5.505 -9.212 -1.236 1.00 0.00 H new ATOM 0 HA LEU A 132 7.608 -7.177 -1.460 1.00 0.00 H new ATOM 0 HB2 LEU A 132 7.537 -10.098 -0.684 1.00 0.00 H new ATOM 0 HB3 LEU A 132 9.005 -9.420 -1.359 1.00 0.00 H new ATOM 0 HG LEU A 132 7.678 -8.571 1.220 1.00 0.00 H new ATOM 0 HD11 LEU A 132 9.797 -9.663 2.151 1.00 0.00 H new ATOM 0 HD12 LEU A 132 8.860 -10.827 1.183 1.00 0.00 H new ATOM 0 HD13 LEU A 132 10.299 -10.045 0.487 1.00 0.00 H new ATOM 0 HD21 LEU A 132 9.693 -7.266 1.685 1.00 0.00 H new ATOM 0 HD22 LEU A 132 10.308 -7.630 0.055 1.00 0.00 H new ATOM 0 HD23 LEU A 132 8.829 -6.660 0.252 1.00 0.00 H new ATOM 1940 N MET A 133 8.461 -8.125 -3.715 1.00 0.00 N ATOM 1941 CA MET A 133 8.999 -8.525 -4.997 1.00 0.00 C ATOM 1942 C MET A 133 10.451 -8.914 -4.766 1.00 0.00 C ATOM 1943 O MET A 133 11.213 -8.140 -4.181 1.00 0.00 O ATOM 1944 CB MET A 133 8.905 -7.311 -5.937 1.00 0.00 C ATOM 1945 CG MET A 133 9.692 -7.346 -7.253 1.00 0.00 C ATOM 1946 SD MET A 133 8.814 -7.974 -8.690 1.00 0.00 S ATOM 1947 CE MET A 133 8.688 -9.662 -8.118 1.00 0.00 C ATOM 0 H MET A 133 8.974 -7.336 -3.321 1.00 0.00 H new ATOM 0 HA MET A 133 8.459 -9.363 -5.439 1.00 0.00 H new ATOM 0 HB2 MET A 133 7.854 -7.162 -6.183 1.00 0.00 H new ATOM 0 HB3 MET A 133 9.230 -6.433 -5.379 1.00 0.00 H new ATOM 0 HG2 MET A 133 10.032 -6.335 -7.475 1.00 0.00 H new ATOM 0 HG3 MET A 133 10.583 -7.956 -7.103 1.00 0.00 H new ATOM 0 HE1 MET A 133 8.432 -10.312 -8.955 1.00 0.00 H new ATOM 0 HE2 MET A 133 9.642 -9.975 -7.695 1.00 0.00 H new ATOM 0 HE3 MET A 133 7.913 -9.731 -7.355 1.00 0.00 H new ATOM 1957 N ALA A 134 10.854 -10.094 -5.232 1.00 0.00 N ATOM 1958 CA ALA A 134 12.270 -10.400 -5.317 1.00 0.00 C ATOM 1959 C ALA A 134 12.882 -9.692 -6.517 1.00 0.00 C ATOM 1960 O ALA A 134 12.293 -9.661 -7.597 1.00 0.00 O ATOM 1961 CB ALA A 134 12.476 -11.897 -5.464 1.00 0.00 C ATOM 0 H ALA A 134 10.231 -10.837 -5.549 1.00 0.00 H new ATOM 0 HA ALA A 134 12.754 -10.057 -4.403 1.00 0.00 H new ATOM 0 HB1 ALA A 134 13.543 -12.113 -5.527 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.052 -12.409 -4.600 1.00 0.00 H new ATOM 0 HB3 ALA A 134 11.981 -12.245 -6.371 1.00 0.00 H new ATOM 1967 N THR A 135 14.098 -9.203 -6.339 1.00 0.00 N ATOM 1968 CA THR A 135 14.886 -8.576 -7.384 1.00 0.00 C ATOM 1969 C THR A 135 16.284 -9.212 -7.483 1.00 0.00 C ATOM 1970 O THR A 135 16.953 -9.073 -8.514 1.00 0.00 O ATOM 1971 CB THR A 135 14.898 -7.066 -7.122 1.00 0.00 C ATOM 1972 OG1 THR A 135 15.457 -6.778 -5.852 1.00 0.00 O ATOM 1973 CG2 THR A 135 13.499 -6.438 -7.183 1.00 0.00 C ATOM 0 H THR A 135 14.576 -9.233 -5.439 1.00 0.00 H new ATOM 0 HA THR A 135 14.443 -8.742 -8.366 1.00 0.00 H new ATOM 0 HB THR A 135 15.506 -6.634 -7.916 1.00 0.00 H new ATOM 0 HG1 THR A 135 16.278 -6.256 -5.967 1.00 0.00 H new ATOM 0 HG21 THR A 135 13.572 -5.368 -6.989 1.00 0.00 H new ATOM 0 HG22 THR A 135 13.070 -6.600 -8.172 1.00 0.00 H new ATOM 0 HG23 THR A 135 12.860 -6.900 -6.431 1.00 0.00 H new ATOM 1981 N GLN A 136 16.694 -9.978 -6.461 1.00 0.00 N ATOM 1982 CA GLN A 136 17.745 -10.985 -6.526 1.00 0.00 C ATOM 1983 C GLN A 136 17.306 -12.214 -5.731 1.00 0.00 C ATOM 1984 O GLN A 136 16.231 -12.233 -5.120 1.00 0.00 O ATOM 1985 CB GLN A 136 19.092 -10.475 -5.966 1.00 0.00 C ATOM 1986 CG GLN A 136 19.616 -9.156 -6.566 1.00 0.00 C ATOM 1987 CD GLN A 136 20.170 -9.233 -7.993 1.00 0.00 C ATOM 1988 OE1 GLN A 136 20.842 -8.310 -8.443 1.00 0.00 O ATOM 1989 NE2 GLN A 136 19.948 -10.289 -8.762 1.00 0.00 N ATOM 0 H GLN A 136 16.280 -9.904 -5.532 1.00 0.00 H new ATOM 0 HA GLN A 136 17.900 -11.231 -7.577 1.00 0.00 H new ATOM 0 HB2 GLN A 136 18.989 -10.346 -4.889 1.00 0.00 H new ATOM 0 HB3 GLN A 136 19.845 -11.247 -6.124 1.00 0.00 H new ATOM 0 HG2 GLN A 136 18.805 -8.428 -6.552 1.00 0.00 H new ATOM 0 HG3 GLN A 136 20.401 -8.771 -5.914 1.00 0.00 H new ATOM 0 HE21 GLN A 136 19.392 -11.069 -8.410 1.00 0.00 H new ATOM 0 HE22 GLN A 136 20.333 -10.322 -9.706 1.00 0.00 H new ATOM 1998 N VAL A 137 18.158 -13.239 -5.706 1.00 0.00 N ATOM 1999 CA VAL A 137 17.873 -14.506 -5.043 1.00 0.00 C ATOM 2000 C VAL A 137 18.939 -14.796 -3.963 1.00 0.00 C ATOM 2001 O VAL A 137 19.493 -15.898 -3.938 1.00 0.00 O ATOM 2002 CB VAL A 137 17.742 -15.565 -6.155 1.00 0.00 C ATOM 2003 CG1 VAL A 137 16.726 -15.093 -7.207 1.00 0.00 C ATOM 2004 CG2 VAL A 137 18.989 -15.912 -6.960 1.00 0.00 C ATOM 0 H VAL A 137 19.075 -13.210 -6.151 1.00 0.00 H new ATOM 0 HA VAL A 137 16.937 -14.499 -4.485 1.00 0.00 H new ATOM 0 HB VAL A 137 17.462 -16.452 -5.587 1.00 0.00 H new ATOM 0 HG11 VAL A 137 16.637 -15.845 -7.991 1.00 0.00 H new ATOM 0 HG12 VAL A 137 15.755 -14.945 -6.734 1.00 0.00 H new ATOM 0 HG13 VAL A 137 17.064 -14.153 -7.643 1.00 0.00 H new ATOM 0 HG21 VAL A 137 18.743 -16.670 -7.704 1.00 0.00 H new ATOM 0 HG22 VAL A 137 19.359 -15.018 -7.462 1.00 0.00 H new ATOM 0 HG23 VAL A 137 19.759 -16.297 -6.291 1.00 0.00 H new ATOM 2014 N PRO A 138 19.224 -13.878 -3.009 1.00 0.00 N ATOM 2015 CA PRO A 138 20.165 -14.158 -1.933 1.00 0.00 C ATOM 2016 C PRO A 138 19.562 -15.105 -0.892 1.00 0.00 C ATOM 2017 O PRO A 138 20.298 -15.726 -0.134 1.00 0.00 O ATOM 2018 CB PRO A 138 20.506 -12.823 -1.274 1.00 0.00 C ATOM 2019 CG PRO A 138 19.269 -11.995 -1.559 1.00 0.00 C ATOM 2020 CD PRO A 138 18.864 -12.476 -2.942 1.00 0.00 C ATOM 0 HA PRO A 138 21.052 -14.645 -2.338 1.00 0.00 H new ATOM 0 HB2 PRO A 138 20.685 -12.932 -0.204 1.00 0.00 H new ATOM 0 HB3 PRO A 138 21.402 -12.375 -1.703 1.00 0.00 H new ATOM 0 HG2 PRO A 138 18.485 -12.170 -0.823 1.00 0.00 H new ATOM 0 HG3 PRO A 138 19.484 -10.927 -1.548 1.00 0.00 H new ATOM 0 HD2 PRO A 138 17.794 -12.342 -3.102 1.00 0.00 H new ATOM 0 HD3 PRO A 138 19.376 -11.906 -3.717 1.00 0.00 H new ATOM 2028 N VAL A 139 18.225 -15.172 -0.830 1.00 0.00 N ATOM 2029 CA VAL A 139 17.439 -15.948 0.134 1.00 0.00 C ATOM 2030 C VAL A 139 17.979 -15.843 1.579 1.00 0.00 C ATOM 2031 O VAL A 139 18.005 -16.809 2.340 1.00 0.00 O ATOM 2032 CB VAL A 139 17.169 -17.376 -0.395 1.00 0.00 C ATOM 2033 CG1 VAL A 139 16.431 -17.311 -1.748 1.00 0.00 C ATOM 2034 CG2 VAL A 139 18.414 -18.257 -0.579 1.00 0.00 C ATOM 0 H VAL A 139 17.634 -14.660 -1.485 1.00 0.00 H new ATOM 0 HA VAL A 139 16.452 -15.495 0.224 1.00 0.00 H new ATOM 0 HB VAL A 139 16.566 -17.842 0.384 1.00 0.00 H new ATOM 0 HG11 VAL A 139 16.246 -18.322 -2.111 1.00 0.00 H new ATOM 0 HG12 VAL A 139 15.481 -16.792 -1.620 1.00 0.00 H new ATOM 0 HG13 VAL A 139 17.044 -16.772 -2.471 1.00 0.00 H new ATOM 0 HG21 VAL A 139 18.115 -19.236 -0.953 1.00 0.00 H new ATOM 0 HG22 VAL A 139 19.090 -17.787 -1.293 1.00 0.00 H new ATOM 0 HG23 VAL A 139 18.922 -18.374 0.378 1.00 0.00 H new ATOM 2044 N THR A 140 18.340 -14.619 1.970 1.00 0.00 N ATOM 2045 CA THR A 140 18.684 -14.195 3.304 1.00 0.00 C ATOM 2046 C THR A 140 17.355 -14.000 4.028 1.00 0.00 C ATOM 2047 O THR A 140 16.492 -13.226 3.598 1.00 0.00 O ATOM 2048 CB THR A 140 19.463 -12.870 3.173 1.00 0.00 C ATOM 2049 OG1 THR A 140 20.833 -13.120 2.929 1.00 0.00 O ATOM 2050 CG2 THR A 140 19.369 -11.922 4.372 1.00 0.00 C ATOM 0 H THR A 140 18.400 -13.850 1.302 1.00 0.00 H new ATOM 0 HA THR A 140 19.303 -14.904 3.853 1.00 0.00 H new ATOM 0 HB THR A 140 18.978 -12.368 2.336 1.00 0.00 H new ATOM 0 HG1 THR A 140 21.311 -12.269 2.847 1.00 0.00 H new ATOM 0 HG21 THR A 140 19.953 -11.024 4.172 1.00 0.00 H new ATOM 0 HG22 THR A 140 18.327 -11.648 4.538 1.00 0.00 H new ATOM 0 HG23 THR A 140 19.760 -12.419 5.260 1.00 0.00 H new ATOM 2058 N ALA A 141 17.216 -14.685 5.150 1.00 0.00 N ATOM 2059 CA ALA A 141 16.236 -14.346 6.166 1.00 0.00 C ATOM 2060 C ALA A 141 16.626 -13.016 6.826 1.00 0.00 C ATOM 2061 O ALA A 141 17.690 -12.900 7.438 1.00 0.00 O ATOM 2062 CB ALA A 141 16.126 -15.469 7.195 1.00 0.00 C ATOM 0 H ALA A 141 17.785 -15.499 5.383 1.00 0.00 H new ATOM 0 HA ALA A 141 15.256 -14.229 5.704 1.00 0.00 H new ATOM 0 HB1 ALA A 141 15.387 -15.200 7.950 1.00 0.00 H new ATOM 0 HB2 ALA A 141 15.818 -16.389 6.698 1.00 0.00 H new ATOM 0 HB3 ALA A 141 17.094 -15.621 7.673 1.00 0.00 H new ATOM 2068 N GLY A 142 15.777 -12.000 6.702 1.00 0.00 N ATOM 2069 CA GLY A 142 15.857 -10.744 7.422 1.00 0.00 C ATOM 2070 C GLY A 142 14.509 -10.028 7.346 1.00 0.00 C ATOM 2071 O GLY A 142 13.964 -9.823 6.263 1.00 0.00 O ATOM 0 H GLY A 142 14.980 -12.037 6.066 1.00 0.00 H new ATOM 0 HA2 GLY A 142 16.127 -10.925 8.462 1.00 0.00 H new ATOM 0 HA3 GLY A 142 16.639 -10.116 6.995 1.00 0.00 H new ATOM 2075 N HIS A 143 13.940 -9.691 8.503 1.00 0.00 N ATOM 2076 CA HIS A 143 12.642 -9.039 8.692 1.00 0.00 C ATOM 2077 C HIS A 143 12.388 -7.926 7.681 1.00 0.00 C ATOM 2078 O HIS A 143 13.254 -7.094 7.399 1.00 0.00 O ATOM 2079 CB HIS A 143 12.474 -8.505 10.126 1.00 0.00 C ATOM 2080 CG HIS A 143 13.590 -7.623 10.627 1.00 0.00 C ATOM 2081 ND1 HIS A 143 14.146 -6.543 9.961 1.00 0.00 N ATOM 2082 CD2 HIS A 143 14.227 -7.759 11.827 1.00 0.00 C ATOM 2083 CE1 HIS A 143 15.107 -6.033 10.747 1.00 0.00 C ATOM 2084 NE2 HIS A 143 15.168 -6.753 11.880 1.00 0.00 N ATOM 0 H HIS A 143 14.403 -9.878 9.392 1.00 0.00 H new ATOM 0 HA HIS A 143 11.894 -9.813 8.521 1.00 0.00 H new ATOM 0 HB2 HIS A 143 11.540 -7.945 10.179 1.00 0.00 H new ATOM 0 HB3 HIS A 143 12.375 -9.354 10.802 1.00 0.00 H new ATOM 0 HD1 HIS A 143 13.874 -6.198 9.040 1.00 0.00 H new ATOM 0 HD2 HIS A 143 14.033 -8.505 12.583 1.00 0.00 H new ATOM 0 HE1 HIS A 143 15.729 -5.183 10.508 1.00 0.00 H new ATOM 2093 N ILE A 144 11.157 -7.872 7.192 1.00 0.00 N ATOM 2094 CA ILE A 144 10.702 -6.816 6.319 1.00 0.00 C ATOM 2095 C ILE A 144 10.390 -5.650 7.250 1.00 0.00 C ATOM 2096 O ILE A 144 9.505 -5.761 8.098 1.00 0.00 O ATOM 2097 CB ILE A 144 9.480 -7.283 5.508 1.00 0.00 C ATOM 2098 CG1 ILE A 144 9.782 -8.394 4.485 1.00 0.00 C ATOM 2099 CG2 ILE A 144 8.862 -6.117 4.738 1.00 0.00 C ATOM 2100 CD1 ILE A 144 10.047 -9.785 5.049 1.00 0.00 C ATOM 0 H ILE A 144 10.443 -8.571 7.397 1.00 0.00 H new ATOM 0 HA ILE A 144 11.442 -6.524 5.574 1.00 0.00 H new ATOM 0 HB ILE A 144 8.797 -7.686 6.256 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.941 -8.460 3.795 1.00 0.00 H new ATOM 0 HG13 ILE A 144 10.651 -8.092 3.900 1.00 0.00 H new ATOM 0 HG21 ILE A 144 8.000 -6.471 4.172 1.00 0.00 H new ATOM 0 HG22 ILE A 144 8.544 -5.346 5.439 1.00 0.00 H new ATOM 0 HG23 ILE A 144 9.601 -5.702 4.052 1.00 0.00 H new ATOM 0 HD11 ILE A 144 10.246 -10.477 4.231 1.00 0.00 H new ATOM 0 HD12 ILE A 144 10.911 -9.750 5.713 1.00 0.00 H new ATOM 0 HD13 ILE A 144 9.174 -10.124 5.607 1.00 0.00 H new ATOM 2112 N ASN A 145 11.157 -4.579 7.083 1.00 0.00 N ATOM 2113 CA ASN A 145 11.059 -3.301 7.763 1.00 0.00 C ATOM 2114 C ASN A 145 11.351 -2.294 6.668 1.00 0.00 C ATOM 2115 O ASN A 145 12.482 -2.266 6.189 1.00 0.00 O ATOM 2116 CB ASN A 145 12.157 -3.185 8.839 1.00 0.00 C ATOM 2117 CG ASN A 145 11.757 -3.642 10.225 1.00 0.00 C ATOM 2118 OD1 ASN A 145 10.603 -3.923 10.502 1.00 0.00 O ATOM 2119 ND2 ASN A 145 12.715 -3.751 11.119 1.00 0.00 N ATOM 0 H ASN A 145 11.925 -4.587 6.412 1.00 0.00 H new ATOM 0 HA ASN A 145 10.095 -3.161 8.252 1.00 0.00 H new ATOM 0 HB2 ASN A 145 13.020 -3.768 8.518 1.00 0.00 H new ATOM 0 HB3 ASN A 145 12.478 -2.145 8.896 1.00 0.00 H new ATOM 0 HD21 ASN A 145 12.498 -4.075 12.062 1.00 0.00 H new ATOM 0 HD22 ASN A 145 13.675 -3.512 10.870 1.00 0.00 H new ATOM 2126 N ALA A 146 10.372 -1.513 6.220 1.00 0.00 N ATOM 2127 CA ALA A 146 10.594 -0.422 5.274 1.00 0.00 C ATOM 2128 C ALA A 146 9.854 0.809 5.771 1.00 0.00 C ATOM 2129 O ALA A 146 8.991 0.708 6.648 1.00 0.00 O ATOM 2130 CB ALA A 146 10.084 -0.787 3.882 1.00 0.00 C ATOM 0 H ALA A 146 9.398 -1.619 6.504 1.00 0.00 H new ATOM 0 HA ALA A 146 11.664 -0.228 5.205 1.00 0.00 H new ATOM 0 HB1 ALA A 146 10.263 0.044 3.200 1.00 0.00 H new ATOM 0 HB2 ALA A 146 10.610 -1.672 3.522 1.00 0.00 H new ATOM 0 HB3 ALA A 146 9.015 -0.994 3.929 1.00 0.00 H new ATOM 2136 N THR A 147 10.106 1.946 5.144 1.00 0.00 N ATOM 2137 CA THR A 147 9.511 3.230 5.446 1.00 0.00 C ATOM 2138 C THR A 147 9.342 3.983 4.125 1.00 0.00 C ATOM 2139 O THR A 147 10.219 3.934 3.258 1.00 0.00 O ATOM 2140 CB THR A 147 10.378 3.945 6.504 1.00 0.00 C ATOM 2141 OG1 THR A 147 9.949 5.273 6.717 1.00 0.00 O ATOM 2142 CG2 THR A 147 11.876 3.924 6.164 1.00 0.00 C ATOM 0 H THR A 147 10.768 1.997 4.369 1.00 0.00 H new ATOM 0 HA THR A 147 8.519 3.152 5.891 1.00 0.00 H new ATOM 0 HB THR A 147 10.244 3.379 7.426 1.00 0.00 H new ATOM 0 HG1 THR A 147 10.518 5.696 7.394 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.434 4.442 6.944 1.00 0.00 H new ATOM 0 HG22 THR A 147 12.219 2.892 6.097 1.00 0.00 H new ATOM 0 HG23 THR A 147 12.039 4.424 5.209 1.00 0.00 H new ATOM 2150 N ALA A 148 8.184 4.621 3.948 1.00 0.00 N ATOM 2151 CA ALA A 148 7.886 5.499 2.831 1.00 0.00 C ATOM 2152 C ALA A 148 6.764 6.450 3.236 1.00 0.00 C ATOM 2153 O ALA A 148 6.161 6.316 4.307 1.00 0.00 O ATOM 2154 CB ALA A 148 7.454 4.692 1.603 1.00 0.00 C ATOM 0 H ALA A 148 7.407 4.534 4.603 1.00 0.00 H new ATOM 0 HA ALA A 148 8.784 6.061 2.573 1.00 0.00 H new ATOM 0 HB1 ALA A 148 7.236 5.372 0.779 1.00 0.00 H new ATOM 0 HB2 ALA A 148 8.257 4.015 1.312 1.00 0.00 H new ATOM 0 HB3 ALA A 148 6.561 4.115 1.843 1.00 0.00 H new ATOM 2160 N THR A 149 6.450 7.377 2.340 1.00 0.00 N ATOM 2161 CA THR A 149 5.561 8.498 2.562 1.00 0.00 C ATOM 2162 C THR A 149 4.643 8.634 1.354 1.00 0.00 C ATOM 2163 O THR A 149 5.053 9.072 0.273 1.00 0.00 O ATOM 2164 CB THR A 149 6.397 9.753 2.852 1.00 0.00 C ATOM 2165 OG1 THR A 149 7.575 9.819 2.063 1.00 0.00 O ATOM 2166 CG2 THR A 149 6.849 9.720 4.311 1.00 0.00 C ATOM 0 H THR A 149 6.830 7.362 1.394 1.00 0.00 H new ATOM 0 HA THR A 149 4.922 8.346 3.432 1.00 0.00 H new ATOM 0 HB THR A 149 5.766 10.612 2.624 1.00 0.00 H new ATOM 0 HG1 THR A 149 7.386 9.479 1.163 1.00 0.00 H new ATOM 0 HG21 THR A 149 7.444 10.607 4.528 1.00 0.00 H new ATOM 0 HG22 THR A 149 5.975 9.701 4.962 1.00 0.00 H new ATOM 0 HG23 THR A 149 7.451 8.828 4.485 1.00 0.00 H new ATOM 2174 N PHE A 150 3.401 8.195 1.528 1.00 0.00 N ATOM 2175 CA PHE A 150 2.312 8.512 0.626 1.00 0.00 C ATOM 2176 C PHE A 150 1.810 9.904 0.993 1.00 0.00 C ATOM 2177 O PHE A 150 1.790 10.272 2.166 1.00 0.00 O ATOM 2178 CB PHE A 150 1.242 7.433 0.706 1.00 0.00 C ATOM 2179 CG PHE A 150 0.574 7.234 2.043 1.00 0.00 C ATOM 2180 CD1 PHE A 150 1.241 6.556 3.083 1.00 0.00 C ATOM 2181 CD2 PHE A 150 -0.750 7.665 2.222 1.00 0.00 C ATOM 2182 CE1 PHE A 150 0.560 6.240 4.267 1.00 0.00 C ATOM 2183 CE2 PHE A 150 -1.426 7.345 3.405 1.00 0.00 C ATOM 2184 CZ PHE A 150 -0.795 6.576 4.396 1.00 0.00 C ATOM 0 H PHE A 150 3.124 7.602 2.311 1.00 0.00 H new ATOM 0 HA PHE A 150 2.632 8.529 -0.416 1.00 0.00 H new ATOM 0 HB2 PHE A 150 0.470 7.665 -0.028 1.00 0.00 H new ATOM 0 HB3 PHE A 150 1.692 6.486 0.407 1.00 0.00 H new ATOM 0 HD1 PHE A 150 2.279 6.279 2.968 1.00 0.00 H new ATOM 0 HD2 PHE A 150 -1.244 8.240 1.452 1.00 0.00 H new ATOM 0 HE1 PHE A 150 1.076 5.741 5.074 1.00 0.00 H new ATOM 0 HE2 PHE A 150 -2.438 7.691 3.556 1.00 0.00 H new ATOM 0 HZ PHE A 150 -1.354 6.243 5.258 1.00 0.00 H new ATOM 2194 N THR A 151 1.428 10.689 -0.004 1.00 0.00 N ATOM 2195 CA THR A 151 0.995 12.063 0.170 1.00 0.00 C ATOM 2196 C THR A 151 -0.200 12.268 -0.752 1.00 0.00 C ATOM 2197 O THR A 151 -0.141 11.882 -1.922 1.00 0.00 O ATOM 2198 CB THR A 151 2.172 13.013 -0.131 1.00 0.00 C ATOM 2199 OG1 THR A 151 2.795 12.771 -1.381 1.00 0.00 O ATOM 2200 CG2 THR A 151 3.259 12.925 0.945 1.00 0.00 C ATOM 0 H THR A 151 1.411 10.380 -0.976 1.00 0.00 H new ATOM 0 HA THR A 151 0.687 12.281 1.193 1.00 0.00 H new ATOM 0 HB THR A 151 1.719 14.004 -0.149 1.00 0.00 H new ATOM 0 HG1 THR A 151 2.732 11.818 -1.599 1.00 0.00 H new ATOM 0 HG21 THR A 151 4.071 13.609 0.698 1.00 0.00 H new ATOM 0 HG22 THR A 151 2.837 13.198 1.912 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.644 11.906 0.991 1.00 0.00 H new ATOM 2208 N LEU A 152 -1.301 12.802 -0.225 1.00 0.00 N ATOM 2209 CA LEU A 152 -2.504 13.092 -0.982 1.00 0.00 C ATOM 2210 C LEU A 152 -2.573 14.610 -1.106 1.00 0.00 C ATOM 2211 O LEU A 152 -2.999 15.300 -0.183 1.00 0.00 O ATOM 2212 CB LEU A 152 -3.754 12.479 -0.312 1.00 0.00 C ATOM 2213 CG LEU A 152 -3.785 10.943 -0.110 1.00 0.00 C ATOM 2214 CD1 LEU A 152 -3.058 10.164 -1.220 1.00 0.00 C ATOM 2215 CD2 LEU A 152 -3.278 10.489 1.272 1.00 0.00 C ATOM 0 H LEU A 152 -1.377 13.048 0.762 1.00 0.00 H new ATOM 0 HA LEU A 152 -2.476 12.640 -1.973 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -3.874 12.948 0.665 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -4.623 12.756 -0.908 1.00 0.00 H new ATOM 0 HG LEU A 152 -4.845 10.697 -0.169 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -3.119 9.095 -1.015 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -3.527 10.376 -2.181 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -2.012 10.468 -1.252 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -3.329 9.402 1.339 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -2.246 10.812 1.405 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -3.900 10.931 2.051 1.00 0.00 H new ATOM 2227 N GLU A 153 -2.086 15.149 -2.223 1.00 0.00 N ATOM 2228 CA GLU A 153 -2.187 16.571 -2.516 1.00 0.00 C ATOM 2229 C GLU A 153 -3.605 16.814 -3.037 1.00 0.00 C ATOM 2230 O GLU A 153 -3.888 16.729 -4.234 1.00 0.00 O ATOM 2231 CB GLU A 153 -1.061 17.033 -3.471 1.00 0.00 C ATOM 2232 CG GLU A 153 -0.281 18.247 -2.931 1.00 0.00 C ATOM 2233 CD GLU A 153 -1.049 19.576 -2.976 1.00 0.00 C ATOM 2234 OE1 GLU A 153 -1.425 20.037 -4.080 1.00 0.00 O ATOM 2235 OE2 GLU A 153 -1.175 20.247 -1.921 1.00 0.00 O ATOM 0 H GLU A 153 -1.612 14.610 -2.947 1.00 0.00 H new ATOM 0 HA GLU A 153 -2.035 17.182 -1.626 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -0.369 16.207 -3.636 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -1.493 17.286 -4.439 1.00 0.00 H new ATOM 0 HG2 GLU A 153 0.009 18.046 -1.900 1.00 0.00 H new ATOM 0 HG3 GLU A 153 0.639 18.355 -3.506 1.00 0.00 H new ATOM 2242 N TYR A 154 -4.521 17.059 -2.100 1.00 0.00 N ATOM 2243 CA TYR A 154 -5.878 17.507 -2.380 1.00 0.00 C ATOM 2244 C TYR A 154 -5.821 18.819 -3.147 1.00 0.00 C ATOM 2245 O TYR A 154 -4.980 19.674 -2.836 1.00 0.00 O ATOM 2246 CB TYR A 154 -6.640 17.725 -1.070 1.00 0.00 C ATOM 2247 CG TYR A 154 -6.502 16.594 -0.075 1.00 0.00 C ATOM 2248 CD1 TYR A 154 -7.035 15.327 -0.373 1.00 0.00 C ATOM 2249 CD2 TYR A 154 -5.865 16.824 1.158 1.00 0.00 C ATOM 2250 CE1 TYR A 154 -6.933 14.286 0.566 1.00 0.00 C ATOM 2251 CE2 TYR A 154 -5.777 15.796 2.107 1.00 0.00 C ATOM 2252 CZ TYR A 154 -6.309 14.523 1.811 1.00 0.00 C ATOM 2253 OH TYR A 154 -6.289 13.553 2.755 1.00 0.00 O ATOM 0 H TYR A 154 -4.332 16.948 -1.104 1.00 0.00 H new ATOM 0 HA TYR A 154 -6.391 16.748 -2.971 1.00 0.00 H new ATOM 0 HB2 TYR A 154 -6.287 18.646 -0.607 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -7.697 17.867 -1.297 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -7.522 15.154 -1.322 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -5.443 17.794 1.374 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -7.330 13.308 0.336 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -5.304 15.978 3.061 1.00 0.00 H new ATOM 0 HH TYR A 154 -6.764 13.864 3.554 1.00 0.00 H new ATOM 2263 N GLN A 155 -6.727 19.011 -4.100 1.00 0.00 N ATOM 2264 CA GLN A 155 -6.925 20.310 -4.724 1.00 0.00 C ATOM 2265 C GLN A 155 -7.664 21.236 -3.748 1.00 0.00 C ATOM 2266 O GLN A 155 -8.229 20.806 -2.744 1.00 0.00 O ATOM 2267 CB GLN A 155 -7.555 20.202 -6.131 1.00 0.00 C ATOM 2268 CG GLN A 155 -8.428 18.977 -6.457 1.00 0.00 C ATOM 2269 CD GLN A 155 -9.854 19.085 -5.922 1.00 0.00 C ATOM 2270 OE1 GLN A 155 -10.102 19.093 -4.717 1.00 0.00 O ATOM 2271 NE2 GLN A 155 -10.818 19.170 -6.819 1.00 0.00 N ATOM 0 H GLN A 155 -7.338 18.277 -4.457 1.00 0.00 H new ATOM 0 HA GLN A 155 -5.958 20.772 -4.922 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -8.162 21.093 -6.291 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -6.745 20.234 -6.859 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -8.463 18.843 -7.538 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -7.959 18.085 -6.041 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -10.591 19.162 -7.813 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -11.790 19.244 -6.518 1.00 0.00 H new ATOM 2463 N ASP A 167 3.666 13.756 6.663 1.00 0.00 N ATOM 2464 CA ASP A 167 4.395 12.492 6.699 1.00 0.00 C ATOM 2465 C ASP A 167 3.418 11.378 7.072 1.00 0.00 C ATOM 2466 O ASP A 167 3.370 10.974 8.230 1.00 0.00 O ATOM 2467 CB ASP A 167 5.550 12.600 7.706 1.00 0.00 C ATOM 2468 CG ASP A 167 6.512 11.416 7.665 1.00 0.00 C ATOM 2469 OD1 ASP A 167 6.321 10.408 8.374 1.00 0.00 O ATOM 2470 OD2 ASP A 167 7.557 11.562 6.989 1.00 0.00 O ATOM 0 HA ASP A 167 4.826 12.261 5.725 1.00 0.00 H new ATOM 0 HB2 ASP A 167 6.107 13.516 7.510 1.00 0.00 H new ATOM 0 HB3 ASP A 167 5.137 12.687 8.711 1.00 0.00 H new ATOM 2475 N SER A 168 2.595 10.913 6.127 1.00 0.00 N ATOM 2476 CA SER A 168 1.848 9.680 6.340 1.00 0.00 C ATOM 2477 C SER A 168 2.847 8.519 6.284 1.00 0.00 C ATOM 2478 O SER A 168 3.223 8.058 5.202 1.00 0.00 O ATOM 2479 CB SER A 168 0.719 9.495 5.336 1.00 0.00 C ATOM 2480 OG SER A 168 -0.298 10.469 5.483 1.00 0.00 O ATOM 0 H SER A 168 2.434 11.364 5.226 1.00 0.00 H new ATOM 0 HA SER A 168 1.359 9.718 7.314 1.00 0.00 H new ATOM 0 HB2 SER A 168 1.123 9.545 4.325 1.00 0.00 H new ATOM 0 HB3 SER A 168 0.287 8.502 5.457 1.00 0.00 H new ATOM 0 HG SER A 168 -1.000 10.312 4.817 1.00 0.00 H new ATOM 2486 N THR A 169 3.345 8.122 7.448 1.00 0.00 N ATOM 2487 CA THR A 169 4.380 7.132 7.645 1.00 0.00 C ATOM 2488 C THR A 169 3.805 5.744 7.303 1.00 0.00 C ATOM 2489 O THR A 169 2.958 5.219 8.030 1.00 0.00 O ATOM 2490 CB THR A 169 4.873 7.236 9.105 1.00 0.00 C ATOM 2491 OG1 THR A 169 4.853 8.557 9.633 1.00 0.00 O ATOM 2492 CG2 THR A 169 6.307 6.748 9.255 1.00 0.00 C ATOM 0 H THR A 169 3.012 8.511 8.330 1.00 0.00 H new ATOM 0 HA THR A 169 5.237 7.297 6.992 1.00 0.00 H new ATOM 0 HB THR A 169 4.169 6.611 9.655 1.00 0.00 H new ATOM 0 HG1 THR A 169 5.191 9.184 8.959 1.00 0.00 H new ATOM 0 HG21 THR A 169 6.615 6.838 10.297 1.00 0.00 H new ATOM 0 HG22 THR A 169 6.370 5.704 8.947 1.00 0.00 H new ATOM 0 HG23 THR A 169 6.964 7.352 8.629 1.00 0.00 H new ATOM 2500 N ILE A 170 4.226 5.158 6.178 1.00 0.00 N ATOM 2501 CA ILE A 170 3.956 3.768 5.810 1.00 0.00 C ATOM 2502 C ILE A 170 5.081 2.952 6.459 1.00 0.00 C ATOM 2503 O ILE A 170 6.259 3.230 6.231 1.00 0.00 O ATOM 2504 CB ILE A 170 3.827 3.668 4.254 1.00 0.00 C ATOM 2505 CG1 ILE A 170 2.382 3.343 3.804 1.00 0.00 C ATOM 2506 CG2 ILE A 170 4.826 2.768 3.509 1.00 0.00 C ATOM 2507 CD1 ILE A 170 2.038 1.872 3.546 1.00 0.00 C ATOM 0 H ILE A 170 4.780 5.653 5.479 1.00 0.00 H new ATOM 0 HA ILE A 170 3.010 3.367 6.172 1.00 0.00 H new ATOM 0 HB ILE A 170 4.105 4.678 3.951 1.00 0.00 H new ATOM 0 HG12 ILE A 170 1.699 3.720 4.565 1.00 0.00 H new ATOM 0 HG13 ILE A 170 2.180 3.902 2.890 1.00 0.00 H new ATOM 0 HG21 ILE A 170 4.615 2.797 2.440 1.00 0.00 H new ATOM 0 HG22 ILE A 170 5.840 3.124 3.689 1.00 0.00 H new ATOM 0 HG23 ILE A 170 4.732 1.744 3.869 1.00 0.00 H new ATOM 0 HD11 ILE A 170 0.996 1.791 3.238 1.00 0.00 H new ATOM 0 HD12 ILE A 170 2.681 1.481 2.757 1.00 0.00 H new ATOM 0 HD13 ILE A 170 2.192 1.297 4.459 1.00 0.00 H new ATOM 2519 N THR A 171 4.763 1.972 7.301 1.00 0.00 N ATOM 2520 CA THR A 171 5.695 1.037 7.917 1.00 0.00 C ATOM 2521 C THR A 171 5.132 -0.384 7.841 1.00 0.00 C ATOM 2522 O THR A 171 4.442 -0.886 8.734 1.00 0.00 O ATOM 2523 CB THR A 171 6.086 1.524 9.315 1.00 0.00 C ATOM 2524 OG1 THR A 171 6.624 2.832 9.204 1.00 0.00 O ATOM 2525 CG2 THR A 171 7.154 0.619 9.939 1.00 0.00 C ATOM 0 H THR A 171 3.798 1.802 7.585 1.00 0.00 H new ATOM 0 HA THR A 171 6.635 0.998 7.367 1.00 0.00 H new ATOM 0 HB THR A 171 5.198 1.509 9.947 1.00 0.00 H new ATOM 0 HG1 THR A 171 6.878 3.158 10.093 1.00 0.00 H new ATOM 0 HG21 THR A 171 7.411 0.990 10.931 1.00 0.00 H new ATOM 0 HG22 THR A 171 6.768 -0.397 10.021 1.00 0.00 H new ATOM 0 HG23 THR A 171 8.044 0.619 9.310 1.00 0.00 H new ATOM 2533 N ILE A 172 5.419 -1.026 6.710 1.00 0.00 N ATOM 2534 CA ILE A 172 4.968 -2.363 6.389 1.00 0.00 C ATOM 2535 C ILE A 172 5.873 -3.368 7.113 1.00 0.00 C ATOM 2536 O ILE A 172 7.098 -3.323 6.974 1.00 0.00 O ATOM 2537 CB ILE A 172 4.905 -2.525 4.853 1.00 0.00 C ATOM 2538 CG1 ILE A 172 3.872 -1.512 4.294 1.00 0.00 C ATOM 2539 CG2 ILE A 172 4.564 -3.979 4.483 1.00 0.00 C ATOM 2540 CD1 ILE A 172 3.752 -1.521 2.790 1.00 0.00 C ATOM 0 H ILE A 172 5.990 -0.610 5.974 1.00 0.00 H new ATOM 0 HA ILE A 172 3.955 -2.556 6.742 1.00 0.00 H new ATOM 0 HB ILE A 172 5.875 -2.311 4.403 1.00 0.00 H new ATOM 0 HG12 ILE A 172 2.895 -1.729 4.727 1.00 0.00 H new ATOM 0 HG13 ILE A 172 4.149 -0.509 4.620 1.00 0.00 H new ATOM 0 HG21 ILE A 172 4.523 -4.078 3.398 1.00 0.00 H new ATOM 0 HG22 ILE A 172 5.331 -4.645 4.880 1.00 0.00 H new ATOM 0 HG23 ILE A 172 3.597 -4.245 4.909 1.00 0.00 H new ATOM 0 HD11 ILE A 172 3.010 -0.785 2.480 1.00 0.00 H new ATOM 0 HD12 ILE A 172 4.716 -1.273 2.347 1.00 0.00 H new ATOM 0 HD13 ILE A 172 3.443 -2.511 2.456 1.00 0.00 H new ATOM 2552 N ARG A 173 5.263 -4.260 7.900 1.00 0.00 N ATOM 2553 CA ARG A 173 5.932 -5.340 8.624 1.00 0.00 C ATOM 2554 C ARG A 173 6.028 -6.560 7.724 1.00 0.00 C ATOM 2555 O ARG A 173 5.165 -6.798 6.875 1.00 0.00 O ATOM 2556 CB ARG A 173 5.106 -5.785 9.853 1.00 0.00 C ATOM 2557 CG ARG A 173 4.668 -4.684 10.823 1.00 0.00 C ATOM 2558 CD ARG A 173 5.804 -4.107 11.682 1.00 0.00 C ATOM 2559 NE ARG A 173 6.356 -5.133 12.593 1.00 0.00 N ATOM 2560 CZ ARG A 173 7.615 -5.585 12.607 1.00 0.00 C ATOM 2561 NH1 ARG A 173 8.581 -4.922 12.007 1.00 0.00 N ATOM 2562 NH2 ARG A 173 7.911 -6.725 13.207 1.00 0.00 N ATOM 0 H ARG A 173 4.255 -4.247 8.054 1.00 0.00 H new ATOM 0 HA ARG A 173 6.910 -4.969 8.932 1.00 0.00 H new ATOM 0 HB2 ARG A 173 4.213 -6.298 9.495 1.00 0.00 H new ATOM 0 HB3 ARG A 173 5.692 -6.516 10.410 1.00 0.00 H new ATOM 0 HG2 ARG A 173 4.213 -3.874 10.253 1.00 0.00 H new ATOM 0 HG3 ARG A 173 3.897 -5.083 11.482 1.00 0.00 H new ATOM 0 HD2 ARG A 173 6.595 -3.726 11.036 1.00 0.00 H new ATOM 0 HD3 ARG A 173 5.432 -3.263 12.263 1.00 0.00 H new ATOM 0 HE ARG A 173 5.715 -5.535 13.277 1.00 0.00 H new ATOM 0 HH11 ARG A 173 8.375 -4.049 11.521 1.00 0.00 H new ATOM 0 HH12 ARG A 173 9.535 -5.281 12.028 1.00 0.00 H new ATOM 0 HH21 ARG A 173 7.177 -7.267 13.664 1.00 0.00 H new ATOM 0 HH22 ARG A 173 8.873 -7.063 13.213 1.00 0.00 H new ATOM 2576 N GLY A 174 6.935 -7.465 8.052 1.00 0.00 N ATOM 2577 CA GLY A 174 6.899 -8.839 7.589 1.00 0.00 C ATOM 2578 C GLY A 174 8.089 -9.583 8.146 1.00 0.00 C ATOM 2579 O GLY A 174 8.960 -9.004 8.801 1.00 0.00 O ATOM 0 H GLY A 174 7.730 -7.260 8.658 1.00 0.00 H new ATOM 0 HA2 GLY A 174 5.974 -9.318 7.908 1.00 0.00 H new ATOM 0 HA3 GLY A 174 6.914 -8.869 6.500 1.00 0.00 H new ATOM 2583 N TYR A 175 8.159 -10.876 7.865 1.00 0.00 N ATOM 2584 CA TYR A 175 9.272 -11.693 8.304 1.00 0.00 C ATOM 2585 C TYR A 175 9.433 -12.751 7.247 1.00 0.00 C ATOM 2586 O TYR A 175 8.457 -13.415 6.915 1.00 0.00 O ATOM 2587 CB TYR A 175 8.969 -12.310 9.674 1.00 0.00 C ATOM 2588 CG TYR A 175 10.019 -13.276 10.193 1.00 0.00 C ATOM 2589 CD1 TYR A 175 11.366 -12.887 10.346 1.00 0.00 C ATOM 2590 CD2 TYR A 175 9.629 -14.573 10.566 1.00 0.00 C ATOM 2591 CE1 TYR A 175 12.308 -13.787 10.887 1.00 0.00 C ATOM 2592 CE2 TYR A 175 10.560 -15.470 11.103 1.00 0.00 C ATOM 2593 CZ TYR A 175 11.903 -15.083 11.285 1.00 0.00 C ATOM 2594 OH TYR A 175 12.777 -15.945 11.878 1.00 0.00 O ATOM 0 H TYR A 175 7.451 -11.381 7.331 1.00 0.00 H new ATOM 0 HA TYR A 175 10.188 -11.115 8.423 1.00 0.00 H new ATOM 0 HB2 TYR A 175 8.849 -11.505 10.399 1.00 0.00 H new ATOM 0 HB3 TYR A 175 8.014 -12.832 9.616 1.00 0.00 H new ATOM 0 HD1 TYR A 175 11.677 -11.897 10.048 1.00 0.00 H new ATOM 0 HD2 TYR A 175 8.602 -14.881 10.437 1.00 0.00 H new ATOM 0 HE1 TYR A 175 13.339 -13.486 10.998 1.00 0.00 H new ATOM 0 HE2 TYR A 175 10.247 -16.466 11.380 1.00 0.00 H new ATOM 0 HH TYR A 175 12.319 -16.787 12.082 1.00 0.00 H new ATOM 2604 N VAL A 176 10.616 -12.838 6.656 1.00 0.00 N ATOM 2605 CA VAL A 176 11.020 -13.999 5.890 1.00 0.00 C ATOM 2606 C VAL A 176 11.479 -15.030 6.904 1.00 0.00 C ATOM 2607 O VAL A 176 12.430 -14.803 7.648 1.00 0.00 O ATOM 2608 CB VAL A 176 12.137 -13.685 4.880 1.00 0.00 C ATOM 2609 CG1 VAL A 176 11.615 -13.138 3.561 1.00 0.00 C ATOM 2610 CG2 VAL A 176 13.080 -12.622 5.385 1.00 0.00 C ATOM 0 H VAL A 176 11.321 -12.102 6.697 1.00 0.00 H new ATOM 0 HA VAL A 176 10.186 -14.362 5.289 1.00 0.00 H new ATOM 0 HB VAL A 176 12.633 -14.646 4.742 1.00 0.00 H new ATOM 0 HG11 VAL A 176 12.453 -12.937 2.893 1.00 0.00 H new ATOM 0 HG12 VAL A 176 10.951 -13.870 3.101 1.00 0.00 H new ATOM 0 HG13 VAL A 176 11.066 -12.214 3.742 1.00 0.00 H new ATOM 0 HG21 VAL A 176 13.851 -12.435 4.638 1.00 0.00 H new ATOM 0 HG22 VAL A 176 12.525 -11.703 5.572 1.00 0.00 H new ATOM 0 HG23 VAL A 176 13.546 -12.959 6.311 1.00 0.00 H new ATOM 2620 N ARG A 177 10.834 -16.181 6.865 1.00 0.00 N ATOM 2621 CA ARG A 177 11.312 -17.366 7.541 1.00 0.00 C ATOM 2622 C ARG A 177 12.428 -17.928 6.681 1.00 0.00 C ATOM 2623 O ARG A 177 12.291 -17.937 5.459 1.00 0.00 O ATOM 2624 CB ARG A 177 10.199 -18.412 7.508 1.00 0.00 C ATOM 2625 CG ARG A 177 8.832 -17.966 8.027 1.00 0.00 C ATOM 2626 CD ARG A 177 8.582 -18.458 9.452 1.00 0.00 C ATOM 2627 NE ARG A 177 7.200 -18.909 9.585 1.00 0.00 N ATOM 2628 CZ ARG A 177 6.693 -20.049 9.108 1.00 0.00 C ATOM 2629 NH1 ARG A 177 7.440 -20.926 8.430 1.00 0.00 N ATOM 2630 NH2 ARG A 177 5.419 -20.318 9.345 1.00 0.00 N ATOM 0 H ARG A 177 9.959 -16.318 6.360 1.00 0.00 H new ATOM 0 HA ARG A 177 11.624 -17.139 8.560 1.00 0.00 H new ATOM 0 HB2 ARG A 177 10.080 -18.752 6.479 1.00 0.00 H new ATOM 0 HB3 ARG A 177 10.522 -19.273 8.093 1.00 0.00 H new ATOM 0 HG2 ARG A 177 8.770 -16.878 8.001 1.00 0.00 H new ATOM 0 HG3 ARG A 177 8.051 -18.346 7.368 1.00 0.00 H new ATOM 0 HD2 ARG A 177 9.265 -19.274 9.690 1.00 0.00 H new ATOM 0 HD3 ARG A 177 8.783 -17.657 10.163 1.00 0.00 H new ATOM 0 HE ARG A 177 6.561 -18.295 10.090 1.00 0.00 H new ATOM 0 HH11 ARG A 177 8.428 -20.733 8.264 1.00 0.00 H new ATOM 0 HH12 ARG A 177 7.022 -21.788 8.079 1.00 0.00 H new ATOM 0 HH21 ARG A 177 4.850 -19.662 9.880 1.00 0.00 H new ATOM 0 HH22 ARG A 177 5.006 -21.181 8.992 1.00 0.00 H new ATOM 2644 N ASP A 178 13.513 -18.420 7.260 1.00 0.00 N ATOM 2645 CA ASP A 178 14.517 -19.122 6.464 1.00 0.00 C ATOM 2646 C ASP A 178 14.000 -20.468 5.928 1.00 0.00 C ATOM 2647 O ASP A 178 14.531 -20.964 4.934 1.00 0.00 O ATOM 2648 CB ASP A 178 15.857 -19.196 7.198 1.00 0.00 C ATOM 2649 CG ASP A 178 16.161 -20.537 7.859 1.00 0.00 C ATOM 2650 OD1 ASP A 178 15.418 -20.932 8.786 1.00 0.00 O ATOM 2651 OD2 ASP A 178 17.243 -21.095 7.561 1.00 0.00 O ATOM 0 H ASP A 178 13.722 -18.351 8.256 1.00 0.00 H new ATOM 0 HA ASP A 178 14.712 -18.534 5.567 1.00 0.00 H new ATOM 0 HB2 ASP A 178 16.654 -18.969 6.490 1.00 0.00 H new ATOM 0 HB3 ASP A 178 15.878 -18.419 7.962 1.00 0.00 H new ATOM 2656 N ASN A 179 12.887 -20.971 6.479 1.00 0.00 N ATOM 2657 CA ASN A 179 11.949 -21.873 5.824 1.00 0.00 C ATOM 2658 C ASN A 179 10.543 -21.561 6.306 1.00 0.00 C ATOM 2659 O ASN A 179 10.288 -21.598 7.530 1.00 0.00 O ATOM 2660 CB ASN A 179 12.267 -23.356 6.078 1.00 0.00 C ATOM 2661 CG ASN A 179 11.342 -24.297 5.303 1.00 0.00 C ATOM 2662 OD1 ASN A 179 10.520 -23.806 4.386 1.00 0.00 O flip ATOM 2663 ND2 ASN A 179 11.397 -25.512 5.467 1.00 0.00 N flip ATOM 0 H ASN A 179 12.610 -20.747 7.435 1.00 0.00 H new ATOM 0 HA ASN A 179 12.036 -21.712 4.749 1.00 0.00 H new ATOM 0 HB2 ASN A 179 13.301 -23.556 5.796 1.00 0.00 H new ATOM 0 HB3 ASN A 179 12.181 -23.565 7.144 1.00 0.00 H new ATOM 0 HD21 ASN A 179 12.025 -25.904 6.169 1.00 0.00 H new ATOM 0 HD22 ASN A 179 10.815 -26.130 4.901 1.00 0.00 H new