USER MOD reduce.3.24.130724 H: found=0, std=0, add=419, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 421 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 Single : B 101 TYR OH : rot 180:sc= 0 USER MOD Single : B 103 TYR OH : rot 134:sc= 0.416 USER MOD Single : B 107 THR OG1 : rot 180:sc= 0.367 USER MOD Single : B 112 SER OG : rot 180:sc= 0 USER MOD Single : B 114 HIS : no HD1:sc= 0 X(o=0,f=-0.068) USER MOD Single : B 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 123 ASN : amide:sc= -0.0764 K(o=-0.076,f=-3.2!) USER MOD Single : B 124 SER OG : rot 118:sc= 1.64 USER MOD Single : B 134 SER OG : rot 84:sc= 0.366 USER MOD Single : B 136 THR OG1 : rot 180:sc= 0 USER MOD Single : B 137 THR OG1 : rot 180:sc= -0.667 USER MOD Single : B 140 THR OG1 : rot 180:sc= -0.777 USER MOD Single : B 142 TYR OH : rot 180:sc= 0 USER MOD Single : B 145 SER OG : rot -122:sc= 0.908 USER MOD Single : B 146 ASN : amide:sc= -0.413 X(o=-0.41,f=-0.41) USER MOD Single : B 147 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N LEU A 95 -10.746 -0.597 -21.184 1.00 0.00 N ATOM 70 CA LEU A 95 -10.351 -1.936 -20.663 1.00 0.00 C ATOM 71 C LEU A 95 -8.820 -2.037 -20.612 1.00 0.00 C ATOM 72 O LEU A 95 -8.189 -2.309 -21.614 1.00 0.00 O ATOM 73 CB LEU A 95 -10.903 -3.023 -21.585 1.00 0.00 C ATOM 74 CG LEU A 95 -11.734 -4.012 -20.767 1.00 0.00 C ATOM 75 CD1 LEU A 95 -12.213 -5.149 -21.671 1.00 0.00 C ATOM 76 CD2 LEU A 95 -10.872 -4.585 -19.638 1.00 0.00 C ATOM 0 HA LEU A 95 -10.756 -2.069 -19.660 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -11.517 -2.575 -22.366 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -10.084 -3.543 -22.082 1.00 0.00 H new ATOM 0 HG LEU A 95 -12.598 -3.499 -20.343 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -12.805 -5.853 -21.087 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -12.824 -4.741 -22.476 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -11.351 -5.664 -22.095 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -11.461 -5.291 -19.053 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -10.009 -5.098 -20.063 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.531 -3.775 -18.994 1.00 0.00 H new ATOM 88 N PRO A 96 -8.267 -1.813 -19.443 1.00 0.00 N ATOM 89 CA PRO A 96 -6.807 -1.874 -19.240 1.00 0.00 C ATOM 90 C PRO A 96 -6.292 -3.289 -19.514 1.00 0.00 C ATOM 91 O PRO A 96 -6.973 -4.108 -20.096 1.00 0.00 O ATOM 92 CB PRO A 96 -6.601 -1.511 -17.761 1.00 0.00 C ATOM 93 CG PRO A 96 -7.997 -1.258 -17.137 1.00 0.00 C ATOM 94 CD PRO A 96 -9.047 -1.480 -18.237 1.00 0.00 C ATOM 0 HA PRO A 96 -6.269 -1.203 -19.910 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -6.089 -2.318 -17.237 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -5.975 -0.624 -17.669 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -8.170 -1.935 -16.300 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -8.063 -0.243 -16.745 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.731 -2.287 -17.973 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -9.652 -0.587 -18.392 1.00 0.00 H new ATOM 238 N LEU B 86 -19.103 -8.494 -3.069 1.00 0.00 N ATOM 239 CA LEU B 86 -17.889 -7.696 -2.735 1.00 0.00 C ATOM 240 C LEU B 86 -16.833 -7.900 -3.824 1.00 0.00 C ATOM 241 O LEU B 86 -16.473 -9.013 -4.150 1.00 0.00 O ATOM 242 CB LEU B 86 -17.327 -8.164 -1.392 1.00 0.00 C ATOM 243 CG LEU B 86 -17.562 -7.087 -0.332 1.00 0.00 C ATOM 244 CD1 LEU B 86 -16.952 -5.766 -0.803 1.00 0.00 C ATOM 245 CD2 LEU B 86 -19.067 -6.906 -0.117 1.00 0.00 C ATOM 0 HA LEU B 86 -18.152 -6.640 -2.673 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -17.807 -9.095 -1.091 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -16.261 -8.370 -1.485 1.00 0.00 H new ATOM 0 HG LEU B 86 -17.094 -7.389 0.605 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -17.119 -4.998 -0.048 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -15.881 -5.895 -0.958 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -17.420 -5.462 -1.739 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -19.237 -6.139 0.638 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -19.535 -6.603 -1.054 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -19.503 -7.847 0.218 1.00 0.00 H new ATOM 257 N PHE B 87 -16.334 -6.835 -4.389 1.00 0.00 N ATOM 258 CA PHE B 87 -15.301 -6.974 -5.454 1.00 0.00 C ATOM 259 C PHE B 87 -14.128 -6.042 -5.155 1.00 0.00 C ATOM 260 O PHE B 87 -14.304 -4.866 -4.903 1.00 0.00 O ATOM 261 CB PHE B 87 -15.907 -6.605 -6.810 1.00 0.00 C ATOM 262 CG PHE B 87 -17.007 -7.579 -7.152 1.00 0.00 C ATOM 263 CD1 PHE B 87 -18.160 -7.641 -6.360 1.00 0.00 C ATOM 264 CD2 PHE B 87 -16.876 -8.418 -8.265 1.00 0.00 C ATOM 265 CE1 PHE B 87 -19.180 -8.544 -6.680 1.00 0.00 C ATOM 266 CE2 PHE B 87 -17.897 -9.320 -8.585 1.00 0.00 C ATOM 267 CZ PHE B 87 -19.049 -9.383 -7.793 1.00 0.00 C ATOM 0 H PHE B 87 -16.596 -5.876 -4.160 1.00 0.00 H new ATOM 0 HA PHE B 87 -14.950 -8.006 -5.481 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -16.302 -5.590 -6.779 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -15.137 -6.624 -7.581 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -18.262 -6.992 -5.503 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -15.987 -8.369 -8.877 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -20.069 -8.594 -6.068 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -17.796 -9.968 -9.443 1.00 0.00 H new ATOM 0 HZ PHE B 87 -19.837 -10.079 -8.040 1.00 0.00 H new ATOM 277 N VAL B 88 -12.930 -6.555 -5.189 1.00 0.00 N ATOM 278 CA VAL B 88 -11.744 -5.697 -4.913 1.00 0.00 C ATOM 279 C VAL B 88 -11.029 -5.387 -6.229 1.00 0.00 C ATOM 280 O VAL B 88 -11.181 -6.090 -7.210 1.00 0.00 O ATOM 281 CB VAL B 88 -10.784 -6.431 -3.975 1.00 0.00 C ATOM 282 CG1 VAL B 88 -9.980 -5.410 -3.169 1.00 0.00 C ATOM 283 CG2 VAL B 88 -11.581 -7.321 -3.019 1.00 0.00 C ATOM 0 H VAL B 88 -12.721 -7.532 -5.396 1.00 0.00 H new ATOM 0 HA VAL B 88 -12.069 -4.769 -4.442 1.00 0.00 H new ATOM 0 HB VAL B 88 -10.105 -7.048 -4.563 1.00 0.00 H new ATOM 0 HG11 VAL B 88 -9.296 -5.932 -2.500 1.00 0.00 H new ATOM 0 HG12 VAL B 88 -9.410 -4.777 -3.849 1.00 0.00 H new ATOM 0 HG13 VAL B 88 -10.660 -4.793 -2.582 1.00 0.00 H new ATOM 0 HG21 VAL B 88 -10.896 -7.843 -2.351 1.00 0.00 H new ATOM 0 HG22 VAL B 88 -12.262 -6.705 -2.431 1.00 0.00 H new ATOM 0 HG23 VAL B 88 -12.154 -8.049 -3.593 1.00 0.00 H new ATOM 293 N ALA B 89 -10.248 -4.342 -6.253 1.00 0.00 N ATOM 294 CA ALA B 89 -9.517 -3.984 -7.499 1.00 0.00 C ATOM 295 C ALA B 89 -8.218 -4.790 -7.567 1.00 0.00 C ATOM 296 O ALA B 89 -7.350 -4.659 -6.727 1.00 0.00 O ATOM 297 CB ALA B 89 -9.197 -2.488 -7.492 1.00 0.00 C ATOM 0 H ALA B 89 -10.085 -3.720 -5.461 1.00 0.00 H new ATOM 0 HA ALA B 89 -10.134 -4.213 -8.367 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -8.662 -2.226 -8.405 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -10.124 -1.918 -7.439 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -8.577 -2.253 -6.627 1.00 0.00 H new ATOM 303 N LEU B 100 -8.087 -5.633 -8.553 1.00 0.00 N ATOM 304 CA LEU B 100 -6.853 -6.461 -8.670 1.00 0.00 C ATOM 305 C LEU B 100 -5.713 -5.629 -9.263 1.00 0.00 C ATOM 306 O LEU B 100 -4.598 -6.094 -9.389 1.00 0.00 O ATOM 307 CB LEU B 100 -7.136 -7.655 -9.580 1.00 0.00 C ATOM 308 CG LEU B 100 -8.420 -8.347 -9.123 1.00 0.00 C ATOM 309 CD1 LEU B 100 -9.122 -8.970 -10.329 1.00 0.00 C ATOM 310 CD2 LEU B 100 -8.075 -9.442 -8.111 1.00 0.00 C ATOM 0 H LEU B 100 -8.782 -5.785 -9.284 1.00 0.00 H new ATOM 0 HA LEU B 100 -6.559 -6.809 -7.680 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -7.236 -7.323 -10.613 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -6.301 -8.355 -9.550 1.00 0.00 H new ATOM 0 HG LEU B 100 -9.081 -7.616 -8.657 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -10.037 -9.463 -10.002 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -9.367 -8.190 -11.050 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -8.463 -9.701 -10.796 1.00 0.00 H new ATOM 0 HD21 LEU B 100 -8.990 -9.937 -7.784 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -7.414 -10.173 -8.577 1.00 0.00 H new ATOM 0 HD23 LEU B 100 -7.575 -8.998 -7.250 1.00 0.00 H new ATOM 322 N TYR B 101 -5.978 -4.405 -9.629 1.00 0.00 N ATOM 323 CA TYR B 101 -4.896 -3.560 -10.212 1.00 0.00 C ATOM 324 C TYR B 101 -5.249 -2.080 -10.048 1.00 0.00 C ATOM 325 O TYR B 101 -6.404 -1.703 -10.026 1.00 0.00 O ATOM 326 CB TYR B 101 -4.734 -3.891 -11.697 1.00 0.00 C ATOM 327 CG TYR B 101 -4.196 -5.295 -11.839 1.00 0.00 C ATOM 328 CD1 TYR B 101 -2.914 -5.605 -11.366 1.00 0.00 C ATOM 329 CD2 TYR B 101 -4.978 -6.288 -12.439 1.00 0.00 C ATOM 330 CE1 TYR B 101 -2.417 -6.908 -11.494 1.00 0.00 C ATOM 331 CE2 TYR B 101 -4.481 -7.590 -12.567 1.00 0.00 C ATOM 332 CZ TYR B 101 -3.200 -7.900 -12.094 1.00 0.00 C ATOM 333 OH TYR B 101 -2.712 -9.185 -12.219 1.00 0.00 O ATOM 0 H TYR B 101 -6.890 -3.955 -9.551 1.00 0.00 H new ATOM 0 HA TYR B 101 -3.960 -3.763 -9.692 1.00 0.00 H new ATOM 0 HB2 TYR B 101 -5.693 -3.803 -12.208 1.00 0.00 H new ATOM 0 HB3 TYR B 101 -4.056 -3.180 -12.168 1.00 0.00 H new ATOM 0 HD1 TYR B 101 -2.309 -4.839 -10.903 1.00 0.00 H new ATOM 0 HD2 TYR B 101 -5.966 -6.050 -12.804 1.00 0.00 H new ATOM 0 HE1 TYR B 101 -1.429 -7.147 -11.129 1.00 0.00 H new ATOM 0 HE2 TYR B 101 -5.085 -8.356 -13.031 1.00 0.00 H new ATOM 0 HH TYR B 101 -3.383 -9.749 -12.657 1.00 0.00 H new ATOM 343 N ASP B 102 -4.257 -1.240 -9.927 1.00 0.00 N ATOM 344 CA ASP B 102 -4.521 0.217 -9.756 1.00 0.00 C ATOM 345 C ASP B 102 -5.127 0.788 -11.041 1.00 0.00 C ATOM 346 O ASP B 102 -5.063 0.182 -12.092 1.00 0.00 O ATOM 347 CB ASP B 102 -3.205 0.937 -9.452 1.00 0.00 C ATOM 348 CG ASP B 102 -2.242 0.767 -10.630 1.00 0.00 C ATOM 349 OD1 ASP B 102 -1.957 -0.367 -10.976 1.00 0.00 O ATOM 350 OD2 ASP B 102 -1.807 1.774 -11.164 1.00 0.00 O ATOM 0 H ASP B 102 -3.271 -1.502 -9.939 1.00 0.00 H new ATOM 0 HA ASP B 102 -5.220 0.363 -8.933 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -3.391 1.996 -9.272 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -2.759 0.532 -8.543 1.00 0.00 H new ATOM 355 N TYR B 103 -5.712 1.953 -10.962 1.00 0.00 N ATOM 356 CA TYR B 103 -6.320 2.568 -12.175 1.00 0.00 C ATOM 357 C TYR B 103 -6.497 4.071 -11.951 1.00 0.00 C ATOM 358 O TYR B 103 -7.048 4.500 -10.956 1.00 0.00 O ATOM 359 CB TYR B 103 -7.686 1.933 -12.442 1.00 0.00 C ATOM 360 CG TYR B 103 -8.372 2.677 -13.563 1.00 0.00 C ATOM 361 CD1 TYR B 103 -7.626 3.142 -14.652 1.00 0.00 C ATOM 362 CD2 TYR B 103 -9.753 2.902 -13.514 1.00 0.00 C ATOM 363 CE1 TYR B 103 -8.259 3.833 -15.693 1.00 0.00 C ATOM 364 CE2 TYR B 103 -10.387 3.593 -14.555 1.00 0.00 C ATOM 365 CZ TYR B 103 -9.640 4.058 -15.643 1.00 0.00 C ATOM 366 OH TYR B 103 -10.265 4.739 -16.669 1.00 0.00 O ATOM 0 H TYR B 103 -5.795 2.505 -10.108 1.00 0.00 H new ATOM 0 HA TYR B 103 -5.666 2.400 -13.031 1.00 0.00 H new ATOM 0 HB2 TYR B 103 -7.566 0.883 -12.707 1.00 0.00 H new ATOM 0 HB3 TYR B 103 -8.298 1.966 -11.540 1.00 0.00 H new ATOM 0 HD1 TYR B 103 -6.561 2.968 -14.690 1.00 0.00 H new ATOM 0 HD2 TYR B 103 -10.329 2.543 -12.674 1.00 0.00 H new ATOM 0 HE1 TYR B 103 -7.683 4.192 -16.533 1.00 0.00 H new ATOM 0 HE2 TYR B 103 -11.452 3.767 -14.518 1.00 0.00 H new ATOM 0 HH TYR B 103 -11.079 4.260 -16.931 1.00 0.00 H new ATOM 376 N GLU B 104 -6.038 4.877 -12.870 1.00 0.00 N ATOM 377 CA GLU B 104 -6.186 6.350 -12.708 1.00 0.00 C ATOM 378 C GLU B 104 -7.276 6.860 -13.652 1.00 0.00 C ATOM 379 O GLU B 104 -7.052 7.047 -14.832 1.00 0.00 O ATOM 380 CB GLU B 104 -4.860 7.038 -13.044 1.00 0.00 C ATOM 381 CG GLU B 104 -3.981 7.092 -11.793 1.00 0.00 C ATOM 382 CD GLU B 104 -3.657 8.550 -11.461 1.00 0.00 C ATOM 383 OE1 GLU B 104 -4.572 9.272 -11.101 1.00 0.00 O ATOM 384 OE2 GLU B 104 -2.499 8.919 -11.571 1.00 0.00 O ATOM 0 H GLU B 104 -5.568 4.579 -13.725 1.00 0.00 H new ATOM 0 HA GLU B 104 -6.461 6.575 -11.678 1.00 0.00 H new ATOM 0 HB2 GLU B 104 -4.348 6.495 -13.838 1.00 0.00 H new ATOM 0 HB3 GLU B 104 -5.045 8.046 -13.415 1.00 0.00 H new ATOM 0 HG2 GLU B 104 -4.494 6.622 -10.954 1.00 0.00 H new ATOM 0 HG3 GLU B 104 -3.060 6.532 -11.958 1.00 0.00 H new ATOM 391 N ALA B 105 -8.457 7.084 -13.144 1.00 0.00 N ATOM 392 CA ALA B 105 -9.559 7.578 -14.015 1.00 0.00 C ATOM 393 C ALA B 105 -9.110 8.855 -14.729 1.00 0.00 C ATOM 394 O ALA B 105 -8.703 9.815 -14.107 1.00 0.00 O ATOM 395 CB ALA B 105 -10.791 7.879 -13.159 1.00 0.00 C ATOM 0 H ALA B 105 -8.706 6.946 -12.164 1.00 0.00 H new ATOM 0 HA ALA B 105 -9.808 6.816 -14.754 1.00 0.00 H new ATOM 0 HB1 ALA B 105 -11.598 8.241 -13.797 1.00 0.00 H new ATOM 0 HB2 ALA B 105 -11.111 6.970 -12.650 1.00 0.00 H new ATOM 0 HB3 ALA B 105 -10.543 8.641 -12.420 1.00 0.00 H new ATOM 401 N ARG B 106 -9.183 8.873 -16.031 1.00 0.00 N ATOM 402 CA ARG B 106 -8.764 10.090 -16.782 1.00 0.00 C ATOM 403 C ARG B 106 -10.003 10.912 -17.141 1.00 0.00 C ATOM 404 O ARG B 106 -9.949 11.814 -17.952 1.00 0.00 O ATOM 405 CB ARG B 106 -8.024 9.677 -18.058 1.00 0.00 C ATOM 406 CG ARG B 106 -9.023 9.158 -19.094 1.00 0.00 C ATOM 407 CD ARG B 106 -8.282 8.815 -20.388 1.00 0.00 C ATOM 408 NE ARG B 106 -7.408 7.629 -20.162 1.00 0.00 N ATOM 409 CZ ARG B 106 -6.124 7.710 -20.390 1.00 0.00 C ATOM 410 NH1 ARG B 106 -5.687 7.884 -21.607 1.00 0.00 N ATOM 411 NH2 ARG B 106 -5.279 7.615 -19.401 1.00 0.00 N ATOM 0 H ARG B 106 -9.514 8.099 -16.607 1.00 0.00 H new ATOM 0 HA ARG B 106 -8.097 10.692 -16.164 1.00 0.00 H new ATOM 0 HB2 ARG B 106 -7.476 10.528 -18.463 1.00 0.00 H new ATOM 0 HB3 ARG B 106 -7.290 8.905 -17.829 1.00 0.00 H new ATOM 0 HG2 ARG B 106 -9.536 8.276 -18.711 1.00 0.00 H new ATOM 0 HG3 ARG B 106 -9.787 9.911 -19.288 1.00 0.00 H new ATOM 0 HD2 ARG B 106 -8.997 8.607 -21.184 1.00 0.00 H new ATOM 0 HD3 ARG B 106 -7.682 9.665 -20.712 1.00 0.00 H new ATOM 0 HE ARG B 106 -7.812 6.754 -19.829 1.00 0.00 H new ATOM 0 HH11 ARG B 106 -6.348 7.957 -22.381 1.00 0.00 H new ATOM 0 HH12 ARG B 106 -4.685 7.947 -21.785 1.00 0.00 H new ATOM 0 HH21 ARG B 106 -5.621 7.477 -18.450 1.00 0.00 H new ATOM 0 HH22 ARG B 106 -4.277 7.678 -19.579 1.00 0.00 H new ATOM 425 N THR B 107 -11.120 10.607 -16.539 1.00 0.00 N ATOM 426 CA THR B 107 -12.365 11.369 -16.840 1.00 0.00 C ATOM 427 C THR B 107 -13.127 11.635 -15.540 1.00 0.00 C ATOM 428 O THR B 107 -12.730 11.204 -14.476 1.00 0.00 O ATOM 429 CB THR B 107 -13.246 10.557 -17.792 1.00 0.00 C ATOM 430 OG1 THR B 107 -13.996 9.609 -17.046 1.00 0.00 O ATOM 431 CG2 THR B 107 -12.367 9.830 -18.810 1.00 0.00 C ATOM 0 H THR B 107 -11.224 9.862 -15.851 1.00 0.00 H new ATOM 0 HA THR B 107 -12.105 12.318 -17.309 1.00 0.00 H new ATOM 0 HB THR B 107 -13.927 11.226 -18.318 1.00 0.00 H new ATOM 0 HG1 THR B 107 -14.562 9.089 -17.654 1.00 0.00 H new ATOM 0 HG21 THR B 107 -12.996 9.252 -19.487 1.00 0.00 H new ATOM 0 HG22 THR B 107 -11.793 10.559 -19.382 1.00 0.00 H new ATOM 0 HG23 THR B 107 -11.684 9.159 -18.288 1.00 0.00 H new ATOM 439 N GLU B 108 -14.221 12.344 -15.617 1.00 0.00 N ATOM 440 CA GLU B 108 -15.008 12.641 -14.387 1.00 0.00 C ATOM 441 C GLU B 108 -16.100 11.584 -14.206 1.00 0.00 C ATOM 442 O GLU B 108 -17.000 11.740 -13.403 1.00 0.00 O ATOM 443 CB GLU B 108 -15.656 14.021 -14.520 1.00 0.00 C ATOM 444 CG GLU B 108 -16.332 14.134 -15.888 1.00 0.00 C ATOM 445 CD GLU B 108 -17.342 15.282 -15.868 1.00 0.00 C ATOM 446 OE1 GLU B 108 -17.658 15.748 -14.786 1.00 0.00 O ATOM 447 OE2 GLU B 108 -17.782 15.677 -16.936 1.00 0.00 O ATOM 0 H GLU B 108 -14.604 12.730 -16.480 1.00 0.00 H new ATOM 0 HA GLU B 108 -14.345 12.628 -13.522 1.00 0.00 H new ATOM 0 HB2 GLU B 108 -16.388 14.169 -13.727 1.00 0.00 H new ATOM 0 HB3 GLU B 108 -14.903 14.801 -14.408 1.00 0.00 H new ATOM 0 HG2 GLU B 108 -15.584 14.308 -16.661 1.00 0.00 H new ATOM 0 HG3 GLU B 108 -16.834 13.199 -16.135 1.00 0.00 H new ATOM 454 N ASP B 109 -16.035 10.511 -14.946 1.00 0.00 N ATOM 455 CA ASP B 109 -17.076 9.453 -14.814 1.00 0.00 C ATOM 456 C ASP B 109 -16.461 8.191 -14.202 1.00 0.00 C ATOM 457 O ASP B 109 -17.142 7.400 -13.580 1.00 0.00 O ATOM 458 CB ASP B 109 -17.643 9.121 -16.196 1.00 0.00 C ATOM 459 CG ASP B 109 -19.154 8.911 -16.091 1.00 0.00 C ATOM 460 OD1 ASP B 109 -19.712 9.259 -15.063 1.00 0.00 O ATOM 461 OD2 ASP B 109 -19.729 8.406 -17.041 1.00 0.00 O ATOM 0 H ASP B 109 -15.307 10.322 -15.635 1.00 0.00 H new ATOM 0 HA ASP B 109 -17.874 9.815 -14.166 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -17.425 9.930 -16.894 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -17.167 8.223 -16.590 1.00 0.00 H new ATOM 466 N ASP B 110 -15.182 7.991 -14.376 1.00 0.00 N ATOM 467 CA ASP B 110 -14.537 6.775 -13.806 1.00 0.00 C ATOM 468 C ASP B 110 -14.005 7.081 -12.404 1.00 0.00 C ATOM 469 O ASP B 110 -14.136 8.181 -11.906 1.00 0.00 O ATOM 470 CB ASP B 110 -13.380 6.341 -14.707 1.00 0.00 C ATOM 471 CG ASP B 110 -13.925 5.920 -16.073 1.00 0.00 C ATOM 472 OD1 ASP B 110 -15.008 5.359 -16.109 1.00 0.00 O ATOM 473 OD2 ASP B 110 -13.252 6.166 -17.060 1.00 0.00 O ATOM 0 H ASP B 110 -14.558 8.616 -14.887 1.00 0.00 H new ATOM 0 HA ASP B 110 -15.272 5.973 -13.745 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -12.670 7.160 -14.824 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -12.839 5.513 -14.249 1.00 0.00 H new ATOM 478 N LEU B 111 -13.406 6.113 -11.766 1.00 0.00 N ATOM 479 CA LEU B 111 -12.864 6.343 -10.397 1.00 0.00 C ATOM 480 C LEU B 111 -11.367 6.032 -10.381 1.00 0.00 C ATOM 481 O LEU B 111 -10.843 5.400 -11.277 1.00 0.00 O ATOM 482 CB LEU B 111 -13.580 5.425 -9.403 1.00 0.00 C ATOM 483 CG LEU B 111 -15.092 5.587 -9.553 1.00 0.00 C ATOM 484 CD1 LEU B 111 -15.757 4.210 -9.539 1.00 0.00 C ATOM 485 CD2 LEU B 111 -15.633 6.424 -8.391 1.00 0.00 C ATOM 0 H LEU B 111 -13.268 5.172 -12.134 1.00 0.00 H new ATOM 0 HA LEU B 111 -13.024 7.384 -10.116 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -13.296 4.388 -9.581 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -13.277 5.668 -8.385 1.00 0.00 H new ATOM 0 HG LEU B 111 -15.311 6.087 -10.496 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -16.836 4.326 -9.646 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -15.372 3.612 -10.365 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -15.538 3.710 -8.596 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -16.712 6.540 -8.497 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -15.413 5.923 -7.448 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -15.160 7.406 -8.399 1.00 0.00 H new ATOM 497 N SER B 112 -10.676 6.465 -9.364 1.00 0.00 N ATOM 498 CA SER B 112 -9.214 6.190 -9.283 1.00 0.00 C ATOM 499 C SER B 112 -8.920 5.431 -7.987 1.00 0.00 C ATOM 500 O SER B 112 -9.420 5.770 -6.933 1.00 0.00 O ATOM 501 CB SER B 112 -8.443 7.510 -9.289 1.00 0.00 C ATOM 502 OG SER B 112 -9.207 8.495 -9.974 1.00 0.00 O ATOM 0 H SER B 112 -11.061 6.998 -8.584 1.00 0.00 H new ATOM 0 HA SER B 112 -8.905 5.591 -10.139 1.00 0.00 H new ATOM 0 HB2 SER B 112 -8.244 7.833 -8.267 1.00 0.00 H new ATOM 0 HB3 SER B 112 -7.477 7.378 -9.776 1.00 0.00 H new ATOM 0 HG SER B 112 -8.717 9.344 -9.979 1.00 0.00 H new ATOM 508 N PHE B 113 -8.118 4.404 -8.056 1.00 0.00 N ATOM 509 CA PHE B 113 -7.804 3.627 -6.824 1.00 0.00 C ATOM 510 C PHE B 113 -6.517 2.826 -7.036 1.00 0.00 C ATOM 511 O PHE B 113 -5.868 2.934 -8.057 1.00 0.00 O ATOM 512 CB PHE B 113 -8.957 2.668 -6.524 1.00 0.00 C ATOM 513 CG PHE B 113 -9.330 1.921 -7.782 1.00 0.00 C ATOM 514 CD1 PHE B 113 -8.678 0.725 -8.102 1.00 0.00 C ATOM 515 CD2 PHE B 113 -10.326 2.424 -8.629 1.00 0.00 C ATOM 516 CE1 PHE B 113 -9.020 0.030 -9.268 1.00 0.00 C ATOM 517 CE2 PHE B 113 -10.668 1.729 -9.795 1.00 0.00 C ATOM 518 CZ PHE B 113 -10.015 0.531 -10.116 1.00 0.00 C ATOM 0 H PHE B 113 -7.668 4.070 -8.909 1.00 0.00 H new ATOM 0 HA PHE B 113 -7.669 4.312 -5.987 1.00 0.00 H new ATOM 0 HB2 PHE B 113 -8.666 1.965 -5.744 1.00 0.00 H new ATOM 0 HB3 PHE B 113 -9.817 3.222 -6.149 1.00 0.00 H new ATOM 0 HD1 PHE B 113 -7.910 0.338 -7.449 1.00 0.00 H new ATOM 0 HD2 PHE B 113 -10.830 3.347 -8.383 1.00 0.00 H new ATOM 0 HE1 PHE B 113 -8.516 -0.893 -9.514 1.00 0.00 H new ATOM 0 HE2 PHE B 113 -11.436 2.116 -10.448 1.00 0.00 H new ATOM 0 HZ PHE B 113 -10.279 -0.005 -11.016 1.00 0.00 H new ATOM 528 N HIS B 114 -6.145 2.023 -6.077 1.00 0.00 N ATOM 529 CA HIS B 114 -4.902 1.215 -6.219 1.00 0.00 C ATOM 530 C HIS B 114 -5.186 -0.229 -5.798 1.00 0.00 C ATOM 531 O HIS B 114 -6.076 -0.493 -5.013 1.00 0.00 O ATOM 532 CB HIS B 114 -3.807 1.803 -5.327 1.00 0.00 C ATOM 533 CG HIS B 114 -3.259 3.053 -5.961 1.00 0.00 C ATOM 534 ND1 HIS B 114 -2.270 3.016 -6.931 1.00 0.00 N ATOM 535 CD2 HIS B 114 -3.551 4.381 -5.774 1.00 0.00 C ATOM 536 CE1 HIS B 114 -2.004 4.286 -7.288 1.00 0.00 C ATOM 537 NE2 HIS B 114 -2.759 5.158 -6.613 1.00 0.00 N ATOM 0 H HIS B 114 -6.649 1.892 -5.200 1.00 0.00 H new ATOM 0 HA HIS B 114 -4.571 1.233 -7.257 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -4.210 2.030 -4.340 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -3.009 1.075 -5.185 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -4.285 4.765 -5.080 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -1.270 4.566 -8.029 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -2.755 6.175 -6.695 1.00 0.00 H new ATOM 545 N LYS B 115 -4.438 -1.168 -6.312 1.00 0.00 N ATOM 546 CA LYS B 115 -4.667 -2.593 -5.939 1.00 0.00 C ATOM 547 C LYS B 115 -4.879 -2.697 -4.426 1.00 0.00 C ATOM 548 O LYS B 115 -4.011 -2.362 -3.645 1.00 0.00 O ATOM 549 CB LYS B 115 -3.447 -3.428 -6.347 1.00 0.00 C ATOM 550 CG LYS B 115 -3.487 -4.788 -5.643 1.00 0.00 C ATOM 551 CD LYS B 115 -2.368 -5.681 -6.187 1.00 0.00 C ATOM 552 CE LYS B 115 -2.479 -7.077 -5.569 1.00 0.00 C ATOM 553 NZ LYS B 115 -1.584 -8.017 -6.302 1.00 0.00 N ATOM 0 H LYS B 115 -3.678 -1.010 -6.974 1.00 0.00 H new ATOM 0 HA LYS B 115 -5.552 -2.968 -6.454 1.00 0.00 H new ATOM 0 HB2 LYS B 115 -3.437 -3.568 -7.428 1.00 0.00 H new ATOM 0 HB3 LYS B 115 -2.530 -2.900 -6.085 1.00 0.00 H new ATOM 0 HG2 LYS B 115 -3.370 -4.656 -4.567 1.00 0.00 H new ATOM 0 HG3 LYS B 115 -4.455 -5.263 -5.802 1.00 0.00 H new ATOM 0 HD2 LYS B 115 -2.437 -5.746 -7.273 1.00 0.00 H new ATOM 0 HD3 LYS B 115 -1.396 -5.246 -5.955 1.00 0.00 H new ATOM 0 HE2 LYS B 115 -2.203 -7.043 -4.515 1.00 0.00 H new ATOM 0 HE3 LYS B 115 -3.510 -7.427 -5.618 1.00 0.00 H new ATOM 0 HZ1 LYS B 115 -1.659 -8.966 -5.883 1.00 0.00 H new ATOM 0 HZ2 LYS B 115 -1.867 -8.057 -7.302 1.00 0.00 H new ATOM 0 HZ3 LYS B 115 -0.601 -7.685 -6.233 1.00 0.00 H new ATOM 567 N GLY B 116 -6.025 -3.162 -4.007 1.00 0.00 N ATOM 568 CA GLY B 116 -6.285 -3.290 -2.544 1.00 0.00 C ATOM 569 C GLY B 116 -7.503 -2.448 -2.157 1.00 0.00 C ATOM 570 O GLY B 116 -7.974 -2.502 -1.039 1.00 0.00 O ATOM 0 H GLY B 116 -6.791 -3.458 -4.613 1.00 0.00 H new ATOM 0 HA2 GLY B 116 -6.457 -4.335 -2.286 1.00 0.00 H new ATOM 0 HA3 GLY B 116 -5.411 -2.963 -1.980 1.00 0.00 H new ATOM 574 N GLU B 117 -8.017 -1.671 -3.070 1.00 0.00 N ATOM 575 CA GLU B 117 -9.205 -0.830 -2.747 1.00 0.00 C ATOM 576 C GLU B 117 -10.476 -1.672 -2.875 1.00 0.00 C ATOM 577 O GLU B 117 -10.716 -2.301 -3.886 1.00 0.00 O ATOM 578 CB GLU B 117 -9.276 0.350 -3.718 1.00 0.00 C ATOM 579 CG GLU B 117 -8.757 1.613 -3.027 1.00 0.00 C ATOM 580 CD GLU B 117 -9.459 2.841 -3.610 1.00 0.00 C ATOM 581 OE1 GLU B 117 -10.483 2.665 -4.251 1.00 0.00 O ATOM 582 OE2 GLU B 117 -8.961 3.936 -3.407 1.00 0.00 O ATOM 0 H GLU B 117 -7.667 -1.582 -4.024 1.00 0.00 H new ATOM 0 HA GLU B 117 -9.117 -0.456 -1.727 1.00 0.00 H new ATOM 0 HB2 GLU B 117 -8.682 0.139 -4.607 1.00 0.00 H new ATOM 0 HB3 GLU B 117 -10.303 0.500 -4.050 1.00 0.00 H new ATOM 0 HG2 GLU B 117 -8.938 1.553 -1.954 1.00 0.00 H new ATOM 0 HG3 GLU B 117 -7.679 1.698 -3.164 1.00 0.00 H new ATOM 589 N LYS B 118 -11.294 -1.687 -1.859 1.00 0.00 N ATOM 590 CA LYS B 118 -12.550 -2.487 -1.928 1.00 0.00 C ATOM 591 C LYS B 118 -13.585 -1.727 -2.762 1.00 0.00 C ATOM 592 O LYS B 118 -13.534 -0.519 -2.875 1.00 0.00 O ATOM 593 CB LYS B 118 -13.096 -2.710 -0.516 1.00 0.00 C ATOM 594 CG LYS B 118 -11.948 -3.083 0.427 1.00 0.00 C ATOM 595 CD LYS B 118 -11.301 -4.388 -0.043 1.00 0.00 C ATOM 596 CE LYS B 118 -11.277 -5.389 1.115 1.00 0.00 C ATOM 597 NZ LYS B 118 -9.963 -6.093 1.137 1.00 0.00 N ATOM 0 H LYS B 118 -11.148 -1.181 -0.985 1.00 0.00 H new ATOM 0 HA LYS B 118 -12.343 -3.452 -2.390 1.00 0.00 H new ATOM 0 HB2 LYS B 118 -13.593 -1.807 -0.161 1.00 0.00 H new ATOM 0 HB3 LYS B 118 -13.844 -3.503 -0.526 1.00 0.00 H new ATOM 0 HG2 LYS B 118 -11.206 -2.284 0.447 1.00 0.00 H new ATOM 0 HG3 LYS B 118 -12.322 -3.197 1.445 1.00 0.00 H new ATOM 0 HD2 LYS B 118 -11.858 -4.801 -0.884 1.00 0.00 H new ATOM 0 HD3 LYS B 118 -10.287 -4.198 -0.395 1.00 0.00 H new ATOM 0 HE2 LYS B 118 -11.440 -4.872 2.060 1.00 0.00 H new ATOM 0 HE3 LYS B 118 -12.086 -6.111 1.003 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 -9.947 -6.773 1.924 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 -9.825 -6.599 0.239 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 -9.199 -5.399 1.264 1.00 0.00 H new ATOM 611 N PHE B 119 -14.520 -2.422 -3.350 1.00 0.00 N ATOM 612 CA PHE B 119 -15.548 -1.730 -4.178 1.00 0.00 C ATOM 613 C PHE B 119 -16.880 -2.477 -4.081 1.00 0.00 C ATOM 614 O PHE B 119 -16.921 -3.680 -3.917 1.00 0.00 O ATOM 615 CB PHE B 119 -15.093 -1.706 -5.639 1.00 0.00 C ATOM 616 CG PHE B 119 -14.069 -0.614 -5.839 1.00 0.00 C ATOM 617 CD1 PHE B 119 -14.272 0.651 -5.276 1.00 0.00 C ATOM 618 CD2 PHE B 119 -12.915 -0.869 -6.590 1.00 0.00 C ATOM 619 CE1 PHE B 119 -13.321 1.663 -5.464 1.00 0.00 C ATOM 620 CE2 PHE B 119 -11.965 0.141 -6.778 1.00 0.00 C ATOM 621 CZ PHE B 119 -12.167 1.406 -6.216 1.00 0.00 C ATOM 0 H PHE B 119 -14.617 -3.436 -3.293 1.00 0.00 H new ATOM 0 HA PHE B 119 -15.675 -0.711 -3.813 1.00 0.00 H new ATOM 0 HB2 PHE B 119 -14.667 -2.671 -5.912 1.00 0.00 H new ATOM 0 HB3 PHE B 119 -15.949 -1.539 -6.293 1.00 0.00 H new ATOM 0 HD1 PHE B 119 -15.162 0.847 -4.696 1.00 0.00 H new ATOM 0 HD2 PHE B 119 -12.758 -1.845 -7.024 1.00 0.00 H new ATOM 0 HE1 PHE B 119 -13.477 2.639 -5.030 1.00 0.00 H new ATOM 0 HE2 PHE B 119 -11.075 -0.056 -7.357 1.00 0.00 H new ATOM 0 HZ PHE B 119 -11.433 2.185 -6.362 1.00 0.00 H new ATOM 631 N GLN B 120 -17.973 -1.771 -4.192 1.00 0.00 N ATOM 632 CA GLN B 120 -19.303 -2.441 -4.118 1.00 0.00 C ATOM 633 C GLN B 120 -19.983 -2.347 -5.487 1.00 0.00 C ATOM 634 O GLN B 120 -20.613 -1.361 -5.814 1.00 0.00 O ATOM 635 CB GLN B 120 -20.168 -1.745 -3.065 1.00 0.00 C ATOM 636 CG GLN B 120 -19.901 -2.371 -1.694 1.00 0.00 C ATOM 637 CD GLN B 120 -21.228 -2.613 -0.972 1.00 0.00 C ATOM 638 OE1 GLN B 120 -21.693 -3.732 -0.890 1.00 0.00 O ATOM 639 NE2 GLN B 120 -21.862 -1.603 -0.442 1.00 0.00 N ATOM 0 H GLN B 120 -18.002 -0.761 -4.331 1.00 0.00 H new ATOM 0 HA GLN B 120 -19.176 -3.488 -3.841 1.00 0.00 H new ATOM 0 HB2 GLN B 120 -19.943 -0.679 -3.040 1.00 0.00 H new ATOM 0 HB3 GLN B 120 -21.223 -1.842 -3.322 1.00 0.00 H new ATOM 0 HG2 GLN B 120 -19.363 -3.311 -1.811 1.00 0.00 H new ATOM 0 HG3 GLN B 120 -19.267 -1.713 -1.100 1.00 0.00 H new ATOM 0 HE21 GLN B 120 -21.472 -0.663 -0.511 1.00 0.00 H new ATOM 0 HE22 GLN B 120 -22.748 -1.753 0.041 1.00 0.00 H new ATOM 648 N ILE B 121 -19.852 -3.365 -6.295 1.00 0.00 N ATOM 649 CA ILE B 121 -20.478 -3.334 -7.648 1.00 0.00 C ATOM 650 C ILE B 121 -21.999 -3.209 -7.518 1.00 0.00 C ATOM 651 O ILE B 121 -22.640 -3.982 -6.835 1.00 0.00 O ATOM 652 CB ILE B 121 -20.142 -4.627 -8.399 1.00 0.00 C ATOM 653 CG1 ILE B 121 -18.649 -4.654 -8.745 1.00 0.00 C ATOM 654 CG2 ILE B 121 -20.958 -4.694 -9.690 1.00 0.00 C ATOM 655 CD1 ILE B 121 -18.229 -3.304 -9.331 1.00 0.00 C ATOM 0 H ILE B 121 -19.338 -4.218 -6.076 1.00 0.00 H new ATOM 0 HA ILE B 121 -20.090 -2.477 -8.198 1.00 0.00 H new ATOM 0 HB ILE B 121 -20.383 -5.481 -7.766 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -18.063 -4.871 -7.852 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -18.446 -5.451 -9.461 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -20.719 -5.614 -10.224 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -22.021 -4.680 -9.450 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -20.717 -3.836 -10.318 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -17.167 -3.328 -9.575 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -18.805 -3.105 -10.235 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -18.416 -2.517 -8.601 1.00 0.00 H new ATOM 667 N LEU B 122 -22.581 -2.244 -8.180 1.00 0.00 N ATOM 668 CA LEU B 122 -24.061 -2.074 -8.108 1.00 0.00 C ATOM 669 C LEU B 122 -24.683 -2.606 -9.399 1.00 0.00 C ATOM 670 O LEU B 122 -25.639 -3.355 -9.379 1.00 0.00 O ATOM 671 CB LEU B 122 -24.402 -0.591 -7.950 1.00 0.00 C ATOM 672 CG LEU B 122 -23.347 0.088 -7.076 1.00 0.00 C ATOM 673 CD1 LEU B 122 -23.653 1.584 -6.975 1.00 0.00 C ATOM 674 CD2 LEU B 122 -23.369 -0.532 -5.677 1.00 0.00 C ATOM 0 H LEU B 122 -22.095 -1.566 -8.767 1.00 0.00 H new ATOM 0 HA LEU B 122 -24.454 -2.624 -7.253 1.00 0.00 H new ATOM 0 HB2 LEU B 122 -24.443 -0.111 -8.928 1.00 0.00 H new ATOM 0 HB3 LEU B 122 -25.388 -0.480 -7.499 1.00 0.00 H new ATOM 0 HG LEU B 122 -22.362 -0.052 -7.521 1.00 0.00 H new ATOM 0 HD11 LEU B 122 -22.901 2.068 -6.352 1.00 0.00 H new ATOM 0 HD12 LEU B 122 -23.638 2.026 -7.971 1.00 0.00 H new ATOM 0 HD13 LEU B 122 -24.638 1.725 -6.530 1.00 0.00 H new ATOM 0 HD21 LEU B 122 -22.617 -0.049 -5.053 1.00 0.00 H new ATOM 0 HD22 LEU B 122 -24.354 -0.392 -5.232 1.00 0.00 H new ATOM 0 HD23 LEU B 122 -23.151 -1.598 -5.748 1.00 0.00 H new ATOM 686 N ASN B 123 -24.138 -2.226 -10.519 1.00 0.00 N ATOM 687 CA ASN B 123 -24.681 -2.708 -11.820 1.00 0.00 C ATOM 688 C ASN B 123 -23.534 -3.280 -12.657 1.00 0.00 C ATOM 689 O ASN B 123 -22.604 -2.582 -13.011 1.00 0.00 O ATOM 690 CB ASN B 123 -25.330 -1.542 -12.572 1.00 0.00 C ATOM 691 CG ASN B 123 -26.163 -2.086 -13.736 1.00 0.00 C ATOM 692 OD1 ASN B 123 -26.177 -3.274 -13.986 1.00 0.00 O ATOM 693 ND2 ASN B 123 -26.865 -1.258 -14.462 1.00 0.00 N ATOM 0 H ASN B 123 -23.336 -1.600 -10.591 1.00 0.00 H new ATOM 0 HA ASN B 123 -25.430 -3.480 -11.641 1.00 0.00 H new ATOM 0 HB2 ASN B 123 -25.962 -0.966 -11.896 1.00 0.00 H new ATOM 0 HB3 ASN B 123 -24.563 -0.864 -12.946 1.00 0.00 H new ATOM 0 HD21 ASN B 123 -27.425 -1.609 -15.239 1.00 0.00 H new ATOM 0 HD22 ASN B 123 -26.853 -0.260 -14.252 1.00 0.00 H new ATOM 700 N SER B 124 -23.590 -4.546 -12.969 1.00 0.00 N ATOM 701 CA SER B 124 -22.501 -5.162 -13.776 1.00 0.00 C ATOM 702 C SER B 124 -23.097 -6.202 -14.725 1.00 0.00 C ATOM 703 O SER B 124 -23.126 -7.381 -14.432 1.00 0.00 O ATOM 704 CB SER B 124 -21.496 -5.836 -12.842 1.00 0.00 C ATOM 705 OG SER B 124 -21.043 -7.048 -13.433 1.00 0.00 O ATOM 0 H SER B 124 -24.343 -5.179 -12.700 1.00 0.00 H new ATOM 0 HA SER B 124 -21.995 -4.391 -14.357 1.00 0.00 H new ATOM 0 HB2 SER B 124 -20.652 -5.171 -12.656 1.00 0.00 H new ATOM 0 HB3 SER B 124 -21.960 -6.040 -11.877 1.00 0.00 H new ATOM 0 HG SER B 124 -20.077 -6.995 -13.589 1.00 0.00 H new ATOM 744 N ASP B 128 -18.602 -3.269 -21.159 1.00 0.00 N ATOM 745 CA ASP B 128 -17.323 -3.906 -20.735 1.00 0.00 C ATOM 746 C ASP B 128 -16.892 -3.341 -19.379 1.00 0.00 C ATOM 747 O ASP B 128 -16.031 -3.885 -18.717 1.00 0.00 O ATOM 748 CB ASP B 128 -16.241 -3.615 -21.778 1.00 0.00 C ATOM 749 CG ASP B 128 -15.995 -4.869 -22.618 1.00 0.00 C ATOM 750 OD1 ASP B 128 -16.757 -5.812 -22.476 1.00 0.00 O ATOM 751 OD2 ASP B 128 -15.050 -4.867 -23.390 1.00 0.00 O ATOM 0 HA ASP B 128 -17.465 -4.983 -20.648 1.00 0.00 H new ATOM 0 HB2 ASP B 128 -16.551 -2.790 -22.419 1.00 0.00 H new ATOM 0 HB3 ASP B 128 -15.319 -3.307 -21.285 1.00 0.00 H new ATOM 756 N TRP B 129 -17.478 -2.252 -18.962 1.00 0.00 N ATOM 757 CA TRP B 129 -17.092 -1.656 -17.650 1.00 0.00 C ATOM 758 C TRP B 129 -18.295 -1.679 -16.701 1.00 0.00 C ATOM 759 O TRP B 129 -19.430 -1.565 -17.118 1.00 0.00 O ATOM 760 CB TRP B 129 -16.639 -0.209 -17.862 1.00 0.00 C ATOM 761 CG TRP B 129 -15.215 -0.194 -18.318 1.00 0.00 C ATOM 762 CD1 TRP B 129 -14.694 -1.005 -19.268 1.00 0.00 C ATOM 763 CD2 TRP B 129 -14.121 0.658 -17.864 1.00 0.00 C ATOM 764 NE1 TRP B 129 -13.352 -0.709 -19.424 1.00 0.00 N ATOM 765 CE2 TRP B 129 -12.953 0.310 -18.582 1.00 0.00 C ATOM 766 CE3 TRP B 129 -14.031 1.688 -16.910 1.00 0.00 C ATOM 767 CZ2 TRP B 129 -11.738 0.959 -18.360 1.00 0.00 C ATOM 768 CZ3 TRP B 129 -12.809 2.344 -16.685 1.00 0.00 C ATOM 769 CH2 TRP B 129 -11.665 1.979 -17.409 1.00 0.00 C ATOM 0 H TRP B 129 -18.205 -1.750 -19.471 1.00 0.00 H new ATOM 0 HA TRP B 129 -16.277 -2.234 -17.215 1.00 0.00 H new ATOM 0 HB2 TRP B 129 -17.274 0.277 -18.602 1.00 0.00 H new ATOM 0 HB3 TRP B 129 -16.741 0.355 -16.935 1.00 0.00 H new ATOM 0 HD1 TRP B 129 -15.238 -1.761 -19.815 1.00 0.00 H new ATOM 0 HE1 TRP B 129 -12.733 -1.185 -20.080 1.00 0.00 H new ATOM 0 HE3 TRP B 129 -14.907 1.976 -16.347 1.00 0.00 H new ATOM 0 HZ2 TRP B 129 -10.860 0.674 -18.920 1.00 0.00 H new ATOM 0 HZ3 TRP B 129 -12.751 3.134 -15.950 1.00 0.00 H new ATOM 0 HH2 TRP B 129 -10.728 2.486 -17.231 1.00 0.00 H new ATOM 780 N TRP B 130 -18.053 -1.825 -15.426 1.00 0.00 N ATOM 781 CA TRP B 130 -19.180 -1.855 -14.451 1.00 0.00 C ATOM 782 C TRP B 130 -19.161 -0.579 -13.608 1.00 0.00 C ATOM 783 O TRP B 130 -18.237 0.208 -13.673 1.00 0.00 O ATOM 784 CB TRP B 130 -19.028 -3.061 -13.520 1.00 0.00 C ATOM 785 CG TRP B 130 -19.001 -4.324 -14.317 1.00 0.00 C ATOM 786 CD1 TRP B 130 -19.493 -4.470 -15.569 1.00 0.00 C ATOM 787 CD2 TRP B 130 -18.466 -5.622 -13.932 1.00 0.00 C ATOM 788 NE1 TRP B 130 -19.288 -5.777 -15.979 1.00 0.00 N ATOM 789 CE2 TRP B 130 -18.659 -6.525 -15.003 1.00 0.00 C ATOM 790 CE3 TRP B 130 -17.836 -6.096 -12.768 1.00 0.00 C ATOM 791 CZ2 TRP B 130 -18.241 -7.855 -14.921 1.00 0.00 C ATOM 792 CZ3 TRP B 130 -17.416 -7.432 -12.680 1.00 0.00 C ATOM 793 CH2 TRP B 130 -17.618 -8.310 -13.756 1.00 0.00 C ATOM 0 H TRP B 130 -17.124 -1.925 -15.018 1.00 0.00 H new ATOM 0 HA TRP B 130 -20.120 -1.927 -14.998 1.00 0.00 H new ATOM 0 HB2 TRP B 130 -18.110 -2.969 -12.939 1.00 0.00 H new ATOM 0 HB3 TRP B 130 -19.854 -3.088 -12.809 1.00 0.00 H new ATOM 0 HD1 TRP B 130 -19.967 -3.695 -16.153 1.00 0.00 H new ATOM 0 HE1 TRP B 130 -19.567 -6.142 -16.890 1.00 0.00 H new ATOM 0 HE3 TRP B 130 -17.674 -5.427 -11.936 1.00 0.00 H new ATOM 0 HZ2 TRP B 130 -18.398 -8.527 -15.752 1.00 0.00 H new ATOM 0 HZ3 TRP B 130 -16.935 -7.786 -11.780 1.00 0.00 H new ATOM 0 HH2 TRP B 130 -17.292 -9.337 -13.684 1.00 0.00 H new ATOM 804 N GLU B 131 -20.171 -0.375 -12.807 1.00 0.00 N ATOM 805 CA GLU B 131 -20.208 0.839 -11.945 1.00 0.00 C ATOM 806 C GLU B 131 -20.035 0.411 -10.487 1.00 0.00 C ATOM 807 O GLU B 131 -20.884 -0.245 -9.919 1.00 0.00 O ATOM 808 CB GLU B 131 -21.552 1.552 -12.117 1.00 0.00 C ATOM 809 CG GLU B 131 -22.687 0.530 -12.030 1.00 0.00 C ATOM 810 CD GLU B 131 -24.032 1.259 -12.073 1.00 0.00 C ATOM 811 OE1 GLU B 131 -24.394 1.856 -11.073 1.00 0.00 O ATOM 812 OE2 GLU B 131 -24.677 1.208 -13.107 1.00 0.00 O ATOM 0 H GLU B 131 -20.973 -0.998 -12.713 1.00 0.00 H new ATOM 0 HA GLU B 131 -19.406 1.521 -12.229 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -21.673 2.313 -11.346 1.00 0.00 H new ATOM 0 HB3 GLU B 131 -21.583 2.065 -13.078 1.00 0.00 H new ATOM 0 HG2 GLU B 131 -22.618 -0.178 -12.856 1.00 0.00 H new ATOM 0 HG3 GLU B 131 -22.602 -0.046 -11.109 1.00 0.00 H new ATOM 819 N ALA B 132 -18.936 0.763 -9.879 1.00 0.00 N ATOM 820 CA ALA B 132 -18.709 0.358 -8.463 1.00 0.00 C ATOM 821 C ALA B 132 -18.688 1.593 -7.563 1.00 0.00 C ATOM 822 O ALA B 132 -18.276 2.663 -7.965 1.00 0.00 O ATOM 823 CB ALA B 132 -17.368 -0.371 -8.352 1.00 0.00 C ATOM 0 H ALA B 132 -18.187 1.312 -10.300 1.00 0.00 H new ATOM 0 HA ALA B 132 -19.516 -0.303 -8.147 1.00 0.00 H new ATOM 0 HB1 ALA B 132 -17.200 -0.668 -7.317 1.00 0.00 H new ATOM 0 HB2 ALA B 132 -17.382 -1.257 -8.986 1.00 0.00 H new ATOM 0 HB3 ALA B 132 -16.565 0.293 -8.674 1.00 0.00 H new ATOM 829 N ARG B 133 -19.122 1.448 -6.341 1.00 0.00 N ATOM 830 CA ARG B 133 -19.121 2.605 -5.405 1.00 0.00 C ATOM 831 C ARG B 133 -17.952 2.454 -4.429 1.00 0.00 C ATOM 832 O ARG B 133 -17.830 1.457 -3.743 1.00 0.00 O ATOM 833 CB ARG B 133 -20.438 2.635 -4.625 1.00 0.00 C ATOM 834 CG ARG B 133 -20.551 3.956 -3.862 1.00 0.00 C ATOM 835 CD ARG B 133 -20.564 3.680 -2.357 1.00 0.00 C ATOM 836 NE ARG B 133 -21.952 3.354 -1.924 1.00 0.00 N ATOM 837 CZ ARG B 133 -22.420 3.842 -0.807 1.00 0.00 C ATOM 838 NH1 ARG B 133 -21.733 3.728 0.296 1.00 0.00 N ATOM 839 NH2 ARG B 133 -23.579 4.444 -0.793 1.00 0.00 N ATOM 0 H ARG B 133 -19.478 0.575 -5.951 1.00 0.00 H new ATOM 0 HA ARG B 133 -19.016 3.533 -5.967 1.00 0.00 H new ATOM 0 HB2 ARG B 133 -21.280 2.525 -5.308 1.00 0.00 H new ATOM 0 HB3 ARG B 133 -20.480 1.797 -3.930 1.00 0.00 H new ATOM 0 HG2 ARG B 133 -19.714 4.607 -4.115 1.00 0.00 H new ATOM 0 HG3 ARG B 133 -21.461 4.479 -4.154 1.00 0.00 H new ATOM 0 HD2 ARG B 133 -19.895 2.852 -2.122 1.00 0.00 H new ATOM 0 HD3 ARG B 133 -20.197 4.551 -1.814 1.00 0.00 H new ATOM 0 HE ARG B 133 -22.537 2.749 -2.501 1.00 0.00 H new ATOM 0 HH11 ARG B 133 -20.828 3.257 0.287 1.00 0.00 H new ATOM 0 HH12 ARG B 133 -22.100 4.110 1.167 1.00 0.00 H new ATOM 0 HH21 ARG B 133 -24.118 4.533 -1.654 1.00 0.00 H new ATOM 0 HH22 ARG B 133 -23.945 4.825 0.079 1.00 0.00 H new ATOM 853 N SER B 134 -17.089 3.431 -4.367 1.00 0.00 N ATOM 854 CA SER B 134 -15.926 3.340 -3.440 1.00 0.00 C ATOM 855 C SER B 134 -16.427 3.321 -1.995 1.00 0.00 C ATOM 856 O SER B 134 -17.305 4.072 -1.622 1.00 0.00 O ATOM 857 CB SER B 134 -15.013 4.549 -3.648 1.00 0.00 C ATOM 858 OG SER B 134 -14.891 4.810 -5.040 1.00 0.00 O ATOM 0 H SER B 134 -17.139 4.288 -4.918 1.00 0.00 H new ATOM 0 HA SER B 134 -15.369 2.425 -3.643 1.00 0.00 H new ATOM 0 HB2 SER B 134 -15.422 5.421 -3.137 1.00 0.00 H new ATOM 0 HB3 SER B 134 -14.031 4.357 -3.215 1.00 0.00 H new ATOM 0 HG SER B 134 -15.647 5.358 -5.337 1.00 0.00 H new ATOM 864 N LEU B 135 -15.876 2.465 -1.178 1.00 0.00 N ATOM 865 CA LEU B 135 -16.322 2.395 0.242 1.00 0.00 C ATOM 866 C LEU B 135 -15.557 3.425 1.077 1.00 0.00 C ATOM 867 O LEU B 135 -15.981 3.806 2.148 1.00 0.00 O ATOM 868 CB LEU B 135 -16.051 0.992 0.789 1.00 0.00 C ATOM 869 CG LEU B 135 -16.978 -0.012 0.099 1.00 0.00 C ATOM 870 CD1 LEU B 135 -16.377 -1.415 0.196 1.00 0.00 C ATOM 871 CD2 LEU B 135 -18.346 0.004 0.787 1.00 0.00 C ATOM 0 H LEU B 135 -15.136 1.811 -1.433 1.00 0.00 H new ATOM 0 HA LEU B 135 -17.389 2.610 0.297 1.00 0.00 H new ATOM 0 HB2 LEU B 135 -15.010 0.718 0.619 1.00 0.00 H new ATOM 0 HB3 LEU B 135 -16.214 0.972 1.867 1.00 0.00 H new ATOM 0 HG LEU B 135 -17.093 0.261 -0.950 1.00 0.00 H new ATOM 0 HD11 LEU B 135 -17.038 -2.129 -0.296 1.00 0.00 H new ATOM 0 HD12 LEU B 135 -15.402 -1.428 -0.292 1.00 0.00 H new ATOM 0 HD13 LEU B 135 -16.262 -1.690 1.244 1.00 0.00 H new ATOM 0 HD21 LEU B 135 -19.008 -0.710 0.297 1.00 0.00 H new ATOM 0 HD22 LEU B 135 -18.229 -0.270 1.836 1.00 0.00 H new ATOM 0 HD23 LEU B 135 -18.776 1.003 0.718 1.00 0.00 H new ATOM 883 N THR B 136 -14.431 3.878 0.595 1.00 0.00 N ATOM 884 CA THR B 136 -13.644 4.882 1.366 1.00 0.00 C ATOM 885 C THR B 136 -14.121 6.290 1.008 1.00 0.00 C ATOM 886 O THR B 136 -14.518 7.057 1.863 1.00 0.00 O ATOM 887 CB THR B 136 -12.160 4.744 1.018 1.00 0.00 C ATOM 888 OG1 THR B 136 -11.713 3.442 1.370 1.00 0.00 O ATOM 889 CG2 THR B 136 -11.351 5.790 1.788 1.00 0.00 C ATOM 0 H THR B 136 -14.023 3.597 -0.297 1.00 0.00 H new ATOM 0 HA THR B 136 -13.785 4.711 2.433 1.00 0.00 H new ATOM 0 HB THR B 136 -12.022 4.900 -0.052 1.00 0.00 H new ATOM 0 HG1 THR B 136 -10.763 3.351 1.146 1.00 0.00 H new ATOM 0 HG21 THR B 136 -10.295 5.689 1.538 1.00 0.00 H new ATOM 0 HG22 THR B 136 -11.695 6.788 1.516 1.00 0.00 H new ATOM 0 HG23 THR B 136 -11.487 5.639 2.859 1.00 0.00 H new ATOM 897 N THR B 137 -14.086 6.638 -0.249 1.00 0.00 N ATOM 898 CA THR B 137 -14.539 7.996 -0.659 1.00 0.00 C ATOM 899 C THR B 137 -16.062 8.005 -0.794 1.00 0.00 C ATOM 900 O THR B 137 -16.703 9.027 -0.654 1.00 0.00 O ATOM 901 CB THR B 137 -13.906 8.360 -2.004 1.00 0.00 C ATOM 902 OG1 THR B 137 -14.350 7.445 -2.997 1.00 0.00 O ATOM 903 CG2 THR B 137 -12.383 8.291 -1.890 1.00 0.00 C ATOM 0 H THR B 137 -13.763 6.040 -1.010 1.00 0.00 H new ATOM 0 HA THR B 137 -14.236 8.723 0.094 1.00 0.00 H new ATOM 0 HB THR B 137 -14.201 9.372 -2.282 1.00 0.00 H new ATOM 0 HG1 THR B 137 -13.947 7.677 -3.860 1.00 0.00 H new ATOM 0 HG21 THR B 137 -11.934 8.551 -2.849 1.00 0.00 H new ATOM 0 HG22 THR B 137 -12.043 8.993 -1.128 1.00 0.00 H new ATOM 0 HG23 THR B 137 -12.084 7.280 -1.611 1.00 0.00 H new ATOM 911 N GLY B 138 -16.648 6.870 -1.068 1.00 0.00 N ATOM 912 CA GLY B 138 -18.129 6.813 -1.213 1.00 0.00 C ATOM 913 C GLY B 138 -18.535 7.413 -2.560 1.00 0.00 C ATOM 914 O GLY B 138 -19.672 7.783 -2.770 1.00 0.00 O ATOM 0 H GLY B 138 -16.164 5.981 -1.197 1.00 0.00 H new ATOM 0 HA2 GLY B 138 -18.472 5.781 -1.145 1.00 0.00 H new ATOM 0 HA3 GLY B 138 -18.606 7.361 -0.400 1.00 0.00 H new ATOM 918 N GLU B 139 -17.610 7.513 -3.475 1.00 0.00 N ATOM 919 CA GLU B 139 -17.942 8.091 -4.808 1.00 0.00 C ATOM 920 C GLU B 139 -18.241 6.960 -5.793 1.00 0.00 C ATOM 921 O GLU B 139 -17.448 6.057 -5.976 1.00 0.00 O ATOM 922 CB GLU B 139 -16.755 8.912 -5.317 1.00 0.00 C ATOM 923 CG GLU B 139 -17.000 10.396 -5.032 1.00 0.00 C ATOM 924 CD GLU B 139 -18.001 10.953 -6.045 1.00 0.00 C ATOM 925 OE1 GLU B 139 -18.987 10.283 -6.305 1.00 0.00 O ATOM 926 OE2 GLU B 139 -17.765 12.041 -6.545 1.00 0.00 O ATOM 0 H GLU B 139 -16.640 7.220 -3.358 1.00 0.00 H new ATOM 0 HA GLU B 139 -18.817 8.735 -4.718 1.00 0.00 H new ATOM 0 HB2 GLU B 139 -15.837 8.584 -4.830 1.00 0.00 H new ATOM 0 HB3 GLU B 139 -16.622 8.754 -6.387 1.00 0.00 H new ATOM 0 HG2 GLU B 139 -17.382 10.524 -4.019 1.00 0.00 H new ATOM 0 HG3 GLU B 139 -16.062 10.948 -5.091 1.00 0.00 H new ATOM 933 N THR B 140 -19.379 6.999 -6.429 1.00 0.00 N ATOM 934 CA THR B 140 -19.727 5.926 -7.401 1.00 0.00 C ATOM 935 C THR B 140 -19.223 6.315 -8.792 1.00 0.00 C ATOM 936 O THR B 140 -19.308 7.458 -9.196 1.00 0.00 O ATOM 937 CB THR B 140 -21.245 5.745 -7.439 1.00 0.00 C ATOM 938 OG1 THR B 140 -21.736 5.596 -6.114 1.00 0.00 O ATOM 939 CG2 THR B 140 -21.590 4.498 -8.255 1.00 0.00 C ATOM 0 H THR B 140 -20.083 7.728 -6.317 1.00 0.00 H new ATOM 0 HA THR B 140 -19.258 4.991 -7.094 1.00 0.00 H new ATOM 0 HB THR B 140 -21.704 6.619 -7.901 1.00 0.00 H new ATOM 0 HG1 THR B 140 -22.709 5.482 -6.137 1.00 0.00 H new ATOM 0 HG21 THR B 140 -22.672 4.369 -8.282 1.00 0.00 H new ATOM 0 HG22 THR B 140 -21.213 4.612 -9.271 1.00 0.00 H new ATOM 0 HG23 THR B 140 -21.132 3.623 -7.794 1.00 0.00 H new ATOM 947 N GLY B 141 -18.699 5.373 -9.529 1.00 0.00 N ATOM 948 CA GLY B 141 -18.190 5.691 -10.892 1.00 0.00 C ATOM 949 C GLY B 141 -18.120 4.412 -11.728 1.00 0.00 C ATOM 950 O GLY B 141 -18.595 3.367 -11.328 1.00 0.00 O ATOM 0 H GLY B 141 -18.602 4.398 -9.246 1.00 0.00 H new ATOM 0 HA2 GLY B 141 -18.844 6.417 -11.375 1.00 0.00 H new ATOM 0 HA3 GLY B 141 -17.202 6.147 -10.825 1.00 0.00 H new ATOM 954 N TYR B 142 -17.529 4.489 -12.888 1.00 0.00 N ATOM 955 CA TYR B 142 -17.425 3.283 -13.755 1.00 0.00 C ATOM 956 C TYR B 142 -15.971 2.809 -13.797 1.00 0.00 C ATOM 957 O TYR B 142 -15.097 3.500 -14.281 1.00 0.00 O ATOM 958 CB TYR B 142 -17.882 3.634 -15.172 1.00 0.00 C ATOM 959 CG TYR B 142 -19.328 4.069 -15.148 1.00 0.00 C ATOM 960 CD1 TYR B 142 -19.673 5.326 -14.640 1.00 0.00 C ATOM 961 CD2 TYR B 142 -20.324 3.215 -15.637 1.00 0.00 C ATOM 962 CE1 TYR B 142 -21.014 5.730 -14.620 1.00 0.00 C ATOM 963 CE2 TYR B 142 -21.664 3.617 -15.617 1.00 0.00 C ATOM 964 CZ TYR B 142 -22.010 4.876 -15.109 1.00 0.00 C ATOM 965 OH TYR B 142 -23.331 5.273 -15.090 1.00 0.00 O ATOM 0 H TYR B 142 -17.113 5.337 -13.273 1.00 0.00 H new ATOM 0 HA TYR B 142 -18.056 2.491 -13.352 1.00 0.00 H new ATOM 0 HB2 TYR B 142 -17.259 4.431 -15.578 1.00 0.00 H new ATOM 0 HB3 TYR B 142 -17.763 2.771 -15.827 1.00 0.00 H new ATOM 0 HD1 TYR B 142 -18.905 5.985 -14.263 1.00 0.00 H new ATOM 0 HD2 TYR B 142 -20.058 2.245 -16.030 1.00 0.00 H new ATOM 0 HE1 TYR B 142 -21.280 6.700 -14.227 1.00 0.00 H new ATOM 0 HE2 TYR B 142 -22.432 2.957 -15.993 1.00 0.00 H new ATOM 0 HH TYR B 142 -23.891 4.563 -15.467 1.00 0.00 H new ATOM 975 N ILE B 143 -15.706 1.630 -13.305 1.00 0.00 N ATOM 976 CA ILE B 143 -14.308 1.116 -13.332 1.00 0.00 C ATOM 977 C ILE B 143 -14.239 -0.113 -14.237 1.00 0.00 C ATOM 978 O ILE B 143 -15.245 -0.736 -14.514 1.00 0.00 O ATOM 979 CB ILE B 143 -13.855 0.722 -11.920 1.00 0.00 C ATOM 980 CG1 ILE B 143 -14.892 -0.205 -11.276 1.00 0.00 C ATOM 981 CG2 ILE B 143 -13.697 1.979 -11.060 1.00 0.00 C ATOM 982 CD1 ILE B 143 -14.818 -1.588 -11.925 1.00 0.00 C ATOM 0 H ILE B 143 -16.394 1.003 -12.887 1.00 0.00 H new ATOM 0 HA ILE B 143 -13.653 1.900 -13.711 1.00 0.00 H new ATOM 0 HB ILE B 143 -12.900 0.202 -11.988 1.00 0.00 H new ATOM 0 HG12 ILE B 143 -14.708 -0.285 -10.205 1.00 0.00 H new ATOM 0 HG13 ILE B 143 -15.892 0.212 -11.397 1.00 0.00 H new ATOM 0 HG21 ILE B 143 -13.375 1.696 -10.058 1.00 0.00 H new ATOM 0 HG22 ILE B 143 -12.951 2.635 -11.509 1.00 0.00 H new ATOM 0 HG23 ILE B 143 -14.652 2.502 -11.001 1.00 0.00 H new ATOM 0 HD11 ILE B 143 -15.556 -2.245 -11.466 1.00 0.00 H new ATOM 0 HD12 ILE B 143 -15.024 -1.501 -12.992 1.00 0.00 H new ATOM 0 HD13 ILE B 143 -13.821 -2.005 -11.781 1.00 0.00 H new ATOM 994 N PRO B 144 -13.046 -0.432 -14.661 1.00 0.00 N ATOM 995 CA PRO B 144 -12.808 -1.596 -15.529 1.00 0.00 C ATOM 996 C PRO B 144 -13.337 -2.866 -14.856 1.00 0.00 C ATOM 997 O PRO B 144 -12.931 -3.213 -13.767 1.00 0.00 O ATOM 998 CB PRO B 144 -11.281 -1.665 -15.677 1.00 0.00 C ATOM 999 CG PRO B 144 -10.678 -0.497 -14.851 1.00 0.00 C ATOM 1000 CD PRO B 144 -11.839 0.340 -14.313 1.00 0.00 C ATOM 0 HA PRO B 144 -13.311 -1.510 -16.492 1.00 0.00 H new ATOM 0 HB2 PRO B 144 -10.904 -2.623 -15.318 1.00 0.00 H new ATOM 0 HB3 PRO B 144 -10.993 -1.582 -16.725 1.00 0.00 H new ATOM 0 HG2 PRO B 144 -10.072 -0.882 -14.031 1.00 0.00 H new ATOM 0 HG3 PRO B 144 -10.023 0.113 -15.473 1.00 0.00 H new ATOM 0 HD2 PRO B 144 -11.758 0.485 -13.236 1.00 0.00 H new ATOM 0 HD3 PRO B 144 -11.857 1.331 -14.767 1.00 0.00 H new ATOM 1008 N SER B 145 -14.237 -3.562 -15.495 1.00 0.00 N ATOM 1009 CA SER B 145 -14.779 -4.804 -14.886 1.00 0.00 C ATOM 1010 C SER B 145 -13.672 -5.858 -14.830 1.00 0.00 C ATOM 1011 O SER B 145 -13.662 -6.721 -13.973 1.00 0.00 O ATOM 1012 CB SER B 145 -15.933 -5.318 -15.742 1.00 0.00 C ATOM 1013 OG SER B 145 -15.487 -5.486 -17.081 1.00 0.00 O ATOM 0 H SER B 145 -14.618 -3.323 -16.410 1.00 0.00 H new ATOM 0 HA SER B 145 -15.138 -4.599 -13.877 1.00 0.00 H new ATOM 0 HB2 SER B 145 -16.300 -6.266 -15.347 1.00 0.00 H new ATOM 0 HB3 SER B 145 -16.766 -4.616 -15.710 1.00 0.00 H new ATOM 0 HG SER B 145 -16.039 -4.942 -17.680 1.00 0.00 H new ATOM 1019 N ASN B 146 -12.735 -5.790 -15.736 1.00 0.00 N ATOM 1020 CA ASN B 146 -11.624 -6.782 -15.740 1.00 0.00 C ATOM 1021 C ASN B 146 -10.650 -6.459 -14.605 1.00 0.00 C ATOM 1022 O ASN B 146 -9.736 -7.209 -14.326 1.00 0.00 O ATOM 1023 CB ASN B 146 -10.889 -6.716 -17.080 1.00 0.00 C ATOM 1024 CG ASN B 146 -9.653 -7.616 -17.032 1.00 0.00 C ATOM 1025 OD1 ASN B 146 -9.763 -8.810 -16.841 1.00 0.00 O ATOM 1026 ND2 ASN B 146 -8.470 -7.089 -17.199 1.00 0.00 N ATOM 0 H ASN B 146 -12.691 -5.088 -16.475 1.00 0.00 H new ATOM 0 HA ASN B 146 -12.028 -7.784 -15.597 1.00 0.00 H new ATOM 0 HB2 ASN B 146 -11.551 -7.033 -17.886 1.00 0.00 H new ATOM 0 HB3 ASN B 146 -10.595 -5.689 -17.295 1.00 0.00 H new ATOM 0 HD21 ASN B 146 -7.639 -7.680 -17.169 1.00 0.00 H new ATOM 0 HD22 ASN B 146 -8.377 -6.086 -17.360 1.00 0.00 H new ATOM 1033 N TYR B 147 -10.837 -5.346 -13.949 1.00 0.00 N ATOM 1034 CA TYR B 147 -9.922 -4.975 -12.834 1.00 0.00 C ATOM 1035 C TYR B 147 -10.618 -5.216 -11.494 1.00 0.00 C ATOM 1036 O TYR B 147 -10.170 -4.757 -10.462 1.00 0.00 O ATOM 1037 CB TYR B 147 -9.544 -3.497 -12.953 1.00 0.00 C ATOM 1038 CG TYR B 147 -8.190 -3.368 -13.609 1.00 0.00 C ATOM 1039 CD1 TYR B 147 -7.711 -4.390 -14.440 1.00 0.00 C ATOM 1040 CD2 TYR B 147 -7.412 -2.226 -13.387 1.00 0.00 C ATOM 1041 CE1 TYR B 147 -6.455 -4.268 -15.047 1.00 0.00 C ATOM 1042 CE2 TYR B 147 -6.156 -2.104 -13.995 1.00 0.00 C ATOM 1043 CZ TYR B 147 -5.678 -3.125 -14.824 1.00 0.00 C ATOM 1044 OH TYR B 147 -4.441 -3.006 -15.424 1.00 0.00 O ATOM 0 H TYR B 147 -11.584 -4.678 -14.138 1.00 0.00 H new ATOM 0 HA TYR B 147 -9.022 -5.587 -12.889 1.00 0.00 H new ATOM 0 HB2 TYR B 147 -10.294 -2.966 -13.539 1.00 0.00 H new ATOM 0 HB3 TYR B 147 -9.526 -3.036 -11.965 1.00 0.00 H new ATOM 0 HD1 TYR B 147 -8.311 -5.272 -14.612 1.00 0.00 H new ATOM 0 HD2 TYR B 147 -7.780 -1.438 -12.746 1.00 0.00 H new ATOM 0 HE1 TYR B 147 -6.086 -5.056 -15.687 1.00 0.00 H new ATOM 0 HE2 TYR B 147 -5.557 -1.222 -13.824 1.00 0.00 H new ATOM 0 HH TYR B 147 -4.033 -2.153 -15.166 1.00 0.00 H new ATOM 1054 N VAL B 148 -11.709 -5.932 -11.498 1.00 0.00 N ATOM 1055 CA VAL B 148 -12.425 -6.200 -10.218 1.00 0.00 C ATOM 1056 C VAL B 148 -12.764 -7.687 -10.130 1.00 0.00 C ATOM 1057 O VAL B 148 -12.967 -8.349 -11.128 1.00 0.00 O ATOM 1058 CB VAL B 148 -13.713 -5.380 -10.169 1.00 0.00 C ATOM 1059 CG1 VAL B 148 -13.369 -3.907 -9.944 1.00 0.00 C ATOM 1060 CG2 VAL B 148 -14.465 -5.531 -11.494 1.00 0.00 C ATOM 0 H VAL B 148 -12.135 -6.342 -12.329 1.00 0.00 H new ATOM 0 HA VAL B 148 -11.787 -5.920 -9.380 1.00 0.00 H new ATOM 0 HB VAL B 148 -14.341 -5.737 -9.352 1.00 0.00 H new ATOM 0 HG11 VAL B 148 -14.287 -3.320 -9.909 1.00 0.00 H new ATOM 0 HG12 VAL B 148 -12.833 -3.799 -9.001 1.00 0.00 H new ATOM 0 HG13 VAL B 148 -12.742 -3.551 -10.761 1.00 0.00 H new ATOM 0 HG21 VAL B 148 -15.384 -4.946 -11.459 1.00 0.00 H new ATOM 0 HG22 VAL B 148 -13.838 -5.174 -12.311 1.00 0.00 H new ATOM 0 HG23 VAL B 148 -14.709 -6.581 -11.656 1.00 0.00 H new ATOM 1070 N ALA B 149 -12.828 -8.218 -8.942 1.00 0.00 N ATOM 1071 CA ALA B 149 -13.155 -9.666 -8.795 1.00 0.00 C ATOM 1072 C ALA B 149 -13.657 -9.940 -7.375 1.00 0.00 C ATOM 1073 O ALA B 149 -13.306 -9.236 -6.450 1.00 0.00 O ATOM 1074 CB ALA B 149 -11.903 -10.501 -9.065 1.00 0.00 C ATOM 0 H ALA B 149 -12.669 -7.716 -8.069 1.00 0.00 H new ATOM 0 HA ALA B 149 -13.933 -9.935 -9.510 1.00 0.00 H new ATOM 0 HB1 ALA B 149 -12.141 -11.559 -8.958 1.00 0.00 H new ATOM 0 HB2 ALA B 149 -11.549 -10.310 -10.078 1.00 0.00 H new ATOM 0 HB3 ALA B 149 -11.124 -10.230 -8.352 1.00 0.00 H new ATOM 1080 N PRO B 150 -14.464 -10.962 -7.247 1.00 0.00 N ATOM 1081 CA PRO B 150 -15.030 -11.355 -5.945 1.00 0.00 C ATOM 1082 C PRO B 150 -13.905 -11.719 -4.972 1.00 0.00 C ATOM 1083 O PRO B 150 -12.991 -12.445 -5.310 1.00 0.00 O ATOM 1084 CB PRO B 150 -15.904 -12.580 -6.251 1.00 0.00 C ATOM 1085 CG PRO B 150 -15.808 -12.859 -7.774 1.00 0.00 C ATOM 1086 CD PRO B 150 -14.875 -11.803 -8.385 1.00 0.00 C ATOM 0 HA PRO B 150 -15.603 -10.554 -5.478 1.00 0.00 H new ATOM 0 HB2 PRO B 150 -15.563 -13.445 -5.682 1.00 0.00 H new ATOM 0 HB3 PRO B 150 -16.938 -12.394 -5.961 1.00 0.00 H new ATOM 0 HG2 PRO B 150 -15.421 -13.862 -7.955 1.00 0.00 H new ATOM 0 HG3 PRO B 150 -16.795 -12.810 -8.235 1.00 0.00 H new ATOM 0 HD2 PRO B 150 -14.014 -12.267 -8.866 1.00 0.00 H new ATOM 0 HD3 PRO B 150 -15.387 -11.215 -9.147 1.00 0.00 H new ATOM 1094 N VAL B 151 -13.963 -11.221 -3.768 1.00 0.00 N ATOM 1095 CA VAL B 151 -12.894 -11.539 -2.780 1.00 0.00 C ATOM 1096 C VAL B 151 -13.032 -12.996 -2.335 1.00 0.00 C ATOM 1097 O VAL B 151 -14.116 -13.537 -2.476 1.00 0.00 O ATOM 1098 CB VAL B 151 -13.029 -10.621 -1.566 1.00 0.00 C ATOM 1099 CG1 VAL B 151 -14.352 -10.905 -0.851 1.00 0.00 C ATOM 1100 CG2 VAL B 151 -11.865 -10.876 -0.604 1.00 0.00 C ATOM 0 H VAL B 151 -14.703 -10.608 -3.426 1.00 0.00 H new ATOM 0 HA VAL B 151 -11.917 -11.388 -3.240 1.00 0.00 H new ATOM 0 HB VAL B 151 -13.011 -9.582 -1.894 1.00 0.00 H new ATOM 0 HG11 VAL B 151 -14.446 -10.249 0.014 1.00 0.00 H new ATOM 0 HG12 VAL B 151 -15.181 -10.724 -1.535 1.00 0.00 H new ATOM 0 HG13 VAL B 151 -14.372 -11.944 -0.523 1.00 0.00 H new ATOM 0 HG21 VAL B 151 -11.959 -10.222 0.263 1.00 0.00 H new ATOM 0 HG22 VAL B 151 -11.884 -11.916 -0.278 1.00 0.00 H new ATOM 0 HG23 VAL B 151 -10.922 -10.672 -1.111 1.00 0.00 H new