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 Set 1.1: B 134 SER OG : rot 180:sc= 0.0853 USER MOD Set 1.2: B 137 THR OG1 : rot 180:sc= -2.69! USER MOD Single : B 101 TYR OH : rot 180:sc= 0 USER MOD Single : B 103 TYR OH : rot 160:sc= 0.0303 USER MOD Single : B 107 THR OG1 : rot 180:sc= -0.31 USER MOD Single : B 112 SER OG : rot -7:sc= -1.51! USER MOD Single : B 114 HIS : no HD1:sc= -0.066 X(o=-0.066,f=-0.066) 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= -2.68! C(o=-2.7!,f=-3.2!) USER MOD Single : B 123 ASN : amide:sc= -0.298 X(o=-0.3,f=-0.062) USER MOD Single : B 124 SER OG : rot 180:sc= 0.0164 USER MOD Single : B 136 THR OG1 : rot 180:sc= 0 USER MOD Single : B 140 THR OG1 : rot 29:sc= 0.0148 USER MOD Single : B 142 TYR OH : rot -84:sc= 0.908 USER MOD Single : B 145 SER OG : rot -105:sc= 0.562 USER MOD Single : B 146 ASN : amide:sc= -0.0845 X(o=-0.084,f=-0.084) USER MOD Single : B 147 TYR OH : rot -106:sc= -0.463 USER MOD ----------------------------------------------------------------- ATOM 69 N LEU A 95 -11.224 -2.310 -21.929 1.00 0.00 N ATOM 70 CA LEU A 95 -10.566 -2.569 -20.612 1.00 0.00 C ATOM 71 C LEU A 95 -9.062 -2.761 -20.838 1.00 0.00 C ATOM 72 O LEU A 95 -8.651 -3.252 -21.869 1.00 0.00 O ATOM 73 CB LEU A 95 -11.143 -3.828 -19.928 1.00 0.00 C ATOM 74 CG LEU A 95 -12.022 -4.635 -20.891 1.00 0.00 C ATOM 75 CD1 LEU A 95 -11.222 -5.004 -22.141 1.00 0.00 C ATOM 76 CD2 LEU A 95 -12.486 -5.916 -20.194 1.00 0.00 C ATOM 0 HA LEU A 95 -10.752 -1.715 -19.960 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.327 -4.454 -19.567 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.729 -3.534 -19.057 1.00 0.00 H new ATOM 0 HG LEU A 95 -12.885 -4.035 -21.180 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -11.853 -5.577 -22.821 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -10.885 -4.095 -22.639 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -10.357 -5.603 -21.856 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -13.112 -6.494 -20.874 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -11.618 -6.509 -19.907 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -13.060 -5.658 -19.304 1.00 0.00 H new ATOM 88 N PRO A 96 -8.284 -2.362 -19.864 1.00 0.00 N ATOM 89 CA PRO A 96 -6.818 -2.476 -19.937 1.00 0.00 C ATOM 90 C PRO A 96 -6.410 -3.948 -20.044 1.00 0.00 C ATOM 91 O PRO A 96 -5.592 -4.319 -20.862 1.00 0.00 O ATOM 92 CB PRO A 96 -6.309 -1.867 -18.624 1.00 0.00 C ATOM 93 CG PRO A 96 -7.545 -1.405 -17.810 1.00 0.00 C ATOM 94 CD PRO A 96 -8.800 -1.768 -18.619 1.00 0.00 C ATOM 0 HA PRO A 96 -6.404 -1.968 -20.808 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -5.732 -2.600 -18.060 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -5.646 -1.025 -18.824 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -7.565 -1.892 -16.835 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -7.504 -0.331 -17.629 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.431 -2.472 -18.076 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -9.408 -0.887 -18.823 1.00 0.00 H new ATOM 238 N LEU B 86 -18.998 -8.161 -2.501 1.00 0.00 N ATOM 239 CA LEU B 86 -17.861 -7.214 -2.323 1.00 0.00 C ATOM 240 C LEU B 86 -16.726 -7.595 -3.274 1.00 0.00 C ATOM 241 O LEU B 86 -16.332 -8.742 -3.356 1.00 0.00 O ATOM 242 CB LEU B 86 -17.362 -7.285 -0.878 1.00 0.00 C ATOM 243 CG LEU B 86 -18.113 -6.259 -0.027 1.00 0.00 C ATOM 244 CD1 LEU B 86 -17.671 -4.848 -0.418 1.00 0.00 C ATOM 245 CD2 LEU B 86 -19.618 -6.405 -0.266 1.00 0.00 C ATOM 0 HA LEU B 86 -18.194 -6.200 -2.544 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -17.516 -8.287 -0.478 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -16.290 -7.088 -0.842 1.00 0.00 H new ATOM 0 HG LEU B 86 -17.892 -6.429 1.027 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -18.206 -4.118 0.189 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -16.599 -4.743 -0.250 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -17.892 -4.676 -1.471 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -20.155 -5.675 0.339 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -19.837 -6.234 -1.320 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -19.935 -7.410 0.012 1.00 0.00 H new ATOM 257 N PHE B 87 -16.199 -6.645 -3.995 1.00 0.00 N ATOM 258 CA PHE B 87 -15.090 -6.955 -4.940 1.00 0.00 C ATOM 259 C PHE B 87 -13.815 -6.243 -4.488 1.00 0.00 C ATOM 260 O PHE B 87 -13.806 -5.516 -3.515 1.00 0.00 O ATOM 261 CB PHE B 87 -15.459 -6.469 -6.344 1.00 0.00 C ATOM 262 CG PHE B 87 -16.726 -7.148 -6.803 1.00 0.00 C ATOM 263 CD1 PHE B 87 -17.971 -6.604 -6.470 1.00 0.00 C ATOM 264 CD2 PHE B 87 -16.655 -8.320 -7.566 1.00 0.00 C ATOM 265 CE1 PHE B 87 -19.147 -7.230 -6.900 1.00 0.00 C ATOM 266 CE2 PHE B 87 -17.831 -8.947 -7.995 1.00 0.00 C ATOM 267 CZ PHE B 87 -19.077 -8.403 -7.662 1.00 0.00 C ATOM 0 H PHE B 87 -16.488 -5.667 -3.971 1.00 0.00 H new ATOM 0 HA PHE B 87 -14.925 -8.032 -4.954 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -15.596 -5.388 -6.340 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -14.647 -6.685 -7.039 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -18.025 -5.700 -5.881 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -15.694 -8.740 -7.823 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -20.108 -6.809 -6.644 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -17.777 -9.851 -8.583 1.00 0.00 H new ATOM 0 HZ PHE B 87 -19.984 -8.888 -7.992 1.00 0.00 H new ATOM 277 N VAL B 88 -12.739 -6.441 -5.199 1.00 0.00 N ATOM 278 CA VAL B 88 -11.461 -5.774 -4.829 1.00 0.00 C ATOM 279 C VAL B 88 -10.727 -5.379 -6.110 1.00 0.00 C ATOM 280 O VAL B 88 -10.857 -6.026 -7.131 1.00 0.00 O ATOM 281 CB VAL B 88 -10.590 -6.735 -4.018 1.00 0.00 C ATOM 282 CG1 VAL B 88 -9.691 -5.936 -3.069 1.00 0.00 C ATOM 283 CG2 VAL B 88 -11.483 -7.674 -3.202 1.00 0.00 C ATOM 0 H VAL B 88 -12.691 -7.039 -6.024 1.00 0.00 H new ATOM 0 HA VAL B 88 -11.668 -4.889 -4.227 1.00 0.00 H new ATOM 0 HB VAL B 88 -9.972 -7.321 -4.698 1.00 0.00 H new ATOM 0 HG11 VAL B 88 -9.071 -6.622 -2.492 1.00 0.00 H new ATOM 0 HG12 VAL B 88 -9.052 -5.269 -3.648 1.00 0.00 H new ATOM 0 HG13 VAL B 88 -10.309 -5.348 -2.391 1.00 0.00 H new ATOM 0 HG21 VAL B 88 -10.861 -8.358 -2.625 1.00 0.00 H new ATOM 0 HG22 VAL B 88 -12.103 -7.088 -2.524 1.00 0.00 H new ATOM 0 HG23 VAL B 88 -12.122 -8.245 -3.876 1.00 0.00 H new ATOM 293 N ALA B 89 -9.963 -4.323 -6.067 1.00 0.00 N ATOM 294 CA ALA B 89 -9.225 -3.885 -7.286 1.00 0.00 C ATOM 295 C ALA B 89 -7.856 -4.567 -7.329 1.00 0.00 C ATOM 296 O ALA B 89 -7.029 -4.380 -6.458 1.00 0.00 O ATOM 297 CB ALA B 89 -9.043 -2.365 -7.257 1.00 0.00 C ATOM 0 H ALA B 89 -9.817 -3.744 -5.240 1.00 0.00 H new ATOM 0 HA ALA B 89 -9.794 -4.163 -8.173 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -8.503 -2.046 -8.149 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -10.020 -1.882 -7.232 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -8.476 -2.083 -6.370 1.00 0.00 H new ATOM 303 N LEU B 100 -7.615 -5.360 -8.336 1.00 0.00 N ATOM 304 CA LEU B 100 -6.303 -6.061 -8.441 1.00 0.00 C ATOM 305 C LEU B 100 -5.299 -5.167 -9.171 1.00 0.00 C ATOM 306 O LEU B 100 -4.139 -5.503 -9.308 1.00 0.00 O ATOM 307 CB LEU B 100 -6.483 -7.358 -9.231 1.00 0.00 C ATOM 308 CG LEU B 100 -7.773 -8.053 -8.790 1.00 0.00 C ATOM 309 CD1 LEU B 100 -8.667 -8.291 -10.007 1.00 0.00 C ATOM 310 CD2 LEU B 100 -7.432 -9.396 -8.139 1.00 0.00 C ATOM 0 H LEU B 100 -8.271 -5.554 -9.093 1.00 0.00 H new ATOM 0 HA LEU B 100 -5.933 -6.285 -7.440 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -6.521 -7.143 -10.299 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -5.630 -8.016 -9.068 1.00 0.00 H new ATOM 0 HG LEU B 100 -8.297 -7.422 -8.072 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -9.586 -8.786 -9.692 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -8.911 -7.336 -10.472 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -8.143 -8.921 -10.726 1.00 0.00 H new ATOM 0 HD21 LEU B 100 -8.351 -9.892 -7.825 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -6.907 -10.026 -8.858 1.00 0.00 H new ATOM 0 HD23 LEU B 100 -6.795 -9.228 -7.271 1.00 0.00 H new ATOM 322 N TYR B 101 -5.736 -4.036 -9.650 1.00 0.00 N ATOM 323 CA TYR B 101 -4.808 -3.128 -10.380 1.00 0.00 C ATOM 324 C TYR B 101 -5.071 -1.681 -9.961 1.00 0.00 C ATOM 325 O TYR B 101 -6.006 -1.393 -9.241 1.00 0.00 O ATOM 326 CB TYR B 101 -5.044 -3.273 -11.884 1.00 0.00 C ATOM 327 CG TYR B 101 -3.774 -3.742 -12.551 1.00 0.00 C ATOM 328 CD1 TYR B 101 -3.474 -5.109 -12.597 1.00 0.00 C ATOM 329 CD2 TYR B 101 -2.900 -2.812 -13.124 1.00 0.00 C ATOM 330 CE1 TYR B 101 -2.298 -5.546 -13.216 1.00 0.00 C ATOM 331 CE2 TYR B 101 -1.722 -3.250 -13.743 1.00 0.00 C ATOM 332 CZ TYR B 101 -1.421 -4.617 -13.789 1.00 0.00 C ATOM 333 OH TYR B 101 -0.261 -5.047 -14.399 1.00 0.00 O ATOM 0 H TYR B 101 -6.696 -3.701 -9.568 1.00 0.00 H new ATOM 0 HA TYR B 101 -3.777 -3.391 -10.142 1.00 0.00 H new ATOM 0 HB2 TYR B 101 -5.849 -3.984 -12.069 1.00 0.00 H new ATOM 0 HB3 TYR B 101 -5.358 -2.319 -12.307 1.00 0.00 H new ATOM 0 HD1 TYR B 101 -4.150 -5.826 -12.155 1.00 0.00 H new ATOM 0 HD2 TYR B 101 -3.133 -1.758 -13.089 1.00 0.00 H new ATOM 0 HE1 TYR B 101 -2.067 -6.600 -13.252 1.00 0.00 H new ATOM 0 HE2 TYR B 101 -1.046 -2.533 -14.185 1.00 0.00 H new ATOM 0 HH TYR B 101 0.232 -4.274 -14.745 1.00 0.00 H new ATOM 343 N ASP B 102 -4.254 -0.767 -10.409 1.00 0.00 N ATOM 344 CA ASP B 102 -4.460 0.661 -10.039 1.00 0.00 C ATOM 345 C ASP B 102 -5.095 1.402 -11.217 1.00 0.00 C ATOM 346 O ASP B 102 -5.134 0.906 -12.326 1.00 0.00 O ATOM 347 CB ASP B 102 -3.113 1.303 -9.698 1.00 0.00 C ATOM 348 CG ASP B 102 -2.036 0.767 -10.644 1.00 0.00 C ATOM 349 OD1 ASP B 102 -1.498 -0.290 -10.360 1.00 0.00 O ATOM 350 OD2 ASP B 102 -1.769 1.425 -11.636 1.00 0.00 O ATOM 0 H ASP B 102 -3.454 -0.948 -11.015 1.00 0.00 H new ATOM 0 HA ASP B 102 -5.117 0.721 -9.172 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -3.182 2.387 -9.786 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -2.845 1.084 -8.664 1.00 0.00 H new ATOM 355 N TYR B 103 -5.597 2.583 -10.987 1.00 0.00 N ATOM 356 CA TYR B 103 -6.230 3.350 -12.096 1.00 0.00 C ATOM 357 C TYR B 103 -6.249 4.838 -11.741 1.00 0.00 C ATOM 358 O TYR B 103 -6.768 5.235 -10.716 1.00 0.00 O ATOM 359 CB TYR B 103 -7.663 2.855 -12.304 1.00 0.00 C ATOM 360 CG TYR B 103 -8.147 3.280 -13.670 1.00 0.00 C ATOM 361 CD1 TYR B 103 -7.480 2.834 -14.818 1.00 0.00 C ATOM 362 CD2 TYR B 103 -9.259 4.121 -13.788 1.00 0.00 C ATOM 363 CE1 TYR B 103 -7.927 3.229 -16.084 1.00 0.00 C ATOM 364 CE2 TYR B 103 -9.705 4.516 -15.055 1.00 0.00 C ATOM 365 CZ TYR B 103 -9.040 4.070 -16.202 1.00 0.00 C ATOM 366 OH TYR B 103 -9.478 4.461 -17.450 1.00 0.00 O ATOM 0 H TYR B 103 -5.596 3.050 -10.080 1.00 0.00 H new ATOM 0 HA TYR B 103 -5.659 3.204 -13.013 1.00 0.00 H new ATOM 0 HB2 TYR B 103 -7.701 1.769 -12.214 1.00 0.00 H new ATOM 0 HB3 TYR B 103 -8.316 3.262 -11.532 1.00 0.00 H new ATOM 0 HD1 TYR B 103 -6.621 2.186 -14.726 1.00 0.00 H new ATOM 0 HD2 TYR B 103 -9.773 4.465 -12.903 1.00 0.00 H new ATOM 0 HE1 TYR B 103 -7.413 2.885 -16.970 1.00 0.00 H new ATOM 0 HE2 TYR B 103 -10.563 5.165 -15.147 1.00 0.00 H new ATOM 0 HH TYR B 103 -10.409 4.760 -17.391 1.00 0.00 H new ATOM 376 N GLU B 104 -5.686 5.665 -12.578 1.00 0.00 N ATOM 377 CA GLU B 104 -5.672 7.125 -12.287 1.00 0.00 C ATOM 378 C GLU B 104 -6.756 7.821 -13.113 1.00 0.00 C ATOM 379 O GLU B 104 -6.474 8.497 -14.081 1.00 0.00 O ATOM 380 CB GLU B 104 -4.304 7.704 -12.652 1.00 0.00 C ATOM 381 CG GLU B 104 -3.927 7.267 -14.069 1.00 0.00 C ATOM 382 CD GLU B 104 -2.829 6.203 -14.001 1.00 0.00 C ATOM 383 OE1 GLU B 104 -2.211 6.083 -12.957 1.00 0.00 O ATOM 384 OE2 GLU B 104 -2.624 5.528 -14.996 1.00 0.00 O ATOM 0 H GLU B 104 -5.235 5.392 -13.451 1.00 0.00 H new ATOM 0 HA GLU B 104 -5.864 7.285 -11.226 1.00 0.00 H new ATOM 0 HB2 GLU B 104 -4.329 8.792 -12.590 1.00 0.00 H new ATOM 0 HB3 GLU B 104 -3.551 7.362 -11.942 1.00 0.00 H new ATOM 0 HG2 GLU B 104 -4.802 6.869 -14.583 1.00 0.00 H new ATOM 0 HG3 GLU B 104 -3.581 8.125 -14.646 1.00 0.00 H new ATOM 391 N ALA B 105 -7.996 7.660 -12.736 1.00 0.00 N ATOM 392 CA ALA B 105 -9.097 8.311 -13.499 1.00 0.00 C ATOM 393 C ALA B 105 -8.853 9.821 -13.563 1.00 0.00 C ATOM 394 O ALA B 105 -8.719 10.481 -12.551 1.00 0.00 O ATOM 395 CB ALA B 105 -10.432 8.037 -12.803 1.00 0.00 C ATOM 0 H ALA B 105 -8.293 7.106 -11.933 1.00 0.00 H new ATOM 0 HA ALA B 105 -9.126 7.906 -14.511 1.00 0.00 H new ATOM 0 HB1 ALA B 105 -11.238 8.513 -13.361 1.00 0.00 H new ATOM 0 HB2 ALA B 105 -10.606 6.962 -12.760 1.00 0.00 H new ATOM 0 HB3 ALA B 105 -10.404 8.440 -11.791 1.00 0.00 H new ATOM 401 N ARG B 106 -8.795 10.372 -14.745 1.00 0.00 N ATOM 402 CA ARG B 106 -8.560 11.838 -14.874 1.00 0.00 C ATOM 403 C ARG B 106 -9.884 12.541 -15.180 1.00 0.00 C ATOM 404 O ARG B 106 -9.915 13.705 -15.528 1.00 0.00 O ATOM 405 CB ARG B 106 -7.571 12.097 -16.014 1.00 0.00 C ATOM 406 CG ARG B 106 -6.560 10.951 -16.083 1.00 0.00 C ATOM 407 CD ARG B 106 -5.455 11.305 -17.079 1.00 0.00 C ATOM 408 NE ARG B 106 -5.852 10.853 -18.442 1.00 0.00 N ATOM 409 CZ ARG B 106 -5.851 11.699 -19.435 1.00 0.00 C ATOM 410 NH1 ARG B 106 -6.412 12.869 -19.296 1.00 0.00 N ATOM 411 NH2 ARG B 106 -5.290 11.374 -20.567 1.00 0.00 N ATOM 0 H ARG B 106 -8.900 9.870 -15.627 1.00 0.00 H new ATOM 0 HA ARG B 106 -8.150 12.224 -13.941 1.00 0.00 H new ATOM 0 HB2 ARG B 106 -8.105 12.182 -16.960 1.00 0.00 H new ATOM 0 HB3 ARG B 106 -7.054 13.043 -15.853 1.00 0.00 H new ATOM 0 HG2 ARG B 106 -6.131 10.770 -15.097 1.00 0.00 H new ATOM 0 HG3 ARG B 106 -7.058 10.031 -16.388 1.00 0.00 H new ATOM 0 HD2 ARG B 106 -5.280 12.381 -17.077 1.00 0.00 H new ATOM 0 HD3 ARG B 106 -4.519 10.830 -16.785 1.00 0.00 H new ATOM 0 HE ARG B 106 -6.124 9.883 -18.599 1.00 0.00 H new ATOM 0 HH11 ARG B 106 -6.851 13.122 -18.411 1.00 0.00 H new ATOM 0 HH12 ARG B 106 -6.411 13.530 -20.072 1.00 0.00 H new ATOM 0 HH21 ARG B 106 -4.853 10.459 -20.675 1.00 0.00 H new ATOM 0 HH22 ARG B 106 -5.289 12.035 -21.344 1.00 0.00 H new ATOM 425 N THR B 107 -10.980 11.844 -15.052 1.00 0.00 N ATOM 426 CA THR B 107 -12.301 12.474 -15.337 1.00 0.00 C ATOM 427 C THR B 107 -13.175 12.410 -14.084 1.00 0.00 C ATOM 428 O THR B 107 -12.861 11.726 -13.130 1.00 0.00 O ATOM 429 CB THR B 107 -12.990 11.723 -16.478 1.00 0.00 C ATOM 430 OG1 THR B 107 -14.297 12.249 -16.667 1.00 0.00 O ATOM 431 CG2 THR B 107 -13.081 10.236 -16.128 1.00 0.00 C ATOM 0 H THR B 107 -11.018 10.867 -14.763 1.00 0.00 H new ATOM 0 HA THR B 107 -12.153 13.515 -15.625 1.00 0.00 H new ATOM 0 HB THR B 107 -12.414 11.844 -17.395 1.00 0.00 H new ATOM 0 HG1 THR B 107 -14.740 11.770 -17.399 1.00 0.00 H new ATOM 0 HG21 THR B 107 -13.572 9.700 -16.941 1.00 0.00 H new ATOM 0 HG22 THR B 107 -12.078 9.834 -15.982 1.00 0.00 H new ATOM 0 HG23 THR B 107 -13.658 10.113 -15.211 1.00 0.00 H new ATOM 439 N GLU B 108 -14.274 13.114 -14.079 1.00 0.00 N ATOM 440 CA GLU B 108 -15.168 13.089 -12.888 1.00 0.00 C ATOM 441 C GLU B 108 -16.095 11.873 -12.970 1.00 0.00 C ATOM 442 O GLU B 108 -16.992 11.709 -12.167 1.00 0.00 O ATOM 443 CB GLU B 108 -16.003 14.371 -12.849 1.00 0.00 C ATOM 444 CG GLU B 108 -16.765 14.529 -14.165 1.00 0.00 C ATOM 445 CD GLU B 108 -16.208 15.725 -14.939 1.00 0.00 C ATOM 446 OE1 GLU B 108 -16.650 16.833 -14.678 1.00 0.00 O ATOM 447 OE2 GLU B 108 -15.346 15.515 -15.776 1.00 0.00 O ATOM 0 H GLU B 108 -14.591 13.705 -14.848 1.00 0.00 H new ATOM 0 HA GLU B 108 -14.565 13.023 -11.982 1.00 0.00 H new ATOM 0 HB2 GLU B 108 -16.703 14.335 -12.014 1.00 0.00 H new ATOM 0 HB3 GLU B 108 -15.356 15.233 -12.686 1.00 0.00 H new ATOM 0 HG2 GLU B 108 -16.673 13.622 -14.762 1.00 0.00 H new ATOM 0 HG3 GLU B 108 -17.827 14.674 -13.967 1.00 0.00 H new ATOM 454 N ASP B 109 -15.884 11.016 -13.933 1.00 0.00 N ATOM 455 CA ASP B 109 -16.750 9.810 -14.063 1.00 0.00 C ATOM 456 C ASP B 109 -15.985 8.580 -13.573 1.00 0.00 C ATOM 457 O ASP B 109 -16.229 8.073 -12.495 1.00 0.00 O ATOM 458 CB ASP B 109 -17.141 9.617 -15.530 1.00 0.00 C ATOM 459 CG ASP B 109 -18.384 10.451 -15.841 1.00 0.00 C ATOM 460 OD1 ASP B 109 -19.098 10.787 -14.910 1.00 0.00 O ATOM 461 OD2 ASP B 109 -18.603 10.739 -17.007 1.00 0.00 O ATOM 0 H ASP B 109 -15.149 11.100 -14.635 1.00 0.00 H new ATOM 0 HA ASP B 109 -17.650 9.942 -13.463 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -16.318 9.916 -16.179 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -17.338 8.564 -15.729 1.00 0.00 H new ATOM 466 N ASP B 110 -15.056 8.097 -14.354 1.00 0.00 N ATOM 467 CA ASP B 110 -14.273 6.903 -13.927 1.00 0.00 C ATOM 468 C ASP B 110 -13.808 7.098 -12.484 1.00 0.00 C ATOM 469 O ASP B 110 -13.972 8.156 -11.908 1.00 0.00 O ATOM 470 CB ASP B 110 -13.056 6.740 -14.840 1.00 0.00 C ATOM 471 CG ASP B 110 -13.426 5.857 -16.032 1.00 0.00 C ATOM 472 OD1 ASP B 110 -14.608 5.731 -16.307 1.00 0.00 O ATOM 473 OD2 ASP B 110 -12.521 5.323 -16.651 1.00 0.00 O ATOM 0 H ASP B 110 -14.806 8.477 -15.267 1.00 0.00 H new ATOM 0 HA ASP B 110 -14.896 6.011 -13.993 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -12.716 7.715 -15.188 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -12.230 6.294 -14.286 1.00 0.00 H new ATOM 478 N LEU B 111 -13.232 6.090 -11.890 1.00 0.00 N ATOM 479 CA LEU B 111 -12.765 6.232 -10.484 1.00 0.00 C ATOM 480 C LEU B 111 -11.245 6.096 -10.427 1.00 0.00 C ATOM 481 O LEU B 111 -10.624 5.527 -11.303 1.00 0.00 O ATOM 482 CB LEU B 111 -13.402 5.145 -9.617 1.00 0.00 C ATOM 483 CG LEU B 111 -14.896 5.056 -9.926 1.00 0.00 C ATOM 484 CD1 LEU B 111 -15.344 3.594 -9.885 1.00 0.00 C ATOM 485 CD2 LEU B 111 -15.678 5.858 -8.883 1.00 0.00 C ATOM 0 H LEU B 111 -13.065 5.178 -12.316 1.00 0.00 H new ATOM 0 HA LEU B 111 -13.056 7.214 -10.111 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -12.923 4.185 -9.808 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -13.251 5.372 -8.562 1.00 0.00 H new ATOM 0 HG LEU B 111 -15.086 5.463 -10.919 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -16.410 3.534 -10.106 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -14.787 3.022 -10.627 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -15.155 3.183 -8.893 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -16.744 5.796 -9.101 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -15.486 5.449 -7.891 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -15.361 6.901 -8.913 1.00 0.00 H new ATOM 497 N SER B 112 -10.645 6.608 -9.390 1.00 0.00 N ATOM 498 CA SER B 112 -9.167 6.509 -9.251 1.00 0.00 C ATOM 499 C SER B 112 -8.852 5.770 -7.952 1.00 0.00 C ATOM 500 O SER B 112 -9.398 6.074 -6.910 1.00 0.00 O ATOM 501 CB SER B 112 -8.559 7.912 -9.207 1.00 0.00 C ATOM 502 OG SER B 112 -7.269 7.883 -9.799 1.00 0.00 O ATOM 0 H SER B 112 -11.118 7.094 -8.628 1.00 0.00 H new ATOM 0 HA SER B 112 -8.746 5.969 -10.099 1.00 0.00 H new ATOM 0 HB2 SER B 112 -9.200 8.615 -9.739 1.00 0.00 H new ATOM 0 HB3 SER B 112 -8.491 8.259 -8.176 1.00 0.00 H new ATOM 0 HG SER B 112 -7.017 6.955 -9.990 1.00 0.00 H new ATOM 508 N PHE B 113 -7.990 4.793 -7.999 1.00 0.00 N ATOM 509 CA PHE B 113 -7.669 4.039 -6.758 1.00 0.00 C ATOM 510 C PHE B 113 -6.415 3.190 -6.968 1.00 0.00 C ATOM 511 O PHE B 113 -5.768 3.259 -7.995 1.00 0.00 O ATOM 512 CB PHE B 113 -8.844 3.124 -6.411 1.00 0.00 C ATOM 513 CG PHE B 113 -9.225 2.313 -7.629 1.00 0.00 C ATOM 514 CD1 PHE B 113 -10.012 2.886 -8.636 1.00 0.00 C ATOM 515 CD2 PHE B 113 -8.790 0.987 -7.751 1.00 0.00 C ATOM 516 CE1 PHE B 113 -10.363 2.134 -9.765 1.00 0.00 C ATOM 517 CE2 PHE B 113 -9.142 0.236 -8.880 1.00 0.00 C ATOM 518 CZ PHE B 113 -9.928 0.807 -9.886 1.00 0.00 C ATOM 0 H PHE B 113 -7.497 4.486 -8.838 1.00 0.00 H new ATOM 0 HA PHE B 113 -7.490 4.744 -5.946 1.00 0.00 H new ATOM 0 HB2 PHE B 113 -8.573 2.461 -5.589 1.00 0.00 H new ATOM 0 HB3 PHE B 113 -9.694 3.717 -6.075 1.00 0.00 H new ATOM 0 HD1 PHE B 113 -10.348 3.908 -8.542 1.00 0.00 H new ATOM 0 HD2 PHE B 113 -8.184 0.544 -6.975 1.00 0.00 H new ATOM 0 HE1 PHE B 113 -10.969 2.577 -10.542 1.00 0.00 H new ATOM 0 HE2 PHE B 113 -8.806 -0.786 -8.974 1.00 0.00 H new ATOM 0 HZ PHE B 113 -10.200 0.226 -10.755 1.00 0.00 H new ATOM 528 N HIS B 114 -6.073 2.385 -6.000 1.00 0.00 N ATOM 529 CA HIS B 114 -4.869 1.519 -6.131 1.00 0.00 C ATOM 530 C HIS B 114 -5.228 0.094 -5.702 1.00 0.00 C ATOM 531 O HIS B 114 -6.128 -0.117 -4.915 1.00 0.00 O ATOM 532 CB HIS B 114 -3.752 2.058 -5.236 1.00 0.00 C ATOM 533 CG HIS B 114 -3.417 3.466 -5.645 1.00 0.00 C ATOM 534 ND1 HIS B 114 -3.563 4.541 -4.784 1.00 0.00 N ATOM 535 CD2 HIS B 114 -2.943 3.990 -6.822 1.00 0.00 C ATOM 536 CE1 HIS B 114 -3.182 5.647 -5.448 1.00 0.00 C ATOM 537 NE2 HIS B 114 -2.794 5.368 -6.695 1.00 0.00 N ATOM 0 H HIS B 114 -6.579 2.290 -5.119 1.00 0.00 H new ATOM 0 HA HIS B 114 -4.529 1.516 -7.167 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -4.065 2.036 -4.192 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -2.869 1.424 -5.317 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -2.720 3.420 -7.711 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -3.189 6.640 -5.024 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -2.460 6.023 -7.402 1.00 0.00 H new ATOM 545 N LYS B 115 -4.537 -0.884 -6.217 1.00 0.00 N ATOM 546 CA LYS B 115 -4.846 -2.292 -5.839 1.00 0.00 C ATOM 547 C LYS B 115 -5.068 -2.385 -4.327 1.00 0.00 C ATOM 548 O LYS B 115 -4.282 -1.894 -3.543 1.00 0.00 O ATOM 549 CB LYS B 115 -3.677 -3.194 -6.237 1.00 0.00 C ATOM 550 CG LYS B 115 -3.977 -4.634 -5.817 1.00 0.00 C ATOM 551 CD LYS B 115 -3.077 -5.024 -4.642 1.00 0.00 C ATOM 552 CE LYS B 115 -2.668 -6.492 -4.775 1.00 0.00 C ATOM 553 NZ LYS B 115 -3.712 -7.356 -4.154 1.00 0.00 N ATOM 0 H LYS B 115 -3.772 -0.770 -6.883 1.00 0.00 H new ATOM 0 HA LYS B 115 -5.750 -2.614 -6.357 1.00 0.00 H new ATOM 0 HB2 LYS B 115 -3.516 -3.144 -7.314 1.00 0.00 H new ATOM 0 HB3 LYS B 115 -2.759 -2.849 -5.761 1.00 0.00 H new ATOM 0 HG2 LYS B 115 -5.025 -4.730 -5.533 1.00 0.00 H new ATOM 0 HG3 LYS B 115 -3.811 -5.310 -6.656 1.00 0.00 H new ATOM 0 HD2 LYS B 115 -2.191 -4.389 -4.623 1.00 0.00 H new ATOM 0 HD3 LYS B 115 -3.602 -4.866 -3.700 1.00 0.00 H new ATOM 0 HE2 LYS B 115 -2.543 -6.752 -5.826 1.00 0.00 H new ATOM 0 HE3 LYS B 115 -1.707 -6.658 -4.289 1.00 0.00 H new ATOM 0 HZ1 LYS B 115 -3.435 -8.354 -4.244 1.00 0.00 H new ATOM 0 HZ2 LYS B 115 -3.810 -7.113 -3.148 1.00 0.00 H new ATOM 0 HZ3 LYS B 115 -4.621 -7.204 -4.637 1.00 0.00 H new ATOM 567 N GLY B 116 -6.133 -3.020 -3.911 1.00 0.00 N ATOM 568 CA GLY B 116 -6.400 -3.152 -2.450 1.00 0.00 C ATOM 569 C GLY B 116 -7.711 -2.447 -2.092 1.00 0.00 C ATOM 570 O GLY B 116 -8.326 -2.738 -1.086 1.00 0.00 O ATOM 0 H GLY B 116 -6.828 -3.452 -4.520 1.00 0.00 H new ATOM 0 HA2 GLY B 116 -6.457 -4.205 -2.176 1.00 0.00 H new ATOM 0 HA3 GLY B 116 -5.577 -2.719 -1.881 1.00 0.00 H new ATOM 574 N GLU B 117 -8.145 -1.520 -2.901 1.00 0.00 N ATOM 575 CA GLU B 117 -9.414 -0.802 -2.593 1.00 0.00 C ATOM 576 C GLU B 117 -10.606 -1.680 -2.980 1.00 0.00 C ATOM 577 O GLU B 117 -10.734 -2.105 -4.111 1.00 0.00 O ATOM 578 CB GLU B 117 -9.468 0.510 -3.379 1.00 0.00 C ATOM 579 CG GLU B 117 -9.947 1.637 -2.460 1.00 0.00 C ATOM 580 CD GLU B 117 -11.007 2.472 -3.182 1.00 0.00 C ATOM 581 OE1 GLU B 117 -10.840 2.710 -4.366 1.00 0.00 O ATOM 582 OE2 GLU B 117 -11.969 2.858 -2.536 1.00 0.00 O ATOM 0 H GLU B 117 -7.677 -1.229 -3.760 1.00 0.00 H new ATOM 0 HA GLU B 117 -9.455 -0.585 -1.526 1.00 0.00 H new ATOM 0 HB2 GLU B 117 -8.482 0.747 -3.779 1.00 0.00 H new ATOM 0 HB3 GLU B 117 -10.142 0.409 -4.230 1.00 0.00 H new ATOM 0 HG2 GLU B 117 -10.361 1.220 -1.542 1.00 0.00 H new ATOM 0 HG3 GLU B 117 -9.106 2.268 -2.173 1.00 0.00 H new ATOM 589 N LYS B 118 -11.480 -1.952 -2.050 1.00 0.00 N ATOM 590 CA LYS B 118 -12.663 -2.800 -2.369 1.00 0.00 C ATOM 591 C LYS B 118 -13.670 -1.978 -3.173 1.00 0.00 C ATOM 592 O LYS B 118 -13.774 -0.779 -3.014 1.00 0.00 O ATOM 593 CB LYS B 118 -13.316 -3.278 -1.071 1.00 0.00 C ATOM 594 CG LYS B 118 -12.857 -4.705 -0.763 1.00 0.00 C ATOM 595 CD LYS B 118 -11.696 -4.664 0.232 1.00 0.00 C ATOM 596 CE LYS B 118 -12.233 -4.851 1.653 1.00 0.00 C ATOM 597 NZ LYS B 118 -12.224 -6.301 2.001 1.00 0.00 N ATOM 0 H LYS B 118 -11.426 -1.625 -1.085 1.00 0.00 H new ATOM 0 HA LYS B 118 -12.346 -3.664 -2.953 1.00 0.00 H new ATOM 0 HB2 LYS B 118 -13.047 -2.613 -0.250 1.00 0.00 H new ATOM 0 HB3 LYS B 118 -14.402 -3.246 -1.165 1.00 0.00 H new ATOM 0 HG2 LYS B 118 -13.684 -5.283 -0.350 1.00 0.00 H new ATOM 0 HG3 LYS B 118 -12.546 -5.204 -1.681 1.00 0.00 H new ATOM 0 HD2 LYS B 118 -10.975 -5.448 -0.002 1.00 0.00 H new ATOM 0 HD3 LYS B 118 -11.169 -3.713 0.153 1.00 0.00 H new ATOM 0 HE2 LYS B 118 -11.621 -4.292 2.361 1.00 0.00 H new ATOM 0 HE3 LYS B 118 -13.246 -4.455 1.726 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 -12.589 -6.429 2.967 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 -12.826 -6.822 1.332 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 -11.251 -6.665 1.948 1.00 0.00 H new ATOM 611 N PHE B 119 -14.413 -2.611 -4.036 1.00 0.00 N ATOM 612 CA PHE B 119 -15.409 -1.860 -4.849 1.00 0.00 C ATOM 613 C PHE B 119 -16.751 -2.592 -4.817 1.00 0.00 C ATOM 614 O PHE B 119 -16.809 -3.805 -4.850 1.00 0.00 O ATOM 615 CB PHE B 119 -14.919 -1.767 -6.294 1.00 0.00 C ATOM 616 CG PHE B 119 -13.949 -0.618 -6.429 1.00 0.00 C ATOM 617 CD1 PHE B 119 -14.425 0.675 -6.680 1.00 0.00 C ATOM 618 CD2 PHE B 119 -12.575 -0.846 -6.305 1.00 0.00 C ATOM 619 CE1 PHE B 119 -13.524 1.738 -6.808 1.00 0.00 C ATOM 620 CE2 PHE B 119 -11.674 0.217 -6.431 1.00 0.00 C ATOM 621 CZ PHE B 119 -12.149 1.510 -6.684 1.00 0.00 C ATOM 0 H PHE B 119 -14.374 -3.615 -4.214 1.00 0.00 H new ATOM 0 HA PHE B 119 -15.530 -0.858 -4.438 1.00 0.00 H new ATOM 0 HB2 PHE B 119 -14.436 -2.700 -6.585 1.00 0.00 H new ATOM 0 HB3 PHE B 119 -15.765 -1.623 -6.966 1.00 0.00 H new ATOM 0 HD1 PHE B 119 -15.486 0.851 -6.775 1.00 0.00 H new ATOM 0 HD2 PHE B 119 -12.209 -1.844 -6.112 1.00 0.00 H new ATOM 0 HE1 PHE B 119 -13.890 2.735 -7.003 1.00 0.00 H new ATOM 0 HE2 PHE B 119 -10.613 0.041 -6.333 1.00 0.00 H new ATOM 0 HZ PHE B 119 -11.454 2.331 -6.783 1.00 0.00 H new ATOM 631 N GLN B 120 -17.833 -1.864 -4.758 1.00 0.00 N ATOM 632 CA GLN B 120 -19.170 -2.519 -4.729 1.00 0.00 C ATOM 633 C GLN B 120 -19.795 -2.457 -6.124 1.00 0.00 C ATOM 634 O GLN B 120 -20.554 -1.562 -6.438 1.00 0.00 O ATOM 635 CB GLN B 120 -20.071 -1.794 -3.728 1.00 0.00 C ATOM 636 CG GLN B 120 -19.775 -2.304 -2.316 1.00 0.00 C ATOM 637 CD GLN B 120 -21.003 -2.098 -1.429 1.00 0.00 C ATOM 638 OE1 GLN B 120 -21.771 -1.180 -1.638 1.00 0.00 O ATOM 639 NE2 GLN B 120 -21.222 -2.920 -0.440 1.00 0.00 N ATOM 0 H GLN B 120 -17.848 -0.845 -4.729 1.00 0.00 H new ATOM 0 HA GLN B 120 -19.061 -3.561 -4.427 1.00 0.00 H new ATOM 0 HB2 GLN B 120 -19.901 -0.719 -3.781 1.00 0.00 H new ATOM 0 HB3 GLN B 120 -21.119 -1.964 -3.976 1.00 0.00 H new ATOM 0 HG2 GLN B 120 -19.510 -3.361 -2.348 1.00 0.00 H new ATOM 0 HG3 GLN B 120 -18.919 -1.773 -1.899 1.00 0.00 H new ATOM 0 HE21 GLN B 120 -20.577 -3.691 -0.265 1.00 0.00 H new ATOM 0 HE22 GLN B 120 -22.038 -2.792 0.158 1.00 0.00 H new ATOM 648 N ILE B 121 -19.478 -3.404 -6.965 1.00 0.00 N ATOM 649 CA ILE B 121 -20.048 -3.405 -8.341 1.00 0.00 C ATOM 650 C ILE B 121 -21.574 -3.311 -8.268 1.00 0.00 C ATOM 651 O ILE B 121 -22.230 -4.155 -7.690 1.00 0.00 O ATOM 652 CB ILE B 121 -19.651 -4.700 -9.055 1.00 0.00 C ATOM 653 CG1 ILE B 121 -18.127 -4.773 -9.176 1.00 0.00 C ATOM 654 CG2 ILE B 121 -20.272 -4.723 -10.453 1.00 0.00 C ATOM 655 CD1 ILE B 121 -17.634 -3.669 -10.112 1.00 0.00 C ATOM 0 H ILE B 121 -18.847 -4.178 -6.757 1.00 0.00 H new ATOM 0 HA ILE B 121 -19.660 -2.549 -8.893 1.00 0.00 H new ATOM 0 HB ILE B 121 -20.011 -5.554 -8.481 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -17.668 -4.663 -8.193 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -17.829 -5.749 -9.559 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -19.989 -5.645 -10.961 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -21.358 -4.673 -10.370 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -19.912 -3.868 -11.025 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -16.549 -3.722 -10.197 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -18.082 -3.800 -11.097 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -17.919 -2.697 -9.710 1.00 0.00 H new ATOM 667 N LEU B 122 -22.147 -2.294 -8.854 1.00 0.00 N ATOM 668 CA LEU B 122 -23.631 -2.152 -8.823 1.00 0.00 C ATOM 669 C LEU B 122 -24.210 -2.658 -10.142 1.00 0.00 C ATOM 670 O LEU B 122 -25.060 -3.528 -10.170 1.00 0.00 O ATOM 671 CB LEU B 122 -24.012 -0.679 -8.642 1.00 0.00 C ATOM 672 CG LEU B 122 -22.986 0.020 -7.747 1.00 0.00 C ATOM 673 CD1 LEU B 122 -23.120 1.537 -7.907 1.00 0.00 C ATOM 674 CD2 LEU B 122 -23.243 -0.361 -6.286 1.00 0.00 C ATOM 0 H LEU B 122 -21.651 -1.555 -9.353 1.00 0.00 H new ATOM 0 HA LEU B 122 -24.030 -2.732 -7.991 1.00 0.00 H new ATOM 0 HB2 LEU B 122 -24.057 -0.185 -9.612 1.00 0.00 H new ATOM 0 HB3 LEU B 122 -25.005 -0.603 -8.199 1.00 0.00 H new ATOM 0 HG LEU B 122 -21.981 -0.290 -8.034 1.00 0.00 H new ATOM 0 HD11 LEU B 122 -22.390 2.036 -7.270 1.00 0.00 H new ATOM 0 HD12 LEU B 122 -22.941 1.810 -8.947 1.00 0.00 H new ATOM 0 HD13 LEU B 122 -24.125 1.846 -7.618 1.00 0.00 H new ATOM 0 HD21 LEU B 122 -22.513 0.136 -5.647 1.00 0.00 H new ATOM 0 HD22 LEU B 122 -24.248 -0.049 -6.000 1.00 0.00 H new ATOM 0 HD23 LEU B 122 -23.151 -1.441 -6.170 1.00 0.00 H new ATOM 686 N ASN B 123 -23.754 -2.118 -11.233 1.00 0.00 N ATOM 687 CA ASN B 123 -24.269 -2.559 -12.560 1.00 0.00 C ATOM 688 C ASN B 123 -23.128 -3.185 -13.364 1.00 0.00 C ATOM 689 O ASN B 123 -22.281 -2.497 -13.898 1.00 0.00 O ATOM 690 CB ASN B 123 -24.822 -1.350 -13.318 1.00 0.00 C ATOM 691 CG ASN B 123 -26.265 -1.086 -12.882 1.00 0.00 C ATOM 692 OD1 ASN B 123 -26.602 0.013 -12.492 1.00 0.00 O ATOM 693 ND2 ASN B 123 -27.137 -2.056 -12.933 1.00 0.00 N ATOM 0 H ASN B 123 -23.044 -1.387 -11.266 1.00 0.00 H new ATOM 0 HA ASN B 123 -25.062 -3.294 -12.418 1.00 0.00 H new ATOM 0 HB2 ASN B 123 -24.206 -0.472 -13.122 1.00 0.00 H new ATOM 0 HB3 ASN B 123 -24.784 -1.533 -14.392 1.00 0.00 H new ATOM 0 HD21 ASN B 123 -28.101 -1.890 -12.645 1.00 0.00 H new ATOM 0 HD22 ASN B 123 -26.854 -2.980 -13.261 1.00 0.00 H new ATOM 700 N SER B 124 -23.099 -4.487 -13.455 1.00 0.00 N ATOM 701 CA SER B 124 -22.015 -5.158 -14.226 1.00 0.00 C ATOM 702 C SER B 124 -22.588 -5.725 -15.527 1.00 0.00 C ATOM 703 O SER B 124 -21.905 -6.395 -16.276 1.00 0.00 O ATOM 704 CB SER B 124 -21.421 -6.293 -13.391 1.00 0.00 C ATOM 705 OG SER B 124 -22.326 -6.635 -12.350 1.00 0.00 O ATOM 0 H SER B 124 -23.780 -5.115 -13.028 1.00 0.00 H new ATOM 0 HA SER B 124 -21.235 -4.434 -14.459 1.00 0.00 H new ATOM 0 HB2 SER B 124 -21.229 -7.161 -14.021 1.00 0.00 H new ATOM 0 HB3 SER B 124 -20.463 -5.987 -12.970 1.00 0.00 H new ATOM 0 HG SER B 124 -21.948 -7.364 -11.814 1.00 0.00 H new ATOM 744 N ASP B 128 -18.245 -3.844 -21.200 1.00 0.00 N ATOM 745 CA ASP B 128 -17.107 -4.521 -20.518 1.00 0.00 C ATOM 746 C ASP B 128 -16.762 -3.782 -19.222 1.00 0.00 C ATOM 747 O ASP B 128 -16.113 -4.320 -18.346 1.00 0.00 O ATOM 748 CB ASP B 128 -15.889 -4.522 -21.442 1.00 0.00 C ATOM 749 CG ASP B 128 -16.022 -5.653 -22.463 1.00 0.00 C ATOM 750 OD1 ASP B 128 -16.902 -6.481 -22.291 1.00 0.00 O ATOM 751 OD2 ASP B 128 -15.241 -5.674 -23.401 1.00 0.00 O ATOM 0 HA ASP B 128 -17.390 -5.547 -20.281 1.00 0.00 H new ATOM 0 HB2 ASP B 128 -15.808 -3.563 -21.954 1.00 0.00 H new ATOM 0 HB3 ASP B 128 -14.977 -4.650 -20.859 1.00 0.00 H new ATOM 756 N TRP B 129 -17.181 -2.553 -19.090 1.00 0.00 N ATOM 757 CA TRP B 129 -16.864 -1.793 -17.848 1.00 0.00 C ATOM 758 C TRP B 129 -18.093 -1.754 -16.937 1.00 0.00 C ATOM 759 O TRP B 129 -19.214 -1.645 -17.393 1.00 0.00 O ATOM 760 CB TRP B 129 -16.446 -0.367 -18.213 1.00 0.00 C ATOM 761 CG TRP B 129 -15.023 -0.375 -18.669 1.00 0.00 C ATOM 762 CD1 TRP B 129 -14.520 -1.206 -19.611 1.00 0.00 C ATOM 763 CD2 TRP B 129 -13.915 0.459 -18.224 1.00 0.00 C ATOM 764 NE1 TRP B 129 -13.175 -0.931 -19.776 1.00 0.00 N ATOM 765 CE2 TRP B 129 -12.754 0.086 -18.944 1.00 0.00 C ATOM 766 CE3 TRP B 129 -13.801 1.495 -17.276 1.00 0.00 C ATOM 767 CZ2 TRP B 129 -11.527 0.715 -18.731 1.00 0.00 C ATOM 768 CZ3 TRP B 129 -12.567 2.130 -17.060 1.00 0.00 C ATOM 769 CH2 TRP B 129 -11.432 1.739 -17.787 1.00 0.00 C ATOM 0 H TRP B 129 -17.727 -2.044 -19.785 1.00 0.00 H new ATOM 0 HA TRP B 129 -16.046 -2.286 -17.323 1.00 0.00 H new ATOM 0 HB2 TRP B 129 -17.091 0.024 -19.000 1.00 0.00 H new ATOM 0 HB3 TRP B 129 -16.561 0.291 -17.351 1.00 0.00 H new ATOM 0 HD1 TRP B 129 -15.078 -1.960 -20.146 1.00 0.00 H new ATOM 0 HE1 TRP B 129 -12.568 -1.421 -20.433 1.00 0.00 H new ATOM 0 HE3 TRP B 129 -14.669 1.803 -16.711 1.00 0.00 H new ATOM 0 HZ2 TRP B 129 -10.656 0.412 -19.293 1.00 0.00 H new ATOM 0 HZ3 TRP B 129 -12.491 2.923 -16.331 1.00 0.00 H new ATOM 0 HH2 TRP B 129 -10.485 2.230 -17.616 1.00 0.00 H new ATOM 780 N TRP B 130 -17.890 -1.849 -15.650 1.00 0.00 N ATOM 781 CA TRP B 130 -19.043 -1.825 -14.707 1.00 0.00 C ATOM 782 C TRP B 130 -18.973 -0.570 -13.836 1.00 0.00 C ATOM 783 O TRP B 130 -17.938 0.052 -13.708 1.00 0.00 O ATOM 784 CB TRP B 130 -18.990 -3.058 -13.803 1.00 0.00 C ATOM 785 CG TRP B 130 -18.883 -4.295 -14.634 1.00 0.00 C ATOM 786 CD1 TRP B 130 -19.198 -4.381 -15.946 1.00 0.00 C ATOM 787 CD2 TRP B 130 -18.438 -5.620 -14.231 1.00 0.00 C ATOM 788 NE1 TRP B 130 -18.979 -5.678 -16.374 1.00 0.00 N ATOM 789 CE2 TRP B 130 -18.508 -6.480 -15.353 1.00 0.00 C ATOM 790 CE3 TRP B 130 -17.984 -6.154 -13.012 1.00 0.00 C ATOM 791 CZ2 TRP B 130 -18.142 -7.824 -15.268 1.00 0.00 C ATOM 792 CZ3 TRP B 130 -17.615 -7.506 -12.922 1.00 0.00 C ATOM 793 CH2 TRP B 130 -17.694 -8.339 -14.047 1.00 0.00 C ATOM 0 H TRP B 130 -16.974 -1.942 -15.212 1.00 0.00 H new ATOM 0 HA TRP B 130 -19.970 -1.823 -15.280 1.00 0.00 H new ATOM 0 HB2 TRP B 130 -18.137 -2.988 -13.128 1.00 0.00 H new ATOM 0 HB3 TRP B 130 -19.885 -3.103 -13.182 1.00 0.00 H new ATOM 0 HD1 TRP B 130 -19.561 -3.570 -16.559 1.00 0.00 H new ATOM 0 HE1 TRP B 130 -19.145 -6.002 -17.327 1.00 0.00 H new ATOM 0 HE3 TRP B 130 -17.919 -5.521 -12.140 1.00 0.00 H new ATOM 0 HZ2 TRP B 130 -18.204 -8.461 -16.138 1.00 0.00 H new ATOM 0 HZ3 TRP B 130 -17.268 -7.906 -11.981 1.00 0.00 H new ATOM 0 HH2 TRP B 130 -17.409 -9.378 -13.971 1.00 0.00 H new ATOM 804 N GLU B 131 -20.067 -0.205 -13.223 1.00 0.00 N ATOM 805 CA GLU B 131 -20.065 0.996 -12.341 1.00 0.00 C ATOM 806 C GLU B 131 -19.763 0.547 -10.911 1.00 0.00 C ATOM 807 O GLU B 131 -20.594 -0.039 -10.247 1.00 0.00 O ATOM 808 CB GLU B 131 -21.438 1.673 -12.390 1.00 0.00 C ATOM 809 CG GLU B 131 -21.910 1.775 -13.842 1.00 0.00 C ATOM 810 CD GLU B 131 -22.999 2.842 -13.954 1.00 0.00 C ATOM 811 OE1 GLU B 131 -22.812 3.913 -13.400 1.00 0.00 O ATOM 812 OE2 GLU B 131 -24.002 2.572 -14.595 1.00 0.00 O ATOM 0 H GLU B 131 -20.963 -0.688 -13.296 1.00 0.00 H new ATOM 0 HA GLU B 131 -19.309 1.706 -12.677 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -22.157 1.102 -11.803 1.00 0.00 H new ATOM 0 HB3 GLU B 131 -21.381 2.666 -11.945 1.00 0.00 H new ATOM 0 HG2 GLU B 131 -21.071 2.028 -14.491 1.00 0.00 H new ATOM 0 HG3 GLU B 131 -22.294 0.812 -14.178 1.00 0.00 H new ATOM 819 N ALA B 132 -18.573 0.795 -10.436 1.00 0.00 N ATOM 820 CA ALA B 132 -18.217 0.358 -9.056 1.00 0.00 C ATOM 821 C ALA B 132 -18.384 1.516 -8.069 1.00 0.00 C ATOM 822 O ALA B 132 -17.961 2.627 -8.318 1.00 0.00 O ATOM 823 CB ALA B 132 -16.762 -0.111 -9.036 1.00 0.00 C ATOM 0 H ALA B 132 -17.833 1.281 -10.943 1.00 0.00 H new ATOM 0 HA ALA B 132 -18.879 -0.457 -8.762 1.00 0.00 H new ATOM 0 HB1 ALA B 132 -16.497 -0.432 -8.029 1.00 0.00 H new ATOM 0 HB2 ALA B 132 -16.639 -0.945 -9.727 1.00 0.00 H new ATOM 0 HB3 ALA B 132 -16.111 0.709 -9.339 1.00 0.00 H new ATOM 829 N ARG B 133 -18.985 1.254 -6.939 1.00 0.00 N ATOM 830 CA ARG B 133 -19.168 2.326 -5.922 1.00 0.00 C ATOM 831 C ARG B 133 -18.082 2.179 -4.852 1.00 0.00 C ATOM 832 O ARG B 133 -18.127 1.287 -4.027 1.00 0.00 O ATOM 833 CB ARG B 133 -20.551 2.193 -5.278 1.00 0.00 C ATOM 834 CG ARG B 133 -20.613 3.048 -4.010 1.00 0.00 C ATOM 835 CD ARG B 133 -22.017 2.970 -3.408 1.00 0.00 C ATOM 836 NE ARG B 133 -21.933 2.456 -2.012 1.00 0.00 N ATOM 837 CZ ARG B 133 -22.112 3.268 -1.005 1.00 0.00 C ATOM 838 NH1 ARG B 133 -21.179 4.119 -0.678 1.00 0.00 N ATOM 839 NH2 ARG B 133 -23.225 3.230 -0.327 1.00 0.00 N ATOM 0 H ARG B 133 -19.357 0.341 -6.677 1.00 0.00 H new ATOM 0 HA ARG B 133 -19.091 3.305 -6.395 1.00 0.00 H new ATOM 0 HB2 ARG B 133 -21.322 2.510 -5.980 1.00 0.00 H new ATOM 0 HB3 ARG B 133 -20.751 1.149 -5.035 1.00 0.00 H new ATOM 0 HG2 ARG B 133 -19.876 2.698 -3.287 1.00 0.00 H new ATOM 0 HG3 ARG B 133 -20.364 4.083 -4.244 1.00 0.00 H new ATOM 0 HD2 ARG B 133 -22.483 3.955 -3.416 1.00 0.00 H new ATOM 0 HD3 ARG B 133 -22.646 2.315 -4.010 1.00 0.00 H new ATOM 0 HE ARG B 133 -21.736 1.470 -1.843 1.00 0.00 H new ATOM 0 HH11 ARG B 133 -20.309 4.151 -1.209 1.00 0.00 H new ATOM 0 HH12 ARG B 133 -21.320 4.753 0.109 1.00 0.00 H new ATOM 0 HH21 ARG B 133 -23.956 2.566 -0.583 1.00 0.00 H new ATOM 0 HH22 ARG B 133 -23.365 3.864 0.460 1.00 0.00 H new ATOM 853 N SER B 134 -17.103 3.041 -4.866 1.00 0.00 N ATOM 854 CA SER B 134 -16.008 2.946 -3.858 1.00 0.00 C ATOM 855 C SER B 134 -16.601 2.888 -2.448 1.00 0.00 C ATOM 856 O SER B 134 -17.555 3.572 -2.136 1.00 0.00 O ATOM 857 CB SER B 134 -15.102 4.171 -3.977 1.00 0.00 C ATOM 858 OG SER B 134 -15.153 4.667 -5.308 1.00 0.00 O ATOM 0 H SER B 134 -17.013 3.808 -5.532 1.00 0.00 H new ATOM 0 HA SER B 134 -15.429 2.041 -4.041 1.00 0.00 H new ATOM 0 HB2 SER B 134 -15.421 4.943 -3.277 1.00 0.00 H new ATOM 0 HB3 SER B 134 -14.078 3.907 -3.714 1.00 0.00 H new ATOM 0 HG SER B 134 -14.574 5.454 -5.386 1.00 0.00 H new ATOM 864 N LEU B 135 -16.041 2.074 -1.593 1.00 0.00 N ATOM 865 CA LEU B 135 -16.570 1.971 -0.202 1.00 0.00 C ATOM 866 C LEU B 135 -15.797 2.920 0.719 1.00 0.00 C ATOM 867 O LEU B 135 -16.267 3.290 1.777 1.00 0.00 O ATOM 868 CB LEU B 135 -16.402 0.536 0.303 1.00 0.00 C ATOM 869 CG LEU B 135 -17.250 -0.410 -0.547 1.00 0.00 C ATOM 870 CD1 LEU B 135 -16.550 -1.766 -0.647 1.00 0.00 C ATOM 871 CD2 LEU B 135 -18.622 -0.591 0.106 1.00 0.00 C ATOM 0 H LEU B 135 -15.240 1.476 -1.798 1.00 0.00 H new ATOM 0 HA LEU B 135 -17.626 2.242 -0.201 1.00 0.00 H new ATOM 0 HB2 LEU B 135 -15.353 0.243 0.254 1.00 0.00 H new ATOM 0 HB3 LEU B 135 -16.703 0.470 1.349 1.00 0.00 H new ATOM 0 HG LEU B 135 -17.376 0.010 -1.545 1.00 0.00 H new ATOM 0 HD11 LEU B 135 -17.153 -2.443 -1.253 1.00 0.00 H new ATOM 0 HD12 LEU B 135 -15.572 -1.637 -1.111 1.00 0.00 H new ATOM 0 HD13 LEU B 135 -16.426 -2.186 0.351 1.00 0.00 H new ATOM 0 HD21 LEU B 135 -19.227 -1.266 -0.500 1.00 0.00 H new ATOM 0 HD22 LEU B 135 -18.497 -1.012 1.104 1.00 0.00 H new ATOM 0 HD23 LEU B 135 -19.120 0.376 0.180 1.00 0.00 H new ATOM 883 N THR B 136 -14.612 3.311 0.333 1.00 0.00 N ATOM 884 CA THR B 136 -13.814 4.227 1.198 1.00 0.00 C ATOM 885 C THR B 136 -14.123 5.682 0.843 1.00 0.00 C ATOM 886 O THR B 136 -13.957 6.575 1.650 1.00 0.00 O ATOM 887 CB THR B 136 -12.322 3.961 0.986 1.00 0.00 C ATOM 888 OG1 THR B 136 -12.033 2.605 1.300 1.00 0.00 O ATOM 889 CG2 THR B 136 -11.506 4.883 1.893 1.00 0.00 C ATOM 0 H THR B 136 -14.163 3.037 -0.541 1.00 0.00 H new ATOM 0 HA THR B 136 -14.075 4.048 2.241 1.00 0.00 H new ATOM 0 HB THR B 136 -12.062 4.155 -0.055 1.00 0.00 H new ATOM 0 HG1 THR B 136 -11.078 2.434 1.163 1.00 0.00 H new ATOM 0 HG21 THR B 136 -10.443 4.694 1.742 1.00 0.00 H new ATOM 0 HG22 THR B 136 -11.728 5.922 1.650 1.00 0.00 H new ATOM 0 HG23 THR B 136 -11.765 4.691 2.934 1.00 0.00 H new ATOM 897 N THR B 137 -14.564 5.933 -0.359 1.00 0.00 N ATOM 898 CA THR B 137 -14.873 7.335 -0.758 1.00 0.00 C ATOM 899 C THR B 137 -16.389 7.553 -0.746 1.00 0.00 C ATOM 900 O THR B 137 -16.865 8.653 -0.546 1.00 0.00 O ATOM 901 CB THR B 137 -14.327 7.596 -2.163 1.00 0.00 C ATOM 902 OG1 THR B 137 -13.986 6.360 -2.774 1.00 0.00 O ATOM 903 CG2 THR B 137 -13.083 8.480 -2.070 1.00 0.00 C ATOM 0 H THR B 137 -14.723 5.230 -1.080 1.00 0.00 H new ATOM 0 HA THR B 137 -14.407 8.023 -0.053 1.00 0.00 H new ATOM 0 HB THR B 137 -15.086 8.100 -2.761 1.00 0.00 H new ATOM 0 HG1 THR B 137 -13.638 6.526 -3.675 1.00 0.00 H new ATOM 0 HG21 THR B 137 -12.693 8.666 -3.071 1.00 0.00 H new ATOM 0 HG22 THR B 137 -13.345 9.428 -1.600 1.00 0.00 H new ATOM 0 HG23 THR B 137 -12.323 7.977 -1.473 1.00 0.00 H new ATOM 911 N GLY B 138 -17.150 6.515 -0.958 1.00 0.00 N ATOM 912 CA GLY B 138 -18.634 6.668 -0.958 1.00 0.00 C ATOM 913 C GLY B 138 -19.097 7.193 -2.318 1.00 0.00 C ATOM 914 O GLY B 138 -20.247 7.535 -2.503 1.00 0.00 O ATOM 0 H GLY B 138 -16.810 5.569 -1.131 1.00 0.00 H new ATOM 0 HA2 GLY B 138 -19.108 5.710 -0.746 1.00 0.00 H new ATOM 0 HA3 GLY B 138 -18.939 7.355 -0.169 1.00 0.00 H new ATOM 918 N GLU B 139 -18.209 7.259 -3.273 1.00 0.00 N ATOM 919 CA GLU B 139 -18.599 7.762 -4.621 1.00 0.00 C ATOM 920 C GLU B 139 -18.718 6.581 -5.587 1.00 0.00 C ATOM 921 O GLU B 139 -18.425 5.453 -5.242 1.00 0.00 O ATOM 922 CB GLU B 139 -17.534 8.737 -5.130 1.00 0.00 C ATOM 923 CG GLU B 139 -17.153 9.706 -4.010 1.00 0.00 C ATOM 924 CD GLU B 139 -16.439 10.922 -4.605 1.00 0.00 C ATOM 925 OE1 GLU B 139 -16.216 10.924 -5.805 1.00 0.00 O ATOM 926 OE2 GLU B 139 -16.128 11.829 -3.852 1.00 0.00 O ATOM 0 H GLU B 139 -17.231 6.986 -3.178 1.00 0.00 H new ATOM 0 HA GLU B 139 -19.558 8.277 -4.556 1.00 0.00 H new ATOM 0 HB2 GLU B 139 -16.654 8.188 -5.466 1.00 0.00 H new ATOM 0 HB3 GLU B 139 -17.913 9.289 -5.990 1.00 0.00 H new ATOM 0 HG2 GLU B 139 -18.045 10.023 -3.471 1.00 0.00 H new ATOM 0 HG3 GLU B 139 -16.505 9.208 -3.289 1.00 0.00 H new ATOM 933 N THR B 140 -19.145 6.829 -6.795 1.00 0.00 N ATOM 934 CA THR B 140 -19.280 5.717 -7.776 1.00 0.00 C ATOM 935 C THR B 140 -18.756 6.168 -9.141 1.00 0.00 C ATOM 936 O THR B 140 -18.759 7.340 -9.463 1.00 0.00 O ATOM 937 CB THR B 140 -20.755 5.323 -7.901 1.00 0.00 C ATOM 938 OG1 THR B 140 -20.866 4.165 -8.716 1.00 0.00 O ATOM 939 CG2 THR B 140 -21.541 6.472 -8.534 1.00 0.00 C ATOM 0 H THR B 140 -19.405 7.751 -7.144 1.00 0.00 H new ATOM 0 HA THR B 140 -18.701 4.860 -7.432 1.00 0.00 H new ATOM 0 HB THR B 140 -21.160 5.112 -6.911 1.00 0.00 H new ATOM 0 HG1 THR B 140 -20.050 3.628 -8.634 1.00 0.00 H new ATOM 0 HG21 THR B 140 -22.590 6.190 -8.622 1.00 0.00 H new ATOM 0 HG22 THR B 140 -21.455 7.360 -7.908 1.00 0.00 H new ATOM 0 HG23 THR B 140 -21.138 6.686 -9.524 1.00 0.00 H new ATOM 947 N GLY B 141 -18.310 5.243 -9.946 1.00 0.00 N ATOM 948 CA GLY B 141 -17.789 5.612 -11.292 1.00 0.00 C ATOM 949 C GLY B 141 -17.728 4.363 -12.171 1.00 0.00 C ATOM 950 O GLY B 141 -18.332 3.352 -11.869 1.00 0.00 O ATOM 0 H GLY B 141 -18.284 4.247 -9.729 1.00 0.00 H new ATOM 0 HA2 GLY B 141 -18.433 6.362 -11.751 1.00 0.00 H new ATOM 0 HA3 GLY B 141 -16.797 6.056 -11.202 1.00 0.00 H new ATOM 954 N TYR B 142 -17.009 4.419 -13.260 1.00 0.00 N ATOM 955 CA TYR B 142 -16.924 3.229 -14.153 1.00 0.00 C ATOM 956 C TYR B 142 -15.486 2.709 -14.194 1.00 0.00 C ATOM 957 O TYR B 142 -14.571 3.409 -14.578 1.00 0.00 O ATOM 958 CB TYR B 142 -17.362 3.621 -15.565 1.00 0.00 C ATOM 959 CG TYR B 142 -18.784 4.129 -15.529 1.00 0.00 C ATOM 960 CD1 TYR B 142 -19.085 5.318 -14.853 1.00 0.00 C ATOM 961 CD2 TYR B 142 -19.799 3.413 -16.174 1.00 0.00 C ATOM 962 CE1 TYR B 142 -20.404 5.790 -14.822 1.00 0.00 C ATOM 963 CE2 TYR B 142 -21.117 3.885 -16.143 1.00 0.00 C ATOM 964 CZ TYR B 142 -21.420 5.073 -15.466 1.00 0.00 C ATOM 965 OH TYR B 142 -22.718 5.538 -15.436 1.00 0.00 O ATOM 0 H TYR B 142 -16.479 5.234 -13.568 1.00 0.00 H new ATOM 0 HA TYR B 142 -17.578 2.446 -13.769 1.00 0.00 H new ATOM 0 HB2 TYR B 142 -16.700 4.390 -15.962 1.00 0.00 H new ATOM 0 HB3 TYR B 142 -17.288 2.762 -16.232 1.00 0.00 H new ATOM 0 HD1 TYR B 142 -18.301 5.871 -14.356 1.00 0.00 H new ATOM 0 HD2 TYR B 142 -19.566 2.497 -16.696 1.00 0.00 H new ATOM 0 HE1 TYR B 142 -20.637 6.707 -14.301 1.00 0.00 H new ATOM 0 HE2 TYR B 142 -21.900 3.333 -16.641 1.00 0.00 H new ATOM 0 HH TYR B 142 -23.152 5.242 -14.609 1.00 0.00 H new ATOM 975 N ILE B 143 -15.283 1.479 -13.809 1.00 0.00 N ATOM 976 CA ILE B 143 -13.909 0.904 -13.834 1.00 0.00 C ATOM 977 C ILE B 143 -13.927 -0.412 -14.612 1.00 0.00 C ATOM 978 O ILE B 143 -14.967 -1.014 -14.788 1.00 0.00 O ATOM 979 CB ILE B 143 -13.432 0.627 -12.406 1.00 0.00 C ATOM 980 CG1 ILE B 143 -14.452 -0.264 -11.694 1.00 0.00 C ATOM 981 CG2 ILE B 143 -13.286 1.950 -11.649 1.00 0.00 C ATOM 982 CD1 ILE B 143 -13.720 -1.298 -10.835 1.00 0.00 C ATOM 0 H ILE B 143 -16.011 0.846 -13.478 1.00 0.00 H new ATOM 0 HA ILE B 143 -13.234 1.615 -14.312 1.00 0.00 H new ATOM 0 HB ILE B 143 -12.467 0.121 -12.435 1.00 0.00 H new ATOM 0 HG12 ILE B 143 -15.108 0.343 -11.070 1.00 0.00 H new ATOM 0 HG13 ILE B 143 -15.084 -0.767 -12.426 1.00 0.00 H new ATOM 0 HG21 ILE B 143 -12.946 1.752 -10.632 1.00 0.00 H new ATOM 0 HG22 ILE B 143 -12.558 2.582 -12.158 1.00 0.00 H new ATOM 0 HG23 ILE B 143 -14.249 2.459 -11.617 1.00 0.00 H new ATOM 0 HD11 ILE B 143 -14.448 -1.932 -10.329 1.00 0.00 H new ATOM 0 HD12 ILE B 143 -13.083 -1.913 -11.470 1.00 0.00 H new ATOM 0 HD13 ILE B 143 -13.107 -0.786 -10.093 1.00 0.00 H new ATOM 994 N PRO B 144 -12.766 -0.823 -15.046 1.00 0.00 N ATOM 995 CA PRO B 144 -12.610 -2.077 -15.800 1.00 0.00 C ATOM 996 C PRO B 144 -13.157 -3.248 -14.981 1.00 0.00 C ATOM 997 O PRO B 144 -12.770 -3.456 -13.847 1.00 0.00 O ATOM 998 CB PRO B 144 -11.096 -2.223 -15.998 1.00 0.00 C ATOM 999 CG PRO B 144 -10.414 -1.010 -15.313 1.00 0.00 C ATOM 1000 CD PRO B 144 -11.517 -0.073 -14.822 1.00 0.00 C ATOM 0 HA PRO B 144 -13.150 -2.068 -16.747 1.00 0.00 H new ATOM 0 HB2 PRO B 144 -10.741 -3.157 -15.563 1.00 0.00 H new ATOM 0 HB3 PRO B 144 -10.850 -2.252 -17.059 1.00 0.00 H new ATOM 0 HG2 PRO B 144 -9.794 -1.340 -14.480 1.00 0.00 H new ATOM 0 HG3 PRO B 144 -9.758 -0.494 -16.014 1.00 0.00 H new ATOM 0 HD2 PRO B 144 -11.387 0.175 -13.769 1.00 0.00 H new ATOM 0 HD3 PRO B 144 -11.514 0.867 -15.374 1.00 0.00 H new ATOM 1008 N SER B 145 -14.050 -4.015 -15.538 1.00 0.00 N ATOM 1009 CA SER B 145 -14.611 -5.164 -14.784 1.00 0.00 C ATOM 1010 C SER B 145 -13.494 -6.168 -14.486 1.00 0.00 C ATOM 1011 O SER B 145 -13.529 -6.875 -13.499 1.00 0.00 O ATOM 1012 CB SER B 145 -15.692 -5.837 -15.625 1.00 0.00 C ATOM 1013 OG SER B 145 -15.090 -6.464 -16.748 1.00 0.00 O ATOM 0 H SER B 145 -14.415 -3.895 -16.483 1.00 0.00 H new ATOM 0 HA SER B 145 -15.044 -4.814 -13.847 1.00 0.00 H new ATOM 0 HB2 SER B 145 -16.228 -6.574 -15.027 1.00 0.00 H new ATOM 0 HB3 SER B 145 -16.424 -5.100 -15.955 1.00 0.00 H new ATOM 0 HG SER B 145 -15.267 -5.934 -17.553 1.00 0.00 H new ATOM 1019 N ASN B 146 -12.503 -6.236 -15.331 1.00 0.00 N ATOM 1020 CA ASN B 146 -11.387 -7.194 -15.093 1.00 0.00 C ATOM 1021 C ASN B 146 -10.490 -6.672 -13.969 1.00 0.00 C ATOM 1022 O ASN B 146 -9.735 -7.413 -13.371 1.00 0.00 O ATOM 1023 CB ASN B 146 -10.564 -7.344 -16.375 1.00 0.00 C ATOM 1024 CG ASN B 146 -9.411 -8.320 -16.129 1.00 0.00 C ATOM 1025 OD1 ASN B 146 -9.631 -9.467 -15.795 1.00 0.00 O ATOM 1026 ND2 ASN B 146 -8.181 -7.910 -16.282 1.00 0.00 N ATOM 0 H ASN B 146 -12.418 -5.670 -16.175 1.00 0.00 H new ATOM 0 HA ASN B 146 -11.797 -8.162 -14.806 1.00 0.00 H new ATOM 0 HB2 ASN B 146 -11.196 -7.708 -17.185 1.00 0.00 H new ATOM 0 HB3 ASN B 146 -10.174 -6.375 -16.685 1.00 0.00 H new ATOM 0 HD21 ASN B 146 -7.405 -8.553 -16.121 1.00 0.00 H new ATOM 0 HD22 ASN B 146 -7.996 -6.947 -16.562 1.00 0.00 H new ATOM 1033 N TYR B 147 -10.564 -5.403 -13.676 1.00 0.00 N ATOM 1034 CA TYR B 147 -9.713 -4.839 -12.589 1.00 0.00 C ATOM 1035 C TYR B 147 -10.370 -5.101 -11.233 1.00 0.00 C ATOM 1036 O TYR B 147 -9.877 -4.682 -10.205 1.00 0.00 O ATOM 1037 CB TYR B 147 -9.556 -3.331 -12.791 1.00 0.00 C ATOM 1038 CG TYR B 147 -8.323 -3.057 -13.619 1.00 0.00 C ATOM 1039 CD1 TYR B 147 -7.873 -4.007 -14.543 1.00 0.00 C ATOM 1040 CD2 TYR B 147 -7.631 -1.849 -13.464 1.00 0.00 C ATOM 1041 CE1 TYR B 147 -6.731 -3.751 -15.312 1.00 0.00 C ATOM 1042 CE2 TYR B 147 -6.489 -1.593 -14.234 1.00 0.00 C ATOM 1043 CZ TYR B 147 -6.040 -2.544 -15.158 1.00 0.00 C ATOM 1044 OH TYR B 147 -4.916 -2.290 -15.917 1.00 0.00 O ATOM 0 H TYR B 147 -11.176 -4.732 -14.141 1.00 0.00 H new ATOM 0 HA TYR B 147 -8.733 -5.315 -12.617 1.00 0.00 H new ATOM 0 HB2 TYR B 147 -10.438 -2.927 -13.288 1.00 0.00 H new ATOM 0 HB3 TYR B 147 -9.477 -2.831 -11.826 1.00 0.00 H new ATOM 0 HD1 TYR B 147 -8.407 -4.938 -14.663 1.00 0.00 H new ATOM 0 HD2 TYR B 147 -7.978 -1.115 -12.751 1.00 0.00 H new ATOM 0 HE1 TYR B 147 -6.384 -4.485 -16.024 1.00 0.00 H new ATOM 0 HE2 TYR B 147 -5.955 -0.662 -14.115 1.00 0.00 H new ATOM 0 HH TYR B 147 -4.117 -2.368 -15.355 1.00 0.00 H new ATOM 1054 N VAL B 148 -11.477 -5.792 -11.217 1.00 0.00 N ATOM 1055 CA VAL B 148 -12.149 -6.074 -9.918 1.00 0.00 C ATOM 1056 C VAL B 148 -12.622 -7.528 -9.890 1.00 0.00 C ATOM 1057 O VAL B 148 -12.937 -8.108 -10.910 1.00 0.00 O ATOM 1058 CB VAL B 148 -13.351 -5.146 -9.739 1.00 0.00 C ATOM 1059 CG1 VAL B 148 -12.868 -3.761 -9.307 1.00 0.00 C ATOM 1060 CG2 VAL B 148 -14.112 -5.029 -11.061 1.00 0.00 C ATOM 0 H VAL B 148 -11.942 -6.171 -12.042 1.00 0.00 H new ATOM 0 HA VAL B 148 -11.440 -5.904 -9.108 1.00 0.00 H new ATOM 0 HB VAL B 148 -14.012 -5.556 -8.975 1.00 0.00 H new ATOM 0 HG11 VAL B 148 -13.725 -3.100 -9.180 1.00 0.00 H new ATOM 0 HG12 VAL B 148 -12.329 -3.842 -8.363 1.00 0.00 H new ATOM 0 HG13 VAL B 148 -12.205 -3.353 -10.070 1.00 0.00 H new ATOM 0 HG21 VAL B 148 -14.968 -4.367 -10.931 1.00 0.00 H new ATOM 0 HG22 VAL B 148 -13.451 -4.621 -11.826 1.00 0.00 H new ATOM 0 HG23 VAL B 148 -14.459 -6.015 -11.369 1.00 0.00 H new ATOM 1070 N ALA B 149 -12.673 -8.121 -8.729 1.00 0.00 N ATOM 1071 CA ALA B 149 -13.127 -9.540 -8.641 1.00 0.00 C ATOM 1072 C ALA B 149 -13.688 -9.820 -7.242 1.00 0.00 C ATOM 1073 O ALA B 149 -13.502 -9.037 -6.332 1.00 0.00 O ATOM 1074 CB ALA B 149 -11.945 -10.472 -8.911 1.00 0.00 C ATOM 0 H ALA B 149 -12.421 -7.688 -7.841 1.00 0.00 H new ATOM 0 HA ALA B 149 -13.906 -9.714 -9.383 1.00 0.00 H new ATOM 0 HB1 ALA B 149 -12.277 -11.508 -8.847 1.00 0.00 H new ATOM 0 HB2 ALA B 149 -11.550 -10.279 -9.908 1.00 0.00 H new ATOM 0 HB3 ALA B 149 -11.165 -10.294 -8.171 1.00 0.00 H new ATOM 1080 N PRO B 150 -14.362 -10.939 -7.117 1.00 0.00 N ATOM 1081 CA PRO B 150 -14.966 -11.357 -5.839 1.00 0.00 C ATOM 1082 C PRO B 150 -13.887 -11.517 -4.765 1.00 0.00 C ATOM 1083 O PRO B 150 -12.788 -11.958 -5.035 1.00 0.00 O ATOM 1084 CB PRO B 150 -15.632 -12.708 -6.140 1.00 0.00 C ATOM 1085 CG PRO B 150 -15.383 -13.032 -7.636 1.00 0.00 C ATOM 1086 CD PRO B 150 -14.571 -11.874 -8.237 1.00 0.00 C ATOM 0 HA PRO B 150 -15.679 -10.624 -5.461 1.00 0.00 H new ATOM 0 HB2 PRO B 150 -15.216 -13.490 -5.505 1.00 0.00 H new ATOM 0 HB3 PRO B 150 -16.701 -12.663 -5.931 1.00 0.00 H new ATOM 0 HG2 PRO B 150 -14.841 -13.972 -7.738 1.00 0.00 H new ATOM 0 HG3 PRO B 150 -16.329 -13.150 -8.164 1.00 0.00 H new ATOM 0 HD2 PRO B 150 -13.622 -12.225 -8.642 1.00 0.00 H new ATOM 0 HD3 PRO B 150 -15.109 -11.396 -9.056 1.00 0.00 H new ATOM 1094 N VAL B 151 -14.194 -11.161 -3.548 1.00 0.00 N ATOM 1095 CA VAL B 151 -13.191 -11.292 -2.457 1.00 0.00 C ATOM 1096 C VAL B 151 -12.706 -12.742 -2.384 1.00 0.00 C ATOM 1097 O VAL B 151 -13.273 -13.571 -3.077 1.00 0.00 O ATOM 1098 CB VAL B 151 -13.833 -10.902 -1.125 1.00 0.00 C ATOM 1099 CG1 VAL B 151 -12.808 -11.052 -0.001 1.00 0.00 C ATOM 1100 CG2 VAL B 151 -14.304 -9.447 -1.194 1.00 0.00 C ATOM 0 H VAL B 151 -15.098 -10.785 -3.263 1.00 0.00 H new ATOM 0 HA VAL B 151 -12.345 -10.635 -2.659 1.00 0.00 H new ATOM 0 HB VAL B 151 -14.685 -11.552 -0.928 1.00 0.00 H new ATOM 0 HG11 VAL B 151 -13.266 -10.774 0.948 1.00 0.00 H new ATOM 0 HG12 VAL B 151 -12.471 -12.087 0.048 1.00 0.00 H new ATOM 0 HG13 VAL B 151 -11.955 -10.402 -0.197 1.00 0.00 H new ATOM 0 HG21 VAL B 151 -14.762 -9.167 -0.245 1.00 0.00 H new ATOM 0 HG22 VAL B 151 -13.451 -8.797 -1.391 1.00 0.00 H new ATOM 0 HG23 VAL B 151 -15.035 -9.339 -1.995 1.00 0.00 H new