USER MOD reduce.3.24.130724 H: found=0, std=0, add=508, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 509 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 : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ -145:sc= 0.019 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= -1.03 K(o=-1,f=-6.2!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl 149:sc= -0.274 (180deg=-1.69) USER MOD Single : A 122 GLN : amide:sc= -1.28 X(o=-1.3,f=-1.7) USER MOD Single : A 124 THR OG1 : rot -50:sc= 0.675 USER MOD Single : A 127 THR OG1 : rot 35:sc= 1.11 USER MOD Single : A 129 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 137 MET CE :methyl 145:sc= -5.08 (180deg=-9.18!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ -146:sc= 1.27 (180deg=1.09) USER MOD Single : A 143 ASN : amide:sc= -2.48 K(o=-2.5,f=-8.7!) USER MOD Single : A 144 ASN :FLIP amide:sc= 0.176 F(o=-0.93,f=0.18) USER MOD Single : A 150 TYR OH : rot 180:sc= -0.3 USER MOD Single : A 157 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 210 N GLU A 94 120.292 -5.930 7.416 1.00 0.00 N ATOM 211 CA GLU A 94 121.382 -6.127 6.465 1.00 0.00 C ATOM 212 C GLU A 94 120.847 -6.300 5.044 1.00 0.00 C ATOM 213 O GLU A 94 121.545 -6.023 4.070 1.00 0.00 O ATOM 214 CB GLU A 94 122.213 -7.350 6.860 1.00 0.00 C ATOM 215 CG GLU A 94 123.407 -7.015 7.739 1.00 0.00 C ATOM 216 CD GLU A 94 124.206 -8.243 8.129 1.00 0.00 C ATOM 217 OE1 GLU A 94 124.447 -9.099 7.252 1.00 0.00 O ATOM 218 OE2 GLU A 94 124.591 -8.351 9.313 1.00 0.00 O ATOM 0 HA GLU A 94 122.014 -5.239 6.488 1.00 0.00 H new ATOM 0 HB2 GLU A 94 121.573 -8.060 7.385 1.00 0.00 H new ATOM 0 HB3 GLU A 94 122.566 -7.847 5.956 1.00 0.00 H new ATOM 0 HG2 GLU A 94 124.056 -6.316 7.212 1.00 0.00 H new ATOM 0 HG3 GLU A 94 123.060 -6.510 8.641 1.00 0.00 H new ATOM 225 N GLU A 95 119.601 -6.755 4.937 1.00 0.00 N ATOM 226 CA GLU A 95 118.970 -6.961 3.637 1.00 0.00 C ATOM 227 C GLU A 95 118.986 -5.676 2.813 1.00 0.00 C ATOM 228 O GLU A 95 118.982 -5.716 1.582 1.00 0.00 O ATOM 229 CB GLU A 95 117.533 -7.450 3.816 1.00 0.00 C ATOM 230 CG GLU A 95 117.051 -8.348 2.687 1.00 0.00 C ATOM 231 CD GLU A 95 116.756 -9.763 3.148 1.00 0.00 C ATOM 232 OE1 GLU A 95 115.846 -9.936 3.986 1.00 0.00 O ATOM 233 OE2 GLU A 95 117.437 -10.695 2.673 1.00 0.00 O ATOM 0 H GLU A 95 119.009 -6.988 5.734 1.00 0.00 H new ATOM 0 HA GLU A 95 119.540 -7.720 3.101 1.00 0.00 H new ATOM 0 HB2 GLU A 95 117.457 -7.993 4.758 1.00 0.00 H new ATOM 0 HB3 GLU A 95 116.871 -6.587 3.891 1.00 0.00 H new ATOM 0 HG2 GLU A 95 116.151 -7.919 2.246 1.00 0.00 H new ATOM 0 HG3 GLU A 95 117.808 -8.376 1.903 1.00 0.00 H new ATOM 240 N GLU A 96 119.007 -4.537 3.498 1.00 0.00 N ATOM 241 CA GLU A 96 119.025 -3.240 2.828 1.00 0.00 C ATOM 242 C GLU A 96 120.445 -2.847 2.413 1.00 0.00 C ATOM 243 O GLU A 96 120.658 -1.770 1.858 1.00 0.00 O ATOM 244 CB GLU A 96 118.428 -2.165 3.738 1.00 0.00 C ATOM 245 CG GLU A 96 119.298 -1.828 4.940 1.00 0.00 C ATOM 246 CD GLU A 96 119.649 -0.354 5.014 1.00 0.00 C ATOM 247 OE1 GLU A 96 120.147 0.189 4.006 1.00 0.00 O ATOM 248 OE2 GLU A 96 119.428 0.256 6.082 1.00 0.00 O ATOM 0 H GLU A 96 119.012 -4.485 4.517 1.00 0.00 H new ATOM 0 HA GLU A 96 118.419 -3.322 1.925 1.00 0.00 H new ATOM 0 HB2 GLU A 96 118.263 -1.259 3.155 1.00 0.00 H new ATOM 0 HB3 GLU A 96 117.452 -2.500 4.090 1.00 0.00 H new ATOM 0 HG2 GLU A 96 118.778 -2.120 5.853 1.00 0.00 H new ATOM 0 HG3 GLU A 96 120.216 -2.414 4.895 1.00 0.00 H new ATOM 255 N LEU A 97 121.412 -3.721 2.684 1.00 0.00 N ATOM 256 CA LEU A 97 122.803 -3.453 2.338 1.00 0.00 C ATOM 257 C LEU A 97 122.960 -3.228 0.836 1.00 0.00 C ATOM 258 O LEU A 97 123.856 -2.509 0.398 1.00 0.00 O ATOM 259 CB LEU A 97 123.695 -4.613 2.787 1.00 0.00 C ATOM 260 CG LEU A 97 124.014 -4.642 4.283 1.00 0.00 C ATOM 261 CD1 LEU A 97 124.675 -5.957 4.663 1.00 0.00 C ATOM 262 CD2 LEU A 97 124.905 -3.468 4.660 1.00 0.00 C ATOM 0 H LEU A 97 121.257 -4.619 3.142 1.00 0.00 H new ATOM 0 HA LEU A 97 123.110 -2.545 2.856 1.00 0.00 H new ATOM 0 HB2 LEU A 97 123.210 -5.551 2.516 1.00 0.00 H new ATOM 0 HB3 LEU A 97 124.632 -4.567 2.232 1.00 0.00 H new ATOM 0 HG LEU A 97 123.079 -4.556 4.836 1.00 0.00 H new ATOM 0 HD11 LEU A 97 124.894 -5.959 5.731 1.00 0.00 H new ATOM 0 HD12 LEU A 97 124.003 -6.783 4.429 1.00 0.00 H new ATOM 0 HD13 LEU A 97 125.602 -6.074 4.102 1.00 0.00 H new ATOM 0 HD21 LEU A 97 125.122 -3.504 5.728 1.00 0.00 H new ATOM 0 HD22 LEU A 97 125.837 -3.524 4.098 1.00 0.00 H new ATOM 0 HD23 LEU A 97 124.395 -2.534 4.425 1.00 0.00 H new ATOM 274 N SER A 98 122.082 -3.847 0.053 1.00 0.00 N ATOM 275 CA SER A 98 122.125 -3.712 -1.398 1.00 0.00 C ATOM 276 C SER A 98 121.823 -2.279 -1.822 1.00 0.00 C ATOM 277 O SER A 98 122.360 -1.787 -2.815 1.00 0.00 O ATOM 278 CB SER A 98 121.126 -4.669 -2.051 1.00 0.00 C ATOM 279 OG SER A 98 119.809 -4.149 -1.997 1.00 0.00 O ATOM 0 H SER A 98 121.333 -4.446 0.399 1.00 0.00 H new ATOM 0 HA SER A 98 123.132 -3.966 -1.730 1.00 0.00 H new ATOM 0 HB2 SER A 98 121.409 -4.842 -3.089 1.00 0.00 H new ATOM 0 HB3 SER A 98 121.160 -5.634 -1.546 1.00 0.00 H new ATOM 0 HG SER A 98 119.191 -4.779 -2.423 1.00 0.00 H new ATOM 285 N ASP A 99 120.959 -1.613 -1.063 1.00 0.00 N ATOM 286 CA ASP A 99 120.585 -0.233 -1.360 1.00 0.00 C ATOM 287 C ASP A 99 121.704 0.731 -0.980 1.00 0.00 C ATOM 288 O ASP A 99 121.858 1.788 -1.592 1.00 0.00 O ATOM 289 CB ASP A 99 119.302 0.139 -0.613 1.00 0.00 C ATOM 290 CG ASP A 99 118.803 1.523 -0.977 1.00 0.00 C ATOM 291 OD1 ASP A 99 118.465 1.740 -2.160 1.00 0.00 O ATOM 292 OD2 ASP A 99 118.749 2.390 -0.080 1.00 0.00 O ATOM 0 H ASP A 99 120.505 -2.005 -0.238 1.00 0.00 H new ATOM 0 HA ASP A 99 120.412 -0.153 -2.433 1.00 0.00 H new ATOM 0 HB2 ASP A 99 118.528 -0.594 -0.838 1.00 0.00 H new ATOM 0 HB3 ASP A 99 119.483 0.092 0.461 1.00 0.00 H new ATOM 297 N LEU A 100 122.482 0.361 0.031 1.00 0.00 N ATOM 298 CA LEU A 100 123.586 1.196 0.491 1.00 0.00 C ATOM 299 C LEU A 100 124.766 1.124 -0.473 1.00 0.00 C ATOM 300 O LEU A 100 125.546 2.071 -0.584 1.00 0.00 O ATOM 301 CB LEU A 100 124.029 0.763 1.889 1.00 0.00 C ATOM 302 CG LEU A 100 123.167 1.294 3.035 1.00 0.00 C ATOM 303 CD1 LEU A 100 123.192 0.330 4.213 1.00 0.00 C ATOM 304 CD2 LEU A 100 123.643 2.675 3.463 1.00 0.00 C ATOM 0 H LEU A 100 122.369 -0.511 0.548 1.00 0.00 H new ATOM 0 HA LEU A 100 123.236 2.228 0.529 1.00 0.00 H new ATOM 0 HB2 LEU A 100 124.032 -0.326 1.931 1.00 0.00 H new ATOM 0 HB3 LEU A 100 125.057 1.091 2.046 1.00 0.00 H new ATOM 0 HG LEU A 100 122.139 1.378 2.683 1.00 0.00 H new ATOM 0 HD11 LEU A 100 122.573 0.724 5.019 1.00 0.00 H new ATOM 0 HD12 LEU A 100 122.804 -0.639 3.899 1.00 0.00 H new ATOM 0 HD13 LEU A 100 124.217 0.213 4.566 1.00 0.00 H new ATOM 0 HD21 LEU A 100 123.019 3.038 4.279 1.00 0.00 H new ATOM 0 HD22 LEU A 100 124.679 2.615 3.797 1.00 0.00 H new ATOM 0 HD23 LEU A 100 123.573 3.362 2.619 1.00 0.00 H new ATOM 316 N PHE A 101 124.895 -0.002 -1.167 1.00 0.00 N ATOM 317 CA PHE A 101 125.983 -0.194 -2.118 1.00 0.00 C ATOM 318 C PHE A 101 125.873 0.785 -3.283 1.00 0.00 C ATOM 319 O PHE A 101 126.842 1.458 -3.633 1.00 0.00 O ATOM 320 CB PHE A 101 125.986 -1.629 -2.644 1.00 0.00 C ATOM 321 CG PHE A 101 127.126 -1.921 -3.578 1.00 0.00 C ATOM 322 CD1 PHE A 101 128.436 -1.850 -3.135 1.00 0.00 C ATOM 323 CD2 PHE A 101 126.887 -2.261 -4.900 1.00 0.00 C ATOM 324 CE1 PHE A 101 129.488 -2.115 -3.992 1.00 0.00 C ATOM 325 CE2 PHE A 101 127.933 -2.526 -5.762 1.00 0.00 C ATOM 326 CZ PHE A 101 129.236 -2.453 -5.308 1.00 0.00 C ATOM 0 H PHE A 101 124.259 -0.796 -1.088 1.00 0.00 H new ATOM 0 HA PHE A 101 126.920 -0.004 -1.595 1.00 0.00 H new ATOM 0 HB2 PHE A 101 126.032 -2.317 -1.800 1.00 0.00 H new ATOM 0 HB3 PHE A 101 125.045 -1.821 -3.160 1.00 0.00 H new ATOM 0 HD1 PHE A 101 128.638 -1.584 -2.108 1.00 0.00 H new ATOM 0 HD2 PHE A 101 125.871 -2.319 -5.261 1.00 0.00 H new ATOM 0 HE1 PHE A 101 130.505 -2.058 -3.634 1.00 0.00 H new ATOM 0 HE2 PHE A 101 127.733 -2.790 -6.790 1.00 0.00 H new ATOM 0 HZ PHE A 101 130.056 -2.660 -5.980 1.00 0.00 H new ATOM 336 N ARG A 102 124.689 0.857 -3.884 1.00 0.00 N ATOM 337 CA ARG A 102 124.457 1.753 -5.013 1.00 0.00 C ATOM 338 C ARG A 102 124.830 3.190 -4.658 1.00 0.00 C ATOM 339 O ARG A 102 125.344 3.932 -5.495 1.00 0.00 O ATOM 340 CB ARG A 102 122.993 1.686 -5.455 1.00 0.00 C ATOM 341 CG ARG A 102 122.004 1.939 -4.329 1.00 0.00 C ATOM 342 CD ARG A 102 120.656 2.395 -4.864 1.00 0.00 C ATOM 343 NE ARG A 102 120.656 3.813 -5.209 1.00 0.00 N ATOM 344 CZ ARG A 102 119.550 4.528 -5.406 1.00 0.00 C ATOM 345 NH1 ARG A 102 118.355 3.962 -5.295 1.00 0.00 N ATOM 346 NH2 ARG A 102 119.639 5.815 -5.716 1.00 0.00 N ATOM 0 H ARG A 102 123.876 0.306 -3.609 1.00 0.00 H new ATOM 0 HA ARG A 102 125.092 1.427 -5.837 1.00 0.00 H new ATOM 0 HB2 ARG A 102 122.827 2.419 -6.244 1.00 0.00 H new ATOM 0 HB3 ARG A 102 122.797 0.704 -5.885 1.00 0.00 H new ATOM 0 HG2 ARG A 102 121.875 1.028 -3.745 1.00 0.00 H new ATOM 0 HG3 ARG A 102 122.404 2.696 -3.655 1.00 0.00 H new ATOM 0 HD2 ARG A 102 120.398 1.808 -5.745 1.00 0.00 H new ATOM 0 HD3 ARG A 102 119.886 2.204 -4.117 1.00 0.00 H new ATOM 0 HE ARG A 102 121.556 4.284 -5.305 1.00 0.00 H new ATOM 0 HH11 ARG A 102 118.279 2.973 -5.057 1.00 0.00 H new ATOM 0 HH12 ARG A 102 117.512 4.516 -5.447 1.00 0.00 H new ATOM 0 HH21 ARG A 102 120.554 6.256 -5.803 1.00 0.00 H new ATOM 0 HH22 ARG A 102 118.792 6.363 -5.867 1.00 0.00 H new ATOM 360 N MET A 103 124.572 3.573 -3.413 1.00 0.00 N ATOM 361 CA MET A 103 124.884 4.920 -2.950 1.00 0.00 C ATOM 362 C MET A 103 126.380 5.195 -3.059 1.00 0.00 C ATOM 363 O MET A 103 126.796 6.210 -3.616 1.00 0.00 O ATOM 364 CB MET A 103 124.422 5.104 -1.502 1.00 0.00 C ATOM 365 CG MET A 103 122.922 4.941 -1.315 1.00 0.00 C ATOM 366 SD MET A 103 122.157 6.369 -0.522 1.00 0.00 S ATOM 367 CE MET A 103 122.230 7.573 -1.846 1.00 0.00 C ATOM 0 H MET A 103 124.148 2.971 -2.707 1.00 0.00 H new ATOM 0 HA MET A 103 124.354 5.630 -3.584 1.00 0.00 H new ATOM 0 HB2 MET A 103 124.939 4.382 -0.870 1.00 0.00 H new ATOM 0 HB3 MET A 103 124.717 6.096 -1.159 1.00 0.00 H new ATOM 0 HG2 MET A 103 122.455 4.777 -2.286 1.00 0.00 H new ATOM 0 HG3 MET A 103 122.730 4.052 -0.715 1.00 0.00 H new ATOM 0 HE1 MET A 103 121.793 8.513 -1.508 1.00 0.00 H new ATOM 0 HE2 MET A 103 123.269 7.738 -2.131 1.00 0.00 H new ATOM 0 HE3 MET A 103 121.672 7.202 -2.706 1.00 0.00 H new ATOM 377 N PHE A 104 127.183 4.284 -2.522 1.00 0.00 N ATOM 378 CA PHE A 104 128.635 4.425 -2.558 1.00 0.00 C ATOM 379 C PHE A 104 129.145 4.474 -3.995 1.00 0.00 C ATOM 380 O PHE A 104 130.180 5.078 -4.276 1.00 0.00 O ATOM 381 CB PHE A 104 129.299 3.271 -1.802 1.00 0.00 C ATOM 382 CG PHE A 104 129.910 3.686 -0.494 1.00 0.00 C ATOM 383 CD1 PHE A 104 129.108 3.989 0.594 1.00 0.00 C ATOM 384 CD2 PHE A 104 131.286 3.773 -0.353 1.00 0.00 C ATOM 385 CE1 PHE A 104 129.667 4.371 1.799 1.00 0.00 C ATOM 386 CE2 PHE A 104 131.850 4.154 0.849 1.00 0.00 C ATOM 387 CZ PHE A 104 131.039 4.454 1.926 1.00 0.00 C ATOM 0 H PHE A 104 126.853 3.439 -2.056 1.00 0.00 H new ATOM 0 HA PHE A 104 128.896 5.365 -2.072 1.00 0.00 H new ATOM 0 HB2 PHE A 104 128.558 2.494 -1.617 1.00 0.00 H new ATOM 0 HB3 PHE A 104 130.072 2.831 -2.432 1.00 0.00 H new ATOM 0 HD1 PHE A 104 128.034 3.926 0.500 1.00 0.00 H new ATOM 0 HD2 PHE A 104 131.924 3.540 -1.192 1.00 0.00 H new ATOM 0 HE1 PHE A 104 129.031 4.604 2.640 1.00 0.00 H new ATOM 0 HE2 PHE A 104 132.924 4.217 0.947 1.00 0.00 H new ATOM 0 HZ PHE A 104 131.478 4.753 2.866 1.00 0.00 H new ATOM 397 N ASP A 105 128.411 3.836 -4.904 1.00 0.00 N ATOM 398 CA ASP A 105 128.792 3.810 -6.311 1.00 0.00 C ATOM 399 C ASP A 105 128.602 5.183 -6.950 1.00 0.00 C ATOM 400 O ASP A 105 127.642 5.892 -6.647 1.00 0.00 O ATOM 401 CB ASP A 105 127.970 2.763 -7.065 1.00 0.00 C ATOM 402 CG ASP A 105 128.704 1.443 -7.206 1.00 0.00 C ATOM 403 OD1 ASP A 105 128.949 0.788 -6.172 1.00 0.00 O ATOM 404 OD2 ASP A 105 129.030 1.066 -8.350 1.00 0.00 O ATOM 0 H ASP A 105 127.551 3.331 -4.690 1.00 0.00 H new ATOM 0 HA ASP A 105 129.847 3.544 -6.372 1.00 0.00 H new ATOM 0 HB2 ASP A 105 127.029 2.598 -6.541 1.00 0.00 H new ATOM 0 HB3 ASP A 105 127.721 3.145 -8.055 1.00 0.00 H new ATOM 409 N LYS A 106 129.525 5.553 -7.832 1.00 0.00 N ATOM 410 CA LYS A 106 129.461 6.842 -8.511 1.00 0.00 C ATOM 411 C LYS A 106 128.528 6.781 -9.717 1.00 0.00 C ATOM 412 O LYS A 106 127.651 7.630 -9.875 1.00 0.00 O ATOM 413 CB LYS A 106 130.860 7.276 -8.957 1.00 0.00 C ATOM 414 CG LYS A 106 130.896 8.659 -9.585 1.00 0.00 C ATOM 415 CD LYS A 106 130.628 9.746 -8.556 1.00 0.00 C ATOM 416 CE LYS A 106 130.039 10.990 -9.200 1.00 0.00 C ATOM 417 NZ LYS A 106 128.583 10.839 -9.471 1.00 0.00 N ATOM 0 H LYS A 106 130.326 4.978 -8.093 1.00 0.00 H new ATOM 0 HA LYS A 106 129.065 7.574 -7.807 1.00 0.00 H new ATOM 0 HB2 LYS A 106 131.528 7.259 -8.096 1.00 0.00 H new ATOM 0 HB3 LYS A 106 131.245 6.551 -9.673 1.00 0.00 H new ATOM 0 HG2 LYS A 106 131.870 8.825 -10.046 1.00 0.00 H new ATOM 0 HG3 LYS A 106 130.153 8.718 -10.380 1.00 0.00 H new ATOM 0 HD2 LYS A 106 129.943 9.369 -7.797 1.00 0.00 H new ATOM 0 HD3 LYS A 106 131.557 10.004 -8.047 1.00 0.00 H new ATOM 0 HE2 LYS A 106 130.200 11.848 -8.547 1.00 0.00 H new ATOM 0 HE3 LYS A 106 130.562 11.198 -10.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 128.340 11.337 -10.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 128.351 9.830 -9.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 128.039 11.245 -8.683 1.00 0.00 H new ATOM 431 N ASN A 107 128.723 5.776 -10.564 1.00 0.00 N ATOM 432 CA ASN A 107 127.897 5.610 -11.756 1.00 0.00 C ATOM 433 C ASN A 107 127.165 4.269 -11.742 1.00 0.00 C ATOM 434 O ASN A 107 126.677 3.811 -12.774 1.00 0.00 O ATOM 435 CB ASN A 107 128.760 5.717 -13.014 1.00 0.00 C ATOM 436 CG ASN A 107 129.854 4.668 -13.055 1.00 0.00 C ATOM 437 OD1 ASN A 107 129.761 3.631 -12.395 1.00 0.00 O ATOM 438 ND2 ASN A 107 130.899 4.931 -13.830 1.00 0.00 N ATOM 0 H ASN A 107 129.445 5.065 -10.448 1.00 0.00 H new ATOM 0 HA ASN A 107 127.151 6.405 -11.760 1.00 0.00 H new ATOM 0 HB2 ASN A 107 128.127 5.613 -13.895 1.00 0.00 H new ATOM 0 HB3 ASN A 107 129.210 6.709 -13.060 1.00 0.00 H new ATOM 0 HD21 ASN A 107 131.666 4.262 -13.896 1.00 0.00 H new ATOM 0 HD22 ASN A 107 130.935 5.802 -14.359 1.00 0.00 H new ATOM 445 N ALA A 108 127.090 3.644 -10.568 1.00 0.00 N ATOM 446 CA ALA A 108 126.415 2.358 -10.426 1.00 0.00 C ATOM 447 C ALA A 108 126.908 1.354 -11.466 1.00 0.00 C ATOM 448 O ALA A 108 126.193 1.023 -12.412 1.00 0.00 O ATOM 449 CB ALA A 108 124.909 2.539 -10.536 1.00 0.00 C ATOM 0 H ALA A 108 127.489 4.008 -9.703 1.00 0.00 H new ATOM 0 HA ALA A 108 126.653 1.960 -9.439 1.00 0.00 H new ATOM 0 HB1 ALA A 108 124.418 1.572 -10.428 1.00 0.00 H new ATOM 0 HB2 ALA A 108 124.565 3.211 -9.749 1.00 0.00 H new ATOM 0 HB3 ALA A 108 124.664 2.964 -11.509 1.00 0.00 H new ATOM 455 N ASP A 109 128.135 0.874 -11.285 1.00 0.00 N ATOM 456 CA ASP A 109 128.722 -0.090 -12.209 1.00 0.00 C ATOM 457 C ASP A 109 128.894 -1.461 -11.554 1.00 0.00 C ATOM 458 O ASP A 109 129.330 -2.413 -12.200 1.00 0.00 O ATOM 459 CB ASP A 109 130.075 0.417 -12.712 1.00 0.00 C ATOM 460 CG ASP A 109 131.064 0.643 -11.585 1.00 0.00 C ATOM 461 OD1 ASP A 109 130.949 1.677 -10.894 1.00 0.00 O ATOM 462 OD2 ASP A 109 131.951 -0.213 -11.395 1.00 0.00 O ATOM 0 H ASP A 109 128.741 1.137 -10.508 1.00 0.00 H new ATOM 0 HA ASP A 109 128.039 -0.200 -13.051 1.00 0.00 H new ATOM 0 HB2 ASP A 109 130.490 -0.303 -13.417 1.00 0.00 H new ATOM 0 HB3 ASP A 109 129.930 1.350 -13.257 1.00 0.00 H new ATOM 467 N GLY A 110 128.553 -1.558 -10.271 1.00 0.00 N ATOM 468 CA GLY A 110 128.685 -2.820 -9.565 1.00 0.00 C ATOM 469 C GLY A 110 129.964 -2.906 -8.753 1.00 0.00 C ATOM 470 O GLY A 110 130.114 -3.790 -7.909 1.00 0.00 O ATOM 0 H GLY A 110 128.189 -0.788 -9.710 1.00 0.00 H new ATOM 0 HA2 GLY A 110 127.829 -2.952 -8.903 1.00 0.00 H new ATOM 0 HA3 GLY A 110 128.661 -3.638 -10.285 1.00 0.00 H new ATOM 474 N TYR A 111 130.891 -1.983 -9.005 1.00 0.00 N ATOM 475 CA TYR A 111 132.160 -1.958 -8.289 1.00 0.00 C ATOM 476 C TYR A 111 132.630 -0.524 -8.074 1.00 0.00 C ATOM 477 O TYR A 111 132.285 0.373 -8.844 1.00 0.00 O ATOM 478 CB TYR A 111 133.223 -2.742 -9.061 1.00 0.00 C ATOM 479 CG TYR A 111 132.767 -4.118 -9.494 1.00 0.00 C ATOM 480 CD1 TYR A 111 131.990 -4.286 -10.632 1.00 0.00 C ATOM 481 CD2 TYR A 111 133.117 -5.248 -8.765 1.00 0.00 C ATOM 482 CE1 TYR A 111 131.571 -5.541 -11.031 1.00 0.00 C ATOM 483 CE2 TYR A 111 132.704 -6.507 -9.157 1.00 0.00 C ATOM 484 CZ TYR A 111 131.930 -6.648 -10.291 1.00 0.00 C ATOM 485 OH TYR A 111 131.517 -7.899 -10.685 1.00 0.00 O ATOM 0 H TYR A 111 130.785 -1.244 -9.700 1.00 0.00 H new ATOM 0 HA TYR A 111 132.009 -2.426 -7.316 1.00 0.00 H new ATOM 0 HB2 TYR A 111 133.514 -2.171 -9.943 1.00 0.00 H new ATOM 0 HB3 TYR A 111 134.112 -2.842 -8.438 1.00 0.00 H new ATOM 0 HD1 TYR A 111 131.708 -3.422 -11.215 1.00 0.00 H new ATOM 0 HD2 TYR A 111 133.722 -5.140 -7.877 1.00 0.00 H new ATOM 0 HE1 TYR A 111 130.965 -5.654 -11.918 1.00 0.00 H new ATOM 0 HE2 TYR A 111 132.985 -7.375 -8.580 1.00 0.00 H new ATOM 0 HH TYR A 111 131.857 -8.569 -10.056 1.00 0.00 H new ATOM 495 N ILE A 112 133.419 -0.312 -7.025 1.00 0.00 N ATOM 496 CA ILE A 112 133.932 1.016 -6.717 1.00 0.00 C ATOM 497 C ILE A 112 135.446 0.994 -6.546 1.00 0.00 C ATOM 498 O ILE A 112 136.025 -0.021 -6.152 1.00 0.00 O ATOM 499 CB ILE A 112 133.289 1.591 -5.439 1.00 0.00 C ATOM 500 CG1 ILE A 112 131.766 1.457 -5.500 1.00 0.00 C ATOM 501 CG2 ILE A 112 133.692 3.046 -5.253 1.00 0.00 C ATOM 502 CD1 ILE A 112 131.120 1.290 -4.142 1.00 0.00 C ATOM 0 H ILE A 112 133.716 -1.041 -6.376 1.00 0.00 H new ATOM 0 HA ILE A 112 133.673 1.656 -7.561 1.00 0.00 H new ATOM 0 HB ILE A 112 133.649 1.022 -4.582 1.00 0.00 H new ATOM 0 HG12 ILE A 112 131.351 2.340 -5.985 1.00 0.00 H new ATOM 0 HG13 ILE A 112 131.509 0.601 -6.124 1.00 0.00 H new ATOM 0 HG21 ILE A 112 133.230 3.438 -4.347 1.00 0.00 H new ATOM 0 HG22 ILE A 112 134.776 3.115 -5.167 1.00 0.00 H new ATOM 0 HG23 ILE A 112 133.358 3.629 -6.112 1.00 0.00 H new ATOM 0 HD11 ILE A 112 130.040 1.201 -4.261 1.00 0.00 H new ATOM 0 HD12 ILE A 112 131.507 0.391 -3.663 1.00 0.00 H new ATOM 0 HD13 ILE A 112 131.346 2.158 -3.522 1.00 0.00 H new ATOM 514 N ASP A 113 136.081 2.123 -6.847 1.00 0.00 N ATOM 515 CA ASP A 113 137.529 2.244 -6.732 1.00 0.00 C ATOM 516 C ASP A 113 137.914 3.532 -6.011 1.00 0.00 C ATOM 517 O ASP A 113 137.049 4.281 -5.555 1.00 0.00 O ATOM 518 CB ASP A 113 138.177 2.213 -8.119 1.00 0.00 C ATOM 519 CG ASP A 113 137.676 1.061 -8.969 1.00 0.00 C ATOM 520 OD1 ASP A 113 136.443 0.911 -9.099 1.00 0.00 O ATOM 521 OD2 ASP A 113 138.516 0.311 -9.507 1.00 0.00 O ATOM 0 H ASP A 113 135.613 2.969 -7.173 1.00 0.00 H new ATOM 0 HA ASP A 113 137.892 1.398 -6.148 1.00 0.00 H new ATOM 0 HB2 ASP A 113 137.975 3.153 -8.632 1.00 0.00 H new ATOM 0 HB3 ASP A 113 139.259 2.136 -8.009 1.00 0.00 H new ATOM 526 N LEU A 114 139.215 3.780 -5.909 1.00 0.00 N ATOM 527 CA LEU A 114 139.714 4.978 -5.239 1.00 0.00 C ATOM 528 C LEU A 114 139.236 6.240 -5.949 1.00 0.00 C ATOM 529 O LEU A 114 138.807 7.199 -5.309 1.00 0.00 O ATOM 530 CB LEU A 114 141.245 4.961 -5.180 1.00 0.00 C ATOM 531 CG LEU A 114 141.942 4.412 -6.429 1.00 0.00 C ATOM 532 CD1 LEU A 114 143.117 5.295 -6.819 1.00 0.00 C ATOM 533 CD2 LEU A 114 142.405 2.982 -6.197 1.00 0.00 C ATOM 0 H LEU A 114 139.943 3.170 -6.280 1.00 0.00 H new ATOM 0 HA LEU A 114 139.319 4.982 -4.223 1.00 0.00 H new ATOM 0 HB2 LEU A 114 141.597 5.978 -5.005 1.00 0.00 H new ATOM 0 HB3 LEU A 114 141.553 4.365 -4.321 1.00 0.00 H new ATOM 0 HG LEU A 114 141.224 4.413 -7.249 1.00 0.00 H new ATOM 0 HD11 LEU A 114 143.599 4.888 -7.708 1.00 0.00 H new ATOM 0 HD12 LEU A 114 142.760 6.303 -7.029 1.00 0.00 H new ATOM 0 HD13 LEU A 114 143.835 5.327 -6.000 1.00 0.00 H new ATOM 0 HD21 LEU A 114 142.898 2.609 -7.095 1.00 0.00 H new ATOM 0 HD22 LEU A 114 143.105 2.957 -5.362 1.00 0.00 H new ATOM 0 HD23 LEU A 114 141.544 2.354 -5.968 1.00 0.00 H new ATOM 545 N GLU A 115 139.315 6.234 -7.277 1.00 0.00 N ATOM 546 CA GLU A 115 138.892 7.381 -8.074 1.00 0.00 C ATOM 547 C GLU A 115 137.421 7.705 -7.825 1.00 0.00 C ATOM 548 O GLU A 115 137.057 8.862 -7.613 1.00 0.00 O ATOM 549 CB GLU A 115 139.125 7.110 -9.561 1.00 0.00 C ATOM 550 CG GLU A 115 138.513 5.807 -10.048 1.00 0.00 C ATOM 551 CD GLU A 115 137.164 6.007 -10.711 1.00 0.00 C ATOM 552 OE1 GLU A 115 136.538 7.063 -10.476 1.00 0.00 O ATOM 553 OE2 GLU A 115 136.733 5.108 -11.463 1.00 0.00 O ATOM 0 H GLU A 115 139.668 5.448 -7.823 1.00 0.00 H new ATOM 0 HA GLU A 115 139.489 8.241 -7.773 1.00 0.00 H new ATOM 0 HB2 GLU A 115 138.711 7.935 -10.141 1.00 0.00 H new ATOM 0 HB3 GLU A 115 140.198 7.092 -9.754 1.00 0.00 H new ATOM 0 HG2 GLU A 115 139.194 5.332 -10.754 1.00 0.00 H new ATOM 0 HG3 GLU A 115 138.402 5.125 -9.205 1.00 0.00 H new ATOM 560 N GLU A 116 136.580 6.677 -7.853 1.00 0.00 N ATOM 561 CA GLU A 116 135.149 6.852 -7.629 1.00 0.00 C ATOM 562 C GLU A 116 134.866 7.181 -6.167 1.00 0.00 C ATOM 563 O GLU A 116 134.169 8.148 -5.860 1.00 0.00 O ATOM 564 CB GLU A 116 134.388 5.589 -8.038 1.00 0.00 C ATOM 565 CG GLU A 116 133.903 5.611 -9.477 1.00 0.00 C ATOM 566 CD GLU A 116 133.184 4.335 -9.868 1.00 0.00 C ATOM 567 OE1 GLU A 116 132.117 4.051 -9.284 1.00 0.00 O ATOM 568 OE2 GLU A 116 133.688 3.618 -10.758 1.00 0.00 O ATOM 0 H GLU A 116 136.864 5.713 -8.029 1.00 0.00 H new ATOM 0 HA GLU A 116 134.809 7.685 -8.243 1.00 0.00 H new ATOM 0 HB2 GLU A 116 135.034 4.723 -7.894 1.00 0.00 H new ATOM 0 HB3 GLU A 116 133.531 5.461 -7.376 1.00 0.00 H new ATOM 0 HG2 GLU A 116 133.233 6.459 -9.618 1.00 0.00 H new ATOM 0 HG3 GLU A 116 134.754 5.763 -10.141 1.00 0.00 H new ATOM 575 N LEU A 117 135.411 6.366 -5.267 1.00 0.00 N ATOM 576 CA LEU A 117 135.219 6.565 -3.835 1.00 0.00 C ATOM 577 C LEU A 117 135.643 7.970 -3.414 1.00 0.00 C ATOM 578 O LEU A 117 135.086 8.543 -2.478 1.00 0.00 O ATOM 579 CB LEU A 117 136.013 5.523 -3.045 1.00 0.00 C ATOM 580 CG LEU A 117 135.501 5.255 -1.629 1.00 0.00 C ATOM 581 CD1 LEU A 117 134.139 4.579 -1.674 1.00 0.00 C ATOM 582 CD2 LEU A 117 136.496 4.402 -0.857 1.00 0.00 C ATOM 0 H LEU A 117 135.990 5.561 -5.506 1.00 0.00 H new ATOM 0 HA LEU A 117 134.157 6.448 -3.618 1.00 0.00 H new ATOM 0 HB2 LEU A 117 136.006 4.585 -3.601 1.00 0.00 H new ATOM 0 HB3 LEU A 117 137.051 5.850 -2.984 1.00 0.00 H new ATOM 0 HG LEU A 117 135.393 6.210 -1.114 1.00 0.00 H new ATOM 0 HD11 LEU A 117 133.790 4.396 -0.658 1.00 0.00 H new ATOM 0 HD12 LEU A 117 133.429 5.225 -2.191 1.00 0.00 H new ATOM 0 HD13 LEU A 117 134.221 3.631 -2.206 1.00 0.00 H new ATOM 0 HD21 LEU A 117 136.116 4.221 0.149 1.00 0.00 H new ATOM 0 HD22 LEU A 117 136.634 3.450 -1.370 1.00 0.00 H new ATOM 0 HD23 LEU A 117 137.451 4.923 -0.796 1.00 0.00 H new ATOM 594 N LYS A 118 136.632 8.517 -4.114 1.00 0.00 N ATOM 595 CA LYS A 118 137.131 9.854 -3.814 1.00 0.00 C ATOM 596 C LYS A 118 136.079 10.914 -4.128 1.00 0.00 C ATOM 597 O LYS A 118 136.065 11.988 -3.526 1.00 0.00 O ATOM 598 CB LYS A 118 138.406 10.135 -4.611 1.00 0.00 C ATOM 599 CG LYS A 118 139.069 11.454 -4.254 1.00 0.00 C ATOM 600 CD LYS A 118 140.345 11.671 -5.053 1.00 0.00 C ATOM 601 CE LYS A 118 140.735 13.140 -5.100 1.00 0.00 C ATOM 602 NZ LYS A 118 140.815 13.648 -6.498 1.00 0.00 N ATOM 0 H LYS A 118 137.103 8.055 -4.892 1.00 0.00 H new ATOM 0 HA LYS A 118 137.357 9.898 -2.749 1.00 0.00 H new ATOM 0 HB2 LYS A 118 139.115 9.325 -4.443 1.00 0.00 H new ATOM 0 HB3 LYS A 118 138.167 10.134 -5.674 1.00 0.00 H new ATOM 0 HG2 LYS A 118 138.376 12.274 -4.444 1.00 0.00 H new ATOM 0 HG3 LYS A 118 139.298 11.470 -3.189 1.00 0.00 H new ATOM 0 HD2 LYS A 118 141.155 11.093 -4.609 1.00 0.00 H new ATOM 0 HD3 LYS A 118 140.207 11.298 -6.068 1.00 0.00 H new ATOM 0 HE2 LYS A 118 140.006 13.727 -4.541 1.00 0.00 H new ATOM 0 HE3 LYS A 118 141.698 13.276 -4.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 141.083 14.653 -6.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 141.528 13.105 -7.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 139.889 13.542 -6.959 1.00 0.00 H new ATOM 616 N ILE A 119 135.200 10.606 -5.077 1.00 0.00 N ATOM 617 CA ILE A 119 134.145 11.532 -5.472 1.00 0.00 C ATOM 618 C ILE A 119 133.057 11.625 -4.403 1.00 0.00 C ATOM 619 O ILE A 119 132.325 12.612 -4.335 1.00 0.00 O ATOM 620 CB ILE A 119 133.499 11.113 -6.808 1.00 0.00 C ATOM 621 CG1 ILE A 119 134.578 10.860 -7.863 1.00 0.00 C ATOM 622 CG2 ILE A 119 132.525 12.180 -7.285 1.00 0.00 C ATOM 623 CD1 ILE A 119 134.118 9.964 -8.994 1.00 0.00 C ATOM 0 H ILE A 119 135.198 9.722 -5.586 1.00 0.00 H new ATOM 0 HA ILE A 119 134.615 12.508 -5.592 1.00 0.00 H new ATOM 0 HB ILE A 119 132.945 10.188 -6.651 1.00 0.00 H new ATOM 0 HG12 ILE A 119 134.903 11.815 -8.276 1.00 0.00 H new ATOM 0 HG13 ILE A 119 135.446 10.409 -7.383 1.00 0.00 H new ATOM 0 HG21 ILE A 119 132.078 11.869 -8.229 1.00 0.00 H new ATOM 0 HG22 ILE A 119 131.741 12.316 -6.540 1.00 0.00 H new ATOM 0 HG23 ILE A 119 133.057 13.120 -7.428 1.00 0.00 H new ATOM 0 HD11 ILE A 119 134.933 9.828 -9.705 1.00 0.00 H new ATOM 0 HD12 ILE A 119 133.821 8.995 -8.593 1.00 0.00 H new ATOM 0 HD13 ILE A 119 133.269 10.423 -9.500 1.00 0.00 H new ATOM 635 N MET A 120 132.953 10.591 -3.575 1.00 0.00 N ATOM 636 CA MET A 120 131.951 10.559 -2.516 1.00 0.00 C ATOM 637 C MET A 120 132.418 11.334 -1.288 1.00 0.00 C ATOM 638 O MET A 120 131.614 11.951 -0.588 1.00 0.00 O ATOM 639 CB MET A 120 131.637 9.112 -2.128 1.00 0.00 C ATOM 640 CG MET A 120 130.374 8.966 -1.296 1.00 0.00 C ATOM 641 SD MET A 120 130.361 7.452 -0.315 1.00 0.00 S ATOM 642 CE MET A 120 131.672 7.796 0.855 1.00 0.00 C ATOM 0 H MET A 120 133.550 9.765 -3.617 1.00 0.00 H new ATOM 0 HA MET A 120 131.048 11.035 -2.897 1.00 0.00 H new ATOM 0 HB2 MET A 120 131.536 8.515 -3.035 1.00 0.00 H new ATOM 0 HB3 MET A 120 132.479 8.703 -1.570 1.00 0.00 H new ATOM 0 HG2 MET A 120 130.279 9.825 -0.632 1.00 0.00 H new ATOM 0 HG3 MET A 120 129.506 8.975 -1.955 1.00 0.00 H new ATOM 0 HE1 MET A 120 131.456 7.298 1.800 1.00 0.00 H new ATOM 0 HE2 MET A 120 132.619 7.429 0.459 1.00 0.00 H new ATOM 0 HE3 MET A 120 131.740 8.871 1.019 1.00 0.00 H new ATOM 652 N LEU A 121 133.720 11.294 -1.025 1.00 0.00 N ATOM 653 CA LEU A 121 134.291 11.988 0.125 1.00 0.00 C ATOM 654 C LEU A 121 134.325 13.498 -0.101 1.00 0.00 C ATOM 655 O LEU A 121 134.176 14.276 0.840 1.00 0.00 O ATOM 656 CB LEU A 121 135.702 11.468 0.413 1.00 0.00 C ATOM 657 CG LEU A 121 135.796 10.460 1.559 1.00 0.00 C ATOM 658 CD1 LEU A 121 135.483 11.129 2.888 1.00 0.00 C ATOM 659 CD2 LEU A 121 134.856 9.289 1.316 1.00 0.00 C ATOM 0 H LEU A 121 134.400 10.788 -1.592 1.00 0.00 H new ATOM 0 HA LEU A 121 133.654 11.788 0.987 1.00 0.00 H new ATOM 0 HB2 LEU A 121 136.094 11.004 -0.492 1.00 0.00 H new ATOM 0 HB3 LEU A 121 136.347 12.317 0.641 1.00 0.00 H new ATOM 0 HG LEU A 121 136.817 10.080 1.599 1.00 0.00 H new ATOM 0 HD11 LEU A 121 135.555 10.395 3.691 1.00 0.00 H new ATOM 0 HD12 LEU A 121 136.196 11.934 3.067 1.00 0.00 H new ATOM 0 HD13 LEU A 121 134.473 11.538 2.860 1.00 0.00 H new ATOM 0 HD21 LEU A 121 134.936 8.581 2.141 1.00 0.00 H new ATOM 0 HD22 LEU A 121 133.831 9.653 1.248 1.00 0.00 H new ATOM 0 HD23 LEU A 121 135.127 8.792 0.384 1.00 0.00 H new ATOM 671 N GLN A 122 134.516 13.904 -1.351 1.00 0.00 N ATOM 672 CA GLN A 122 134.563 15.322 -1.688 1.00 0.00 C ATOM 673 C GLN A 122 133.218 15.981 -1.416 1.00 0.00 C ATOM 674 O GLN A 122 133.152 17.110 -0.929 1.00 0.00 O ATOM 675 CB GLN A 122 134.943 15.511 -3.157 1.00 0.00 C ATOM 676 CG GLN A 122 134.182 14.602 -4.105 1.00 0.00 C ATOM 677 CD GLN A 122 134.372 14.989 -5.560 1.00 0.00 C ATOM 678 OE1 GLN A 122 133.411 15.315 -6.258 1.00 0.00 O ATOM 679 NE2 GLN A 122 135.616 14.952 -6.023 1.00 0.00 N ATOM 0 H GLN A 122 134.640 13.275 -2.144 1.00 0.00 H new ATOM 0 HA GLN A 122 135.321 15.794 -1.063 1.00 0.00 H new ATOM 0 HB2 GLN A 122 134.763 16.548 -3.439 1.00 0.00 H new ATOM 0 HB3 GLN A 122 136.012 15.330 -3.273 1.00 0.00 H new ATOM 0 HG2 GLN A 122 134.512 13.573 -3.960 1.00 0.00 H new ATOM 0 HG3 GLN A 122 133.120 14.634 -3.860 1.00 0.00 H new ATOM 0 HE21 GLN A 122 136.381 14.676 -5.408 1.00 0.00 H new ATOM 0 HE22 GLN A 122 135.806 15.200 -6.994 1.00 0.00 H new ATOM 688 N ALA A 123 132.148 15.263 -1.735 1.00 0.00 N ATOM 689 CA ALA A 123 130.793 15.764 -1.528 1.00 0.00 C ATOM 690 C ALA A 123 130.626 16.326 -0.121 1.00 0.00 C ATOM 691 O ALA A 123 129.945 17.331 0.081 1.00 0.00 O ATOM 692 CB ALA A 123 129.778 14.660 -1.782 1.00 0.00 C ATOM 0 H ALA A 123 132.192 14.328 -2.140 1.00 0.00 H new ATOM 0 HA ALA A 123 130.618 16.573 -2.237 1.00 0.00 H new ATOM 0 HB1 ALA A 123 128.772 15.048 -1.624 1.00 0.00 H new ATOM 0 HB2 ALA A 123 129.874 14.307 -2.809 1.00 0.00 H new ATOM 0 HB3 ALA A 123 129.960 13.833 -1.096 1.00 0.00 H new ATOM 698 N THR A 124 131.261 15.673 0.850 1.00 0.00 N ATOM 699 CA THR A 124 131.187 16.115 2.239 1.00 0.00 C ATOM 700 C THR A 124 131.649 17.564 2.362 1.00 0.00 C ATOM 701 O THR A 124 132.059 18.177 1.377 1.00 0.00 O ATOM 702 CB THR A 124 132.045 15.214 3.130 1.00 0.00 C ATOM 703 OG1 THR A 124 133.423 15.453 2.904 1.00 0.00 O ATOM 704 CG2 THR A 124 131.791 13.738 2.910 1.00 0.00 C ATOM 0 H THR A 124 131.830 14.840 0.701 1.00 0.00 H new ATOM 0 HA THR A 124 130.150 16.049 2.567 1.00 0.00 H new ATOM 0 HB THR A 124 131.763 15.465 4.153 1.00 0.00 H new ATOM 0 HG1 THR A 124 133.606 15.428 1.942 1.00 0.00 H new ATOM 0 HG21 THR A 124 132.431 13.156 3.573 1.00 0.00 H new ATOM 0 HG22 THR A 124 130.746 13.513 3.125 1.00 0.00 H new ATOM 0 HG23 THR A 124 132.012 13.481 1.874 1.00 0.00 H new ATOM 712 N GLY A 125 131.583 18.110 3.573 1.00 0.00 N ATOM 713 CA GLY A 125 132.002 19.483 3.785 1.00 0.00 C ATOM 714 C GLY A 125 133.233 19.588 4.666 1.00 0.00 C ATOM 715 O GLY A 125 133.521 20.648 5.218 1.00 0.00 O ATOM 0 H GLY A 125 131.248 17.628 4.407 1.00 0.00 H new ATOM 0 HA2 GLY A 125 132.209 19.949 2.821 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.185 20.042 4.241 1.00 0.00 H new ATOM 719 N GLU A 126 133.961 18.482 4.797 1.00 0.00 N ATOM 720 CA GLU A 126 135.167 18.454 5.617 1.00 0.00 C ATOM 721 C GLU A 126 136.416 18.535 4.742 1.00 0.00 C ATOM 722 O GLU A 126 136.329 18.805 3.546 1.00 0.00 O ATOM 723 CB GLU A 126 135.201 17.180 6.462 1.00 0.00 C ATOM 724 CG GLU A 126 135.285 15.909 5.637 1.00 0.00 C ATOM 725 CD GLU A 126 135.357 14.660 6.493 1.00 0.00 C ATOM 726 OE1 GLU A 126 136.430 14.403 7.079 1.00 0.00 O ATOM 727 OE2 GLU A 126 134.340 13.939 6.580 1.00 0.00 O ATOM 0 H GLU A 126 133.737 17.595 4.346 1.00 0.00 H new ATOM 0 HA GLU A 126 135.152 19.319 6.280 1.00 0.00 H new ATOM 0 HB2 GLU A 126 136.056 17.223 7.136 1.00 0.00 H new ATOM 0 HB3 GLU A 126 134.307 17.142 7.084 1.00 0.00 H new ATOM 0 HG2 GLU A 126 134.415 15.847 4.983 1.00 0.00 H new ATOM 0 HG3 GLU A 126 136.164 15.955 4.994 1.00 0.00 H new ATOM 734 N THR A 127 137.577 18.300 5.347 1.00 0.00 N ATOM 735 CA THR A 127 138.840 18.346 4.621 1.00 0.00 C ATOM 736 C THR A 127 139.549 16.998 4.685 1.00 0.00 C ATOM 737 O THR A 127 140.152 16.652 5.700 1.00 0.00 O ATOM 738 CB THR A 127 139.744 19.436 5.198 1.00 0.00 C ATOM 739 OG1 THR A 127 140.105 19.133 6.534 1.00 0.00 O ATOM 740 CG2 THR A 127 139.104 20.808 5.197 1.00 0.00 C ATOM 0 H THR A 127 137.668 18.076 6.338 1.00 0.00 H new ATOM 0 HA THR A 127 138.624 18.577 3.578 1.00 0.00 H new ATOM 0 HB THR A 127 140.618 19.460 4.547 1.00 0.00 H new ATOM 0 HG1 THR A 127 140.210 18.164 6.633 1.00 0.00 H new ATOM 0 HG21 THR A 127 139.799 21.534 5.619 1.00 0.00 H new ATOM 0 HG22 THR A 127 138.858 21.094 4.174 1.00 0.00 H new ATOM 0 HG23 THR A 127 138.194 20.785 5.797 1.00 0.00 H new ATOM 748 N ILE A 128 139.472 16.238 3.597 1.00 0.00 N ATOM 749 CA ILE A 128 140.107 14.927 3.536 1.00 0.00 C ATOM 750 C ILE A 128 141.262 14.919 2.542 1.00 0.00 C ATOM 751 O ILE A 128 141.268 15.683 1.575 1.00 0.00 O ATOM 752 CB ILE A 128 139.099 13.829 3.140 1.00 0.00 C ATOM 753 CG1 ILE A 128 137.790 13.996 3.916 1.00 0.00 C ATOM 754 CG2 ILE A 128 139.697 12.451 3.384 1.00 0.00 C ATOM 755 CD1 ILE A 128 136.635 14.466 3.060 1.00 0.00 C ATOM 0 H ILE A 128 138.977 16.507 2.747 1.00 0.00 H new ATOM 0 HA ILE A 128 140.489 14.717 4.535 1.00 0.00 H new ATOM 0 HB ILE A 128 138.879 13.926 2.077 1.00 0.00 H new ATOM 0 HG12 ILE A 128 137.526 13.044 4.377 1.00 0.00 H new ATOM 0 HG13 ILE A 128 137.945 14.709 4.725 1.00 0.00 H new ATOM 0 HG21 ILE A 128 138.975 11.686 3.100 1.00 0.00 H new ATOM 0 HG22 ILE A 128 140.601 12.336 2.787 1.00 0.00 H new ATOM 0 HG23 ILE A 128 139.944 12.343 4.440 1.00 0.00 H new ATOM 0 HD11 ILE A 128 135.741 14.562 3.676 1.00 0.00 H new ATOM 0 HD12 ILE A 128 136.878 15.433 2.620 1.00 0.00 H new ATOM 0 HD13 ILE A 128 136.452 13.742 2.266 1.00 0.00 H new ATOM 767 N THR A 129 142.239 14.052 2.784 1.00 0.00 N ATOM 768 CA THR A 129 143.399 13.943 1.908 1.00 0.00 C ATOM 769 C THR A 129 143.323 12.677 1.062 1.00 0.00 C ATOM 770 O THR A 129 142.606 11.735 1.400 1.00 0.00 O ATOM 771 CB THR A 129 144.689 13.947 2.730 1.00 0.00 C ATOM 772 OG1 THR A 129 145.792 13.545 1.935 1.00 0.00 O ATOM 773 CG2 THR A 129 144.636 13.032 3.934 1.00 0.00 C ATOM 0 H THR A 129 142.250 13.414 3.580 1.00 0.00 H new ATOM 0 HA THR A 129 143.402 14.805 1.240 1.00 0.00 H new ATOM 0 HB THR A 129 144.805 14.973 3.078 1.00 0.00 H new ATOM 0 HG1 THR A 129 146.608 13.556 2.478 1.00 0.00 H new ATOM 0 HG21 THR A 129 145.583 13.083 4.472 1.00 0.00 H new ATOM 0 HG22 THR A 129 143.827 13.345 4.593 1.00 0.00 H new ATOM 0 HG23 THR A 129 144.461 12.008 3.605 1.00 0.00 H new ATOM 781 N GLU A 130 144.067 12.661 -0.038 1.00 0.00 N ATOM 782 CA GLU A 130 144.083 11.508 -0.932 1.00 0.00 C ATOM 783 C GLU A 130 144.561 10.255 -0.201 1.00 0.00 C ATOM 784 O GLU A 130 144.165 9.140 -0.536 1.00 0.00 O ATOM 785 CB GLU A 130 144.982 11.784 -2.140 1.00 0.00 C ATOM 786 CG GLU A 130 144.345 11.416 -3.468 1.00 0.00 C ATOM 787 CD GLU A 130 144.610 9.974 -3.862 1.00 0.00 C ATOM 788 OE1 GLU A 130 145.748 9.502 -3.658 1.00 0.00 O ATOM 789 OE2 GLU A 130 143.678 9.319 -4.374 1.00 0.00 O ATOM 0 H GLU A 130 144.666 13.432 -0.332 1.00 0.00 H new ATOM 0 HA GLU A 130 143.064 11.336 -1.278 1.00 0.00 H new ATOM 0 HB2 GLU A 130 145.244 12.842 -2.153 1.00 0.00 H new ATOM 0 HB3 GLU A 130 145.912 11.227 -2.026 1.00 0.00 H new ATOM 0 HG2 GLU A 130 143.269 11.581 -3.409 1.00 0.00 H new ATOM 0 HG3 GLU A 130 144.727 12.077 -4.246 1.00 0.00 H new ATOM 796 N ASP A 131 145.415 10.450 0.799 1.00 0.00 N ATOM 797 CA ASP A 131 145.948 9.338 1.577 1.00 0.00 C ATOM 798 C ASP A 131 144.879 8.755 2.498 1.00 0.00 C ATOM 799 O ASP A 131 144.888 7.561 2.795 1.00 0.00 O ATOM 800 CB ASP A 131 147.154 9.798 2.401 1.00 0.00 C ATOM 801 CG ASP A 131 148.472 9.442 1.741 1.00 0.00 C ATOM 802 OD1 ASP A 131 148.649 9.773 0.550 1.00 0.00 O ATOM 803 OD2 ASP A 131 149.328 8.832 2.418 1.00 0.00 O ATOM 0 H ASP A 131 145.752 11.368 1.089 1.00 0.00 H new ATOM 0 HA ASP A 131 146.266 8.560 0.883 1.00 0.00 H new ATOM 0 HB2 ASP A 131 147.102 10.877 2.545 1.00 0.00 H new ATOM 0 HB3 ASP A 131 147.111 9.342 3.390 1.00 0.00 H new ATOM 808 N ASP A 132 143.962 9.607 2.947 1.00 0.00 N ATOM 809 CA ASP A 132 142.889 9.175 3.835 1.00 0.00 C ATOM 810 C ASP A 132 141.903 8.269 3.102 1.00 0.00 C ATOM 811 O ASP A 132 141.305 7.375 3.700 1.00 0.00 O ATOM 812 CB ASP A 132 142.154 10.388 4.408 1.00 0.00 C ATOM 813 CG ASP A 132 142.742 10.850 5.727 1.00 0.00 C ATOM 814 OD1 ASP A 132 142.984 9.993 6.602 1.00 0.00 O ATOM 815 OD2 ASP A 132 142.961 12.071 5.883 1.00 0.00 O ATOM 0 H ASP A 132 143.941 10.599 2.711 1.00 0.00 H new ATOM 0 HA ASP A 132 143.336 8.608 4.652 1.00 0.00 H new ATOM 0 HB2 ASP A 132 142.194 11.206 3.689 1.00 0.00 H new ATOM 0 HB3 ASP A 132 141.102 10.139 4.550 1.00 0.00 H new ATOM 820 N ILE A 133 141.739 8.506 1.805 1.00 0.00 N ATOM 821 CA ILE A 133 140.827 7.711 0.990 1.00 0.00 C ATOM 822 C ILE A 133 141.356 6.295 0.773 1.00 0.00 C ATOM 823 O ILE A 133 140.619 5.409 0.340 1.00 0.00 O ATOM 824 CB ILE A 133 140.580 8.368 -0.384 1.00 0.00 C ATOM 825 CG1 ILE A 133 140.292 9.863 -0.219 1.00 0.00 C ATOM 826 CG2 ILE A 133 139.432 7.678 -1.106 1.00 0.00 C ATOM 827 CD1 ILE A 133 139.130 10.159 0.703 1.00 0.00 C ATOM 0 H ILE A 133 142.226 9.243 1.295 1.00 0.00 H new ATOM 0 HA ILE A 133 139.887 7.661 1.539 1.00 0.00 H new ATOM 0 HB ILE A 133 141.481 8.256 -0.987 1.00 0.00 H new ATOM 0 HG12 ILE A 133 141.185 10.356 0.166 1.00 0.00 H new ATOM 0 HG13 ILE A 133 140.087 10.295 -1.198 1.00 0.00 H new ATOM 0 HG21 ILE A 133 139.272 8.154 -2.073 1.00 0.00 H new ATOM 0 HG22 ILE A 133 139.676 6.626 -1.255 1.00 0.00 H new ATOM 0 HG23 ILE A 133 138.525 7.758 -0.507 1.00 0.00 H new ATOM 0 HD11 ILE A 133 138.985 11.237 0.771 1.00 0.00 H new ATOM 0 HD12 ILE A 133 138.226 9.696 0.309 1.00 0.00 H new ATOM 0 HD13 ILE A 133 139.341 9.758 1.694 1.00 0.00 H new ATOM 839 N GLU A 134 142.635 6.084 1.075 1.00 0.00 N ATOM 840 CA GLU A 134 143.253 4.774 0.907 1.00 0.00 C ATOM 841 C GLU A 134 142.788 3.805 1.990 1.00 0.00 C ATOM 842 O GLU A 134 142.603 2.616 1.733 1.00 0.00 O ATOM 843 CB GLU A 134 144.777 4.898 0.941 1.00 0.00 C ATOM 844 CG GLU A 134 145.353 5.660 -0.242 1.00 0.00 C ATOM 845 CD GLU A 134 146.454 4.896 -0.953 1.00 0.00 C ATOM 846 OE1 GLU A 134 147.310 4.309 -0.259 1.00 0.00 O ATOM 847 OE2 GLU A 134 146.458 4.882 -2.202 1.00 0.00 O ATOM 0 H GLU A 134 143.262 6.803 1.437 1.00 0.00 H new ATOM 0 HA GLU A 134 142.947 4.380 -0.062 1.00 0.00 H new ATOM 0 HB2 GLU A 134 145.072 5.399 1.863 1.00 0.00 H new ATOM 0 HB3 GLU A 134 145.214 3.900 0.967 1.00 0.00 H new ATOM 0 HG2 GLU A 134 144.554 5.880 -0.950 1.00 0.00 H new ATOM 0 HG3 GLU A 134 145.745 6.616 0.104 1.00 0.00 H new ATOM 854 N GLU A 135 142.602 4.322 3.200 1.00 0.00 N ATOM 855 CA GLU A 135 142.161 3.500 4.322 1.00 0.00 C ATOM 856 C GLU A 135 140.747 2.968 4.093 1.00 0.00 C ATOM 857 O GLU A 135 140.372 1.926 4.632 1.00 0.00 O ATOM 858 CB GLU A 135 142.210 4.304 5.622 1.00 0.00 C ATOM 859 CG GLU A 135 141.228 5.464 5.660 1.00 0.00 C ATOM 860 CD GLU A 135 140.242 5.357 6.809 1.00 0.00 C ATOM 861 OE1 GLU A 135 140.588 5.785 7.929 1.00 0.00 O ATOM 862 OE2 GLU A 135 139.125 4.844 6.586 1.00 0.00 O ATOM 0 H GLU A 135 142.749 5.305 3.429 1.00 0.00 H new ATOM 0 HA GLU A 135 142.839 2.650 4.401 1.00 0.00 H new ATOM 0 HB2 GLU A 135 142.004 3.637 6.459 1.00 0.00 H new ATOM 0 HB3 GLU A 135 143.220 4.689 5.763 1.00 0.00 H new ATOM 0 HG2 GLU A 135 141.780 6.400 5.746 1.00 0.00 H new ATOM 0 HG3 GLU A 135 140.680 5.502 4.718 1.00 0.00 H new ATOM 869 N LEU A 136 139.968 3.690 3.294 1.00 0.00 N ATOM 870 CA LEU A 136 138.597 3.287 2.999 1.00 0.00 C ATOM 871 C LEU A 136 138.567 1.964 2.240 1.00 0.00 C ATOM 872 O LEU A 136 137.935 1.001 2.676 1.00 0.00 O ATOM 873 CB LEU A 136 137.887 4.373 2.185 1.00 0.00 C ATOM 874 CG LEU A 136 137.057 5.359 3.009 1.00 0.00 C ATOM 875 CD1 LEU A 136 137.070 6.736 2.365 1.00 0.00 C ATOM 876 CD2 LEU A 136 135.630 4.853 3.161 1.00 0.00 C ATOM 0 H LEU A 136 140.261 4.555 2.840 1.00 0.00 H new ATOM 0 HA LEU A 136 138.074 3.152 3.946 1.00 0.00 H new ATOM 0 HB2 LEU A 136 138.635 4.932 1.623 1.00 0.00 H new ATOM 0 HB3 LEU A 136 137.234 3.892 1.457 1.00 0.00 H new ATOM 0 HG LEU A 136 137.502 5.441 4.001 1.00 0.00 H new ATOM 0 HD11 LEU A 136 136.474 7.424 2.965 1.00 0.00 H new ATOM 0 HD12 LEU A 136 138.096 7.100 2.306 1.00 0.00 H new ATOM 0 HD13 LEU A 136 136.649 6.672 1.361 1.00 0.00 H new ATOM 0 HD21 LEU A 136 135.052 5.565 3.750 1.00 0.00 H new ATOM 0 HD22 LEU A 136 135.176 4.743 2.176 1.00 0.00 H new ATOM 0 HD23 LEU A 136 135.638 3.887 3.666 1.00 0.00 H new ATOM 888 N MET A 137 139.253 1.924 1.104 1.00 0.00 N ATOM 889 CA MET A 137 139.305 0.718 0.283 1.00 0.00 C ATOM 890 C MET A 137 140.210 -0.340 0.911 1.00 0.00 C ATOM 891 O MET A 137 140.104 -1.525 0.596 1.00 0.00 O ATOM 892 CB MET A 137 139.801 1.056 -1.124 1.00 0.00 C ATOM 893 CG MET A 137 139.521 -0.035 -2.145 1.00 0.00 C ATOM 894 SD MET A 137 139.170 0.625 -3.786 1.00 0.00 S ATOM 895 CE MET A 137 137.403 0.892 -3.674 1.00 0.00 C ATOM 0 H MET A 137 139.781 2.712 0.729 1.00 0.00 H new ATOM 0 HA MET A 137 138.295 0.312 0.221 1.00 0.00 H new ATOM 0 HB2 MET A 137 139.329 1.981 -1.454 1.00 0.00 H new ATOM 0 HB3 MET A 137 140.875 1.241 -1.087 1.00 0.00 H new ATOM 0 HG2 MET A 137 140.380 -0.703 -2.202 1.00 0.00 H new ATOM 0 HG3 MET A 137 138.674 -0.633 -1.809 1.00 0.00 H new ATOM 0 HE1 MET A 137 137.133 1.782 -4.242 1.00 0.00 H new ATOM 0 HE2 MET A 137 136.878 0.028 -4.082 1.00 0.00 H new ATOM 0 HE3 MET A 137 137.121 1.029 -2.630 1.00 0.00 H new ATOM 905 N LYS A 138 141.103 0.095 1.798 1.00 0.00 N ATOM 906 CA LYS A 138 142.027 -0.818 2.465 1.00 0.00 C ATOM 907 C LYS A 138 141.282 -1.972 3.128 1.00 0.00 C ATOM 908 O LYS A 138 141.376 -3.119 2.688 1.00 0.00 O ATOM 909 CB LYS A 138 142.857 -0.066 3.508 1.00 0.00 C ATOM 910 CG LYS A 138 144.289 -0.564 3.617 1.00 0.00 C ATOM 911 CD LYS A 138 145.282 0.464 3.100 1.00 0.00 C ATOM 912 CE LYS A 138 146.508 -0.201 2.495 1.00 0.00 C ATOM 913 NZ LYS A 138 147.629 -0.290 3.472 1.00 0.00 N ATOM 0 H LYS A 138 141.206 1.073 2.071 1.00 0.00 H new ATOM 0 HA LYS A 138 142.692 -1.232 1.707 1.00 0.00 H new ATOM 0 HB2 LYS A 138 142.868 0.995 3.256 1.00 0.00 H new ATOM 0 HB3 LYS A 138 142.374 -0.158 4.481 1.00 0.00 H new ATOM 0 HG2 LYS A 138 144.515 -0.797 4.657 1.00 0.00 H new ATOM 0 HG3 LYS A 138 144.396 -1.490 3.052 1.00 0.00 H new ATOM 0 HD2 LYS A 138 144.800 1.092 2.351 1.00 0.00 H new ATOM 0 HD3 LYS A 138 145.587 1.119 3.916 1.00 0.00 H new ATOM 0 HE2 LYS A 138 146.246 -1.201 2.151 1.00 0.00 H new ATOM 0 HE3 LYS A 138 146.832 0.362 1.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 148.446 -0.749 3.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 147.896 0.666 3.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 147.328 -0.849 4.296 1.00 0.00 H new ATOM 927 N ASP A 139 140.544 -1.666 4.190 1.00 0.00 N ATOM 928 CA ASP A 139 139.787 -2.681 4.913 1.00 0.00 C ATOM 929 C ASP A 139 138.621 -3.207 4.079 1.00 0.00 C ATOM 930 O ASP A 139 138.153 -4.326 4.289 1.00 0.00 O ATOM 931 CB ASP A 139 139.289 -2.117 6.250 1.00 0.00 C ATOM 932 CG ASP A 139 138.163 -1.113 6.089 1.00 0.00 C ATOM 933 OD1 ASP A 139 137.942 -0.642 4.953 1.00 0.00 O ATOM 934 OD2 ASP A 139 137.505 -0.795 7.101 1.00 0.00 O ATOM 0 H ASP A 139 140.454 -0.723 4.569 1.00 0.00 H new ATOM 0 HA ASP A 139 140.452 -3.521 5.112 1.00 0.00 H new ATOM 0 HB2 ASP A 139 138.948 -2.939 6.880 1.00 0.00 H new ATOM 0 HB3 ASP A 139 140.121 -1.641 6.769 1.00 0.00 H new ATOM 939 N GLY A 140 138.156 -2.398 3.132 1.00 0.00 N ATOM 940 CA GLY A 140 137.053 -2.810 2.283 1.00 0.00 C ATOM 941 C GLY A 140 137.478 -3.785 1.199 1.00 0.00 C ATOM 942 O GLY A 140 136.638 -4.312 0.469 1.00 0.00 O ATOM 0 H GLY A 140 138.523 -1.466 2.938 1.00 0.00 H new ATOM 0 HA2 GLY A 140 136.280 -3.271 2.898 1.00 0.00 H new ATOM 0 HA3 GLY A 140 136.608 -1.929 1.819 1.00 0.00 H new ATOM 946 N ASP A 141 138.783 -4.025 1.089 1.00 0.00 N ATOM 947 CA ASP A 141 139.309 -4.940 0.084 1.00 0.00 C ATOM 948 C ASP A 141 139.594 -6.311 0.688 1.00 0.00 C ATOM 949 O ASP A 141 140.374 -6.436 1.633 1.00 0.00 O ATOM 950 CB ASP A 141 140.586 -4.368 -0.536 1.00 0.00 C ATOM 951 CG ASP A 141 140.951 -5.046 -1.843 1.00 0.00 C ATOM 952 OD1 ASP A 141 140.240 -5.995 -2.240 1.00 0.00 O ATOM 953 OD2 ASP A 141 141.947 -4.628 -2.471 1.00 0.00 O ATOM 0 H ASP A 141 139.493 -3.598 1.684 1.00 0.00 H new ATOM 0 HA ASP A 141 138.554 -5.057 -0.694 1.00 0.00 H new ATOM 0 HB2 ASP A 141 140.455 -3.300 -0.709 1.00 0.00 H new ATOM 0 HB3 ASP A 141 141.410 -4.478 0.169 1.00 0.00 H new ATOM 958 N LYS A 142 138.955 -7.338 0.135 1.00 0.00 N ATOM 959 CA LYS A 142 139.139 -8.703 0.618 1.00 0.00 C ATOM 960 C LYS A 142 139.836 -9.567 -0.431 1.00 0.00 C ATOM 961 O LYS A 142 140.525 -10.530 -0.097 1.00 0.00 O ATOM 962 CB LYS A 142 137.790 -9.320 0.991 1.00 0.00 C ATOM 963 CG LYS A 142 137.370 -9.040 2.425 1.00 0.00 C ATOM 964 CD LYS A 142 137.020 -7.574 2.626 1.00 0.00 C ATOM 965 CE LYS A 142 136.659 -7.285 4.074 1.00 0.00 C ATOM 966 NZ LYS A 142 137.851 -6.898 4.877 1.00 0.00 N ATOM 0 H LYS A 142 138.306 -7.251 -0.647 1.00 0.00 H new ATOM 0 HA LYS A 142 139.771 -8.664 1.505 1.00 0.00 H new ATOM 0 HB2 LYS A 142 137.025 -8.937 0.316 1.00 0.00 H new ATOM 0 HB3 LYS A 142 137.838 -10.398 0.839 1.00 0.00 H new ATOM 0 HG2 LYS A 142 136.510 -9.659 2.681 1.00 0.00 H new ATOM 0 HG3 LYS A 142 138.177 -9.319 3.103 1.00 0.00 H new ATOM 0 HD2 LYS A 142 137.865 -6.952 2.329 1.00 0.00 H new ATOM 0 HD3 LYS A 142 136.184 -7.306 1.980 1.00 0.00 H new ATOM 0 HE2 LYS A 142 135.921 -6.484 4.111 1.00 0.00 H new ATOM 0 HE3 LYS A 142 136.195 -8.167 4.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 137.745 -7.253 5.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 138.706 -7.309 4.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 137.936 -5.862 4.894 1.00 0.00 H new ATOM 980 N ASN A 143 139.654 -9.215 -1.701 1.00 0.00 N ATOM 981 CA ASN A 143 140.269 -9.957 -2.797 1.00 0.00 C ATOM 982 C ASN A 143 141.605 -9.336 -3.205 1.00 0.00 C ATOM 983 O ASN A 143 142.384 -9.947 -3.937 1.00 0.00 O ATOM 984 CB ASN A 143 139.326 -10.009 -4.001 1.00 0.00 C ATOM 985 CG ASN A 143 138.756 -8.648 -4.350 1.00 0.00 C ATOM 986 OD1 ASN A 143 139.077 -7.645 -3.710 1.00 0.00 O ATOM 987 ND2 ASN A 143 137.906 -8.605 -5.368 1.00 0.00 N ATOM 0 H ASN A 143 139.086 -8.421 -1.996 1.00 0.00 H new ATOM 0 HA ASN A 143 140.458 -10.972 -2.448 1.00 0.00 H new ATOM 0 HB2 ASN A 143 139.863 -10.406 -4.862 1.00 0.00 H new ATOM 0 HB3 ASN A 143 138.509 -10.698 -3.789 1.00 0.00 H new ATOM 0 HD21 ASN A 143 137.490 -7.717 -5.648 1.00 0.00 H new ATOM 0 HD22 ASN A 143 137.668 -9.460 -5.870 1.00 0.00 H new ATOM 994 N ASN A 144 141.865 -8.119 -2.727 1.00 0.00 N ATOM 995 CA ASN A 144 143.106 -7.417 -3.042 1.00 0.00 C ATOM 996 C ASN A 144 143.140 -6.978 -4.501 1.00 0.00 C ATOM 997 O ASN A 144 144.207 -6.877 -5.105 1.00 0.00 O ATOM 998 CB ASN A 144 144.319 -8.300 -2.733 1.00 0.00 C ATOM 999 CG ASN A 144 145.582 -7.490 -2.519 1.00 0.00 C ATOM 1000 OD1 ASN A 144 146.333 -7.829 -1.477 1.00 0.00 O flip ATOM 1001 ND2 ASN A 144 145.881 -6.571 -3.281 1.00 0.00 N flip ATOM 0 H ASN A 144 141.231 -7.600 -2.120 1.00 0.00 H new ATOM 0 HA ASN A 144 143.147 -6.526 -2.416 1.00 0.00 H new ATOM 0 HB2 ASN A 144 144.116 -8.894 -1.842 1.00 0.00 H new ATOM 0 HB3 ASN A 144 144.474 -9.000 -3.554 1.00 0.00 H new ATOM 0 HD21 ASN A 144 145.275 -6.345 -4.069 1.00 0.00 H new ATOM 0 HD22 ASN A 144 146.735 -6.036 -3.124 1.00 0.00 H new ATOM 1008 N ASP A 145 141.965 -6.711 -5.060 1.00 0.00 N ATOM 1009 CA ASP A 145 141.864 -6.270 -6.445 1.00 0.00 C ATOM 1010 C ASP A 145 141.940 -4.748 -6.526 1.00 0.00 C ATOM 1011 O ASP A 145 142.410 -4.189 -7.516 1.00 0.00 O ATOM 1012 CB ASP A 145 140.555 -6.763 -7.067 1.00 0.00 C ATOM 1013 CG ASP A 145 139.332 -6.202 -6.368 1.00 0.00 C ATOM 1014 OD1 ASP A 145 139.471 -5.713 -5.229 1.00 0.00 O ATOM 1015 OD2 ASP A 145 138.233 -6.253 -6.962 1.00 0.00 O ATOM 0 H ASP A 145 141.071 -6.792 -4.576 1.00 0.00 H new ATOM 0 HA ASP A 145 142.700 -6.693 -7.003 1.00 0.00 H new ATOM 0 HB2 ASP A 145 140.528 -6.482 -8.120 1.00 0.00 H new ATOM 0 HB3 ASP A 145 140.525 -7.852 -7.027 1.00 0.00 H new ATOM 1020 N GLY A 146 141.474 -4.088 -5.470 1.00 0.00 N ATOM 1021 CA GLY A 146 141.495 -2.638 -5.430 1.00 0.00 C ATOM 1022 C GLY A 146 140.125 -2.033 -5.659 1.00 0.00 C ATOM 1023 O GLY A 146 140.008 -0.908 -6.148 1.00 0.00 O ATOM 0 H GLY A 146 141.082 -4.533 -4.640 1.00 0.00 H new ATOM 0 HA2 GLY A 146 141.877 -2.310 -4.463 1.00 0.00 H new ATOM 0 HA3 GLY A 146 142.184 -2.266 -6.188 1.00 0.00 H new ATOM 1027 N ARG A 147 139.083 -2.777 -5.304 1.00 0.00 N ATOM 1028 CA ARG A 147 137.714 -2.307 -5.474 1.00 0.00 C ATOM 1029 C ARG A 147 136.791 -2.933 -4.434 1.00 0.00 C ATOM 1030 O ARG A 147 137.229 -3.703 -3.581 1.00 0.00 O ATOM 1031 CB ARG A 147 137.205 -2.634 -6.880 1.00 0.00 C ATOM 1032 CG ARG A 147 138.225 -2.375 -7.975 1.00 0.00 C ATOM 1033 CD ARG A 147 137.686 -2.775 -9.339 1.00 0.00 C ATOM 1034 NE ARG A 147 138.001 -4.165 -9.666 1.00 0.00 N ATOM 1035 CZ ARG A 147 137.943 -4.669 -10.895 1.00 0.00 C ATOM 1036 NH1 ARG A 147 137.593 -3.900 -11.920 1.00 0.00 N ATOM 1037 NH2 ARG A 147 138.240 -5.944 -11.103 1.00 0.00 N ATOM 0 H ARG A 147 139.161 -3.709 -4.896 1.00 0.00 H new ATOM 0 HA ARG A 147 137.712 -1.226 -5.337 1.00 0.00 H new ATOM 0 HB2 ARG A 147 136.907 -3.682 -6.914 1.00 0.00 H new ATOM 0 HB3 ARG A 147 136.312 -2.042 -7.080 1.00 0.00 H new ATOM 0 HG2 ARG A 147 138.492 -1.318 -7.983 1.00 0.00 H new ATOM 0 HG3 ARG A 147 139.137 -2.933 -7.764 1.00 0.00 H new ATOM 0 HD2 ARG A 147 136.605 -2.634 -9.357 1.00 0.00 H new ATOM 0 HD3 ARG A 147 138.106 -2.119 -10.101 1.00 0.00 H new ATOM 0 HE ARG A 147 138.282 -4.785 -8.906 1.00 0.00 H new ATOM 0 HH11 ARG A 147 137.367 -2.917 -11.766 1.00 0.00 H new ATOM 0 HH12 ARG A 147 137.550 -4.292 -12.861 1.00 0.00 H new ATOM 0 HH21 ARG A 147 138.513 -6.538 -10.320 1.00 0.00 H new ATOM 0 HH22 ARG A 147 138.196 -6.331 -12.046 1.00 0.00 H new ATOM 1051 N ILE A 148 135.507 -2.602 -4.518 1.00 0.00 N ATOM 1052 CA ILE A 148 134.517 -3.136 -3.590 1.00 0.00 C ATOM 1053 C ILE A 148 133.217 -3.476 -4.310 1.00 0.00 C ATOM 1054 O ILE A 148 132.731 -2.701 -5.134 1.00 0.00 O ATOM 1055 CB ILE A 148 134.219 -2.146 -2.449 1.00 0.00 C ATOM 1056 CG1 ILE A 148 135.523 -1.614 -1.851 1.00 0.00 C ATOM 1057 CG2 ILE A 148 133.371 -2.815 -1.376 1.00 0.00 C ATOM 1058 CD1 ILE A 148 135.322 -0.455 -0.898 1.00 0.00 C ATOM 0 H ILE A 148 135.127 -1.966 -5.219 1.00 0.00 H new ATOM 0 HA ILE A 148 134.942 -4.045 -3.165 1.00 0.00 H new ATOM 0 HB ILE A 148 133.659 -1.304 -2.855 1.00 0.00 H new ATOM 0 HG12 ILE A 148 136.029 -2.423 -1.324 1.00 0.00 H new ATOM 0 HG13 ILE A 148 136.182 -1.299 -2.660 1.00 0.00 H new ATOM 0 HG21 ILE A 148 133.168 -2.103 -0.576 1.00 0.00 H new ATOM 0 HG22 ILE A 148 132.429 -3.149 -1.812 1.00 0.00 H new ATOM 0 HG23 ILE A 148 133.907 -3.673 -0.971 1.00 0.00 H new ATOM 0 HD11 ILE A 148 136.288 -0.129 -0.512 1.00 0.00 H new ATOM 0 HD12 ILE A 148 134.844 0.371 -1.425 1.00 0.00 H new ATOM 0 HD13 ILE A 148 134.689 -0.771 -0.069 1.00 0.00 H new ATOM 1070 N ASP A 149 132.659 -4.639 -3.992 1.00 0.00 N ATOM 1071 CA ASP A 149 131.414 -5.083 -4.606 1.00 0.00 C ATOM 1072 C ASP A 149 130.455 -5.630 -3.554 1.00 0.00 C ATOM 1073 O ASP A 149 130.818 -5.782 -2.388 1.00 0.00 O ATOM 1074 CB ASP A 149 131.696 -6.151 -5.664 1.00 0.00 C ATOM 1075 CG ASP A 149 132.415 -7.358 -5.092 1.00 0.00 C ATOM 1076 OD1 ASP A 149 131.963 -7.878 -4.049 1.00 0.00 O ATOM 1077 OD2 ASP A 149 133.428 -7.781 -5.685 1.00 0.00 O ATOM 0 H ASP A 149 133.050 -5.291 -3.312 1.00 0.00 H new ATOM 0 HA ASP A 149 130.946 -4.223 -5.085 1.00 0.00 H new ATOM 0 HB2 ASP A 149 130.756 -6.471 -6.113 1.00 0.00 H new ATOM 0 HB3 ASP A 149 132.299 -5.717 -6.462 1.00 0.00 H new ATOM 1082 N TYR A 150 129.229 -5.923 -3.974 1.00 0.00 N ATOM 1083 CA TYR A 150 128.212 -6.450 -3.067 1.00 0.00 C ATOM 1084 C TYR A 150 128.656 -7.771 -2.444 1.00 0.00 C ATOM 1085 O TYR A 150 128.218 -8.128 -1.351 1.00 0.00 O ATOM 1086 CB TYR A 150 126.891 -6.646 -3.811 1.00 0.00 C ATOM 1087 CG TYR A 150 125.699 -6.814 -2.895 1.00 0.00 C ATOM 1088 CD1 TYR A 150 125.433 -5.890 -1.892 1.00 0.00 C ATOM 1089 CD2 TYR A 150 124.842 -7.899 -3.032 1.00 0.00 C ATOM 1090 CE1 TYR A 150 124.347 -6.043 -1.053 1.00 0.00 C ATOM 1091 CE2 TYR A 150 123.753 -8.058 -2.197 1.00 0.00 C ATOM 1092 CZ TYR A 150 123.509 -7.127 -1.209 1.00 0.00 C ATOM 1093 OH TYR A 150 122.426 -7.282 -0.376 1.00 0.00 O ATOM 0 H TYR A 150 128.914 -5.805 -4.937 1.00 0.00 H new ATOM 0 HA TYR A 150 128.071 -5.725 -2.266 1.00 0.00 H new ATOM 0 HB2 TYR A 150 126.720 -5.789 -4.462 1.00 0.00 H new ATOM 0 HB3 TYR A 150 126.972 -7.523 -4.453 1.00 0.00 H new ATOM 0 HD1 TYR A 150 126.086 -5.039 -1.767 1.00 0.00 H new ATOM 0 HD2 TYR A 150 125.030 -8.630 -3.804 1.00 0.00 H new ATOM 0 HE1 TYR A 150 124.155 -5.316 -0.277 1.00 0.00 H new ATOM 0 HE2 TYR A 150 123.096 -8.907 -2.317 1.00 0.00 H new ATOM 0 HH TYR A 150 121.939 -8.096 -0.621 1.00 0.00 H new ATOM 1103 N ASP A 151 129.524 -8.495 -3.145 1.00 0.00 N ATOM 1104 CA ASP A 151 130.017 -9.778 -2.655 1.00 0.00 C ATOM 1105 C ASP A 151 130.914 -9.590 -1.436 1.00 0.00 C ATOM 1106 O ASP A 151 130.609 -10.077 -0.346 1.00 0.00 O ATOM 1107 CB ASP A 151 130.782 -10.509 -3.761 1.00 0.00 C ATOM 1108 CG ASP A 151 130.010 -11.693 -4.311 1.00 0.00 C ATOM 1109 OD1 ASP A 151 128.853 -11.501 -4.737 1.00 0.00 O ATOM 1110 OD2 ASP A 151 130.565 -12.813 -4.314 1.00 0.00 O ATOM 0 H ASP A 151 129.899 -8.216 -4.051 1.00 0.00 H new ATOM 0 HA ASP A 151 129.158 -10.379 -2.358 1.00 0.00 H new ATOM 0 HB2 ASP A 151 130.999 -9.812 -4.571 1.00 0.00 H new ATOM 0 HB3 ASP A 151 131.740 -10.853 -3.371 1.00 0.00 H new ATOM 1115 N GLU A 152 132.022 -8.883 -1.627 1.00 0.00 N ATOM 1116 CA GLU A 152 132.966 -8.635 -0.543 1.00 0.00 C ATOM 1117 C GLU A 152 132.422 -7.602 0.442 1.00 0.00 C ATOM 1118 O GLU A 152 132.887 -7.513 1.578 1.00 0.00 O ATOM 1119 CB GLU A 152 134.308 -8.165 -1.104 1.00 0.00 C ATOM 1120 CG GLU A 152 134.214 -6.874 -1.894 1.00 0.00 C ATOM 1121 CD GLU A 152 135.568 -6.374 -2.361 1.00 0.00 C ATOM 1122 OE1 GLU A 152 136.390 -5.997 -1.501 1.00 0.00 O ATOM 1123 OE2 GLU A 152 135.804 -6.361 -3.587 1.00 0.00 O ATOM 0 H GLU A 152 132.289 -8.472 -2.521 1.00 0.00 H new ATOM 0 HA GLU A 152 133.111 -9.573 -0.007 1.00 0.00 H new ATOM 0 HB2 GLU A 152 135.009 -8.028 -0.281 1.00 0.00 H new ATOM 0 HB3 GLU A 152 134.718 -8.945 -1.745 1.00 0.00 H new ATOM 0 HG2 GLU A 152 133.570 -7.029 -2.760 1.00 0.00 H new ATOM 0 HG3 GLU A 152 133.742 -6.109 -1.278 1.00 0.00 H new ATOM 1130 N PHE A 153 131.435 -6.825 0.005 1.00 0.00 N ATOM 1131 CA PHE A 153 130.833 -5.804 0.856 1.00 0.00 C ATOM 1132 C PHE A 153 130.050 -6.445 1.999 1.00 0.00 C ATOM 1133 O PHE A 153 130.126 -5.998 3.143 1.00 0.00 O ATOM 1134 CB PHE A 153 129.913 -4.898 0.031 1.00 0.00 C ATOM 1135 CG PHE A 153 129.115 -3.926 0.855 1.00 0.00 C ATOM 1136 CD1 PHE A 153 129.678 -3.304 1.960 1.00 0.00 C ATOM 1137 CD2 PHE A 153 127.801 -3.635 0.526 1.00 0.00 C ATOM 1138 CE1 PHE A 153 128.945 -2.413 2.719 1.00 0.00 C ATOM 1139 CE2 PHE A 153 127.064 -2.743 1.281 1.00 0.00 C ATOM 1140 CZ PHE A 153 127.636 -2.131 2.380 1.00 0.00 C ATOM 0 H PHE A 153 131.036 -6.883 -0.932 1.00 0.00 H new ATOM 0 HA PHE A 153 131.634 -5.200 1.282 1.00 0.00 H new ATOM 0 HB2 PHE A 153 130.516 -4.341 -0.686 1.00 0.00 H new ATOM 0 HB3 PHE A 153 129.227 -5.520 -0.544 1.00 0.00 H new ATOM 0 HD1 PHE A 153 130.701 -3.519 2.230 1.00 0.00 H new ATOM 0 HD2 PHE A 153 127.347 -4.111 -0.331 1.00 0.00 H new ATOM 0 HE1 PHE A 153 129.395 -1.937 3.577 1.00 0.00 H new ATOM 0 HE2 PHE A 153 126.041 -2.524 1.012 1.00 0.00 H new ATOM 0 HZ PHE A 153 127.061 -1.434 2.972 1.00 0.00 H new ATOM 1150 N LEU A 154 129.298 -7.494 1.678 1.00 0.00 N ATOM 1151 CA LEU A 154 128.498 -8.197 2.676 1.00 0.00 C ATOM 1152 C LEU A 154 129.364 -8.665 3.843 1.00 0.00 C ATOM 1153 O LEU A 154 128.890 -8.780 4.973 1.00 0.00 O ATOM 1154 CB LEU A 154 127.785 -9.392 2.037 1.00 0.00 C ATOM 1155 CG LEU A 154 126.301 -9.175 1.735 1.00 0.00 C ATOM 1156 CD1 LEU A 154 125.510 -9.036 3.024 1.00 0.00 C ATOM 1157 CD2 LEU A 154 126.112 -7.946 0.855 1.00 0.00 C ATOM 0 H LEU A 154 129.226 -7.876 0.735 1.00 0.00 H new ATOM 0 HA LEU A 154 127.752 -7.502 3.062 1.00 0.00 H new ATOM 0 HB2 LEU A 154 128.296 -9.646 1.108 1.00 0.00 H new ATOM 0 HB3 LEU A 154 127.883 -10.251 2.700 1.00 0.00 H new ATOM 0 HG LEU A 154 125.927 -10.045 1.196 1.00 0.00 H new ATOM 0 HD11 LEU A 154 124.457 -8.882 2.790 1.00 0.00 H new ATOM 0 HD12 LEU A 154 125.621 -9.943 3.619 1.00 0.00 H new ATOM 0 HD13 LEU A 154 125.884 -8.183 3.590 1.00 0.00 H new ATOM 0 HD21 LEU A 154 125.051 -7.805 0.649 1.00 0.00 H new ATOM 0 HD22 LEU A 154 126.501 -7.067 1.369 1.00 0.00 H new ATOM 0 HD23 LEU A 154 126.648 -8.085 -0.084 1.00 0.00 H new ATOM 1169 N GLU A 155 130.635 -8.933 3.562 1.00 0.00 N ATOM 1170 CA GLU A 155 131.566 -9.387 4.589 1.00 0.00 C ATOM 1171 C GLU A 155 132.180 -8.200 5.325 1.00 0.00 C ATOM 1172 O GLU A 155 132.467 -8.279 6.519 1.00 0.00 O ATOM 1173 CB GLU A 155 132.670 -10.243 3.965 1.00 0.00 C ATOM 1174 CG GLU A 155 132.292 -11.707 3.814 1.00 0.00 C ATOM 1175 CD GLU A 155 133.501 -12.620 3.772 1.00 0.00 C ATOM 1176 OE1 GLU A 155 134.588 -12.147 3.377 1.00 0.00 O ATOM 1177 OE2 GLU A 155 133.362 -13.808 4.131 1.00 0.00 O ATOM 0 H GLU A 155 131.044 -8.844 2.632 1.00 0.00 H new ATOM 0 HA GLU A 155 131.012 -9.991 5.307 1.00 0.00 H new ATOM 0 HB2 GLU A 155 132.922 -9.838 2.985 1.00 0.00 H new ATOM 0 HB3 GLU A 155 133.567 -10.169 4.580 1.00 0.00 H new ATOM 0 HG2 GLU A 155 131.649 -12.000 4.644 1.00 0.00 H new ATOM 0 HG3 GLU A 155 131.712 -11.836 2.900 1.00 0.00 H new ATOM 1184 N PHE A 156 132.378 -7.102 4.603 1.00 0.00 N ATOM 1185 CA PHE A 156 132.955 -5.897 5.185 1.00 0.00 C ATOM 1186 C PHE A 156 131.981 -5.243 6.159 1.00 0.00 C ATOM 1187 O PHE A 156 132.393 -4.591 7.118 1.00 0.00 O ATOM 1188 CB PHE A 156 133.338 -4.908 4.083 1.00 0.00 C ATOM 1189 CG PHE A 156 134.002 -3.662 4.594 1.00 0.00 C ATOM 1190 CD1 PHE A 156 134.949 -3.728 5.602 1.00 0.00 C ATOM 1191 CD2 PHE A 156 133.677 -2.423 4.064 1.00 0.00 C ATOM 1192 CE1 PHE A 156 135.562 -2.581 6.073 1.00 0.00 C ATOM 1193 CE2 PHE A 156 134.285 -1.273 4.531 1.00 0.00 C ATOM 1194 CZ PHE A 156 135.227 -1.353 5.537 1.00 0.00 C ATOM 0 H PHE A 156 132.147 -7.022 3.613 1.00 0.00 H new ATOM 0 HA PHE A 156 133.852 -6.181 5.735 1.00 0.00 H new ATOM 0 HB2 PHE A 156 134.007 -5.403 3.379 1.00 0.00 H new ATOM 0 HB3 PHE A 156 132.441 -4.630 3.529 1.00 0.00 H new ATOM 0 HD1 PHE A 156 135.212 -4.686 6.025 1.00 0.00 H new ATOM 0 HD2 PHE A 156 132.940 -2.356 3.277 1.00 0.00 H new ATOM 0 HE1 PHE A 156 136.301 -2.646 6.858 1.00 0.00 H new ATOM 0 HE2 PHE A 156 134.024 -0.314 4.110 1.00 0.00 H new ATOM 0 HZ PHE A 156 135.702 -0.455 5.905 1.00 0.00 H new ATOM 1204 N MET A 157 130.689 -5.426 5.911 1.00 0.00 N ATOM 1205 CA MET A 157 129.658 -4.855 6.769 1.00 0.00 C ATOM 1206 C MET A 157 129.226 -5.849 7.850 1.00 0.00 C ATOM 1207 O MET A 157 128.318 -5.568 8.631 1.00 0.00 O ATOM 1208 CB MET A 157 128.447 -4.431 5.936 1.00 0.00 C ATOM 1209 CG MET A 157 128.373 -2.932 5.693 1.00 0.00 C ATOM 1210 SD MET A 157 127.765 -2.025 7.127 1.00 0.00 S ATOM 1211 CE MET A 157 128.664 -0.486 6.959 1.00 0.00 C ATOM 0 H MET A 157 130.331 -5.965 5.123 1.00 0.00 H new ATOM 0 HA MET A 157 130.079 -3.977 7.259 1.00 0.00 H new ATOM 0 HB2 MET A 157 128.478 -4.946 4.976 1.00 0.00 H new ATOM 0 HB3 MET A 157 127.537 -4.755 6.441 1.00 0.00 H new ATOM 0 HG2 MET A 157 129.363 -2.562 5.427 1.00 0.00 H new ATOM 0 HG3 MET A 157 127.721 -2.738 4.842 1.00 0.00 H new ATOM 0 HE1 MET A 157 128.395 0.184 7.776 1.00 0.00 H new ATOM 0 HE2 MET A 157 129.735 -0.685 6.991 1.00 0.00 H new ATOM 0 HE3 MET A 157 128.410 -0.018 6.008 1.00 0.00 H new ATOM 1221 N LYS A 158 129.878 -7.010 7.888 1.00 0.00 N ATOM 1222 CA LYS A 158 129.554 -8.035 8.874 1.00 0.00 C ATOM 1223 C LYS A 158 130.406 -7.875 10.130 1.00 0.00 C ATOM 1224 O LYS A 158 130.946 -8.848 10.655 1.00 0.00 O ATOM 1225 CB LYS A 158 129.767 -9.427 8.273 1.00 0.00 C ATOM 1226 CG LYS A 158 129.331 -10.559 9.190 1.00 0.00 C ATOM 1227 CD LYS A 158 130.364 -11.673 9.234 1.00 0.00 C ATOM 1228 CE LYS A 158 129.929 -12.801 10.156 1.00 0.00 C ATOM 1229 NZ LYS A 158 130.994 -13.829 10.316 1.00 0.00 N ATOM 0 H LYS A 158 130.632 -7.262 7.248 1.00 0.00 H new ATOM 0 HA LYS A 158 128.507 -7.919 9.154 1.00 0.00 H new ATOM 0 HB2 LYS A 158 129.215 -9.497 7.335 1.00 0.00 H new ATOM 0 HB3 LYS A 158 130.823 -9.552 8.032 1.00 0.00 H new ATOM 0 HG2 LYS A 158 129.170 -10.172 10.196 1.00 0.00 H new ATOM 0 HG3 LYS A 158 128.377 -10.960 8.846 1.00 0.00 H new ATOM 0 HD2 LYS A 158 130.522 -12.064 8.229 1.00 0.00 H new ATOM 0 HD3 LYS A 158 131.319 -11.272 9.574 1.00 0.00 H new ATOM 0 HE2 LYS A 158 129.669 -12.392 11.132 1.00 0.00 H new ATOM 0 HE3 LYS A 158 129.029 -13.269 9.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 130.658 -14.581 10.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 131.224 -14.238 9.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 131.844 -13.388 10.720 1.00 0.00 H new ATOM 1243 N GLY A 159 130.521 -6.639 10.606 1.00 0.00 N ATOM 1244 CA GLY A 159 131.309 -6.374 11.796 1.00 0.00 C ATOM 1245 C GLY A 159 132.646 -5.742 11.473 1.00 0.00 C ATOM 1246 O GLY A 159 133.694 -6.372 11.628 1.00 0.00 O ATOM 0 H GLY A 159 130.083 -5.817 10.190 1.00 0.00 H new ATOM 0 HA2 GLY A 159 130.749 -5.715 12.460 1.00 0.00 H new ATOM 0 HA3 GLY A 159 131.472 -7.307 12.336 1.00 0.00 H new ATOM 1250 N VAL A 160 132.613 -4.495 11.018 1.00 0.00 N ATOM 1251 CA VAL A 160 133.832 -3.774 10.668 1.00 0.00 C ATOM 1252 C VAL A 160 134.734 -3.599 11.885 1.00 0.00 C ATOM 1253 O VAL A 160 135.958 -3.553 11.761 1.00 0.00 O ATOM 1254 CB VAL A 160 133.522 -2.385 10.071 1.00 0.00 C ATOM 1255 CG1 VAL A 160 134.750 -1.821 9.373 1.00 0.00 C ATOM 1256 CG2 VAL A 160 132.339 -2.458 9.112 1.00 0.00 C ATOM 0 H VAL A 160 131.754 -3.961 10.882 1.00 0.00 H new ATOM 0 HA VAL A 160 134.345 -4.374 9.917 1.00 0.00 H new ATOM 0 HB VAL A 160 133.252 -1.714 10.886 1.00 0.00 H new ATOM 0 HG11 VAL A 160 134.514 -0.841 8.958 1.00 0.00 H new ATOM 0 HG12 VAL A 160 135.564 -1.724 10.091 1.00 0.00 H new ATOM 0 HG13 VAL A 160 135.052 -2.493 8.570 1.00 0.00 H new ATOM 0 HG21 VAL A 160 132.140 -1.467 8.704 1.00 0.00 H new ATOM 0 HG22 VAL A 160 132.572 -3.145 8.299 1.00 0.00 H new ATOM 0 HG23 VAL A 160 131.459 -2.814 9.647 1.00 0.00 H new