USER MOD reduce.3.24.130724 H: found=0, std=0, add=508, rem=0, adj=12 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 Set 1.1: A 138 LYS NZ :NH3+ -136:sc= 0.0302 (180deg=-0.0191) USER MOD Set 1.2: A 144 ASN : amide:sc= 0.0627 X(o=0.093,f=-0.35) USER MOD Single : A 98 SER OG : rot 69:sc= 0.03 USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 142:sc= -0.379 (180deg=-1.23!) USER MOD Single : A 107 ASN : amide:sc= -2.66 K(o=-2.7,f=-11!) 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 -140:sc= -0.952 (180deg=-3.48!) USER MOD Single : A 122 GLN : amide:sc= -0.336 K(o=-0.34,f=-2.4!) USER MOD Single : A 124 THR OG1 : rot -78:sc= 1.26 USER MOD Single : A 127 THR OG1 : rot 8:sc= 1.15 USER MOD Single : A 129 THR OG1 : rot 180:sc= -0.101 USER MOD Single : A 137 MET CE :methyl -166:sc= -2.16 (180deg=-2.93!) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 TYR OH : rot 180:sc=-0.000848 USER MOD Single : A 157 MET CE :methyl -151:sc= -0.0277 (180deg=-0.568) USER MOD Single : A 158 LYS NZ :NH3+ 159:sc= -0.0213 (180deg=-0.185) USER MOD ----------------------------------------------------------------- ATOM 210 N GLU A 94 121.075 -5.583 7.438 1.00 0.00 N ATOM 211 CA GLU A 94 122.143 -6.040 6.557 1.00 0.00 C ATOM 212 C GLU A 94 121.638 -6.171 5.124 1.00 0.00 C ATOM 213 O GLU A 94 122.327 -5.801 4.174 1.00 0.00 O ATOM 214 CB GLU A 94 122.696 -7.383 7.040 1.00 0.00 C ATOM 215 CG GLU A 94 123.825 -7.247 8.049 1.00 0.00 C ATOM 216 CD GLU A 94 123.357 -6.676 9.373 1.00 0.00 C ATOM 217 OE1 GLU A 94 122.694 -7.411 10.136 1.00 0.00 O ATOM 218 OE2 GLU A 94 123.654 -5.494 9.648 1.00 0.00 O ATOM 0 HA GLU A 94 122.943 -5.300 6.580 1.00 0.00 H new ATOM 0 HB2 GLU A 94 121.887 -7.960 7.488 1.00 0.00 H new ATOM 0 HB3 GLU A 94 123.054 -7.950 6.180 1.00 0.00 H new ATOM 0 HG2 GLU A 94 124.276 -8.225 8.218 1.00 0.00 H new ATOM 0 HG3 GLU A 94 124.602 -6.605 7.635 1.00 0.00 H new ATOM 225 N GLU A 95 120.425 -6.694 4.981 1.00 0.00 N ATOM 226 CA GLU A 95 119.819 -6.866 3.666 1.00 0.00 C ATOM 227 C GLU A 95 119.601 -5.514 2.991 1.00 0.00 C ATOM 228 O GLU A 95 119.484 -5.430 1.769 1.00 0.00 O ATOM 229 CB GLU A 95 118.489 -7.613 3.789 1.00 0.00 C ATOM 230 CG GLU A 95 118.600 -9.104 3.514 1.00 0.00 C ATOM 231 CD GLU A 95 118.888 -9.407 2.055 1.00 0.00 C ATOM 232 OE1 GLU A 95 118.493 -8.596 1.191 1.00 0.00 O ATOM 233 OE2 GLU A 95 119.506 -10.456 1.779 1.00 0.00 O ATOM 0 H GLU A 95 119.843 -7.006 5.758 1.00 0.00 H new ATOM 0 HA GLU A 95 120.499 -7.454 3.050 1.00 0.00 H new ATOM 0 HB2 GLU A 95 118.091 -7.466 4.793 1.00 0.00 H new ATOM 0 HB3 GLU A 95 117.771 -7.176 3.094 1.00 0.00 H new ATOM 0 HG2 GLU A 95 119.392 -9.526 4.132 1.00 0.00 H new ATOM 0 HG3 GLU A 95 117.672 -9.594 3.807 1.00 0.00 H new ATOM 240 N GLU A 96 119.548 -4.457 3.798 1.00 0.00 N ATOM 241 CA GLU A 96 119.347 -3.107 3.286 1.00 0.00 C ATOM 242 C GLU A 96 120.635 -2.548 2.681 1.00 0.00 C ATOM 243 O GLU A 96 120.606 -1.587 1.913 1.00 0.00 O ATOM 244 CB GLU A 96 118.838 -2.194 4.409 1.00 0.00 C ATOM 245 CG GLU A 96 119.937 -1.558 5.250 1.00 0.00 C ATOM 246 CD GLU A 96 120.131 -0.086 4.940 1.00 0.00 C ATOM 247 OE1 GLU A 96 119.717 0.350 3.846 1.00 0.00 O ATOM 248 OE2 GLU A 96 120.694 0.632 5.794 1.00 0.00 O ATOM 0 H GLU A 96 119.642 -4.512 4.812 1.00 0.00 H new ATOM 0 HA GLU A 96 118.600 -3.147 2.494 1.00 0.00 H new ATOM 0 HB2 GLU A 96 118.230 -1.403 3.970 1.00 0.00 H new ATOM 0 HB3 GLU A 96 118.185 -2.772 5.063 1.00 0.00 H new ATOM 0 HG2 GLU A 96 119.694 -1.674 6.306 1.00 0.00 H new ATOM 0 HG3 GLU A 96 120.874 -2.088 5.078 1.00 0.00 H new ATOM 255 N LEU A 97 121.767 -3.153 3.041 1.00 0.00 N ATOM 256 CA LEU A 97 123.067 -2.715 2.542 1.00 0.00 C ATOM 257 C LEU A 97 123.109 -2.703 1.016 1.00 0.00 C ATOM 258 O LEU A 97 123.936 -2.015 0.418 1.00 0.00 O ATOM 259 CB LEU A 97 124.172 -3.622 3.085 1.00 0.00 C ATOM 260 CG LEU A 97 124.525 -3.403 4.557 1.00 0.00 C ATOM 261 CD1 LEU A 97 125.428 -4.519 5.061 1.00 0.00 C ATOM 262 CD2 LEU A 97 125.193 -2.050 4.749 1.00 0.00 C ATOM 0 H LEU A 97 121.808 -3.949 3.678 1.00 0.00 H new ATOM 0 HA LEU A 97 123.229 -1.695 2.891 1.00 0.00 H new ATOM 0 HB2 LEU A 97 123.868 -4.660 2.951 1.00 0.00 H new ATOM 0 HB3 LEU A 97 125.070 -3.473 2.486 1.00 0.00 H new ATOM 0 HG LEU A 97 123.603 -3.418 5.138 1.00 0.00 H new ATOM 0 HD11 LEU A 97 125.669 -4.346 6.110 1.00 0.00 H new ATOM 0 HD12 LEU A 97 124.916 -5.476 4.959 1.00 0.00 H new ATOM 0 HD13 LEU A 97 126.347 -4.535 4.476 1.00 0.00 H new ATOM 0 HD21 LEU A 97 125.437 -1.911 5.802 1.00 0.00 H new ATOM 0 HD22 LEU A 97 126.107 -2.008 4.156 1.00 0.00 H new ATOM 0 HD23 LEU A 97 124.514 -1.260 4.427 1.00 0.00 H new ATOM 274 N SER A 98 122.217 -3.464 0.388 1.00 0.00 N ATOM 275 CA SER A 98 122.166 -3.531 -1.069 1.00 0.00 C ATOM 276 C SER A 98 121.841 -2.165 -1.664 1.00 0.00 C ATOM 277 O SER A 98 122.469 -1.732 -2.630 1.00 0.00 O ATOM 278 CB SER A 98 121.123 -4.557 -1.516 1.00 0.00 C ATOM 279 OG SER A 98 121.381 -5.005 -2.835 1.00 0.00 O ATOM 0 H SER A 98 121.522 -4.041 0.863 1.00 0.00 H new ATOM 0 HA SER A 98 123.147 -3.840 -1.429 1.00 0.00 H new ATOM 0 HB2 SER A 98 121.128 -5.406 -0.833 1.00 0.00 H new ATOM 0 HB3 SER A 98 120.128 -4.114 -1.467 1.00 0.00 H new ATOM 0 HG SER A 98 122.200 -5.543 -2.843 1.00 0.00 H new ATOM 285 N ASP A 99 120.855 -1.490 -1.082 1.00 0.00 N ATOM 286 CA ASP A 99 120.445 -0.172 -1.552 1.00 0.00 C ATOM 287 C ASP A 99 121.577 0.840 -1.396 1.00 0.00 C ATOM 288 O ASP A 99 121.852 1.623 -2.304 1.00 0.00 O ATOM 289 CB ASP A 99 119.209 0.304 -0.786 1.00 0.00 C ATOM 290 CG ASP A 99 118.244 1.069 -1.669 1.00 0.00 C ATOM 291 OD1 ASP A 99 118.586 2.195 -2.087 1.00 0.00 O ATOM 292 OD2 ASP A 99 117.143 0.544 -1.941 1.00 0.00 O ATOM 0 H ASP A 99 120.324 -1.835 -0.282 1.00 0.00 H new ATOM 0 HA ASP A 99 120.199 -0.252 -2.611 1.00 0.00 H new ATOM 0 HB2 ASP A 99 118.698 -0.557 -0.354 1.00 0.00 H new ATOM 0 HB3 ASP A 99 119.521 0.939 0.043 1.00 0.00 H new ATOM 297 N LEU A 100 122.224 0.819 -0.236 1.00 0.00 N ATOM 298 CA LEU A 100 123.325 1.735 0.043 1.00 0.00 C ATOM 299 C LEU A 100 124.450 1.572 -0.975 1.00 0.00 C ATOM 300 O LEU A 100 125.214 2.506 -1.225 1.00 0.00 O ATOM 301 CB LEU A 100 123.864 1.503 1.455 1.00 0.00 C ATOM 302 CG LEU A 100 123.099 2.226 2.567 1.00 0.00 C ATOM 303 CD1 LEU A 100 122.371 1.228 3.456 1.00 0.00 C ATOM 304 CD2 LEU A 100 124.044 3.086 3.394 1.00 0.00 C ATOM 0 H LEU A 100 122.005 0.178 0.527 1.00 0.00 H new ATOM 0 HA LEU A 100 122.940 2.752 -0.032 1.00 0.00 H new ATOM 0 HB2 LEU A 100 123.850 0.433 1.662 1.00 0.00 H new ATOM 0 HB3 LEU A 100 124.906 1.820 1.486 1.00 0.00 H new ATOM 0 HG LEU A 100 122.357 2.876 2.103 1.00 0.00 H new ATOM 0 HD11 LEU A 100 121.834 1.763 4.239 1.00 0.00 H new ATOM 0 HD12 LEU A 100 121.663 0.656 2.857 1.00 0.00 H new ATOM 0 HD13 LEU A 100 123.094 0.550 3.910 1.00 0.00 H new ATOM 0 HD21 LEU A 100 123.482 3.592 4.179 1.00 0.00 H new ATOM 0 HD22 LEU A 100 124.810 2.455 3.845 1.00 0.00 H new ATOM 0 HD23 LEU A 100 124.518 3.828 2.751 1.00 0.00 H new ATOM 316 N PHE A 101 124.549 0.381 -1.561 1.00 0.00 N ATOM 317 CA PHE A 101 125.586 0.101 -2.549 1.00 0.00 C ATOM 318 C PHE A 101 125.502 1.072 -3.722 1.00 0.00 C ATOM 319 O PHE A 101 126.488 1.719 -4.076 1.00 0.00 O ATOM 320 CB PHE A 101 125.463 -1.338 -3.054 1.00 0.00 C ATOM 321 CG PHE A 101 126.610 -1.767 -3.924 1.00 0.00 C ATOM 322 CD1 PHE A 101 127.883 -1.907 -3.395 1.00 0.00 C ATOM 323 CD2 PHE A 101 126.416 -2.026 -5.272 1.00 0.00 C ATOM 324 CE1 PHE A 101 128.941 -2.300 -4.193 1.00 0.00 C ATOM 325 CE2 PHE A 101 127.471 -2.419 -6.075 1.00 0.00 C ATOM 326 CZ PHE A 101 128.735 -2.556 -5.534 1.00 0.00 C ATOM 0 H PHE A 101 123.925 -0.403 -1.369 1.00 0.00 H new ATOM 0 HA PHE A 101 126.555 0.229 -2.066 1.00 0.00 H new ATOM 0 HB2 PHE A 101 125.395 -2.010 -2.199 1.00 0.00 H new ATOM 0 HB3 PHE A 101 124.534 -1.440 -3.615 1.00 0.00 H new ATOM 0 HD1 PHE A 101 128.051 -1.707 -2.347 1.00 0.00 H new ATOM 0 HD2 PHE A 101 125.430 -1.920 -5.700 1.00 0.00 H new ATOM 0 HE1 PHE A 101 129.928 -2.407 -3.768 1.00 0.00 H new ATOM 0 HE2 PHE A 101 127.307 -2.619 -7.124 1.00 0.00 H new ATOM 0 HZ PHE A 101 129.561 -2.863 -6.159 1.00 0.00 H new ATOM 336 N ARG A 102 124.321 1.171 -4.323 1.00 0.00 N ATOM 337 CA ARG A 102 124.112 2.066 -5.457 1.00 0.00 C ATOM 338 C ARG A 102 124.469 3.503 -5.091 1.00 0.00 C ATOM 339 O ARG A 102 124.972 4.259 -5.923 1.00 0.00 O ATOM 340 CB ARG A 102 122.658 1.995 -5.929 1.00 0.00 C ATOM 341 CG ARG A 102 122.311 0.691 -6.631 1.00 0.00 C ATOM 342 CD ARG A 102 121.201 -0.057 -5.907 1.00 0.00 C ATOM 343 NE ARG A 102 119.877 0.407 -6.311 1.00 0.00 N ATOM 344 CZ ARG A 102 119.276 0.044 -7.441 1.00 0.00 C ATOM 345 NH1 ARG A 102 119.879 -0.784 -8.286 1.00 0.00 N ATOM 346 NH2 ARG A 102 118.070 0.511 -7.731 1.00 0.00 N ATOM 0 H ARG A 102 123.494 0.643 -4.044 1.00 0.00 H new ATOM 0 HA ARG A 102 124.767 1.743 -6.267 1.00 0.00 H new ATOM 0 HB2 ARG A 102 121.999 2.123 -5.070 1.00 0.00 H new ATOM 0 HB3 ARG A 102 122.463 2.826 -6.607 1.00 0.00 H new ATOM 0 HG2 ARG A 102 122.002 0.900 -7.655 1.00 0.00 H new ATOM 0 HG3 ARG A 102 123.198 0.060 -6.688 1.00 0.00 H new ATOM 0 HD2 ARG A 102 121.289 -1.124 -6.111 1.00 0.00 H new ATOM 0 HD3 ARG A 102 121.318 0.072 -4.831 1.00 0.00 H new ATOM 0 HE ARG A 102 119.383 1.048 -5.690 1.00 0.00 H new ATOM 0 HH11 ARG A 102 120.808 -1.145 -8.070 1.00 0.00 H new ATOM 0 HH12 ARG A 102 119.413 -1.059 -9.151 1.00 0.00 H new ATOM 0 HH21 ARG A 102 117.602 1.149 -7.088 1.00 0.00 H new ATOM 0 HH22 ARG A 102 117.610 0.232 -8.598 1.00 0.00 H new ATOM 360 N MET A 103 124.207 3.872 -3.842 1.00 0.00 N ATOM 361 CA MET A 103 124.503 5.218 -3.366 1.00 0.00 C ATOM 362 C MET A 103 125.998 5.506 -3.452 1.00 0.00 C ATOM 363 O MET A 103 126.413 6.529 -3.999 1.00 0.00 O ATOM 364 CB MET A 103 124.021 5.390 -1.925 1.00 0.00 C ATOM 365 CG MET A 103 122.589 5.889 -1.819 1.00 0.00 C ATOM 366 SD MET A 103 122.421 7.622 -2.289 1.00 0.00 S ATOM 367 CE MET A 103 120.898 8.054 -1.450 1.00 0.00 C ATOM 0 H MET A 103 123.791 3.259 -3.142 1.00 0.00 H new ATOM 0 HA MET A 103 123.976 5.927 -4.004 1.00 0.00 H new ATOM 0 HB2 MET A 103 124.104 4.435 -1.406 1.00 0.00 H new ATOM 0 HB3 MET A 103 124.680 6.090 -1.411 1.00 0.00 H new ATOM 0 HG2 MET A 103 121.948 5.280 -2.456 1.00 0.00 H new ATOM 0 HG3 MET A 103 122.238 5.758 -0.796 1.00 0.00 H new ATOM 0 HE1 MET A 103 120.659 9.100 -1.645 1.00 0.00 H new ATOM 0 HE2 MET A 103 120.089 7.423 -1.817 1.00 0.00 H new ATOM 0 HE3 MET A 103 121.018 7.903 -0.377 1.00 0.00 H new ATOM 377 N PHE A 104 126.802 4.598 -2.908 1.00 0.00 N ATOM 378 CA PHE A 104 128.252 4.754 -2.923 1.00 0.00 C ATOM 379 C PHE A 104 128.789 4.759 -4.351 1.00 0.00 C ATOM 380 O PHE A 104 129.852 5.319 -4.622 1.00 0.00 O ATOM 381 CB PHE A 104 128.915 3.634 -2.120 1.00 0.00 C ATOM 382 CG PHE A 104 129.005 3.920 -0.649 1.00 0.00 C ATOM 383 CD1 PHE A 104 130.068 4.647 -0.136 1.00 0.00 C ATOM 384 CD2 PHE A 104 128.027 3.465 0.221 1.00 0.00 C ATOM 385 CE1 PHE A 104 130.154 4.914 1.216 1.00 0.00 C ATOM 386 CE2 PHE A 104 128.109 3.729 1.575 1.00 0.00 C ATOM 387 CZ PHE A 104 129.173 4.454 2.073 1.00 0.00 C ATOM 0 H PHE A 104 126.474 3.747 -2.452 1.00 0.00 H new ATOM 0 HA PHE A 104 128.491 5.713 -2.463 1.00 0.00 H new ATOM 0 HB2 PHE A 104 128.354 2.711 -2.268 1.00 0.00 H new ATOM 0 HB3 PHE A 104 129.918 3.464 -2.510 1.00 0.00 H new ATOM 0 HD1 PHE A 104 130.838 5.009 -0.802 1.00 0.00 H new ATOM 0 HD2 PHE A 104 127.192 2.898 -0.163 1.00 0.00 H new ATOM 0 HE1 PHE A 104 130.987 5.482 1.603 1.00 0.00 H new ATOM 0 HE2 PHE A 104 127.341 3.368 2.243 1.00 0.00 H new ATOM 0 HZ PHE A 104 129.238 4.661 3.131 1.00 0.00 H new ATOM 397 N ASP A 105 128.049 4.133 -5.263 1.00 0.00 N ATOM 398 CA ASP A 105 128.456 4.069 -6.662 1.00 0.00 C ATOM 399 C ASP A 105 128.107 5.364 -7.391 1.00 0.00 C ATOM 400 O ASP A 105 127.153 6.052 -7.031 1.00 0.00 O ATOM 401 CB ASP A 105 127.780 2.883 -7.355 1.00 0.00 C ATOM 402 CG ASP A 105 128.731 2.124 -8.260 1.00 0.00 C ATOM 403 OD1 ASP A 105 129.091 2.663 -9.328 1.00 0.00 O ATOM 404 OD2 ASP A 105 129.114 0.991 -7.902 1.00 0.00 O ATOM 0 H ASP A 105 127.167 3.664 -5.058 1.00 0.00 H new ATOM 0 HA ASP A 105 129.537 3.935 -6.695 1.00 0.00 H new ATOM 0 HB2 ASP A 105 127.381 2.204 -6.601 1.00 0.00 H new ATOM 0 HB3 ASP A 105 126.934 3.242 -7.941 1.00 0.00 H new ATOM 409 N LYS A 106 128.890 5.689 -8.415 1.00 0.00 N ATOM 410 CA LYS A 106 128.663 6.901 -9.195 1.00 0.00 C ATOM 411 C LYS A 106 128.234 6.559 -10.619 1.00 0.00 C ATOM 412 O LYS A 106 127.300 7.154 -11.156 1.00 0.00 O ATOM 413 CB LYS A 106 129.930 7.760 -9.221 1.00 0.00 C ATOM 414 CG LYS A 106 129.877 8.948 -8.275 1.00 0.00 C ATOM 415 CD LYS A 106 129.208 10.148 -8.925 1.00 0.00 C ATOM 416 CE LYS A 106 127.691 10.054 -8.837 1.00 0.00 C ATOM 417 NZ LYS A 106 127.229 9.821 -7.441 1.00 0.00 N ATOM 0 H LYS A 106 129.686 5.131 -8.724 1.00 0.00 H new ATOM 0 HA LYS A 106 127.861 7.465 -8.720 1.00 0.00 H new ATOM 0 HB2 LYS A 106 130.787 7.138 -8.962 1.00 0.00 H new ATOM 0 HB3 LYS A 106 130.094 8.121 -10.236 1.00 0.00 H new ATOM 0 HG2 LYS A 106 129.333 8.671 -7.372 1.00 0.00 H new ATOM 0 HG3 LYS A 106 130.888 9.216 -7.968 1.00 0.00 H new ATOM 0 HD2 LYS A 106 129.546 11.063 -8.438 1.00 0.00 H new ATOM 0 HD3 LYS A 106 129.510 10.213 -9.970 1.00 0.00 H new ATOM 0 HE2 LYS A 106 127.248 10.974 -9.217 1.00 0.00 H new ATOM 0 HE3 LYS A 106 127.340 9.243 -9.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 126.356 10.360 -7.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 127.043 8.807 -7.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 127.965 10.133 -6.775 1.00 0.00 H new ATOM 431 N ASN A 107 128.921 5.595 -11.223 1.00 0.00 N ATOM 432 CA ASN A 107 128.610 5.173 -12.584 1.00 0.00 C ATOM 433 C ASN A 107 127.574 4.051 -12.591 1.00 0.00 C ATOM 434 O ASN A 107 126.927 3.799 -13.608 1.00 0.00 O ATOM 435 CB ASN A 107 129.882 4.711 -13.300 1.00 0.00 C ATOM 436 CG ASN A 107 130.615 3.629 -12.533 1.00 0.00 C ATOM 437 OD1 ASN A 107 130.098 3.081 -11.560 1.00 0.00 O ATOM 438 ND2 ASN A 107 131.831 3.315 -12.969 1.00 0.00 N ATOM 0 H ASN A 107 129.696 5.092 -10.792 1.00 0.00 H new ATOM 0 HA ASN A 107 128.191 6.029 -13.112 1.00 0.00 H new ATOM 0 HB2 ASN A 107 129.623 4.338 -14.291 1.00 0.00 H new ATOM 0 HB3 ASN A 107 130.545 5.564 -13.443 1.00 0.00 H new ATOM 0 HD21 ASN A 107 132.373 2.594 -12.493 1.00 0.00 H new ATOM 0 HD22 ASN A 107 132.222 3.795 -13.780 1.00 0.00 H new ATOM 445 N ALA A 108 127.421 3.378 -11.452 1.00 0.00 N ATOM 446 CA ALA A 108 126.462 2.283 -11.331 1.00 0.00 C ATOM 447 C ALA A 108 126.883 1.090 -12.182 1.00 0.00 C ATOM 448 O ALA A 108 126.050 0.446 -12.822 1.00 0.00 O ATOM 449 CB ALA A 108 125.068 2.752 -11.725 1.00 0.00 C ATOM 0 H ALA A 108 127.949 3.572 -10.601 1.00 0.00 H new ATOM 0 HA ALA A 108 126.442 1.964 -10.289 1.00 0.00 H new ATOM 0 HB1 ALA A 108 124.365 1.924 -11.629 1.00 0.00 H new ATOM 0 HB2 ALA A 108 124.760 3.567 -11.070 1.00 0.00 H new ATOM 0 HB3 ALA A 108 125.080 3.101 -12.758 1.00 0.00 H new ATOM 455 N ASP A 109 128.179 0.801 -12.186 1.00 0.00 N ATOM 456 CA ASP A 109 128.714 -0.316 -12.956 1.00 0.00 C ATOM 457 C ASP A 109 128.645 -1.620 -12.162 1.00 0.00 C ATOM 458 O ASP A 109 128.781 -2.706 -12.726 1.00 0.00 O ATOM 459 CB ASP A 109 130.159 -0.032 -13.366 1.00 0.00 C ATOM 460 CG ASP A 109 131.075 0.144 -12.170 1.00 0.00 C ATOM 461 OD1 ASP A 109 130.563 0.437 -11.069 1.00 0.00 O ATOM 462 OD2 ASP A 109 132.304 -0.011 -12.334 1.00 0.00 O ATOM 0 H ASP A 109 128.880 1.326 -11.663 1.00 0.00 H new ATOM 0 HA ASP A 109 128.102 -0.429 -13.851 1.00 0.00 H new ATOM 0 HB2 ASP A 109 130.526 -0.851 -13.984 1.00 0.00 H new ATOM 0 HB3 ASP A 109 130.190 0.869 -13.979 1.00 0.00 H new ATOM 467 N GLY A 110 128.436 -1.506 -10.854 1.00 0.00 N ATOM 468 CA GLY A 110 128.355 -2.687 -10.011 1.00 0.00 C ATOM 469 C GLY A 110 129.520 -2.801 -9.045 1.00 0.00 C ATOM 470 O GLY A 110 129.570 -3.725 -8.232 1.00 0.00 O ATOM 0 H GLY A 110 128.321 -0.619 -10.363 1.00 0.00 H new ATOM 0 HA2 GLY A 110 127.423 -2.662 -9.447 1.00 0.00 H new ATOM 0 HA3 GLY A 110 128.323 -3.576 -10.641 1.00 0.00 H new ATOM 474 N TYR A 111 130.459 -1.863 -9.129 1.00 0.00 N ATOM 475 CA TYR A 111 131.625 -1.869 -8.252 1.00 0.00 C ATOM 476 C TYR A 111 132.125 -0.450 -8.002 1.00 0.00 C ATOM 477 O TYR A 111 131.813 0.471 -8.758 1.00 0.00 O ATOM 478 CB TYR A 111 132.746 -2.713 -8.859 1.00 0.00 C ATOM 479 CG TYR A 111 132.286 -4.062 -9.365 1.00 0.00 C ATOM 480 CD1 TYR A 111 131.668 -4.186 -10.603 1.00 0.00 C ATOM 481 CD2 TYR A 111 132.468 -5.209 -8.604 1.00 0.00 C ATOM 482 CE1 TYR A 111 131.245 -5.418 -11.068 1.00 0.00 C ATOM 483 CE2 TYR A 111 132.049 -6.443 -9.062 1.00 0.00 C ATOM 484 CZ TYR A 111 131.437 -6.542 -10.293 1.00 0.00 C ATOM 485 OH TYR A 111 131.015 -7.768 -10.752 1.00 0.00 O ATOM 0 H TYR A 111 130.435 -1.090 -9.794 1.00 0.00 H new ATOM 0 HA TYR A 111 131.326 -2.306 -7.299 1.00 0.00 H new ATOM 0 HB2 TYR A 111 133.199 -2.161 -9.683 1.00 0.00 H new ATOM 0 HB3 TYR A 111 133.523 -2.862 -8.109 1.00 0.00 H new ATOM 0 HD1 TYR A 111 131.516 -3.307 -11.212 1.00 0.00 H new ATOM 0 HD2 TYR A 111 132.945 -5.135 -7.638 1.00 0.00 H new ATOM 0 HE1 TYR A 111 130.767 -5.499 -12.033 1.00 0.00 H new ATOM 0 HE2 TYR A 111 132.200 -7.326 -8.459 1.00 0.00 H new ATOM 0 HH TYR A 111 131.226 -8.456 -10.087 1.00 0.00 H new ATOM 495 N ILE A 112 132.903 -0.282 -6.939 1.00 0.00 N ATOM 496 CA ILE A 112 133.451 1.023 -6.591 1.00 0.00 C ATOM 497 C ILE A 112 134.964 0.943 -6.421 1.00 0.00 C ATOM 498 O ILE A 112 135.494 -0.068 -5.961 1.00 0.00 O ATOM 499 CB ILE A 112 132.819 1.576 -5.296 1.00 0.00 C ATOM 500 CG1 ILE A 112 131.305 1.361 -5.306 1.00 0.00 C ATOM 501 CG2 ILE A 112 133.145 3.053 -5.130 1.00 0.00 C ATOM 502 CD1 ILE A 112 130.650 1.603 -3.963 1.00 0.00 C ATOM 0 H ILE A 112 133.169 -1.034 -6.303 1.00 0.00 H new ATOM 0 HA ILE A 112 133.213 1.701 -7.410 1.00 0.00 H new ATOM 0 HB ILE A 112 133.240 1.034 -4.449 1.00 0.00 H new ATOM 0 HG12 ILE A 112 130.857 2.026 -6.045 1.00 0.00 H new ATOM 0 HG13 ILE A 112 131.093 0.341 -5.626 1.00 0.00 H new ATOM 0 HG21 ILE A 112 132.691 3.425 -4.212 1.00 0.00 H new ATOM 0 HG22 ILE A 112 134.226 3.184 -5.079 1.00 0.00 H new ATOM 0 HG23 ILE A 112 132.752 3.610 -5.980 1.00 0.00 H new ATOM 0 HD11 ILE A 112 129.577 1.432 -4.046 1.00 0.00 H new ATOM 0 HD12 ILE A 112 131.071 0.920 -3.225 1.00 0.00 H new ATOM 0 HD13 ILE A 112 130.830 2.631 -3.650 1.00 0.00 H new ATOM 514 N ASP A 113 135.654 2.017 -6.795 1.00 0.00 N ATOM 515 CA ASP A 113 137.107 2.069 -6.685 1.00 0.00 C ATOM 516 C ASP A 113 137.558 3.365 -6.019 1.00 0.00 C ATOM 517 O ASP A 113 136.734 4.185 -5.611 1.00 0.00 O ATOM 518 CB ASP A 113 137.751 1.942 -8.067 1.00 0.00 C ATOM 519 CG ASP A 113 137.555 0.568 -8.678 1.00 0.00 C ATOM 520 OD1 ASP A 113 136.466 -0.014 -8.491 1.00 0.00 O ATOM 521 OD2 ASP A 113 138.490 0.076 -9.343 1.00 0.00 O ATOM 0 H ASP A 113 135.230 2.862 -7.177 1.00 0.00 H new ATOM 0 HA ASP A 113 137.427 1.232 -6.064 1.00 0.00 H new ATOM 0 HB2 ASP A 113 137.327 2.695 -8.732 1.00 0.00 H new ATOM 0 HB3 ASP A 113 138.818 2.151 -7.987 1.00 0.00 H new ATOM 526 N LEU A 114 138.872 3.542 -5.913 1.00 0.00 N ATOM 527 CA LEU A 114 139.439 4.737 -5.295 1.00 0.00 C ATOM 528 C LEU A 114 138.876 6.005 -5.930 1.00 0.00 C ATOM 529 O LEU A 114 138.691 7.018 -5.256 1.00 0.00 O ATOM 530 CB LEU A 114 140.963 4.725 -5.425 1.00 0.00 C ATOM 531 CG LEU A 114 141.706 4.024 -4.285 1.00 0.00 C ATOM 532 CD1 LEU A 114 141.315 4.625 -2.944 1.00 0.00 C ATOM 533 CD2 LEU A 114 141.421 2.529 -4.305 1.00 0.00 C ATOM 0 H LEU A 114 139.565 2.872 -6.247 1.00 0.00 H new ATOM 0 HA LEU A 114 139.166 4.732 -4.240 1.00 0.00 H new ATOM 0 HB2 LEU A 114 141.228 4.239 -6.364 1.00 0.00 H new ATOM 0 HB3 LEU A 114 141.315 5.755 -5.488 1.00 0.00 H new ATOM 0 HG LEU A 114 142.776 4.173 -4.428 1.00 0.00 H new ATOM 0 HD11 LEU A 114 141.853 4.114 -2.146 1.00 0.00 H new ATOM 0 HD12 LEU A 114 141.569 5.685 -2.932 1.00 0.00 H new ATOM 0 HD13 LEU A 114 140.242 4.507 -2.792 1.00 0.00 H new ATOM 0 HD21 LEU A 114 141.957 2.046 -3.488 1.00 0.00 H new ATOM 0 HD22 LEU A 114 140.351 2.361 -4.186 1.00 0.00 H new ATOM 0 HD23 LEU A 114 141.751 2.108 -5.255 1.00 0.00 H new ATOM 545 N GLU A 115 138.607 5.942 -7.230 1.00 0.00 N ATOM 546 CA GLU A 115 138.066 7.086 -7.954 1.00 0.00 C ATOM 547 C GLU A 115 136.630 7.373 -7.525 1.00 0.00 C ATOM 548 O GLU A 115 136.308 8.481 -7.099 1.00 0.00 O ATOM 549 CB GLU A 115 138.125 6.835 -9.462 1.00 0.00 C ATOM 550 CG GLU A 115 138.745 7.979 -10.246 1.00 0.00 C ATOM 551 CD GLU A 115 140.224 7.769 -10.508 1.00 0.00 C ATOM 552 OE1 GLU A 115 140.903 7.174 -9.644 1.00 0.00 O ATOM 553 OE2 GLU A 115 140.704 8.201 -11.577 1.00 0.00 O ATOM 0 H GLU A 115 138.755 5.111 -7.803 1.00 0.00 H new ATOM 0 HA GLU A 115 138.675 7.958 -7.716 1.00 0.00 H new ATOM 0 HB2 GLU A 115 138.697 5.926 -9.648 1.00 0.00 H new ATOM 0 HB3 GLU A 115 137.115 6.658 -9.832 1.00 0.00 H new ATOM 0 HG2 GLU A 115 138.223 8.089 -11.197 1.00 0.00 H new ATOM 0 HG3 GLU A 115 138.605 8.910 -9.696 1.00 0.00 H new ATOM 560 N GLU A 116 135.771 6.365 -7.642 1.00 0.00 N ATOM 561 CA GLU A 116 134.367 6.510 -7.268 1.00 0.00 C ATOM 562 C GLU A 116 134.228 6.799 -5.776 1.00 0.00 C ATOM 563 O GLU A 116 133.474 7.685 -5.374 1.00 0.00 O ATOM 564 CB GLU A 116 133.590 5.243 -7.633 1.00 0.00 C ATOM 565 CG GLU A 116 132.643 5.427 -8.809 1.00 0.00 C ATOM 566 CD GLU A 116 132.794 4.342 -9.857 1.00 0.00 C ATOM 567 OE1 GLU A 116 132.699 3.151 -9.496 1.00 0.00 O ATOM 568 OE2 GLU A 116 133.010 4.683 -11.039 1.00 0.00 O ATOM 0 H GLU A 116 136.021 5.440 -7.992 1.00 0.00 H new ATOM 0 HA GLU A 116 133.952 7.353 -7.820 1.00 0.00 H new ATOM 0 HB2 GLU A 116 134.298 4.448 -7.868 1.00 0.00 H new ATOM 0 HB3 GLU A 116 133.018 4.915 -6.765 1.00 0.00 H new ATOM 0 HG2 GLU A 116 131.616 5.434 -8.445 1.00 0.00 H new ATOM 0 HG3 GLU A 116 132.825 6.398 -9.269 1.00 0.00 H new ATOM 575 N LEU A 117 134.957 6.045 -4.960 1.00 0.00 N ATOM 576 CA LEU A 117 134.913 6.219 -3.511 1.00 0.00 C ATOM 577 C LEU A 117 135.233 7.659 -3.119 1.00 0.00 C ATOM 578 O LEU A 117 134.619 8.217 -2.210 1.00 0.00 O ATOM 579 CB LEU A 117 135.892 5.262 -2.828 1.00 0.00 C ATOM 580 CG LEU A 117 135.661 5.059 -1.329 1.00 0.00 C ATOM 581 CD1 LEU A 117 134.346 4.334 -1.086 1.00 0.00 C ATOM 582 CD2 LEU A 117 136.818 4.292 -0.710 1.00 0.00 C ATOM 0 H LEU A 117 135.586 5.307 -5.277 1.00 0.00 H new ATOM 0 HA LEU A 117 133.901 5.990 -3.178 1.00 0.00 H new ATOM 0 HB2 LEU A 117 135.834 4.293 -3.323 1.00 0.00 H new ATOM 0 HB3 LEU A 117 136.905 5.636 -2.977 1.00 0.00 H new ATOM 0 HG LEU A 117 135.606 6.038 -0.853 1.00 0.00 H new ATOM 0 HD11 LEU A 117 134.198 4.198 -0.015 1.00 0.00 H new ATOM 0 HD12 LEU A 117 133.525 4.923 -1.494 1.00 0.00 H new ATOM 0 HD13 LEU A 117 134.372 3.360 -1.575 1.00 0.00 H new ATOM 0 HD21 LEU A 117 136.636 4.157 0.356 1.00 0.00 H new ATOM 0 HD22 LEU A 117 136.906 3.317 -1.189 1.00 0.00 H new ATOM 0 HD23 LEU A 117 137.743 4.851 -0.852 1.00 0.00 H new ATOM 594 N LYS A 118 136.197 8.256 -3.813 1.00 0.00 N ATOM 595 CA LYS A 118 136.595 9.631 -3.537 1.00 0.00 C ATOM 596 C LYS A 118 135.423 10.589 -3.733 1.00 0.00 C ATOM 597 O LYS A 118 135.368 11.652 -3.116 1.00 0.00 O ATOM 598 CB LYS A 118 137.760 10.041 -4.441 1.00 0.00 C ATOM 599 CG LYS A 118 138.781 10.932 -3.753 1.00 0.00 C ATOM 600 CD LYS A 118 139.358 11.962 -4.709 1.00 0.00 C ATOM 601 CE LYS A 118 140.302 12.919 -3.997 1.00 0.00 C ATOM 602 NZ LYS A 118 141.730 12.569 -4.237 1.00 0.00 N ATOM 0 H LYS A 118 136.716 7.810 -4.569 1.00 0.00 H new ATOM 0 HA LYS A 118 136.915 9.686 -2.497 1.00 0.00 H new ATOM 0 HB2 LYS A 118 138.260 9.143 -4.804 1.00 0.00 H new ATOM 0 HB3 LYS A 118 137.366 10.562 -5.314 1.00 0.00 H new ATOM 0 HG2 LYS A 118 138.312 11.440 -2.910 1.00 0.00 H new ATOM 0 HG3 LYS A 118 139.586 10.319 -3.349 1.00 0.00 H new ATOM 0 HD2 LYS A 118 139.891 11.455 -5.513 1.00 0.00 H new ATOM 0 HD3 LYS A 118 138.547 12.526 -5.170 1.00 0.00 H new ATOM 0 HE2 LYS A 118 140.115 13.937 -4.340 1.00 0.00 H new ATOM 0 HE3 LYS A 118 140.098 12.901 -2.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 142.342 13.244 -3.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 141.915 11.607 -3.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 141.931 12.611 -5.257 1.00 0.00 H new ATOM 616 N ILE A 119 134.486 10.204 -4.596 1.00 0.00 N ATOM 617 CA ILE A 119 133.316 11.028 -4.870 1.00 0.00 C ATOM 618 C ILE A 119 132.419 11.130 -3.640 1.00 0.00 C ATOM 619 O ILE A 119 131.848 12.184 -3.360 1.00 0.00 O ATOM 620 CB ILE A 119 132.493 10.467 -6.047 1.00 0.00 C ATOM 621 CG1 ILE A 119 133.395 10.205 -7.255 1.00 0.00 C ATOM 622 CG2 ILE A 119 131.373 11.428 -6.416 1.00 0.00 C ATOM 623 CD1 ILE A 119 134.013 11.460 -7.834 1.00 0.00 C ATOM 0 H ILE A 119 134.516 9.327 -5.116 1.00 0.00 H new ATOM 0 HA ILE A 119 133.682 12.020 -5.135 1.00 0.00 H new ATOM 0 HB ILE A 119 132.049 9.521 -5.739 1.00 0.00 H new ATOM 0 HG12 ILE A 119 134.191 9.520 -6.962 1.00 0.00 H new ATOM 0 HG13 ILE A 119 132.814 9.705 -8.030 1.00 0.00 H new ATOM 0 HG21 ILE A 119 130.801 11.018 -7.248 1.00 0.00 H new ATOM 0 HG22 ILE A 119 130.716 11.567 -5.558 1.00 0.00 H new ATOM 0 HG23 ILE A 119 131.799 12.388 -6.707 1.00 0.00 H new ATOM 0 HD11 ILE A 119 134.639 11.197 -8.687 1.00 0.00 H new ATOM 0 HD12 ILE A 119 133.224 12.138 -8.159 1.00 0.00 H new ATOM 0 HD13 ILE A 119 134.622 11.950 -7.074 1.00 0.00 H new ATOM 635 N MET A 120 132.300 10.026 -2.909 1.00 0.00 N ATOM 636 CA MET A 120 131.471 9.990 -1.709 1.00 0.00 C ATOM 637 C MET A 120 132.094 10.819 -0.591 1.00 0.00 C ATOM 638 O MET A 120 131.396 11.535 0.127 1.00 0.00 O ATOM 639 CB MET A 120 131.278 8.547 -1.239 1.00 0.00 C ATOM 640 CG MET A 120 130.066 8.355 -0.343 1.00 0.00 C ATOM 641 SD MET A 120 130.323 8.998 1.322 1.00 0.00 S ATOM 642 CE MET A 120 131.782 8.084 1.816 1.00 0.00 C ATOM 0 H MET A 120 132.767 9.145 -3.126 1.00 0.00 H new ATOM 0 HA MET A 120 130.500 10.418 -1.958 1.00 0.00 H new ATOM 0 HB2 MET A 120 131.181 7.900 -2.111 1.00 0.00 H new ATOM 0 HB3 MET A 120 132.171 8.226 -0.702 1.00 0.00 H new ATOM 0 HG2 MET A 120 129.206 8.852 -0.791 1.00 0.00 H new ATOM 0 HG3 MET A 120 129.827 7.293 -0.285 1.00 0.00 H new ATOM 0 HE1 MET A 120 131.686 7.782 2.859 1.00 0.00 H new ATOM 0 HE2 MET A 120 131.886 7.198 1.190 1.00 0.00 H new ATOM 0 HE3 MET A 120 132.663 8.715 1.701 1.00 0.00 H new ATOM 652 N LEU A 121 133.411 10.717 -0.447 1.00 0.00 N ATOM 653 CA LEU A 121 134.126 11.457 0.585 1.00 0.00 C ATOM 654 C LEU A 121 134.143 12.950 0.274 1.00 0.00 C ATOM 655 O LEU A 121 134.149 13.782 1.182 1.00 0.00 O ATOM 656 CB LEU A 121 135.558 10.934 0.721 1.00 0.00 C ATOM 657 CG LEU A 121 135.703 9.649 1.542 1.00 0.00 C ATOM 658 CD1 LEU A 121 136.196 8.507 0.667 1.00 0.00 C ATOM 659 CD2 LEU A 121 136.643 9.867 2.717 1.00 0.00 C ATOM 0 H LEU A 121 134.004 10.129 -1.032 1.00 0.00 H new ATOM 0 HA LEU A 121 133.603 11.308 1.530 1.00 0.00 H new ATOM 0 HB2 LEU A 121 135.960 10.757 -0.276 1.00 0.00 H new ATOM 0 HB3 LEU A 121 136.170 11.711 1.179 1.00 0.00 H new ATOM 0 HG LEU A 121 134.722 9.381 1.934 1.00 0.00 H new ATOM 0 HD11 LEU A 121 136.293 7.603 1.269 1.00 0.00 H new ATOM 0 HD12 LEU A 121 135.483 8.332 -0.139 1.00 0.00 H new ATOM 0 HD13 LEU A 121 137.166 8.766 0.243 1.00 0.00 H new ATOM 0 HD21 LEU A 121 136.733 8.943 3.288 1.00 0.00 H new ATOM 0 HD22 LEU A 121 137.625 10.162 2.347 1.00 0.00 H new ATOM 0 HD23 LEU A 121 136.246 10.653 3.360 1.00 0.00 H new ATOM 671 N GLN A 122 134.147 13.284 -1.011 1.00 0.00 N ATOM 672 CA GLN A 122 134.158 14.678 -1.436 1.00 0.00 C ATOM 673 C GLN A 122 132.869 15.379 -1.019 1.00 0.00 C ATOM 674 O GLN A 122 132.848 16.594 -0.817 1.00 0.00 O ATOM 675 CB GLN A 122 134.338 14.772 -2.951 1.00 0.00 C ATOM 676 CG GLN A 122 135.758 14.494 -3.413 1.00 0.00 C ATOM 677 CD GLN A 122 136.474 15.744 -3.889 1.00 0.00 C ATOM 678 OE1 GLN A 122 135.982 16.858 -3.713 1.00 0.00 O ATOM 679 NE2 GLN A 122 137.641 15.563 -4.496 1.00 0.00 N ATOM 0 H GLN A 122 134.143 12.609 -1.776 1.00 0.00 H new ATOM 0 HA GLN A 122 134.997 15.175 -0.949 1.00 0.00 H new ATOM 0 HB2 GLN A 122 133.663 14.065 -3.433 1.00 0.00 H new ATOM 0 HB3 GLN A 122 134.046 15.768 -3.282 1.00 0.00 H new ATOM 0 HG2 GLN A 122 136.321 14.047 -2.594 1.00 0.00 H new ATOM 0 HG3 GLN A 122 135.736 13.763 -4.221 1.00 0.00 H new ATOM 0 HE21 GLN A 122 138.011 14.620 -4.620 1.00 0.00 H new ATOM 0 HE22 GLN A 122 138.168 16.367 -4.838 1.00 0.00 H new ATOM 688 N ALA A 123 131.794 14.605 -0.890 1.00 0.00 N ATOM 689 CA ALA A 123 130.502 15.151 -0.494 1.00 0.00 C ATOM 690 C ALA A 123 130.601 15.875 0.842 1.00 0.00 C ATOM 691 O ALA A 123 130.059 16.967 1.010 1.00 0.00 O ATOM 692 CB ALA A 123 129.462 14.042 -0.421 1.00 0.00 C ATOM 0 H ALA A 123 131.794 13.598 -1.054 1.00 0.00 H new ATOM 0 HA ALA A 123 130.193 15.875 -1.248 1.00 0.00 H new ATOM 0 HB1 ALA A 123 128.501 14.463 -0.124 1.00 0.00 H new ATOM 0 HB2 ALA A 123 129.365 13.570 -1.398 1.00 0.00 H new ATOM 0 HB3 ALA A 123 129.774 13.298 0.312 1.00 0.00 H new ATOM 698 N THR A 124 131.300 15.261 1.794 1.00 0.00 N ATOM 699 CA THR A 124 131.471 15.854 3.114 1.00 0.00 C ATOM 700 C THR A 124 132.204 17.187 3.013 1.00 0.00 C ATOM 701 O THR A 124 132.655 17.577 1.936 1.00 0.00 O ATOM 702 CB THR A 124 132.244 14.900 4.028 1.00 0.00 C ATOM 703 OG1 THR A 124 133.567 14.716 3.556 1.00 0.00 O ATOM 704 CG2 THR A 124 131.605 13.534 4.146 1.00 0.00 C ATOM 0 H THR A 124 131.755 14.356 1.675 1.00 0.00 H new ATOM 0 HA THR A 124 130.484 16.031 3.540 1.00 0.00 H new ATOM 0 HB THR A 124 132.237 15.372 5.010 1.00 0.00 H new ATOM 0 HG1 THR A 124 133.561 14.094 2.799 1.00 0.00 H new ATOM 0 HG21 THR A 124 132.204 12.908 4.808 1.00 0.00 H new ATOM 0 HG22 THR A 124 130.600 13.637 4.555 1.00 0.00 H new ATOM 0 HG23 THR A 124 131.551 13.071 3.161 1.00 0.00 H new ATOM 712 N GLY A 125 132.324 17.884 4.139 1.00 0.00 N ATOM 713 CA GLY A 125 133.007 19.165 4.147 1.00 0.00 C ATOM 714 C GLY A 125 134.285 19.135 4.961 1.00 0.00 C ATOM 715 O GLY A 125 134.717 20.160 5.489 1.00 0.00 O ATOM 0 H GLY A 125 131.961 17.585 5.044 1.00 0.00 H new ATOM 0 HA2 GLY A 125 133.239 19.456 3.123 1.00 0.00 H new ATOM 0 HA3 GLY A 125 132.340 19.926 4.551 1.00 0.00 H new ATOM 719 N GLU A 126 134.892 17.956 5.065 1.00 0.00 N ATOM 720 CA GLU A 126 136.129 17.797 5.823 1.00 0.00 C ATOM 721 C GLU A 126 137.338 17.798 4.894 1.00 0.00 C ATOM 722 O GLU A 126 137.225 18.120 3.712 1.00 0.00 O ATOM 723 CB GLU A 126 136.091 16.498 6.630 1.00 0.00 C ATOM 724 CG GLU A 126 134.789 16.290 7.388 1.00 0.00 C ATOM 725 CD GLU A 126 135.011 16.001 8.860 1.00 0.00 C ATOM 726 OE1 GLU A 126 135.881 15.163 9.177 1.00 0.00 O ATOM 727 OE2 GLU A 126 134.314 16.613 9.697 1.00 0.00 O ATOM 0 H GLU A 126 134.548 17.098 4.634 1.00 0.00 H new ATOM 0 HA GLU A 126 136.220 18.640 6.508 1.00 0.00 H new ATOM 0 HB2 GLU A 126 136.247 15.656 5.955 1.00 0.00 H new ATOM 0 HB3 GLU A 126 136.919 16.496 7.339 1.00 0.00 H new ATOM 0 HG2 GLU A 126 134.167 17.180 7.286 1.00 0.00 H new ATOM 0 HG3 GLU A 126 134.239 15.463 6.938 1.00 0.00 H new ATOM 734 N THR A 127 138.495 17.435 5.438 1.00 0.00 N ATOM 735 CA THR A 127 139.727 17.392 4.659 1.00 0.00 C ATOM 736 C THR A 127 140.307 15.982 4.637 1.00 0.00 C ATOM 737 O THR A 127 140.809 15.492 5.649 1.00 0.00 O ATOM 738 CB THR A 127 140.754 18.369 5.237 1.00 0.00 C ATOM 739 OG1 THR A 127 141.307 17.859 6.438 1.00 0.00 O ATOM 740 CG2 THR A 127 140.176 19.733 5.541 1.00 0.00 C ATOM 0 H THR A 127 138.605 17.166 6.416 1.00 0.00 H new ATOM 0 HA THR A 127 139.492 17.685 3.636 1.00 0.00 H new ATOM 0 HB THR A 127 141.516 18.480 4.466 1.00 0.00 H new ATOM 0 HG1 THR A 127 141.006 16.936 6.571 1.00 0.00 H new ATOM 0 HG21 THR A 127 140.956 20.376 5.948 1.00 0.00 H new ATOM 0 HG22 THR A 127 139.783 20.174 4.625 1.00 0.00 H new ATOM 0 HG23 THR A 127 139.372 19.633 6.270 1.00 0.00 H new ATOM 748 N ILE A 128 140.236 15.334 3.479 1.00 0.00 N ATOM 749 CA ILE A 128 140.756 13.981 3.329 1.00 0.00 C ATOM 750 C ILE A 128 141.972 13.957 2.412 1.00 0.00 C ATOM 751 O ILE A 128 142.024 14.678 1.414 1.00 0.00 O ATOM 752 CB ILE A 128 139.685 13.025 2.767 1.00 0.00 C ATOM 753 CG1 ILE A 128 138.374 13.181 3.538 1.00 0.00 C ATOM 754 CG2 ILE A 128 140.176 11.586 2.827 1.00 0.00 C ATOM 755 CD1 ILE A 128 137.388 14.116 2.873 1.00 0.00 C ATOM 0 H ILE A 128 139.824 15.724 2.632 1.00 0.00 H new ATOM 0 HA ILE A 128 141.048 13.644 4.324 1.00 0.00 H new ATOM 0 HB ILE A 128 139.501 13.282 1.724 1.00 0.00 H new ATOM 0 HG12 ILE A 128 137.911 12.201 3.654 1.00 0.00 H new ATOM 0 HG13 ILE A 128 138.593 13.550 4.540 1.00 0.00 H new ATOM 0 HG21 ILE A 128 139.409 10.923 2.427 1.00 0.00 H new ATOM 0 HG22 ILE A 128 141.086 11.487 2.235 1.00 0.00 H new ATOM 0 HG23 ILE A 128 140.385 11.316 3.862 1.00 0.00 H new ATOM 0 HD11 ILE A 128 136.482 14.178 3.476 1.00 0.00 H new ATOM 0 HD12 ILE A 128 137.832 15.107 2.782 1.00 0.00 H new ATOM 0 HD13 ILE A 128 137.139 13.737 1.882 1.00 0.00 H new ATOM 767 N THR A 129 142.951 13.126 2.755 1.00 0.00 N ATOM 768 CA THR A 129 144.168 13.010 1.962 1.00 0.00 C ATOM 769 C THR A 129 144.090 11.814 1.017 1.00 0.00 C ATOM 770 O THR A 129 143.272 10.915 1.205 1.00 0.00 O ATOM 771 CB THR A 129 145.387 12.874 2.875 1.00 0.00 C ATOM 772 OG1 THR A 129 145.145 11.924 3.897 1.00 0.00 O ATOM 773 CG2 THR A 129 145.783 14.174 3.543 1.00 0.00 C ATOM 0 H THR A 129 142.925 12.523 3.577 1.00 0.00 H new ATOM 0 HA THR A 129 144.270 13.916 1.365 1.00 0.00 H new ATOM 0 HB THR A 129 146.201 12.555 2.224 1.00 0.00 H new ATOM 0 HG1 THR A 129 145.937 11.850 4.469 1.00 0.00 H new ATOM 0 HG21 THR A 129 146.654 14.007 4.176 1.00 0.00 H new ATOM 0 HG22 THR A 129 146.025 14.915 2.781 1.00 0.00 H new ATOM 0 HG23 THR A 129 144.955 14.537 4.153 1.00 0.00 H new ATOM 781 N GLU A 130 144.947 11.812 0.001 1.00 0.00 N ATOM 782 CA GLU A 130 144.975 10.728 -0.974 1.00 0.00 C ATOM 783 C GLU A 130 145.270 9.393 -0.297 1.00 0.00 C ATOM 784 O GLU A 130 144.767 8.351 -0.714 1.00 0.00 O ATOM 785 CB GLU A 130 146.024 11.010 -2.051 1.00 0.00 C ATOM 786 CG GLU A 130 145.613 10.542 -3.438 1.00 0.00 C ATOM 787 CD GLU A 130 146.638 10.892 -4.498 1.00 0.00 C ATOM 788 OE1 GLU A 130 147.409 11.852 -4.285 1.00 0.00 O ATOM 789 OE2 GLU A 130 146.671 10.206 -5.542 1.00 0.00 O ATOM 0 H GLU A 130 145.631 12.549 -0.168 1.00 0.00 H new ATOM 0 HA GLU A 130 143.992 10.668 -1.441 1.00 0.00 H new ATOM 0 HB2 GLU A 130 146.222 12.081 -2.082 1.00 0.00 H new ATOM 0 HB3 GLU A 130 146.958 10.521 -1.774 1.00 0.00 H new ATOM 0 HG2 GLU A 130 145.464 9.462 -3.424 1.00 0.00 H new ATOM 0 HG3 GLU A 130 144.656 10.992 -3.701 1.00 0.00 H new ATOM 796 N ASP A 131 146.089 9.435 0.749 1.00 0.00 N ATOM 797 CA ASP A 131 146.452 8.227 1.483 1.00 0.00 C ATOM 798 C ASP A 131 145.283 7.735 2.330 1.00 0.00 C ATOM 799 O ASP A 131 145.134 6.535 2.560 1.00 0.00 O ATOM 800 CB ASP A 131 147.667 8.494 2.374 1.00 0.00 C ATOM 801 CG ASP A 131 148.606 7.307 2.441 1.00 0.00 C ATOM 802 OD1 ASP A 131 148.822 6.660 1.393 1.00 0.00 O ATOM 803 OD2 ASP A 131 149.127 7.022 3.540 1.00 0.00 O ATOM 0 H ASP A 131 146.513 10.291 1.107 1.00 0.00 H new ATOM 0 HA ASP A 131 146.704 7.452 0.759 1.00 0.00 H new ATOM 0 HB2 ASP A 131 148.208 9.361 1.995 1.00 0.00 H new ATOM 0 HB3 ASP A 131 147.329 8.744 3.380 1.00 0.00 H new ATOM 808 N ASP A 132 144.458 8.668 2.793 1.00 0.00 N ATOM 809 CA ASP A 132 143.303 8.328 3.615 1.00 0.00 C ATOM 810 C ASP A 132 142.287 7.516 2.816 1.00 0.00 C ATOM 811 O ASP A 132 141.699 6.564 3.326 1.00 0.00 O ATOM 812 CB ASP A 132 142.645 9.599 4.159 1.00 0.00 C ATOM 813 CG ASP A 132 143.055 9.894 5.589 1.00 0.00 C ATOM 814 OD1 ASP A 132 142.920 8.994 6.443 1.00 0.00 O ATOM 815 OD2 ASP A 132 143.513 11.026 5.852 1.00 0.00 O ATOM 0 H ASP A 132 144.568 9.666 2.613 1.00 0.00 H new ATOM 0 HA ASP A 132 143.649 7.721 4.451 1.00 0.00 H new ATOM 0 HB2 ASP A 132 142.913 10.444 3.525 1.00 0.00 H new ATOM 0 HB3 ASP A 132 141.561 9.494 4.109 1.00 0.00 H new ATOM 820 N ILE A 133 142.086 7.902 1.561 1.00 0.00 N ATOM 821 CA ILE A 133 141.142 7.211 0.690 1.00 0.00 C ATOM 822 C ILE A 133 141.617 5.799 0.365 1.00 0.00 C ATOM 823 O ILE A 133 140.815 4.923 0.040 1.00 0.00 O ATOM 824 CB ILE A 133 140.924 7.981 -0.627 1.00 0.00 C ATOM 825 CG1 ILE A 133 140.654 9.462 -0.346 1.00 0.00 C ATOM 826 CG2 ILE A 133 139.776 7.369 -1.414 1.00 0.00 C ATOM 827 CD1 ILE A 133 139.498 9.698 0.600 1.00 0.00 C ATOM 0 H ILE A 133 142.564 8.690 1.124 1.00 0.00 H new ATOM 0 HA ILE A 133 140.199 7.156 1.233 1.00 0.00 H new ATOM 0 HB ILE A 133 141.832 7.906 -1.225 1.00 0.00 H new ATOM 0 HG12 ILE A 133 141.553 9.914 0.073 1.00 0.00 H new ATOM 0 HG13 ILE A 133 140.451 9.971 -1.288 1.00 0.00 H new ATOM 0 HG21 ILE A 133 139.634 7.924 -2.342 1.00 0.00 H new ATOM 0 HG22 ILE A 133 140.007 6.329 -1.645 1.00 0.00 H new ATOM 0 HG23 ILE A 133 138.863 7.415 -0.821 1.00 0.00 H new ATOM 0 HD11 ILE A 133 139.365 10.769 0.752 1.00 0.00 H new ATOM 0 HD12 ILE A 133 138.587 9.277 0.174 1.00 0.00 H new ATOM 0 HD13 ILE A 133 139.707 9.219 1.556 1.00 0.00 H new ATOM 839 N GLU A 134 142.926 5.583 0.453 1.00 0.00 N ATOM 840 CA GLU A 134 143.505 4.275 0.165 1.00 0.00 C ATOM 841 C GLU A 134 143.261 3.303 1.315 1.00 0.00 C ATOM 842 O GLU A 134 143.145 2.096 1.106 1.00 0.00 O ATOM 843 CB GLU A 134 145.008 4.406 -0.097 1.00 0.00 C ATOM 844 CG GLU A 134 145.357 4.558 -1.568 1.00 0.00 C ATOM 845 CD GLU A 134 146.579 3.753 -1.963 1.00 0.00 C ATOM 846 OE1 GLU A 134 146.641 2.556 -1.609 1.00 0.00 O ATOM 847 OE2 GLU A 134 147.473 4.317 -2.628 1.00 0.00 O ATOM 0 H GLU A 134 143.605 6.296 0.721 1.00 0.00 H new ATOM 0 HA GLU A 134 143.019 3.881 -0.727 1.00 0.00 H new ATOM 0 HB2 GLU A 134 145.390 5.268 0.450 1.00 0.00 H new ATOM 0 HB3 GLU A 134 145.516 3.527 0.300 1.00 0.00 H new ATOM 0 HG2 GLU A 134 144.507 4.243 -2.174 1.00 0.00 H new ATOM 0 HG3 GLU A 134 145.533 5.611 -1.789 1.00 0.00 H new ATOM 854 N GLU A 135 143.181 3.837 2.529 1.00 0.00 N ATOM 855 CA GLU A 135 142.951 3.014 3.712 1.00 0.00 C ATOM 856 C GLU A 135 141.548 2.413 3.701 1.00 0.00 C ATOM 857 O GLU A 135 141.312 1.356 4.286 1.00 0.00 O ATOM 858 CB GLU A 135 143.151 3.845 4.981 1.00 0.00 C ATOM 859 CG GLU A 135 144.565 4.381 5.143 1.00 0.00 C ATOM 860 CD GLU A 135 145.591 3.276 5.307 1.00 0.00 C ATOM 861 OE1 GLU A 135 145.746 2.774 6.440 1.00 0.00 O ATOM 862 OE2 GLU A 135 146.238 2.914 4.303 1.00 0.00 O ATOM 0 H GLU A 135 143.272 4.835 2.720 1.00 0.00 H new ATOM 0 HA GLU A 135 143.673 2.198 3.699 1.00 0.00 H new ATOM 0 HB2 GLU A 135 142.453 4.682 4.970 1.00 0.00 H new ATOM 0 HB3 GLU A 135 142.902 3.234 5.848 1.00 0.00 H new ATOM 0 HG2 GLU A 135 144.823 4.985 4.273 1.00 0.00 H new ATOM 0 HG3 GLU A 135 144.603 5.039 6.011 1.00 0.00 H new ATOM 869 N LEU A 136 140.621 3.091 3.031 1.00 0.00 N ATOM 870 CA LEU A 136 139.244 2.620 2.947 1.00 0.00 C ATOM 871 C LEU A 136 139.153 1.345 2.114 1.00 0.00 C ATOM 872 O LEU A 136 138.735 0.298 2.605 1.00 0.00 O ATOM 873 CB LEU A 136 138.349 3.705 2.343 1.00 0.00 C ATOM 874 CG LEU A 136 137.494 4.476 3.350 1.00 0.00 C ATOM 875 CD1 LEU A 136 136.710 5.577 2.653 1.00 0.00 C ATOM 876 CD2 LEU A 136 136.552 3.530 4.081 1.00 0.00 C ATOM 0 H LEU A 136 140.799 3.967 2.539 1.00 0.00 H new ATOM 0 HA LEU A 136 138.901 2.396 3.957 1.00 0.00 H new ATOM 0 HB2 LEU A 136 138.978 4.415 1.805 1.00 0.00 H new ATOM 0 HB3 LEU A 136 137.689 3.243 1.609 1.00 0.00 H new ATOM 0 HG LEU A 136 138.156 4.938 4.082 1.00 0.00 H new ATOM 0 HD11 LEU A 136 136.108 6.114 3.386 1.00 0.00 H new ATOM 0 HD12 LEU A 136 137.402 6.269 2.174 1.00 0.00 H new ATOM 0 HD13 LEU A 136 136.057 5.137 1.899 1.00 0.00 H new ATOM 0 HD21 LEU A 136 135.951 4.094 4.794 1.00 0.00 H new ATOM 0 HD22 LEU A 136 135.897 3.041 3.361 1.00 0.00 H new ATOM 0 HD23 LEU A 136 137.133 2.777 4.613 1.00 0.00 H new ATOM 888 N MET A 137 139.551 1.443 0.849 1.00 0.00 N ATOM 889 CA MET A 137 139.515 0.298 -0.055 1.00 0.00 C ATOM 890 C MET A 137 140.405 -0.831 0.456 1.00 0.00 C ATOM 891 O MET A 137 140.155 -2.003 0.178 1.00 0.00 O ATOM 892 CB MET A 137 139.959 0.717 -1.458 1.00 0.00 C ATOM 893 CG MET A 137 138.859 1.372 -2.276 1.00 0.00 C ATOM 894 SD MET A 137 137.994 0.200 -3.339 1.00 0.00 S ATOM 895 CE MET A 137 136.316 0.816 -3.228 1.00 0.00 C ATOM 0 H MET A 137 139.902 2.303 0.427 1.00 0.00 H new ATOM 0 HA MET A 137 138.488 -0.066 -0.098 1.00 0.00 H new ATOM 0 HB2 MET A 137 140.797 1.409 -1.373 1.00 0.00 H new ATOM 0 HB3 MET A 137 140.323 -0.161 -1.992 1.00 0.00 H new ATOM 0 HG2 MET A 137 138.143 1.844 -1.603 1.00 0.00 H new ATOM 0 HG3 MET A 137 139.290 2.164 -2.889 1.00 0.00 H new ATOM 0 HE1 MET A 137 135.627 0.068 -3.620 1.00 0.00 H new ATOM 0 HE2 MET A 137 136.073 1.023 -2.186 1.00 0.00 H new ATOM 0 HE3 MET A 137 136.226 1.733 -3.811 1.00 0.00 H new ATOM 905 N LYS A 138 141.445 -0.470 1.202 1.00 0.00 N ATOM 906 CA LYS A 138 142.375 -1.453 1.748 1.00 0.00 C ATOM 907 C LYS A 138 141.640 -2.519 2.556 1.00 0.00 C ATOM 908 O LYS A 138 141.557 -3.676 2.144 1.00 0.00 O ATOM 909 CB LYS A 138 143.423 -0.763 2.624 1.00 0.00 C ATOM 910 CG LYS A 138 144.819 -1.345 2.475 1.00 0.00 C ATOM 911 CD LYS A 138 145.451 -0.948 1.149 1.00 0.00 C ATOM 912 CE LYS A 138 146.077 -2.143 0.446 1.00 0.00 C ATOM 913 NZ LYS A 138 145.237 -2.625 -0.684 1.00 0.00 N ATOM 0 H LYS A 138 141.665 0.497 1.442 1.00 0.00 H new ATOM 0 HA LYS A 138 142.874 -1.943 0.912 1.00 0.00 H new ATOM 0 HB2 LYS A 138 143.452 0.298 2.374 1.00 0.00 H new ATOM 0 HB3 LYS A 138 143.117 -0.836 3.668 1.00 0.00 H new ATOM 0 HG2 LYS A 138 145.447 -1.000 3.296 1.00 0.00 H new ATOM 0 HG3 LYS A 138 144.771 -2.432 2.545 1.00 0.00 H new ATOM 0 HD2 LYS A 138 144.694 -0.501 0.504 1.00 0.00 H new ATOM 0 HD3 LYS A 138 146.212 -0.187 1.322 1.00 0.00 H new ATOM 0 HE2 LYS A 138 147.064 -1.869 0.073 1.00 0.00 H new ATOM 0 HE3 LYS A 138 146.220 -2.952 1.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 145.186 -3.663 -0.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 144.279 -2.229 -0.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 145.658 -2.320 -1.585 1.00 0.00 H new ATOM 927 N ASP A 139 141.112 -2.125 3.711 1.00 0.00 N ATOM 928 CA ASP A 139 140.389 -3.051 4.574 1.00 0.00 C ATOM 929 C ASP A 139 139.055 -3.469 3.958 1.00 0.00 C ATOM 930 O ASP A 139 138.494 -4.503 4.322 1.00 0.00 O ATOM 931 CB ASP A 139 140.171 -2.427 5.958 1.00 0.00 C ATOM 932 CG ASP A 139 139.128 -1.325 5.957 1.00 0.00 C ATOM 933 OD1 ASP A 139 138.712 -0.900 4.858 1.00 0.00 O ATOM 934 OD2 ASP A 139 138.732 -0.883 7.055 1.00 0.00 O ATOM 0 H ASP A 139 141.171 -1.172 4.070 1.00 0.00 H new ATOM 0 HA ASP A 139 140.996 -3.950 4.683 1.00 0.00 H new ATOM 0 HB2 ASP A 139 139.867 -3.206 6.657 1.00 0.00 H new ATOM 0 HB3 ASP A 139 141.116 -2.024 6.321 1.00 0.00 H new ATOM 939 N GLY A 140 138.552 -2.669 3.024 1.00 0.00 N ATOM 940 CA GLY A 140 137.292 -2.988 2.379 1.00 0.00 C ATOM 941 C GLY A 140 137.419 -4.140 1.403 1.00 0.00 C ATOM 942 O GLY A 140 136.620 -5.076 1.427 1.00 0.00 O ATOM 0 H GLY A 140 138.993 -1.807 2.703 1.00 0.00 H new ATOM 0 HA2 GLY A 140 136.551 -3.239 3.138 1.00 0.00 H new ATOM 0 HA3 GLY A 140 136.923 -2.108 1.852 1.00 0.00 H new ATOM 946 N ASP A 141 138.426 -4.068 0.540 1.00 0.00 N ATOM 947 CA ASP A 141 138.658 -5.111 -0.454 1.00 0.00 C ATOM 948 C ASP A 141 139.120 -6.405 0.208 1.00 0.00 C ATOM 949 O ASP A 141 139.794 -6.382 1.238 1.00 0.00 O ATOM 950 CB ASP A 141 139.697 -4.650 -1.477 1.00 0.00 C ATOM 951 CG ASP A 141 139.593 -5.407 -2.785 1.00 0.00 C ATOM 952 OD1 ASP A 141 139.625 -6.656 -2.750 1.00 0.00 O ATOM 953 OD2 ASP A 141 139.476 -4.754 -3.842 1.00 0.00 O ATOM 0 H ASP A 141 139.095 -3.299 0.508 1.00 0.00 H new ATOM 0 HA ASP A 141 137.715 -5.303 -0.965 1.00 0.00 H new ATOM 0 HB2 ASP A 141 139.569 -3.584 -1.666 1.00 0.00 H new ATOM 0 HB3 ASP A 141 140.696 -4.783 -1.062 1.00 0.00 H new ATOM 958 N LYS A 142 138.749 -7.533 -0.391 1.00 0.00 N ATOM 959 CA LYS A 142 139.123 -8.840 0.139 1.00 0.00 C ATOM 960 C LYS A 142 140.042 -9.590 -0.824 1.00 0.00 C ATOM 961 O LYS A 142 140.654 -10.592 -0.454 1.00 0.00 O ATOM 962 CB LYS A 142 137.870 -9.674 0.416 1.00 0.00 C ATOM 963 CG LYS A 142 136.840 -8.959 1.275 1.00 0.00 C ATOM 964 CD LYS A 142 137.379 -8.670 2.667 1.00 0.00 C ATOM 965 CE LYS A 142 136.315 -8.886 3.732 1.00 0.00 C ATOM 966 NZ LYS A 142 136.895 -8.893 5.103 1.00 0.00 N ATOM 0 H LYS A 142 138.190 -7.568 -1.243 1.00 0.00 H new ATOM 0 HA LYS A 142 139.666 -8.679 1.070 1.00 0.00 H new ATOM 0 HB2 LYS A 142 137.410 -9.950 -0.533 1.00 0.00 H new ATOM 0 HB3 LYS A 142 138.162 -10.601 0.910 1.00 0.00 H new ATOM 0 HG2 LYS A 142 136.550 -8.024 0.795 1.00 0.00 H new ATOM 0 HG3 LYS A 142 135.941 -9.571 1.352 1.00 0.00 H new ATOM 0 HD2 LYS A 142 138.234 -9.316 2.869 1.00 0.00 H new ATOM 0 HD3 LYS A 142 137.738 -7.642 2.713 1.00 0.00 H new ATOM 0 HE2 LYS A 142 135.564 -8.099 3.660 1.00 0.00 H new ATOM 0 HE3 LYS A 142 135.805 -9.832 3.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 136.137 -9.043 5.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 137.593 -9.660 5.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 137.360 -7.981 5.288 1.00 0.00 H new ATOM 980 N ASN A 143 140.136 -9.105 -2.062 1.00 0.00 N ATOM 981 CA ASN A 143 140.984 -9.740 -3.066 1.00 0.00 C ATOM 982 C ASN A 143 142.150 -8.834 -3.465 1.00 0.00 C ATOM 983 O ASN A 143 142.865 -9.121 -4.424 1.00 0.00 O ATOM 984 CB ASN A 143 140.157 -10.096 -4.304 1.00 0.00 C ATOM 985 CG ASN A 143 138.874 -10.824 -3.952 1.00 0.00 C ATOM 986 OD1 ASN A 143 137.782 -10.391 -4.317 1.00 0.00 O ATOM 987 ND2 ASN A 143 139.002 -11.937 -3.240 1.00 0.00 N ATOM 0 H ASN A 143 139.637 -8.278 -2.391 1.00 0.00 H new ATOM 0 HA ASN A 143 141.395 -10.650 -2.629 1.00 0.00 H new ATOM 0 HB2 ASN A 143 139.916 -9.185 -4.851 1.00 0.00 H new ATOM 0 HB3 ASN A 143 140.754 -10.719 -4.970 1.00 0.00 H new ATOM 0 HD21 ASN A 143 138.174 -12.470 -2.974 1.00 0.00 H new ATOM 0 HD22 ASN A 143 139.928 -12.259 -2.959 1.00 0.00 H new ATOM 994 N ASN A 144 142.338 -7.743 -2.725 1.00 0.00 N ATOM 995 CA ASN A 144 143.419 -6.805 -3.007 1.00 0.00 C ATOM 996 C ASN A 144 143.350 -6.301 -4.447 1.00 0.00 C ATOM 997 O ASN A 144 144.367 -5.922 -5.031 1.00 0.00 O ATOM 998 CB ASN A 144 144.776 -7.464 -2.748 1.00 0.00 C ATOM 999 CG ASN A 144 145.396 -7.015 -1.439 1.00 0.00 C ATOM 1000 OD1 ASN A 144 145.441 -5.824 -1.136 1.00 0.00 O ATOM 1001 ND2 ASN A 144 145.877 -7.973 -0.653 1.00 0.00 N ATOM 0 H ASN A 144 141.756 -7.488 -1.927 1.00 0.00 H new ATOM 0 HA ASN A 144 143.304 -5.951 -2.340 1.00 0.00 H new ATOM 0 HB2 ASN A 144 144.655 -8.547 -2.737 1.00 0.00 H new ATOM 0 HB3 ASN A 144 145.454 -7.228 -3.568 1.00 0.00 H new ATOM 0 HD21 ASN A 144 146.304 -7.732 0.241 1.00 0.00 H new ATOM 0 HD22 ASN A 144 145.819 -8.949 -0.944 1.00 0.00 H new ATOM 1008 N ASP A 145 142.148 -6.294 -5.013 1.00 0.00 N ATOM 1009 CA ASP A 145 141.951 -5.830 -6.383 1.00 0.00 C ATOM 1010 C ASP A 145 141.838 -4.309 -6.429 1.00 0.00 C ATOM 1011 O ASP A 145 142.215 -3.679 -7.417 1.00 0.00 O ATOM 1012 CB ASP A 145 140.699 -6.471 -6.984 1.00 0.00 C ATOM 1013 CG ASP A 145 139.440 -6.115 -6.216 1.00 0.00 C ATOM 1014 OD1 ASP A 145 138.891 -5.019 -6.450 1.00 0.00 O ATOM 1015 OD2 ASP A 145 139.005 -6.934 -5.379 1.00 0.00 O ATOM 0 H ASP A 145 141.296 -6.604 -4.546 1.00 0.00 H new ATOM 0 HA ASP A 145 142.818 -6.127 -6.973 1.00 0.00 H new ATOM 0 HB2 ASP A 145 140.592 -6.150 -8.020 1.00 0.00 H new ATOM 0 HB3 ASP A 145 140.819 -7.554 -6.997 1.00 0.00 H new ATOM 1020 N GLY A 146 141.321 -3.728 -5.354 1.00 0.00 N ATOM 1021 CA GLY A 146 141.171 -2.286 -5.288 1.00 0.00 C ATOM 1022 C GLY A 146 139.757 -1.829 -5.591 1.00 0.00 C ATOM 1023 O GLY A 146 139.548 -0.712 -6.064 1.00 0.00 O ATOM 0 H GLY A 146 141.002 -4.230 -4.525 1.00 0.00 H new ATOM 0 HA2 GLY A 146 141.455 -1.941 -4.294 1.00 0.00 H new ATOM 0 HA3 GLY A 146 141.858 -1.821 -5.995 1.00 0.00 H new ATOM 1027 N ARG A 147 138.782 -2.691 -5.317 1.00 0.00 N ATOM 1028 CA ARG A 147 137.383 -2.362 -5.564 1.00 0.00 C ATOM 1029 C ARG A 147 136.483 -2.960 -4.486 1.00 0.00 C ATOM 1030 O ARG A 147 136.957 -3.638 -3.573 1.00 0.00 O ATOM 1031 CB ARG A 147 136.948 -2.865 -6.942 1.00 0.00 C ATOM 1032 CG ARG A 147 137.981 -2.634 -8.034 1.00 0.00 C ATOM 1033 CD ARG A 147 137.364 -2.747 -9.420 1.00 0.00 C ATOM 1034 NE ARG A 147 138.138 -3.629 -10.291 1.00 0.00 N ATOM 1035 CZ ARG A 147 137.656 -4.181 -11.403 1.00 0.00 C ATOM 1036 NH1 ARG A 147 136.405 -3.950 -11.781 1.00 0.00 N ATOM 1037 NH2 ARG A 147 138.428 -4.969 -12.139 1.00 0.00 N ATOM 0 H ARG A 147 138.935 -3.620 -4.925 1.00 0.00 H new ATOM 0 HA ARG A 147 137.285 -1.277 -5.535 1.00 0.00 H new ATOM 0 HB2 ARG A 147 136.733 -3.932 -6.878 1.00 0.00 H new ATOM 0 HB3 ARG A 147 136.019 -2.369 -7.223 1.00 0.00 H new ATOM 0 HG2 ARG A 147 138.426 -1.646 -7.912 1.00 0.00 H new ATOM 0 HG3 ARG A 147 138.787 -3.361 -7.933 1.00 0.00 H new ATOM 0 HD2 ARG A 147 136.345 -3.125 -9.334 1.00 0.00 H new ATOM 0 HD3 ARG A 147 137.300 -1.757 -9.871 1.00 0.00 H new ATOM 0 HE ARG A 147 139.103 -3.834 -10.032 1.00 0.00 H new ATOM 0 HH11 ARG A 147 135.806 -3.346 -11.219 1.00 0.00 H new ATOM 0 HH12 ARG A 147 136.043 -4.376 -12.634 1.00 0.00 H new ATOM 0 HH21 ARG A 147 139.390 -5.152 -11.853 1.00 0.00 H new ATOM 0 HH22 ARG A 147 138.060 -5.392 -12.991 1.00 0.00 H new ATOM 1051 N ILE A 148 135.185 -2.704 -4.602 1.00 0.00 N ATOM 1052 CA ILE A 148 134.214 -3.218 -3.642 1.00 0.00 C ATOM 1053 C ILE A 148 132.889 -3.540 -4.327 1.00 0.00 C ATOM 1054 O ILE A 148 132.470 -2.843 -5.251 1.00 0.00 O ATOM 1055 CB ILE A 148 133.964 -2.210 -2.499 1.00 0.00 C ATOM 1056 CG1 ILE A 148 135.270 -1.905 -1.761 1.00 0.00 C ATOM 1057 CG2 ILE A 148 132.917 -2.745 -1.530 1.00 0.00 C ATOM 1058 CD1 ILE A 148 135.840 -3.094 -1.018 1.00 0.00 C ATOM 0 H ILE A 148 134.780 -2.143 -5.352 1.00 0.00 H new ATOM 0 HA ILE A 148 134.633 -4.131 -3.220 1.00 0.00 H new ATOM 0 HB ILE A 148 133.587 -1.284 -2.934 1.00 0.00 H new ATOM 0 HG12 ILE A 148 136.008 -1.548 -2.479 1.00 0.00 H new ATOM 0 HG13 ILE A 148 135.096 -1.094 -1.053 1.00 0.00 H new ATOM 0 HG21 ILE A 148 132.755 -2.020 -0.732 1.00 0.00 H new ATOM 0 HG22 ILE A 148 131.981 -2.913 -2.062 1.00 0.00 H new ATOM 0 HG23 ILE A 148 133.265 -3.685 -1.101 1.00 0.00 H new ATOM 0 HD11 ILE A 148 136.765 -2.803 -0.520 1.00 0.00 H new ATOM 0 HD12 ILE A 148 135.120 -3.438 -0.275 1.00 0.00 H new ATOM 0 HD13 ILE A 148 136.046 -3.899 -1.723 1.00 0.00 H new ATOM 1070 N ASP A 149 132.234 -4.600 -3.866 1.00 0.00 N ATOM 1071 CA ASP A 149 130.956 -5.016 -4.432 1.00 0.00 C ATOM 1072 C ASP A 149 129.980 -5.423 -3.331 1.00 0.00 C ATOM 1073 O ASP A 149 130.306 -5.358 -2.145 1.00 0.00 O ATOM 1074 CB ASP A 149 131.159 -6.178 -5.406 1.00 0.00 C ATOM 1075 CG ASP A 149 131.883 -7.347 -4.771 1.00 0.00 C ATOM 1076 OD1 ASP A 149 131.409 -7.844 -3.729 1.00 0.00 O ATOM 1077 OD2 ASP A 149 132.927 -7.766 -5.315 1.00 0.00 O ATOM 0 H ASP A 149 132.567 -5.187 -3.101 1.00 0.00 H new ATOM 0 HA ASP A 149 130.533 -4.169 -4.972 1.00 0.00 H new ATOM 0 HB2 ASP A 149 130.189 -6.512 -5.775 1.00 0.00 H new ATOM 0 HB3 ASP A 149 131.726 -5.829 -6.269 1.00 0.00 H new ATOM 1082 N TYR A 150 128.784 -5.840 -3.731 1.00 0.00 N ATOM 1083 CA TYR A 150 127.761 -6.256 -2.777 1.00 0.00 C ATOM 1084 C TYR A 150 128.255 -7.412 -1.911 1.00 0.00 C ATOM 1085 O TYR A 150 127.801 -7.590 -0.781 1.00 0.00 O ATOM 1086 CB TYR A 150 126.483 -6.665 -3.512 1.00 0.00 C ATOM 1087 CG TYR A 150 125.313 -6.923 -2.590 1.00 0.00 C ATOM 1088 CD1 TYR A 150 124.892 -5.959 -1.681 1.00 0.00 C ATOM 1089 CD2 TYR A 150 124.628 -8.131 -2.628 1.00 0.00 C ATOM 1090 CE1 TYR A 150 123.824 -6.191 -0.837 1.00 0.00 C ATOM 1091 CE2 TYR A 150 123.558 -8.371 -1.786 1.00 0.00 C ATOM 1092 CZ TYR A 150 123.160 -7.398 -0.894 1.00 0.00 C ATOM 1093 OH TYR A 150 122.096 -7.634 -0.054 1.00 0.00 O ATOM 0 H TYR A 150 128.498 -5.899 -4.708 1.00 0.00 H new ATOM 0 HA TYR A 150 127.544 -5.408 -2.127 1.00 0.00 H new ATOM 0 HB2 TYR A 150 126.213 -5.880 -4.218 1.00 0.00 H new ATOM 0 HB3 TYR A 150 126.681 -7.564 -4.095 1.00 0.00 H new ATOM 0 HD1 TYR A 150 125.409 -5.012 -1.634 1.00 0.00 H new ATOM 0 HD2 TYR A 150 124.936 -8.895 -3.326 1.00 0.00 H new ATOM 0 HE1 TYR A 150 123.511 -5.431 -0.136 1.00 0.00 H new ATOM 0 HE2 TYR A 150 123.037 -9.316 -1.827 1.00 0.00 H new ATOM 0 HH TYR A 150 121.739 -8.531 -0.222 1.00 0.00 H new ATOM 1103 N ASP A 151 129.189 -8.191 -2.448 1.00 0.00 N ATOM 1104 CA ASP A 151 129.743 -9.327 -1.719 1.00 0.00 C ATOM 1105 C ASP A 151 130.775 -8.858 -0.696 1.00 0.00 C ATOM 1106 O ASP A 151 130.714 -9.231 0.476 1.00 0.00 O ATOM 1107 CB ASP A 151 130.380 -10.322 -2.691 1.00 0.00 C ATOM 1108 CG ASP A 151 129.563 -11.592 -2.834 1.00 0.00 C ATOM 1109 OD1 ASP A 151 129.559 -12.405 -1.886 1.00 0.00 O ATOM 1110 OD2 ASP A 151 128.930 -11.774 -3.895 1.00 0.00 O ATOM 0 H ASP A 151 129.577 -8.057 -3.382 1.00 0.00 H new ATOM 0 HA ASP A 151 128.930 -9.824 -1.189 1.00 0.00 H new ATOM 0 HB2 ASP A 151 130.490 -9.852 -3.668 1.00 0.00 H new ATOM 0 HB3 ASP A 151 131.382 -10.575 -2.344 1.00 0.00 H new ATOM 1115 N GLU A 152 131.718 -8.039 -1.149 1.00 0.00 N ATOM 1116 CA GLU A 152 132.762 -7.520 -0.276 1.00 0.00 C ATOM 1117 C GLU A 152 132.184 -6.547 0.747 1.00 0.00 C ATOM 1118 O GLU A 152 132.728 -6.384 1.840 1.00 0.00 O ATOM 1119 CB GLU A 152 133.847 -6.825 -1.101 1.00 0.00 C ATOM 1120 CG GLU A 152 134.360 -7.663 -2.260 1.00 0.00 C ATOM 1121 CD GLU A 152 135.417 -6.945 -3.076 1.00 0.00 C ATOM 1122 OE1 GLU A 152 136.485 -6.625 -2.513 1.00 0.00 O ATOM 1123 OE2 GLU A 152 135.178 -6.704 -4.278 1.00 0.00 O ATOM 0 H GLU A 152 131.780 -7.721 -2.116 1.00 0.00 H new ATOM 0 HA GLU A 152 133.204 -8.361 0.259 1.00 0.00 H new ATOM 0 HB2 GLU A 152 133.451 -5.887 -1.489 1.00 0.00 H new ATOM 0 HB3 GLU A 152 134.683 -6.573 -0.448 1.00 0.00 H new ATOM 0 HG2 GLU A 152 134.775 -8.594 -1.874 1.00 0.00 H new ATOM 0 HG3 GLU A 152 133.525 -7.930 -2.908 1.00 0.00 H new ATOM 1130 N PHE A 153 131.079 -5.900 0.388 1.00 0.00 N ATOM 1131 CA PHE A 153 130.430 -4.944 1.278 1.00 0.00 C ATOM 1132 C PHE A 153 129.759 -5.657 2.447 1.00 0.00 C ATOM 1133 O PHE A 153 129.919 -5.263 3.602 1.00 0.00 O ATOM 1134 CB PHE A 153 129.398 -4.118 0.509 1.00 0.00 C ATOM 1135 CG PHE A 153 128.844 -2.965 1.296 1.00 0.00 C ATOM 1136 CD1 PHE A 153 129.685 -2.142 2.028 1.00 0.00 C ATOM 1137 CD2 PHE A 153 127.483 -2.704 1.303 1.00 0.00 C ATOM 1138 CE1 PHE A 153 129.178 -1.079 2.753 1.00 0.00 C ATOM 1139 CE2 PHE A 153 126.971 -1.644 2.027 1.00 0.00 C ATOM 1140 CZ PHE A 153 127.819 -0.831 2.752 1.00 0.00 C ATOM 0 H PHE A 153 130.615 -6.021 -0.512 1.00 0.00 H new ATOM 0 HA PHE A 153 131.196 -4.277 1.674 1.00 0.00 H new ATOM 0 HB2 PHE A 153 129.857 -3.737 -0.404 1.00 0.00 H new ATOM 0 HB3 PHE A 153 128.577 -4.768 0.206 1.00 0.00 H new ATOM 0 HD1 PHE A 153 130.748 -2.333 2.032 1.00 0.00 H new ATOM 0 HD2 PHE A 153 126.815 -3.336 0.736 1.00 0.00 H new ATOM 0 HE1 PHE A 153 129.843 -0.444 3.319 1.00 0.00 H new ATOM 0 HE2 PHE A 153 125.908 -1.452 2.026 1.00 0.00 H new ATOM 0 HZ PHE A 153 127.420 -0.002 3.318 1.00 0.00 H new ATOM 1150 N LEU A 154 129.011 -6.711 2.139 1.00 0.00 N ATOM 1151 CA LEU A 154 128.315 -7.482 3.163 1.00 0.00 C ATOM 1152 C LEU A 154 129.302 -8.054 4.177 1.00 0.00 C ATOM 1153 O LEU A 154 128.977 -8.212 5.353 1.00 0.00 O ATOM 1154 CB LEU A 154 127.506 -8.612 2.520 1.00 0.00 C ATOM 1155 CG LEU A 154 125.988 -8.425 2.560 1.00 0.00 C ATOM 1156 CD1 LEU A 154 125.478 -8.505 3.990 1.00 0.00 C ATOM 1157 CD2 LEU A 154 125.600 -7.098 1.926 1.00 0.00 C ATOM 0 H LEU A 154 128.871 -7.051 1.188 1.00 0.00 H new ATOM 0 HA LEU A 154 127.633 -6.813 3.687 1.00 0.00 H new ATOM 0 HB2 LEU A 154 127.817 -8.715 1.480 1.00 0.00 H new ATOM 0 HB3 LEU A 154 127.755 -9.547 3.021 1.00 0.00 H new ATOM 0 HG LEU A 154 125.525 -9.229 1.987 1.00 0.00 H new ATOM 0 HD11 LEU A 154 124.396 -8.370 3.999 1.00 0.00 H new ATOM 0 HD12 LEU A 154 125.725 -9.480 4.410 1.00 0.00 H new ATOM 0 HD13 LEU A 154 125.946 -7.723 4.588 1.00 0.00 H new ATOM 0 HD21 LEU A 154 124.517 -6.980 1.962 1.00 0.00 H new ATOM 0 HD22 LEU A 154 126.072 -6.282 2.473 1.00 0.00 H new ATOM 0 HD23 LEU A 154 125.932 -7.080 0.888 1.00 0.00 H new ATOM 1169 N GLU A 155 130.508 -8.363 3.710 1.00 0.00 N ATOM 1170 CA GLU A 155 131.543 -8.918 4.576 1.00 0.00 C ATOM 1171 C GLU A 155 132.244 -7.812 5.359 1.00 0.00 C ATOM 1172 O GLU A 155 132.504 -7.950 6.553 1.00 0.00 O ATOM 1173 CB GLU A 155 132.566 -9.698 3.747 1.00 0.00 C ATOM 1174 CG GLU A 155 131.985 -10.925 3.064 1.00 0.00 C ATOM 1175 CD GLU A 155 133.030 -11.985 2.782 1.00 0.00 C ATOM 1176 OE1 GLU A 155 133.621 -12.509 3.751 1.00 0.00 O ATOM 1177 OE2 GLU A 155 133.260 -12.291 1.593 1.00 0.00 O ATOM 0 H GLU A 155 130.792 -8.239 2.738 1.00 0.00 H new ATOM 0 HA GLU A 155 131.066 -9.596 5.284 1.00 0.00 H new ATOM 0 HB2 GLU A 155 132.988 -9.037 2.990 1.00 0.00 H new ATOM 0 HB3 GLU A 155 133.387 -10.007 4.394 1.00 0.00 H new ATOM 0 HG2 GLU A 155 131.203 -11.350 3.693 1.00 0.00 H new ATOM 0 HG3 GLU A 155 131.514 -10.626 2.127 1.00 0.00 H new ATOM 1184 N PHE A 156 132.545 -6.712 4.674 1.00 0.00 N ATOM 1185 CA PHE A 156 133.216 -5.580 5.303 1.00 0.00 C ATOM 1186 C PHE A 156 132.295 -4.888 6.303 1.00 0.00 C ATOM 1187 O PHE A 156 132.755 -4.314 7.289 1.00 0.00 O ATOM 1188 CB PHE A 156 133.677 -4.582 4.241 1.00 0.00 C ATOM 1189 CG PHE A 156 134.535 -3.476 4.785 1.00 0.00 C ATOM 1190 CD1 PHE A 156 135.683 -3.764 5.508 1.00 0.00 C ATOM 1191 CD2 PHE A 156 134.194 -2.150 4.574 1.00 0.00 C ATOM 1192 CE1 PHE A 156 136.474 -2.748 6.010 1.00 0.00 C ATOM 1193 CE2 PHE A 156 134.982 -1.130 5.075 1.00 0.00 C ATOM 1194 CZ PHE A 156 136.123 -1.429 5.792 1.00 0.00 C ATOM 0 H PHE A 156 132.335 -6.581 3.684 1.00 0.00 H new ATOM 0 HA PHE A 156 134.086 -5.957 5.840 1.00 0.00 H new ATOM 0 HB2 PHE A 156 134.233 -5.116 3.470 1.00 0.00 H new ATOM 0 HB3 PHE A 156 132.801 -4.147 3.759 1.00 0.00 H new ATOM 0 HD1 PHE A 156 135.962 -4.793 5.681 1.00 0.00 H new ATOM 0 HD2 PHE A 156 133.303 -1.910 4.012 1.00 0.00 H new ATOM 0 HE1 PHE A 156 137.365 -2.984 6.572 1.00 0.00 H new ATOM 0 HE2 PHE A 156 134.705 -0.100 4.905 1.00 0.00 H new ATOM 0 HZ PHE A 156 136.741 -0.633 6.182 1.00 0.00 H new ATOM 1204 N MET A 157 130.992 -4.948 6.043 1.00 0.00 N ATOM 1205 CA MET A 157 130.008 -4.326 6.924 1.00 0.00 C ATOM 1206 C MET A 157 129.545 -5.295 8.012 1.00 0.00 C ATOM 1207 O MET A 157 128.661 -4.969 8.803 1.00 0.00 O ATOM 1208 CB MET A 157 128.805 -3.841 6.114 1.00 0.00 C ATOM 1209 CG MET A 157 128.970 -2.436 5.558 1.00 0.00 C ATOM 1210 SD MET A 157 128.651 -1.160 6.791 1.00 0.00 S ATOM 1211 CE MET A 157 130.301 -0.508 7.041 1.00 0.00 C ATOM 0 H MET A 157 130.593 -5.420 5.231 1.00 0.00 H new ATOM 0 HA MET A 157 130.485 -3.474 7.408 1.00 0.00 H new ATOM 0 HB2 MET A 157 128.632 -4.531 5.288 1.00 0.00 H new ATOM 0 HB3 MET A 157 127.917 -3.871 6.745 1.00 0.00 H new ATOM 0 HG2 MET A 157 129.983 -2.318 5.173 1.00 0.00 H new ATOM 0 HG3 MET A 157 128.291 -2.300 4.716 1.00 0.00 H new ATOM 0 HE1 MET A 157 130.390 -0.123 8.057 1.00 0.00 H new ATOM 0 HE2 MET A 157 131.033 -1.301 6.888 1.00 0.00 H new ATOM 0 HE3 MET A 157 130.485 0.298 6.330 1.00 0.00 H new ATOM 1221 N LYS A 158 130.141 -6.485 8.047 1.00 0.00 N ATOM 1222 CA LYS A 158 129.780 -7.490 9.040 1.00 0.00 C ATOM 1223 C LYS A 158 130.650 -7.363 10.289 1.00 0.00 C ATOM 1224 O LYS A 158 131.148 -8.359 10.816 1.00 0.00 O ATOM 1225 CB LYS A 158 129.923 -8.893 8.446 1.00 0.00 C ATOM 1226 CG LYS A 158 128.878 -9.876 8.950 1.00 0.00 C ATOM 1227 CD LYS A 158 128.668 -11.017 7.968 1.00 0.00 C ATOM 1228 CE LYS A 158 127.207 -11.433 7.900 1.00 0.00 C ATOM 1229 NZ LYS A 158 126.364 -10.391 7.252 1.00 0.00 N ATOM 0 H LYS A 158 130.874 -6.775 7.400 1.00 0.00 H new ATOM 0 HA LYS A 158 128.741 -7.325 9.327 1.00 0.00 H new ATOM 0 HB2 LYS A 158 129.855 -8.828 7.360 1.00 0.00 H new ATOM 0 HB3 LYS A 158 130.915 -9.278 8.680 1.00 0.00 H new ATOM 0 HG2 LYS A 158 129.189 -10.277 9.914 1.00 0.00 H new ATOM 0 HG3 LYS A 158 127.934 -9.355 9.111 1.00 0.00 H new ATOM 0 HD2 LYS A 158 129.007 -10.713 6.978 1.00 0.00 H new ATOM 0 HD3 LYS A 158 129.277 -11.871 8.265 1.00 0.00 H new ATOM 0 HE2 LYS A 158 127.121 -12.367 7.345 1.00 0.00 H new ATOM 0 HE3 LYS A 158 126.837 -11.625 8.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 125.485 -10.823 6.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 126.135 -9.650 7.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 126.883 -9.971 6.455 1.00 0.00 H new ATOM 1243 N GLY A 159 130.831 -6.131 10.757 1.00 0.00 N ATOM 1244 CA GLY A 159 131.641 -5.899 11.936 1.00 0.00 C ATOM 1245 C GLY A 159 133.008 -5.341 11.595 1.00 0.00 C ATOM 1246 O GLY A 159 134.018 -6.033 11.719 1.00 0.00 O ATOM 0 H GLY A 159 130.431 -5.291 10.340 1.00 0.00 H new ATOM 0 HA2 GLY A 159 131.123 -5.206 12.599 1.00 0.00 H new ATOM 0 HA3 GLY A 159 131.759 -6.835 12.483 1.00 0.00 H new ATOM 1250 N VAL A 160 133.039 -4.086 11.161 1.00 0.00 N ATOM 1251 CA VAL A 160 134.291 -3.433 10.794 1.00 0.00 C ATOM 1252 C VAL A 160 135.156 -3.179 12.024 1.00 0.00 C ATOM 1253 O VAL A 160 136.334 -3.535 12.051 1.00 0.00 O ATOM 1254 CB VAL A 160 134.045 -2.093 10.071 1.00 0.00 C ATOM 1255 CG1 VAL A 160 135.319 -1.614 9.394 1.00 0.00 C ATOM 1256 CG2 VAL A 160 132.913 -2.221 9.058 1.00 0.00 C ATOM 0 H VAL A 160 132.211 -3.500 11.055 1.00 0.00 H new ATOM 0 HA VAL A 160 134.810 -4.110 10.115 1.00 0.00 H new ATOM 0 HB VAL A 160 133.749 -1.353 10.815 1.00 0.00 H new ATOM 0 HG11 VAL A 160 135.129 -0.667 8.888 1.00 0.00 H new ATOM 0 HG12 VAL A 160 136.099 -1.475 10.143 1.00 0.00 H new ATOM 0 HG13 VAL A 160 135.644 -2.356 8.665 1.00 0.00 H new ATOM 0 HG21 VAL A 160 132.759 -1.263 8.562 1.00 0.00 H new ATOM 0 HG22 VAL A 160 133.172 -2.977 8.316 1.00 0.00 H new ATOM 0 HG23 VAL A 160 131.997 -2.515 9.571 1.00 0.00 H new