USER MOD reduce.3.24.130724 H: found=0, std=0, add=649, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 651 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 139 MET CE :methyl -149:sc= -2.6 (180deg=-4.54!) USER MOD Set 1.2: A 186 MET CE :methyl -173:sc= -2.65! (180deg=-2.48!) USER MOD Set 2.1: A 174 THR OG1 : rot 106:sc= 1.28 USER MOD Set 2.2: A 182 THR OG1 : rot 180:sc= 1.01 USER MOD Single : A 110 MET CE :methyl 167:sc= -0.0756 (180deg=-0.36) USER MOD Single : A 112 ASN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 117 MET CE :methyl 180:sc= -10.2! (180deg=-10.2!) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= -0.0173 USER MOD Single : A 121 LYS NZ :NH3+ 153:sc= 0.302 (180deg=0.0784) USER MOD Single : A 122 ASN : amide:sc= -0.138 K(o=-0.14,f=-1.3!) USER MOD Single : A 124 MET CE :methyl -152:sc= -13.3! (180deg=-15.5!) USER MOD Single : A 126 LYS NZ :NH3+ 174:sc= -0.627 (180deg=-0.84) USER MOD Single : A 131 THR OG1 : rot 145:sc= -1.15 USER MOD Single : A 132 GLN :FLIP amide:sc= -0.138 F(o=-0.93,f=-0.14) USER MOD Single : A 133 TYR OH : rot 180:sc= -1.54 USER MOD Single : A 135 GLN : amide:sc= -0.439 K(o=-0.44,f=-1.9!) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot 17:sc= -1.52! USER MOD Single : A 148 GLN :FLIP amide:sc= -0.0979 F(o=-1.3!,f=-0.098) USER MOD Single : A 150 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 151 SER OG : rot 95:sc= 1.25 USER MOD Single : A 154 MET CE :methyl 150:sc= -5.83! (180deg=-8.1!) USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 179 HIS : no HD1:sc= -0.263 K(o=-0.26,f=-2.1) USER MOD Single : A 185 ASN : amide:sc= -5.52! C(o=-5.5!,f=-11!) USER MOD Single : A 188 ASN :FLIP amide:sc= -0.635 F(o=-3.2!,f=-0.64) USER MOD Single : A 189 ASN : amide:sc= -0.241 X(o=-0.24,f=-0.65) USER MOD Single : A 191 GLN :FLIP amide:sc= 0 F(o=-0.95,f=0) USER MOD ----------------------------------------------------------------- ATOM 319 N ARG A 109 10.114 0.128 -1.924 1.00 0.50 N ATOM 320 CA ARG A 109 9.124 1.177 -2.036 1.00 0.44 C ATOM 321 C ARG A 109 8.246 0.939 -3.253 1.00 0.36 C ATOM 322 O ARG A 109 8.469 1.568 -4.290 1.00 0.56 O ATOM 323 CB ARG A 109 9.793 2.502 -2.221 1.00 0.57 C ATOM 324 CG ARG A 109 11.114 2.667 -1.479 1.00 0.98 C ATOM 325 CD ARG A 109 11.892 3.876 -1.973 1.00 1.83 C ATOM 326 NE ARG A 109 12.304 3.734 -3.367 1.00 2.50 N ATOM 327 CZ ARG A 109 13.230 4.491 -3.953 1.00 3.50 C ATOM 328 NH1 ARG A 109 13.832 5.461 -3.275 1.00 4.03 N ATOM 329 NH2 ARG A 109 13.554 4.276 -5.219 1.00 4.32 N ATOM 0 HA ARG A 109 8.528 1.173 -1.124 1.00 0.44 H new ATOM 0 HB2 ARG A 109 9.970 2.657 -3.285 1.00 0.57 H new ATOM 0 HB3 ARG A 109 9.110 3.286 -1.894 1.00 0.57 H new ATOM 0 HG2 ARG A 109 10.921 2.771 -0.411 1.00 0.98 H new ATOM 0 HG3 ARG A 109 11.718 1.769 -1.608 1.00 0.98 H new ATOM 0 HD2 ARG A 109 11.277 4.770 -1.867 1.00 1.83 H new ATOM 0 HD3 ARG A 109 12.773 4.019 -1.348 1.00 1.83 H new ATOM 0 HE ARG A 109 11.854 3.010 -3.927 1.00 2.50 H new ATOM 0 HH11 ARG A 109 13.586 5.630 -2.300 1.00 4.03 H new ATOM 0 HH12 ARG A 109 14.540 6.037 -3.730 1.00 4.03 H new ATOM 0 HH21 ARG A 109 13.095 3.532 -5.744 1.00 4.32 H new ATOM 0 HH22 ARG A 109 14.263 4.855 -5.669 1.00 4.32 H new ATOM 343 N MET A 110 7.277 0.072 -3.179 1.00 0.28 N ATOM 344 CA MET A 110 6.595 -0.311 -4.442 1.00 0.36 C ATOM 345 C MET A 110 5.085 -0.507 -4.332 1.00 0.41 C ATOM 346 O MET A 110 4.599 -1.209 -3.458 1.00 0.67 O ATOM 347 CB MET A 110 7.260 -1.543 -5.067 1.00 0.58 C ATOM 348 CG MET A 110 6.562 -2.060 -6.320 1.00 0.97 C ATOM 349 SD MET A 110 6.356 -0.789 -7.589 1.00 1.86 S ATOM 350 CE MET A 110 8.049 -0.258 -7.834 1.00 2.59 C ATOM 0 H MET A 110 6.936 -0.375 -2.328 1.00 0.28 H new ATOM 0 HA MET A 110 6.718 0.550 -5.099 1.00 0.36 H new ATOM 0 HB2 MET A 110 8.293 -1.298 -5.314 1.00 0.58 H new ATOM 0 HB3 MET A 110 7.290 -2.341 -4.326 1.00 0.58 H new ATOM 0 HG2 MET A 110 7.137 -2.889 -6.734 1.00 0.97 H new ATOM 0 HG3 MET A 110 5.584 -2.455 -6.047 1.00 0.97 H new ATOM 0 HE1 MET A 110 8.113 0.348 -8.738 1.00 2.59 H new ATOM 0 HE2 MET A 110 8.373 0.333 -6.977 1.00 2.59 H new ATOM 0 HE3 MET A 110 8.693 -1.131 -7.937 1.00 2.59 H new ATOM 360 N VAL A 111 4.340 0.075 -5.269 1.00 0.33 N ATOM 361 CA VAL A 111 2.894 -0.062 -5.262 1.00 0.35 C ATOM 362 C VAL A 111 2.348 -0.690 -6.533 1.00 0.33 C ATOM 363 O VAL A 111 2.348 -0.094 -7.609 1.00 0.35 O ATOM 364 CB VAL A 111 2.187 1.281 -4.992 1.00 0.43 C ATOM 365 CG1 VAL A 111 2.431 1.737 -3.568 1.00 0.74 C ATOM 366 CG2 VAL A 111 2.660 2.335 -5.962 1.00 0.73 C ATOM 0 H VAL A 111 4.713 0.639 -6.033 1.00 0.33 H new ATOM 0 HA VAL A 111 2.675 -0.743 -4.440 1.00 0.35 H new ATOM 0 HB VAL A 111 1.116 1.134 -5.132 1.00 0.43 H new ATOM 0 HG11 VAL A 111 1.924 2.687 -3.398 1.00 0.74 H new ATOM 0 HG12 VAL A 111 2.044 0.990 -2.875 1.00 0.74 H new ATOM 0 HG13 VAL A 111 3.501 1.863 -3.405 1.00 0.74 H new ATOM 0 HG21 VAL A 111 2.149 3.275 -5.755 1.00 0.73 H new ATOM 0 HG22 VAL A 111 3.735 2.474 -5.852 1.00 0.73 H new ATOM 0 HG23 VAL A 111 2.437 2.018 -6.981 1.00 0.73 H new ATOM 376 N ASN A 112 1.911 -1.927 -6.383 1.00 0.36 N ATOM 377 CA ASN A 112 1.117 -2.606 -7.380 1.00 0.37 C ATOM 378 C ASN A 112 0.383 -3.722 -6.683 1.00 0.40 C ATOM 379 O ASN A 112 0.993 -4.700 -6.263 1.00 0.55 O ATOM 380 CB ASN A 112 1.995 -3.167 -8.485 1.00 0.46 C ATOM 381 CG ASN A 112 1.185 -3.796 -9.605 1.00 0.77 C ATOM 382 OD1 ASN A 112 0.044 -3.407 -9.856 1.00 1.14 O ATOM 383 ND2 ASN A 112 1.768 -4.770 -10.287 1.00 1.38 N ATOM 0 H ASN A 112 2.102 -2.491 -5.555 1.00 0.36 H new ATOM 0 HA ASN A 112 0.419 -1.909 -7.843 1.00 0.37 H new ATOM 0 HB2 ASN A 112 2.615 -2.369 -8.893 1.00 0.46 H new ATOM 0 HB3 ASN A 112 2.670 -3.913 -8.066 1.00 0.46 H new ATOM 0 HD21 ASN A 112 1.270 -5.226 -11.051 1.00 1.38 H new ATOM 0 HD22 ASN A 112 2.715 -5.064 -10.048 1.00 1.38 H new ATOM 390 N LEU A 113 -0.912 -3.578 -6.548 1.00 0.37 N ATOM 391 CA LEU A 113 -1.676 -4.475 -5.707 1.00 0.40 C ATOM 392 C LEU A 113 -2.266 -5.576 -6.525 1.00 0.38 C ATOM 393 O LEU A 113 -3.283 -5.399 -7.192 1.00 0.52 O ATOM 394 CB LEU A 113 -2.777 -3.729 -4.969 1.00 0.42 C ATOM 395 CG LEU A 113 -2.315 -2.892 -3.776 1.00 0.58 C ATOM 396 CD1 LEU A 113 -1.140 -2.037 -4.165 1.00 1.33 C ATOM 397 CD2 LEU A 113 -3.442 -2.017 -3.255 1.00 1.17 C ATOM 0 H LEU A 113 -1.461 -2.851 -7.007 1.00 0.37 H new ATOM 0 HA LEU A 113 -0.998 -4.903 -4.969 1.00 0.40 H new ATOM 0 HB2 LEU A 113 -3.286 -3.074 -5.676 1.00 0.42 H new ATOM 0 HB3 LEU A 113 -3.513 -4.454 -4.620 1.00 0.42 H new ATOM 0 HG LEU A 113 -2.014 -3.574 -2.981 1.00 0.58 H new ATOM 0 HD11 LEU A 113 -0.820 -1.446 -3.307 1.00 1.33 H new ATOM 0 HD12 LEU A 113 -0.319 -2.674 -4.493 1.00 1.33 H new ATOM 0 HD13 LEU A 113 -1.428 -1.370 -4.978 1.00 1.33 H new ATOM 0 HD21 LEU A 113 -3.086 -1.432 -2.407 1.00 1.17 H new ATOM 0 HD22 LEU A 113 -3.775 -1.344 -4.045 1.00 1.17 H new ATOM 0 HD23 LEU A 113 -4.274 -2.646 -2.939 1.00 1.17 H new ATOM 409 N GLU A 114 -1.642 -6.717 -6.471 1.00 0.34 N ATOM 410 CA GLU A 114 -2.058 -7.794 -7.313 1.00 0.34 C ATOM 411 C GLU A 114 -1.867 -9.113 -6.580 1.00 0.33 C ATOM 412 O GLU A 114 -0.775 -9.674 -6.535 1.00 0.39 O ATOM 413 CB GLU A 114 -1.293 -7.686 -8.636 1.00 0.39 C ATOM 414 CG GLU A 114 -1.914 -8.439 -9.805 1.00 0.47 C ATOM 415 CD GLU A 114 -1.602 -9.918 -9.803 1.00 1.13 C ATOM 416 OE1 GLU A 114 -2.527 -10.727 -9.599 1.00 1.93 O ATOM 417 OE2 GLU A 114 -0.429 -10.283 -10.026 1.00 1.50 O ATOM 0 H GLU A 114 -0.852 -6.922 -5.859 1.00 0.34 H new ATOM 0 HA GLU A 114 -3.120 -7.744 -7.554 1.00 0.34 H new ATOM 0 HB2 GLU A 114 -1.210 -6.633 -8.905 1.00 0.39 H new ATOM 0 HB3 GLU A 114 -0.279 -8.056 -8.483 1.00 0.39 H new ATOM 0 HG2 GLU A 114 -2.995 -8.304 -9.781 1.00 0.47 H new ATOM 0 HG3 GLU A 114 -1.559 -8.002 -10.738 1.00 0.47 H new ATOM 424 N PRO A 115 -2.972 -9.567 -5.962 1.00 0.39 N ATOM 425 CA PRO A 115 -3.059 -10.743 -5.087 1.00 0.46 C ATOM 426 C PRO A 115 -2.142 -11.890 -5.448 1.00 0.45 C ATOM 427 O PRO A 115 -1.916 -12.187 -6.622 1.00 0.49 O ATOM 428 CB PRO A 115 -4.516 -11.125 -5.237 1.00 0.59 C ATOM 429 CG PRO A 115 -5.194 -9.809 -5.273 1.00 0.65 C ATOM 430 CD PRO A 115 -4.278 -8.909 -6.068 1.00 0.53 C ATOM 0 HA PRO A 115 -2.736 -10.515 -4.071 1.00 0.46 H new ATOM 0 HB2 PRO A 115 -4.693 -11.697 -6.148 1.00 0.59 H new ATOM 0 HB3 PRO A 115 -4.862 -11.737 -4.404 1.00 0.59 H new ATOM 0 HG2 PRO A 115 -6.175 -9.885 -5.742 1.00 0.65 H new ATOM 0 HG3 PRO A 115 -5.351 -9.420 -4.267 1.00 0.65 H new ATOM 0 HD2 PRO A 115 -4.601 -8.824 -7.106 1.00 0.53 H new ATOM 0 HD3 PRO A 115 -4.253 -7.899 -5.658 1.00 0.53 H new ATOM 438 N ASP A 116 -1.637 -12.526 -4.390 1.00 0.46 N ATOM 439 CA ASP A 116 -0.588 -13.526 -4.488 1.00 0.49 C ATOM 440 C ASP A 116 0.727 -12.840 -4.823 1.00 0.48 C ATOM 441 O ASP A 116 1.535 -13.309 -5.625 1.00 0.58 O ATOM 442 CB ASP A 116 -0.952 -14.599 -5.495 1.00 0.55 C ATOM 443 CG ASP A 116 0.055 -15.733 -5.541 1.00 0.63 C ATOM 444 OD1 ASP A 116 0.600 -16.011 -6.630 1.00 0.67 O ATOM 445 OD2 ASP A 116 0.309 -16.351 -4.482 1.00 0.72 O ATOM 0 H ASP A 116 -1.952 -12.356 -3.435 1.00 0.46 H new ATOM 0 HA ASP A 116 -0.474 -14.032 -3.530 1.00 0.49 H new ATOM 0 HB2 ASP A 116 -1.934 -15.002 -5.249 1.00 0.55 H new ATOM 0 HB3 ASP A 116 -1.030 -14.149 -6.485 1.00 0.55 H new ATOM 450 N MET A 117 0.913 -11.697 -4.189 1.00 0.39 N ATOM 451 CA MET A 117 2.135 -10.933 -4.302 1.00 0.40 C ATOM 452 C MET A 117 2.793 -10.823 -2.951 1.00 0.37 C ATOM 453 O MET A 117 2.133 -10.897 -1.926 1.00 0.33 O ATOM 454 CB MET A 117 1.893 -9.543 -4.868 1.00 0.42 C ATOM 455 CG MET A 117 0.837 -8.762 -4.137 1.00 0.45 C ATOM 456 SD MET A 117 0.950 -6.998 -4.449 1.00 0.80 S ATOM 457 CE MET A 117 -0.255 -6.386 -3.287 1.00 1.67 C ATOM 0 H MET A 117 0.215 -11.273 -3.578 1.00 0.39 H new ATOM 0 HA MET A 117 2.789 -11.461 -4.996 1.00 0.40 H new ATOM 0 HB2 MET A 117 2.828 -8.983 -4.842 1.00 0.42 H new ATOM 0 HB3 MET A 117 1.604 -9.633 -5.915 1.00 0.42 H new ATOM 0 HG2 MET A 117 -0.148 -9.119 -4.438 1.00 0.45 H new ATOM 0 HG3 MET A 117 0.929 -8.945 -3.067 1.00 0.45 H new ATOM 0 HE1 MET A 117 -0.307 -5.299 -3.355 1.00 1.67 H new ATOM 0 HE2 MET A 117 -1.232 -6.811 -3.518 1.00 1.67 H new ATOM 0 HE3 MET A 117 0.036 -6.673 -2.276 1.00 1.67 H new ATOM 467 N THR A 118 4.087 -10.632 -2.947 1.00 0.41 N ATOM 468 CA THR A 118 4.824 -10.607 -1.713 1.00 0.41 C ATOM 469 C THR A 118 5.107 -9.168 -1.350 1.00 0.43 C ATOM 470 O THR A 118 6.185 -8.628 -1.595 1.00 0.58 O ATOM 471 CB THR A 118 6.118 -11.414 -1.804 1.00 0.49 C ATOM 472 OG1 THR A 118 5.832 -12.716 -2.340 1.00 0.52 O ATOM 473 CG2 THR A 118 6.745 -11.557 -0.424 1.00 0.49 C ATOM 0 H THR A 118 4.651 -10.492 -3.785 1.00 0.41 H new ATOM 0 HA THR A 118 4.224 -11.075 -0.933 1.00 0.41 H new ATOM 0 HB THR A 118 6.818 -10.893 -2.458 1.00 0.49 H new ATOM 0 HG1 THR A 118 6.662 -13.234 -2.401 1.00 0.52 H new ATOM 0 HG21 THR A 118 7.667 -12.134 -0.501 1.00 0.49 H new ATOM 0 HG22 THR A 118 6.968 -10.569 -0.022 1.00 0.49 H new ATOM 0 HG23 THR A 118 6.050 -12.071 0.240 1.00 0.49 H new ATOM 481 N ILE A 119 4.099 -8.569 -0.773 1.00 0.41 N ATOM 482 CA ILE A 119 4.061 -7.149 -0.544 1.00 0.45 C ATOM 483 C ILE A 119 4.314 -6.855 0.930 1.00 0.40 C ATOM 484 O ILE A 119 4.208 -7.760 1.757 1.00 0.38 O ATOM 485 CB ILE A 119 2.701 -6.617 -0.969 1.00 0.53 C ATOM 486 CG1 ILE A 119 2.744 -5.114 -1.010 1.00 0.65 C ATOM 487 CG2 ILE A 119 1.645 -7.126 -0.026 1.00 0.49 C ATOM 488 CD1 ILE A 119 2.394 -4.562 -2.355 1.00 0.56 C ATOM 0 H ILE A 119 3.269 -9.062 -0.444 1.00 0.41 H new ATOM 0 HA ILE A 119 4.838 -6.657 -1.129 1.00 0.45 H new ATOM 0 HB ILE A 119 2.450 -6.971 -1.969 1.00 0.53 H new ATOM 0 HG12 ILE A 119 2.053 -4.715 -0.267 1.00 0.65 H new ATOM 0 HG13 ILE A 119 3.742 -4.776 -0.732 1.00 0.65 H new ATOM 0 HG21 ILE A 119 0.671 -6.745 -0.331 1.00 0.49 H new ATOM 0 HG22 ILE A 119 1.631 -8.216 -0.049 1.00 0.49 H new ATOM 0 HG23 ILE A 119 1.867 -6.787 0.986 1.00 0.49 H new ATOM 0 HD11 ILE A 119 2.441 -3.473 -2.325 1.00 0.56 H new ATOM 0 HD12 ILE A 119 3.100 -4.936 -3.097 1.00 0.56 H new ATOM 0 HD13 ILE A 119 1.385 -4.874 -2.625 1.00 0.56 H new ATOM 500 N SER A 120 4.678 -5.622 1.280 1.00 0.40 N ATOM 501 CA SER A 120 5.049 -5.350 2.642 1.00 0.39 C ATOM 502 C SER A 120 4.572 -3.976 3.059 1.00 0.42 C ATOM 503 O SER A 120 3.993 -3.246 2.249 1.00 0.44 O ATOM 504 CB SER A 120 6.560 -5.485 2.807 1.00 0.36 C ATOM 505 OG SER A 120 7.005 -6.758 2.369 1.00 0.38 O ATOM 0 H SER A 120 4.720 -4.823 0.648 1.00 0.40 H new ATOM 0 HA SER A 120 4.567 -6.079 3.294 1.00 0.39 H new ATOM 0 HB2 SER A 120 7.063 -4.704 2.238 1.00 0.36 H new ATOM 0 HB3 SER A 120 6.830 -5.341 3.853 1.00 0.36 H new ATOM 0 HG SER A 120 7.976 -6.822 2.482 1.00 0.38 H new ATOM 511 N LYS A 121 4.844 -3.618 4.303 1.00 0.45 N ATOM 512 CA LYS A 121 4.666 -2.249 4.767 1.00 0.50 C ATOM 513 C LYS A 121 5.582 -1.363 3.954 1.00 0.44 C ATOM 514 O LYS A 121 5.365 -0.175 3.823 1.00 0.42 O ATOM 515 CB LYS A 121 5.031 -2.123 6.252 1.00 0.62 C ATOM 516 CG LYS A 121 4.391 -3.185 7.125 1.00 0.58 C ATOM 517 CD LYS A 121 5.425 -3.903 7.983 1.00 1.16 C ATOM 518 CE LYS A 121 4.822 -5.067 8.761 1.00 1.76 C ATOM 519 NZ LYS A 121 3.919 -4.620 9.854 1.00 2.33 N ATOM 0 H LYS A 121 5.191 -4.260 5.015 1.00 0.45 H new ATOM 0 HA LYS A 121 3.623 -1.956 4.647 1.00 0.50 H new ATOM 0 HB2 LYS A 121 6.114 -2.181 6.358 1.00 0.62 H new ATOM 0 HB3 LYS A 121 4.728 -1.139 6.610 1.00 0.62 H new ATOM 0 HG2 LYS A 121 3.640 -2.725 7.768 1.00 0.58 H new ATOM 0 HG3 LYS A 121 3.872 -3.909 6.497 1.00 0.58 H new ATOM 0 HD2 LYS A 121 6.229 -4.272 7.347 1.00 1.16 H new ATOM 0 HD3 LYS A 121 5.870 -3.194 8.681 1.00 1.16 H new ATOM 0 HE2 LYS A 121 4.267 -5.708 8.076 1.00 1.76 H new ATOM 0 HE3 LYS A 121 5.625 -5.671 9.183 1.00 1.76 H new ATOM 0 HZ1 LYS A 121 3.211 -5.358 10.043 1.00 2.33 H new ATOM 0 HZ2 LYS A 121 4.476 -4.446 10.715 1.00 2.33 H new ATOM 0 HZ3 LYS A 121 3.438 -3.743 9.570 1.00 2.33 H new ATOM 533 N ASN A 122 6.629 -1.989 3.449 1.00 0.45 N ATOM 534 CA ASN A 122 7.635 -1.343 2.623 1.00 0.47 C ATOM 535 C ASN A 122 7.251 -1.251 1.158 1.00 0.46 C ATOM 536 O ASN A 122 7.789 -0.464 0.428 1.00 0.53 O ATOM 537 CB ASN A 122 8.883 -2.143 2.674 1.00 0.56 C ATOM 538 CG ASN A 122 10.141 -1.321 2.886 1.00 0.79 C ATOM 539 OD1 ASN A 122 10.100 -0.239 3.468 1.00 1.32 O ATOM 540 ND2 ASN A 122 11.272 -1.846 2.440 1.00 1.27 N ATOM 0 H ASN A 122 6.808 -2.981 3.604 1.00 0.45 H new ATOM 0 HA ASN A 122 7.749 -0.334 3.019 1.00 0.47 H new ATOM 0 HB2 ASN A 122 8.800 -2.874 3.479 1.00 0.56 H new ATOM 0 HB3 ASN A 122 8.981 -2.703 1.744 1.00 0.56 H new ATOM 0 HD21 ASN A 122 12.153 -1.349 2.575 1.00 1.27 H new ATOM 0 HD22 ASN A 122 11.262 -2.747 1.962 1.00 1.27 H new ATOM 547 N GLU A 123 6.403 -2.086 0.665 1.00 0.43 N ATOM 548 CA GLU A 123 5.998 -1.899 -0.695 1.00 0.46 C ATOM 549 C GLU A 123 4.946 -0.819 -0.691 1.00 0.46 C ATOM 550 O GLU A 123 5.116 0.273 -1.240 1.00 0.59 O ATOM 551 CB GLU A 123 5.437 -3.192 -1.214 1.00 0.51 C ATOM 552 CG GLU A 123 6.091 -3.724 -2.472 1.00 0.78 C ATOM 553 CD GLU A 123 7.530 -4.138 -2.255 1.00 1.23 C ATOM 554 OE1 GLU A 123 7.768 -5.168 -1.593 1.00 1.57 O ATOM 555 OE2 GLU A 123 8.436 -3.423 -2.732 1.00 2.06 O ATOM 0 H GLU A 123 5.987 -2.877 1.156 1.00 0.43 H new ATOM 0 HA GLU A 123 6.830 -1.608 -1.336 1.00 0.46 H new ATOM 0 HB2 GLU A 123 5.524 -3.946 -0.432 1.00 0.51 H new ATOM 0 HB3 GLU A 123 4.373 -3.055 -1.408 1.00 0.51 H new ATOM 0 HG2 GLU A 123 5.523 -4.579 -2.837 1.00 0.78 H new ATOM 0 HG3 GLU A 123 6.051 -2.960 -3.248 1.00 0.78 H new ATOM 562 N MET A 124 3.896 -1.138 0.020 1.00 0.41 N ATOM 563 CA MET A 124 2.798 -0.216 0.291 1.00 0.40 C ATOM 564 C MET A 124 3.271 1.034 0.981 1.00 0.36 C ATOM 565 O MET A 124 2.543 2.008 1.020 1.00 0.38 O ATOM 566 CB MET A 124 1.739 -0.893 1.126 1.00 0.47 C ATOM 567 CG MET A 124 0.886 -1.867 0.341 1.00 1.17 C ATOM 568 SD MET A 124 0.137 -1.095 -1.106 1.00 2.20 S ATOM 569 CE MET A 124 1.393 -1.362 -2.349 1.00 3.13 C ATOM 0 H MET A 124 3.767 -2.059 0.439 1.00 0.41 H new ATOM 0 HA MET A 124 2.373 0.074 -0.670 1.00 0.40 H new ATOM 0 HB2 MET A 124 2.219 -1.423 1.948 1.00 0.47 H new ATOM 0 HB3 MET A 124 1.095 -0.133 1.569 1.00 0.47 H new ATOM 0 HG2 MET A 124 1.498 -2.712 0.025 1.00 1.17 H new ATOM 0 HG3 MET A 124 0.103 -2.264 0.986 1.00 1.17 H new ATOM 0 HE1 MET A 124 1.338 -0.572 -3.097 1.00 3.13 H new ATOM 0 HE2 MET A 124 2.377 -1.350 -1.880 1.00 3.13 H new ATOM 0 HE3 MET A 124 1.231 -2.327 -2.828 1.00 3.13 H new ATOM 579 N VAL A 125 4.468 0.995 1.553 1.00 0.35 N ATOM 580 CA VAL A 125 5.040 2.161 2.208 1.00 0.32 C ATOM 581 C VAL A 125 4.821 3.394 1.375 1.00 0.30 C ATOM 582 O VAL A 125 4.493 4.464 1.873 1.00 0.29 O ATOM 583 CB VAL A 125 6.556 2.018 2.459 1.00 0.34 C ATOM 584 CG1 VAL A 125 7.365 2.023 1.168 1.00 0.37 C ATOM 585 CG2 VAL A 125 7.031 3.130 3.370 1.00 0.34 C ATOM 0 H VAL A 125 5.061 0.166 1.576 1.00 0.35 H new ATOM 0 HA VAL A 125 4.533 2.246 3.169 1.00 0.32 H new ATOM 0 HB VAL A 125 6.716 1.050 2.935 1.00 0.34 H new ATOM 0 HG11 VAL A 125 8.425 1.920 1.402 1.00 0.37 H new ATOM 0 HG12 VAL A 125 7.050 1.191 0.538 1.00 0.37 H new ATOM 0 HG13 VAL A 125 7.200 2.962 0.639 1.00 0.37 H new ATOM 0 HG21 VAL A 125 8.102 3.025 3.544 1.00 0.34 H new ATOM 0 HG22 VAL A 125 6.832 4.094 2.902 1.00 0.34 H new ATOM 0 HG23 VAL A 125 6.501 3.073 4.321 1.00 0.34 H new ATOM 595 N LYS A 126 5.017 3.222 0.098 1.00 0.33 N ATOM 596 CA LYS A 126 4.823 4.310 -0.833 1.00 0.35 C ATOM 597 C LYS A 126 3.386 4.740 -0.975 1.00 0.39 C ATOM 598 O LYS A 126 3.123 5.919 -1.135 1.00 0.41 O ATOM 599 CB LYS A 126 5.414 3.943 -2.156 1.00 0.39 C ATOM 600 CG LYS A 126 6.910 3.930 -2.118 1.00 0.37 C ATOM 601 CD LYS A 126 7.497 5.266 -1.656 1.00 0.38 C ATOM 602 CE LYS A 126 7.744 5.320 -0.145 1.00 0.41 C ATOM 603 NZ LYS A 126 9.044 4.718 0.246 1.00 0.63 N ATOM 0 H LYS A 126 5.311 2.342 -0.327 1.00 0.33 H new ATOM 0 HA LYS A 126 5.340 5.179 -0.425 1.00 0.35 H new ATOM 0 HB2 LYS A 126 5.050 2.960 -2.455 1.00 0.39 H new ATOM 0 HB3 LYS A 126 5.077 4.651 -2.913 1.00 0.39 H new ATOM 0 HG2 LYS A 126 7.246 3.138 -1.448 1.00 0.37 H new ATOM 0 HG3 LYS A 126 7.293 3.692 -3.110 1.00 0.37 H new ATOM 0 HD2 LYS A 126 8.437 5.444 -2.179 1.00 0.38 H new ATOM 0 HD3 LYS A 126 6.818 6.071 -1.937 1.00 0.38 H new ATOM 0 HE2 LYS A 126 7.715 6.358 0.187 1.00 0.41 H new ATOM 0 HE3 LYS A 126 6.937 4.798 0.370 1.00 0.41 H new ATOM 0 HZ1 LYS A 126 9.206 4.871 1.262 1.00 0.63 H new ATOM 0 HZ2 LYS A 126 9.027 3.697 0.048 1.00 0.63 H new ATOM 0 HZ3 LYS A 126 9.810 5.163 -0.298 1.00 0.63 H new ATOM 617 N LEU A 127 2.474 3.797 -0.949 1.00 0.44 N ATOM 618 CA LEU A 127 1.062 4.105 -0.805 1.00 0.50 C ATOM 619 C LEU A 127 0.835 4.918 0.459 1.00 0.43 C ATOM 620 O LEU A 127 -0.023 5.792 0.512 1.00 0.49 O ATOM 621 CB LEU A 127 0.263 2.804 -0.730 1.00 0.56 C ATOM 622 CG LEU A 127 -1.255 2.945 -0.605 1.00 0.67 C ATOM 623 CD1 LEU A 127 -1.660 3.184 0.826 1.00 1.47 C ATOM 624 CD2 LEU A 127 -1.781 4.067 -1.490 1.00 1.79 C ATOM 0 H LEU A 127 2.682 2.801 -1.026 1.00 0.44 H new ATOM 0 HA LEU A 127 0.731 4.687 -1.666 1.00 0.50 H new ATOM 0 HB2 LEU A 127 0.479 2.218 -1.623 1.00 0.56 H new ATOM 0 HB3 LEU A 127 0.624 2.230 0.123 1.00 0.56 H new ATOM 0 HG LEU A 127 -1.697 2.007 -0.940 1.00 0.67 H new ATOM 0 HD11 LEU A 127 -2.744 3.281 0.886 1.00 1.47 H new ATOM 0 HD12 LEU A 127 -1.336 2.344 1.441 1.00 1.47 H new ATOM 0 HD13 LEU A 127 -1.194 4.100 1.188 1.00 1.47 H new ATOM 0 HD21 LEU A 127 -2.863 4.142 -1.379 1.00 1.79 H new ATOM 0 HD22 LEU A 127 -1.320 5.010 -1.195 1.00 1.79 H new ATOM 0 HD23 LEU A 127 -1.537 3.854 -2.531 1.00 1.79 H new ATOM 636 N LEU A 128 1.620 4.632 1.467 1.00 0.34 N ATOM 637 CA LEU A 128 1.378 5.190 2.782 1.00 0.30 C ATOM 638 C LEU A 128 1.995 6.559 2.852 1.00 0.32 C ATOM 639 O LEU A 128 1.532 7.441 3.558 1.00 0.36 O ATOM 640 CB LEU A 128 1.935 4.271 3.859 1.00 0.27 C ATOM 641 CG LEU A 128 1.707 2.783 3.597 1.00 0.32 C ATOM 642 CD1 LEU A 128 2.361 1.952 4.677 1.00 0.38 C ATOM 643 CD2 LEU A 128 0.221 2.466 3.493 1.00 0.34 C ATOM 0 H LEU A 128 2.432 4.018 1.407 1.00 0.34 H new ATOM 0 HA LEU A 128 0.306 5.279 2.956 1.00 0.30 H new ATOM 0 HB2 LEU A 128 3.006 4.451 3.955 1.00 0.27 H new ATOM 0 HB3 LEU A 128 1.481 4.533 4.814 1.00 0.27 H new ATOM 0 HG LEU A 128 2.167 2.531 2.642 1.00 0.32 H new ATOM 0 HD11 LEU A 128 2.190 0.894 4.476 1.00 0.38 H new ATOM 0 HD12 LEU A 128 3.433 2.150 4.690 1.00 0.38 H new ATOM 0 HD13 LEU A 128 1.933 2.212 5.645 1.00 0.38 H new ATOM 0 HD21 LEU A 128 0.089 1.400 3.306 1.00 0.34 H new ATOM 0 HD22 LEU A 128 -0.275 2.735 4.426 1.00 0.34 H new ATOM 0 HD23 LEU A 128 -0.216 3.035 2.672 1.00 0.34 H new ATOM 655 N GLU A 129 3.067 6.692 2.118 1.00 0.30 N ATOM 656 CA GLU A 129 3.699 7.964 1.848 1.00 0.35 C ATOM 657 C GLU A 129 2.826 8.793 0.917 1.00 0.44 C ATOM 658 O GLU A 129 2.809 10.020 0.964 1.00 0.56 O ATOM 659 CB GLU A 129 5.034 7.684 1.193 1.00 0.35 C ATOM 660 CG GLU A 129 6.113 8.652 1.627 1.00 0.91 C ATOM 661 CD GLU A 129 6.409 8.565 3.112 1.00 1.04 C ATOM 662 OE1 GLU A 129 7.418 7.935 3.492 1.00 1.96 O ATOM 663 OE2 GLU A 129 5.631 9.130 3.909 1.00 1.41 O ATOM 0 H GLU A 129 3.540 5.902 1.679 1.00 0.30 H new ATOM 0 HA GLU A 129 3.837 8.525 2.773 1.00 0.35 H new ATOM 0 HB2 GLU A 129 5.346 6.668 1.433 1.00 0.35 H new ATOM 0 HB3 GLU A 129 4.920 7.735 0.110 1.00 0.35 H new ATOM 0 HG2 GLU A 129 7.025 8.450 1.066 1.00 0.91 H new ATOM 0 HG3 GLU A 129 5.806 9.668 1.380 1.00 0.91 H new ATOM 670 N ALA A 130 2.116 8.077 0.072 1.00 0.45 N ATOM 671 CA ALA A 130 1.199 8.643 -0.903 1.00 0.54 C ATOM 672 C ALA A 130 -0.052 9.171 -0.241 1.00 0.56 C ATOM 673 O ALA A 130 -0.522 10.269 -0.535 1.00 0.64 O ATOM 674 CB ALA A 130 0.816 7.561 -1.882 1.00 0.58 C ATOM 0 H ALA A 130 2.159 7.058 0.041 1.00 0.45 H new ATOM 0 HA ALA A 130 1.693 9.473 -1.408 1.00 0.54 H new ATOM 0 HB1 ALA A 130 0.127 7.968 -2.622 1.00 0.58 H new ATOM 0 HB2 ALA A 130 1.710 7.191 -2.383 1.00 0.58 H new ATOM 0 HB3 ALA A 130 0.333 6.742 -1.349 1.00 0.58 H new ATOM 680 N THR A 131 -0.573 8.373 0.670 1.00 0.48 N ATOM 681 CA THR A 131 -1.794 8.696 1.362 1.00 0.46 C ATOM 682 C THR A 131 -1.386 9.405 2.634 1.00 0.45 C ATOM 683 O THR A 131 -2.179 9.930 3.397 1.00 0.52 O ATOM 684 CB THR A 131 -2.658 7.411 1.567 1.00 0.39 C ATOM 685 OG1 THR A 131 -4.046 7.713 1.388 1.00 0.59 O ATOM 686 CG2 THR A 131 -2.466 6.765 2.928 1.00 0.57 C ATOM 0 H THR A 131 -0.158 7.484 0.948 1.00 0.48 H new ATOM 0 HA THR A 131 -2.444 9.362 0.795 1.00 0.46 H new ATOM 0 HB THR A 131 -2.318 6.698 0.816 1.00 0.39 H new ATOM 0 HG1 THR A 131 -4.497 6.947 0.976 1.00 0.59 H new ATOM 0 HG21 THR A 131 -3.096 5.878 3.002 1.00 0.57 H new ATOM 0 HG22 THR A 131 -1.421 6.479 3.051 1.00 0.57 H new ATOM 0 HG23 THR A 131 -2.743 7.473 3.709 1.00 0.57 H new ATOM 694 N GLN A 132 -0.081 9.488 2.746 1.00 0.44 N ATOM 695 CA GLN A 132 0.605 10.285 3.718 1.00 0.46 C ATOM 696 C GLN A 132 0.142 9.977 5.127 1.00 0.42 C ATOM 697 O GLN A 132 -0.202 10.880 5.890 1.00 0.49 O ATOM 698 CB GLN A 132 0.396 11.746 3.397 1.00 0.56 C ATOM 699 CG GLN A 132 0.445 12.035 1.911 1.00 0.62 C ATOM 700 CD GLN A 132 1.546 13.003 1.520 1.00 1.03 C ATOM 701 OE1 GLN A 132 2.659 12.970 2.235 1.00 1.53 O flip ATOM 702 NE2 GLN A 132 1.400 13.766 0.567 1.00 1.80 N flip ATOM 0 H GLN A 132 0.553 8.977 2.132 1.00 0.44 H new ATOM 0 HA GLN A 132 1.668 10.046 3.673 1.00 0.46 H new ATOM 0 HB2 GLN A 132 -0.568 12.066 3.793 1.00 0.56 H new ATOM 0 HB3 GLN A 132 1.160 12.337 3.902 1.00 0.56 H new ATOM 0 HG2 GLN A 132 0.586 11.099 1.371 1.00 0.62 H new ATOM 0 HG3 GLN A 132 -0.516 12.443 1.596 1.00 0.62 H new ATOM 0 HE21 GLN A 132 0.527 13.762 0.040 1.00 1.80 H new ATOM 0 HE22 GLN A 132 2.152 14.403 0.304 1.00 1.80 H new ATOM 711 N TYR A 133 0.133 8.708 5.475 1.00 0.33 N ATOM 712 CA TYR A 133 -0.403 8.307 6.742 1.00 0.30 C ATOM 713 C TYR A 133 0.541 7.409 7.499 1.00 0.27 C ATOM 714 O TYR A 133 1.604 7.028 7.004 1.00 0.27 O ATOM 715 CB TYR A 133 -1.748 7.609 6.598 1.00 0.27 C ATOM 716 CG TYR A 133 -2.552 7.722 7.852 1.00 0.30 C ATOM 717 CD1 TYR A 133 -3.302 6.639 8.288 1.00 0.27 C ATOM 718 CD2 TYR A 133 -2.596 8.895 8.578 1.00 0.40 C ATOM 719 CE1 TYR A 133 -4.073 6.717 9.412 1.00 0.34 C ATOM 720 CE2 TYR A 133 -3.363 8.973 9.719 1.00 0.46 C ATOM 721 CZ TYR A 133 -3.972 7.984 10.203 1.00 0.41 C ATOM 722 OH TYR A 133 -4.884 7.948 11.255 1.00 0.52 O ATOM 0 H TYR A 133 0.490 7.947 4.898 1.00 0.33 H new ATOM 0 HA TYR A 133 -0.542 9.228 7.308 1.00 0.30 H new ATOM 0 HB2 TYR A 133 -2.301 8.047 5.767 1.00 0.27 H new ATOM 0 HB3 TYR A 133 -1.591 6.558 6.357 1.00 0.27 H new ATOM 0 HD1 TYR A 133 -3.275 5.716 7.727 1.00 0.27 H new ATOM 0 HD2 TYR A 133 -2.028 9.753 8.251 1.00 0.40 H new ATOM 0 HE1 TYR A 133 -4.721 5.908 9.714 1.00 0.34 H new ATOM 0 HE2 TYR A 133 -3.446 9.926 10.221 1.00 0.46 H new ATOM 0 HH TYR A 133 -4.818 8.777 11.774 1.00 0.52 H new ATOM 732 N ARG A 134 0.138 7.092 8.713 1.00 0.28 N ATOM 733 CA ARG A 134 0.861 6.198 9.552 1.00 0.29 C ATOM 734 C ARG A 134 -0.172 5.362 10.271 1.00 0.27 C ATOM 735 O ARG A 134 -1.284 5.832 10.513 1.00 0.28 O ATOM 736 CB ARG A 134 1.751 6.968 10.521 1.00 0.38 C ATOM 737 CG ARG A 134 0.998 7.984 11.362 1.00 1.16 C ATOM 738 CD ARG A 134 1.939 8.817 12.210 1.00 1.83 C ATOM 739 NE ARG A 134 1.235 9.904 12.887 1.00 2.68 N ATOM 740 CZ ARG A 134 1.255 11.171 12.474 1.00 3.59 C ATOM 741 NH1 ARG A 134 1.924 11.506 11.377 1.00 3.92 N ATOM 742 NH2 ARG A 134 0.605 12.103 13.159 1.00 4.54 N ATOM 0 H ARG A 134 -0.714 7.460 9.137 1.00 0.28 H new ATOM 0 HA ARG A 134 1.531 5.559 8.977 1.00 0.29 H new ATOM 0 HB2 ARG A 134 2.251 6.260 11.182 1.00 0.38 H new ATOM 0 HB3 ARG A 134 2.529 7.481 9.957 1.00 0.38 H new ATOM 0 HG2 ARG A 134 0.419 8.639 10.710 1.00 1.16 H new ATOM 0 HG3 ARG A 134 0.287 7.467 12.007 1.00 1.16 H new ATOM 0 HD2 ARG A 134 2.423 8.180 12.950 1.00 1.83 H new ATOM 0 HD3 ARG A 134 2.727 9.230 11.581 1.00 1.83 H new ATOM 0 HE ARG A 134 0.697 9.680 13.724 1.00 2.68 H new ATOM 0 HH11 ARG A 134 2.425 10.793 10.847 1.00 3.92 H new ATOM 0 HH12 ARG A 134 1.937 12.477 11.064 1.00 3.92 H new ATOM 0 HH21 ARG A 134 0.090 11.850 14.002 1.00 4.54 H new ATOM 0 HH22 ARG A 134 0.621 13.073 12.843 1.00 4.54 H new ATOM 756 N GLN A 135 0.184 4.143 10.588 1.00 0.27 N ATOM 757 CA GLN A 135 -0.762 3.140 11.028 1.00 0.27 C ATOM 758 C GLN A 135 -1.657 3.600 12.157 1.00 0.29 C ATOM 759 O GLN A 135 -1.248 4.276 13.105 1.00 0.32 O ATOM 760 CB GLN A 135 -0.022 1.890 11.380 1.00 0.29 C ATOM 761 CG GLN A 135 -0.934 0.733 11.748 1.00 0.30 C ATOM 762 CD GLN A 135 -1.158 0.613 13.245 1.00 0.38 C ATOM 763 OE1 GLN A 135 -0.301 0.984 14.045 1.00 1.10 O ATOM 764 NE2 GLN A 135 -2.307 0.088 13.634 1.00 1.28 N ATOM 0 H GLN A 135 1.148 3.812 10.549 1.00 0.27 H new ATOM 0 HA GLN A 135 -1.443 2.943 10.200 1.00 0.27 H new ATOM 0 HB2 GLN A 135 0.603 1.597 10.536 1.00 0.29 H new ATOM 0 HB3 GLN A 135 0.647 2.096 12.216 1.00 0.29 H new ATOM 0 HG2 GLN A 135 -1.895 0.862 11.251 1.00 0.30 H new ATOM 0 HG3 GLN A 135 -0.504 -0.196 11.374 1.00 0.30 H new ATOM 0 HE21 GLN A 135 -2.993 -0.208 12.940 1.00 1.28 H new ATOM 0 HE22 GLN A 135 -2.507 -0.021 14.628 1.00 1.28 H new ATOM 773 N VAL A 136 -2.886 3.169 12.023 1.00 0.31 N ATOM 774 CA VAL A 136 -4.007 3.733 12.706 1.00 0.37 C ATOM 775 C VAL A 136 -4.921 2.629 13.238 1.00 0.43 C ATOM 776 O VAL A 136 -5.045 1.564 12.624 1.00 0.48 O ATOM 777 CB VAL A 136 -4.675 4.618 11.660 1.00 0.47 C ATOM 778 CG1 VAL A 136 -5.192 3.804 10.530 1.00 1.05 C ATOM 779 CG2 VAL A 136 -5.766 5.478 12.177 1.00 0.92 C ATOM 0 H VAL A 136 -3.135 2.390 11.414 1.00 0.31 H new ATOM 0 HA VAL A 136 -3.735 4.313 13.588 1.00 0.37 H new ATOM 0 HB VAL A 136 -3.885 5.289 11.324 1.00 0.47 H new ATOM 0 HG11 VAL A 136 -5.664 4.458 9.797 1.00 1.05 H new ATOM 0 HG12 VAL A 136 -4.367 3.268 10.060 1.00 1.05 H new ATOM 0 HG13 VAL A 136 -5.925 3.088 10.903 1.00 1.05 H new ATOM 0 HG21 VAL A 136 -6.180 6.071 11.361 1.00 0.92 H new ATOM 0 HG22 VAL A 136 -6.550 4.853 12.606 1.00 0.92 H new ATOM 0 HG23 VAL A 136 -5.372 6.143 12.945 1.00 0.92 H new ATOM 789 N SER A 137 -5.518 2.879 14.408 1.00 0.49 N ATOM 790 CA SER A 137 -6.398 1.910 15.064 1.00 0.57 C ATOM 791 C SER A 137 -7.544 1.586 14.146 1.00 0.53 C ATOM 792 O SER A 137 -8.056 0.468 14.091 1.00 0.60 O ATOM 793 CB SER A 137 -6.972 2.497 16.354 1.00 0.67 C ATOM 794 OG SER A 137 -7.452 1.482 17.219 1.00 1.38 O ATOM 0 H SER A 137 -5.405 3.752 14.923 1.00 0.49 H new ATOM 0 HA SER A 137 -5.820 1.015 15.296 1.00 0.57 H new ATOM 0 HB2 SER A 137 -6.203 3.078 16.864 1.00 0.67 H new ATOM 0 HB3 SER A 137 -7.783 3.184 16.113 1.00 0.67 H new ATOM 0 HG SER A 137 -7.811 1.890 18.035 1.00 1.38 H new ATOM 800 N LYS A 138 -7.912 2.605 13.429 1.00 0.47 N ATOM 801 CA LYS A 138 -8.995 2.554 12.481 1.00 0.46 C ATOM 802 C LYS A 138 -8.842 3.675 11.502 1.00 0.43 C ATOM 803 O LYS A 138 -8.698 4.836 11.880 1.00 0.44 O ATOM 804 CB LYS A 138 -10.343 2.687 13.141 1.00 0.51 C ATOM 805 CG LYS A 138 -11.455 2.979 12.137 1.00 0.55 C ATOM 806 CD LYS A 138 -12.392 4.096 12.584 1.00 0.82 C ATOM 807 CE LYS A 138 -11.647 5.385 12.915 1.00 0.92 C ATOM 808 NZ LYS A 138 -12.552 6.418 13.481 1.00 1.44 N ATOM 0 H LYS A 138 -7.460 3.518 13.485 1.00 0.47 H new ATOM 0 HA LYS A 138 -8.950 1.582 11.989 1.00 0.46 H new ATOM 0 HB2 LYS A 138 -10.574 1.767 13.678 1.00 0.51 H new ATOM 0 HB3 LYS A 138 -10.305 3.487 13.881 1.00 0.51 H new ATOM 0 HG2 LYS A 138 -11.009 3.249 11.180 1.00 0.55 H new ATOM 0 HG3 LYS A 138 -12.035 2.071 11.973 1.00 0.55 H new ATOM 0 HD2 LYS A 138 -13.120 4.293 11.797 1.00 0.82 H new ATOM 0 HD3 LYS A 138 -12.951 3.768 13.460 1.00 0.82 H new ATOM 0 HE2 LYS A 138 -10.850 5.171 13.627 1.00 0.92 H new ATOM 0 HE3 LYS A 138 -11.173 5.772 12.013 1.00 0.92 H new ATOM 0 HZ1 LYS A 138 -12.007 7.278 13.692 1.00 1.44 H new ATOM 0 HZ2 LYS A 138 -13.298 6.641 12.792 1.00 1.44 H new ATOM 0 HZ3 LYS A 138 -12.985 6.059 14.356 1.00 1.44 H new ATOM 822 N MET A 139 -8.892 3.336 10.258 1.00 0.42 N ATOM 823 CA MET A 139 -8.741 4.307 9.224 1.00 0.41 C ATOM 824 C MET A 139 -10.004 4.426 8.397 1.00 0.46 C ATOM 825 O MET A 139 -10.535 3.431 7.904 1.00 0.57 O ATOM 826 CB MET A 139 -7.555 3.911 8.355 1.00 0.41 C ATOM 827 CG MET A 139 -7.862 3.794 6.868 1.00 0.61 C ATOM 828 SD MET A 139 -7.532 2.156 6.185 1.00 0.90 S ATOM 829 CE MET A 139 -8.786 1.168 6.992 1.00 0.54 C ATOM 0 H MET A 139 -9.038 2.382 9.928 1.00 0.42 H new ATOM 0 HA MET A 139 -8.558 5.285 9.669 1.00 0.41 H new ATOM 0 HB2 MET A 139 -6.762 4.646 8.491 1.00 0.41 H new ATOM 0 HB3 MET A 139 -7.168 2.955 8.708 1.00 0.41 H new ATOM 0 HG2 MET A 139 -8.910 4.043 6.702 1.00 0.61 H new ATOM 0 HG3 MET A 139 -7.270 4.530 6.325 1.00 0.61 H new ATOM 0 HE1 MET A 139 -8.415 0.153 7.132 1.00 0.54 H new ATOM 0 HE2 MET A 139 -9.025 1.604 7.962 1.00 0.54 H new ATOM 0 HE3 MET A 139 -9.684 1.144 6.374 1.00 0.54 H new ATOM 839 N THR A 140 -10.528 5.625 8.304 1.00 0.42 N ATOM 840 CA THR A 140 -11.319 5.968 7.158 1.00 0.43 C ATOM 841 C THR A 140 -11.356 7.472 6.996 1.00 0.41 C ATOM 842 O THR A 140 -12.121 8.193 7.642 1.00 0.48 O ATOM 843 CB THR A 140 -12.747 5.397 7.304 1.00 0.53 C ATOM 844 OG1 THR A 140 -13.618 5.937 6.302 1.00 0.61 O ATOM 845 CG2 THR A 140 -13.308 5.669 8.700 1.00 0.58 C ATOM 0 H THR A 140 -10.421 6.365 8.998 1.00 0.42 H new ATOM 0 HA THR A 140 -10.869 5.531 6.266 1.00 0.43 H new ATOM 0 HB THR A 140 -12.688 4.318 7.164 1.00 0.53 H new ATOM 0 HG1 THR A 140 -14.516 5.561 6.412 1.00 0.61 H new ATOM 0 HG21 THR A 140 -14.314 5.256 8.775 1.00 0.58 H new ATOM 0 HG22 THR A 140 -12.667 5.201 9.447 1.00 0.58 H new ATOM 0 HG23 THR A 140 -13.343 6.744 8.875 1.00 0.58 H new ATOM 853 N ARG A 141 -10.486 7.908 6.116 1.00 0.35 N ATOM 854 CA ARG A 141 -10.472 9.219 5.509 1.00 0.36 C ATOM 855 C ARG A 141 -9.511 9.137 4.322 1.00 0.32 C ATOM 856 O ARG A 141 -8.696 8.214 4.277 1.00 0.32 O ATOM 857 CB ARG A 141 -10.051 10.273 6.532 1.00 0.40 C ATOM 858 CG ARG A 141 -9.216 9.687 7.643 1.00 0.43 C ATOM 859 CD ARG A 141 -9.831 9.926 9.000 1.00 0.53 C ATOM 860 NE ARG A 141 -9.673 11.311 9.436 1.00 0.87 N ATOM 861 CZ ARG A 141 -9.750 11.703 10.702 1.00 1.27 C ATOM 862 NH1 ARG A 141 -10.024 10.825 11.660 1.00 1.53 N ATOM 863 NH2 ARG A 141 -9.562 12.980 11.007 1.00 1.77 N ATOM 0 H ARG A 141 -9.721 7.320 5.784 1.00 0.35 H new ATOM 0 HA ARG A 141 -11.461 9.519 5.162 1.00 0.36 H new ATOM 0 HB2 ARG A 141 -9.486 11.058 6.030 1.00 0.40 H new ATOM 0 HB3 ARG A 141 -10.940 10.741 6.956 1.00 0.40 H new ATOM 0 HG2 ARG A 141 -9.099 8.615 7.482 1.00 0.43 H new ATOM 0 HG3 ARG A 141 -8.218 10.124 7.615 1.00 0.43 H new ATOM 0 HD2 ARG A 141 -10.891 9.675 8.967 1.00 0.53 H new ATOM 0 HD3 ARG A 141 -9.369 9.261 9.730 1.00 0.53 H new ATOM 0 HE ARG A 141 -9.493 12.020 8.725 1.00 0.87 H new ATOM 0 HH11 ARG A 141 -10.176 9.844 11.425 1.00 1.53 H new ATOM 0 HH12 ARG A 141 -10.082 11.131 12.631 1.00 1.53 H new ATOM 0 HH21 ARG A 141 -9.359 13.656 10.270 1.00 1.77 H new ATOM 0 HH22 ARG A 141 -9.620 13.286 11.978 1.00 1.77 H new ATOM 877 N PRO A 142 -9.567 10.050 3.354 1.00 0.35 N ATOM 878 CA PRO A 142 -8.566 10.088 2.278 1.00 0.36 C ATOM 879 C PRO A 142 -7.176 10.433 2.824 1.00 0.30 C ATOM 880 O PRO A 142 -6.981 11.538 3.338 1.00 0.33 O ATOM 881 CB PRO A 142 -9.067 11.212 1.361 1.00 0.45 C ATOM 882 CG PRO A 142 -10.493 11.431 1.742 1.00 0.62 C ATOM 883 CD PRO A 142 -10.586 11.095 3.202 1.00 0.44 C ATOM 0 HA PRO A 142 -8.462 9.128 1.772 1.00 0.36 H new ATOM 0 HB2 PRO A 142 -8.480 12.121 1.497 1.00 0.45 H new ATOM 0 HB3 PRO A 142 -8.980 10.931 0.312 1.00 0.45 H new ATOM 0 HG2 PRO A 142 -10.792 12.463 1.559 1.00 0.62 H new ATOM 0 HG3 PRO A 142 -11.156 10.798 1.153 1.00 0.62 H new ATOM 0 HD2 PRO A 142 -10.377 11.960 3.831 1.00 0.44 H new ATOM 0 HD3 PRO A 142 -11.579 10.736 3.473 1.00 0.44 H new ATOM 891 N GLY A 143 -6.205 9.518 2.704 1.00 0.32 N ATOM 892 CA GLY A 143 -4.925 9.748 3.321 1.00 0.36 C ATOM 893 C GLY A 143 -4.678 8.861 4.528 1.00 0.35 C ATOM 894 O GLY A 143 -3.856 9.192 5.377 1.00 0.51 O ATOM 0 H GLY A 143 -6.292 8.638 2.196 1.00 0.32 H new ATOM 0 HA2 GLY A 143 -4.138 9.578 2.586 1.00 0.36 H new ATOM 0 HA3 GLY A 143 -4.857 10.793 3.625 1.00 0.36 H new ATOM 898 N GLU A 144 -5.388 7.742 4.616 1.00 0.27 N ATOM 899 CA GLU A 144 -5.273 6.838 5.750 1.00 0.28 C ATOM 900 C GLU A 144 -5.169 5.374 5.299 1.00 0.29 C ATOM 901 O GLU A 144 -5.556 5.028 4.181 1.00 0.43 O ATOM 902 CB GLU A 144 -6.475 7.026 6.684 1.00 0.30 C ATOM 903 CG GLU A 144 -6.279 8.096 7.746 1.00 0.71 C ATOM 904 CD GLU A 144 -6.179 9.522 7.231 1.00 1.59 C ATOM 905 OE1 GLU A 144 -6.767 9.832 6.180 1.00 2.16 O ATOM 906 OE2 GLU A 144 -5.546 10.354 7.914 1.00 1.95 O ATOM 0 H GLU A 144 -6.055 7.439 3.907 1.00 0.27 H new ATOM 0 HA GLU A 144 -4.355 7.080 6.286 1.00 0.28 H new ATOM 0 HB2 GLU A 144 -7.350 7.280 6.085 1.00 0.30 H new ATOM 0 HB3 GLU A 144 -6.690 6.077 7.176 1.00 0.30 H new ATOM 0 HG2 GLU A 144 -7.109 8.040 8.450 1.00 0.71 H new ATOM 0 HG3 GLU A 144 -5.372 7.866 8.305 1.00 0.71 H new ATOM 913 N PHE A 145 -4.643 4.528 6.190 1.00 0.22 N ATOM 914 CA PHE A 145 -4.468 3.087 5.939 1.00 0.21 C ATOM 915 C PHE A 145 -4.242 2.409 7.262 1.00 0.22 C ATOM 916 O PHE A 145 -3.919 3.075 8.231 1.00 0.28 O ATOM 917 CB PHE A 145 -3.233 2.791 5.098 1.00 0.18 C ATOM 918 CG PHE A 145 -1.959 3.135 5.794 1.00 0.15 C ATOM 919 CD1 PHE A 145 -1.337 2.214 6.597 1.00 0.16 C ATOM 920 CD2 PHE A 145 -1.373 4.385 5.623 1.00 0.16 C ATOM 921 CE1 PHE A 145 -0.159 2.526 7.225 1.00 0.17 C ATOM 922 CE2 PHE A 145 -0.193 4.698 6.249 1.00 0.18 C ATOM 923 CZ PHE A 145 0.385 3.778 7.111 1.00 0.18 C ATOM 0 H PHE A 145 -4.323 4.822 7.113 1.00 0.22 H new ATOM 0 HA PHE A 145 -5.356 2.736 5.414 1.00 0.21 H new ATOM 0 HB2 PHE A 145 -3.223 1.733 4.836 1.00 0.18 H new ATOM 0 HB3 PHE A 145 -3.293 3.350 4.164 1.00 0.18 H new ATOM 0 HD1 PHE A 145 -1.777 1.238 6.736 1.00 0.16 H new ATOM 0 HD2 PHE A 145 -1.852 5.117 4.990 1.00 0.16 H new ATOM 0 HE1 PHE A 145 0.346 1.776 7.816 1.00 0.17 H new ATOM 0 HE2 PHE A 145 0.281 5.652 6.072 1.00 0.18 H new ATOM 0 HZ PHE A 145 1.257 4.047 7.688 1.00 0.18 H new ATOM 933 N THR A 146 -4.305 1.098 7.293 1.00 0.24 N ATOM 934 CA THR A 146 -3.965 0.394 8.503 1.00 0.24 C ATOM 935 C THR A 146 -3.043 -0.772 8.227 1.00 0.22 C ATOM 936 O THR A 146 -3.331 -1.622 7.391 1.00 0.24 O ATOM 937 CB THR A 146 -5.190 -0.113 9.283 1.00 0.27 C ATOM 938 OG1 THR A 146 -5.696 -1.318 8.712 1.00 0.42 O ATOM 939 CG2 THR A 146 -6.301 0.914 9.305 1.00 0.39 C ATOM 0 H THR A 146 -4.583 0.508 6.509 1.00 0.24 H new ATOM 0 HA THR A 146 -3.456 1.131 9.124 1.00 0.24 H new ATOM 0 HB THR A 146 -4.856 -0.300 10.303 1.00 0.27 H new ATOM 0 HG1 THR A 146 -5.017 -1.712 8.125 1.00 0.42 H new ATOM 0 HG21 THR A 146 -7.149 0.520 9.865 1.00 0.39 H new ATOM 0 HG22 THR A 146 -5.944 1.827 9.782 1.00 0.39 H new ATOM 0 HG23 THR A 146 -6.612 1.136 8.284 1.00 0.39 H new ATOM 947 N VAL A 147 -1.933 -0.810 8.932 1.00 0.22 N ATOM 948 CA VAL A 147 -0.993 -1.905 8.772 1.00 0.23 C ATOM 949 C VAL A 147 -0.673 -2.589 10.102 1.00 0.29 C ATOM 950 O VAL A 147 -0.312 -1.945 11.081 1.00 0.34 O ATOM 951 CB VAL A 147 0.293 -1.436 8.076 1.00 0.24 C ATOM 952 CG1 VAL A 147 1.026 -0.418 8.928 1.00 0.26 C ATOM 953 CG2 VAL A 147 1.182 -2.631 7.745 1.00 0.29 C ATOM 0 H VAL A 147 -1.658 -0.104 9.616 1.00 0.22 H new ATOM 0 HA VAL A 147 -1.476 -2.646 8.135 1.00 0.23 H new ATOM 0 HB VAL A 147 0.025 -0.946 7.140 1.00 0.24 H new ATOM 0 HG11 VAL A 147 1.934 -0.100 8.415 1.00 0.26 H new ATOM 0 HG12 VAL A 147 0.383 0.446 9.097 1.00 0.26 H new ATOM 0 HG13 VAL A 147 1.289 -0.867 9.886 1.00 0.26 H new ATOM 0 HG21 VAL A 147 2.090 -2.284 7.252 1.00 0.29 H new ATOM 0 HG22 VAL A 147 1.446 -3.154 8.664 1.00 0.29 H new ATOM 0 HG23 VAL A 147 0.646 -3.310 7.082 1.00 0.29 H new ATOM 963 N GLN A 148 -0.822 -3.898 10.143 1.00 0.52 N ATOM 964 CA GLN A 148 -0.503 -4.642 11.347 1.00 0.68 C ATOM 965 C GLN A 148 0.325 -5.872 10.998 1.00 0.75 C ATOM 966 O GLN A 148 1.546 -5.873 11.160 1.00 1.52 O ATOM 967 CB GLN A 148 -1.780 -5.045 12.090 1.00 1.16 C ATOM 968 CG GLN A 148 -1.537 -5.550 13.502 1.00 1.93 C ATOM 969 CD GLN A 148 -1.055 -4.463 14.445 1.00 2.50 C ATOM 970 OE1 GLN A 148 -1.498 -3.235 14.220 1.00 3.11 O flip ATOM 971 NE2 GLN A 148 -0.304 -4.727 15.382 1.00 3.01 N flip ATOM 0 H GLN A 148 -1.159 -4.465 9.365 1.00 0.52 H new ATOM 0 HA GLN A 148 0.083 -4.001 12.006 1.00 0.68 H new ATOM 0 HB2 GLN A 148 -2.451 -4.187 12.132 1.00 1.16 H new ATOM 0 HB3 GLN A 148 -2.291 -5.821 11.520 1.00 1.16 H new ATOM 0 HG2 GLN A 148 -2.460 -5.979 13.892 1.00 1.93 H new ATOM 0 HG3 GLN A 148 -0.799 -6.352 13.473 1.00 1.93 H new ATOM 0 HE21 GLN A 148 0.017 -5.685 15.524 1.00 3.01 H new ATOM 0 HE22 GLN A 148 -0.002 -3.988 16.017 1.00 3.01 H new ATOM 980 N ALA A 149 -0.335 -6.899 10.481 1.00 0.84 N ATOM 981 CA ALA A 149 0.343 -8.136 10.135 1.00 1.18 C ATOM 982 C ALA A 149 -0.304 -8.803 8.928 1.00 0.92 C ATOM 983 O ALA A 149 0.348 -9.022 7.909 1.00 1.08 O ATOM 984 CB ALA A 149 0.345 -9.086 11.324 1.00 1.65 C ATOM 0 H ALA A 149 -1.338 -6.898 10.293 1.00 0.84 H new ATOM 0 HA ALA A 149 1.373 -7.893 9.872 1.00 1.18 H new ATOM 0 HB1 ALA A 149 0.856 -10.009 11.051 1.00 1.65 H new ATOM 0 HB2 ALA A 149 0.862 -8.619 12.162 1.00 1.65 H new ATOM 0 HB3 ALA A 149 -0.682 -9.311 11.611 1.00 1.65 H new ATOM 990 N ASN A 150 -1.597 -9.094 9.033 1.00 0.69 N ATOM 991 CA ASN A 150 -2.293 -9.857 8.001 1.00 0.51 C ATOM 992 C ASN A 150 -2.907 -8.972 6.937 1.00 0.31 C ATOM 993 O ASN A 150 -3.592 -9.466 6.047 1.00 0.31 O ATOM 994 CB ASN A 150 -3.390 -10.726 8.600 1.00 0.64 C ATOM 995 CG ASN A 150 -2.866 -11.996 9.238 1.00 1.08 C ATOM 996 OD1 ASN A 150 -1.740 -12.047 9.732 1.00 1.68 O ATOM 997 ND2 ASN A 150 -3.684 -13.037 9.230 1.00 1.55 N ATOM 0 H ASN A 150 -2.183 -8.814 9.820 1.00 0.69 H new ATOM 0 HA ASN A 150 -1.533 -10.485 7.536 1.00 0.51 H new ATOM 0 HB2 ASN A 150 -3.933 -10.149 9.348 1.00 0.64 H new ATOM 0 HB3 ASN A 150 -4.104 -10.988 7.819 1.00 0.64 H new ATOM 0 HD21 ASN A 150 -3.388 -13.921 9.643 1.00 1.55 H new ATOM 0 HD22 ASN A 150 -4.610 -12.955 8.811 1.00 1.55 H new ATOM 1004 N SER A 151 -2.683 -7.675 7.016 1.00 0.29 N ATOM 1005 CA SER A 151 -3.221 -6.777 6.014 1.00 0.23 C ATOM 1006 C SER A 151 -2.640 -5.385 6.086 1.00 0.26 C ATOM 1007 O SER A 151 -2.197 -4.913 7.140 1.00 0.30 O ATOM 1008 CB SER A 151 -4.747 -6.694 6.104 1.00 0.27 C ATOM 1009 OG SER A 151 -5.189 -6.487 7.435 1.00 0.37 O ATOM 0 H SER A 151 -2.140 -7.224 7.753 1.00 0.29 H new ATOM 0 HA SER A 151 -2.931 -7.205 5.054 1.00 0.23 H new ATOM 0 HB2 SER A 151 -5.104 -5.880 5.473 1.00 0.27 H new ATOM 0 HB3 SER A 151 -5.184 -7.614 5.716 1.00 0.27 H new ATOM 0 HG SER A 151 -5.318 -5.528 7.592 1.00 0.37 H new ATOM 1015 N ILE A 152 -2.633 -4.757 4.931 1.00 0.27 N ATOM 1016 CA ILE A 152 -2.490 -3.328 4.836 1.00 0.30 C ATOM 1017 C ILE A 152 -3.782 -2.801 4.278 1.00 0.30 C ATOM 1018 O ILE A 152 -4.115 -3.027 3.117 1.00 0.34 O ATOM 1019 CB ILE A 152 -1.321 -2.833 3.942 1.00 0.33 C ATOM 1020 CG1 ILE A 152 0.036 -3.180 4.573 1.00 0.38 C ATOM 1021 CG2 ILE A 152 -1.434 -1.319 3.736 1.00 0.40 C ATOM 1022 CD1 ILE A 152 1.234 -2.654 3.805 1.00 0.53 C ATOM 0 H ILE A 152 -2.727 -5.228 4.031 1.00 0.27 H new ATOM 0 HA ILE A 152 -2.256 -2.961 5.835 1.00 0.30 H new ATOM 0 HB ILE A 152 -1.385 -3.335 2.977 1.00 0.33 H new ATOM 0 HG12 ILE A 152 0.065 -2.780 5.587 1.00 0.38 H new ATOM 0 HG13 ILE A 152 0.119 -4.264 4.655 1.00 0.38 H new ATOM 0 HG21 ILE A 152 -0.612 -0.975 3.108 1.00 0.40 H new ATOM 0 HG22 ILE A 152 -2.382 -1.088 3.251 1.00 0.40 H new ATOM 0 HG23 ILE A 152 -1.388 -0.816 4.702 1.00 0.40 H new ATOM 0 HD11 ILE A 152 2.151 -2.943 4.319 1.00 0.53 H new ATOM 0 HD12 ILE A 152 1.234 -3.073 2.799 1.00 0.53 H new ATOM 0 HD13 ILE A 152 1.179 -1.567 3.745 1.00 0.53 H new ATOM 1034 N GLU A 153 -4.524 -2.138 5.106 1.00 0.30 N ATOM 1035 CA GLU A 153 -5.728 -1.526 4.663 1.00 0.37 C ATOM 1036 C GLU A 153 -5.347 -0.138 4.272 1.00 0.52 C ATOM 1037 O GLU A 153 -4.302 0.333 4.676 1.00 1.07 O ATOM 1038 CB GLU A 153 -6.816 -1.531 5.736 1.00 0.41 C ATOM 1039 CG GLU A 153 -7.444 -2.898 5.958 1.00 0.38 C ATOM 1040 CD GLU A 153 -7.029 -3.547 7.262 1.00 0.74 C ATOM 1041 OE1 GLU A 153 -7.868 -3.642 8.179 1.00 1.09 O ATOM 1042 OE2 GLU A 153 -5.853 -3.955 7.378 1.00 1.13 O ATOM 0 H GLU A 153 -4.313 -2.008 6.096 1.00 0.30 H new ATOM 0 HA GLU A 153 -6.161 -2.077 3.829 1.00 0.37 H new ATOM 0 HB2 GLU A 153 -6.390 -1.179 6.676 1.00 0.41 H new ATOM 0 HB3 GLU A 153 -7.596 -0.823 5.455 1.00 0.41 H new ATOM 0 HG2 GLU A 153 -8.529 -2.798 5.940 1.00 0.38 H new ATOM 0 HG3 GLU A 153 -7.170 -3.554 5.131 1.00 0.38 H new ATOM 1049 N MET A 154 -6.151 0.478 3.474 1.00 0.20 N ATOM 1050 CA MET A 154 -5.826 1.764 2.901 1.00 0.21 C ATOM 1051 C MET A 154 -7.051 2.421 2.339 1.00 0.20 C ATOM 1052 O MET A 154 -8.068 1.773 2.108 1.00 0.26 O ATOM 1053 CB MET A 154 -4.815 1.637 1.772 1.00 0.25 C ATOM 1054 CG MET A 154 -5.331 0.804 0.595 1.00 0.39 C ATOM 1055 SD MET A 154 -4.091 0.570 -0.686 1.00 0.81 S ATOM 1056 CE MET A 154 -2.754 -0.129 0.279 1.00 1.80 C ATOM 0 H MET A 154 -7.060 0.112 3.192 1.00 0.20 H new ATOM 0 HA MET A 154 -5.404 2.363 3.708 1.00 0.21 H new ATOM 0 HB2 MET A 154 -4.550 2.633 1.416 1.00 0.25 H new ATOM 0 HB3 MET A 154 -3.903 1.183 2.159 1.00 0.25 H new ATOM 0 HG2 MET A 154 -5.658 -0.169 0.960 1.00 0.39 H new ATOM 0 HG3 MET A 154 -6.205 1.293 0.164 1.00 0.39 H new ATOM 0 HE1 MET A 154 -2.163 -0.797 -0.348 1.00 1.80 H new ATOM 0 HE2 MET A 154 -2.119 0.673 0.655 1.00 1.80 H new ATOM 0 HE3 MET A 154 -3.166 -0.689 1.118 1.00 1.80 H new ATOM 1066 N ILE A 155 -6.942 3.703 2.130 1.00 0.25 N ATOM 1067 CA ILE A 155 -7.854 4.410 1.298 1.00 0.26 C ATOM 1068 C ILE A 155 -7.165 4.877 0.030 1.00 0.35 C ATOM 1069 O ILE A 155 -6.288 5.748 0.051 1.00 0.43 O ATOM 1070 CB ILE A 155 -8.520 5.538 2.078 1.00 0.30 C ATOM 1071 CG1 ILE A 155 -9.596 4.882 2.921 1.00 0.35 C ATOM 1072 CG2 ILE A 155 -9.079 6.581 1.141 1.00 0.39 C ATOM 1073 CD1 ILE A 155 -10.449 5.830 3.711 1.00 0.41 C ATOM 0 H ILE A 155 -6.210 4.284 2.538 1.00 0.25 H new ATOM 0 HA ILE A 155 -8.654 3.741 0.982 1.00 0.26 H new ATOM 0 HB ILE A 155 -7.811 6.069 2.713 1.00 0.30 H new ATOM 0 HG12 ILE A 155 -10.241 4.295 2.267 1.00 0.35 H new ATOM 0 HG13 ILE A 155 -9.121 4.184 3.610 1.00 0.35 H new ATOM 0 HG21 ILE A 155 -9.549 7.376 1.720 1.00 0.39 H new ATOM 0 HG22 ILE A 155 -8.272 6.999 0.539 1.00 0.39 H new ATOM 0 HG23 ILE A 155 -9.820 6.122 0.486 1.00 0.39 H new ATOM 0 HD11 ILE A 155 -11.188 5.266 4.280 1.00 0.41 H new ATOM 0 HD12 ILE A 155 -9.821 6.400 4.396 1.00 0.41 H new ATOM 0 HD13 ILE A 155 -10.959 6.513 3.032 1.00 0.41 H new ATOM 1085 N ARG A 156 -7.543 4.206 -1.059 1.00 0.45 N ATOM 1086 CA ARG A 156 -7.062 4.495 -2.397 1.00 0.64 C ATOM 1087 C ARG A 156 -7.085 5.980 -2.645 1.00 1.04 C ATOM 1088 O ARG A 156 -8.144 6.588 -2.756 1.00 1.40 O ATOM 1089 CB ARG A 156 -7.914 3.736 -3.413 1.00 0.98 C ATOM 1090 CG ARG A 156 -7.890 4.269 -4.837 1.00 0.99 C ATOM 1091 CD ARG A 156 -6.507 4.286 -5.462 1.00 0.95 C ATOM 1092 NE ARG A 156 -6.560 4.801 -6.833 1.00 1.68 N ATOM 1093 CZ ARG A 156 -6.799 4.044 -7.908 1.00 2.27 C ATOM 1094 NH1 ARG A 156 -6.971 2.735 -7.783 1.00 2.49 N ATOM 1095 NH2 ARG A 156 -6.874 4.602 -9.107 1.00 3.13 N ATOM 0 H ARG A 156 -8.206 3.432 -1.027 1.00 0.45 H new ATOM 0 HA ARG A 156 -6.029 4.163 -2.503 1.00 0.64 H new ATOM 0 HB2 ARG A 156 -7.584 2.697 -3.430 1.00 0.98 H new ATOM 0 HB3 ARG A 156 -8.947 3.737 -3.064 1.00 0.98 H new ATOM 0 HG2 ARG A 156 -8.550 3.659 -5.454 1.00 0.99 H new ATOM 0 HG3 ARG A 156 -8.294 5.282 -4.843 1.00 0.99 H new ATOM 0 HD2 ARG A 156 -5.840 4.905 -4.862 1.00 0.95 H new ATOM 0 HD3 ARG A 156 -6.092 3.278 -5.463 1.00 0.95 H new ATOM 0 HE ARG A 156 -6.405 5.799 -6.976 1.00 1.68 H new ATOM 0 HH11 ARG A 156 -6.921 2.300 -6.862 1.00 2.49 H new ATOM 0 HH12 ARG A 156 -7.153 2.163 -8.608 1.00 2.49 H new ATOM 0 HH21 ARG A 156 -6.749 5.609 -9.210 1.00 3.13 H new ATOM 0 HH22 ARG A 156 -7.056 4.025 -9.928 1.00 3.13 H new ATOM 1280 N GLN A 168 -12.335 7.663 -3.517 1.00 0.54 N ATOM 1281 CA GLN A 168 -11.828 6.874 -2.428 1.00 0.41 C ATOM 1282 C GLN A 168 -12.324 5.432 -2.446 1.00 0.38 C ATOM 1283 O GLN A 168 -13.449 5.138 -2.861 1.00 0.47 O ATOM 1284 CB GLN A 168 -12.245 7.535 -1.145 1.00 0.62 C ATOM 1285 CG GLN A 168 -12.347 6.570 0.008 1.00 0.85 C ATOM 1286 CD GLN A 168 -13.155 7.107 1.173 1.00 1.27 C ATOM 1287 OE1 GLN A 168 -13.209 8.312 1.406 1.00 1.69 O ATOM 1288 NE2 GLN A 168 -13.792 6.214 1.912 1.00 1.86 N ATOM 0 HA GLN A 168 -10.743 6.825 -2.524 1.00 0.41 H new ATOM 0 HB2 GLN A 168 -11.527 8.316 -0.895 1.00 0.62 H new ATOM 0 HB3 GLN A 168 -13.209 8.022 -1.290 1.00 0.62 H new ATOM 0 HG2 GLN A 168 -12.801 5.643 -0.343 1.00 0.85 H new ATOM 0 HG3 GLN A 168 -11.344 6.322 0.355 1.00 0.85 H new ATOM 0 HE21 GLN A 168 -13.722 5.222 1.686 1.00 1.86 H new ATOM 0 HE22 GLN A 168 -14.353 6.518 2.708 1.00 1.86 H new ATOM 1297 N VAL A 169 -11.467 4.561 -1.941 1.00 0.33 N ATOM 1298 CA VAL A 169 -11.737 3.137 -1.810 1.00 0.30 C ATOM 1299 C VAL A 169 -10.891 2.569 -0.681 1.00 0.26 C ATOM 1300 O VAL A 169 -9.666 2.660 -0.721 1.00 0.28 O ATOM 1301 CB VAL A 169 -11.425 2.327 -3.093 1.00 0.33 C ATOM 1302 CG1 VAL A 169 -11.501 0.835 -2.798 1.00 0.36 C ATOM 1303 CG2 VAL A 169 -12.373 2.685 -4.225 1.00 0.41 C ATOM 0 H VAL A 169 -10.543 4.829 -1.603 1.00 0.33 H new ATOM 0 HA VAL A 169 -12.805 3.044 -1.611 1.00 0.30 H new ATOM 0 HB VAL A 169 -10.415 2.582 -3.413 1.00 0.33 H new ATOM 0 HG11 VAL A 169 -11.280 0.273 -3.705 1.00 0.36 H new ATOM 0 HG12 VAL A 169 -10.774 0.579 -2.027 1.00 0.36 H new ATOM 0 HG13 VAL A 169 -12.503 0.583 -2.450 1.00 0.36 H new ATOM 0 HG21 VAL A 169 -12.124 2.097 -5.108 1.00 0.41 H new ATOM 0 HG22 VAL A 169 -13.398 2.469 -3.923 1.00 0.41 H new ATOM 0 HG23 VAL A 169 -12.279 3.746 -4.457 1.00 0.41 H new ATOM 1313 N ARG A 170 -11.522 2.006 0.325 1.00 0.27 N ATOM 1314 CA ARG A 170 -10.810 1.262 1.324 1.00 0.29 C ATOM 1315 C ARG A 170 -10.440 -0.096 0.775 1.00 0.27 C ATOM 1316 O ARG A 170 -11.320 -0.909 0.494 1.00 0.34 O ATOM 1317 CB ARG A 170 -11.686 1.097 2.526 1.00 0.36 C ATOM 1318 CG ARG A 170 -11.290 2.007 3.653 1.00 0.52 C ATOM 1319 CD ARG A 170 -12.444 2.191 4.607 1.00 0.69 C ATOM 1320 NE ARG A 170 -12.059 2.021 6.009 1.00 1.46 N ATOM 1321 CZ ARG A 170 -12.681 1.193 6.852 1.00 1.84 C ATOM 1322 NH1 ARG A 170 -13.732 0.488 6.447 1.00 1.60 N ATOM 1323 NH2 ARG A 170 -12.258 1.080 8.105 1.00 2.80 N ATOM 0 H ARG A 170 -12.531 2.053 0.468 1.00 0.27 H new ATOM 0 HA ARG A 170 -9.901 1.795 1.603 1.00 0.29 H new ATOM 0 HB2 ARG A 170 -12.721 1.297 2.248 1.00 0.36 H new ATOM 0 HB3 ARG A 170 -11.641 0.062 2.865 1.00 0.36 H new ATOM 0 HG2 ARG A 170 -10.434 1.589 4.183 1.00 0.52 H new ATOM 0 HG3 ARG A 170 -10.979 2.974 3.257 1.00 0.52 H new ATOM 0 HD2 ARG A 170 -12.866 3.186 4.470 1.00 0.69 H new ATOM 0 HD3 ARG A 170 -13.229 1.475 4.362 1.00 0.69 H new ATOM 0 HE ARG A 170 -11.272 2.565 6.362 1.00 1.46 H new ATOM 0 HH11 ARG A 170 -14.067 0.578 5.488 1.00 1.60 H new ATOM 0 HH12 ARG A 170 -14.203 -0.143 7.095 1.00 1.60 H new ATOM 0 HH21 ARG A 170 -11.458 1.626 8.424 1.00 2.80 H new ATOM 0 HH22 ARG A 170 -12.733 0.447 8.749 1.00 2.80 H new ATOM 1337 N ALA A 171 -9.162 -0.358 0.609 1.00 0.24 N ATOM 1338 CA ALA A 171 -8.777 -1.637 0.048 1.00 0.22 C ATOM 1339 C ALA A 171 -8.097 -2.491 1.084 1.00 0.22 C ATOM 1340 O ALA A 171 -7.216 -2.042 1.816 1.00 0.29 O ATOM 1341 CB ALA A 171 -7.915 -1.484 -1.195 1.00 0.24 C ATOM 0 H ALA A 171 -8.395 0.271 0.844 1.00 0.24 H new ATOM 0 HA ALA A 171 -9.691 -2.142 -0.265 1.00 0.22 H new ATOM 0 HB1 ALA A 171 -7.652 -2.470 -1.579 1.00 0.24 H new ATOM 0 HB2 ALA A 171 -8.468 -0.934 -1.956 1.00 0.24 H new ATOM 0 HB3 ALA A 171 -7.006 -0.938 -0.942 1.00 0.24 H new ATOM 1347 N ARG A 172 -8.552 -3.717 1.151 1.00 0.19 N ATOM 1348 CA ARG A 172 -8.049 -4.678 2.098 1.00 0.19 C ATOM 1349 C ARG A 172 -6.940 -5.501 1.478 1.00 0.20 C ATOM 1350 O ARG A 172 -7.203 -6.458 0.761 1.00 0.28 O ATOM 1351 CB ARG A 172 -9.187 -5.601 2.509 1.00 0.20 C ATOM 1352 CG ARG A 172 -8.775 -6.733 3.422 1.00 0.38 C ATOM 1353 CD ARG A 172 -8.311 -6.194 4.751 1.00 0.24 C ATOM 1354 NE ARG A 172 -9.410 -5.606 5.514 1.00 0.96 N ATOM 1355 CZ ARG A 172 -9.751 -5.983 6.744 1.00 0.95 C ATOM 1356 NH1 ARG A 172 -9.095 -6.966 7.355 1.00 1.08 N ATOM 1357 NH2 ARG A 172 -10.754 -5.376 7.364 1.00 1.71 N ATOM 0 H ARG A 172 -9.288 -4.078 0.544 1.00 0.19 H new ATOM 0 HA ARG A 172 -7.652 -4.152 2.966 1.00 0.19 H new ATOM 0 HB2 ARG A 172 -9.956 -5.010 3.007 1.00 0.20 H new ATOM 0 HB3 ARG A 172 -9.640 -6.021 1.611 1.00 0.20 H new ATOM 0 HG2 ARG A 172 -9.614 -7.412 3.571 1.00 0.38 H new ATOM 0 HG3 ARG A 172 -7.976 -7.311 2.958 1.00 0.38 H new ATOM 0 HD2 ARG A 172 -7.856 -6.998 5.330 1.00 0.24 H new ATOM 0 HD3 ARG A 172 -7.539 -5.442 4.588 1.00 0.24 H new ATOM 0 HE ARG A 172 -9.950 -4.859 5.076 1.00 0.96 H new ATOM 0 HH11 ARG A 172 -8.324 -7.437 6.881 1.00 1.08 H new ATOM 0 HH12 ARG A 172 -9.363 -7.249 8.298 1.00 1.08 H new ATOM 0 HH21 ARG A 172 -11.261 -4.623 6.898 1.00 1.71 H new ATOM 0 HH22 ARG A 172 -11.019 -5.662 8.307 1.00 1.71 H new ATOM 1371 N LEU A 173 -5.712 -5.129 1.739 1.00 0.18 N ATOM 1372 CA LEU A 173 -4.584 -5.902 1.275 1.00 0.21 C ATOM 1373 C LEU A 173 -4.251 -6.978 2.281 1.00 0.21 C ATOM 1374 O LEU A 173 -3.475 -6.751 3.198 1.00 0.23 O ATOM 1375 CB LEU A 173 -3.377 -5.001 1.059 1.00 0.27 C ATOM 1376 CG LEU A 173 -3.403 -4.167 -0.213 1.00 0.40 C ATOM 1377 CD1 LEU A 173 -4.556 -3.174 -0.202 1.00 0.28 C ATOM 1378 CD2 LEU A 173 -2.074 -3.462 -0.373 1.00 0.69 C ATOM 0 H LEU A 173 -5.466 -4.294 2.271 1.00 0.18 H new ATOM 0 HA LEU A 173 -4.845 -6.368 0.325 1.00 0.21 H new ATOM 0 HB2 LEU A 173 -3.290 -4.328 1.912 1.00 0.27 H new ATOM 0 HB3 LEU A 173 -2.480 -5.620 1.049 1.00 0.27 H new ATOM 0 HG LEU A 173 -3.562 -4.827 -1.066 1.00 0.40 H new ATOM 0 HD11 LEU A 173 -4.546 -2.594 -1.125 1.00 0.28 H new ATOM 0 HD12 LEU A 173 -5.500 -3.713 -0.123 1.00 0.28 H new ATOM 0 HD13 LEU A 173 -4.449 -2.502 0.650 1.00 0.28 H new ATOM 0 HD21 LEU A 173 -2.087 -2.863 -1.283 1.00 0.69 H new ATOM 0 HD22 LEU A 173 -1.900 -2.814 0.486 1.00 0.69 H new ATOM 0 HD23 LEU A 173 -1.275 -4.201 -0.437 1.00 0.69 H new ATOM 1390 N THR A 174 -4.831 -8.146 2.107 1.00 0.20 N ATOM 1391 CA THR A 174 -4.691 -9.196 3.084 1.00 0.21 C ATOM 1392 C THR A 174 -3.539 -10.102 2.771 1.00 0.21 C ATOM 1393 O THR A 174 -3.501 -10.799 1.757 1.00 0.25 O ATOM 1394 CB THR A 174 -5.980 -9.992 3.247 1.00 0.23 C ATOM 1395 OG1 THR A 174 -6.892 -9.684 2.181 1.00 0.26 O ATOM 1396 CG2 THR A 174 -6.600 -9.654 4.588 1.00 0.26 C ATOM 0 H THR A 174 -5.403 -8.389 1.298 1.00 0.20 H new ATOM 0 HA THR A 174 -4.478 -8.710 4.036 1.00 0.21 H new ATOM 0 HB THR A 174 -5.760 -11.059 3.207 1.00 0.23 H new ATOM 0 HG1 THR A 174 -6.920 -10.432 1.548 1.00 0.26 H new ATOM 0 HG21 THR A 174 -7.524 -10.219 4.715 1.00 0.26 H new ATOM 0 HG22 THR A 174 -5.904 -9.913 5.386 1.00 0.26 H new ATOM 0 HG23 THR A 174 -6.819 -8.587 4.629 1.00 0.26 H new ATOM 1404 N PHE A 175 -2.594 -10.038 3.668 1.00 0.23 N ATOM 1405 CA PHE A 175 -1.390 -10.809 3.589 1.00 0.25 C ATOM 1406 C PHE A 175 -1.626 -12.194 4.129 1.00 0.32 C ATOM 1407 O PHE A 175 -2.238 -12.373 5.184 1.00 0.43 O ATOM 1408 CB PHE A 175 -0.263 -10.159 4.403 1.00 0.33 C ATOM 1409 CG PHE A 175 0.183 -8.798 3.948 1.00 0.33 C ATOM 1410 CD1 PHE A 175 -0.693 -7.994 3.245 1.00 0.40 C ATOM 1411 CD2 PHE A 175 1.459 -8.327 4.200 1.00 0.63 C ATOM 1412 CE1 PHE A 175 -0.309 -6.750 2.802 1.00 0.43 C ATOM 1413 CE2 PHE A 175 1.850 -7.080 3.761 1.00 0.72 C ATOM 1414 CZ PHE A 175 1.046 -6.284 3.157 1.00 0.51 C ATOM 0 H PHE A 175 -2.643 -9.436 4.490 1.00 0.23 H new ATOM 0 HA PHE A 175 -1.098 -10.855 2.540 1.00 0.25 H new ATOM 0 HB2 PHE A 175 -0.589 -10.084 5.440 1.00 0.33 H new ATOM 0 HB3 PHE A 175 0.599 -10.825 4.387 1.00 0.33 H new ATOM 0 HD1 PHE A 175 -1.693 -8.347 3.040 1.00 0.40 H new ATOM 0 HD2 PHE A 175 2.157 -8.943 4.747 1.00 0.63 H new ATOM 0 HE1 PHE A 175 -0.975 -6.135 2.215 1.00 0.43 H new ATOM 0 HE2 PHE A 175 2.868 -6.763 3.932 1.00 0.72 H new ATOM 0 HZ PHE A 175 1.358 -5.280 2.910 1.00 0.51 H new ATOM 1424 N ASP A 176 -1.146 -13.170 3.399 1.00 0.28 N ATOM 1425 CA ASP A 176 -0.983 -14.496 3.939 1.00 0.34 C ATOM 1426 C ASP A 176 0.246 -14.463 4.794 1.00 0.35 C ATOM 1427 O ASP A 176 1.271 -15.061 4.471 1.00 0.35 O ATOM 1428 CB ASP A 176 -0.790 -15.506 2.821 1.00 0.34 C ATOM 1429 CG ASP A 176 -0.739 -16.938 3.319 1.00 0.64 C ATOM 1430 OD1 ASP A 176 -1.791 -17.454 3.758 1.00 0.71 O ATOM 1431 OD2 ASP A 176 0.346 -17.558 3.272 1.00 1.09 O ATOM 0 H ASP A 176 -0.860 -13.070 2.425 1.00 0.28 H new ATOM 0 HA ASP A 176 -1.865 -14.789 4.509 1.00 0.34 H new ATOM 0 HB2 ASP A 176 -1.604 -15.405 2.103 1.00 0.34 H new ATOM 0 HB3 ASP A 176 0.134 -15.279 2.289 1.00 0.34 H new ATOM 1436 N GLY A 177 0.163 -13.715 5.862 1.00 0.39 N ATOM 1437 CA GLY A 177 1.329 -13.536 6.665 1.00 0.43 C ATOM 1438 C GLY A 177 2.237 -12.504 6.041 1.00 0.42 C ATOM 1439 O GLY A 177 2.038 -11.303 6.210 1.00 0.47 O ATOM 0 H GLY A 177 -0.677 -13.235 6.185 1.00 0.39 H new ATOM 0 HA2 GLY A 177 1.044 -13.221 7.669 1.00 0.43 H new ATOM 0 HA3 GLY A 177 1.859 -14.483 6.767 1.00 0.43 H new ATOM 1443 N ASP A 178 3.245 -12.972 5.319 1.00 0.39 N ATOM 1444 CA ASP A 178 4.210 -12.088 4.695 1.00 0.43 C ATOM 1445 C ASP A 178 3.847 -11.708 3.280 1.00 0.38 C ATOM 1446 O ASP A 178 4.444 -10.790 2.717 1.00 0.44 O ATOM 1447 CB ASP A 178 5.571 -12.745 4.665 1.00 0.49 C ATOM 1448 CG ASP A 178 6.205 -12.818 6.039 1.00 0.62 C ATOM 1449 OD1 ASP A 178 6.025 -11.867 6.834 1.00 0.83 O ATOM 1450 OD2 ASP A 178 6.889 -13.817 6.337 1.00 0.69 O ATOM 0 H ASP A 178 3.413 -13.964 5.152 1.00 0.39 H new ATOM 0 HA ASP A 178 4.217 -11.180 5.298 1.00 0.43 H new ATOM 0 HB2 ASP A 178 5.477 -13.751 4.257 1.00 0.49 H new ATOM 0 HB3 ASP A 178 6.226 -12.189 3.994 1.00 0.49 H new ATOM 1455 N HIS A 179 2.897 -12.393 2.677 1.00 0.30 N ATOM 1456 CA HIS A 179 2.666 -12.182 1.286 1.00 0.27 C ATOM 1457 C HIS A 179 1.203 -12.087 0.997 1.00 0.21 C ATOM 1458 O HIS A 179 0.418 -12.961 1.341 1.00 0.19 O ATOM 1459 CB HIS A 179 3.334 -13.265 0.462 1.00 0.31 C ATOM 1460 CG HIS A 179 2.850 -14.668 0.710 1.00 0.35 C ATOM 1461 ND1 HIS A 179 2.302 -15.457 -0.274 1.00 1.21 N ATOM 1462 CD2 HIS A 179 2.829 -15.418 1.837 1.00 0.96 C ATOM 1463 CE1 HIS A 179 1.961 -16.624 0.234 1.00 1.07 C ATOM 1464 NE2 HIS A 179 2.268 -16.630 1.518 1.00 0.58 N ATOM 0 H HIS A 179 2.292 -13.081 3.125 1.00 0.30 H new ATOM 0 HA HIS A 179 3.115 -11.230 1.002 1.00 0.27 H new ATOM 0 HB2 HIS A 179 3.191 -13.033 -0.593 1.00 0.31 H new ATOM 0 HB3 HIS A 179 4.407 -13.232 0.653 1.00 0.31 H new ATOM 0 HD2 HIS A 179 3.188 -15.118 2.810 1.00 0.96 H new ATOM 0 HE1 HIS A 179 1.506 -17.439 -0.309 1.00 1.07 H new ATOM 0 HE2 HIS A 179 2.114 -17.404 2.164 1.00 0.58 H new ATOM 1473 N LEU A 180 0.874 -10.996 0.373 1.00 0.21 N ATOM 1474 CA LEU A 180 -0.495 -10.658 0.052 1.00 0.18 C ATOM 1475 C LEU A 180 -1.165 -11.775 -0.701 1.00 0.18 C ATOM 1476 O LEU A 180 -0.673 -12.240 -1.724 1.00 0.21 O ATOM 1477 CB LEU A 180 -0.582 -9.402 -0.760 1.00 0.20 C ATOM 1478 CG LEU A 180 -1.994 -8.881 -0.870 1.00 0.24 C ATOM 1479 CD1 LEU A 180 -2.018 -7.405 -0.627 1.00 0.64 C ATOM 1480 CD2 LEU A 180 -2.574 -9.224 -2.209 1.00 0.59 C ATOM 0 H LEU A 180 1.553 -10.300 0.065 1.00 0.21 H new ATOM 0 HA LEU A 180 -1.007 -10.499 1.001 1.00 0.18 H new ATOM 0 HB2 LEU A 180 0.050 -8.637 -0.309 1.00 0.20 H new ATOM 0 HB3 LEU A 180 -0.189 -9.591 -1.759 1.00 0.20 H new ATOM 0 HG LEU A 180 -2.611 -9.358 -0.108 1.00 0.24 H new ATOM 0 HD11 LEU A 180 -3.042 -7.039 -0.709 1.00 0.64 H new ATOM 0 HD12 LEU A 180 -1.636 -7.194 0.372 1.00 0.64 H new ATOM 0 HD13 LEU A 180 -1.394 -6.904 -1.367 1.00 0.64 H new ATOM 0 HD21 LEU A 180 -3.593 -8.842 -2.273 1.00 0.59 H new ATOM 0 HD22 LEU A 180 -1.967 -8.774 -2.995 1.00 0.59 H new ATOM 0 HD23 LEU A 180 -2.584 -10.307 -2.334 1.00 0.59 H new ATOM 1492 N ALA A 181 -2.302 -12.174 -0.202 1.00 0.20 N ATOM 1493 CA ALA A 181 -3.026 -13.276 -0.768 1.00 0.23 C ATOM 1494 C ALA A 181 -4.238 -12.776 -1.519 1.00 0.26 C ATOM 1495 O ALA A 181 -4.573 -13.287 -2.588 1.00 0.29 O ATOM 1496 CB ALA A 181 -3.423 -14.237 0.332 1.00 0.27 C ATOM 0 H ALA A 181 -2.751 -11.745 0.607 1.00 0.20 H new ATOM 0 HA ALA A 181 -2.389 -13.804 -1.478 1.00 0.23 H new ATOM 0 HB1 ALA A 181 -3.973 -15.074 -0.097 1.00 0.27 H new ATOM 0 HB2 ALA A 181 -2.528 -14.608 0.831 1.00 0.27 H new ATOM 0 HB3 ALA A 181 -4.054 -13.721 1.056 1.00 0.27 H new ATOM 1502 N THR A 182 -4.881 -11.755 -0.968 1.00 0.26 N ATOM 1503 CA THR A 182 -6.087 -11.218 -1.551 1.00 0.28 C ATOM 1504 C THR A 182 -6.182 -9.733 -1.308 1.00 0.29 C ATOM 1505 O THR A 182 -5.438 -9.179 -0.497 1.00 0.29 O ATOM 1506 CB THR A 182 -7.337 -11.865 -0.938 1.00 0.31 C ATOM 1507 OG1 THR A 182 -7.260 -11.800 0.494 1.00 0.32 O ATOM 1508 CG2 THR A 182 -7.485 -13.312 -1.372 1.00 0.33 C ATOM 0 H THR A 182 -4.580 -11.285 -0.114 1.00 0.26 H new ATOM 0 HA THR A 182 -6.041 -11.430 -2.619 1.00 0.28 H new ATOM 0 HB THR A 182 -8.209 -11.314 -1.291 1.00 0.31 H new ATOM 0 HG1 THR A 182 -8.059 -12.212 0.884 1.00 0.32 H new ATOM 0 HG21 THR A 182 -8.380 -13.738 -0.919 1.00 0.33 H new ATOM 0 HG22 THR A 182 -7.570 -13.359 -2.458 1.00 0.33 H new ATOM 0 HG23 THR A 182 -6.611 -13.879 -1.051 1.00 0.33 H new ATOM 1516 N ILE A 183 -7.093 -9.090 -2.014 1.00 0.31 N ATOM 1517 CA ILE A 183 -7.451 -7.734 -1.719 1.00 0.31 C ATOM 1518 C ILE A 183 -8.951 -7.661 -1.817 1.00 0.20 C ATOM 1519 O ILE A 183 -9.553 -8.377 -2.608 1.00 0.20 O ATOM 1520 CB ILE A 183 -6.791 -6.738 -2.685 1.00 0.42 C ATOM 1521 CG1 ILE A 183 -5.305 -7.009 -2.760 1.00 0.76 C ATOM 1522 CG2 ILE A 183 -7.038 -5.293 -2.267 1.00 0.33 C ATOM 1523 CD1 ILE A 183 -4.651 -6.343 -3.927 1.00 0.45 C ATOM 0 H ILE A 183 -7.597 -9.498 -2.801 1.00 0.31 H new ATOM 0 HA ILE A 183 -7.100 -7.458 -0.725 1.00 0.31 H new ATOM 0 HB ILE A 183 -7.241 -6.877 -3.668 1.00 0.42 H new ATOM 0 HG12 ILE A 183 -4.831 -6.666 -1.840 1.00 0.76 H new ATOM 0 HG13 ILE A 183 -5.140 -8.085 -2.822 1.00 0.76 H new ATOM 0 HG21 ILE A 183 -6.555 -4.621 -2.976 1.00 0.33 H new ATOM 0 HG22 ILE A 183 -8.110 -5.096 -2.254 1.00 0.33 H new ATOM 0 HG23 ILE A 183 -6.626 -5.127 -1.272 1.00 0.33 H new ATOM 0 HD11 ILE A 183 -3.586 -6.574 -3.928 1.00 0.45 H new ATOM 0 HD12 ILE A 183 -5.101 -6.704 -4.852 1.00 0.45 H new ATOM 0 HD13 ILE A 183 -4.788 -5.264 -3.854 1.00 0.45 H new ATOM 1535 N VAL A 184 -9.546 -6.860 -0.989 1.00 0.21 N ATOM 1536 CA VAL A 184 -10.981 -6.782 -0.902 1.00 0.20 C ATOM 1537 C VAL A 184 -11.400 -5.339 -0.751 1.00 0.18 C ATOM 1538 O VAL A 184 -10.810 -4.585 0.018 1.00 0.20 O ATOM 1539 CB VAL A 184 -11.493 -7.647 0.275 1.00 0.29 C ATOM 1540 CG1 VAL A 184 -12.951 -7.362 0.571 1.00 0.35 C ATOM 1541 CG2 VAL A 184 -11.294 -9.129 -0.030 1.00 0.31 C ATOM 0 H VAL A 184 -9.053 -6.237 -0.349 1.00 0.21 H new ATOM 0 HA VAL A 184 -11.425 -7.174 -1.817 1.00 0.20 H new ATOM 0 HB VAL A 184 -10.913 -7.388 1.160 1.00 0.29 H new ATOM 0 HG11 VAL A 184 -13.282 -7.985 1.402 1.00 0.35 H new ATOM 0 HG12 VAL A 184 -13.070 -6.311 0.835 1.00 0.35 H new ATOM 0 HG13 VAL A 184 -13.552 -7.585 -0.311 1.00 0.35 H new ATOM 0 HG21 VAL A 184 -11.659 -9.725 0.807 1.00 0.31 H new ATOM 0 HG22 VAL A 184 -11.847 -9.392 -0.931 1.00 0.31 H new ATOM 0 HG23 VAL A 184 -10.234 -9.330 -0.183 1.00 0.31 H new ATOM 1551 N ASN A 185 -12.401 -4.950 -1.509 1.00 0.21 N ATOM 1552 CA ASN A 185 -12.868 -3.592 -1.493 1.00 0.26 C ATOM 1553 C ASN A 185 -13.756 -3.443 -0.322 1.00 0.29 C ATOM 1554 O ASN A 185 -14.891 -3.861 -0.372 1.00 0.39 O ATOM 1555 CB ASN A 185 -13.678 -3.300 -2.729 1.00 0.37 C ATOM 1556 CG ASN A 185 -13.894 -1.816 -2.936 1.00 0.84 C ATOM 1557 OD1 ASN A 185 -13.928 -1.049 -1.976 1.00 1.77 O ATOM 1558 ND2 ASN A 185 -14.035 -1.400 -4.182 1.00 1.12 N ATOM 0 H ASN A 185 -12.907 -5.564 -2.147 1.00 0.21 H new ATOM 0 HA ASN A 185 -12.017 -2.912 -1.452 1.00 0.26 H new ATOM 0 HB2 ASN A 185 -13.171 -3.716 -3.600 1.00 0.37 H new ATOM 0 HB3 ASN A 185 -14.644 -3.799 -2.654 1.00 0.37 H new ATOM 0 HD21 ASN A 185 -14.178 -0.409 -4.376 1.00 1.12 H new ATOM 0 HD22 ASN A 185 -14.000 -2.070 -4.950 1.00 1.12 H new ATOM 1565 N MET A 186 -13.264 -2.823 0.704 1.00 0.26 N ATOM 1566 CA MET A 186 -13.913 -2.891 1.991 1.00 0.32 C ATOM 1567 C MET A 186 -15.274 -2.190 2.009 1.00 0.38 C ATOM 1568 O MET A 186 -15.972 -2.204 3.024 1.00 0.45 O ATOM 1569 CB MET A 186 -12.983 -2.321 3.039 1.00 0.34 C ATOM 1570 CG MET A 186 -11.609 -2.953 2.998 1.00 0.55 C ATOM 1571 SD MET A 186 -10.731 -2.857 4.567 1.00 0.54 S ATOM 1572 CE MET A 186 -10.429 -1.096 4.669 1.00 0.55 C ATOM 0 H MET A 186 -12.413 -2.261 0.683 1.00 0.26 H new ATOM 0 HA MET A 186 -14.121 -3.938 2.213 1.00 0.32 H new ATOM 0 HB2 MET A 186 -12.889 -1.245 2.891 1.00 0.34 H new ATOM 0 HB3 MET A 186 -13.419 -2.470 4.027 1.00 0.34 H new ATOM 0 HG2 MET A 186 -11.707 -3.999 2.708 1.00 0.55 H new ATOM 0 HG3 MET A 186 -11.015 -2.463 2.227 1.00 0.55 H new ATOM 0 HE1 MET A 186 -9.785 -0.886 5.523 1.00 0.55 H new ATOM 0 HE2 MET A 186 -9.942 -0.757 3.755 1.00 0.55 H new ATOM 0 HE3 MET A 186 -11.376 -0.571 4.791 1.00 0.55 H new ATOM 1582 N GLU A 187 -15.647 -1.584 0.891 1.00 0.39 N ATOM 1583 CA GLU A 187 -16.925 -0.931 0.763 1.00 0.50 C ATOM 1584 C GLU A 187 -18.013 -1.927 0.402 1.00 0.52 C ATOM 1585 O GLU A 187 -19.127 -1.891 0.918 1.00 0.60 O ATOM 1586 CB GLU A 187 -16.818 0.139 -0.310 1.00 0.59 C ATOM 1587 CG GLU A 187 -16.756 -0.364 -1.736 1.00 0.59 C ATOM 1588 CD GLU A 187 -16.942 0.740 -2.762 1.00 0.80 C ATOM 1589 OE1 GLU A 187 -18.088 0.951 -3.210 1.00 0.89 O ATOM 1590 OE2 GLU A 187 -15.947 1.403 -3.129 1.00 1.02 O ATOM 0 H GLU A 187 -15.067 -1.536 0.053 1.00 0.39 H new ATOM 0 HA GLU A 187 -17.194 -0.479 1.718 1.00 0.50 H new ATOM 0 HB2 GLU A 187 -17.674 0.807 -0.217 1.00 0.59 H new ATOM 0 HB3 GLU A 187 -15.926 0.735 -0.115 1.00 0.59 H new ATOM 0 HG2 GLU A 187 -15.795 -0.850 -1.903 1.00 0.59 H new ATOM 0 HG3 GLU A 187 -17.526 -1.122 -1.882 1.00 0.59 H new ATOM 1597 N ASN A 188 -17.658 -2.808 -0.496 1.00 0.48 N ATOM 1598 CA ASN A 188 -18.573 -3.812 -1.018 1.00 0.56 C ATOM 1599 C ASN A 188 -18.192 -5.157 -0.480 1.00 0.55 C ATOM 1600 O ASN A 188 -18.994 -6.087 -0.411 1.00 0.65 O ATOM 1601 CB ASN A 188 -18.487 -3.845 -2.529 1.00 0.61 C ATOM 1602 CG ASN A 188 -19.372 -2.815 -3.212 1.00 0.77 C ATOM 1603 OD1 ASN A 188 -19.657 -1.718 -2.529 1.00 1.40 O flip ATOM 1604 ND2 ASN A 188 -19.804 -3.013 -4.347 1.00 1.37 N flip ATOM 0 H ASN A 188 -16.720 -2.857 -0.894 1.00 0.48 H new ATOM 0 HA ASN A 188 -19.590 -3.563 -0.715 1.00 0.56 H new ATOM 0 HB2 ASN A 188 -17.452 -3.679 -2.829 1.00 0.61 H new ATOM 0 HB3 ASN A 188 -18.765 -4.839 -2.879 1.00 0.61 H new ATOM 0 HD21 ASN A 188 -19.562 -3.871 -4.842 1.00 1.37 H new ATOM 0 HD22 ASN A 188 -20.404 -2.319 -4.793 1.00 1.37 H new ATOM 1611 N ASN A 189 -16.921 -5.223 -0.153 1.00 0.46 N ATOM 1612 CA ASN A 189 -16.283 -6.402 0.405 1.00 0.47 C ATOM 1613 C ASN A 189 -16.086 -7.393 -0.719 1.00 0.52 C ATOM 1614 O ASN A 189 -16.137 -8.607 -0.549 1.00 0.59 O ATOM 1615 CB ASN A 189 -17.094 -6.971 1.565 1.00 0.57 C ATOM 1616 CG ASN A 189 -16.385 -8.074 2.338 1.00 0.67 C ATOM 1617 OD1 ASN A 189 -16.526 -9.261 2.036 1.00 1.33 O ATOM 1618 ND2 ASN A 189 -15.637 -7.689 3.359 1.00 1.30 N ATOM 0 H ASN A 189 -16.281 -4.437 -0.270 1.00 0.46 H new ATOM 0 HA ASN A 189 -15.311 -6.151 0.830 1.00 0.47 H new ATOM 0 HB2 ASN A 189 -17.341 -6.162 2.252 1.00 0.57 H new ATOM 0 HB3 ASN A 189 -18.036 -7.361 1.179 1.00 0.57 H new ATOM 0 HD21 ASN A 189 -15.153 -8.384 3.927 1.00 1.30 H new ATOM 0 HD22 ASN A 189 -15.545 -6.697 3.578 1.00 1.30 H new ATOM 1625 N ARG A 190 -15.859 -6.827 -1.892 1.00 0.51 N ATOM 1626 CA ARG A 190 -15.634 -7.606 -3.083 1.00 0.57 C ATOM 1627 C ARG A 190 -14.170 -7.908 -3.219 1.00 0.48 C ATOM 1628 O ARG A 190 -13.323 -7.248 -2.626 1.00 0.37 O ATOM 1629 CB ARG A 190 -16.105 -6.853 -4.315 1.00 0.66 C ATOM 1630 CG ARG A 190 -15.207 -5.689 -4.689 1.00 0.72 C ATOM 1631 CD ARG A 190 -15.966 -4.579 -5.365 1.00 0.74 C ATOM 1632 NE ARG A 190 -16.755 -5.042 -6.503 1.00 1.22 N ATOM 1633 CZ ARG A 190 -17.492 -4.240 -7.270 1.00 1.47 C ATOM 1634 NH1 ARG A 190 -17.502 -2.930 -7.053 1.00 1.27 N ATOM 1635 NH2 ARG A 190 -18.201 -4.743 -8.269 1.00 2.28 N ATOM 0 H ARG A 190 -15.827 -5.818 -2.039 1.00 0.51 H new ATOM 0 HA ARG A 190 -16.200 -8.534 -2.999 1.00 0.57 H new ATOM 0 HB2 ARG A 190 -16.160 -7.545 -5.156 1.00 0.66 H new ATOM 0 HB3 ARG A 190 -17.115 -6.482 -4.141 1.00 0.66 H new ATOM 0 HG2 ARG A 190 -14.724 -5.302 -3.792 1.00 0.72 H new ATOM 0 HG3 ARG A 190 -14.416 -6.041 -5.351 1.00 0.72 H new ATOM 0 HD2 ARG A 190 -16.627 -4.104 -4.640 1.00 0.74 H new ATOM 0 HD3 ARG A 190 -15.263 -3.818 -5.702 1.00 0.74 H new ATOM 0 HE ARG A 190 -16.741 -6.038 -6.724 1.00 1.22 H new ATOM 0 HH11 ARG A 190 -16.944 -2.534 -6.297 1.00 1.27 H new ATOM 0 HH12 ARG A 190 -18.068 -2.320 -7.643 1.00 1.27 H new ATOM 0 HH21 ARG A 190 -18.183 -5.746 -8.452 1.00 2.28 H new ATOM 0 HH22 ARG A 190 -18.765 -4.127 -8.855 1.00 2.28 H new ATOM 1649 N GLN A 191 -13.893 -8.881 -4.027 1.00 0.55 N ATOM 1650 CA GLN A 191 -12.545 -9.360 -4.204 1.00 0.47 C ATOM 1651 C GLN A 191 -11.791 -8.627 -5.297 1.00 0.38 C ATOM 1652 O GLN A 191 -12.319 -8.304 -6.363 1.00 0.59 O ATOM 1653 CB GLN A 191 -12.549 -10.856 -4.453 1.00 0.58 C ATOM 1654 CG GLN A 191 -12.861 -11.625 -3.192 1.00 0.61 C ATOM 1655 CD GLN A 191 -12.903 -13.128 -3.396 1.00 0.75 C ATOM 1656 OE1 GLN A 191 -13.305 -13.561 -4.578 1.00 1.36 O flip ATOM 1657 NE2 GLN A 191 -12.582 -13.894 -2.491 1.00 1.27 N flip ATOM 0 H GLN A 191 -14.591 -9.371 -4.587 1.00 0.55 H new ATOM 0 HA GLN A 191 -12.009 -9.152 -3.278 1.00 0.47 H new ATOM 0 HB2 GLN A 191 -13.286 -11.097 -5.219 1.00 0.58 H new ATOM 0 HB3 GLN A 191 -11.577 -11.165 -4.838 1.00 0.58 H new ATOM 0 HG2 GLN A 191 -12.111 -11.389 -2.437 1.00 0.61 H new ATOM 0 HG3 GLN A 191 -13.822 -11.292 -2.801 1.00 0.61 H new ATOM 0 HE21 GLN A 191 -12.277 -13.522 -1.592 1.00 1.27 H new ATOM 0 HE22 GLN A 191 -12.621 -14.903 -2.639 1.00 1.27 H new ATOM 1666 N PHE A 192 -10.541 -8.382 -4.979 1.00 0.25 N ATOM 1667 CA PHE A 192 -9.586 -7.724 -5.805 1.00 0.46 C ATOM 1668 C PHE A 192 -8.631 -8.774 -6.330 1.00 0.63 C ATOM 1669 O PHE A 192 -8.893 -9.970 -6.195 1.00 1.18 O ATOM 1670 CB PHE A 192 -8.908 -6.576 -5.066 1.00 0.58 C ATOM 1671 CG PHE A 192 -9.625 -5.268 -5.251 1.00 0.63 C ATOM 1672 CD1 PHE A 192 -9.882 -4.785 -6.524 1.00 0.84 C ATOM 1673 CD2 PHE A 192 -10.045 -4.528 -4.160 1.00 0.63 C ATOM 1674 CE1 PHE A 192 -10.545 -3.587 -6.705 1.00 0.95 C ATOM 1675 CE2 PHE A 192 -10.707 -3.328 -4.335 1.00 0.70 C ATOM 1676 CZ PHE A 192 -10.958 -2.857 -5.609 1.00 0.81 C ATOM 0 H PHE A 192 -10.151 -8.659 -4.078 1.00 0.25 H new ATOM 0 HA PHE A 192 -10.067 -7.245 -6.658 1.00 0.46 H new ATOM 0 HB2 PHE A 192 -8.858 -6.812 -4.003 1.00 0.58 H new ATOM 0 HB3 PHE A 192 -7.882 -6.477 -5.419 1.00 0.58 H new ATOM 0 HD1 PHE A 192 -9.560 -5.352 -7.385 1.00 0.84 H new ATOM 0 HD2 PHE A 192 -9.853 -4.892 -3.161 1.00 0.63 H new ATOM 0 HE1 PHE A 192 -10.740 -3.222 -7.703 1.00 0.95 H new ATOM 0 HE2 PHE A 192 -11.028 -2.758 -3.476 1.00 0.70 H new ATOM 0 HZ PHE A 192 -11.476 -1.920 -5.747 1.00 0.81 H new ATOM 1686 N GLY A 193 -7.525 -8.358 -6.884 1.00 1.17 N ATOM 1687 CA GLY A 193 -6.888 -9.064 -7.964 1.00 1.28 C ATOM 1688 C GLY A 193 -6.425 -8.058 -8.953 1.00 0.64 C ATOM 1689 O GLY A 193 -5.684 -8.360 -9.890 1.00 0.63 O ATOM 0 H GLY A 193 -7.035 -7.511 -6.596 1.00 1.17 H new ATOM 0 HA2 GLY A 193 -6.047 -9.651 -7.594 1.00 1.28 H new ATOM 0 HA3 GLY A 193 -7.585 -9.763 -8.427 1.00 1.28 H new ATOM 1693 N PHE A 194 -6.860 -6.834 -8.719 1.00 0.41 N ATOM 1694 CA PHE A 194 -6.141 -5.683 -9.216 1.00 0.61 C ATOM 1695 C PHE A 194 -6.444 -4.438 -8.374 1.00 0.66 C ATOM 1696 O PHE A 194 -7.561 -3.940 -8.391 1.00 0.89 O ATOM 1697 CB PHE A 194 -6.433 -5.425 -10.698 1.00 0.86 C ATOM 1698 CG PHE A 194 -7.885 -5.234 -11.029 1.00 1.25 C ATOM 1699 CD1 PHE A 194 -8.697 -6.327 -11.270 1.00 1.36 C ATOM 1700 CD2 PHE A 194 -8.436 -3.966 -11.091 1.00 2.03 C ATOM 1701 CE1 PHE A 194 -10.035 -6.161 -11.570 1.00 2.10 C ATOM 1702 CE2 PHE A 194 -9.772 -3.792 -11.392 1.00 2.80 C ATOM 1703 CZ PHE A 194 -10.567 -4.869 -11.653 1.00 2.80 C ATOM 0 H PHE A 194 -7.704 -6.615 -8.190 1.00 0.41 H new ATOM 0 HA PHE A 194 -5.077 -5.904 -9.127 1.00 0.61 H new ATOM 0 HB2 PHE A 194 -5.883 -4.538 -11.013 1.00 0.86 H new ATOM 0 HB3 PHE A 194 -6.049 -6.262 -11.281 1.00 0.86 H new ATOM 0 HD1 PHE A 194 -8.280 -7.322 -11.223 1.00 1.36 H new ATOM 0 HD2 PHE A 194 -7.814 -3.103 -10.902 1.00 2.03 H new ATOM 0 HE1 PHE A 194 -10.666 -7.021 -11.739 1.00 2.10 H new ATOM 0 HE2 PHE A 194 -10.190 -2.797 -11.421 1.00 2.80 H new ATOM 0 HZ PHE A 194 -11.603 -4.726 -11.923 1.00 2.80 H new ATOM 1713 N PHE A 195 -5.493 -3.960 -7.592 1.00 0.49 N ATOM 1714 CA PHE A 195 -5.607 -2.606 -7.069 1.00 0.43 C ATOM 1715 C PHE A 195 -4.352 -1.813 -7.438 1.00 0.39 C ATOM 1716 O PHE A 195 -3.247 -2.345 -7.429 1.00 0.60 O ATOM 1717 CB PHE A 195 -5.862 -2.620 -5.559 1.00 0.41 C ATOM 1718 CG PHE A 195 -6.709 -1.472 -5.109 1.00 0.36 C ATOM 1719 CD1 PHE A 195 -6.293 -0.640 -4.090 1.00 0.56 C ATOM 1720 CD2 PHE A 195 -7.922 -1.219 -5.718 1.00 0.51 C ATOM 1721 CE1 PHE A 195 -7.067 0.412 -3.684 1.00 0.57 C ATOM 1722 CE2 PHE A 195 -8.703 -0.167 -5.315 1.00 0.60 C ATOM 1723 CZ PHE A 195 -8.272 0.649 -4.295 1.00 0.47 C ATOM 0 H PHE A 195 -4.656 -4.469 -7.310 1.00 0.49 H new ATOM 0 HA PHE A 195 -6.467 -2.112 -7.522 1.00 0.43 H new ATOM 0 HB2 PHE A 195 -6.349 -3.556 -5.285 1.00 0.41 H new ATOM 0 HB3 PHE A 195 -4.908 -2.591 -5.033 1.00 0.41 H new ATOM 0 HD1 PHE A 195 -5.344 -0.822 -3.607 1.00 0.56 H new ATOM 0 HD2 PHE A 195 -8.259 -1.857 -6.521 1.00 0.51 H new ATOM 0 HE1 PHE A 195 -6.730 1.055 -2.884 1.00 0.57 H new ATOM 0 HE2 PHE A 195 -9.652 0.020 -5.796 1.00 0.60 H new ATOM 0 HZ PHE A 195 -8.884 1.479 -3.974 1.00 0.47 H new ATOM 1733 N ARG A 196 -4.529 -0.571 -7.851 1.00 0.48 N ATOM 1734 CA ARG A 196 -3.407 0.253 -8.305 1.00 0.46 C ATOM 1735 C ARG A 196 -3.325 1.532 -7.495 1.00 0.48 C ATOM 1736 O ARG A 196 -4.347 2.067 -7.066 1.00 0.66 O ATOM 1737 CB ARG A 196 -3.540 0.585 -9.788 1.00 0.53 C ATOM 1738 CG ARG A 196 -3.203 -0.568 -10.725 1.00 1.29 C ATOM 1739 CD ARG A 196 -4.177 -1.726 -10.577 1.00 1.91 C ATOM 1740 NE ARG A 196 -3.787 -2.868 -11.403 1.00 2.91 N ATOM 1741 CZ ARG A 196 -3.205 -3.970 -10.933 1.00 3.82 C ATOM 1742 NH1 ARG A 196 -2.909 -4.073 -9.644 1.00 4.08 N ATOM 1743 NH2 ARG A 196 -2.908 -4.964 -11.757 1.00 4.77 N ATOM 0 H ARG A 196 -5.436 -0.105 -7.884 1.00 0.48 H new ATOM 0 HA ARG A 196 -2.490 -0.319 -8.158 1.00 0.46 H new ATOM 0 HB2 ARG A 196 -4.562 0.910 -9.985 1.00 0.53 H new ATOM 0 HB3 ARG A 196 -2.888 1.427 -10.019 1.00 0.53 H new ATOM 0 HG2 ARG A 196 -3.216 -0.213 -11.756 1.00 1.29 H new ATOM 0 HG3 ARG A 196 -2.191 -0.917 -10.521 1.00 1.29 H new ATOM 0 HD2 ARG A 196 -4.223 -2.032 -9.532 1.00 1.91 H new ATOM 0 HD3 ARG A 196 -5.178 -1.398 -10.858 1.00 1.91 H new ATOM 0 HE ARG A 196 -3.973 -2.817 -12.405 1.00 2.91 H new ATOM 0 HH11 ARG A 196 -3.127 -3.306 -9.008 1.00 4.08 H new ATOM 0 HH12 ARG A 196 -2.463 -4.919 -9.289 1.00 4.08 H new ATOM 0 HH21 ARG A 196 -3.125 -4.885 -12.751 1.00 4.77 H new ATOM 0 HH22 ARG A 196 -2.462 -5.808 -11.398 1.00 4.77 H new ATOM 1757 N LEU A 197 -2.113 2.015 -7.271 1.00 0.40 N ATOM 1758 CA LEU A 197 -1.913 3.182 -6.438 1.00 0.46 C ATOM 1759 C LEU A 197 -0.888 4.136 -7.039 1.00 0.56 C ATOM 1760 O LEU A 197 -0.216 3.807 -8.017 1.00 0.65 O ATOM 1761 CB LEU A 197 -1.458 2.716 -5.068 1.00 0.64 C ATOM 1762 CG LEU A 197 -2.425 1.754 -4.380 1.00 0.98 C ATOM 1763 CD1 LEU A 197 -1.743 1.103 -3.204 1.00 1.61 C ATOM 1764 CD2 LEU A 197 -3.701 2.472 -3.944 1.00 1.04 C ATOM 0 H LEU A 197 -1.257 1.615 -7.655 1.00 0.40 H new ATOM 0 HA LEU A 197 -2.852 3.730 -6.363 1.00 0.46 H new ATOM 0 HB2 LEU A 197 -0.488 2.229 -5.166 1.00 0.64 H new ATOM 0 HB3 LEU A 197 -1.315 3.588 -4.429 1.00 0.64 H new ATOM 0 HG LEU A 197 -2.715 0.981 -5.092 1.00 0.98 H new ATOM 0 HD11 LEU A 197 -2.436 0.417 -2.716 1.00 1.61 H new ATOM 0 HD12 LEU A 197 -0.869 0.551 -3.550 1.00 1.61 H new ATOM 0 HD13 LEU A 197 -1.430 1.869 -2.495 1.00 1.61 H new ATOM 0 HD21 LEU A 197 -4.370 1.762 -3.458 1.00 1.04 H new ATOM 0 HD22 LEU A 197 -3.449 3.270 -3.246 1.00 1.04 H new ATOM 0 HD23 LEU A 197 -4.196 2.897 -4.817 1.00 1.04 H new ATOM 1776 N ASP A 198 -0.779 5.313 -6.438 1.00 0.64 N ATOM 1777 CA ASP A 198 0.134 6.347 -6.909 1.00 0.79 C ATOM 1778 C ASP A 198 1.226 6.577 -5.871 1.00 0.86 C ATOM 1779 O ASP A 198 0.935 7.059 -4.785 1.00 1.05 O ATOM 1780 CB ASP A 198 -0.634 7.653 -7.141 1.00 0.95 C ATOM 1781 CG ASP A 198 0.202 8.719 -7.823 1.00 1.85 C ATOM 1782 OD1 ASP A 198 1.062 9.329 -7.161 1.00 2.19 O ATOM 1783 OD2 ASP A 198 -0.021 8.974 -9.022 1.00 2.66 O ATOM 0 H ASP A 198 -1.318 5.578 -5.614 1.00 0.64 H new ATOM 0 HA ASP A 198 0.586 6.024 -7.847 1.00 0.79 H new ATOM 0 HB2 ASP A 198 -1.515 7.447 -7.748 1.00 0.95 H new ATOM 0 HB3 ASP A 198 -0.989 8.035 -6.184 1.00 0.95 H new