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 -160:sc= -0.455 (180deg=-0.876) USER MOD Set 1.2: A 146 THR OG1 : rot 20:sc= -1.27! USER MOD Set 1.3: A 186 MET CE :methyl 179:sc= -3.71 (180deg=-3.7) USER MOD Set 2.1: A 174 THR OG1 : rot 115:sc= 1.25 USER MOD Set 2.2: A 182 THR OG1 : rot 180:sc= 1.05 USER MOD Set 3.1: A 117 MET CE :methyl 168:sc= -8.42! (180deg=-8.58!) USER MOD Set 3.2: A 124 MET CE :methyl 142:sc= -10.5! (180deg=-11.3!) USER MOD Single : A 110 MET CE :methyl -153:sc= 0 (180deg=-0.908) USER MOD Single : A 112 ASN : amide:sc= 0.819 K(o=0.82,f=-4.2!) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 84:sc= 1.2 USER MOD Single : A 121 LYS NZ :NH3+ 173:sc= -0.0047 (180deg=-0.074) USER MOD Single : A 122 ASN :FLIP amide:sc= -0.171 F(o=-0.94,f=-0.17) USER MOD Single : A 126 LYS NZ :NH3+ 153:sc= 1.2 (180deg=0.392) USER MOD Single : A 131 THR OG1 : rot 104:sc= -0.341 USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 TYR OH : rot 180:sc= -0.243 USER MOD Single : A 135 GLN :FLIP amide:sc= -0.339 F(o=-1.7!,f=-0.34) 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 148 GLN : amide:sc= 0.985 K(o=0.98,f=-0.014) USER MOD Single : A 150 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 151 SER OG : rot 70:sc= 1.23 USER MOD Single : A 154 MET CE :methyl -171:sc= -1.56 (180deg=-1.77) USER MOD Single : A 168 GLN :FLIP amide:sc= -0.16 F(o=-1,f=-0.16) USER MOD Single : A 179 HIS : no HD1:sc= -2.45! C(o=-2.5!,f=-3.5!) USER MOD Single : A 185 ASN : amide:sc= -3.9! C(o=-3.9!,f=-8.2!) USER MOD Single : A 188 ASN : amide:sc= -1.42 K(o=-1.4,f=-4.4!) USER MOD Single : A 189 ASN : amide:sc= -0.717 X(o=-0.72,f=-0.36) USER MOD Single : A 191 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 319 N ARG A 109 10.219 -1.063 -1.635 1.00 0.50 N ATOM 320 CA ARG A 109 9.313 0.080 -1.505 1.00 0.44 C ATOM 321 C ARG A 109 8.483 0.159 -2.768 1.00 0.36 C ATOM 322 O ARG A 109 9.024 0.417 -3.844 1.00 0.56 O ATOM 323 CB ARG A 109 10.088 1.373 -1.368 1.00 0.57 C ATOM 324 CG ARG A 109 11.255 1.306 -0.396 1.00 0.98 C ATOM 325 CD ARG A 109 12.170 2.512 -0.537 1.00 1.83 C ATOM 326 NE ARG A 109 12.850 2.533 -1.835 1.00 2.50 N ATOM 327 CZ ARG A 109 13.361 3.630 -2.394 1.00 3.50 C ATOM 328 NH1 ARG A 109 13.268 4.799 -1.776 1.00 4.03 N ATOM 329 NH2 ARG A 109 13.971 3.553 -3.570 1.00 4.32 N ATOM 0 HA ARG A 109 8.693 -0.054 -0.618 1.00 0.44 H new ATOM 0 HB2 ARG A 109 10.464 1.662 -2.349 1.00 0.57 H new ATOM 0 HB3 ARG A 109 9.406 2.159 -1.044 1.00 0.57 H new ATOM 0 HG2 ARG A 109 10.877 1.253 0.625 1.00 0.98 H new ATOM 0 HG3 ARG A 109 11.825 0.394 -0.573 1.00 0.98 H new ATOM 0 HD2 ARG A 109 11.588 3.426 -0.417 1.00 1.83 H new ATOM 0 HD3 ARG A 109 12.912 2.500 0.261 1.00 1.83 H new ATOM 0 HE ARG A 109 12.938 1.653 -2.343 1.00 2.50 H new ATOM 0 HH11 ARG A 109 12.804 4.861 -0.870 1.00 4.03 H new ATOM 0 HH12 ARG A 109 13.660 5.636 -2.207 1.00 4.03 H new ATOM 0 HH21 ARG A 109 14.049 2.654 -4.046 1.00 4.32 H new ATOM 0 HH22 ARG A 109 14.362 4.392 -3.998 1.00 4.32 H new ATOM 343 N MET A 110 7.193 -0.065 -2.665 1.00 0.28 N ATOM 344 CA MET A 110 6.404 -0.285 -3.891 1.00 0.36 C ATOM 345 C MET A 110 4.996 0.313 -3.829 1.00 0.41 C ATOM 346 O MET A 110 4.489 0.616 -2.748 1.00 0.67 O ATOM 347 CB MET A 110 6.333 -1.791 -4.187 1.00 0.58 C ATOM 348 CG MET A 110 5.768 -2.133 -5.559 1.00 0.97 C ATOM 349 SD MET A 110 6.704 -1.367 -6.897 1.00 1.86 S ATOM 350 CE MET A 110 5.844 -2.011 -8.330 1.00 2.59 C ATOM 0 H MET A 110 6.669 -0.102 -1.790 1.00 0.28 H new ATOM 0 HA MET A 110 6.916 0.238 -4.698 1.00 0.36 H new ATOM 0 HB2 MET A 110 7.334 -2.214 -4.103 1.00 0.58 H new ATOM 0 HB3 MET A 110 5.720 -2.271 -3.424 1.00 0.58 H new ATOM 0 HG2 MET A 110 5.770 -3.215 -5.691 1.00 0.97 H new ATOM 0 HG3 MET A 110 4.729 -1.807 -5.613 1.00 0.97 H new ATOM 0 HE1 MET A 110 6.528 -2.048 -9.178 1.00 2.59 H new ATOM 0 HE2 MET A 110 5.479 -3.015 -8.114 1.00 2.59 H new ATOM 0 HE3 MET A 110 5.002 -1.362 -8.571 1.00 2.59 H new ATOM 360 N VAL A 111 4.385 0.528 -5.005 1.00 0.33 N ATOM 361 CA VAL A 111 2.941 0.662 -5.099 1.00 0.35 C ATOM 362 C VAL A 111 2.423 -0.197 -6.255 1.00 0.33 C ATOM 363 O VAL A 111 2.602 0.102 -7.438 1.00 0.35 O ATOM 364 CB VAL A 111 2.490 2.148 -5.222 1.00 0.43 C ATOM 365 CG1 VAL A 111 3.284 2.993 -4.262 1.00 0.74 C ATOM 366 CG2 VAL A 111 2.641 2.698 -6.619 1.00 0.73 C ATOM 0 H VAL A 111 4.875 0.611 -5.896 1.00 0.33 H new ATOM 0 HA VAL A 111 2.500 0.299 -4.171 1.00 0.35 H new ATOM 0 HB VAL A 111 1.428 2.181 -4.980 1.00 0.43 H new ATOM 0 HG11 VAL A 111 2.970 4.033 -4.347 1.00 0.74 H new ATOM 0 HG12 VAL A 111 3.113 2.644 -3.243 1.00 0.74 H new ATOM 0 HG13 VAL A 111 4.345 2.914 -4.500 1.00 0.74 H new ATOM 0 HG21 VAL A 111 2.310 3.736 -6.639 1.00 0.73 H new ATOM 0 HG22 VAL A 111 3.687 2.645 -6.920 1.00 0.73 H new ATOM 0 HG23 VAL A 111 2.035 2.111 -7.309 1.00 0.73 H new ATOM 376 N ASN A 112 1.864 -1.334 -5.889 1.00 0.36 N ATOM 377 CA ASN A 112 1.199 -2.205 -6.821 1.00 0.37 C ATOM 378 C ASN A 112 0.361 -3.179 -6.038 1.00 0.40 C ATOM 379 O ASN A 112 0.904 -4.010 -5.326 1.00 0.55 O ATOM 380 CB ASN A 112 2.208 -2.962 -7.671 1.00 0.46 C ATOM 381 CG ASN A 112 1.549 -3.831 -8.730 1.00 0.77 C ATOM 382 OD1 ASN A 112 0.485 -3.496 -9.259 1.00 1.14 O ATOM 383 ND2 ASN A 112 2.171 -4.959 -9.034 1.00 1.38 N ATOM 0 H ASN A 112 1.862 -1.676 -4.928 1.00 0.36 H new ATOM 0 HA ASN A 112 0.575 -1.613 -7.490 1.00 0.37 H new ATOM 0 HB2 ASN A 112 2.876 -2.250 -8.156 1.00 0.46 H new ATOM 0 HB3 ASN A 112 2.824 -3.588 -7.025 1.00 0.46 H new ATOM 0 HD21 ASN A 112 1.772 -5.590 -9.730 1.00 1.38 H new ATOM 0 HD22 ASN A 112 3.049 -5.198 -8.573 1.00 1.38 H new ATOM 390 N LEU A 113 -0.933 -3.071 -6.129 1.00 0.37 N ATOM 391 CA LEU A 113 -1.798 -3.987 -5.418 1.00 0.40 C ATOM 392 C LEU A 113 -2.228 -5.108 -6.334 1.00 0.38 C ATOM 393 O LEU A 113 -3.091 -4.905 -7.191 1.00 0.52 O ATOM 394 CB LEU A 113 -3.012 -3.241 -4.906 1.00 0.42 C ATOM 395 CG LEU A 113 -2.761 -2.236 -3.784 1.00 0.58 C ATOM 396 CD1 LEU A 113 -3.987 -2.078 -2.896 1.00 1.33 C ATOM 397 CD2 LEU A 113 -1.560 -2.655 -2.982 1.00 1.17 C ATOM 0 H LEU A 113 -1.417 -2.365 -6.683 1.00 0.37 H new ATOM 0 HA LEU A 113 -1.255 -4.413 -4.574 1.00 0.40 H new ATOM 0 HB2 LEU A 113 -3.468 -2.713 -5.743 1.00 0.42 H new ATOM 0 HB3 LEU A 113 -3.741 -3.972 -4.555 1.00 0.42 H new ATOM 0 HG LEU A 113 -2.561 -1.262 -4.231 1.00 0.58 H new ATOM 0 HD11 LEU A 113 -3.775 -1.356 -2.108 1.00 1.33 H new ATOM 0 HD12 LEU A 113 -4.827 -1.725 -3.495 1.00 1.33 H new ATOM 0 HD13 LEU A 113 -4.239 -3.040 -2.449 1.00 1.33 H new ATOM 0 HD21 LEU A 113 -1.386 -1.934 -2.183 1.00 1.17 H new ATOM 0 HD22 LEU A 113 -1.737 -3.640 -2.550 1.00 1.17 H new ATOM 0 HD23 LEU A 113 -0.685 -2.695 -3.631 1.00 1.17 H new ATOM 409 N GLU A 114 -1.639 -6.288 -6.172 1.00 0.34 N ATOM 410 CA GLU A 114 -1.913 -7.357 -7.095 1.00 0.34 C ATOM 411 C GLU A 114 -1.650 -8.718 -6.439 1.00 0.33 C ATOM 412 O GLU A 114 -0.502 -9.099 -6.239 1.00 0.39 O ATOM 413 CB GLU A 114 -1.031 -7.145 -8.321 1.00 0.39 C ATOM 414 CG GLU A 114 -1.462 -7.947 -9.535 1.00 0.47 C ATOM 415 CD GLU A 114 -0.448 -7.890 -10.651 1.00 1.13 C ATOM 416 OE1 GLU A 114 -0.774 -7.359 -11.732 1.00 1.93 O ATOM 417 OE2 GLU A 114 0.686 -8.366 -10.457 1.00 1.50 O ATOM 0 H GLU A 114 -0.984 -6.516 -5.424 1.00 0.34 H new ATOM 0 HA GLU A 114 -2.962 -7.351 -7.391 1.00 0.34 H new ATOM 0 HB2 GLU A 114 -1.032 -6.086 -8.578 1.00 0.39 H new ATOM 0 HB3 GLU A 114 -0.004 -7.410 -8.068 1.00 0.39 H new ATOM 0 HG2 GLU A 114 -1.620 -8.985 -9.244 1.00 0.47 H new ATOM 0 HG3 GLU A 114 -2.418 -7.568 -9.897 1.00 0.47 H new ATOM 424 N PRO A 115 -2.739 -9.443 -6.098 1.00 0.39 N ATOM 425 CA PRO A 115 -2.732 -10.715 -5.373 1.00 0.46 C ATOM 426 C PRO A 115 -1.577 -11.636 -5.678 1.00 0.45 C ATOM 427 O PRO A 115 -1.104 -11.721 -6.817 1.00 0.49 O ATOM 428 CB PRO A 115 -4.030 -11.351 -5.829 1.00 0.59 C ATOM 429 CG PRO A 115 -4.953 -10.209 -5.954 1.00 0.65 C ATOM 430 CD PRO A 115 -4.112 -9.045 -6.389 1.00 0.53 C ATOM 0 HA PRO A 115 -2.630 -10.542 -4.302 1.00 0.46 H new ATOM 0 HB2 PRO A 115 -3.908 -11.873 -6.778 1.00 0.59 H new ATOM 0 HB3 PRO A 115 -4.393 -12.082 -5.107 1.00 0.59 H new ATOM 0 HG2 PRO A 115 -5.737 -10.418 -6.682 1.00 0.65 H new ATOM 0 HG3 PRO A 115 -5.447 -10.001 -5.005 1.00 0.65 H new ATOM 0 HD2 PRO A 115 -4.246 -8.836 -7.450 1.00 0.53 H new ATOM 0 HD3 PRO A 115 -4.383 -8.138 -5.849 1.00 0.53 H new ATOM 438 N ASP A 116 -1.153 -12.338 -4.632 1.00 0.46 N ATOM 439 CA ASP A 116 -0.069 -13.293 -4.719 1.00 0.49 C ATOM 440 C ASP A 116 1.233 -12.560 -4.986 1.00 0.48 C ATOM 441 O ASP A 116 2.068 -12.975 -5.792 1.00 0.58 O ATOM 442 CB ASP A 116 -0.382 -14.331 -5.784 1.00 0.55 C ATOM 443 CG ASP A 116 0.596 -15.492 -5.806 1.00 0.63 C ATOM 444 OD1 ASP A 116 1.234 -15.719 -6.860 1.00 0.67 O ATOM 445 OD2 ASP A 116 0.756 -16.166 -4.767 1.00 0.72 O ATOM 0 H ASP A 116 -1.557 -12.256 -3.699 1.00 0.46 H new ATOM 0 HA ASP A 116 0.043 -13.825 -3.774 1.00 0.49 H new ATOM 0 HB2 ASP A 116 -1.388 -14.717 -5.619 1.00 0.55 H new ATOM 0 HB3 ASP A 116 -0.382 -13.848 -6.761 1.00 0.55 H new ATOM 450 N MET A 117 1.371 -11.428 -4.316 1.00 0.39 N ATOM 451 CA MET A 117 2.607 -10.686 -4.321 1.00 0.40 C ATOM 452 C MET A 117 3.207 -10.703 -2.939 1.00 0.37 C ATOM 453 O MET A 117 2.499 -10.833 -1.953 1.00 0.33 O ATOM 454 CB MET A 117 2.424 -9.254 -4.806 1.00 0.42 C ATOM 455 CG MET A 117 1.348 -8.490 -4.093 1.00 0.45 C ATOM 456 SD MET A 117 1.513 -6.724 -4.324 1.00 0.80 S ATOM 457 CE MET A 117 0.116 -6.163 -3.372 1.00 1.67 C ATOM 0 H MET A 117 0.630 -11.005 -3.758 1.00 0.39 H new ATOM 0 HA MET A 117 3.284 -11.170 -5.025 1.00 0.40 H new ATOM 0 HB2 MET A 117 3.368 -8.721 -4.691 1.00 0.42 H new ATOM 0 HB3 MET A 117 2.195 -9.271 -5.872 1.00 0.42 H new ATOM 0 HG2 MET A 117 0.373 -8.813 -4.456 1.00 0.45 H new ATOM 0 HG3 MET A 117 1.384 -8.721 -3.028 1.00 0.45 H new ATOM 0 HE1 MET A 117 0.184 -5.085 -3.228 1.00 1.67 H new ATOM 0 HE2 MET A 117 -0.806 -6.401 -3.903 1.00 1.67 H new ATOM 0 HE3 MET A 117 0.114 -6.660 -2.402 1.00 1.67 H new ATOM 467 N THR A 118 4.502 -10.559 -2.866 1.00 0.41 N ATOM 468 CA THR A 118 5.195 -10.701 -1.614 1.00 0.41 C ATOM 469 C THR A 118 5.531 -9.323 -1.110 1.00 0.43 C ATOM 470 O THR A 118 6.551 -8.740 -1.463 1.00 0.58 O ATOM 471 CB THR A 118 6.460 -11.553 -1.757 1.00 0.49 C ATOM 472 OG1 THR A 118 6.133 -12.794 -2.395 1.00 0.52 O ATOM 473 CG2 THR A 118 7.070 -11.834 -0.392 1.00 0.49 C ATOM 0 H THR A 118 5.101 -10.342 -3.662 1.00 0.41 H new ATOM 0 HA THR A 118 4.553 -11.219 -0.902 1.00 0.41 H new ATOM 0 HB THR A 118 7.183 -11.005 -2.361 1.00 0.49 H new ATOM 0 HG1 THR A 118 6.943 -13.338 -2.488 1.00 0.52 H new ATOM 0 HG21 THR A 118 7.968 -12.440 -0.513 1.00 0.49 H new ATOM 0 HG22 THR A 118 7.330 -10.892 0.091 1.00 0.49 H new ATOM 0 HG23 THR A 118 6.350 -12.371 0.225 1.00 0.49 H new ATOM 481 N ILE A 119 4.644 -8.809 -0.298 1.00 0.41 N ATOM 482 CA ILE A 119 4.626 -7.406 -0.003 1.00 0.45 C ATOM 483 C ILE A 119 4.658 -7.164 1.509 1.00 0.40 C ATOM 484 O ILE A 119 4.380 -8.079 2.285 1.00 0.38 O ATOM 485 CB ILE A 119 3.398 -6.790 -0.647 1.00 0.53 C ATOM 486 CG1 ILE A 119 3.584 -5.302 -0.682 1.00 0.65 C ATOM 487 CG2 ILE A 119 2.155 -7.196 0.099 1.00 0.49 C ATOM 488 CD1 ILE A 119 3.116 -4.671 -1.951 1.00 0.56 C ATOM 0 H ILE A 119 3.919 -9.350 0.173 1.00 0.41 H new ATOM 0 HA ILE A 119 5.517 -6.930 -0.413 1.00 0.45 H new ATOM 0 HB ILE A 119 3.275 -7.150 -1.668 1.00 0.53 H new ATOM 0 HG12 ILE A 119 3.046 -4.857 0.155 1.00 0.65 H new ATOM 0 HG13 ILE A 119 4.640 -5.073 -0.540 1.00 0.65 H new ATOM 0 HG21 ILE A 119 1.283 -6.746 -0.375 1.00 0.49 H new ATOM 0 HG22 ILE A 119 2.058 -8.282 0.081 1.00 0.49 H new ATOM 0 HG23 ILE A 119 2.223 -6.855 1.132 1.00 0.49 H new ATOM 0 HD11 ILE A 119 3.282 -3.595 -1.905 1.00 0.56 H new ATOM 0 HD12 ILE A 119 3.671 -5.088 -2.791 1.00 0.56 H new ATOM 0 HD13 ILE A 119 2.053 -4.869 -2.085 1.00 0.56 H new ATOM 500 N SER A 120 5.011 -5.949 1.934 1.00 0.40 N ATOM 501 CA SER A 120 5.281 -5.690 3.328 1.00 0.39 C ATOM 502 C SER A 120 4.755 -4.312 3.679 1.00 0.42 C ATOM 503 O SER A 120 4.239 -3.626 2.803 1.00 0.44 O ATOM 504 CB SER A 120 6.786 -5.779 3.592 1.00 0.36 C ATOM 505 OG SER A 120 7.338 -6.959 3.022 1.00 0.38 O ATOM 0 H SER A 120 5.113 -5.137 1.325 1.00 0.40 H new ATOM 0 HA SER A 120 4.783 -6.434 3.950 1.00 0.39 H new ATOM 0 HB2 SER A 120 7.284 -4.903 3.175 1.00 0.36 H new ATOM 0 HB3 SER A 120 6.971 -5.770 4.666 1.00 0.36 H new ATOM 0 HG SER A 120 7.544 -6.800 2.077 1.00 0.38 H new ATOM 511 N LYS A 121 4.899 -3.897 4.927 1.00 0.45 N ATOM 512 CA LYS A 121 4.685 -2.499 5.295 1.00 0.50 C ATOM 513 C LYS A 121 5.541 -1.624 4.420 1.00 0.44 C ATOM 514 O LYS A 121 5.163 -0.527 4.059 1.00 0.42 O ATOM 515 CB LYS A 121 5.088 -2.240 6.739 1.00 0.62 C ATOM 516 CG LYS A 121 4.364 -3.099 7.745 1.00 0.58 C ATOM 517 CD LYS A 121 5.266 -3.490 8.907 1.00 1.16 C ATOM 518 CE LYS A 121 5.789 -2.274 9.662 1.00 1.76 C ATOM 519 NZ LYS A 121 4.695 -1.489 10.292 1.00 2.33 N ATOM 0 H LYS A 121 5.162 -4.503 5.704 1.00 0.45 H new ATOM 0 HA LYS A 121 3.625 -2.277 5.170 1.00 0.50 H new ATOM 0 HB2 LYS A 121 6.160 -2.406 6.841 1.00 0.62 H new ATOM 0 HB3 LYS A 121 4.904 -1.192 6.974 1.00 0.62 H new ATOM 0 HG2 LYS A 121 3.495 -2.561 8.124 1.00 0.58 H new ATOM 0 HG3 LYS A 121 3.993 -3.999 7.254 1.00 0.58 H new ATOM 0 HD2 LYS A 121 4.714 -4.132 9.593 1.00 1.16 H new ATOM 0 HD3 LYS A 121 6.107 -4.073 8.532 1.00 1.16 H new ATOM 0 HE2 LYS A 121 6.489 -2.600 10.431 1.00 1.76 H new ATOM 0 HE3 LYS A 121 6.344 -1.634 8.976 1.00 1.76 H new ATOM 0 HZ1 LYS A 121 5.103 -0.743 10.890 1.00 2.33 H new ATOM 0 HZ2 LYS A 121 4.107 -1.056 9.551 1.00 2.33 H new ATOM 0 HZ3 LYS A 121 4.108 -2.118 10.876 1.00 2.33 H new ATOM 533 N ASN A 122 6.707 -2.143 4.107 1.00 0.45 N ATOM 534 CA ASN A 122 7.699 -1.427 3.320 1.00 0.47 C ATOM 535 C ASN A 122 7.428 -1.508 1.818 1.00 0.46 C ATOM 536 O ASN A 122 7.754 -0.605 1.080 1.00 0.53 O ATOM 537 CB ASN A 122 9.063 -1.990 3.610 1.00 0.56 C ATOM 538 CG ASN A 122 10.203 -0.986 3.485 1.00 0.79 C ATOM 539 OD1 ASN A 122 10.136 -0.102 2.506 1.00 1.32 O flip ATOM 540 ND2 ASN A 122 11.166 -1.037 4.250 1.00 1.27 N flip ATOM 0 H ASN A 122 7.000 -3.078 4.390 1.00 0.45 H new ATOM 0 HA ASN A 122 7.644 -0.376 3.604 1.00 0.47 H new ATOM 0 HB2 ASN A 122 9.066 -2.399 4.620 1.00 0.56 H new ATOM 0 HB3 ASN A 122 9.251 -2.820 2.929 1.00 0.56 H new ATOM 0 HD21 ASN A 122 11.188 -1.732 4.997 1.00 1.27 H new ATOM 0 HD22 ASN A 122 11.942 -0.385 4.137 1.00 1.27 H new ATOM 547 N GLU A 123 6.876 -2.578 1.322 1.00 0.43 N ATOM 548 CA GLU A 123 6.619 -2.644 -0.077 1.00 0.46 C ATOM 549 C GLU A 123 5.286 -1.998 -0.367 1.00 0.46 C ATOM 550 O GLU A 123 4.983 -1.617 -1.480 1.00 0.59 O ATOM 551 CB GLU A 123 6.688 -4.077 -0.487 1.00 0.51 C ATOM 552 CG GLU A 123 8.108 -4.564 -0.692 1.00 0.78 C ATOM 553 CD GLU A 123 8.223 -6.067 -0.690 1.00 1.23 C ATOM 554 OE1 GLU A 123 8.021 -6.676 0.379 1.00 1.57 O ATOM 555 OE2 GLU A 123 8.491 -6.647 -1.768 1.00 2.06 O ATOM 0 H GLU A 123 6.601 -3.401 1.859 1.00 0.43 H new ATOM 0 HA GLU A 123 7.360 -2.095 -0.659 1.00 0.46 H new ATOM 0 HB2 GLU A 123 6.205 -4.691 0.273 1.00 0.51 H new ATOM 0 HB3 GLU A 123 6.126 -4.213 -1.411 1.00 0.51 H new ATOM 0 HG2 GLU A 123 8.485 -4.178 -1.639 1.00 0.78 H new ATOM 0 HG3 GLU A 123 8.743 -4.156 0.094 1.00 0.78 H new ATOM 562 N MET A 124 4.494 -1.921 0.670 1.00 0.41 N ATOM 563 CA MET A 124 3.298 -1.096 0.690 1.00 0.40 C ATOM 564 C MET A 124 3.629 0.321 1.086 1.00 0.36 C ATOM 565 O MET A 124 2.829 1.208 0.902 1.00 0.38 O ATOM 566 CB MET A 124 2.285 -1.606 1.693 1.00 0.47 C ATOM 567 CG MET A 124 1.603 -2.886 1.277 1.00 1.17 C ATOM 568 SD MET A 124 0.871 -2.781 -0.358 1.00 2.20 S ATOM 569 CE MET A 124 0.138 -4.404 -0.451 1.00 3.13 C ATOM 0 H MET A 124 4.656 -2.432 1.538 1.00 0.41 H new ATOM 0 HA MET A 124 2.885 -1.135 -0.318 1.00 0.40 H new ATOM 0 HB2 MET A 124 2.784 -1.766 2.649 1.00 0.47 H new ATOM 0 HB3 MET A 124 1.528 -0.838 1.853 1.00 0.47 H new ATOM 0 HG2 MET A 124 2.327 -3.701 1.295 1.00 1.17 H new ATOM 0 HG3 MET A 124 0.828 -3.132 2.003 1.00 1.17 H new ATOM 0 HE1 MET A 124 -0.825 -4.340 -0.957 1.00 3.13 H new ATOM 0 HE2 MET A 124 0.797 -5.070 -1.008 1.00 3.13 H new ATOM 0 HE3 MET A 124 -0.007 -4.796 0.556 1.00 3.13 H new ATOM 579 N VAL A 125 4.778 0.523 1.701 1.00 0.35 N ATOM 580 CA VAL A 125 5.062 1.800 2.339 1.00 0.32 C ATOM 581 C VAL A 125 4.884 2.937 1.382 1.00 0.30 C ATOM 582 O VAL A 125 4.457 4.021 1.745 1.00 0.29 O ATOM 583 CB VAL A 125 6.475 1.878 2.924 1.00 0.34 C ATOM 584 CG1 VAL A 125 7.555 1.884 1.853 1.00 0.37 C ATOM 585 CG2 VAL A 125 6.600 3.115 3.785 1.00 0.34 C ATOM 0 H VAL A 125 5.524 -0.169 1.774 1.00 0.35 H new ATOM 0 HA VAL A 125 4.346 1.879 3.157 1.00 0.32 H new ATOM 0 HB VAL A 125 6.626 0.981 3.525 1.00 0.34 H new ATOM 0 HG11 VAL A 125 8.536 1.941 2.325 1.00 0.37 H new ATOM 0 HG12 VAL A 125 7.488 0.969 1.264 1.00 0.37 H new ATOM 0 HG13 VAL A 125 7.416 2.746 1.201 1.00 0.37 H new ATOM 0 HG21 VAL A 125 7.606 3.169 4.201 1.00 0.34 H new ATOM 0 HG22 VAL A 125 6.410 4.001 3.179 1.00 0.34 H new ATOM 0 HG23 VAL A 125 5.874 3.068 4.597 1.00 0.34 H new ATOM 595 N LYS A 126 5.245 2.683 0.163 1.00 0.33 N ATOM 596 CA LYS A 126 5.064 3.669 -0.877 1.00 0.35 C ATOM 597 C LYS A 126 3.606 3.846 -1.243 1.00 0.39 C ATOM 598 O LYS A 126 3.166 4.947 -1.521 1.00 0.41 O ATOM 599 CB LYS A 126 5.885 3.292 -2.075 1.00 0.39 C ATOM 600 CG LYS A 126 7.355 3.201 -1.784 1.00 0.37 C ATOM 601 CD LYS A 126 7.997 4.516 -1.337 1.00 0.38 C ATOM 602 CE LYS A 126 7.622 4.918 0.071 1.00 0.41 C ATOM 603 NZ LYS A 126 8.738 5.576 0.800 1.00 0.63 N ATOM 0 H LYS A 126 5.666 1.806 -0.144 1.00 0.33 H new ATOM 0 HA LYS A 126 5.407 4.632 -0.499 1.00 0.35 H new ATOM 0 HB2 LYS A 126 5.537 2.332 -2.457 1.00 0.39 H new ATOM 0 HB3 LYS A 126 5.723 4.027 -2.864 1.00 0.39 H new ATOM 0 HG2 LYS A 126 7.513 2.452 -1.008 1.00 0.37 H new ATOM 0 HG3 LYS A 126 7.868 2.847 -2.678 1.00 0.37 H new ATOM 0 HD2 LYS A 126 9.081 4.424 -1.404 1.00 0.38 H new ATOM 0 HD3 LYS A 126 7.701 5.308 -2.024 1.00 0.38 H new ATOM 0 HE2 LYS A 126 6.769 5.595 0.035 1.00 0.41 H new ATOM 0 HE3 LYS A 126 7.305 4.034 0.624 1.00 0.41 H new ATOM 0 HZ1 LYS A 126 8.351 6.215 1.523 1.00 0.63 H new ATOM 0 HZ2 LYS A 126 9.328 4.852 1.258 1.00 0.63 H new ATOM 0 HZ3 LYS A 126 9.317 6.121 0.130 1.00 0.63 H new ATOM 617 N LEU A 127 2.897 2.742 -1.296 1.00 0.44 N ATOM 618 CA LEU A 127 1.432 2.726 -1.338 1.00 0.50 C ATOM 619 C LEU A 127 0.887 3.626 -0.224 1.00 0.43 C ATOM 620 O LEU A 127 -0.107 4.328 -0.388 1.00 0.49 O ATOM 621 CB LEU A 127 0.999 1.256 -1.138 1.00 0.56 C ATOM 622 CG LEU A 127 -0.427 0.837 -1.456 1.00 0.67 C ATOM 623 CD1 LEU A 127 -1.424 1.578 -0.595 1.00 1.47 C ATOM 624 CD2 LEU A 127 -0.722 0.983 -2.939 1.00 1.79 C ATOM 0 H LEU A 127 3.316 1.812 -1.312 1.00 0.44 H new ATOM 0 HA LEU A 127 1.043 3.103 -2.284 1.00 0.50 H new ATOM 0 HB2 LEU A 127 1.662 0.637 -1.743 1.00 0.56 H new ATOM 0 HB3 LEU A 127 1.188 1.001 -0.095 1.00 0.56 H new ATOM 0 HG LEU A 127 -0.531 -0.221 -1.214 1.00 0.67 H new ATOM 0 HD11 LEU A 127 -2.434 1.255 -0.848 1.00 1.47 H new ATOM 0 HD12 LEU A 127 -1.227 1.365 0.456 1.00 1.47 H new ATOM 0 HD13 LEU A 127 -1.331 2.650 -0.771 1.00 1.47 H new ATOM 0 HD21 LEU A 127 -1.749 0.676 -3.138 1.00 1.79 H new ATOM 0 HD22 LEU A 127 -0.590 2.024 -3.235 1.00 1.79 H new ATOM 0 HD23 LEU A 127 -0.039 0.354 -3.510 1.00 1.79 H new ATOM 636 N LEU A 128 1.578 3.619 0.896 1.00 0.34 N ATOM 637 CA LEU A 128 1.127 4.327 2.076 1.00 0.30 C ATOM 638 C LEU A 128 1.588 5.765 2.026 1.00 0.32 C ATOM 639 O LEU A 128 0.919 6.670 2.512 1.00 0.36 O ATOM 640 CB LEU A 128 1.628 3.613 3.311 1.00 0.27 C ATOM 641 CG LEU A 128 1.405 2.106 3.259 1.00 0.32 C ATOM 642 CD1 LEU A 128 1.919 1.449 4.517 1.00 0.38 C ATOM 643 CD2 LEU A 128 -0.069 1.788 3.018 1.00 0.34 C ATOM 0 H LEU A 128 2.463 3.126 1.015 1.00 0.34 H new ATOM 0 HA LEU A 128 0.038 4.338 2.112 1.00 0.30 H new ATOM 0 HB2 LEU A 128 2.692 3.813 3.433 1.00 0.27 H new ATOM 0 HB3 LEU A 128 1.125 4.019 4.188 1.00 0.27 H new ATOM 0 HG LEU A 128 1.970 1.698 2.421 1.00 0.32 H new ATOM 0 HD11 LEU A 128 1.751 0.374 4.461 1.00 0.38 H new ATOM 0 HD12 LEU A 128 2.986 1.644 4.619 1.00 0.38 H new ATOM 0 HD13 LEU A 128 1.392 1.854 5.381 1.00 0.38 H new ATOM 0 HD21 LEU A 128 -0.207 0.707 2.984 1.00 0.34 H new ATOM 0 HD22 LEU A 128 -0.668 2.205 3.827 1.00 0.34 H new ATOM 0 HD23 LEU A 128 -0.385 2.224 2.070 1.00 0.34 H new ATOM 655 N GLU A 129 2.762 5.935 1.458 1.00 0.30 N ATOM 656 CA GLU A 129 3.283 7.222 1.060 1.00 0.35 C ATOM 657 C GLU A 129 2.329 7.862 0.067 1.00 0.44 C ATOM 658 O GLU A 129 2.141 9.071 0.042 1.00 0.56 O ATOM 659 CB GLU A 129 4.620 6.974 0.390 1.00 0.35 C ATOM 660 CG GLU A 129 5.654 8.044 0.647 1.00 0.91 C ATOM 661 CD GLU A 129 6.178 8.014 2.064 1.00 1.04 C ATOM 662 OE1 GLU A 129 5.654 8.762 2.912 1.00 1.96 O ATOM 663 OE2 GLU A 129 7.123 7.242 2.334 1.00 1.41 O ATOM 0 H GLU A 129 3.396 5.162 1.256 1.00 0.30 H new ATOM 0 HA GLU A 129 3.395 7.884 1.918 1.00 0.35 H new ATOM 0 HB2 GLU A 129 5.012 6.017 0.733 1.00 0.35 H new ATOM 0 HB3 GLU A 129 4.463 6.888 -0.685 1.00 0.35 H new ATOM 0 HG2 GLU A 129 6.485 7.916 -0.047 1.00 0.91 H new ATOM 0 HG3 GLU A 129 5.218 9.022 0.445 1.00 0.91 H new ATOM 670 N ALA A 130 1.745 6.995 -0.734 1.00 0.45 N ATOM 671 CA ALA A 130 0.831 7.351 -1.802 1.00 0.54 C ATOM 672 C ALA A 130 -0.531 7.782 -1.272 1.00 0.56 C ATOM 673 O ALA A 130 -1.152 8.697 -1.805 1.00 0.64 O ATOM 674 CB ALA A 130 0.681 6.147 -2.703 1.00 0.58 C ATOM 0 H ALA A 130 1.898 5.989 -0.658 1.00 0.45 H new ATOM 0 HA ALA A 130 1.237 8.202 -2.349 1.00 0.54 H new ATOM 0 HB1 ALA A 130 -0.003 6.385 -3.518 1.00 0.58 H new ATOM 0 HB2 ALA A 130 1.654 5.876 -3.113 1.00 0.58 H new ATOM 0 HB3 ALA A 130 0.283 5.310 -2.129 1.00 0.58 H new ATOM 680 N THR A 131 -0.995 7.120 -0.219 1.00 0.48 N ATOM 681 CA THR A 131 -2.254 7.500 0.416 1.00 0.46 C ATOM 682 C THR A 131 -1.925 8.528 1.474 1.00 0.45 C ATOM 683 O THR A 131 -2.767 9.177 2.077 1.00 0.52 O ATOM 684 CB THR A 131 -3.006 6.279 1.001 1.00 0.39 C ATOM 685 OG1 THR A 131 -4.275 6.660 1.524 1.00 0.59 O ATOM 686 CG2 THR A 131 -2.205 5.583 2.079 1.00 0.57 C ATOM 0 H THR A 131 -0.524 6.324 0.211 1.00 0.48 H new ATOM 0 HA THR A 131 -2.936 7.923 -0.322 1.00 0.46 H new ATOM 0 HB THR A 131 -3.152 5.580 0.177 1.00 0.39 H new ATOM 0 HG1 THR A 131 -4.981 6.382 0.904 1.00 0.59 H new ATOM 0 HG21 THR A 131 -2.770 4.733 2.461 1.00 0.57 H new ATOM 0 HG22 THR A 131 -1.261 5.233 1.662 1.00 0.57 H new ATOM 0 HG23 THR A 131 -2.006 6.281 2.892 1.00 0.57 H new ATOM 694 N GLN A 132 -0.639 8.688 1.586 1.00 0.44 N ATOM 695 CA GLN A 132 0.014 9.656 2.410 1.00 0.46 C ATOM 696 C GLN A 132 -0.382 9.544 3.873 1.00 0.42 C ATOM 697 O GLN A 132 -0.793 10.532 4.489 1.00 0.49 O ATOM 698 CB GLN A 132 -0.270 11.036 1.884 1.00 0.56 C ATOM 699 CG GLN A 132 -0.019 11.155 0.399 1.00 0.62 C ATOM 700 CD GLN A 132 -0.844 12.252 -0.238 1.00 1.03 C ATOM 701 OE1 GLN A 132 -1.957 12.022 -0.704 1.00 1.53 O ATOM 702 NE2 GLN A 132 -0.309 13.462 -0.246 1.00 1.80 N ATOM 0 H GLN A 132 0.022 8.107 1.070 1.00 0.44 H new ATOM 0 HA GLN A 132 1.085 9.459 2.367 1.00 0.46 H new ATOM 0 HB2 GLN A 132 -1.308 11.295 2.095 1.00 0.56 H new ATOM 0 HB3 GLN A 132 0.353 11.758 2.413 1.00 0.56 H new ATOM 0 HG2 GLN A 132 1.039 11.353 0.227 1.00 0.62 H new ATOM 0 HG3 GLN A 132 -0.248 10.205 -0.083 1.00 0.62 H new ATOM 0 HE21 GLN A 132 0.618 13.612 0.151 1.00 1.80 H new ATOM 0 HE22 GLN A 132 -0.824 14.245 -0.649 1.00 1.80 H new ATOM 711 N TYR A 133 -0.253 8.355 4.440 1.00 0.33 N ATOM 712 CA TYR A 133 -0.659 8.156 5.814 1.00 0.30 C ATOM 713 C TYR A 133 0.350 7.342 6.596 1.00 0.27 C ATOM 714 O TYR A 133 1.377 6.913 6.062 1.00 0.27 O ATOM 715 CB TYR A 133 -2.019 7.484 5.907 1.00 0.27 C ATOM 716 CG TYR A 133 -2.685 7.758 7.226 1.00 0.30 C ATOM 717 CD1 TYR A 133 -3.404 6.754 7.861 1.00 0.27 C ATOM 718 CD2 TYR A 133 -2.614 8.998 7.829 1.00 0.40 C ATOM 719 CE1 TYR A 133 -4.030 6.973 9.061 1.00 0.34 C ATOM 720 CE2 TYR A 133 -3.240 9.217 9.041 1.00 0.46 C ATOM 721 CZ TYR A 133 -3.879 8.323 9.660 1.00 0.41 C ATOM 722 OH TYR A 133 -4.569 8.430 10.858 1.00 0.52 O ATOM 0 H TYR A 133 0.124 7.528 3.976 1.00 0.33 H new ATOM 0 HA TYR A 133 -0.721 9.151 6.254 1.00 0.30 H new ATOM 0 HB2 TYR A 133 -2.656 7.839 5.097 1.00 0.27 H new ATOM 0 HB3 TYR A 133 -1.903 6.408 5.774 1.00 0.27 H new ATOM 0 HD1 TYR A 133 -3.472 5.780 7.400 1.00 0.27 H new ATOM 0 HD2 TYR A 133 -2.068 9.799 7.352 1.00 0.40 H new ATOM 0 HE1 TYR A 133 -4.606 6.200 9.548 1.00 0.34 H new ATOM 0 HE2 TYR A 133 -3.179 10.202 9.480 1.00 0.46 H new ATOM 0 HH TYR A 133 -4.448 9.330 11.226 1.00 0.52 H new ATOM 732 N ARG A 134 0.069 7.175 7.881 1.00 0.28 N ATOM 733 CA ARG A 134 0.848 6.305 8.721 1.00 0.29 C ATOM 734 C ARG A 134 -0.124 5.464 9.541 1.00 0.27 C ATOM 735 O ARG A 134 -1.257 5.883 9.753 1.00 0.28 O ATOM 736 CB ARG A 134 1.785 7.117 9.607 1.00 0.38 C ATOM 737 CG ARG A 134 2.814 6.276 10.345 1.00 1.16 C ATOM 738 CD ARG A 134 3.657 7.116 11.290 1.00 1.83 C ATOM 739 NE ARG A 134 4.695 6.316 11.941 1.00 2.68 N ATOM 740 CZ ARG A 134 5.036 6.426 13.225 1.00 3.59 C ATOM 741 NH1 ARG A 134 4.421 7.301 14.012 1.00 3.92 N ATOM 742 NH2 ARG A 134 5.989 5.652 13.729 1.00 4.54 N ATOM 0 H ARG A 134 -0.703 7.640 8.359 1.00 0.28 H new ATOM 0 HA ARG A 134 1.480 5.649 8.122 1.00 0.29 H new ATOM 0 HB2 ARG A 134 2.304 7.853 8.993 1.00 0.38 H new ATOM 0 HB3 ARG A 134 1.192 7.671 10.335 1.00 0.38 H new ATOM 0 HG2 ARG A 134 2.307 5.493 10.909 1.00 1.16 H new ATOM 0 HG3 ARG A 134 3.463 5.779 9.623 1.00 1.16 H new ATOM 0 HD2 ARG A 134 4.120 7.933 10.737 1.00 1.83 H new ATOM 0 HD3 ARG A 134 3.016 7.567 12.047 1.00 1.83 H new ATOM 0 HE ARG A 134 5.191 5.628 11.374 1.00 2.68 H new ATOM 0 HH11 ARG A 134 3.682 7.895 13.635 1.00 3.92 H new ATOM 0 HH12 ARG A 134 4.687 7.379 14.993 1.00 3.92 H new ATOM 0 HH21 ARG A 134 6.462 4.972 13.134 1.00 4.54 H new ATOM 0 HH22 ARG A 134 6.249 5.737 14.712 1.00 4.54 H new ATOM 756 N GLN A 135 0.311 4.293 9.987 1.00 0.27 N ATOM 757 CA GLN A 135 -0.580 3.307 10.590 1.00 0.27 C ATOM 758 C GLN A 135 -1.450 3.889 11.676 1.00 0.29 C ATOM 759 O GLN A 135 -1.027 4.701 12.504 1.00 0.32 O ATOM 760 CB GLN A 135 0.204 2.134 11.124 1.00 0.29 C ATOM 761 CG GLN A 135 -0.683 1.018 11.666 1.00 0.30 C ATOM 762 CD GLN A 135 -0.707 0.959 13.183 1.00 0.38 C ATOM 763 OE1 GLN A 135 0.397 1.319 13.817 1.00 1.10 O flip ATOM 764 NE2 GLN A 135 -1.711 0.581 13.779 1.00 1.28 N flip ATOM 0 H GLN A 135 1.287 3.999 9.942 1.00 0.27 H new ATOM 0 HA GLN A 135 -1.245 2.966 9.796 1.00 0.27 H new ATOM 0 HB2 GLN A 135 0.835 1.735 10.330 1.00 0.29 H new ATOM 0 HB3 GLN A 135 0.868 2.479 11.916 1.00 0.29 H new ATOM 0 HG2 GLN A 135 -1.699 1.159 11.298 1.00 0.30 H new ATOM 0 HG3 GLN A 135 -0.332 0.062 11.277 1.00 0.30 H new ATOM 0 HE21 GLN A 135 -2.544 0.311 13.255 1.00 1.28 H new ATOM 0 HE22 GLN A 135 -1.713 0.536 14.798 1.00 1.28 H new ATOM 773 N VAL A 136 -2.666 3.424 11.651 1.00 0.31 N ATOM 774 CA VAL A 136 -3.742 4.012 12.370 1.00 0.37 C ATOM 775 C VAL A 136 -4.636 2.912 12.939 1.00 0.43 C ATOM 776 O VAL A 136 -4.896 1.907 12.277 1.00 0.48 O ATOM 777 CB VAL A 136 -4.447 4.923 11.361 1.00 0.47 C ATOM 778 CG1 VAL A 136 -5.066 4.136 10.265 1.00 1.05 C ATOM 779 CG2 VAL A 136 -5.479 5.802 11.957 1.00 0.92 C ATOM 0 H VAL A 136 -2.936 2.601 11.112 1.00 0.31 H new ATOM 0 HA VAL A 136 -3.428 4.599 13.233 1.00 0.37 H new ATOM 0 HB VAL A 136 -3.657 5.565 10.971 1.00 0.47 H new ATOM 0 HG11 VAL A 136 -5.558 4.811 9.565 1.00 1.05 H new ATOM 0 HG12 VAL A 136 -4.294 3.571 9.742 1.00 1.05 H new ATOM 0 HG13 VAL A 136 -5.800 3.447 10.682 1.00 1.05 H new ATOM 0 HG21 VAL A 136 -5.930 6.415 11.176 1.00 0.92 H new ATOM 0 HG22 VAL A 136 -6.249 5.191 12.429 1.00 0.92 H new ATOM 0 HG23 VAL A 136 -5.019 6.448 12.705 1.00 0.92 H new ATOM 789 N SER A 137 -5.042 3.084 14.202 1.00 0.49 N ATOM 790 CA SER A 137 -5.839 2.083 14.913 1.00 0.57 C ATOM 791 C SER A 137 -7.125 1.846 14.174 1.00 0.53 C ATOM 792 O SER A 137 -7.698 0.757 14.178 1.00 0.60 O ATOM 793 CB SER A 137 -6.184 2.572 16.318 1.00 0.67 C ATOM 794 OG SER A 137 -6.563 1.496 17.162 1.00 1.38 O ATOM 0 H SER A 137 -4.829 3.914 14.755 1.00 0.49 H new ATOM 0 HA SER A 137 -5.255 1.164 14.976 1.00 0.57 H new ATOM 0 HB2 SER A 137 -5.325 3.087 16.747 1.00 0.67 H new ATOM 0 HB3 SER A 137 -6.996 3.297 16.263 1.00 0.67 H new ATOM 0 HG SER A 137 -6.776 1.840 18.055 1.00 1.38 H new ATOM 800 N LYS A 138 -7.546 2.901 13.542 1.00 0.47 N ATOM 801 CA LYS A 138 -8.774 2.920 12.794 1.00 0.46 C ATOM 802 C LYS A 138 -8.725 4.039 11.812 1.00 0.43 C ATOM 803 O LYS A 138 -8.578 5.207 12.167 1.00 0.44 O ATOM 804 CB LYS A 138 -9.971 3.097 13.690 1.00 0.51 C ATOM 805 CG LYS A 138 -11.259 3.421 12.951 1.00 0.55 C ATOM 806 CD LYS A 138 -12.307 3.993 13.883 1.00 0.82 C ATOM 807 CE LYS A 138 -11.911 5.370 14.379 1.00 0.92 C ATOM 808 NZ LYS A 138 -12.949 5.966 15.261 1.00 1.44 N ATOM 0 H LYS A 138 -7.041 3.787 13.530 1.00 0.47 H new ATOM 0 HA LYS A 138 -8.877 1.962 12.284 1.00 0.46 H new ATOM 0 HB2 LYS A 138 -10.116 2.184 14.268 1.00 0.51 H new ATOM 0 HB3 LYS A 138 -9.763 3.896 14.402 1.00 0.51 H new ATOM 0 HG2 LYS A 138 -11.052 4.135 12.153 1.00 0.55 H new ATOM 0 HG3 LYS A 138 -11.645 2.518 12.478 1.00 0.55 H new ATOM 0 HD2 LYS A 138 -13.264 4.052 13.365 1.00 0.82 H new ATOM 0 HD3 LYS A 138 -12.445 3.324 14.732 1.00 0.82 H new ATOM 0 HE2 LYS A 138 -10.969 5.302 14.923 1.00 0.92 H new ATOM 0 HE3 LYS A 138 -11.740 6.027 13.526 1.00 0.92 H new ATOM 0 HZ1 LYS A 138 -12.638 6.907 15.577 1.00 1.44 H new ATOM 0 HZ2 LYS A 138 -13.842 6.056 14.735 1.00 1.44 H new ATOM 0 HZ3 LYS A 138 -13.095 5.353 16.089 1.00 1.44 H new ATOM 822 N MET A 139 -8.836 3.667 10.588 1.00 0.42 N ATOM 823 CA MET A 139 -8.761 4.596 9.515 1.00 0.41 C ATOM 824 C MET A 139 -10.111 4.734 8.850 1.00 0.46 C ATOM 825 O MET A 139 -10.705 3.745 8.410 1.00 0.57 O ATOM 826 CB MET A 139 -7.701 4.115 8.532 1.00 0.41 C ATOM 827 CG MET A 139 -8.178 3.917 7.103 1.00 0.61 C ATOM 828 SD MET A 139 -7.801 2.280 6.441 1.00 0.90 S ATOM 829 CE MET A 139 -8.961 1.263 7.354 1.00 0.54 C ATOM 0 H MET A 139 -8.983 2.700 10.298 1.00 0.42 H new ATOM 0 HA MET A 139 -8.480 5.582 9.886 1.00 0.41 H new ATOM 0 HB2 MET A 139 -6.882 4.834 8.527 1.00 0.41 H new ATOM 0 HB3 MET A 139 -7.295 3.171 8.895 1.00 0.41 H new ATOM 0 HG2 MET A 139 -9.255 4.078 7.062 1.00 0.61 H new ATOM 0 HG3 MET A 139 -7.718 4.673 6.466 1.00 0.61 H new ATOM 0 HE1 MET A 139 -8.629 0.225 7.335 1.00 0.54 H new ATOM 0 HE2 MET A 139 -9.013 1.608 8.387 1.00 0.54 H new ATOM 0 HE3 MET A 139 -9.948 1.336 6.897 1.00 0.54 H new ATOM 839 N THR A 140 -10.637 5.936 8.843 1.00 0.42 N ATOM 840 CA THR A 140 -11.624 6.270 7.862 1.00 0.43 C ATOM 841 C THR A 140 -11.590 7.761 7.615 1.00 0.41 C ATOM 842 O THR A 140 -12.161 8.580 8.339 1.00 0.48 O ATOM 843 CB THR A 140 -13.010 5.812 8.357 1.00 0.53 C ATOM 844 OG1 THR A 140 -14.068 6.461 7.635 1.00 0.61 O ATOM 845 CG2 THR A 140 -13.148 6.065 9.857 1.00 0.58 C ATOM 0 H THR A 140 -10.399 6.683 9.496 1.00 0.42 H new ATOM 0 HA THR A 140 -11.415 5.761 6.921 1.00 0.43 H new ATOM 0 HB THR A 140 -13.094 4.741 8.172 1.00 0.53 H new ATOM 0 HG1 THR A 140 -14.934 6.148 7.971 1.00 0.61 H new ATOM 0 HG21 THR A 140 -14.132 5.737 10.192 1.00 0.58 H new ATOM 0 HG22 THR A 140 -12.378 5.509 10.392 1.00 0.58 H new ATOM 0 HG23 THR A 140 -13.033 7.130 10.058 1.00 0.58 H new ATOM 853 N ARG A 141 -10.858 8.060 6.570 1.00 0.35 N ATOM 854 CA ARG A 141 -10.825 9.319 5.872 1.00 0.36 C ATOM 855 C ARG A 141 -10.088 9.031 4.565 1.00 0.32 C ATOM 856 O ARG A 141 -9.415 8.007 4.479 1.00 0.32 O ATOM 857 CB ARG A 141 -10.121 10.368 6.727 1.00 0.40 C ATOM 858 CG ARG A 141 -9.115 9.752 7.666 1.00 0.43 C ATOM 859 CD ARG A 141 -9.424 10.072 9.106 1.00 0.53 C ATOM 860 NE ARG A 141 -9.231 11.489 9.401 1.00 0.87 N ATOM 861 CZ ARG A 141 -9.846 12.132 10.388 1.00 1.27 C ATOM 862 NH1 ARG A 141 -10.663 11.476 11.201 1.00 1.53 N ATOM 863 NH2 ARG A 141 -9.639 13.428 10.566 1.00 1.77 N ATOM 0 H ARG A 141 -10.223 7.378 6.156 1.00 0.35 H new ATOM 0 HA ARG A 141 -11.817 9.723 5.668 1.00 0.36 H new ATOM 0 HB2 ARG A 141 -9.619 11.086 6.079 1.00 0.40 H new ATOM 0 HB3 ARG A 141 -10.862 10.922 7.303 1.00 0.40 H new ATOM 0 HG2 ARG A 141 -9.104 8.671 7.528 1.00 0.43 H new ATOM 0 HG3 ARG A 141 -8.117 10.115 7.419 1.00 0.43 H new ATOM 0 HD2 ARG A 141 -10.454 9.792 9.328 1.00 0.53 H new ATOM 0 HD3 ARG A 141 -8.784 9.475 9.756 1.00 0.53 H new ATOM 0 HE ARG A 141 -8.585 12.017 8.814 1.00 0.87 H new ATOM 0 HH11 ARG A 141 -10.820 10.477 11.069 1.00 1.53 H new ATOM 0 HH12 ARG A 141 -11.134 11.971 11.958 1.00 1.53 H new ATOM 0 HH21 ARG A 141 -9.007 13.934 9.945 1.00 1.77 H new ATOM 0 HH22 ARG A 141 -10.112 13.921 11.324 1.00 1.77 H new ATOM 877 N PRO A 142 -10.168 9.876 3.542 1.00 0.35 N ATOM 878 CA PRO A 142 -9.374 9.667 2.328 1.00 0.36 C ATOM 879 C PRO A 142 -7.883 9.950 2.566 1.00 0.30 C ATOM 880 O PRO A 142 -7.533 11.035 3.030 1.00 0.33 O ATOM 881 CB PRO A 142 -9.975 10.675 1.346 1.00 0.45 C ATOM 882 CG PRO A 142 -10.553 11.748 2.204 1.00 0.62 C ATOM 883 CD PRO A 142 -11.020 11.072 3.464 1.00 0.44 C ATOM 0 HA PRO A 142 -9.412 8.638 1.971 1.00 0.36 H new ATOM 0 HB2 PRO A 142 -9.215 11.073 0.674 1.00 0.45 H new ATOM 0 HB3 PRO A 142 -10.740 10.212 0.723 1.00 0.45 H new ATOM 0 HG2 PRO A 142 -9.808 12.513 2.426 1.00 0.62 H new ATOM 0 HG3 PRO A 142 -11.381 12.246 1.700 1.00 0.62 H new ATOM 0 HD2 PRO A 142 -10.893 11.714 4.336 1.00 0.44 H new ATOM 0 HD3 PRO A 142 -12.077 10.810 3.412 1.00 0.44 H new ATOM 891 N GLY A 143 -6.997 9.001 2.209 1.00 0.32 N ATOM 892 CA GLY A 143 -5.583 9.182 2.472 1.00 0.36 C ATOM 893 C GLY A 143 -5.101 8.503 3.744 1.00 0.35 C ATOM 894 O GLY A 143 -4.163 8.980 4.382 1.00 0.51 O ATOM 0 H GLY A 143 -7.241 8.124 1.748 1.00 0.32 H new ATOM 0 HA2 GLY A 143 -5.014 8.795 1.627 1.00 0.36 H new ATOM 0 HA3 GLY A 143 -5.369 10.249 2.538 1.00 0.36 H new ATOM 898 N GLU A 144 -5.734 7.397 4.122 1.00 0.27 N ATOM 899 CA GLU A 144 -5.369 6.671 5.323 1.00 0.28 C ATOM 900 C GLU A 144 -5.143 5.195 4.997 1.00 0.29 C ATOM 901 O GLU A 144 -5.322 4.785 3.857 1.00 0.43 O ATOM 902 CB GLU A 144 -6.468 6.843 6.373 1.00 0.30 C ATOM 903 CG GLU A 144 -6.327 8.101 7.219 1.00 0.71 C ATOM 904 CD GLU A 144 -6.283 9.403 6.439 1.00 1.59 C ATOM 905 OE1 GLU A 144 -7.128 9.584 5.533 1.00 2.16 O ATOM 906 OE2 GLU A 144 -5.406 10.240 6.702 1.00 1.95 O ATOM 0 H GLU A 144 -6.510 6.984 3.604 1.00 0.27 H new ATOM 0 HA GLU A 144 -4.438 7.070 5.725 1.00 0.28 H new ATOM 0 HB2 GLU A 144 -7.435 6.862 5.871 1.00 0.30 H new ATOM 0 HB3 GLU A 144 -6.467 5.974 7.031 1.00 0.30 H new ATOM 0 HG2 GLU A 144 -7.161 8.144 7.920 1.00 0.71 H new ATOM 0 HG3 GLU A 144 -5.416 8.020 7.812 1.00 0.71 H new ATOM 913 N PHE A 145 -4.691 4.422 5.980 1.00 0.22 N ATOM 914 CA PHE A 145 -4.521 2.970 5.829 1.00 0.21 C ATOM 915 C PHE A 145 -4.259 2.383 7.186 1.00 0.22 C ATOM 916 O PHE A 145 -3.837 3.095 8.082 1.00 0.28 O ATOM 917 CB PHE A 145 -3.323 2.625 4.955 1.00 0.18 C ATOM 918 CG PHE A 145 -2.018 2.957 5.577 1.00 0.15 C ATOM 919 CD1 PHE A 145 -1.408 2.080 6.466 1.00 0.16 C ATOM 920 CD2 PHE A 145 -1.416 4.150 5.296 1.00 0.16 C ATOM 921 CE1 PHE A 145 -0.218 2.403 7.061 1.00 0.17 C ATOM 922 CE2 PHE A 145 -0.227 4.475 5.885 1.00 0.18 C ATOM 923 CZ PHE A 145 0.378 3.606 6.774 1.00 0.18 C ATOM 0 H PHE A 145 -4.432 4.776 6.901 1.00 0.22 H new ATOM 0 HA PHE A 145 -5.425 2.574 5.367 1.00 0.21 H new ATOM 0 HB2 PHE A 145 -3.346 1.560 4.726 1.00 0.18 H new ATOM 0 HB3 PHE A 145 -3.410 3.157 4.008 1.00 0.18 H new ATOM 0 HD1 PHE A 145 -1.878 1.134 6.690 1.00 0.16 H new ATOM 0 HD2 PHE A 145 -1.881 4.839 4.606 1.00 0.16 H new ATOM 0 HE1 PHE A 145 0.249 1.716 7.751 1.00 0.17 H new ATOM 0 HE2 PHE A 145 0.244 5.419 5.654 1.00 0.18 H new ATOM 0 HZ PHE A 145 1.315 3.872 7.240 1.00 0.18 H new ATOM 933 N THR A 146 -4.398 1.091 7.319 1.00 0.24 N ATOM 934 CA THR A 146 -4.056 0.448 8.568 1.00 0.24 C ATOM 935 C THR A 146 -3.213 -0.777 8.330 1.00 0.22 C ATOM 936 O THR A 146 -3.591 -1.664 7.585 1.00 0.24 O ATOM 937 CB THR A 146 -5.292 0.039 9.395 1.00 0.27 C ATOM 938 OG1 THR A 146 -5.951 -1.080 8.803 1.00 0.42 O ATOM 939 CG2 THR A 146 -6.290 1.171 9.520 1.00 0.39 C ATOM 0 H THR A 146 -4.741 0.466 6.590 1.00 0.24 H new ATOM 0 HA THR A 146 -3.496 1.190 9.137 1.00 0.24 H new ATOM 0 HB THR A 146 -4.927 -0.223 10.388 1.00 0.27 H new ATOM 0 HG1 THR A 146 -5.334 -1.540 8.197 1.00 0.42 H new ATOM 0 HG21 THR A 146 -7.144 0.839 10.110 1.00 0.39 H new ATOM 0 HG22 THR A 146 -5.817 2.020 10.013 1.00 0.39 H new ATOM 0 HG23 THR A 146 -6.628 1.469 8.528 1.00 0.39 H new ATOM 947 N VAL A 147 -2.080 -0.835 8.981 1.00 0.22 N ATOM 948 CA VAL A 147 -1.218 -1.991 8.835 1.00 0.23 C ATOM 949 C VAL A 147 -1.138 -2.805 10.124 1.00 0.29 C ATOM 950 O VAL A 147 -0.581 -2.362 11.132 1.00 0.34 O ATOM 951 CB VAL A 147 0.174 -1.600 8.312 1.00 0.24 C ATOM 952 CG1 VAL A 147 0.819 -0.549 9.188 1.00 0.26 C ATOM 953 CG2 VAL A 147 1.063 -2.832 8.186 1.00 0.29 C ATOM 0 H VAL A 147 -1.732 -0.111 9.609 1.00 0.22 H new ATOM 0 HA VAL A 147 -1.670 -2.637 8.082 1.00 0.23 H new ATOM 0 HB VAL A 147 0.050 -1.164 7.321 1.00 0.24 H new ATOM 0 HG11 VAL A 147 1.801 -0.296 8.789 1.00 0.26 H new ATOM 0 HG12 VAL A 147 0.194 0.344 9.206 1.00 0.26 H new ATOM 0 HG13 VAL A 147 0.927 -0.936 10.201 1.00 0.26 H new ATOM 0 HG21 VAL A 147 2.044 -2.536 7.815 1.00 0.29 H new ATOM 0 HG22 VAL A 147 1.172 -3.304 9.163 1.00 0.29 H new ATOM 0 HG23 VAL A 147 0.610 -3.538 7.491 1.00 0.29 H new ATOM 963 N GLN A 148 -1.724 -4.000 10.083 1.00 0.52 N ATOM 964 CA GLN A 148 -1.841 -4.850 11.264 1.00 0.68 C ATOM 965 C GLN A 148 -1.413 -6.289 10.963 1.00 0.75 C ATOM 966 O GLN A 148 -2.089 -7.240 11.366 1.00 1.52 O ATOM 967 CB GLN A 148 -3.285 -4.834 11.774 1.00 1.16 C ATOM 968 CG GLN A 148 -3.735 -3.480 12.303 1.00 1.93 C ATOM 969 CD GLN A 148 -3.082 -3.120 13.623 1.00 2.50 C ATOM 970 OE1 GLN A 148 -3.615 -3.412 14.692 1.00 3.11 O ATOM 971 NE2 GLN A 148 -1.921 -2.490 13.561 1.00 3.01 N ATOM 0 H GLN A 148 -2.128 -4.403 9.237 1.00 0.52 H new ATOM 0 HA GLN A 148 -1.176 -4.454 12.031 1.00 0.68 H new ATOM 0 HB2 GLN A 148 -3.950 -5.136 10.965 1.00 1.16 H new ATOM 0 HB3 GLN A 148 -3.389 -5.576 12.566 1.00 1.16 H new ATOM 0 HG2 GLN A 148 -3.503 -2.711 11.566 1.00 1.93 H new ATOM 0 HG3 GLN A 148 -4.818 -3.485 12.428 1.00 1.93 H new ATOM 0 HE21 GLN A 148 -1.511 -2.265 12.655 1.00 3.01 H new ATOM 0 HE22 GLN A 148 -1.436 -2.229 14.419 1.00 3.01 H new ATOM 980 N ALA A 149 -0.302 -6.429 10.237 1.00 0.84 N ATOM 981 CA ALA A 149 0.325 -7.731 9.954 1.00 1.18 C ATOM 982 C ALA A 149 -0.469 -8.590 8.966 1.00 0.92 C ATOM 983 O ALA A 149 0.073 -9.024 7.951 1.00 1.08 O ATOM 984 CB ALA A 149 0.584 -8.506 11.239 1.00 1.65 C ATOM 0 H ALA A 149 0.195 -5.640 9.824 1.00 0.84 H new ATOM 0 HA ALA A 149 1.277 -7.503 9.474 1.00 1.18 H new ATOM 0 HB1 ALA A 149 1.047 -9.463 11.000 1.00 1.65 H new ATOM 0 HB2 ALA A 149 1.250 -7.931 11.883 1.00 1.65 H new ATOM 0 HB3 ALA A 149 -0.360 -8.679 11.756 1.00 1.65 H new ATOM 990 N ASN A 150 -1.744 -8.830 9.250 1.00 0.69 N ATOM 991 CA ASN A 150 -2.561 -9.708 8.407 1.00 0.51 C ATOM 992 C ASN A 150 -3.058 -8.957 7.197 1.00 0.31 C ATOM 993 O ASN A 150 -3.508 -9.548 6.216 1.00 0.31 O ATOM 994 CB ASN A 150 -3.755 -10.263 9.177 1.00 0.64 C ATOM 995 CG ASN A 150 -3.354 -10.950 10.467 1.00 1.08 C ATOM 996 OD1 ASN A 150 -3.251 -10.311 11.516 1.00 1.68 O ATOM 997 ND2 ASN A 150 -3.134 -12.254 10.402 1.00 1.55 N ATOM 0 H ASN A 150 -2.236 -8.434 10.051 1.00 0.69 H new ATOM 0 HA ASN A 150 -1.931 -10.540 8.092 1.00 0.51 H new ATOM 0 HB2 ASN A 150 -4.445 -9.450 9.403 1.00 0.64 H new ATOM 0 HB3 ASN A 150 -4.292 -10.971 8.545 1.00 0.64 H new ATOM 0 HD21 ASN A 150 -2.868 -12.769 11.241 1.00 1.55 H new ATOM 0 HD22 ASN A 150 -3.231 -12.744 9.513 1.00 1.55 H new ATOM 1004 N SER A 151 -2.953 -7.653 7.269 1.00 0.29 N ATOM 1005 CA SER A 151 -3.383 -6.804 6.188 1.00 0.23 C ATOM 1006 C SER A 151 -2.838 -5.412 6.333 1.00 0.26 C ATOM 1007 O SER A 151 -2.487 -4.959 7.429 1.00 0.30 O ATOM 1008 CB SER A 151 -4.908 -6.747 6.107 1.00 0.27 C ATOM 1009 OG SER A 151 -5.485 -6.423 7.359 1.00 0.37 O ATOM 0 H SER A 151 -2.570 -7.154 8.072 1.00 0.29 H new ATOM 0 HA SER A 151 -2.993 -7.238 5.267 1.00 0.23 H new ATOM 0 HB2 SER A 151 -5.206 -6.006 5.366 1.00 0.27 H new ATOM 0 HB3 SER A 151 -5.291 -7.709 5.767 1.00 0.27 H new ATOM 0 HG SER A 151 -5.289 -5.488 7.577 1.00 0.37 H new ATOM 1015 N ILE A 152 -2.735 -4.773 5.200 1.00 0.27 N ATOM 1016 CA ILE A 152 -2.560 -3.354 5.140 1.00 0.30 C ATOM 1017 C ILE A 152 -3.799 -2.796 4.492 1.00 0.30 C ATOM 1018 O ILE A 152 -4.059 -3.021 3.326 1.00 0.34 O ATOM 1019 CB ILE A 152 -1.301 -2.904 4.355 1.00 0.33 C ATOM 1020 CG1 ILE A 152 -0.023 -3.392 5.072 1.00 0.38 C ATOM 1021 CG2 ILE A 152 -1.294 -1.383 4.229 1.00 0.40 C ATOM 1022 CD1 ILE A 152 1.290 -2.886 4.495 1.00 0.53 C ATOM 0 H ILE A 152 -2.771 -5.229 4.288 1.00 0.27 H new ATOM 0 HA ILE A 152 -2.409 -2.980 6.153 1.00 0.30 H new ATOM 0 HB ILE A 152 -1.323 -3.343 3.357 1.00 0.33 H new ATOM 0 HG12 ILE A 152 -0.078 -3.092 6.118 1.00 0.38 H new ATOM 0 HG13 ILE A 152 -0.011 -4.482 5.053 1.00 0.38 H new ATOM 0 HG21 ILE A 152 -0.409 -1.068 3.677 1.00 0.40 H new ATOM 0 HG22 ILE A 152 -2.188 -1.058 3.697 1.00 0.40 H new ATOM 0 HG23 ILE A 152 -1.280 -0.936 5.223 1.00 0.40 H new ATOM 0 HD11 ILE A 152 2.121 -3.289 5.073 1.00 0.53 H new ATOM 0 HD12 ILE A 152 1.380 -3.208 3.458 1.00 0.53 H new ATOM 0 HD13 ILE A 152 1.311 -1.797 4.540 1.00 0.53 H new ATOM 1034 N GLU A 153 -4.578 -2.105 5.256 1.00 0.30 N ATOM 1035 CA GLU A 153 -5.773 -1.511 4.739 1.00 0.37 C ATOM 1036 C GLU A 153 -5.390 -0.154 4.233 1.00 0.52 C ATOM 1037 O GLU A 153 -4.241 0.215 4.359 1.00 1.07 O ATOM 1038 CB GLU A 153 -6.877 -1.431 5.796 1.00 0.41 C ATOM 1039 CG GLU A 153 -7.522 -2.776 6.108 1.00 0.38 C ATOM 1040 CD GLU A 153 -6.922 -3.482 7.312 1.00 0.74 C ATOM 1041 OE1 GLU A 153 -7.646 -3.674 8.316 1.00 1.09 O ATOM 1042 OE2 GLU A 153 -5.737 -3.856 7.262 1.00 1.13 O ATOM 0 H GLU A 153 -4.410 -1.935 6.248 1.00 0.30 H new ATOM 0 HA GLU A 153 -6.188 -2.121 3.937 1.00 0.37 H new ATOM 0 HB2 GLU A 153 -6.460 -1.016 6.714 1.00 0.41 H new ATOM 0 HB3 GLU A 153 -7.647 -0.739 5.454 1.00 0.41 H new ATOM 0 HG2 GLU A 153 -8.588 -2.625 6.281 1.00 0.38 H new ATOM 0 HG3 GLU A 153 -7.429 -3.423 5.236 1.00 0.38 H new ATOM 1049 N MET A 154 -6.307 0.542 3.617 1.00 0.20 N ATOM 1050 CA MET A 154 -5.995 1.793 2.943 1.00 0.21 C ATOM 1051 C MET A 154 -7.259 2.520 2.554 1.00 0.20 C ATOM 1052 O MET A 154 -8.327 1.915 2.461 1.00 0.26 O ATOM 1053 CB MET A 154 -5.173 1.541 1.690 1.00 0.25 C ATOM 1054 CG MET A 154 -5.973 0.845 0.597 1.00 0.39 C ATOM 1055 SD MET A 154 -5.038 0.610 -0.922 1.00 0.81 S ATOM 1056 CE MET A 154 -4.838 2.306 -1.452 1.00 1.80 C ATOM 0 H MET A 154 -7.288 0.268 3.563 1.00 0.20 H new ATOM 0 HA MET A 154 -5.421 2.404 3.639 1.00 0.21 H new ATOM 0 HB2 MET A 154 -4.795 2.490 1.310 1.00 0.25 H new ATOM 0 HB3 MET A 154 -4.306 0.932 1.945 1.00 0.25 H new ATOM 0 HG2 MET A 154 -6.309 -0.125 0.963 1.00 0.39 H new ATOM 0 HG3 MET A 154 -6.866 1.431 0.380 1.00 0.39 H new ATOM 0 HE1 MET A 154 -4.419 2.326 -2.458 1.00 1.80 H new ATOM 0 HE2 MET A 154 -5.808 2.804 -1.453 1.00 1.80 H new ATOM 0 HE3 MET A 154 -4.165 2.824 -0.769 1.00 1.80 H new ATOM 1066 N ILE A 155 -7.139 3.812 2.332 1.00 0.25 N ATOM 1067 CA ILE A 155 -8.189 4.571 1.704 1.00 0.26 C ATOM 1068 C ILE A 155 -7.651 5.424 0.571 1.00 0.35 C ATOM 1069 O ILE A 155 -6.942 6.401 0.800 1.00 0.43 O ATOM 1070 CB ILE A 155 -8.944 5.443 2.699 1.00 0.30 C ATOM 1071 CG1 ILE A 155 -9.475 4.560 3.814 1.00 0.35 C ATOM 1072 CG2 ILE A 155 -10.067 6.164 1.983 1.00 0.39 C ATOM 1073 CD1 ILE A 155 -10.483 5.236 4.696 1.00 0.41 C ATOM 0 H ILE A 155 -6.315 4.359 2.581 1.00 0.25 H new ATOM 0 HA ILE A 155 -8.892 3.845 1.295 1.00 0.26 H new ATOM 0 HB ILE A 155 -8.284 6.194 3.133 1.00 0.30 H new ATOM 0 HG12 ILE A 155 -9.928 3.671 3.376 1.00 0.35 H new ATOM 0 HG13 ILE A 155 -8.639 4.222 4.427 1.00 0.35 H new ATOM 0 HG21 ILE A 155 -10.609 6.789 2.693 1.00 0.39 H new ATOM 0 HG22 ILE A 155 -9.652 6.789 1.192 1.00 0.39 H new ATOM 0 HG23 ILE A 155 -10.749 5.434 1.548 1.00 0.39 H new ATOM 0 HD11 ILE A 155 -10.815 4.542 5.468 1.00 0.41 H new ATOM 0 HD12 ILE A 155 -10.029 6.109 5.164 1.00 0.41 H new ATOM 0 HD13 ILE A 155 -11.338 5.549 4.097 1.00 0.41 H new ATOM 1085 N ARG A 156 -8.005 5.048 -0.644 1.00 0.45 N ATOM 1086 CA ARG A 156 -7.616 5.789 -1.836 1.00 0.64 C ATOM 1087 C ARG A 156 -8.269 7.163 -1.832 1.00 1.04 C ATOM 1088 O ARG A 156 -9.395 7.339 -2.285 1.00 1.40 O ATOM 1089 CB ARG A 156 -8.035 5.000 -3.080 1.00 0.98 C ATOM 1090 CG ARG A 156 -7.900 5.750 -4.397 1.00 0.99 C ATOM 1091 CD ARG A 156 -6.488 5.724 -4.938 1.00 0.95 C ATOM 1092 NE ARG A 156 -6.463 5.456 -6.378 1.00 1.68 N ATOM 1093 CZ ARG A 156 -5.484 5.829 -7.201 1.00 2.27 C ATOM 1094 NH1 ARG A 156 -4.479 6.581 -6.765 1.00 2.49 N ATOM 1095 NH2 ARG A 156 -5.530 5.460 -8.471 1.00 3.13 N ATOM 0 H ARG A 156 -8.570 4.221 -0.835 1.00 0.45 H new ATOM 0 HA ARG A 156 -6.534 5.924 -1.846 1.00 0.64 H new ATOM 0 HB2 ARG A 156 -7.435 4.092 -3.134 1.00 0.98 H new ATOM 0 HB3 ARG A 156 -9.073 4.690 -2.962 1.00 0.98 H new ATOM 0 HG2 ARG A 156 -8.575 5.311 -5.132 1.00 0.99 H new ATOM 0 HG3 ARG A 156 -8.212 6.785 -4.255 1.00 0.99 H new ATOM 0 HD2 ARG A 156 -6.004 6.680 -4.738 1.00 0.95 H new ATOM 0 HD3 ARG A 156 -5.912 4.960 -4.416 1.00 0.95 H new ATOM 0 HE ARG A 156 -7.251 4.948 -6.779 1.00 1.68 H new ATOM 0 HH11 ARG A 156 -4.451 6.879 -5.790 1.00 2.49 H new ATOM 0 HH12 ARG A 156 -3.736 6.860 -7.405 1.00 2.49 H new ATOM 0 HH21 ARG A 156 -6.309 4.896 -8.810 1.00 3.13 H new ATOM 0 HH22 ARG A 156 -4.786 5.740 -9.111 1.00 3.13 H new ATOM 1280 N GLN A 168 -12.597 7.847 -3.480 1.00 0.54 N ATOM 1281 CA GLN A 168 -12.256 7.156 -2.280 1.00 0.41 C ATOM 1282 C GLN A 168 -12.672 5.695 -2.234 1.00 0.38 C ATOM 1283 O GLN A 168 -13.760 5.314 -2.670 1.00 0.47 O ATOM 1284 CB GLN A 168 -12.897 7.893 -1.145 1.00 0.62 C ATOM 1285 CG GLN A 168 -12.376 7.415 0.172 1.00 0.85 C ATOM 1286 CD GLN A 168 -12.915 8.183 1.363 1.00 1.27 C ATOM 1287 OE1 GLN A 168 -13.231 9.453 1.167 1.00 1.69 O flip ATOM 1288 NE2 GLN A 168 -13.049 7.634 2.456 1.00 1.86 N flip ATOM 0 HA GLN A 168 -11.168 7.138 -2.218 1.00 0.41 H new ATOM 0 HB2 GLN A 168 -12.707 8.961 -1.248 1.00 0.62 H new ATOM 0 HB3 GLN A 168 -13.978 7.756 -1.183 1.00 0.62 H new ATOM 0 HG2 GLN A 168 -12.626 6.361 0.289 1.00 0.85 H new ATOM 0 HG3 GLN A 168 -11.288 7.486 0.169 1.00 0.85 H new ATOM 0 HE21 GLN A 168 -12.794 6.653 2.568 1.00 1.86 H new ATOM 0 HE22 GLN A 168 -13.415 8.160 3.250 1.00 1.86 H new ATOM 1297 N VAL A 169 -11.788 4.907 -1.640 1.00 0.33 N ATOM 1298 CA VAL A 169 -11.978 3.468 -1.485 1.00 0.30 C ATOM 1299 C VAL A 169 -11.210 2.958 -0.276 1.00 0.26 C ATOM 1300 O VAL A 169 -10.003 3.172 -0.164 1.00 0.28 O ATOM 1301 CB VAL A 169 -11.517 2.645 -2.714 1.00 0.33 C ATOM 1302 CG1 VAL A 169 -11.490 1.161 -2.363 1.00 0.36 C ATOM 1303 CG2 VAL A 169 -12.419 2.880 -3.914 1.00 0.41 C ATOM 0 H VAL A 169 -10.911 5.249 -1.248 1.00 0.33 H new ATOM 0 HA VAL A 169 -13.053 3.331 -1.365 1.00 0.30 H new ATOM 0 HB VAL A 169 -10.513 2.975 -2.982 1.00 0.33 H new ATOM 0 HG11 VAL A 169 -11.165 0.588 -3.231 1.00 0.36 H new ATOM 0 HG12 VAL A 169 -10.797 0.995 -1.538 1.00 0.36 H new ATOM 0 HG13 VAL A 169 -12.489 0.839 -2.068 1.00 0.36 H new ATOM 0 HG21 VAL A 169 -12.065 2.287 -4.757 1.00 0.41 H new ATOM 0 HG22 VAL A 169 -13.439 2.586 -3.666 1.00 0.41 H new ATOM 0 HG23 VAL A 169 -12.401 3.937 -4.181 1.00 0.41 H new ATOM 1313 N ARG A 170 -11.911 2.298 0.618 1.00 0.27 N ATOM 1314 CA ARG A 170 -11.305 1.557 1.683 1.00 0.29 C ATOM 1315 C ARG A 170 -10.931 0.173 1.187 1.00 0.27 C ATOM 1316 O ARG A 170 -11.808 -0.649 0.913 1.00 0.34 O ATOM 1317 CB ARG A 170 -12.292 1.452 2.813 1.00 0.36 C ATOM 1318 CG ARG A 170 -11.740 2.036 4.079 1.00 0.52 C ATOM 1319 CD ARG A 170 -12.751 2.008 5.194 1.00 0.69 C ATOM 1320 NE ARG A 170 -13.836 2.962 4.981 1.00 1.46 N ATOM 1321 CZ ARG A 170 -14.826 3.176 5.847 1.00 1.84 C ATOM 1322 NH1 ARG A 170 -14.873 2.500 6.990 1.00 1.60 N ATOM 1323 NH2 ARG A 170 -15.764 4.073 5.572 1.00 2.80 N ATOM 0 H ARG A 170 -12.930 2.265 0.619 1.00 0.27 H new ATOM 0 HA ARG A 170 -10.402 2.061 2.029 1.00 0.29 H new ATOM 0 HB2 ARG A 170 -13.212 1.970 2.543 1.00 0.36 H new ATOM 0 HB3 ARG A 170 -12.551 0.406 2.976 1.00 0.36 H new ATOM 0 HG2 ARG A 170 -10.852 1.480 4.379 1.00 0.52 H new ATOM 0 HG3 ARG A 170 -11.426 3.064 3.899 1.00 0.52 H new ATOM 0 HD2 ARG A 170 -13.165 1.003 5.281 1.00 0.69 H new ATOM 0 HD3 ARG A 170 -12.254 2.231 6.138 1.00 0.69 H new ATOM 0 HE ARG A 170 -13.836 3.499 4.114 1.00 1.46 H new ATOM 0 HH11 ARG A 170 -14.150 1.814 7.207 1.00 1.60 H new ATOM 0 HH12 ARG A 170 -15.632 2.667 7.650 1.00 1.60 H new ATOM 0 HH21 ARG A 170 -15.727 4.598 4.698 1.00 2.80 H new ATOM 0 HH22 ARG A 170 -16.522 4.237 6.234 1.00 2.80 H new ATOM 1337 N ALA A 171 -9.648 -0.095 1.063 1.00 0.24 N ATOM 1338 CA ALA A 171 -9.229 -1.358 0.481 1.00 0.22 C ATOM 1339 C ALA A 171 -8.469 -2.210 1.482 1.00 0.22 C ATOM 1340 O ALA A 171 -7.786 -1.704 2.370 1.00 0.29 O ATOM 1341 CB ALA A 171 -8.423 -1.135 -0.796 1.00 0.24 C ATOM 0 H ALA A 171 -8.891 0.526 1.349 1.00 0.24 H new ATOM 0 HA ALA A 171 -10.129 -1.911 0.209 1.00 0.22 H new ATOM 0 HB1 ALA A 171 -8.123 -2.098 -1.210 1.00 0.24 H new ATOM 0 HB2 ALA A 171 -9.035 -0.602 -1.524 1.00 0.24 H new ATOM 0 HB3 ALA A 171 -7.535 -0.546 -0.568 1.00 0.24 H new ATOM 1347 N ARG A 172 -8.631 -3.509 1.330 1.00 0.19 N ATOM 1348 CA ARG A 172 -8.085 -4.494 2.250 1.00 0.19 C ATOM 1349 C ARG A 172 -6.948 -5.269 1.601 1.00 0.20 C ATOM 1350 O ARG A 172 -7.191 -6.206 0.855 1.00 0.28 O ATOM 1351 CB ARG A 172 -9.193 -5.479 2.613 1.00 0.20 C ATOM 1352 CG ARG A 172 -8.749 -6.641 3.483 1.00 0.38 C ATOM 1353 CD ARG A 172 -8.477 -6.200 4.904 1.00 0.24 C ATOM 1354 NE ARG A 172 -9.710 -5.950 5.651 1.00 0.96 N ATOM 1355 CZ ARG A 172 -9.815 -6.061 6.976 1.00 0.95 C ATOM 1356 NH1 ARG A 172 -8.770 -6.434 7.705 1.00 1.08 N ATOM 1357 NH2 ARG A 172 -10.971 -5.802 7.572 1.00 1.71 N ATOM 0 H ARG A 172 -9.152 -3.918 0.555 1.00 0.19 H new ATOM 0 HA ARG A 172 -7.704 -3.981 3.133 1.00 0.19 H new ATOM 0 HB2 ARG A 172 -9.986 -4.938 3.130 1.00 0.20 H new ATOM 0 HB3 ARG A 172 -9.624 -5.875 1.693 1.00 0.20 H new ATOM 0 HG2 ARG A 172 -9.519 -7.412 3.482 1.00 0.38 H new ATOM 0 HG3 ARG A 172 -7.849 -7.089 3.062 1.00 0.38 H new ATOM 0 HD2 ARG A 172 -7.894 -6.966 5.415 1.00 0.24 H new ATOM 0 HD3 ARG A 172 -7.872 -5.294 4.892 1.00 0.24 H new ATOM 0 HE ARG A 172 -10.540 -5.674 5.126 1.00 0.96 H new ATOM 0 HH11 ARG A 172 -7.879 -6.638 7.252 1.00 1.08 H new ATOM 0 HH12 ARG A 172 -8.858 -6.517 8.718 1.00 1.08 H new ATOM 0 HH21 ARG A 172 -11.779 -5.518 7.017 1.00 1.71 H new ATOM 0 HH22 ARG A 172 -11.053 -5.887 8.585 1.00 1.71 H new ATOM 1371 N LEU A 173 -5.723 -4.892 1.885 1.00 0.18 N ATOM 1372 CA LEU A 173 -4.574 -5.592 1.334 1.00 0.21 C ATOM 1373 C LEU A 173 -4.207 -6.725 2.273 1.00 0.21 C ATOM 1374 O LEU A 173 -3.476 -6.525 3.237 1.00 0.23 O ATOM 1375 CB LEU A 173 -3.377 -4.639 1.160 1.00 0.27 C ATOM 1376 CG LEU A 173 -3.556 -3.464 0.179 1.00 0.40 C ATOM 1377 CD1 LEU A 173 -4.834 -2.698 0.430 1.00 0.28 C ATOM 1378 CD2 LEU A 173 -2.393 -2.498 0.298 1.00 0.69 C ATOM 0 H LEU A 173 -5.491 -4.106 2.493 1.00 0.18 H new ATOM 0 HA LEU A 173 -4.829 -5.985 0.350 1.00 0.21 H new ATOM 0 HB2 LEU A 173 -3.126 -4.229 2.138 1.00 0.27 H new ATOM 0 HB3 LEU A 173 -2.520 -5.227 0.831 1.00 0.27 H new ATOM 0 HG LEU A 173 -3.598 -3.897 -0.821 1.00 0.40 H new ATOM 0 HD11 LEU A 173 -4.915 -1.880 -0.286 1.00 0.28 H new ATOM 0 HD12 LEU A 173 -5.687 -3.366 0.315 1.00 0.28 H new ATOM 0 HD13 LEU A 173 -4.823 -2.294 1.442 1.00 0.28 H new ATOM 0 HD21 LEU A 173 -2.532 -1.673 -0.401 1.00 0.69 H new ATOM 0 HD22 LEU A 173 -2.346 -2.108 1.315 1.00 0.69 H new ATOM 0 HD23 LEU A 173 -1.463 -3.017 0.065 1.00 0.69 H new ATOM 1390 N THR A 174 -4.716 -7.912 2.000 1.00 0.20 N ATOM 1391 CA THR A 174 -4.599 -9.012 2.928 1.00 0.21 C ATOM 1392 C THR A 174 -3.425 -9.877 2.612 1.00 0.21 C ATOM 1393 O THR A 174 -3.290 -10.436 1.522 1.00 0.25 O ATOM 1394 CB THR A 174 -5.877 -9.851 2.992 1.00 0.23 C ATOM 1395 OG1 THR A 174 -6.777 -9.471 1.937 1.00 0.26 O ATOM 1396 CG2 THR A 174 -6.540 -9.652 4.342 1.00 0.26 C ATOM 0 H THR A 174 -5.215 -8.135 1.139 1.00 0.20 H new ATOM 0 HA THR A 174 -4.442 -8.569 3.911 1.00 0.21 H new ATOM 0 HB THR A 174 -5.623 -10.903 2.865 1.00 0.23 H new ATOM 0 HG1 THR A 174 -6.885 -10.219 1.314 1.00 0.26 H new ATOM 0 HG21 THR A 174 -7.451 -10.248 4.391 1.00 0.26 H new ATOM 0 HG22 THR A 174 -5.858 -9.966 5.132 1.00 0.26 H new ATOM 0 HG23 THR A 174 -6.788 -8.599 4.474 1.00 0.26 H new ATOM 1404 N PHE A 175 -2.572 -9.945 3.592 1.00 0.23 N ATOM 1405 CA PHE A 175 -1.357 -10.693 3.505 1.00 0.25 C ATOM 1406 C PHE A 175 -1.582 -12.097 3.996 1.00 0.32 C ATOM 1407 O PHE A 175 -2.131 -12.311 5.078 1.00 0.43 O ATOM 1408 CB PHE A 175 -0.251 -10.049 4.345 1.00 0.33 C ATOM 1409 CG PHE A 175 0.183 -8.680 3.906 1.00 0.33 C ATOM 1410 CD1 PHE A 175 -0.700 -7.868 3.223 1.00 0.40 C ATOM 1411 CD2 PHE A 175 1.455 -8.204 4.167 1.00 0.63 C ATOM 1412 CE1 PHE A 175 -0.325 -6.612 2.807 1.00 0.43 C ATOM 1413 CE2 PHE A 175 1.837 -6.947 3.755 1.00 0.72 C ATOM 1414 CZ PHE A 175 1.024 -6.160 3.118 1.00 0.51 C ATOM 0 H PHE A 175 -2.705 -9.474 4.487 1.00 0.23 H new ATOM 0 HA PHE A 175 -1.048 -10.705 2.460 1.00 0.25 H new ATOM 0 HB2 PHE A 175 -0.593 -9.988 5.378 1.00 0.33 H new ATOM 0 HB3 PHE A 175 0.618 -10.707 4.335 1.00 0.33 H new ATOM 0 HD1 PHE A 175 -1.698 -8.224 3.013 1.00 0.40 H new ATOM 0 HD2 PHE A 175 2.158 -8.826 4.701 1.00 0.63 H new ATOM 0 HE1 PHE A 175 -1.012 -5.979 2.265 1.00 0.43 H new ATOM 0 HE2 PHE A 175 2.840 -6.606 3.967 1.00 0.72 H new ATOM 0 HZ PHE A 175 1.347 -5.174 2.820 1.00 0.51 H new ATOM 1424 N ASP A 176 -1.156 -13.048 3.202 1.00 0.28 N ATOM 1425 CA ASP A 176 -1.029 -14.406 3.673 1.00 0.34 C ATOM 1426 C ASP A 176 0.244 -14.458 4.463 1.00 0.35 C ATOM 1427 O ASP A 176 1.219 -15.112 4.083 1.00 0.35 O ATOM 1428 CB ASP A 176 -0.942 -15.367 2.497 1.00 0.34 C ATOM 1429 CG ASP A 176 -0.971 -16.828 2.908 1.00 0.64 C ATOM 1430 OD1 ASP A 176 -2.045 -17.313 3.317 1.00 0.71 O ATOM 1431 OD2 ASP A 176 0.071 -17.506 2.797 1.00 1.09 O ATOM 0 H ASP A 176 -0.891 -12.908 2.227 1.00 0.28 H new ATOM 0 HA ASP A 176 -1.890 -14.695 4.275 1.00 0.34 H new ATOM 0 HB2 ASP A 176 -1.771 -15.172 1.816 1.00 0.34 H new ATOM 0 HB3 ASP A 176 -0.023 -15.171 1.945 1.00 0.34 H new ATOM 1436 N GLY A 177 0.244 -13.728 5.549 1.00 0.39 N ATOM 1437 CA GLY A 177 1.438 -13.629 6.325 1.00 0.43 C ATOM 1438 C GLY A 177 2.461 -12.764 5.625 1.00 0.42 C ATOM 1439 O GLY A 177 2.388 -11.536 5.663 1.00 0.47 O ATOM 0 H GLY A 177 -0.556 -13.205 5.905 1.00 0.39 H new ATOM 0 HA2 GLY A 177 1.207 -13.208 7.304 1.00 0.43 H new ATOM 0 HA3 GLY A 177 1.851 -14.623 6.495 1.00 0.43 H new ATOM 1443 N ASP A 178 3.410 -13.415 4.968 1.00 0.39 N ATOM 1444 CA ASP A 178 4.496 -12.729 4.291 1.00 0.43 C ATOM 1445 C ASP A 178 4.078 -12.130 2.968 1.00 0.38 C ATOM 1446 O ASP A 178 4.684 -11.167 2.501 1.00 0.44 O ATOM 1447 CB ASP A 178 5.634 -13.700 4.022 1.00 0.49 C ATOM 1448 CG ASP A 178 6.415 -14.064 5.266 1.00 0.62 C ATOM 1449 OD1 ASP A 178 7.540 -13.549 5.437 1.00 0.83 O ATOM 1450 OD2 ASP A 178 5.902 -14.865 6.081 1.00 0.69 O ATOM 0 H ASP A 178 3.447 -14.431 4.890 1.00 0.39 H new ATOM 0 HA ASP A 178 4.808 -11.921 4.953 1.00 0.43 H new ATOM 0 HB2 ASP A 178 5.230 -14.609 3.576 1.00 0.49 H new ATOM 0 HB3 ASP A 178 6.312 -13.261 3.291 1.00 0.49 H new ATOM 1455 N HIS A 179 3.056 -12.684 2.349 1.00 0.30 N ATOM 1456 CA HIS A 179 2.783 -12.352 0.984 1.00 0.27 C ATOM 1457 C HIS A 179 1.326 -12.072 0.792 1.00 0.21 C ATOM 1458 O HIS A 179 0.470 -12.860 1.171 1.00 0.19 O ATOM 1459 CB HIS A 179 3.258 -13.465 0.051 1.00 0.31 C ATOM 1460 CG HIS A 179 2.914 -14.854 0.508 1.00 0.35 C ATOM 1461 ND1 HIS A 179 3.814 -15.685 1.134 1.00 1.21 N ATOM 1462 CD2 HIS A 179 1.751 -15.541 0.451 1.00 0.96 C ATOM 1463 CE1 HIS A 179 3.218 -16.820 1.446 1.00 1.07 C ATOM 1464 NE2 HIS A 179 1.963 -16.761 1.045 1.00 0.58 N ATOM 0 H HIS A 179 2.414 -13.356 2.770 1.00 0.30 H new ATOM 0 HA HIS A 179 3.336 -11.447 0.732 1.00 0.27 H new ATOM 0 HB2 HIS A 179 2.824 -13.304 -0.936 1.00 0.31 H new ATOM 0 HB3 HIS A 179 4.340 -13.391 -0.060 1.00 0.31 H new ATOM 0 HD2 HIS A 179 0.825 -15.194 0.018 1.00 0.96 H new ATOM 0 HE1 HIS A 179 3.681 -17.658 1.946 1.00 1.07 H new ATOM 0 HE2 HIS A 179 1.267 -17.498 1.157 1.00 0.58 H new ATOM 1473 N LEU A 180 1.074 -10.928 0.218 1.00 0.21 N ATOM 1474 CA LEU A 180 -0.271 -10.493 -0.069 1.00 0.18 C ATOM 1475 C LEU A 180 -0.989 -11.531 -0.884 1.00 0.18 C ATOM 1476 O LEU A 180 -0.493 -12.000 -1.905 1.00 0.21 O ATOM 1477 CB LEU A 180 -0.309 -9.187 -0.815 1.00 0.20 C ATOM 1478 CG LEU A 180 -1.717 -8.648 -0.971 1.00 0.24 C ATOM 1479 CD1 LEU A 180 -1.769 -7.201 -0.589 1.00 0.64 C ATOM 1480 CD2 LEU A 180 -2.218 -8.858 -2.377 1.00 0.59 C ATOM 0 H LEU A 180 1.796 -10.266 -0.066 1.00 0.21 H new ATOM 0 HA LEU A 180 -0.763 -10.350 0.893 1.00 0.18 H new ATOM 0 HB2 LEU A 180 0.301 -8.453 -0.288 1.00 0.20 H new ATOM 0 HB3 LEU A 180 0.136 -9.322 -1.801 1.00 0.20 H new ATOM 0 HG LEU A 180 -2.374 -9.199 -0.299 1.00 0.24 H new ATOM 0 HD11 LEU A 180 -2.787 -6.830 -0.707 1.00 0.64 H new ATOM 0 HD12 LEU A 180 -1.459 -7.088 0.450 1.00 0.64 H new ATOM 0 HD13 LEU A 180 -1.098 -6.631 -1.232 1.00 0.64 H new ATOM 0 HD21 LEU A 180 -3.230 -8.463 -2.465 1.00 0.59 H new ATOM 0 HD22 LEU A 180 -1.564 -8.339 -3.078 1.00 0.59 H new ATOM 0 HD23 LEU A 180 -2.223 -9.924 -2.606 1.00 0.59 H new ATOM 1492 N ALA A 181 -2.167 -11.856 -0.442 1.00 0.20 N ATOM 1493 CA ALA A 181 -2.943 -12.884 -1.061 1.00 0.23 C ATOM 1494 C ALA A 181 -4.077 -12.267 -1.848 1.00 0.26 C ATOM 1495 O ALA A 181 -4.383 -12.709 -2.954 1.00 0.29 O ATOM 1496 CB ALA A 181 -3.464 -13.820 0.004 1.00 0.27 C ATOM 0 H ALA A 181 -2.616 -11.414 0.360 1.00 0.20 H new ATOM 0 HA ALA A 181 -2.324 -13.454 -1.754 1.00 0.23 H new ATOM 0 HB1 ALA A 181 -4.057 -14.607 -0.462 1.00 0.27 H new ATOM 0 HB2 ALA A 181 -2.625 -14.266 0.538 1.00 0.27 H new ATOM 0 HB3 ALA A 181 -4.086 -13.263 0.705 1.00 0.27 H new ATOM 1502 N THR A 182 -4.672 -11.219 -1.289 1.00 0.26 N ATOM 1503 CA THR A 182 -5.852 -10.620 -1.867 1.00 0.28 C ATOM 1504 C THR A 182 -5.954 -9.148 -1.508 1.00 0.29 C ATOM 1505 O THR A 182 -5.206 -8.652 -0.665 1.00 0.29 O ATOM 1506 CB THR A 182 -7.109 -11.328 -1.350 1.00 0.31 C ATOM 1507 OG1 THR A 182 -7.029 -11.487 0.073 1.00 0.32 O ATOM 1508 CG2 THR A 182 -7.290 -12.692 -1.997 1.00 0.33 C ATOM 0 H THR A 182 -4.348 -10.771 -0.432 1.00 0.26 H new ATOM 0 HA THR A 182 -5.774 -10.723 -2.949 1.00 0.28 H new ATOM 0 HB THR A 182 -7.967 -10.709 -1.610 1.00 0.31 H new ATOM 0 HG1 THR A 182 -7.836 -11.939 0.398 1.00 0.32 H new ATOM 0 HG21 THR A 182 -8.191 -13.164 -1.606 1.00 0.33 H new ATOM 0 HG22 THR A 182 -7.382 -12.573 -3.077 1.00 0.33 H new ATOM 0 HG23 THR A 182 -6.426 -13.318 -1.773 1.00 0.33 H new ATOM 1516 N ILE A 183 -6.876 -8.454 -2.159 1.00 0.31 N ATOM 1517 CA ILE A 183 -7.272 -7.127 -1.751 1.00 0.31 C ATOM 1518 C ILE A 183 -8.782 -7.120 -1.837 1.00 0.20 C ATOM 1519 O ILE A 183 -9.338 -7.808 -2.681 1.00 0.20 O ATOM 1520 CB ILE A 183 -6.658 -6.018 -2.639 1.00 0.42 C ATOM 1521 CG1 ILE A 183 -5.131 -6.102 -2.607 1.00 0.76 C ATOM 1522 CG2 ILE A 183 -7.095 -4.630 -2.182 1.00 0.33 C ATOM 1523 CD1 ILE A 183 -4.486 -6.172 -3.968 1.00 0.45 C ATOM 0 H ILE A 183 -7.366 -8.800 -2.984 1.00 0.31 H new ATOM 0 HA ILE A 183 -6.912 -6.909 -0.746 1.00 0.31 H new ATOM 0 HB ILE A 183 -7.016 -6.176 -3.656 1.00 0.42 H new ATOM 0 HG12 ILE A 183 -4.742 -5.232 -2.077 1.00 0.76 H new ATOM 0 HG13 ILE A 183 -4.839 -6.982 -2.033 1.00 0.76 H new ATOM 0 HG21 ILE A 183 -6.645 -3.876 -2.828 1.00 0.33 H new ATOM 0 HG22 ILE A 183 -8.181 -4.554 -2.237 1.00 0.33 H new ATOM 0 HG23 ILE A 183 -6.772 -4.467 -1.154 1.00 0.33 H new ATOM 0 HD11 ILE A 183 -3.403 -6.229 -3.855 1.00 0.45 H new ATOM 0 HD12 ILE A 183 -4.843 -7.057 -4.495 1.00 0.45 H new ATOM 0 HD13 ILE A 183 -4.744 -5.281 -4.539 1.00 0.45 H new ATOM 1535 N VAL A 184 -9.444 -6.433 -0.944 1.00 0.21 N ATOM 1536 CA VAL A 184 -10.890 -6.468 -0.893 1.00 0.20 C ATOM 1537 C VAL A 184 -11.441 -5.079 -0.635 1.00 0.18 C ATOM 1538 O VAL A 184 -10.877 -4.313 0.141 1.00 0.20 O ATOM 1539 CB VAL A 184 -11.360 -7.467 0.195 1.00 0.29 C ATOM 1540 CG1 VAL A 184 -12.835 -7.321 0.474 1.00 0.35 C ATOM 1541 CG2 VAL A 184 -11.050 -8.902 -0.221 1.00 0.31 C ATOM 0 H VAL A 184 -9.008 -5.840 -0.238 1.00 0.21 H new ATOM 0 HA VAL A 184 -11.272 -6.808 -1.855 1.00 0.20 H new ATOM 0 HB VAL A 184 -10.814 -7.236 1.110 1.00 0.29 H new ATOM 0 HG11 VAL A 184 -13.133 -8.036 1.241 1.00 0.35 H new ATOM 0 HG12 VAL A 184 -13.041 -6.309 0.821 1.00 0.35 H new ATOM 0 HG13 VAL A 184 -13.399 -7.513 -0.439 1.00 0.35 H new ATOM 0 HG21 VAL A 184 -11.388 -9.587 0.556 1.00 0.31 H new ATOM 0 HG22 VAL A 184 -11.565 -9.130 -1.154 1.00 0.31 H new ATOM 0 HG23 VAL A 184 -9.975 -9.016 -0.363 1.00 0.31 H new ATOM 1551 N ASN A 185 -12.529 -4.751 -1.307 1.00 0.21 N ATOM 1552 CA ASN A 185 -13.146 -3.465 -1.150 1.00 0.26 C ATOM 1553 C ASN A 185 -13.974 -3.520 0.077 1.00 0.29 C ATOM 1554 O ASN A 185 -15.023 -4.133 0.079 1.00 0.39 O ATOM 1555 CB ASN A 185 -14.052 -3.158 -2.317 1.00 0.37 C ATOM 1556 CG ASN A 185 -14.406 -1.687 -2.387 1.00 0.84 C ATOM 1557 OD1 ASN A 185 -14.463 -1.009 -1.366 1.00 1.77 O ATOM 1558 ND2 ASN A 185 -14.632 -1.176 -3.584 1.00 1.12 N ATOM 0 H ASN A 185 -12.999 -5.368 -1.969 1.00 0.21 H new ATOM 0 HA ASN A 185 -12.377 -2.695 -1.093 1.00 0.26 H new ATOM 0 HB2 ASN A 185 -13.564 -3.458 -3.244 1.00 0.37 H new ATOM 0 HB3 ASN A 185 -14.965 -3.747 -2.232 1.00 0.37 H new ATOM 0 HD21 ASN A 185 -14.863 -0.187 -3.681 1.00 1.12 H new ATOM 0 HD22 ASN A 185 -14.576 -1.770 -4.411 1.00 1.12 H new ATOM 1565 N MET A 186 -13.529 -2.861 1.097 1.00 0.26 N ATOM 1566 CA MET A 186 -14.087 -3.064 2.408 1.00 0.32 C ATOM 1567 C MET A 186 -15.518 -2.535 2.526 1.00 0.38 C ATOM 1568 O MET A 186 -16.148 -2.655 3.577 1.00 0.45 O ATOM 1569 CB MET A 186 -13.156 -2.446 3.435 1.00 0.34 C ATOM 1570 CG MET A 186 -11.749 -2.993 3.331 1.00 0.55 C ATOM 1571 SD MET A 186 -10.738 -2.671 4.786 1.00 0.54 S ATOM 1572 CE MET A 186 -10.394 -0.934 4.557 1.00 0.55 C ATOM 0 H MET A 186 -12.777 -2.173 1.054 1.00 0.26 H new ATOM 0 HA MET A 186 -14.166 -4.135 2.596 1.00 0.32 H new ATOM 0 HB2 MET A 186 -13.135 -1.365 3.300 1.00 0.34 H new ATOM 0 HB3 MET A 186 -13.545 -2.635 4.436 1.00 0.34 H new ATOM 0 HG2 MET A 186 -11.798 -4.069 3.165 1.00 0.55 H new ATOM 0 HG3 MET A 186 -11.263 -2.557 2.458 1.00 0.55 H new ATOM 0 HE1 MET A 186 -9.788 -0.570 5.387 1.00 0.55 H new ATOM 0 HE2 MET A 186 -9.852 -0.791 3.622 1.00 0.55 H new ATOM 0 HE3 MET A 186 -11.331 -0.379 4.522 1.00 0.55 H new ATOM 1582 N GLU A 187 -16.025 -1.950 1.448 1.00 0.39 N ATOM 1583 CA GLU A 187 -17.378 -1.452 1.410 1.00 0.50 C ATOM 1584 C GLU A 187 -18.357 -2.549 1.037 1.00 0.52 C ATOM 1585 O GLU A 187 -19.416 -2.702 1.639 1.00 0.60 O ATOM 1586 CB GLU A 187 -17.457 -0.320 0.402 1.00 0.59 C ATOM 1587 CG GLU A 187 -17.399 -0.732 -1.053 1.00 0.59 C ATOM 1588 CD GLU A 187 -17.689 0.418 -1.998 1.00 0.80 C ATOM 1589 OE1 GLU A 187 -18.815 0.960 -1.959 1.00 0.89 O ATOM 1590 OE2 GLU A 187 -16.797 0.778 -2.793 1.00 1.02 O ATOM 0 H GLU A 187 -15.505 -1.812 0.582 1.00 0.39 H new ATOM 0 HA GLU A 187 -17.648 -1.090 2.402 1.00 0.50 H new ATOM 0 HB2 GLU A 187 -18.385 0.227 0.569 1.00 0.59 H new ATOM 0 HB3 GLU A 187 -16.639 0.374 0.597 1.00 0.59 H new ATOM 0 HG2 GLU A 187 -16.411 -1.137 -1.273 1.00 0.59 H new ATOM 0 HG3 GLU A 187 -18.118 -1.532 -1.229 1.00 0.59 H new ATOM 1597 N ASN A 188 -17.973 -3.303 0.039 1.00 0.48 N ATOM 1598 CA ASN A 188 -18.818 -4.349 -0.516 1.00 0.56 C ATOM 1599 C ASN A 188 -18.290 -5.682 -0.090 1.00 0.55 C ATOM 1600 O ASN A 188 -19.010 -6.677 -0.014 1.00 0.65 O ATOM 1601 CB ASN A 188 -18.798 -4.282 -2.031 1.00 0.61 C ATOM 1602 CG ASN A 188 -19.750 -3.245 -2.604 1.00 0.77 C ATOM 1603 OD1 ASN A 188 -20.030 -2.224 -1.980 1.00 1.40 O ATOM 1604 ND2 ASN A 188 -20.255 -3.502 -3.798 1.00 1.37 N ATOM 0 H ASN A 188 -17.065 -3.215 -0.418 1.00 0.48 H new ATOM 0 HA ASN A 188 -19.838 -4.211 -0.158 1.00 0.56 H new ATOM 0 HB2 ASN A 188 -17.785 -4.057 -2.364 1.00 0.61 H new ATOM 0 HB3 ASN A 188 -19.055 -5.262 -2.434 1.00 0.61 H new ATOM 0 HD21 ASN A 188 -20.901 -2.842 -4.232 1.00 1.37 H new ATOM 0 HD22 ASN A 188 -19.999 -4.360 -4.286 1.00 1.37 H new ATOM 1611 N ASN A 189 -16.997 -5.655 0.166 1.00 0.46 N ATOM 1612 CA ASN A 189 -16.226 -6.825 0.554 1.00 0.47 C ATOM 1613 C ASN A 189 -15.975 -7.635 -0.700 1.00 0.52 C ATOM 1614 O ASN A 189 -15.876 -8.858 -0.697 1.00 0.59 O ATOM 1615 CB ASN A 189 -16.925 -7.620 1.659 1.00 0.57 C ATOM 1616 CG ASN A 189 -16.135 -8.822 2.161 1.00 0.67 C ATOM 1617 OD1 ASN A 189 -15.244 -8.687 2.999 1.00 1.33 O ATOM 1618 ND2 ASN A 189 -16.490 -10.010 1.689 1.00 1.30 N ATOM 0 H ASN A 189 -16.439 -4.803 0.110 1.00 0.46 H new ATOM 0 HA ASN A 189 -15.270 -6.534 0.989 1.00 0.47 H new ATOM 0 HB2 ASN A 189 -17.125 -6.954 2.499 1.00 0.57 H new ATOM 0 HB3 ASN A 189 -17.891 -7.964 1.288 1.00 0.57 H new ATOM 0 HD21 ASN A 189 -16.019 -10.852 2.021 1.00 1.30 H new ATOM 0 HD22 ASN A 189 -17.234 -10.081 0.995 1.00 1.30 H new ATOM 1625 N ARG A 190 -15.864 -6.902 -1.793 1.00 0.51 N ATOM 1626 CA ARG A 190 -15.586 -7.494 -3.068 1.00 0.57 C ATOM 1627 C ARG A 190 -14.103 -7.574 -3.252 1.00 0.48 C ATOM 1628 O ARG A 190 -13.342 -6.852 -2.618 1.00 0.37 O ATOM 1629 CB ARG A 190 -16.201 -6.685 -4.197 1.00 0.66 C ATOM 1630 CG ARG A 190 -15.476 -5.384 -4.493 1.00 0.72 C ATOM 1631 CD ARG A 190 -16.408 -4.327 -5.026 1.00 0.74 C ATOM 1632 NE ARG A 190 -17.223 -4.816 -6.139 1.00 1.22 N ATOM 1633 CZ ARG A 190 -17.943 -4.037 -6.947 1.00 1.47 C ATOM 1634 NH1 ARG A 190 -17.984 -2.723 -6.761 1.00 1.27 N ATOM 1635 NH2 ARG A 190 -18.629 -4.581 -7.943 1.00 2.28 N ATOM 0 H ARG A 190 -15.965 -5.887 -1.812 1.00 0.51 H new ATOM 0 HA ARG A 190 -16.024 -8.492 -3.094 1.00 0.57 H new ATOM 0 HB2 ARG A 190 -16.215 -7.294 -5.101 1.00 0.66 H new ATOM 0 HB3 ARG A 190 -17.238 -6.462 -3.947 1.00 0.66 H new ATOM 0 HG2 ARG A 190 -14.998 -5.020 -3.583 1.00 0.72 H new ATOM 0 HG3 ARG A 190 -14.683 -5.568 -5.218 1.00 0.72 H new ATOM 0 HD2 ARG A 190 -17.061 -3.983 -4.224 1.00 0.74 H new ATOM 0 HD3 ARG A 190 -15.827 -3.466 -5.355 1.00 0.74 H new ATOM 0 HE ARG A 190 -17.242 -5.822 -6.308 1.00 1.22 H new ATOM 0 HH11 ARG A 190 -17.461 -2.300 -5.994 1.00 1.27 H new ATOM 0 HH12 ARG A 190 -18.538 -2.137 -7.385 1.00 1.27 H new ATOM 0 HH21 ARG A 190 -18.604 -5.590 -8.088 1.00 2.28 H new ATOM 0 HH22 ARG A 190 -19.182 -3.990 -8.564 1.00 2.28 H new ATOM 1649 N GLN A 191 -13.709 -8.434 -4.124 1.00 0.55 N ATOM 1650 CA GLN A 191 -12.308 -8.713 -4.314 1.00 0.47 C ATOM 1651 C GLN A 191 -11.638 -7.734 -5.262 1.00 0.38 C ATOM 1652 O GLN A 191 -12.252 -7.178 -6.173 1.00 0.59 O ATOM 1653 CB GLN A 191 -12.113 -10.157 -4.749 1.00 0.58 C ATOM 1654 CG GLN A 191 -12.407 -11.118 -3.616 1.00 0.61 C ATOM 1655 CD GLN A 191 -12.249 -12.574 -4.004 1.00 0.75 C ATOM 1656 OE1 GLN A 191 -13.193 -13.213 -4.462 1.00 1.36 O ATOM 1657 NE2 GLN A 191 -11.055 -13.111 -3.809 1.00 1.27 N ATOM 0 H GLN A 191 -14.335 -8.967 -4.728 1.00 0.55 H new ATOM 0 HA GLN A 191 -11.811 -8.576 -3.354 1.00 0.47 H new ATOM 0 HB2 GLN A 191 -12.767 -10.376 -5.593 1.00 0.58 H new ATOM 0 HB3 GLN A 191 -11.089 -10.300 -5.093 1.00 0.58 H new ATOM 0 HG2 GLN A 191 -11.741 -10.898 -2.781 1.00 0.61 H new ATOM 0 HG3 GLN A 191 -13.425 -10.952 -3.264 1.00 0.61 H new ATOM 0 HE21 GLN A 191 -10.298 -12.545 -3.426 1.00 1.27 H new ATOM 0 HE22 GLN A 191 -10.892 -14.091 -4.041 1.00 1.27 H new ATOM 1666 N PHE A 192 -10.368 -7.539 -4.993 1.00 0.25 N ATOM 1667 CA PHE A 192 -9.519 -6.583 -5.634 1.00 0.46 C ATOM 1668 C PHE A 192 -8.247 -7.253 -5.950 1.00 0.63 C ATOM 1669 O PHE A 192 -8.077 -8.458 -5.741 1.00 1.18 O ATOM 1670 CB PHE A 192 -9.191 -5.387 -4.754 1.00 0.58 C ATOM 1671 CG PHE A 192 -10.039 -4.171 -4.986 1.00 0.63 C ATOM 1672 CD1 PHE A 192 -10.289 -3.735 -6.273 1.00 0.84 C ATOM 1673 CD2 PHE A 192 -10.589 -3.473 -3.925 1.00 0.63 C ATOM 1674 CE1 PHE A 192 -11.072 -2.621 -6.500 1.00 0.95 C ATOM 1675 CE2 PHE A 192 -11.372 -2.356 -4.145 1.00 0.70 C ATOM 1676 CZ PHE A 192 -11.599 -1.912 -5.397 1.00 0.81 C ATOM 0 H PHE A 192 -9.879 -8.079 -4.279 1.00 0.25 H new ATOM 0 HA PHE A 192 -10.046 -6.217 -6.515 1.00 0.46 H new ATOM 0 HB2 PHE A 192 -9.291 -5.686 -3.711 1.00 0.58 H new ATOM 0 HB3 PHE A 192 -8.147 -5.117 -4.910 1.00 0.58 H new ATOM 0 HD1 PHE A 192 -9.867 -4.271 -7.110 1.00 0.84 H new ATOM 0 HD2 PHE A 192 -10.404 -3.805 -2.914 1.00 0.63 H new ATOM 0 HE1 PHE A 192 -11.279 -2.295 -7.509 1.00 0.95 H new ATOM 0 HE2 PHE A 192 -11.806 -1.834 -3.305 1.00 0.70 H new ATOM 0 HZ PHE A 192 -12.182 -1.017 -5.557 1.00 0.81 H new ATOM 1686 N GLY A 193 -7.345 -6.470 -6.423 1.00 1.17 N ATOM 1687 CA GLY A 193 -6.109 -6.994 -6.796 1.00 1.28 C ATOM 1688 C GLY A 193 -5.701 -6.580 -8.144 1.00 0.64 C ATOM 1689 O GLY A 193 -4.918 -7.243 -8.825 1.00 0.63 O ATOM 0 H GLY A 193 -7.453 -5.464 -6.556 1.00 1.17 H new ATOM 0 HA2 GLY A 193 -5.353 -6.676 -6.078 1.00 1.28 H new ATOM 0 HA3 GLY A 193 -6.152 -8.082 -6.752 1.00 1.28 H new ATOM 1693 N PHE A 194 -6.250 -5.467 -8.506 1.00 0.41 N ATOM 1694 CA PHE A 194 -5.534 -4.537 -9.322 1.00 0.61 C ATOM 1695 C PHE A 194 -5.842 -3.155 -8.785 1.00 0.66 C ATOM 1696 O PHE A 194 -6.852 -2.542 -9.131 1.00 0.89 O ATOM 1697 CB PHE A 194 -5.917 -4.621 -10.801 1.00 0.86 C ATOM 1698 CG PHE A 194 -5.715 -5.970 -11.428 1.00 1.25 C ATOM 1699 CD1 PHE A 194 -6.790 -6.814 -11.642 1.00 1.36 C ATOM 1700 CD2 PHE A 194 -4.448 -6.396 -11.795 1.00 2.03 C ATOM 1701 CE1 PHE A 194 -6.610 -8.058 -12.212 1.00 2.10 C ATOM 1702 CE2 PHE A 194 -4.260 -7.639 -12.368 1.00 2.80 C ATOM 1703 CZ PHE A 194 -5.336 -8.459 -12.601 1.00 2.80 C ATOM 0 H PHE A 194 -7.194 -5.177 -8.250 1.00 0.41 H new ATOM 0 HA PHE A 194 -4.470 -4.768 -9.276 1.00 0.61 H new ATOM 0 HB2 PHE A 194 -6.965 -4.340 -10.907 1.00 0.86 H new ATOM 0 HB3 PHE A 194 -5.332 -3.887 -11.355 1.00 0.86 H new ATOM 0 HD1 PHE A 194 -7.783 -6.495 -11.359 1.00 1.36 H new ATOM 0 HD2 PHE A 194 -3.599 -5.749 -11.631 1.00 2.03 H new ATOM 0 HE1 PHE A 194 -7.454 -8.717 -12.355 1.00 2.10 H new ATOM 0 HE2 PHE A 194 -3.265 -7.966 -12.633 1.00 2.80 H new ATOM 0 HZ PHE A 194 -5.194 -9.414 -13.085 1.00 2.80 H new ATOM 1713 N PHE A 195 -4.972 -2.676 -7.925 1.00 0.49 N ATOM 1714 CA PHE A 195 -5.142 -1.379 -7.301 1.00 0.43 C ATOM 1715 C PHE A 195 -3.850 -0.592 -7.453 1.00 0.39 C ATOM 1716 O PHE A 195 -2.871 -0.845 -6.751 1.00 0.60 O ATOM 1717 CB PHE A 195 -5.464 -1.603 -5.840 1.00 0.41 C ATOM 1718 CG PHE A 195 -6.436 -0.645 -5.269 1.00 0.36 C ATOM 1719 CD1 PHE A 195 -6.008 0.584 -4.829 1.00 0.56 C ATOM 1720 CD2 PHE A 195 -7.772 -0.959 -5.194 1.00 0.51 C ATOM 1721 CE1 PHE A 195 -6.897 1.489 -4.324 1.00 0.57 C ATOM 1722 CE2 PHE A 195 -8.670 -0.061 -4.683 1.00 0.60 C ATOM 1723 CZ PHE A 195 -8.250 1.101 -4.165 1.00 0.47 C ATOM 0 H PHE A 195 -4.128 -3.171 -7.637 1.00 0.49 H new ATOM 0 HA PHE A 195 -5.950 -0.816 -7.768 1.00 0.43 H new ATOM 0 HB2 PHE A 195 -5.855 -2.613 -5.719 1.00 0.41 H new ATOM 0 HB3 PHE A 195 -4.539 -1.548 -5.265 1.00 0.41 H new ATOM 0 HD1 PHE A 195 -4.959 0.837 -4.883 1.00 0.56 H new ATOM 0 HD2 PHE A 195 -8.116 -1.922 -5.541 1.00 0.51 H new ATOM 0 HE1 PHE A 195 -6.574 2.483 -4.051 1.00 0.57 H new ATOM 0 HE2 PHE A 195 -9.725 -0.291 -4.698 1.00 0.60 H new ATOM 0 HZ PHE A 195 -8.939 1.738 -3.630 1.00 0.47 H new ATOM 1733 N ARG A 196 -3.817 0.326 -8.398 1.00 0.48 N ATOM 1734 CA ARG A 196 -2.594 1.057 -8.680 1.00 0.46 C ATOM 1735 C ARG A 196 -2.674 2.471 -8.143 1.00 0.48 C ATOM 1736 O ARG A 196 -3.621 3.204 -8.419 1.00 0.66 O ATOM 1737 CB ARG A 196 -2.283 1.054 -10.172 1.00 0.53 C ATOM 1738 CG ARG A 196 -1.618 -0.230 -10.654 1.00 1.29 C ATOM 1739 CD ARG A 196 -2.515 -1.444 -10.460 1.00 1.91 C ATOM 1740 NE ARG A 196 -1.824 -2.691 -10.784 1.00 2.91 N ATOM 1741 CZ ARG A 196 -2.179 -3.507 -11.776 1.00 3.82 C ATOM 1742 NH1 ARG A 196 -3.191 -3.195 -12.579 1.00 4.08 N ATOM 1743 NH2 ARG A 196 -1.509 -4.633 -11.978 1.00 4.77 N ATOM 0 H ARG A 196 -4.614 0.583 -8.980 1.00 0.48 H new ATOM 0 HA ARG A 196 -1.775 0.549 -8.170 1.00 0.46 H new ATOM 0 HB2 ARG A 196 -3.208 1.205 -10.728 1.00 0.53 H new ATOM 0 HB3 ARG A 196 -1.633 1.898 -10.401 1.00 0.53 H new ATOM 0 HG2 ARG A 196 -1.363 -0.132 -11.709 1.00 1.29 H new ATOM 0 HG3 ARG A 196 -0.684 -0.379 -10.113 1.00 1.29 H new ATOM 0 HD2 ARG A 196 -2.860 -1.478 -9.427 1.00 1.91 H new ATOM 0 HD3 ARG A 196 -3.400 -1.346 -11.089 1.00 1.91 H new ATOM 0 HE ARG A 196 -1.019 -2.953 -10.215 1.00 2.91 H new ATOM 0 HH11 ARG A 196 -3.704 -2.324 -12.439 1.00 4.08 H new ATOM 0 HH12 ARG A 196 -3.455 -3.826 -13.336 1.00 4.08 H new ATOM 0 HH21 ARG A 196 -0.723 -4.874 -11.374 1.00 4.77 H new ATOM 0 HH22 ARG A 196 -1.780 -5.258 -12.737 1.00 4.77 H new ATOM 1757 N LEU A 197 -1.675 2.839 -7.368 1.00 0.40 N ATOM 1758 CA LEU A 197 -1.652 4.129 -6.711 1.00 0.46 C ATOM 1759 C LEU A 197 -0.703 5.091 -7.390 1.00 0.56 C ATOM 1760 O LEU A 197 0.042 4.727 -8.300 1.00 0.65 O ATOM 1761 CB LEU A 197 -1.230 3.986 -5.254 1.00 0.64 C ATOM 1762 CG LEU A 197 -2.322 3.570 -4.272 1.00 0.98 C ATOM 1763 CD1 LEU A 197 -1.943 4.026 -2.881 1.00 1.61 C ATOM 1764 CD2 LEU A 197 -3.676 4.135 -4.660 1.00 1.04 C ATOM 0 H LEU A 197 -0.860 2.256 -7.176 1.00 0.40 H new ATOM 0 HA LEU A 197 -2.665 4.527 -6.772 1.00 0.46 H new ATOM 0 HB2 LEU A 197 -0.425 3.253 -5.201 1.00 0.64 H new ATOM 0 HB3 LEU A 197 -0.816 4.938 -4.922 1.00 0.64 H new ATOM 0 HG LEU A 197 -2.407 2.484 -4.296 1.00 0.98 H new ATOM 0 HD11 LEU A 197 -2.721 3.731 -2.177 1.00 1.61 H new ATOM 0 HD12 LEU A 197 -0.998 3.566 -2.592 1.00 1.61 H new ATOM 0 HD13 LEU A 197 -1.837 5.111 -2.870 1.00 1.61 H new ATOM 0 HD21 LEU A 197 -4.425 3.815 -3.935 1.00 1.04 H new ATOM 0 HD22 LEU A 197 -3.626 5.224 -4.673 1.00 1.04 H new ATOM 0 HD23 LEU A 197 -3.951 3.772 -5.650 1.00 1.04 H new ATOM 1776 N ASP A 198 -0.759 6.326 -6.927 1.00 0.64 N ATOM 1777 CA ASP A 198 0.161 7.358 -7.346 1.00 0.79 C ATOM 1778 C ASP A 198 1.352 7.365 -6.395 1.00 0.86 C ATOM 1779 O ASP A 198 1.228 7.821 -5.261 1.00 1.05 O ATOM 1780 CB ASP A 198 -0.544 8.712 -7.331 1.00 0.95 C ATOM 1781 CG ASP A 198 0.366 9.829 -7.798 1.00 1.85 C ATOM 1782 OD1 ASP A 198 0.464 10.038 -9.025 1.00 2.19 O ATOM 1783 OD2 ASP A 198 0.997 10.494 -6.950 1.00 2.66 O ATOM 0 H ASP A 198 -1.450 6.640 -6.245 1.00 0.64 H new ATOM 0 HA ASP A 198 0.509 7.163 -8.360 1.00 0.79 H new ATOM 0 HB2 ASP A 198 -1.425 8.670 -7.972 1.00 0.95 H new ATOM 0 HB3 ASP A 198 -0.894 8.927 -6.322 1.00 0.95 H new