USER MOD reduce.3.24.130724 H: found=0, std=0, add=649, rem=0, adj=19 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 -171:sc= -1.76 (180deg=-2.22) USER MOD Set 1.2: A 146 THR OG1 : rot 129:sc= -1.91! USER MOD Set 1.3: A 186 MET CE :methyl -176:sc= -2.85! (180deg=-3.16!) USER MOD Set 2.1: A 174 THR OG1 : rot 111:sc= 1.23 USER MOD Set 2.2: A 182 THR OG1 : rot 180:sc= 1.02 USER MOD Set 3.1: A 135 GLN : amide:sc= 0.00253 K(o=-0.13,f=-4!) USER MOD Set 3.2: A 148 GLN : amide:sc= -0.135 K(o=-0.13,f=-1.2) USER MOD Single : A 110 MET CE :methyl 175:sc= -1.32 (180deg=-1.48) USER MOD Single : A 112 ASN : amide:sc= 0.83 K(o=0.83,f=-8.4!) USER MOD Single : A 117 MET CE :methyl 175:sc= -7.19! (180deg=-7.6!) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 77:sc= 1.01 USER MOD Single : A 121 LYS NZ :NH3+ -170:sc= -0.0041 (180deg=-0.101) USER MOD Single : A 122 ASN : amide:sc= -0.304 K(o=-0.3,f=-6.2!) USER MOD Single : A 124 MET CE :methyl 165:sc= -5.36! (180deg=-7.44!) USER MOD Single : A 126 LYS NZ :NH3+ 149:sc= -0.349 (180deg=-1.63!) USER MOD Single : A 131 THR OG1 : rot -157:sc= 0.549 USER MOD Single : A 132 GLN : amide:sc= -0.4 X(o=-0.4,f=0) USER MOD Single : A 133 TYR OH : rot -71:sc= 0.0641 USER MOD Single : A 137 SER OG : rot 180:sc= 0.012 USER MOD Single : A 138 LYS NZ :NH3+ -133:sc= -0.0919 (180deg=-0.449) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 ASN : amide:sc= -0.0477 K(o=-0.048,f=-1.2!) USER MOD Single : A 151 SER OG : rot 66:sc= 1.3 USER MOD Single : A 154 MET CE :methyl -153:sc= -0.227 (180deg=-1.6) USER MOD Single : A 168 GLN : amide:sc= -0.661 K(o=-0.66,f=-2.6!) USER MOD Single : A 179 HIS : no HD1:sc= -0.866 K(o=-0.87,f=-2.6) USER MOD Single : A 185 ASN : amide:sc= -3.34! C(o=-3.3!,f=-5!) USER MOD Single : A 188 ASN : amide:sc= -1.85! C(o=-1.9!,f=-5.5!) USER MOD Single : A 189 ASN : amide:sc= -0.271 X(o=-0.27,f=-0.69) USER MOD Single : A 191 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 319 N ARG A 109 9.991 0.005 -1.030 1.00 0.50 N ATOM 320 CA ARG A 109 9.101 0.900 -1.807 1.00 0.44 C ATOM 321 C ARG A 109 8.563 0.294 -3.107 1.00 0.36 C ATOM 322 O ARG A 109 9.185 0.420 -4.165 1.00 0.56 O ATOM 323 CB ARG A 109 9.838 2.190 -2.158 1.00 0.57 C ATOM 324 CG ARG A 109 11.345 2.040 -2.314 1.00 0.98 C ATOM 325 CD ARG A 109 11.976 3.299 -2.891 1.00 1.83 C ATOM 326 NE ARG A 109 11.558 3.538 -4.273 1.00 2.50 N ATOM 327 CZ ARG A 109 11.931 4.593 -4.999 1.00 3.50 C ATOM 328 NH1 ARG A 109 12.724 5.522 -4.481 1.00 4.03 N ATOM 329 NH2 ARG A 109 11.509 4.713 -6.249 1.00 4.32 N ATOM 0 HA ARG A 109 8.244 1.081 -1.158 1.00 0.44 H new ATOM 0 HB2 ARG A 109 9.428 2.585 -3.087 1.00 0.57 H new ATOM 0 HB3 ARG A 109 9.639 2.929 -1.382 1.00 0.57 H new ATOM 0 HG2 ARG A 109 11.792 1.820 -1.344 1.00 0.98 H new ATOM 0 HG3 ARG A 109 11.562 1.193 -2.965 1.00 0.98 H new ATOM 0 HD2 ARG A 109 11.702 4.156 -2.276 1.00 1.83 H new ATOM 0 HD3 ARG A 109 13.062 3.212 -2.851 1.00 1.83 H new ATOM 0 HE ARG A 109 10.941 2.853 -4.710 1.00 2.50 H new ATOM 0 HH11 ARG A 109 13.054 5.433 -3.520 1.00 4.03 H new ATOM 0 HH12 ARG A 109 13.004 6.325 -5.044 1.00 4.03 H new ATOM 0 HH21 ARG A 109 10.901 4.000 -6.653 1.00 4.32 H new ATOM 0 HH22 ARG A 109 11.792 5.518 -6.808 1.00 4.32 H new ATOM 343 N MET A 110 7.410 -0.364 -3.031 1.00 0.28 N ATOM 344 CA MET A 110 6.807 -0.954 -4.232 1.00 0.36 C ATOM 345 C MET A 110 5.295 -0.779 -4.241 1.00 0.41 C ATOM 346 O MET A 110 4.613 -1.245 -3.331 1.00 0.67 O ATOM 347 CB MET A 110 7.141 -2.444 -4.339 1.00 0.58 C ATOM 348 CG MET A 110 6.649 -3.082 -5.632 1.00 0.97 C ATOM 349 SD MET A 110 6.954 -4.860 -5.714 1.00 1.86 S ATOM 350 CE MET A 110 5.854 -5.457 -4.432 1.00 2.59 C ATOM 0 H MET A 110 6.880 -0.503 -2.171 1.00 0.28 H new ATOM 0 HA MET A 110 7.227 -0.427 -5.089 1.00 0.36 H new ATOM 0 HB2 MET A 110 8.221 -2.573 -4.267 1.00 0.58 H new ATOM 0 HB3 MET A 110 6.700 -2.970 -3.492 1.00 0.58 H new ATOM 0 HG2 MET A 110 5.579 -2.899 -5.735 1.00 0.97 H new ATOM 0 HG3 MET A 110 7.138 -2.597 -6.477 1.00 0.97 H new ATOM 0 HE1 MET A 110 5.864 -6.547 -4.423 1.00 2.59 H new ATOM 0 HE2 MET A 110 6.187 -5.083 -3.464 1.00 2.59 H new ATOM 0 HE3 MET A 110 4.841 -5.105 -4.629 1.00 2.59 H new ATOM 360 N VAL A 111 4.757 -0.132 -5.268 1.00 0.33 N ATOM 361 CA VAL A 111 3.310 -0.055 -5.388 1.00 0.35 C ATOM 362 C VAL A 111 2.789 -0.559 -6.703 1.00 0.33 C ATOM 363 O VAL A 111 2.924 0.074 -7.748 1.00 0.35 O ATOM 364 CB VAL A 111 2.742 1.349 -5.135 1.00 0.43 C ATOM 365 CG1 VAL A 111 2.493 1.536 -3.662 1.00 0.74 C ATOM 366 CG2 VAL A 111 3.673 2.412 -5.659 1.00 0.73 C ATOM 0 H VAL A 111 5.283 0.333 -6.008 1.00 0.33 H new ATOM 0 HA VAL A 111 2.959 -0.717 -4.596 1.00 0.35 H new ATOM 0 HB VAL A 111 1.797 1.446 -5.670 1.00 0.43 H new ATOM 0 HG11 VAL A 111 2.090 2.533 -3.485 1.00 0.74 H new ATOM 0 HG12 VAL A 111 1.779 0.789 -3.316 1.00 0.74 H new ATOM 0 HG13 VAL A 111 3.430 1.421 -3.117 1.00 0.74 H new ATOM 0 HG21 VAL A 111 3.246 3.396 -5.467 1.00 0.73 H new ATOM 0 HG22 VAL A 111 4.637 2.330 -5.158 1.00 0.73 H new ATOM 0 HG23 VAL A 111 3.810 2.279 -6.732 1.00 0.73 H new ATOM 376 N ASN A 112 2.213 -1.731 -6.610 1.00 0.36 N ATOM 377 CA ASN A 112 1.292 -2.240 -7.574 1.00 0.37 C ATOM 378 C ASN A 112 0.521 -3.319 -6.855 1.00 0.40 C ATOM 379 O ASN A 112 1.058 -4.393 -6.594 1.00 0.55 O ATOM 380 CB ASN A 112 2.033 -2.812 -8.770 1.00 0.46 C ATOM 381 CG ASN A 112 1.130 -3.010 -9.972 1.00 0.77 C ATOM 382 OD1 ASN A 112 -0.078 -3.198 -9.833 1.00 1.14 O ATOM 383 ND2 ASN A 112 1.709 -2.972 -11.162 1.00 1.38 N ATOM 0 H ASN A 112 2.383 -2.371 -5.834 1.00 0.36 H new ATOM 0 HA ASN A 112 0.634 -1.462 -7.960 1.00 0.37 H new ATOM 0 HB2 ASN A 112 2.851 -2.144 -9.040 1.00 0.46 H new ATOM 0 HB3 ASN A 112 2.480 -3.767 -8.494 1.00 0.46 H new ATOM 0 HD21 ASN A 112 1.150 -3.101 -12.005 1.00 1.38 H new ATOM 0 HD22 ASN A 112 2.714 -2.814 -11.235 1.00 1.38 H new ATOM 390 N LEU A 113 -0.714 -3.044 -6.517 1.00 0.37 N ATOM 391 CA LEU A 113 -1.462 -3.951 -5.677 1.00 0.40 C ATOM 392 C LEU A 113 -2.050 -5.054 -6.503 1.00 0.38 C ATOM 393 O LEU A 113 -3.048 -4.856 -7.201 1.00 0.52 O ATOM 394 CB LEU A 113 -2.576 -3.220 -4.958 1.00 0.42 C ATOM 395 CG LEU A 113 -2.149 -2.151 -3.952 1.00 0.58 C ATOM 396 CD1 LEU A 113 -3.271 -1.832 -2.966 1.00 1.33 C ATOM 397 CD2 LEU A 113 -0.905 -2.600 -3.230 1.00 1.17 C ATOM 0 H LEU A 113 -1.221 -2.208 -6.806 1.00 0.37 H new ATOM 0 HA LEU A 113 -0.778 -4.371 -4.940 1.00 0.40 H new ATOM 0 HB2 LEU A 113 -3.214 -2.750 -5.706 1.00 0.42 H new ATOM 0 HB3 LEU A 113 -3.186 -3.957 -4.435 1.00 0.42 H new ATOM 0 HG LEU A 113 -1.930 -1.232 -4.496 1.00 0.58 H new ATOM 0 HD11 LEU A 113 -2.933 -1.068 -2.265 1.00 1.33 H new ATOM 0 HD12 LEU A 113 -4.141 -1.465 -3.511 1.00 1.33 H new ATOM 0 HD13 LEU A 113 -3.541 -2.734 -2.417 1.00 1.33 H new ATOM 0 HD21 LEU A 113 -0.604 -1.835 -2.514 1.00 1.17 H new ATOM 0 HD22 LEU A 113 -1.107 -3.532 -2.702 1.00 1.17 H new ATOM 0 HD23 LEU A 113 -0.103 -2.758 -3.951 1.00 1.17 H new ATOM 409 N GLU A 114 -1.454 -6.219 -6.436 1.00 0.34 N ATOM 410 CA GLU A 114 -1.936 -7.300 -7.237 1.00 0.34 C ATOM 411 C GLU A 114 -1.787 -8.611 -6.499 1.00 0.33 C ATOM 412 O GLU A 114 -0.707 -9.187 -6.423 1.00 0.39 O ATOM 413 CB GLU A 114 -1.227 -7.303 -8.583 1.00 0.39 C ATOM 414 CG GLU A 114 -1.741 -8.362 -9.539 1.00 0.47 C ATOM 415 CD GLU A 114 -1.083 -8.280 -10.894 1.00 1.13 C ATOM 416 OE1 GLU A 114 -1.577 -7.522 -11.757 1.00 1.93 O ATOM 417 OE2 GLU A 114 -0.066 -8.973 -11.102 1.00 1.50 O ATOM 0 H GLU A 114 -0.651 -6.434 -5.845 1.00 0.34 H new ATOM 0 HA GLU A 114 -3.000 -7.167 -7.430 1.00 0.34 H new ATOM 0 HB2 GLU A 114 -1.340 -6.323 -9.046 1.00 0.39 H new ATOM 0 HB3 GLU A 114 -0.160 -7.458 -8.422 1.00 0.39 H new ATOM 0 HG2 GLU A 114 -1.566 -9.349 -9.112 1.00 0.47 H new ATOM 0 HG3 GLU A 114 -2.819 -8.251 -9.654 1.00 0.47 H new ATOM 424 N PRO A 115 -2.907 -9.044 -5.917 1.00 0.39 N ATOM 425 CA PRO A 115 -3.038 -10.263 -5.124 1.00 0.46 C ATOM 426 C PRO A 115 -2.175 -11.417 -5.579 1.00 0.45 C ATOM 427 O PRO A 115 -2.037 -11.674 -6.777 1.00 0.49 O ATOM 428 CB PRO A 115 -4.512 -10.565 -5.287 1.00 0.59 C ATOM 429 CG PRO A 115 -5.124 -9.220 -5.214 1.00 0.65 C ATOM 430 CD PRO A 115 -4.182 -8.320 -5.973 1.00 0.53 C ATOM 0 HA PRO A 115 -2.700 -10.125 -4.097 1.00 0.46 H new ATOM 0 HB2 PRO A 115 -4.723 -11.056 -6.237 1.00 0.59 H new ATOM 0 HB3 PRO A 115 -4.881 -11.222 -4.500 1.00 0.59 H new ATOM 0 HG2 PRO A 115 -6.119 -9.215 -5.659 1.00 0.65 H new ATOM 0 HG3 PRO A 115 -5.235 -8.893 -4.180 1.00 0.65 H new ATOM 0 HD2 PRO A 115 -4.513 -8.166 -7.000 1.00 0.53 H new ATOM 0 HD3 PRO A 115 -4.106 -7.335 -5.511 1.00 0.53 H new ATOM 438 N ASP A 116 -1.615 -12.099 -4.578 1.00 0.46 N ATOM 439 CA ASP A 116 -0.629 -13.153 -4.772 1.00 0.49 C ATOM 440 C ASP A 116 0.726 -12.528 -5.083 1.00 0.48 C ATOM 441 O ASP A 116 1.525 -13.044 -5.867 1.00 0.58 O ATOM 442 CB ASP A 116 -1.081 -14.118 -5.855 1.00 0.55 C ATOM 443 CG ASP A 116 -0.197 -15.344 -5.973 1.00 0.63 C ATOM 444 OD1 ASP A 116 0.254 -15.660 -7.095 1.00 0.67 O ATOM 445 OD2 ASP A 116 0.051 -16.005 -4.943 1.00 0.72 O ATOM 0 H ASP A 116 -1.840 -11.929 -3.598 1.00 0.46 H new ATOM 0 HA ASP A 116 -0.529 -13.736 -3.856 1.00 0.49 H new ATOM 0 HB2 ASP A 116 -2.103 -14.434 -5.647 1.00 0.55 H new ATOM 0 HB3 ASP A 116 -1.098 -13.597 -6.812 1.00 0.55 H new ATOM 450 N MET A 117 0.966 -11.393 -4.441 1.00 0.39 N ATOM 451 CA MET A 117 2.233 -10.700 -4.538 1.00 0.40 C ATOM 452 C MET A 117 2.923 -10.702 -3.196 1.00 0.37 C ATOM 453 O MET A 117 2.284 -10.797 -2.159 1.00 0.33 O ATOM 454 CB MET A 117 2.082 -9.267 -5.037 1.00 0.42 C ATOM 455 CG MET A 117 1.158 -8.415 -4.210 1.00 0.45 C ATOM 456 SD MET A 117 1.441 -6.657 -4.457 1.00 0.80 S ATOM 457 CE MET A 117 0.264 -5.968 -3.303 1.00 1.67 C ATOM 0 H MET A 117 0.284 -10.931 -3.839 1.00 0.39 H new ATOM 0 HA MET A 117 2.836 -11.236 -5.271 1.00 0.40 H new ATOM 0 HB2 MET A 117 3.066 -8.798 -5.060 1.00 0.42 H new ATOM 0 HB3 MET A 117 1.715 -9.289 -6.063 1.00 0.42 H new ATOM 0 HG2 MET A 117 0.125 -8.653 -4.463 1.00 0.45 H new ATOM 0 HG3 MET A 117 1.292 -8.657 -3.156 1.00 0.45 H new ATOM 0 HE1 MET A 117 0.377 -4.884 -3.271 1.00 1.67 H new ATOM 0 HE2 MET A 117 -0.748 -6.218 -3.623 1.00 1.67 H new ATOM 0 HE3 MET A 117 0.443 -6.381 -2.310 1.00 1.67 H new ATOM 467 N THR A 118 4.225 -10.585 -3.214 1.00 0.41 N ATOM 468 CA THR A 118 4.993 -10.663 -2.002 1.00 0.41 C ATOM 469 C THR A 118 5.365 -9.261 -1.593 1.00 0.43 C ATOM 470 O THR A 118 6.245 -8.641 -2.184 1.00 0.58 O ATOM 471 CB THR A 118 6.247 -11.522 -2.181 1.00 0.49 C ATOM 472 OG1 THR A 118 5.893 -12.775 -2.782 1.00 0.52 O ATOM 473 CG2 THR A 118 6.917 -11.775 -0.837 1.00 0.49 C ATOM 0 H THR A 118 4.776 -10.435 -4.059 1.00 0.41 H new ATOM 0 HA THR A 118 4.394 -11.140 -1.226 1.00 0.41 H new ATOM 0 HB THR A 118 6.944 -10.989 -2.827 1.00 0.49 H new ATOM 0 HG1 THR A 118 6.698 -13.322 -2.897 1.00 0.52 H new ATOM 0 HG21 THR A 118 7.807 -12.387 -0.984 1.00 0.49 H new ATOM 0 HG22 THR A 118 7.201 -10.824 -0.387 1.00 0.49 H new ATOM 0 HG23 THR A 118 6.223 -12.295 -0.177 1.00 0.49 H new ATOM 481 N ILE A 119 4.670 -8.765 -0.597 1.00 0.41 N ATOM 482 CA ILE A 119 4.696 -7.363 -0.297 1.00 0.45 C ATOM 483 C ILE A 119 4.814 -7.138 1.214 1.00 0.40 C ATOM 484 O ILE A 119 4.637 -8.078 1.987 1.00 0.38 O ATOM 485 CB ILE A 119 3.434 -6.724 -0.849 1.00 0.53 C ATOM 486 CG1 ILE A 119 3.592 -5.228 -0.822 1.00 0.65 C ATOM 487 CG2 ILE A 119 2.238 -7.187 -0.060 1.00 0.49 C ATOM 488 CD1 ILE A 119 3.182 -4.570 -2.098 1.00 0.56 C ATOM 0 H ILE A 119 4.077 -9.320 0.020 1.00 0.41 H new ATOM 0 HA ILE A 119 5.566 -6.901 -0.763 1.00 0.45 H new ATOM 0 HB ILE A 119 3.272 -7.028 -1.883 1.00 0.53 H new ATOM 0 HG12 ILE A 119 2.998 -4.821 -0.004 1.00 0.65 H new ATOM 0 HG13 ILE A 119 4.633 -4.983 -0.613 1.00 0.65 H new ATOM 0 HG21 ILE A 119 1.336 -6.725 -0.461 1.00 0.49 H new ATOM 0 HG22 ILE A 119 2.153 -8.271 -0.131 1.00 0.49 H new ATOM 0 HG23 ILE A 119 2.358 -6.901 0.985 1.00 0.49 H new ATOM 0 HD11 ILE A 119 3.320 -3.492 -2.012 1.00 0.56 H new ATOM 0 HD12 ILE A 119 3.793 -4.951 -2.916 1.00 0.56 H new ATOM 0 HD13 ILE A 119 2.133 -4.786 -2.298 1.00 0.56 H new ATOM 500 N SER A 120 5.122 -5.913 1.638 1.00 0.40 N ATOM 501 CA SER A 120 5.370 -5.640 3.028 1.00 0.39 C ATOM 502 C SER A 120 4.772 -4.295 3.373 1.00 0.42 C ATOM 503 O SER A 120 4.273 -3.600 2.489 1.00 0.44 O ATOM 504 CB SER A 120 6.874 -5.636 3.311 1.00 0.36 C ATOM 505 OG SER A 120 7.503 -6.797 2.790 1.00 0.38 O ATOM 0 H SER A 120 5.203 -5.101 1.027 1.00 0.40 H new ATOM 0 HA SER A 120 4.911 -6.417 3.640 1.00 0.39 H new ATOM 0 HB2 SER A 120 7.326 -4.747 2.871 1.00 0.36 H new ATOM 0 HB3 SER A 120 7.043 -5.580 4.386 1.00 0.36 H new ATOM 0 HG SER A 120 7.610 -6.704 1.820 1.00 0.38 H new ATOM 511 N LYS A 121 4.842 -3.921 4.633 1.00 0.45 N ATOM 512 CA LYS A 121 4.571 -2.550 5.038 1.00 0.50 C ATOM 513 C LYS A 121 5.573 -1.643 4.363 1.00 0.44 C ATOM 514 O LYS A 121 5.327 -0.474 4.144 1.00 0.42 O ATOM 515 CB LYS A 121 4.708 -2.405 6.549 1.00 0.62 C ATOM 516 CG LYS A 121 4.121 -3.569 7.314 1.00 0.58 C ATOM 517 CD LYS A 121 5.197 -4.551 7.759 1.00 1.16 C ATOM 518 CE LYS A 121 4.616 -5.678 8.601 1.00 1.76 C ATOM 519 NZ LYS A 121 4.135 -5.199 9.923 1.00 2.33 N ATOM 0 H LYS A 121 5.085 -4.547 5.401 1.00 0.45 H new ATOM 0 HA LYS A 121 3.554 -2.283 4.750 1.00 0.50 H new ATOM 0 HB2 LYS A 121 5.763 -2.306 6.804 1.00 0.62 H new ATOM 0 HB3 LYS A 121 4.216 -1.485 6.865 1.00 0.62 H new ATOM 0 HG2 LYS A 121 3.584 -3.197 8.187 1.00 0.58 H new ATOM 0 HG3 LYS A 121 3.393 -4.086 6.688 1.00 0.58 H new ATOM 0 HD2 LYS A 121 5.693 -4.969 6.883 1.00 1.16 H new ATOM 0 HD3 LYS A 121 5.957 -4.022 8.334 1.00 1.16 H new ATOM 0 HE2 LYS A 121 3.790 -6.143 8.063 1.00 1.76 H new ATOM 0 HE3 LYS A 121 5.374 -6.447 8.749 1.00 1.76 H new ATOM 0 HZ1 LYS A 121 3.906 -6.015 10.526 1.00 2.33 H new ATOM 0 HZ2 LYS A 121 4.878 -4.631 10.378 1.00 2.33 H new ATOM 0 HZ3 LYS A 121 3.284 -4.616 9.792 1.00 2.33 H new ATOM 533 N ASN A 122 6.722 -2.220 4.091 1.00 0.45 N ATOM 534 CA ASN A 122 7.832 -1.525 3.447 1.00 0.47 C ATOM 535 C ASN A 122 7.732 -1.498 1.936 1.00 0.46 C ATOM 536 O ASN A 122 8.467 -0.777 1.292 1.00 0.53 O ATOM 537 CB ASN A 122 9.155 -2.167 3.760 1.00 0.56 C ATOM 538 CG ASN A 122 9.266 -2.831 5.131 1.00 0.79 C ATOM 539 OD1 ASN A 122 8.329 -3.461 5.627 1.00 1.32 O ATOM 540 ND2 ASN A 122 10.424 -2.692 5.755 1.00 1.27 N ATOM 0 H ASN A 122 6.922 -3.196 4.310 1.00 0.45 H new ATOM 0 HA ASN A 122 7.771 -0.512 3.845 1.00 0.47 H new ATOM 0 HB2 ASN A 122 9.363 -2.917 2.997 1.00 0.56 H new ATOM 0 HB3 ASN A 122 9.933 -1.408 3.681 1.00 0.56 H new ATOM 0 HD21 ASN A 122 10.562 -3.112 6.674 1.00 1.27 H new ATOM 0 HD22 ASN A 122 11.179 -2.165 5.317 1.00 1.27 H new ATOM 547 N GLU A 123 6.957 -2.358 1.335 1.00 0.43 N ATOM 548 CA GLU A 123 6.705 -2.221 -0.058 1.00 0.46 C ATOM 549 C GLU A 123 5.524 -1.307 -0.255 1.00 0.46 C ATOM 550 O GLU A 123 5.608 -0.275 -0.919 1.00 0.59 O ATOM 551 CB GLU A 123 6.496 -3.585 -0.616 1.00 0.51 C ATOM 552 CG GLU A 123 7.763 -4.171 -1.203 1.00 0.78 C ATOM 553 CD GLU A 123 7.857 -5.669 -1.065 1.00 1.23 C ATOM 554 OE1 GLU A 123 7.646 -6.184 0.054 1.00 1.57 O ATOM 555 OE2 GLU A 123 8.188 -6.333 -2.067 1.00 2.06 O ATOM 0 H GLU A 123 6.498 -3.149 1.787 1.00 0.43 H new ATOM 0 HA GLU A 123 7.542 -1.766 -0.589 1.00 0.46 H new ATOM 0 HB2 GLU A 123 6.125 -4.243 0.170 1.00 0.51 H new ATOM 0 HB3 GLU A 123 5.727 -3.545 -1.387 1.00 0.51 H new ATOM 0 HG2 GLU A 123 7.819 -3.908 -2.259 1.00 0.78 H new ATOM 0 HG3 GLU A 123 8.624 -3.715 -0.715 1.00 0.78 H new ATOM 562 N MET A 124 4.453 -1.678 0.404 1.00 0.41 N ATOM 563 CA MET A 124 3.255 -0.863 0.502 1.00 0.40 C ATOM 564 C MET A 124 3.553 0.468 1.151 1.00 0.36 C ATOM 565 O MET A 124 2.727 1.357 1.119 1.00 0.38 O ATOM 566 CB MET A 124 2.194 -1.569 1.315 1.00 0.47 C ATOM 567 CG MET A 124 0.864 -1.654 0.613 1.00 1.17 C ATOM 568 SD MET A 124 0.770 -3.104 -0.441 1.00 2.20 S ATOM 569 CE MET A 124 0.617 -4.383 0.801 1.00 3.13 C ATOM 0 H MET A 124 4.383 -2.568 0.897 1.00 0.41 H new ATOM 0 HA MET A 124 2.894 -0.697 -0.513 1.00 0.40 H new ATOM 0 HB2 MET A 124 2.537 -2.576 1.551 1.00 0.47 H new ATOM 0 HB3 MET A 124 2.064 -1.046 2.263 1.00 0.47 H new ATOM 0 HG2 MET A 124 0.063 -1.687 1.351 1.00 1.17 H new ATOM 0 HG3 MET A 124 0.709 -0.757 0.014 1.00 1.17 H new ATOM 0 HE1 MET A 124 0.283 -5.308 0.331 1.00 3.13 H new ATOM 0 HE2 MET A 124 1.584 -4.546 1.277 1.00 3.13 H new ATOM 0 HE3 MET A 124 -0.110 -4.075 1.553 1.00 3.13 H new ATOM 579 N VAL A 125 4.695 0.571 1.814 1.00 0.35 N ATOM 580 CA VAL A 125 5.108 1.823 2.432 1.00 0.32 C ATOM 581 C VAL A 125 4.859 2.969 1.498 1.00 0.30 C ATOM 582 O VAL A 125 4.406 4.040 1.885 1.00 0.29 O ATOM 583 CB VAL A 125 6.603 1.819 2.812 1.00 0.34 C ATOM 584 CG1 VAL A 125 7.509 1.700 1.593 1.00 0.37 C ATOM 585 CG2 VAL A 125 6.949 3.068 3.605 1.00 0.34 C ATOM 0 H VAL A 125 5.353 -0.198 1.938 1.00 0.35 H new ATOM 0 HA VAL A 125 4.518 1.934 3.342 1.00 0.32 H new ATOM 0 HB VAL A 125 6.776 0.938 3.431 1.00 0.34 H new ATOM 0 HG11 VAL A 125 8.551 1.702 1.913 1.00 0.37 H new ATOM 0 HG12 VAL A 125 7.292 0.770 1.068 1.00 0.37 H new ATOM 0 HG13 VAL A 125 7.333 2.543 0.925 1.00 0.37 H new ATOM 0 HG21 VAL A 125 8.007 3.052 3.866 1.00 0.34 H new ATOM 0 HG22 VAL A 125 6.738 3.952 3.003 1.00 0.34 H new ATOM 0 HG23 VAL A 125 6.351 3.098 4.516 1.00 0.34 H new ATOM 595 N LYS A 126 5.165 2.716 0.259 1.00 0.33 N ATOM 596 CA LYS A 126 4.925 3.689 -0.775 1.00 0.35 C ATOM 597 C LYS A 126 3.460 3.972 -0.990 1.00 0.39 C ATOM 598 O LYS A 126 3.080 5.111 -1.173 1.00 0.41 O ATOM 599 CB LYS A 126 5.575 3.258 -2.049 1.00 0.39 C ATOM 600 CG LYS A 126 7.057 3.374 -1.977 1.00 0.37 C ATOM 601 CD LYS A 126 7.532 4.781 -1.639 1.00 0.38 C ATOM 602 CE LYS A 126 7.715 4.995 -0.140 1.00 0.41 C ATOM 603 NZ LYS A 126 9.116 4.752 0.296 1.00 0.63 N ATOM 0 H LYS A 126 5.582 1.843 -0.064 1.00 0.33 H new ATOM 0 HA LYS A 126 5.371 4.626 -0.440 1.00 0.35 H new ATOM 0 HB2 LYS A 126 5.301 2.226 -2.266 1.00 0.39 H new ATOM 0 HB3 LYS A 126 5.202 3.867 -2.872 1.00 0.39 H new ATOM 0 HG2 LYS A 126 7.433 2.680 -1.226 1.00 0.37 H new ATOM 0 HG3 LYS A 126 7.486 3.072 -2.933 1.00 0.37 H new ATOM 0 HD2 LYS A 126 8.477 4.973 -2.148 1.00 0.38 H new ATOM 0 HD3 LYS A 126 6.812 5.505 -2.020 1.00 0.38 H new ATOM 0 HE2 LYS A 126 7.428 6.015 0.117 1.00 0.41 H new ATOM 0 HE3 LYS A 126 7.046 4.329 0.405 1.00 0.41 H new ATOM 0 HZ1 LYS A 126 9.339 5.365 1.106 1.00 0.63 H new ATOM 0 HZ2 LYS A 126 9.225 3.756 0.575 1.00 0.63 H new ATOM 0 HZ3 LYS A 126 9.765 4.965 -0.488 1.00 0.63 H new ATOM 617 N LEU A 127 2.659 2.933 -0.990 1.00 0.44 N ATOM 618 CA LEU A 127 1.205 3.060 -0.955 1.00 0.50 C ATOM 619 C LEU A 127 0.779 3.976 0.166 1.00 0.43 C ATOM 620 O LEU A 127 -0.199 4.708 0.066 1.00 0.49 O ATOM 621 CB LEU A 127 0.585 1.716 -0.704 1.00 0.56 C ATOM 622 CG LEU A 127 -0.905 1.719 -0.810 1.00 0.67 C ATOM 623 CD1 LEU A 127 -1.324 0.952 -2.025 1.00 1.47 C ATOM 624 CD2 LEU A 127 -1.481 1.156 0.450 1.00 1.79 C ATOM 0 H LEU A 127 2.990 1.968 -1.014 1.00 0.44 H new ATOM 0 HA LEU A 127 0.880 3.466 -1.913 1.00 0.50 H new ATOM 0 HB2 LEU A 127 0.991 0.998 -1.417 1.00 0.56 H new ATOM 0 HB3 LEU A 127 0.870 1.373 0.291 1.00 0.56 H new ATOM 0 HG LEU A 127 -1.284 2.734 -0.926 1.00 0.67 H new ATOM 0 HD11 LEU A 127 -2.411 0.955 -2.100 1.00 1.47 H new ATOM 0 HD12 LEU A 127 -0.897 1.417 -2.914 1.00 1.47 H new ATOM 0 HD13 LEU A 127 -0.969 -0.076 -1.947 1.00 1.47 H new ATOM 0 HD21 LEU A 127 -2.569 1.154 0.383 1.00 1.79 H new ATOM 0 HD22 LEU A 127 -1.124 0.136 0.589 1.00 1.79 H new ATOM 0 HD23 LEU A 127 -1.171 1.768 1.297 1.00 1.79 H new ATOM 636 N LEU A 128 1.536 3.920 1.231 1.00 0.34 N ATOM 637 CA LEU A 128 1.171 4.601 2.452 1.00 0.30 C ATOM 638 C LEU A 128 1.627 6.035 2.388 1.00 0.32 C ATOM 639 O LEU A 128 0.980 6.931 2.892 1.00 0.36 O ATOM 640 CB LEU A 128 1.760 3.880 3.649 1.00 0.27 C ATOM 641 CG LEU A 128 1.599 2.363 3.595 1.00 0.32 C ATOM 642 CD1 LEU A 128 2.261 1.724 4.793 1.00 0.38 C ATOM 643 CD2 LEU A 128 0.128 1.974 3.510 1.00 0.34 C ATOM 0 H LEU A 128 2.416 3.407 1.280 1.00 0.34 H new ATOM 0 HA LEU A 128 0.087 4.595 2.565 1.00 0.30 H new ATOM 0 HB2 LEU A 128 2.821 4.121 3.721 1.00 0.27 H new ATOM 0 HB3 LEU A 128 1.286 4.254 4.556 1.00 0.27 H new ATOM 0 HG LEU A 128 2.090 1.995 2.694 1.00 0.32 H new ATOM 0 HD11 LEU A 128 2.139 0.642 4.742 1.00 0.38 H new ATOM 0 HD12 LEU A 128 3.323 1.970 4.796 1.00 0.38 H new ATOM 0 HD13 LEU A 128 1.800 2.099 5.707 1.00 0.38 H new ATOM 0 HD21 LEU A 128 0.040 0.888 3.473 1.00 0.34 H new ATOM 0 HD22 LEU A 128 -0.399 2.351 4.386 1.00 0.34 H new ATOM 0 HD23 LEU A 128 -0.311 2.405 2.610 1.00 0.34 H new ATOM 655 N GLU A 129 2.766 6.215 1.768 1.00 0.30 N ATOM 656 CA GLU A 129 3.268 7.519 1.385 1.00 0.35 C ATOM 657 C GLU A 129 2.419 8.104 0.268 1.00 0.44 C ATOM 658 O GLU A 129 2.345 9.313 0.081 1.00 0.56 O ATOM 659 CB GLU A 129 4.700 7.331 0.939 1.00 0.35 C ATOM 660 CG GLU A 129 5.652 7.200 2.106 1.00 0.91 C ATOM 661 CD GLU A 129 6.208 8.529 2.564 1.00 1.04 C ATOM 662 OE1 GLU A 129 7.341 8.877 2.170 1.00 1.96 O ATOM 663 OE2 GLU A 129 5.505 9.238 3.314 1.00 1.41 O ATOM 0 H GLU A 129 3.385 5.447 1.508 1.00 0.30 H new ATOM 0 HA GLU A 129 3.222 8.217 2.221 1.00 0.35 H new ATOM 0 HB2 GLU A 129 4.770 6.440 0.314 1.00 0.35 H new ATOM 0 HB3 GLU A 129 5.000 8.178 0.322 1.00 0.35 H new ATOM 0 HG2 GLU A 129 5.135 6.722 2.938 1.00 0.91 H new ATOM 0 HG3 GLU A 129 6.476 6.545 1.824 1.00 0.91 H new ATOM 670 N ALA A 130 1.790 7.210 -0.465 1.00 0.45 N ATOM 671 CA ALA A 130 0.873 7.558 -1.542 1.00 0.54 C ATOM 672 C ALA A 130 -0.466 8.016 -0.988 1.00 0.56 C ATOM 673 O ALA A 130 -1.046 8.983 -1.468 1.00 0.64 O ATOM 674 CB ALA A 130 0.676 6.351 -2.429 1.00 0.58 C ATOM 0 H ALA A 130 1.900 6.205 -0.331 1.00 0.45 H new ATOM 0 HA ALA A 130 1.299 8.379 -2.118 1.00 0.54 H new ATOM 0 HB1 ALA A 130 -0.009 6.602 -3.238 1.00 0.58 H new ATOM 0 HB2 ALA A 130 1.635 6.046 -2.847 1.00 0.58 H new ATOM 0 HB3 ALA A 130 0.260 5.532 -1.842 1.00 0.58 H new ATOM 680 N THR A 131 -0.946 7.310 0.032 1.00 0.48 N ATOM 681 CA THR A 131 -2.172 7.686 0.725 1.00 0.46 C ATOM 682 C THR A 131 -1.792 8.665 1.813 1.00 0.45 C ATOM 683 O THR A 131 -2.609 9.195 2.567 1.00 0.52 O ATOM 684 CB THR A 131 -2.905 6.442 1.287 1.00 0.39 C ATOM 685 OG1 THR A 131 -4.201 6.796 1.765 1.00 0.59 O ATOM 686 CG2 THR A 131 -2.117 5.793 2.408 1.00 0.57 C ATOM 0 H THR A 131 -0.500 6.469 0.398 1.00 0.48 H new ATOM 0 HA THR A 131 -2.875 8.155 0.036 1.00 0.46 H new ATOM 0 HB THR A 131 -3.001 5.727 0.470 1.00 0.39 H new ATOM 0 HG1 THR A 131 -4.496 6.138 2.428 1.00 0.59 H new ATOM 0 HG21 THR A 131 -2.660 4.924 2.779 1.00 0.57 H new ATOM 0 HG22 THR A 131 -1.143 5.479 2.034 1.00 0.57 H new ATOM 0 HG23 THR A 131 -1.981 6.509 3.219 1.00 0.57 H new ATOM 694 N GLN A 132 -0.502 8.906 1.797 1.00 0.44 N ATOM 695 CA GLN A 132 0.192 9.837 2.630 1.00 0.46 C ATOM 696 C GLN A 132 -0.220 9.723 4.087 1.00 0.42 C ATOM 697 O GLN A 132 -0.582 10.717 4.719 1.00 0.49 O ATOM 698 CB GLN A 132 -0.044 11.234 2.116 1.00 0.56 C ATOM 699 CG GLN A 132 0.130 11.332 0.618 1.00 0.62 C ATOM 700 CD GLN A 132 -0.758 12.389 -0.012 1.00 1.03 C ATOM 701 OE1 GLN A 132 -1.191 12.251 -1.153 1.00 1.53 O ATOM 702 NE2 GLN A 132 -1.027 13.460 0.719 1.00 1.80 N ATOM 0 H GLN A 132 0.125 8.420 1.156 1.00 0.44 H new ATOM 0 HA GLN A 132 1.256 9.604 2.589 1.00 0.46 H new ATOM 0 HB2 GLN A 132 -1.052 11.552 2.384 1.00 0.56 H new ATOM 0 HB3 GLN A 132 0.647 11.920 2.605 1.00 0.56 H new ATOM 0 HG2 GLN A 132 1.172 11.559 0.392 1.00 0.62 H new ATOM 0 HG3 GLN A 132 -0.090 10.364 0.168 1.00 0.62 H new ATOM 0 HE21 GLN A 132 -0.650 13.541 1.663 1.00 1.80 H new ATOM 0 HE22 GLN A 132 -1.611 14.204 0.338 1.00 1.80 H new ATOM 711 N TYR A 133 -0.169 8.516 4.618 1.00 0.33 N ATOM 712 CA TYR A 133 -0.686 8.280 5.935 1.00 0.30 C ATOM 713 C TYR A 133 0.247 7.428 6.782 1.00 0.27 C ATOM 714 O TYR A 133 1.299 6.986 6.317 1.00 0.27 O ATOM 715 CB TYR A 133 -2.057 7.635 5.865 1.00 0.27 C ATOM 716 CG TYR A 133 -2.815 7.923 7.110 1.00 0.30 C ATOM 717 CD1 TYR A 133 -3.372 6.915 7.872 1.00 0.27 C ATOM 718 CD2 TYR A 133 -2.901 9.232 7.558 1.00 0.40 C ATOM 719 CE1 TYR A 133 -4.002 7.221 9.059 1.00 0.34 C ATOM 720 CE2 TYR A 133 -3.533 9.542 8.728 1.00 0.46 C ATOM 721 CZ TYR A 133 -4.079 8.544 9.481 1.00 0.41 C ATOM 722 OH TYR A 133 -4.695 8.869 10.667 1.00 0.52 O ATOM 0 H TYR A 133 0.223 7.696 4.155 1.00 0.33 H new ATOM 0 HA TYR A 133 -0.769 9.253 6.418 1.00 0.30 H new ATOM 0 HB2 TYR A 133 -2.603 8.013 5.001 1.00 0.27 H new ATOM 0 HB3 TYR A 133 -1.956 6.558 5.731 1.00 0.27 H new ATOM 0 HD1 TYR A 133 -3.314 5.889 7.539 1.00 0.27 H new ATOM 0 HD2 TYR A 133 -2.459 10.023 6.970 1.00 0.40 H new ATOM 0 HE1 TYR A 133 -4.435 6.435 9.660 1.00 0.34 H new ATOM 0 HE2 TYR A 133 -3.600 10.569 9.055 1.00 0.46 H new ATOM 0 HH TYR A 133 -5.664 8.753 10.575 1.00 0.52 H new ATOM 732 N ARG A 134 -0.138 7.230 8.043 1.00 0.28 N ATOM 733 CA ARG A 134 0.598 6.399 8.956 1.00 0.29 C ATOM 734 C ARG A 134 -0.427 5.619 9.772 1.00 0.27 C ATOM 735 O ARG A 134 -1.466 6.161 10.130 1.00 0.28 O ATOM 736 CB ARG A 134 1.508 7.253 9.848 1.00 0.38 C ATOM 737 CG ARG A 134 2.613 6.472 10.552 1.00 1.16 C ATOM 738 CD ARG A 134 2.115 5.745 11.790 1.00 1.83 C ATOM 739 NE ARG A 134 3.080 4.752 12.262 1.00 2.68 N ATOM 740 CZ ARG A 134 2.770 3.746 13.077 1.00 3.59 C ATOM 741 NH1 ARG A 134 1.539 3.636 13.560 1.00 3.92 N ATOM 742 NH2 ARG A 134 3.695 2.854 13.414 1.00 4.54 N ATOM 0 H ARG A 134 -0.975 7.650 8.448 1.00 0.28 H new ATOM 0 HA ARG A 134 1.252 5.709 8.423 1.00 0.29 H new ATOM 0 HB2 ARG A 134 1.963 8.034 9.239 1.00 0.38 H new ATOM 0 HB3 ARG A 134 0.896 7.751 10.600 1.00 0.38 H new ATOM 0 HG2 ARG A 134 3.041 5.749 9.858 1.00 1.16 H new ATOM 0 HG3 ARG A 134 3.414 7.156 10.834 1.00 1.16 H new ATOM 0 HD2 ARG A 134 1.920 6.468 12.582 1.00 1.83 H new ATOM 0 HD3 ARG A 134 1.168 5.254 11.567 1.00 1.83 H new ATOM 0 HE ARG A 134 4.047 4.835 11.948 1.00 2.68 H new ATOM 0 HH11 ARG A 134 0.829 4.323 13.307 1.00 3.92 H new ATOM 0 HH12 ARG A 134 1.303 2.865 14.184 1.00 3.92 H new ATOM 0 HH21 ARG A 134 4.643 2.940 13.048 1.00 4.54 H new ATOM 0 HH22 ARG A 134 3.457 2.083 14.038 1.00 4.54 H new ATOM 756 N GLN A 135 -0.121 4.364 10.061 1.00 0.27 N ATOM 757 CA GLN A 135 -1.078 3.415 10.623 1.00 0.27 C ATOM 758 C GLN A 135 -1.847 3.940 11.814 1.00 0.29 C ATOM 759 O GLN A 135 -1.316 4.623 12.687 1.00 0.32 O ATOM 760 CB GLN A 135 -0.326 2.172 11.005 1.00 0.29 C ATOM 761 CG GLN A 135 -1.185 1.069 11.609 1.00 0.30 C ATOM 762 CD GLN A 135 -1.103 1.026 13.126 1.00 0.38 C ATOM 763 OE1 GLN A 135 -0.069 1.340 13.715 1.00 1.10 O ATOM 764 NE2 GLN A 135 -2.197 0.659 13.767 1.00 1.28 N ATOM 0 H GLN A 135 0.807 3.968 9.912 1.00 0.27 H new ATOM 0 HA GLN A 135 -1.830 3.218 9.859 1.00 0.27 H new ATOM 0 HB2 GLN A 135 0.175 1.780 10.120 1.00 0.29 H new ATOM 0 HB3 GLN A 135 0.453 2.440 11.719 1.00 0.29 H new ATOM 0 HG2 GLN A 135 -2.223 1.217 11.309 1.00 0.30 H new ATOM 0 HG3 GLN A 135 -0.871 0.107 11.205 1.00 0.30 H new ATOM 0 HE21 GLN A 135 -3.035 0.406 13.243 1.00 1.28 H new ATOM 0 HE22 GLN A 135 -2.205 0.628 14.787 1.00 1.28 H new ATOM 773 N VAL A 136 -3.101 3.546 11.824 1.00 0.31 N ATOM 774 CA VAL A 136 -4.071 3.968 12.812 1.00 0.37 C ATOM 775 C VAL A 136 -4.723 2.770 13.479 1.00 0.43 C ATOM 776 O VAL A 136 -4.747 1.676 12.909 1.00 0.48 O ATOM 777 CB VAL A 136 -5.164 4.842 12.179 1.00 0.47 C ATOM 778 CG1 VAL A 136 -4.699 6.243 11.944 1.00 1.05 C ATOM 779 CG2 VAL A 136 -5.609 4.294 10.870 1.00 0.92 C ATOM 0 H VAL A 136 -3.485 2.907 11.128 1.00 0.31 H new ATOM 0 HA VAL A 136 -3.534 4.552 13.560 1.00 0.37 H new ATOM 0 HB VAL A 136 -5.989 4.842 12.892 1.00 0.47 H new ATOM 0 HG11 VAL A 136 -5.505 6.823 11.495 1.00 1.05 H new ATOM 0 HG12 VAL A 136 -4.411 6.695 12.893 1.00 1.05 H new ATOM 0 HG13 VAL A 136 -3.841 6.234 11.272 1.00 1.05 H new ATOM 0 HG21 VAL A 136 -6.383 4.937 10.450 1.00 0.92 H new ATOM 0 HG22 VAL A 136 -4.761 4.252 10.186 1.00 0.92 H new ATOM 0 HG23 VAL A 136 -6.010 3.290 11.013 1.00 0.92 H new ATOM 789 N SER A 137 -5.225 2.972 14.692 1.00 0.49 N ATOM 790 CA SER A 137 -6.041 1.966 15.359 1.00 0.57 C ATOM 791 C SER A 137 -7.270 1.722 14.527 1.00 0.53 C ATOM 792 O SER A 137 -7.788 0.607 14.412 1.00 0.60 O ATOM 793 CB SER A 137 -6.473 2.475 16.727 1.00 0.67 C ATOM 794 OG SER A 137 -5.400 3.140 17.374 1.00 1.38 O ATOM 0 H SER A 137 -5.081 3.824 15.233 1.00 0.49 H new ATOM 0 HA SER A 137 -5.465 1.048 15.478 1.00 0.57 H new ATOM 0 HB2 SER A 137 -7.317 3.156 16.618 1.00 0.67 H new ATOM 0 HB3 SER A 137 -6.814 1.641 17.340 1.00 0.67 H new ATOM 0 HG SER A 137 -5.696 3.462 18.251 1.00 1.38 H new ATOM 800 N LYS A 138 -7.709 2.808 13.947 1.00 0.47 N ATOM 801 CA LYS A 138 -8.878 2.836 13.123 1.00 0.46 C ATOM 802 C LYS A 138 -8.846 4.048 12.234 1.00 0.43 C ATOM 803 O LYS A 138 -8.565 5.163 12.680 1.00 0.44 O ATOM 804 CB LYS A 138 -10.125 2.847 13.959 1.00 0.51 C ATOM 805 CG LYS A 138 -11.401 2.987 13.139 1.00 0.55 C ATOM 806 CD LYS A 138 -11.805 4.442 12.886 1.00 0.82 C ATOM 807 CE LYS A 138 -12.301 5.123 14.148 1.00 0.92 C ATOM 808 NZ LYS A 138 -13.494 4.442 14.717 1.00 1.44 N ATOM 0 H LYS A 138 -7.251 3.715 14.039 1.00 0.47 H new ATOM 0 HA LYS A 138 -8.887 1.936 12.509 1.00 0.46 H new ATOM 0 HB2 LYS A 138 -10.173 1.925 14.538 1.00 0.51 H new ATOM 0 HB3 LYS A 138 -10.068 3.669 14.672 1.00 0.51 H new ATOM 0 HG2 LYS A 138 -11.266 2.484 12.182 1.00 0.55 H new ATOM 0 HG3 LYS A 138 -12.214 2.477 13.656 1.00 0.55 H new ATOM 0 HD2 LYS A 138 -10.951 4.991 12.489 1.00 0.82 H new ATOM 0 HD3 LYS A 138 -12.586 4.474 12.126 1.00 0.82 H new ATOM 0 HE2 LYS A 138 -11.503 5.136 14.890 1.00 0.92 H new ATOM 0 HE3 LYS A 138 -12.548 6.161 13.927 1.00 0.92 H new ATOM 0 HZ1 LYS A 138 -14.219 5.150 14.952 1.00 1.44 H new ATOM 0 HZ2 LYS A 138 -13.877 3.772 14.020 1.00 1.44 H new ATOM 0 HZ3 LYS A 138 -13.222 3.927 15.578 1.00 1.44 H new ATOM 822 N MET A 139 -9.128 3.812 10.989 1.00 0.42 N ATOM 823 CA MET A 139 -9.103 4.841 9.986 1.00 0.41 C ATOM 824 C MET A 139 -10.467 5.002 9.323 1.00 0.46 C ATOM 825 O MET A 139 -11.130 4.003 9.029 1.00 0.57 O ATOM 826 CB MET A 139 -8.062 4.440 8.952 1.00 0.41 C ATOM 827 CG MET A 139 -8.611 4.290 7.545 1.00 0.61 C ATOM 828 SD MET A 139 -7.703 3.114 6.530 1.00 0.90 S ATOM 829 CE MET A 139 -8.393 1.575 7.122 1.00 0.54 C ATOM 0 H MET A 139 -9.385 2.891 10.634 1.00 0.42 H new ATOM 0 HA MET A 139 -8.854 5.799 10.443 1.00 0.41 H new ATOM 0 HB2 MET A 139 -7.268 5.187 8.943 1.00 0.41 H new ATOM 0 HB3 MET A 139 -7.608 3.497 9.256 1.00 0.41 H new ATOM 0 HG2 MET A 139 -9.653 3.976 7.604 1.00 0.61 H new ATOM 0 HG3 MET A 139 -8.599 5.264 7.055 1.00 0.61 H new ATOM 0 HE1 MET A 139 -7.826 0.740 6.711 1.00 0.54 H new ATOM 0 HE2 MET A 139 -8.341 1.548 8.210 1.00 0.54 H new ATOM 0 HE3 MET A 139 -9.433 1.497 6.806 1.00 0.54 H new ATOM 839 N THR A 140 -10.916 6.234 9.131 1.00 0.42 N ATOM 840 CA THR A 140 -11.779 6.508 8.000 1.00 0.43 C ATOM 841 C THR A 140 -11.811 7.994 7.697 1.00 0.41 C ATOM 842 O THR A 140 -12.547 8.781 8.299 1.00 0.48 O ATOM 843 CB THR A 140 -13.204 5.969 8.251 1.00 0.53 C ATOM 844 OG1 THR A 140 -14.128 6.471 7.275 1.00 0.61 O ATOM 845 CG2 THR A 140 -13.680 6.318 9.657 1.00 0.58 C ATOM 0 H THR A 140 -10.704 7.035 9.725 1.00 0.42 H new ATOM 0 HA THR A 140 -11.372 5.992 7.131 1.00 0.43 H new ATOM 0 HB THR A 140 -13.165 4.884 8.158 1.00 0.53 H new ATOM 0 HG1 THR A 140 -15.022 6.113 7.456 1.00 0.61 H new ATOM 0 HG21 THR A 140 -14.686 5.927 9.808 1.00 0.58 H new ATOM 0 HG22 THR A 140 -13.005 5.876 10.390 1.00 0.58 H new ATOM 0 HG23 THR A 140 -13.689 7.401 9.780 1.00 0.58 H new ATOM 853 N ARG A 141 -10.991 8.332 6.723 1.00 0.35 N ATOM 854 CA ARG A 141 -11.002 9.573 5.978 1.00 0.36 C ATOM 855 C ARG A 141 -10.198 9.316 4.704 1.00 0.32 C ATOM 856 O ARG A 141 -9.435 8.353 4.666 1.00 0.32 O ATOM 857 CB ARG A 141 -10.397 10.717 6.800 1.00 0.40 C ATOM 858 CG ARG A 141 -9.429 10.235 7.852 1.00 0.43 C ATOM 859 CD ARG A 141 -10.122 10.076 9.195 1.00 0.53 C ATOM 860 NE ARG A 141 -9.264 9.468 10.204 1.00 0.87 N ATOM 861 CZ ARG A 141 -9.567 9.368 11.490 1.00 1.27 C ATOM 862 NH1 ARG A 141 -10.696 9.886 11.957 1.00 1.53 N ATOM 863 NH2 ARG A 141 -8.734 8.740 12.309 1.00 1.77 N ATOM 0 H ARG A 141 -10.250 7.705 6.411 1.00 0.35 H new ATOM 0 HA ARG A 141 -12.021 9.879 5.740 1.00 0.36 H new ATOM 0 HB2 ARG A 141 -9.884 11.407 6.130 1.00 0.40 H new ATOM 0 HB3 ARG A 141 -11.200 11.276 7.281 1.00 0.40 H new ATOM 0 HG2 ARG A 141 -8.998 9.282 7.546 1.00 0.43 H new ATOM 0 HG3 ARG A 141 -8.605 10.942 7.945 1.00 0.43 H new ATOM 0 HD2 ARG A 141 -10.452 11.054 9.546 1.00 0.53 H new ATOM 0 HD3 ARG A 141 -11.015 9.465 9.068 1.00 0.53 H new ATOM 0 HE ARG A 141 -8.366 9.093 9.898 1.00 0.87 H new ATOM 0 HH11 ARG A 141 -11.337 10.365 11.325 1.00 1.53 H new ATOM 0 HH12 ARG A 141 -10.923 9.805 12.948 1.00 1.53 H new ATOM 0 HH21 ARG A 141 -7.869 8.339 11.947 1.00 1.77 H new ATOM 0 HH22 ARG A 141 -8.959 8.658 13.301 1.00 1.77 H new ATOM 877 N PRO A 142 -10.323 10.130 3.654 1.00 0.35 N ATOM 878 CA PRO A 142 -9.480 9.973 2.463 1.00 0.36 C ATOM 879 C PRO A 142 -8.001 10.228 2.786 1.00 0.30 C ATOM 880 O PRO A 142 -7.669 11.246 3.398 1.00 0.33 O ATOM 881 CB PRO A 142 -10.013 11.036 1.494 1.00 0.45 C ATOM 882 CG PRO A 142 -11.341 11.451 2.039 1.00 0.62 C ATOM 883 CD PRO A 142 -11.272 11.243 3.524 1.00 0.44 C ATOM 0 HA PRO A 142 -9.523 8.963 2.055 1.00 0.36 H new ATOM 0 HB2 PRO A 142 -9.333 11.885 1.432 1.00 0.45 H new ATOM 0 HB3 PRO A 142 -10.112 10.633 0.486 1.00 0.45 H new ATOM 0 HG2 PRO A 142 -11.549 12.494 1.802 1.00 0.62 H new ATOM 0 HG3 PRO A 142 -12.144 10.858 1.600 1.00 0.62 H new ATOM 0 HD2 PRO A 142 -10.921 12.136 4.041 1.00 0.44 H new ATOM 0 HD3 PRO A 142 -12.247 10.994 3.943 1.00 0.44 H new ATOM 891 N GLY A 143 -7.106 9.322 2.366 1.00 0.32 N ATOM 892 CA GLY A 143 -5.706 9.463 2.711 1.00 0.36 C ATOM 893 C GLY A 143 -5.346 8.776 4.015 1.00 0.35 C ATOM 894 O GLY A 143 -4.721 9.384 4.882 1.00 0.51 O ATOM 0 H GLY A 143 -7.331 8.504 1.799 1.00 0.32 H new ATOM 0 HA2 GLY A 143 -5.096 9.049 1.908 1.00 0.36 H new ATOM 0 HA3 GLY A 143 -5.460 10.522 2.785 1.00 0.36 H new ATOM 898 N GLU A 144 -5.750 7.519 4.163 1.00 0.27 N ATOM 899 CA GLU A 144 -5.376 6.730 5.328 1.00 0.28 C ATOM 900 C GLU A 144 -5.075 5.296 4.949 1.00 0.29 C ATOM 901 O GLU A 144 -5.140 4.925 3.778 1.00 0.43 O ATOM 902 CB GLU A 144 -6.469 6.722 6.384 1.00 0.30 C ATOM 903 CG GLU A 144 -6.619 8.024 7.123 1.00 0.71 C ATOM 904 CD GLU A 144 -7.525 7.874 8.308 1.00 1.59 C ATOM 905 OE1 GLU A 144 -8.652 7.371 8.142 1.00 2.16 O ATOM 906 OE2 GLU A 144 -7.112 8.249 9.416 1.00 1.95 O ATOM 0 H GLU A 144 -6.337 7.026 3.490 1.00 0.27 H new ATOM 0 HA GLU A 144 -4.483 7.202 5.737 1.00 0.28 H new ATOM 0 HB2 GLU A 144 -7.418 6.476 5.907 1.00 0.30 H new ATOM 0 HB3 GLU A 144 -6.259 5.931 7.103 1.00 0.30 H new ATOM 0 HG2 GLU A 144 -5.640 8.373 7.452 1.00 0.71 H new ATOM 0 HG3 GLU A 144 -7.018 8.783 6.450 1.00 0.71 H new ATOM 913 N PHE A 145 -4.688 4.521 5.950 1.00 0.22 N ATOM 914 CA PHE A 145 -4.564 3.078 5.829 1.00 0.21 C ATOM 915 C PHE A 145 -4.454 2.502 7.213 1.00 0.22 C ATOM 916 O PHE A 145 -4.350 3.239 8.195 1.00 0.28 O ATOM 917 CB PHE A 145 -3.318 2.690 5.052 1.00 0.18 C ATOM 918 CG PHE A 145 -2.051 3.033 5.737 1.00 0.15 C ATOM 919 CD1 PHE A 145 -1.491 2.146 6.609 1.00 0.16 C ATOM 920 CD2 PHE A 145 -1.421 4.245 5.507 1.00 0.16 C ATOM 921 CE1 PHE A 145 -0.327 2.448 7.251 1.00 0.17 C ATOM 922 CE2 PHE A 145 -0.248 4.553 6.147 1.00 0.18 C ATOM 923 CZ PHE A 145 0.308 3.692 6.997 1.00 0.18 C ATOM 0 H PHE A 145 -4.450 4.879 6.875 1.00 0.22 H new ATOM 0 HA PHE A 145 -5.436 2.696 5.298 1.00 0.21 H new ATOM 0 HB2 PHE A 145 -3.339 1.616 4.864 1.00 0.18 H new ATOM 0 HB3 PHE A 145 -3.339 3.184 4.081 1.00 0.18 H new ATOM 0 HD1 PHE A 145 -1.973 1.197 6.792 1.00 0.16 H new ATOM 0 HD2 PHE A 145 -1.857 4.953 4.818 1.00 0.16 H new ATOM 0 HE1 PHE A 145 0.109 1.747 7.947 1.00 0.17 H new ATOM 0 HE2 PHE A 145 0.230 5.503 5.960 1.00 0.18 H new ATOM 0 HZ PHE A 145 1.237 3.939 7.490 1.00 0.18 H new ATOM 933 N THR A 146 -4.425 1.197 7.288 1.00 0.24 N ATOM 934 CA THR A 146 -4.165 0.534 8.537 1.00 0.24 C ATOM 935 C THR A 146 -3.318 -0.692 8.335 1.00 0.22 C ATOM 936 O THR A 146 -3.635 -1.562 7.538 1.00 0.24 O ATOM 937 CB THR A 146 -5.439 0.139 9.296 1.00 0.27 C ATOM 938 OG1 THR A 146 -6.335 -0.567 8.442 1.00 0.42 O ATOM 939 CG2 THR A 146 -6.152 1.339 9.870 1.00 0.39 C ATOM 0 H THR A 146 -4.579 0.572 6.497 1.00 0.24 H new ATOM 0 HA THR A 146 -3.630 1.264 9.144 1.00 0.24 H new ATOM 0 HB THR A 146 -5.126 -0.504 10.119 1.00 0.27 H new ATOM 0 HG1 THR A 146 -6.611 -1.401 8.876 1.00 0.42 H new ATOM 0 HG21 THR A 146 -7.048 1.012 10.398 1.00 0.39 H new ATOM 0 HG22 THR A 146 -5.491 1.858 10.564 1.00 0.39 H new ATOM 0 HG23 THR A 146 -6.434 2.015 9.063 1.00 0.39 H new ATOM 947 N VAL A 147 -2.232 -0.745 9.061 1.00 0.22 N ATOM 948 CA VAL A 147 -1.386 -1.919 9.044 1.00 0.23 C ATOM 949 C VAL A 147 -1.183 -2.433 10.466 1.00 0.29 C ATOM 950 O VAL A 147 -0.508 -1.811 11.285 1.00 0.34 O ATOM 951 CB VAL A 147 -0.055 -1.631 8.315 1.00 0.24 C ATOM 952 CG1 VAL A 147 0.758 -0.575 9.036 1.00 0.26 C ATOM 953 CG2 VAL A 147 0.747 -2.914 8.116 1.00 0.29 C ATOM 0 H VAL A 147 -1.910 0.006 9.671 1.00 0.22 H new ATOM 0 HA VAL A 147 -1.877 -2.711 8.479 1.00 0.23 H new ATOM 0 HB VAL A 147 -0.297 -1.233 7.330 1.00 0.24 H new ATOM 0 HG11 VAL A 147 1.687 -0.399 8.494 1.00 0.26 H new ATOM 0 HG12 VAL A 147 0.187 0.352 9.088 1.00 0.26 H new ATOM 0 HG13 VAL A 147 0.986 -0.917 10.045 1.00 0.26 H new ATOM 0 HG21 VAL A 147 1.679 -2.684 7.601 1.00 0.29 H new ATOM 0 HG22 VAL A 147 0.969 -3.359 9.086 1.00 0.29 H new ATOM 0 HG23 VAL A 147 0.166 -3.617 7.519 1.00 0.29 H new ATOM 963 N GLN A 148 -1.788 -3.566 10.771 1.00 0.52 N ATOM 964 CA GLN A 148 -1.815 -4.045 12.141 1.00 0.68 C ATOM 965 C GLN A 148 -1.679 -5.559 12.208 1.00 0.75 C ATOM 966 O GLN A 148 -0.729 -6.080 12.797 1.00 1.52 O ATOM 967 CB GLN A 148 -3.124 -3.616 12.812 1.00 1.16 C ATOM 968 CG GLN A 148 -3.123 -3.776 14.324 1.00 1.93 C ATOM 969 CD GLN A 148 -2.288 -2.720 15.020 1.00 2.50 C ATOM 970 OE1 GLN A 148 -2.791 -1.657 15.380 1.00 3.11 O ATOM 971 NE2 GLN A 148 -1.011 -3.001 15.224 1.00 3.01 N ATOM 0 H GLN A 148 -2.263 -4.167 10.097 1.00 0.52 H new ATOM 0 HA GLN A 148 -0.966 -3.607 12.666 1.00 0.68 H new ATOM 0 HB2 GLN A 148 -3.321 -2.572 12.567 1.00 1.16 H new ATOM 0 HB3 GLN A 148 -3.943 -4.202 12.395 1.00 1.16 H new ATOM 0 HG2 GLN A 148 -4.148 -3.725 14.692 1.00 1.93 H new ATOM 0 HG3 GLN A 148 -2.741 -4.764 14.581 1.00 1.93 H new ATOM 0 HE21 GLN A 148 -0.629 -3.894 14.911 1.00 3.01 H new ATOM 0 HE22 GLN A 148 -0.409 -2.325 15.694 1.00 3.01 H new ATOM 980 N ALA A 149 -2.624 -6.264 11.603 1.00 0.84 N ATOM 981 CA ALA A 149 -2.696 -7.707 11.755 1.00 1.18 C ATOM 982 C ALA A 149 -2.299 -8.449 10.481 1.00 0.92 C ATOM 983 O ALA A 149 -1.119 -8.712 10.252 1.00 1.08 O ATOM 984 CB ALA A 149 -4.087 -8.120 12.212 1.00 1.65 C ATOM 0 H ALA A 149 -3.347 -5.862 11.006 1.00 0.84 H new ATOM 0 HA ALA A 149 -1.972 -7.989 12.519 1.00 1.18 H new ATOM 0 HB1 ALA A 149 -4.127 -9.204 12.322 1.00 1.65 H new ATOM 0 HB2 ALA A 149 -4.310 -7.650 13.170 1.00 1.65 H new ATOM 0 HB3 ALA A 149 -4.822 -7.803 11.472 1.00 1.65 H new ATOM 990 N ASN A 150 -3.279 -8.765 9.644 1.00 0.69 N ATOM 991 CA ASN A 150 -3.049 -9.627 8.487 1.00 0.51 C ATOM 992 C ASN A 150 -3.017 -8.824 7.205 1.00 0.31 C ATOM 993 O ASN A 150 -2.836 -9.369 6.119 1.00 0.31 O ATOM 994 CB ASN A 150 -4.164 -10.660 8.376 1.00 0.64 C ATOM 995 CG ASN A 150 -3.743 -11.907 7.623 1.00 1.08 C ATOM 996 OD1 ASN A 150 -2.578 -12.308 7.657 1.00 1.68 O ATOM 997 ND2 ASN A 150 -4.691 -12.531 6.941 1.00 1.55 N ATOM 0 H ASN A 150 -4.240 -8.439 9.743 1.00 0.69 H new ATOM 0 HA ASN A 150 -2.086 -10.118 8.629 1.00 0.51 H new ATOM 0 HB2 ASN A 150 -4.493 -10.940 9.377 1.00 0.64 H new ATOM 0 HB3 ASN A 150 -5.020 -10.210 7.873 1.00 0.64 H new ATOM 0 HD21 ASN A 150 -4.469 -13.378 6.417 1.00 1.55 H new ATOM 0 HD22 ASN A 150 -5.643 -12.165 6.940 1.00 1.55 H new ATOM 1004 N SER A 151 -3.196 -7.529 7.326 1.00 0.29 N ATOM 1005 CA SER A 151 -3.420 -6.713 6.155 1.00 0.23 C ATOM 1006 C SER A 151 -2.843 -5.323 6.276 1.00 0.26 C ATOM 1007 O SER A 151 -2.537 -4.840 7.370 1.00 0.30 O ATOM 1008 CB SER A 151 -4.921 -6.626 5.885 1.00 0.27 C ATOM 1009 OG SER A 151 -5.643 -6.421 7.087 1.00 0.37 O ATOM 0 H SER A 151 -3.191 -7.023 8.211 1.00 0.29 H new ATOM 0 HA SER A 151 -2.902 -7.193 5.325 1.00 0.23 H new ATOM 0 HB2 SER A 151 -5.123 -5.809 5.192 1.00 0.27 H new ATOM 0 HB3 SER A 151 -5.261 -7.543 5.404 1.00 0.27 H new ATOM 0 HG SER A 151 -5.416 -5.544 7.460 1.00 0.37 H new ATOM 1015 N ILE A 152 -2.663 -4.719 5.120 1.00 0.27 N ATOM 1016 CA ILE A 152 -2.480 -3.297 5.021 1.00 0.30 C ATOM 1017 C ILE A 152 -3.720 -2.742 4.365 1.00 0.30 C ATOM 1018 O ILE A 152 -3.964 -2.965 3.190 1.00 0.34 O ATOM 1019 CB ILE A 152 -1.245 -2.868 4.194 1.00 0.33 C ATOM 1020 CG1 ILE A 152 0.050 -3.399 4.831 1.00 0.38 C ATOM 1021 CG2 ILE A 152 -1.205 -1.344 4.095 1.00 0.40 C ATOM 1022 CD1 ILE A 152 1.325 -3.011 4.100 1.00 0.53 C ATOM 0 H ILE A 152 -2.640 -5.206 4.224 1.00 0.27 H new ATOM 0 HA ILE A 152 -2.311 -2.912 6.027 1.00 0.30 H new ATOM 0 HB ILE A 152 -1.324 -3.292 3.193 1.00 0.33 H new ATOM 0 HG12 ILE A 152 0.110 -3.034 5.856 1.00 0.38 H new ATOM 0 HG13 ILE A 152 -0.006 -4.486 4.882 1.00 0.38 H new ATOM 0 HG21 ILE A 152 -0.335 -1.040 3.513 1.00 0.40 H new ATOM 0 HG22 ILE A 152 -2.112 -0.987 3.606 1.00 0.40 H new ATOM 0 HG23 ILE A 152 -1.139 -0.916 5.095 1.00 0.40 H new ATOM 0 HD11 ILE A 152 2.185 -3.430 4.622 1.00 0.53 H new ATOM 0 HD12 ILE A 152 1.293 -3.400 3.082 1.00 0.53 H new ATOM 0 HD13 ILE A 152 1.412 -1.925 4.071 1.00 0.53 H new ATOM 1034 N GLU A 153 -4.511 -2.052 5.122 1.00 0.30 N ATOM 1035 CA GLU A 153 -5.696 -1.448 4.583 1.00 0.37 C ATOM 1036 C GLU A 153 -5.310 -0.078 4.098 1.00 0.52 C ATOM 1037 O GLU A 153 -4.162 0.296 4.234 1.00 1.07 O ATOM 1038 CB GLU A 153 -6.826 -1.373 5.610 1.00 0.41 C ATOM 1039 CG GLU A 153 -7.337 -2.729 6.084 1.00 0.38 C ATOM 1040 CD GLU A 153 -6.574 -3.277 7.274 1.00 0.74 C ATOM 1041 OE1 GLU A 153 -7.031 -3.112 8.412 1.00 1.09 O ATOM 1042 OE2 GLU A 153 -5.496 -3.872 7.070 1.00 1.13 O ATOM 0 H GLU A 153 -4.361 -1.890 6.118 1.00 0.30 H new ATOM 0 HA GLU A 153 -6.083 -2.056 3.766 1.00 0.37 H new ATOM 0 HB2 GLU A 153 -6.478 -0.807 6.474 1.00 0.41 H new ATOM 0 HB3 GLU A 153 -7.657 -0.816 5.178 1.00 0.41 H new ATOM 0 HG2 GLU A 153 -8.391 -2.640 6.347 1.00 0.38 H new ATOM 0 HG3 GLU A 153 -7.273 -3.441 5.261 1.00 0.38 H new ATOM 1049 N MET A 154 -6.232 0.625 3.488 1.00 0.20 N ATOM 1050 CA MET A 154 -5.944 1.918 2.879 1.00 0.21 C ATOM 1051 C MET A 154 -7.224 2.637 2.491 1.00 0.20 C ATOM 1052 O MET A 154 -8.257 2.005 2.263 1.00 0.26 O ATOM 1053 CB MET A 154 -5.050 1.772 1.649 1.00 0.25 C ATOM 1054 CG MET A 154 -5.739 1.081 0.476 1.00 0.39 C ATOM 1055 SD MET A 154 -4.717 1.022 -1.004 1.00 0.81 S ATOM 1056 CE MET A 154 -4.449 2.769 -1.301 1.00 1.80 C ATOM 0 H MET A 154 -7.203 0.326 3.395 1.00 0.20 H new ATOM 0 HA MET A 154 -5.415 2.509 3.626 1.00 0.21 H new ATOM 0 HB2 MET A 154 -4.716 2.760 1.333 1.00 0.25 H new ATOM 0 HB3 MET A 154 -4.159 1.206 1.922 1.00 0.25 H new ATOM 0 HG2 MET A 154 -6.007 0.065 0.766 1.00 0.39 H new ATOM 0 HG3 MET A 154 -6.668 1.603 0.249 1.00 0.39 H new ATOM 0 HE1 MET A 154 -4.275 2.935 -2.364 1.00 1.80 H new ATOM 0 HE2 MET A 154 -5.328 3.331 -0.985 1.00 1.80 H new ATOM 0 HE3 MET A 154 -3.581 3.105 -0.734 1.00 1.80 H new ATOM 1066 N ILE A 155 -7.146 3.953 2.428 1.00 0.25 N ATOM 1067 CA ILE A 155 -8.179 4.765 1.829 1.00 0.26 C ATOM 1068 C ILE A 155 -7.583 5.695 0.797 1.00 0.35 C ATOM 1069 O ILE A 155 -6.878 6.640 1.144 1.00 0.43 O ATOM 1070 CB ILE A 155 -8.920 5.610 2.859 1.00 0.30 C ATOM 1071 CG1 ILE A 155 -9.478 4.705 3.937 1.00 0.35 C ATOM 1072 CG2 ILE A 155 -10.026 6.397 2.174 1.00 0.39 C ATOM 1073 CD1 ILE A 155 -10.372 5.424 4.905 1.00 0.41 C ATOM 0 H ILE A 155 -6.358 4.488 2.794 1.00 0.25 H new ATOM 0 HA ILE A 155 -8.886 4.076 1.367 1.00 0.26 H new ATOM 0 HB ILE A 155 -8.237 6.321 3.323 1.00 0.30 H new ATOM 0 HG12 ILE A 155 -10.037 3.894 3.469 1.00 0.35 H new ATOM 0 HG13 ILE A 155 -8.652 4.249 4.484 1.00 0.35 H new ATOM 0 HG21 ILE A 155 -10.554 7.000 2.912 1.00 0.39 H new ATOM 0 HG22 ILE A 155 -9.593 7.049 1.416 1.00 0.39 H new ATOM 0 HG23 ILE A 155 -10.725 5.707 1.702 1.00 0.39 H new ATOM 0 HD11 ILE A 155 -10.739 4.721 5.652 1.00 0.41 H new ATOM 0 HD12 ILE A 155 -9.811 6.217 5.398 1.00 0.41 H new ATOM 0 HD13 ILE A 155 -11.216 5.857 4.368 1.00 0.41 H new ATOM 1085 N ARG A 156 -7.876 5.433 -0.459 1.00 0.45 N ATOM 1086 CA ARG A 156 -7.378 6.274 -1.537 1.00 0.64 C ATOM 1087 C ARG A 156 -7.942 7.678 -1.428 1.00 1.04 C ATOM 1088 O ARG A 156 -9.110 7.901 -1.688 1.00 1.40 O ATOM 1089 CB ARG A 156 -7.743 5.698 -2.907 1.00 0.98 C ATOM 1090 CG ARG A 156 -6.828 4.583 -3.374 1.00 0.99 C ATOM 1091 CD ARG A 156 -7.096 4.228 -4.829 1.00 0.95 C ATOM 1092 NE ARG A 156 -6.952 5.388 -5.710 1.00 1.68 N ATOM 1093 CZ ARG A 156 -6.738 5.304 -7.022 1.00 2.27 C ATOM 1094 NH1 ARG A 156 -6.601 4.121 -7.606 1.00 2.49 N ATOM 1095 NH2 ARG A 156 -6.651 6.407 -7.754 1.00 3.13 N ATOM 0 H ARG A 156 -8.454 4.649 -0.762 1.00 0.45 H new ATOM 0 HA ARG A 156 -6.293 6.307 -1.443 1.00 0.64 H new ATOM 0 HB2 ARG A 156 -8.766 5.323 -2.871 1.00 0.98 H new ATOM 0 HB3 ARG A 156 -7.724 6.501 -3.644 1.00 0.98 H new ATOM 0 HG2 ARG A 156 -5.788 4.888 -3.256 1.00 0.99 H new ATOM 0 HG3 ARG A 156 -6.974 3.702 -2.749 1.00 0.99 H new ATOM 0 HD2 ARG A 156 -6.406 3.445 -5.144 1.00 0.95 H new ATOM 0 HD3 ARG A 156 -8.103 3.823 -4.924 1.00 0.95 H new ATOM 0 HE ARG A 156 -7.020 6.317 -5.294 1.00 1.68 H new ATOM 0 HH11 ARG A 156 -6.659 3.268 -7.050 1.00 2.49 H new ATOM 0 HH12 ARG A 156 -6.437 4.064 -8.611 1.00 2.49 H new ATOM 0 HH21 ARG A 156 -6.748 7.321 -7.312 1.00 3.13 H new ATOM 0 HH22 ARG A 156 -6.487 6.341 -8.759 1.00 3.13 H new ATOM 1280 N GLN A 168 -12.128 8.183 -3.471 1.00 0.54 N ATOM 1281 CA GLN A 168 -11.682 7.381 -2.381 1.00 0.41 C ATOM 1282 C GLN A 168 -12.143 5.922 -2.467 1.00 0.38 C ATOM 1283 O GLN A 168 -13.185 5.614 -3.049 1.00 0.47 O ATOM 1284 CB GLN A 168 -12.211 8.032 -1.142 1.00 0.62 C ATOM 1285 CG GLN A 168 -12.383 7.087 0.007 1.00 0.85 C ATOM 1286 CD GLN A 168 -13.242 7.654 1.121 1.00 1.27 C ATOM 1287 OE1 GLN A 168 -13.256 8.863 1.361 1.00 1.69 O ATOM 1288 NE2 GLN A 168 -13.985 6.789 1.793 1.00 1.86 N ATOM 0 HA GLN A 168 -10.593 7.329 -2.389 1.00 0.41 H new ATOM 0 HB2 GLN A 168 -11.533 8.832 -0.845 1.00 0.62 H new ATOM 0 HB3 GLN A 168 -13.172 8.495 -1.367 1.00 0.62 H new ATOM 0 HG2 GLN A 168 -12.832 6.162 -0.355 1.00 0.85 H new ATOM 0 HG3 GLN A 168 -11.403 6.829 0.408 1.00 0.85 H new ATOM 0 HE21 GLN A 168 -13.945 5.796 1.564 1.00 1.86 H new ATOM 0 HE22 GLN A 168 -14.598 7.115 2.540 1.00 1.86 H new ATOM 1297 N VAL A 169 -11.344 5.050 -1.858 1.00 0.33 N ATOM 1298 CA VAL A 169 -11.615 3.614 -1.772 1.00 0.30 C ATOM 1299 C VAL A 169 -10.919 3.038 -0.549 1.00 0.26 C ATOM 1300 O VAL A 169 -9.747 3.328 -0.309 1.00 0.28 O ATOM 1301 CB VAL A 169 -11.132 2.804 -3.004 1.00 0.33 C ATOM 1302 CG1 VAL A 169 -11.198 1.304 -2.706 1.00 0.36 C ATOM 1303 CG2 VAL A 169 -11.955 3.124 -4.242 1.00 0.41 C ATOM 0 H VAL A 169 -10.474 5.324 -1.402 1.00 0.33 H new ATOM 0 HA VAL A 169 -12.700 3.523 -1.717 1.00 0.30 H new ATOM 0 HB VAL A 169 -10.099 3.089 -3.205 1.00 0.33 H new ATOM 0 HG11 VAL A 169 -10.857 0.745 -3.577 1.00 0.36 H new ATOM 0 HG12 VAL A 169 -10.559 1.074 -1.854 1.00 0.36 H new ATOM 0 HG13 VAL A 169 -12.226 1.024 -2.475 1.00 0.36 H new ATOM 0 HG21 VAL A 169 -11.588 2.538 -5.085 1.00 0.41 H new ATOM 0 HG22 VAL A 169 -13.001 2.878 -4.057 1.00 0.41 H new ATOM 0 HG23 VAL A 169 -11.867 4.186 -4.473 1.00 0.41 H new ATOM 1313 N ARG A 170 -11.634 2.243 0.219 1.00 0.27 N ATOM 1314 CA ARG A 170 -11.041 1.454 1.267 1.00 0.29 C ATOM 1315 C ARG A 170 -10.650 0.097 0.745 1.00 0.27 C ATOM 1316 O ARG A 170 -11.506 -0.697 0.344 1.00 0.34 O ATOM 1317 CB ARG A 170 -12.014 1.310 2.391 1.00 0.36 C ATOM 1318 CG ARG A 170 -11.855 2.430 3.361 1.00 0.52 C ATOM 1319 CD ARG A 170 -13.095 2.625 4.185 1.00 0.69 C ATOM 1320 NE ARG A 170 -14.259 2.963 3.363 1.00 1.46 N ATOM 1321 CZ ARG A 170 -15.203 3.833 3.722 1.00 1.84 C ATOM 1322 NH1 ARG A 170 -15.109 4.484 4.877 1.00 1.60 N ATOM 1323 NH2 ARG A 170 -16.239 4.058 2.923 1.00 2.80 N ATOM 0 H ARG A 170 -12.644 2.129 0.130 1.00 0.27 H new ATOM 0 HA ARG A 170 -10.143 1.956 1.627 1.00 0.29 H new ATOM 0 HB2 ARG A 170 -13.032 1.300 2.001 1.00 0.36 H new ATOM 0 HB3 ARG A 170 -11.857 0.357 2.897 1.00 0.36 H new ATOM 0 HG2 ARG A 170 -11.009 2.227 4.018 1.00 0.52 H new ATOM 0 HG3 ARG A 170 -11.627 3.350 2.822 1.00 0.52 H new ATOM 0 HD2 ARG A 170 -13.302 1.715 4.748 1.00 0.69 H new ATOM 0 HD3 ARG A 170 -12.924 3.418 4.913 1.00 0.69 H new ATOM 0 HE ARG A 170 -14.353 2.503 2.457 1.00 1.46 H new ATOM 0 HH11 ARG A 170 -14.312 4.319 5.492 1.00 1.60 H new ATOM 0 HH12 ARG A 170 -15.833 5.149 5.148 1.00 1.60 H new ATOM 0 HH21 ARG A 170 -16.313 3.565 2.033 1.00 2.80 H new ATOM 0 HH22 ARG A 170 -16.961 4.724 3.199 1.00 2.80 H new ATOM 1337 N ALA A 171 -9.369 -0.175 0.736 1.00 0.24 N ATOM 1338 CA ALA A 171 -8.907 -1.452 0.232 1.00 0.22 C ATOM 1339 C ALA A 171 -8.244 -2.266 1.320 1.00 0.22 C ATOM 1340 O ALA A 171 -7.610 -1.737 2.229 1.00 0.29 O ATOM 1341 CB ALA A 171 -7.994 -1.286 -0.973 1.00 0.24 C ATOM 0 H ALA A 171 -8.637 0.454 1.064 1.00 0.24 H new ATOM 0 HA ALA A 171 -9.785 -2.004 -0.104 1.00 0.22 H new ATOM 0 HB1 ALA A 171 -7.669 -2.266 -1.321 1.00 0.24 H new ATOM 0 HB2 ALA A 171 -8.534 -0.778 -1.772 1.00 0.24 H new ATOM 0 HB3 ALA A 171 -7.123 -0.694 -0.691 1.00 0.24 H new ATOM 1347 N ARG A 172 -8.444 -3.558 1.212 1.00 0.19 N ATOM 1348 CA ARG A 172 -7.982 -4.524 2.198 1.00 0.19 C ATOM 1349 C ARG A 172 -6.871 -5.388 1.618 1.00 0.20 C ATOM 1350 O ARG A 172 -7.141 -6.343 0.902 1.00 0.28 O ATOM 1351 CB ARG A 172 -9.160 -5.420 2.573 1.00 0.20 C ATOM 1352 CG ARG A 172 -8.849 -6.550 3.548 1.00 0.38 C ATOM 1353 CD ARG A 172 -8.416 -6.034 4.908 1.00 0.24 C ATOM 1354 NE ARG A 172 -8.713 -6.993 5.971 1.00 0.96 N ATOM 1355 CZ ARG A 172 -9.067 -6.647 7.210 1.00 0.95 C ATOM 1356 NH1 ARG A 172 -9.154 -5.366 7.549 1.00 1.08 N ATOM 1357 NH2 ARG A 172 -9.337 -7.584 8.111 1.00 1.71 N ATOM 0 H ARG A 172 -8.939 -3.981 0.427 1.00 0.19 H new ATOM 0 HA ARG A 172 -7.596 -3.997 3.071 1.00 0.19 H new ATOM 0 HB2 ARG A 172 -9.943 -4.797 3.006 1.00 0.20 H new ATOM 0 HB3 ARG A 172 -9.567 -5.855 1.660 1.00 0.20 H new ATOM 0 HG2 ARG A 172 -9.731 -7.179 3.665 1.00 0.38 H new ATOM 0 HG3 ARG A 172 -8.061 -7.179 3.133 1.00 0.38 H new ATOM 0 HD2 ARG A 172 -7.346 -5.826 4.894 1.00 0.24 H new ATOM 0 HD3 ARG A 172 -8.921 -5.091 5.117 1.00 0.24 H new ATOM 0 HE ARG A 172 -8.645 -7.987 5.752 1.00 0.96 H new ATOM 0 HH11 ARG A 172 -8.950 -4.641 6.861 1.00 1.08 H new ATOM 0 HH12 ARG A 172 -9.425 -5.107 8.498 1.00 1.08 H new ATOM 0 HH21 ARG A 172 -9.274 -8.570 7.856 1.00 1.71 H new ATOM 0 HH22 ARG A 172 -9.607 -7.318 9.058 1.00 1.71 H new ATOM 1371 N LEU A 173 -5.635 -5.057 1.917 1.00 0.18 N ATOM 1372 CA LEU A 173 -4.501 -5.793 1.384 1.00 0.21 C ATOM 1373 C LEU A 173 -4.101 -6.908 2.339 1.00 0.21 C ATOM 1374 O LEU A 173 -3.318 -6.692 3.258 1.00 0.23 O ATOM 1375 CB LEU A 173 -3.322 -4.843 1.162 1.00 0.27 C ATOM 1376 CG LEU A 173 -3.486 -3.802 0.043 1.00 0.40 C ATOM 1377 CD1 LEU A 173 -4.741 -2.974 0.204 1.00 0.28 C ATOM 1378 CD2 LEU A 173 -2.296 -2.879 0.034 1.00 0.69 C ATOM 0 H LEU A 173 -5.385 -4.280 2.529 1.00 0.18 H new ATOM 0 HA LEU A 173 -4.785 -6.236 0.430 1.00 0.21 H new ATOM 0 HB2 LEU A 173 -3.129 -4.314 2.095 1.00 0.27 H new ATOM 0 HB3 LEU A 173 -2.437 -5.441 0.945 1.00 0.27 H new ATOM 0 HG LEU A 173 -3.562 -4.350 -0.896 1.00 0.40 H new ATOM 0 HD11 LEU A 173 -4.809 -2.254 -0.612 1.00 0.28 H new ATOM 0 HD12 LEU A 173 -5.613 -3.628 0.185 1.00 0.28 H new ATOM 0 HD13 LEU A 173 -4.707 -2.442 1.155 1.00 0.28 H new ATOM 0 HD21 LEU A 173 -2.414 -2.141 -0.760 1.00 0.69 H new ATOM 0 HD22 LEU A 173 -2.223 -2.369 0.995 1.00 0.69 H new ATOM 0 HD23 LEU A 173 -1.388 -3.457 -0.139 1.00 0.69 H new ATOM 1390 N THR A 174 -4.617 -8.101 2.098 1.00 0.20 N ATOM 1391 CA THR A 174 -4.465 -9.202 3.025 1.00 0.21 C ATOM 1392 C THR A 174 -3.345 -10.114 2.622 1.00 0.21 C ATOM 1393 O THR A 174 -3.264 -10.602 1.495 1.00 0.25 O ATOM 1394 CB THR A 174 -5.765 -9.998 3.174 1.00 0.23 C ATOM 1395 OG1 THR A 174 -6.689 -9.644 2.130 1.00 0.26 O ATOM 1396 CG2 THR A 174 -6.385 -9.723 4.536 1.00 0.26 C ATOM 0 H THR A 174 -5.149 -8.330 1.259 1.00 0.20 H new ATOM 0 HA THR A 174 -4.218 -8.765 3.992 1.00 0.21 H new ATOM 0 HB THR A 174 -5.539 -11.061 3.093 1.00 0.23 H new ATOM 0 HG1 THR A 174 -6.794 -10.400 1.516 1.00 0.26 H new ATOM 0 HG21 THR A 174 -7.309 -10.292 4.636 1.00 0.26 H new ATOM 0 HG22 THR A 174 -5.689 -10.021 5.320 1.00 0.26 H new ATOM 0 HG23 THR A 174 -6.602 -8.659 4.629 1.00 0.26 H new ATOM 1404 N PHE A 175 -2.478 -10.304 3.577 1.00 0.23 N ATOM 1405 CA PHE A 175 -1.293 -11.099 3.412 1.00 0.25 C ATOM 1406 C PHE A 175 -1.555 -12.540 3.761 1.00 0.32 C ATOM 1407 O PHE A 175 -2.232 -12.849 4.742 1.00 0.43 O ATOM 1408 CB PHE A 175 -0.171 -10.579 4.315 1.00 0.33 C ATOM 1409 CG PHE A 175 0.363 -9.219 3.971 1.00 0.33 C ATOM 1410 CD1 PHE A 175 -0.472 -8.194 3.561 1.00 0.40 C ATOM 1411 CD2 PHE A 175 1.715 -8.967 4.088 1.00 0.63 C ATOM 1412 CE1 PHE A 175 0.034 -6.945 3.274 1.00 0.43 C ATOM 1413 CE2 PHE A 175 2.228 -7.723 3.799 1.00 0.72 C ATOM 1414 CZ PHE A 175 1.389 -6.709 3.391 1.00 0.51 C ATOM 0 H PHE A 175 -2.577 -9.903 4.510 1.00 0.23 H new ATOM 0 HA PHE A 175 -0.996 -11.027 2.366 1.00 0.25 H new ATOM 0 HB2 PHE A 175 -0.537 -10.557 5.342 1.00 0.33 H new ATOM 0 HB3 PHE A 175 0.654 -11.291 4.286 1.00 0.33 H new ATOM 0 HD1 PHE A 175 -1.532 -8.375 3.465 1.00 0.40 H new ATOM 0 HD2 PHE A 175 2.379 -9.756 4.410 1.00 0.63 H new ATOM 0 HE1 PHE A 175 -0.628 -6.152 2.958 1.00 0.43 H new ATOM 0 HE2 PHE A 175 3.289 -7.542 3.892 1.00 0.72 H new ATOM 0 HZ PHE A 175 1.790 -5.733 3.163 1.00 0.51 H new ATOM 1424 N ASP A 176 -1.013 -13.422 2.957 1.00 0.28 N ATOM 1425 CA ASP A 176 -0.827 -14.789 3.374 1.00 0.34 C ATOM 1426 C ASP A 176 0.400 -14.796 4.233 1.00 0.35 C ATOM 1427 O ASP A 176 1.434 -15.366 3.879 1.00 0.35 O ATOM 1428 CB ASP A 176 -0.604 -15.699 2.172 1.00 0.34 C ATOM 1429 CG ASP A 176 -0.531 -17.173 2.542 1.00 0.64 C ATOM 1430 OD1 ASP A 176 -1.583 -17.773 2.856 1.00 0.71 O ATOM 1431 OD2 ASP A 176 0.583 -17.740 2.522 1.00 1.09 O ATOM 0 H ASP A 176 -0.693 -13.217 2.010 1.00 0.28 H new ATOM 0 HA ASP A 176 -1.707 -15.154 3.905 1.00 0.34 H new ATOM 0 HB2 ASP A 176 -1.413 -15.550 1.457 1.00 0.34 H new ATOM 0 HB3 ASP A 176 0.321 -15.410 1.672 1.00 0.34 H new ATOM 1436 N GLY A 177 0.300 -14.113 5.346 1.00 0.39 N ATOM 1437 CA GLY A 177 1.445 -13.998 6.189 1.00 0.43 C ATOM 1438 C GLY A 177 2.445 -13.028 5.603 1.00 0.42 C ATOM 1439 O GLY A 177 2.321 -11.813 5.757 1.00 0.47 O ATOM 0 H GLY A 177 -0.542 -13.642 5.677 1.00 0.39 H new ATOM 0 HA2 GLY A 177 1.141 -13.660 7.180 1.00 0.43 H new ATOM 0 HA3 GLY A 177 1.910 -14.976 6.315 1.00 0.43 H new ATOM 1443 N ASP A 178 3.446 -13.581 4.934 1.00 0.39 N ATOM 1444 CA ASP A 178 4.525 -12.803 4.359 1.00 0.43 C ATOM 1445 C ASP A 178 4.146 -12.141 3.051 1.00 0.38 C ATOM 1446 O ASP A 178 4.732 -11.128 2.674 1.00 0.44 O ATOM 1447 CB ASP A 178 5.721 -13.704 4.108 1.00 0.49 C ATOM 1448 CG ASP A 178 6.342 -14.215 5.387 1.00 0.62 C ATOM 1449 OD1 ASP A 178 7.246 -13.539 5.927 1.00 0.83 O ATOM 1450 OD2 ASP A 178 5.933 -15.297 5.859 1.00 0.69 O ATOM 0 H ASP A 178 3.530 -14.585 4.776 1.00 0.39 H new ATOM 0 HA ASP A 178 4.760 -12.017 5.076 1.00 0.43 H new ATOM 0 HB2 ASP A 178 5.411 -14.551 3.495 1.00 0.49 H new ATOM 0 HB3 ASP A 178 6.471 -13.156 3.538 1.00 0.49 H new ATOM 1455 N HIS A 179 3.177 -12.692 2.348 1.00 0.30 N ATOM 1456 CA HIS A 179 2.931 -12.257 1.005 1.00 0.27 C ATOM 1457 C HIS A 179 1.466 -12.056 0.770 1.00 0.21 C ATOM 1458 O HIS A 179 0.648 -12.917 1.063 1.00 0.19 O ATOM 1459 CB HIS A 179 3.515 -13.241 -0.003 1.00 0.31 C ATOM 1460 CG HIS A 179 2.991 -14.645 0.080 1.00 0.35 C ATOM 1461 ND1 HIS A 179 2.524 -15.333 -1.016 1.00 1.21 N ATOM 1462 CD2 HIS A 179 2.870 -15.493 1.129 1.00 0.96 C ATOM 1463 CE1 HIS A 179 2.139 -16.538 -0.647 1.00 1.07 C ATOM 1464 NE2 HIS A 179 2.336 -16.663 0.653 1.00 0.58 N ATOM 0 H HIS A 179 2.560 -13.431 2.686 1.00 0.30 H new ATOM 0 HA HIS A 179 3.430 -11.298 0.865 1.00 0.27 H new ATOM 0 HB2 HIS A 179 3.325 -12.861 -1.007 1.00 0.31 H new ATOM 0 HB3 HIS A 179 4.597 -13.268 0.128 1.00 0.31 H new ATOM 0 HD2 HIS A 179 3.144 -15.286 2.153 1.00 0.96 H new ATOM 0 HE1 HIS A 179 1.731 -17.296 -1.299 1.00 1.07 H new ATOM 0 HE2 HIS A 179 2.126 -17.491 1.210 1.00 0.58 H new ATOM 1473 N LEU A 180 1.174 -10.906 0.233 1.00 0.21 N ATOM 1474 CA LEU A 180 -0.187 -10.501 -0.052 1.00 0.18 C ATOM 1475 C LEU A 180 -0.889 -11.549 -0.880 1.00 0.18 C ATOM 1476 O LEU A 180 -0.401 -11.964 -1.928 1.00 0.21 O ATOM 1477 CB LEU A 180 -0.246 -9.187 -0.783 1.00 0.20 C ATOM 1478 CG LEU A 180 -1.653 -8.637 -0.880 1.00 0.24 C ATOM 1479 CD1 LEU A 180 -1.665 -7.168 -0.586 1.00 0.64 C ATOM 1480 CD2 LEU A 180 -2.238 -8.925 -2.235 1.00 0.59 C ATOM 0 H LEU A 180 1.875 -10.211 -0.024 1.00 0.21 H new ATOM 0 HA LEU A 180 -0.687 -10.385 0.910 1.00 0.18 H new ATOM 0 HB2 LEU A 180 0.389 -8.463 -0.272 1.00 0.20 H new ATOM 0 HB3 LEU A 180 0.160 -9.315 -1.786 1.00 0.20 H new ATOM 0 HG LEU A 180 -2.273 -9.133 -0.133 1.00 0.24 H new ATOM 0 HD11 LEU A 180 -2.685 -6.790 -0.661 1.00 0.64 H new ATOM 0 HD12 LEU A 180 -1.287 -6.996 0.422 1.00 0.64 H new ATOM 0 HD13 LEU A 180 -1.032 -6.648 -1.305 1.00 0.64 H new ATOM 0 HD21 LEU A 180 -3.250 -8.523 -2.287 1.00 0.59 H new ATOM 0 HD22 LEU A 180 -1.622 -8.459 -3.004 1.00 0.59 H new ATOM 0 HD23 LEU A 180 -2.267 -10.002 -2.397 1.00 0.59 H new ATOM 1492 N ALA A 181 -2.041 -11.952 -0.417 1.00 0.20 N ATOM 1493 CA ALA A 181 -2.788 -12.994 -1.066 1.00 0.23 C ATOM 1494 C ALA A 181 -3.980 -12.415 -1.796 1.00 0.26 C ATOM 1495 O ALA A 181 -4.273 -12.799 -2.927 1.00 0.29 O ATOM 1496 CB ALA A 181 -3.227 -14.023 -0.045 1.00 0.27 C ATOM 0 H ALA A 181 -2.486 -11.569 0.417 1.00 0.20 H new ATOM 0 HA ALA A 181 -2.150 -13.484 -1.802 1.00 0.23 H new ATOM 0 HB1 ALA A 181 -3.793 -14.811 -0.542 1.00 0.27 H new ATOM 0 HB2 ALA A 181 -2.350 -14.455 0.436 1.00 0.27 H new ATOM 0 HB3 ALA A 181 -3.855 -13.545 0.707 1.00 0.27 H new ATOM 1502 N THR A 182 -4.649 -11.462 -1.162 1.00 0.26 N ATOM 1503 CA THR A 182 -5.861 -10.904 -1.707 1.00 0.28 C ATOM 1504 C THR A 182 -5.976 -9.437 -1.374 1.00 0.29 C ATOM 1505 O THR A 182 -5.241 -8.919 -0.532 1.00 0.29 O ATOM 1506 CB THR A 182 -7.093 -11.611 -1.138 1.00 0.31 C ATOM 1507 OG1 THR A 182 -6.989 -11.691 0.292 1.00 0.32 O ATOM 1508 CG2 THR A 182 -7.250 -13.008 -1.718 1.00 0.33 C ATOM 0 H THR A 182 -4.365 -11.063 -0.267 1.00 0.26 H new ATOM 0 HA THR A 182 -5.816 -11.041 -2.787 1.00 0.28 H new ATOM 0 HB THR A 182 -7.973 -11.029 -1.414 1.00 0.31 H new ATOM 0 HG1 THR A 182 -7.780 -12.143 0.653 1.00 0.32 H new ATOM 0 HG21 THR A 182 -8.135 -13.481 -1.292 1.00 0.33 H new ATOM 0 HG22 THR A 182 -7.359 -12.942 -2.801 1.00 0.33 H new ATOM 0 HG23 THR A 182 -6.369 -13.603 -1.477 1.00 0.33 H new ATOM 1516 N ILE A 183 -6.898 -8.769 -2.043 1.00 0.31 N ATOM 1517 CA ILE A 183 -7.280 -7.437 -1.677 1.00 0.31 C ATOM 1518 C ILE A 183 -8.785 -7.398 -1.752 1.00 0.20 C ATOM 1519 O ILE A 183 -9.376 -8.100 -2.560 1.00 0.20 O ATOM 1520 CB ILE A 183 -6.651 -6.380 -2.601 1.00 0.42 C ATOM 1521 CG1 ILE A 183 -5.144 -6.561 -2.644 1.00 0.76 C ATOM 1522 CG2 ILE A 183 -6.993 -4.971 -2.142 1.00 0.33 C ATOM 1523 CD1 ILE A 183 -4.497 -5.871 -3.808 1.00 0.45 C ATOM 0 H ILE A 183 -7.396 -9.142 -2.851 1.00 0.31 H new ATOM 0 HA ILE A 183 -6.923 -7.198 -0.675 1.00 0.31 H new ATOM 0 HB ILE A 183 -7.062 -6.518 -3.601 1.00 0.42 H new ATOM 0 HG12 ILE A 183 -4.713 -6.179 -1.719 1.00 0.76 H new ATOM 0 HG13 ILE A 183 -4.914 -7.626 -2.688 1.00 0.76 H new ATOM 0 HG21 ILE A 183 -6.534 -4.247 -2.816 1.00 0.33 H new ATOM 0 HG22 ILE A 183 -8.075 -4.838 -2.150 1.00 0.33 H new ATOM 0 HG23 ILE A 183 -6.616 -4.816 -1.131 1.00 0.33 H new ATOM 0 HD11 ILE A 183 -3.421 -6.040 -3.779 1.00 0.45 H new ATOM 0 HD12 ILE A 183 -4.902 -6.270 -4.738 1.00 0.45 H new ATOM 0 HD13 ILE A 183 -4.698 -4.801 -3.754 1.00 0.45 H new ATOM 1535 N VAL A 184 -9.401 -6.650 -0.884 1.00 0.21 N ATOM 1536 CA VAL A 184 -10.838 -6.633 -0.786 1.00 0.20 C ATOM 1537 C VAL A 184 -11.336 -5.205 -0.619 1.00 0.18 C ATOM 1538 O VAL A 184 -10.721 -4.392 0.062 1.00 0.20 O ATOM 1539 CB VAL A 184 -11.304 -7.543 0.380 1.00 0.29 C ATOM 1540 CG1 VAL A 184 -12.766 -7.324 0.704 1.00 0.35 C ATOM 1541 CG2 VAL A 184 -11.052 -9.013 0.042 1.00 0.31 C ATOM 0 H VAL A 184 -8.926 -6.034 -0.224 1.00 0.21 H new ATOM 0 HA VAL A 184 -11.267 -7.027 -1.707 1.00 0.20 H new ATOM 0 HB VAL A 184 -10.722 -7.276 1.262 1.00 0.29 H new ATOM 0 HG11 VAL A 184 -13.059 -7.978 1.526 1.00 0.35 H new ATOM 0 HG12 VAL A 184 -12.923 -6.285 0.994 1.00 0.35 H new ATOM 0 HG13 VAL A 184 -13.371 -7.551 -0.174 1.00 0.35 H new ATOM 0 HG21 VAL A 184 -11.384 -9.639 0.870 1.00 0.31 H new ATOM 0 HG22 VAL A 184 -11.605 -9.279 -0.859 1.00 0.31 H new ATOM 0 HG23 VAL A 184 -9.987 -9.170 -0.127 1.00 0.31 H new ATOM 1551 N ASN A 185 -12.434 -4.904 -1.284 1.00 0.21 N ATOM 1552 CA ASN A 185 -13.013 -3.585 -1.271 1.00 0.26 C ATOM 1553 C ASN A 185 -13.805 -3.451 -0.022 1.00 0.29 C ATOM 1554 O ASN A 185 -14.916 -3.924 0.036 1.00 0.39 O ATOM 1555 CB ASN A 185 -13.945 -3.462 -2.454 1.00 0.37 C ATOM 1556 CG ASN A 185 -14.448 -2.060 -2.725 1.00 0.84 C ATOM 1557 OD1 ASN A 185 -15.530 -1.892 -3.281 1.00 1.77 O ATOM 1558 ND2 ASN A 185 -13.680 -1.048 -2.348 1.00 1.12 N ATOM 0 H ASN A 185 -12.950 -5.577 -1.851 1.00 0.21 H new ATOM 0 HA ASN A 185 -12.241 -2.817 -1.322 1.00 0.26 H new ATOM 0 HB2 ASN A 185 -13.430 -3.826 -3.343 1.00 0.37 H new ATOM 0 HB3 ASN A 185 -14.802 -4.115 -2.292 1.00 0.37 H new ATOM 0 HD21 ASN A 185 -13.981 -0.088 -2.517 1.00 1.12 H new ATOM 0 HD22 ASN A 185 -12.787 -1.229 -1.889 1.00 1.12 H new ATOM 1565 N MET A 186 -13.255 -2.794 0.956 1.00 0.26 N ATOM 1566 CA MET A 186 -13.781 -2.881 2.304 1.00 0.32 C ATOM 1567 C MET A 186 -15.197 -2.315 2.442 1.00 0.38 C ATOM 1568 O MET A 186 -15.791 -2.367 3.518 1.00 0.45 O ATOM 1569 CB MET A 186 -12.835 -2.181 3.257 1.00 0.34 C ATOM 1570 CG MET A 186 -11.424 -2.716 3.184 1.00 0.55 C ATOM 1571 SD MET A 186 -10.432 -2.335 4.642 1.00 0.54 S ATOM 1572 CE MET A 186 -10.309 -0.552 4.526 1.00 0.55 C ATOM 0 H MET A 186 -12.440 -2.188 0.855 1.00 0.26 H new ATOM 0 HA MET A 186 -13.855 -3.939 2.554 1.00 0.32 H new ATOM 0 HB2 MET A 186 -12.826 -1.114 3.033 1.00 0.34 H new ATOM 0 HB3 MET A 186 -13.207 -2.290 4.276 1.00 0.34 H new ATOM 0 HG2 MET A 186 -11.461 -3.797 3.052 1.00 0.55 H new ATOM 0 HG3 MET A 186 -10.933 -2.304 2.303 1.00 0.55 H new ATOM 0 HE1 MET A 186 -9.663 -0.179 5.321 1.00 0.55 H new ATOM 0 HE2 MET A 186 -9.888 -0.279 3.559 1.00 0.55 H new ATOM 0 HE3 MET A 186 -11.301 -0.112 4.627 1.00 0.55 H new ATOM 1582 N GLU A 187 -15.727 -1.780 1.359 1.00 0.39 N ATOM 1583 CA GLU A 187 -17.046 -1.211 1.348 1.00 0.50 C ATOM 1584 C GLU A 187 -18.082 -2.237 0.942 1.00 0.52 C ATOM 1585 O GLU A 187 -19.177 -2.304 1.493 1.00 0.60 O ATOM 1586 CB GLU A 187 -17.033 -0.052 0.382 1.00 0.59 C ATOM 1587 CG GLU A 187 -16.812 -0.424 -1.059 1.00 0.59 C ATOM 1588 CD GLU A 187 -16.482 0.767 -1.933 1.00 0.80 C ATOM 1589 OE1 GLU A 187 -17.341 1.179 -2.737 1.00 0.89 O ATOM 1590 OE2 GLU A 187 -15.358 1.298 -1.815 1.00 1.02 O ATOM 0 H GLU A 187 -15.246 -1.731 0.461 1.00 0.39 H new ATOM 0 HA GLU A 187 -17.315 -0.871 2.348 1.00 0.50 H new ATOM 0 HB2 GLU A 187 -17.982 0.479 0.463 1.00 0.59 H new ATOM 0 HB3 GLU A 187 -16.251 0.645 0.685 1.00 0.59 H new ATOM 0 HG2 GLU A 187 -16.001 -1.149 -1.121 1.00 0.59 H new ATOM 0 HG3 GLU A 187 -17.707 -0.913 -1.444 1.00 0.59 H new ATOM 1597 N ASN A 188 -17.706 -3.032 -0.024 1.00 0.48 N ATOM 1598 CA ASN A 188 -18.580 -4.056 -0.573 1.00 0.56 C ATOM 1599 C ASN A 188 -18.135 -5.405 -0.091 1.00 0.55 C ATOM 1600 O ASN A 188 -18.900 -6.367 -0.037 1.00 0.65 O ATOM 1601 CB ASN A 188 -18.515 -4.031 -2.085 1.00 0.61 C ATOM 1602 CG ASN A 188 -19.315 -2.894 -2.694 1.00 0.77 C ATOM 1603 OD1 ASN A 188 -19.482 -1.835 -2.090 1.00 1.40 O ATOM 1604 ND2 ASN A 188 -19.820 -3.106 -3.895 1.00 1.37 N ATOM 0 H ASN A 188 -16.784 -2.994 -0.459 1.00 0.48 H new ATOM 0 HA ASN A 188 -19.602 -3.862 -0.247 1.00 0.56 H new ATOM 0 HB2 ASN A 188 -17.474 -3.944 -2.397 1.00 0.61 H new ATOM 0 HB3 ASN A 188 -18.886 -4.979 -2.475 1.00 0.61 H new ATOM 0 HD21 ASN A 188 -20.370 -2.379 -4.353 1.00 1.37 H new ATOM 0 HD22 ASN A 188 -19.661 -3.997 -4.365 1.00 1.37 H new ATOM 1611 N ASN A 189 -16.859 -5.430 0.221 1.00 0.46 N ATOM 1612 CA ASN A 189 -16.159 -6.604 0.695 1.00 0.47 C ATOM 1613 C ASN A 189 -15.959 -7.534 -0.477 1.00 0.52 C ATOM 1614 O ASN A 189 -15.979 -8.754 -0.364 1.00 0.59 O ATOM 1615 CB ASN A 189 -16.894 -7.264 1.856 1.00 0.57 C ATOM 1616 CG ASN A 189 -16.109 -8.386 2.515 1.00 0.67 C ATOM 1617 OD1 ASN A 189 -16.279 -9.563 2.194 1.00 1.33 O ATOM 1618 ND2 ASN A 189 -15.242 -8.028 3.448 1.00 1.30 N ATOM 0 H ASN A 189 -16.260 -4.608 0.150 1.00 0.46 H new ATOM 0 HA ASN A 189 -15.184 -6.326 1.096 1.00 0.47 H new ATOM 0 HB2 ASN A 189 -17.127 -6.507 2.605 1.00 0.57 H new ATOM 0 HB3 ASN A 189 -17.844 -7.659 1.496 1.00 0.57 H new ATOM 0 HD21 ASN A 189 -14.687 -8.737 3.928 1.00 1.30 H new ATOM 0 HD22 ASN A 189 -15.128 -7.043 3.687 1.00 1.30 H new ATOM 1625 N ARG A 190 -15.765 -6.915 -1.628 1.00 0.51 N ATOM 1626 CA ARG A 190 -15.533 -7.647 -2.842 1.00 0.57 C ATOM 1627 C ARG A 190 -14.057 -7.812 -3.071 1.00 0.48 C ATOM 1628 O ARG A 190 -13.237 -7.093 -2.511 1.00 0.37 O ATOM 1629 CB ARG A 190 -16.167 -6.947 -4.030 1.00 0.66 C ATOM 1630 CG ARG A 190 -15.404 -5.734 -4.531 1.00 0.72 C ATOM 1631 CD ARG A 190 -16.327 -4.709 -5.132 1.00 0.74 C ATOM 1632 NE ARG A 190 -17.377 -5.325 -5.944 1.00 1.22 N ATOM 1633 CZ ARG A 190 -18.312 -4.649 -6.605 1.00 1.47 C ATOM 1634 NH1 ARG A 190 -18.314 -3.322 -6.600 1.00 1.27 N ATOM 1635 NH2 ARG A 190 -19.244 -5.310 -7.279 1.00 2.28 N ATOM 0 H ARG A 190 -15.765 -5.901 -1.739 1.00 0.51 H new ATOM 0 HA ARG A 190 -15.993 -8.630 -2.739 1.00 0.57 H new ATOM 0 HB2 ARG A 190 -16.263 -7.662 -4.847 1.00 0.66 H new ATOM 0 HB3 ARG A 190 -17.176 -6.638 -3.757 1.00 0.66 H new ATOM 0 HG2 ARG A 190 -14.849 -5.286 -3.706 1.00 0.72 H new ATOM 0 HG3 ARG A 190 -14.672 -6.046 -5.275 1.00 0.72 H new ATOM 0 HD2 ARG A 190 -16.783 -4.121 -4.336 1.00 0.74 H new ATOM 0 HD3 ARG A 190 -15.750 -4.019 -5.748 1.00 0.74 H new ATOM 0 HE ARG A 190 -17.393 -6.343 -6.007 1.00 1.22 H new ATOM 0 HH11 ARG A 190 -17.595 -2.813 -6.086 1.00 1.27 H new ATOM 0 HH12 ARG A 190 -19.035 -2.811 -7.110 1.00 1.27 H new ATOM 0 HH21 ARG A 190 -19.240 -6.330 -7.288 1.00 2.28 H new ATOM 0 HH22 ARG A 190 -19.964 -4.798 -7.788 1.00 2.28 H new ATOM 1649 N GLN A 191 -13.744 -8.748 -3.910 1.00 0.55 N ATOM 1650 CA GLN A 191 -12.375 -9.141 -4.135 1.00 0.47 C ATOM 1651 C GLN A 191 -11.674 -8.315 -5.203 1.00 0.38 C ATOM 1652 O GLN A 191 -12.241 -7.949 -6.232 1.00 0.59 O ATOM 1653 CB GLN A 191 -12.312 -10.624 -4.458 1.00 0.58 C ATOM 1654 CG GLN A 191 -12.570 -11.465 -3.229 1.00 0.61 C ATOM 1655 CD GLN A 191 -12.604 -12.952 -3.511 1.00 0.75 C ATOM 1656 OE1 GLN A 191 -11.961 -13.439 -4.442 1.00 1.36 O ATOM 1657 NE2 GLN A 191 -13.349 -13.689 -2.704 1.00 1.27 N ATOM 0 H GLN A 191 -14.426 -9.267 -4.463 1.00 0.55 H new ATOM 0 HA GLN A 191 -11.831 -8.945 -3.211 1.00 0.47 H new ATOM 0 HB2 GLN A 191 -13.048 -10.863 -5.226 1.00 0.58 H new ATOM 0 HB3 GLN A 191 -11.332 -10.868 -4.869 1.00 0.58 H new ATOM 0 HG2 GLN A 191 -11.795 -11.261 -2.490 1.00 0.61 H new ATOM 0 HG3 GLN A 191 -13.520 -11.165 -2.786 1.00 0.61 H new ATOM 0 HE21 GLN A 191 -13.867 -13.248 -1.944 1.00 1.27 H new ATOM 0 HE22 GLN A 191 -13.405 -14.698 -2.842 1.00 1.27 H new ATOM 1666 N PHE A 192 -10.424 -8.043 -4.899 1.00 0.25 N ATOM 1667 CA PHE A 192 -9.500 -7.319 -5.710 1.00 0.46 C ATOM 1668 C PHE A 192 -8.521 -8.318 -6.275 1.00 0.63 C ATOM 1669 O PHE A 192 -8.758 -9.523 -6.198 1.00 1.18 O ATOM 1670 CB PHE A 192 -8.844 -6.180 -4.936 1.00 0.58 C ATOM 1671 CG PHE A 192 -9.620 -4.896 -5.029 1.00 0.63 C ATOM 1672 CD1 PHE A 192 -9.856 -4.293 -6.253 1.00 0.84 C ATOM 1673 CD2 PHE A 192 -10.105 -4.286 -3.883 1.00 0.63 C ATOM 1674 CE1 PHE A 192 -10.561 -3.109 -6.332 1.00 0.95 C ATOM 1675 CE2 PHE A 192 -10.812 -3.101 -3.956 1.00 0.70 C ATOM 1676 CZ PHE A 192 -11.070 -2.532 -5.220 1.00 0.81 C ATOM 0 H PHE A 192 -10.010 -8.347 -4.018 1.00 0.25 H new ATOM 0 HA PHE A 192 -10.008 -6.821 -6.536 1.00 0.46 H new ATOM 0 HB2 PHE A 192 -8.746 -6.466 -3.889 1.00 0.58 H new ATOM 0 HB3 PHE A 192 -7.836 -6.019 -5.318 1.00 0.58 H new ATOM 0 HD1 PHE A 192 -9.484 -4.754 -7.156 1.00 0.84 H new ATOM 0 HD2 PHE A 192 -9.928 -4.743 -2.920 1.00 0.63 H new ATOM 0 HE1 PHE A 192 -10.708 -2.638 -7.293 1.00 0.95 H new ATOM 0 HE2 PHE A 192 -11.162 -2.617 -3.056 1.00 0.70 H new ATOM 0 HZ PHE A 192 -11.672 -1.639 -5.300 1.00 0.81 H new ATOM 1686 N GLY A 193 -7.430 -7.854 -6.816 1.00 1.17 N ATOM 1687 CA GLY A 193 -6.769 -8.527 -7.899 1.00 1.28 C ATOM 1688 C GLY A 193 -6.343 -7.500 -8.879 1.00 0.64 C ATOM 1689 O GLY A 193 -5.625 -7.779 -9.837 1.00 0.63 O ATOM 0 H GLY A 193 -6.971 -6.993 -6.517 1.00 1.17 H new ATOM 0 HA2 GLY A 193 -5.908 -9.086 -7.533 1.00 1.28 H new ATOM 0 HA3 GLY A 193 -7.440 -9.247 -8.368 1.00 1.28 H new ATOM 1693 N PHE A 194 -6.782 -6.285 -8.605 1.00 0.41 N ATOM 1694 CA PHE A 194 -6.111 -5.122 -9.131 1.00 0.61 C ATOM 1695 C PHE A 194 -6.349 -3.890 -8.251 1.00 0.66 C ATOM 1696 O PHE A 194 -7.479 -3.429 -8.124 1.00 0.89 O ATOM 1697 CB PHE A 194 -6.534 -4.841 -10.572 1.00 0.86 C ATOM 1698 CG PHE A 194 -7.999 -4.570 -10.738 1.00 1.25 C ATOM 1699 CD1 PHE A 194 -8.904 -5.612 -10.765 1.00 1.36 C ATOM 1700 CD2 PHE A 194 -8.466 -3.277 -10.871 1.00 2.03 C ATOM 1701 CE1 PHE A 194 -10.254 -5.371 -10.922 1.00 2.10 C ATOM 1702 CE2 PHE A 194 -9.814 -3.026 -11.030 1.00 2.80 C ATOM 1703 CZ PHE A 194 -10.708 -4.062 -11.037 1.00 2.80 C ATOM 0 H PHE A 194 -7.596 -6.084 -8.024 1.00 0.41 H new ATOM 0 HA PHE A 194 -5.043 -5.338 -9.126 1.00 0.61 H new ATOM 0 HB2 PHE A 194 -5.972 -3.984 -10.944 1.00 0.86 H new ATOM 0 HB3 PHE A 194 -6.261 -5.694 -11.193 1.00 0.86 H new ATOM 0 HD1 PHE A 194 -8.552 -6.628 -10.662 1.00 1.36 H new ATOM 0 HD2 PHE A 194 -7.768 -2.453 -10.850 1.00 2.03 H new ATOM 0 HE1 PHE A 194 -10.953 -6.194 -10.955 1.00 2.10 H new ATOM 0 HE2 PHE A 194 -10.163 -2.011 -11.149 1.00 2.80 H new ATOM 0 HZ PHE A 194 -11.765 -3.863 -11.132 1.00 2.80 H new ATOM 1713 N PHE A 195 -5.322 -3.388 -7.595 1.00 0.49 N ATOM 1714 CA PHE A 195 -5.393 -2.026 -7.072 1.00 0.43 C ATOM 1715 C PHE A 195 -4.155 -1.233 -7.507 1.00 0.39 C ATOM 1716 O PHE A 195 -3.076 -1.388 -6.954 1.00 0.60 O ATOM 1717 CB PHE A 195 -5.500 -2.065 -5.564 1.00 0.41 C ATOM 1718 CG PHE A 195 -6.385 -1.005 -5.014 1.00 0.36 C ATOM 1719 CD1 PHE A 195 -5.837 0.083 -4.377 1.00 0.56 C ATOM 1720 CD2 PHE A 195 -7.758 -1.089 -5.137 1.00 0.51 C ATOM 1721 CE1 PHE A 195 -6.633 1.071 -3.875 1.00 0.57 C ATOM 1722 CE2 PHE A 195 -8.562 -0.103 -4.633 1.00 0.60 C ATOM 1723 CZ PHE A 195 -8.047 0.933 -3.986 1.00 0.47 C ATOM 0 H PHE A 195 -4.448 -3.881 -7.411 1.00 0.49 H new ATOM 0 HA PHE A 195 -6.277 -1.530 -7.472 1.00 0.43 H new ATOM 0 HB2 PHE A 195 -5.878 -3.040 -5.258 1.00 0.41 H new ATOM 0 HB3 PHE A 195 -4.505 -1.959 -5.132 1.00 0.41 H new ATOM 0 HD1 PHE A 195 -4.765 0.157 -4.273 1.00 0.56 H new ATOM 0 HD2 PHE A 195 -8.200 -1.939 -5.635 1.00 0.51 H new ATOM 0 HE1 PHE A 195 -6.200 1.940 -3.403 1.00 0.57 H new ATOM 0 HE2 PHE A 195 -9.632 -0.170 -4.764 1.00 0.60 H new ATOM 0 HZ PHE A 195 -8.699 1.672 -3.543 1.00 0.47 H new ATOM 1733 N ARG A 196 -4.288 -0.393 -8.513 1.00 0.48 N ATOM 1734 CA ARG A 196 -3.111 0.249 -9.089 1.00 0.46 C ATOM 1735 C ARG A 196 -2.931 1.673 -8.577 1.00 0.48 C ATOM 1736 O ARG A 196 -3.866 2.474 -8.605 1.00 0.66 O ATOM 1737 CB ARG A 196 -3.190 0.256 -10.609 1.00 0.53 C ATOM 1738 CG ARG A 196 -3.836 -0.979 -11.214 1.00 1.29 C ATOM 1739 CD ARG A 196 -3.231 -2.262 -10.670 1.00 1.91 C ATOM 1740 NE ARG A 196 -3.736 -3.437 -11.384 1.00 2.91 N ATOM 1741 CZ ARG A 196 -3.121 -4.621 -11.425 1.00 3.82 C ATOM 1742 NH1 ARG A 196 -1.947 -4.794 -10.841 1.00 4.08 N ATOM 1743 NH2 ARG A 196 -3.672 -5.634 -12.077 1.00 4.77 N ATOM 0 H ARG A 196 -5.176 -0.139 -8.945 1.00 0.48 H new ATOM 0 HA ARG A 196 -2.245 -0.335 -8.776 1.00 0.46 H new ATOM 0 HB2 ARG A 196 -3.750 1.136 -10.927 1.00 0.53 H new ATOM 0 HB3 ARG A 196 -2.182 0.357 -11.012 1.00 0.53 H new ATOM 0 HG2 ARG A 196 -4.906 -0.967 -11.007 1.00 1.29 H new ATOM 0 HG3 ARG A 196 -3.720 -0.955 -12.298 1.00 1.29 H new ATOM 0 HD2 ARG A 196 -2.145 -2.220 -10.758 1.00 1.91 H new ATOM 0 HD3 ARG A 196 -3.461 -2.353 -9.608 1.00 1.91 H new ATOM 0 HE ARG A 196 -4.620 -3.344 -11.885 1.00 2.91 H new ATOM 0 HH11 ARG A 196 -1.501 -4.018 -10.352 1.00 4.08 H new ATOM 0 HH12 ARG A 196 -1.487 -5.704 -10.880 1.00 4.08 H new ATOM 0 HH21 ARG A 196 -4.568 -5.510 -12.549 1.00 4.77 H new ATOM 0 HH22 ARG A 196 -3.200 -6.538 -12.107 1.00 4.77 H new ATOM 1757 N LEU A 197 -1.727 1.976 -8.094 1.00 0.40 N ATOM 1758 CA LEU A 197 -1.383 3.333 -7.695 1.00 0.46 C ATOM 1759 C LEU A 197 -0.418 3.969 -8.687 1.00 0.56 C ATOM 1760 O LEU A 197 0.098 3.304 -9.589 1.00 0.65 O ATOM 1761 CB LEU A 197 -0.748 3.353 -6.304 1.00 0.64 C ATOM 1762 CG LEU A 197 -1.703 3.138 -5.127 1.00 0.98 C ATOM 1763 CD1 LEU A 197 -1.064 3.654 -3.853 1.00 1.61 C ATOM 1764 CD2 LEU A 197 -3.047 3.822 -5.356 1.00 1.04 C ATOM 0 H LEU A 197 -0.976 1.297 -7.971 1.00 0.40 H new ATOM 0 HA LEU A 197 -2.310 3.905 -7.677 1.00 0.46 H new ATOM 0 HB2 LEU A 197 0.022 2.582 -6.267 1.00 0.64 H new ATOM 0 HB3 LEU A 197 -0.247 4.311 -6.169 1.00 0.64 H new ATOM 0 HG LEU A 197 -1.892 2.068 -5.037 1.00 0.98 H new ATOM 0 HD11 LEU A 197 -1.745 3.500 -3.016 1.00 1.61 H new ATOM 0 HD12 LEU A 197 -0.135 3.115 -3.668 1.00 1.61 H new ATOM 0 HD13 LEU A 197 -0.852 4.718 -3.957 1.00 1.61 H new ATOM 0 HD21 LEU A 197 -3.696 3.646 -4.498 1.00 1.04 H new ATOM 0 HD22 LEU A 197 -2.893 4.894 -5.480 1.00 1.04 H new ATOM 0 HD23 LEU A 197 -3.514 3.416 -6.254 1.00 1.04 H new ATOM 1776 N ASP A 198 -0.189 5.261 -8.507 1.00 0.64 N ATOM 1777 CA ASP A 198 0.780 5.999 -9.304 1.00 0.79 C ATOM 1778 C ASP A 198 1.893 6.497 -8.385 1.00 0.86 C ATOM 1779 O ASP A 198 1.730 7.505 -7.699 1.00 1.05 O ATOM 1780 CB ASP A 198 0.097 7.169 -10.012 1.00 0.95 C ATOM 1781 CG ASP A 198 1.017 7.883 -10.979 1.00 1.85 C ATOM 1782 OD1 ASP A 198 1.223 7.379 -12.096 1.00 2.19 O ATOM 1783 OD2 ASP A 198 1.554 8.951 -10.620 1.00 2.66 O ATOM 0 H ASP A 198 -0.668 5.827 -7.806 1.00 0.64 H new ATOM 0 HA ASP A 198 1.207 5.349 -10.068 1.00 0.79 H new ATOM 0 HB2 ASP A 198 -0.776 6.802 -10.551 1.00 0.95 H new ATOM 0 HB3 ASP A 198 -0.263 7.879 -9.267 1.00 0.95 H new