USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 697 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 387 TYR OH : rot 36:sc= -4.21! USER MOD Set 1.2: A 404 CYS SG : rot 109:sc= 0.324 USER MOD Single : A 363 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 365 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 368 MET CE :methyl 173:sc= -0.99 (180deg=-1.34) USER MOD Single : A 369 ASN :FLIP amide:sc= -0.402 F(o=-1.9!,f=-0.4) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN :FLIP amide:sc= -0.0433 F(o=-1.7,f=-0.043) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot -33:sc= 0.0375 USER MOD Single : A 380 TYR OH : rot -141:sc= 1.25 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HE2:sc= -3.18 K(o=-3.2,f=-6.4!) USER MOD Single : A 389 THR OG1 : rot 14:sc= 0.942 USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 392 LYS NZ :NH3+ -142:sc= -0.213 (180deg=-0.945) USER MOD Single : A 394 THR OG1 : rot 180:sc= 0 USER MOD Single : A 399 ASN : amide:sc= -3.13 K(o=-3.1,f=-5.5!) USER MOD Single : A 400 SER OG : rot -100:sc= -1.88 USER MOD Single : A 410 THR OG1 : rot 180:sc= -0.0433 USER MOD Single : A 414 THR OG1 : rot 180:sc= -2.51! USER MOD Single : A 419 ASN :FLIP amide:sc= -0.404 F(o=-1.7!,f=-0.4) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -0.82 K(o=-0.82,f=-1.7) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl -108:sc= -0.0403 (180deg=-0.694) USER MOD Single : A 441 TYR OH : rot 180:sc= 0 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.216 X(o=-0.22,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 363 -7.479 -8.273 13.164 1.00 0.00 N ATOM 2 CA MET A 363 -7.631 -9.339 12.140 1.00 0.00 C ATOM 3 C MET A 363 -7.125 -8.873 10.779 1.00 0.00 C ATOM 4 O MET A 363 -7.212 -7.692 10.445 1.00 0.00 O ATOM 5 CB MET A 363 -9.110 -9.720 12.051 1.00 0.00 C ATOM 6 CG MET A 363 -9.642 -10.394 13.305 1.00 0.00 C ATOM 7 SD MET A 363 -10.747 -11.772 12.941 1.00 0.00 S ATOM 8 CE MET A 363 -12.341 -11.019 13.256 1.00 0.00 C ATOM 0 HA MET A 363 -7.036 -10.204 12.432 1.00 0.00 H new ATOM 0 HB2 MET A 363 -9.696 -8.822 11.855 1.00 0.00 H new ATOM 0 HB3 MET A 363 -9.254 -10.387 11.201 1.00 0.00 H new ATOM 0 HG2 MET A 363 -8.804 -10.754 13.902 1.00 0.00 H new ATOM 0 HG3 MET A 363 -10.172 -9.659 13.910 1.00 0.00 H new ATOM 0 HE1 MET A 363 -13.130 -11.748 13.074 1.00 0.00 H new ATOM 0 HE2 MET A 363 -12.387 -10.685 14.293 1.00 0.00 H new ATOM 0 HE3 MET A 363 -12.477 -10.164 12.593 1.00 0.00 H new ATOM 20 N ASP A 364 -6.595 -9.809 10.000 1.00 0.00 N ATOM 21 CA ASP A 364 -6.073 -9.495 8.675 1.00 0.00 C ATOM 22 C ASP A 364 -7.179 -9.554 7.626 1.00 0.00 C ATOM 23 O ASP A 364 -7.845 -10.578 7.469 1.00 0.00 O ATOM 24 CB ASP A 364 -4.949 -10.464 8.304 1.00 0.00 C ATOM 25 CG ASP A 364 -3.819 -10.454 9.314 1.00 0.00 C ATOM 26 OD1 ASP A 364 -4.054 -10.030 10.465 1.00 0.00 O ATOM 27 OD2 ASP A 364 -2.698 -10.871 8.956 1.00 0.00 O ATOM 0 H ASP A 364 -6.515 -10.791 10.263 1.00 0.00 H new ATOM 0 HA ASP A 364 -5.675 -8.481 8.700 1.00 0.00 H new ATOM 0 HB2 ASP A 364 -5.354 -11.473 8.226 1.00 0.00 H new ATOM 0 HB3 ASP A 364 -4.557 -10.202 7.322 1.00 0.00 H new ATOM 32 N LYS A 365 -7.369 -8.449 6.911 1.00 0.00 N ATOM 33 CA LYS A 365 -8.396 -8.376 5.876 1.00 0.00 C ATOM 34 C LYS A 365 -8.317 -7.051 5.128 1.00 0.00 C ATOM 35 O LYS A 365 -8.431 -7.008 3.903 1.00 0.00 O ATOM 36 CB LYS A 365 -9.785 -8.547 6.495 1.00 0.00 C ATOM 37 CG LYS A 365 -10.742 -9.352 5.630 1.00 0.00 C ATOM 38 CD LYS A 365 -11.880 -9.931 6.453 1.00 0.00 C ATOM 39 CE LYS A 365 -13.178 -9.970 5.660 1.00 0.00 C ATOM 40 NZ LYS A 365 -14.357 -9.639 6.508 1.00 0.00 N ATOM 0 H LYS A 365 -6.827 -7.593 7.029 1.00 0.00 H new ATOM 0 HA LYS A 365 -8.222 -9.184 5.165 1.00 0.00 H new ATOM 0 HB2 LYS A 365 -9.684 -9.037 7.463 1.00 0.00 H new ATOM 0 HB3 LYS A 365 -10.215 -7.563 6.679 1.00 0.00 H new ATOM 0 HG2 LYS A 365 -11.147 -8.715 4.844 1.00 0.00 H new ATOM 0 HG3 LYS A 365 -10.199 -10.159 5.138 1.00 0.00 H new ATOM 0 HD2 LYS A 365 -11.620 -10.939 6.777 1.00 0.00 H new ATOM 0 HD3 LYS A 365 -12.020 -9.333 7.353 1.00 0.00 H new ATOM 0 HE2 LYS A 365 -13.118 -9.265 4.831 1.00 0.00 H new ATOM 0 HE3 LYS A 365 -13.309 -10.962 5.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 365 -15.221 -9.676 5.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 365 -14.430 -10.326 7.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 365 -14.244 -8.683 6.901 1.00 0.00 H new ATOM 54 N LEU A 366 -8.123 -5.972 5.876 1.00 0.00 N ATOM 55 CA LEU A 366 -8.027 -4.641 5.292 1.00 0.00 C ATOM 56 C LEU A 366 -6.631 -4.059 5.500 1.00 0.00 C ATOM 57 O LEU A 366 -6.481 -2.911 5.920 1.00 0.00 O ATOM 58 CB LEU A 366 -9.078 -3.715 5.910 1.00 0.00 C ATOM 59 CG LEU A 366 -9.557 -2.581 5.000 1.00 0.00 C ATOM 60 CD1 LEU A 366 -10.892 -2.937 4.362 1.00 0.00 C ATOM 61 CD2 LEU A 366 -9.670 -1.280 5.782 1.00 0.00 C ATOM 0 H LEU A 366 -8.029 -5.993 6.891 1.00 0.00 H new ATOM 0 HA LEU A 366 -8.211 -4.723 4.221 1.00 0.00 H new ATOM 0 HB2 LEU A 366 -9.940 -4.314 6.204 1.00 0.00 H new ATOM 0 HB3 LEU A 366 -8.667 -3.280 6.821 1.00 0.00 H new ATOM 0 HG LEU A 366 -8.822 -2.443 4.207 1.00 0.00 H new ATOM 0 HD11 LEU A 366 -11.217 -2.120 3.719 1.00 0.00 H new ATOM 0 HD12 LEU A 366 -10.781 -3.844 3.768 1.00 0.00 H new ATOM 0 HD13 LEU A 366 -11.635 -3.103 5.142 1.00 0.00 H new ATOM 0 HD21 LEU A 366 -10.012 -0.485 5.119 1.00 0.00 H new ATOM 0 HD22 LEU A 366 -10.384 -1.406 6.596 1.00 0.00 H new ATOM 0 HD23 LEU A 366 -8.695 -1.016 6.192 1.00 0.00 H new ATOM 73 N ASP A 367 -5.613 -4.861 5.207 1.00 0.00 N ATOM 74 CA ASP A 367 -4.230 -4.427 5.366 1.00 0.00 C ATOM 75 C ASP A 367 -3.946 -4.069 6.821 1.00 0.00 C ATOM 76 O ASP A 367 -3.271 -3.073 7.111 1.00 0.00 O ATOM 77 CB ASP A 367 -3.942 -3.234 4.458 1.00 0.00 C ATOM 78 CG ASP A 367 -3.360 -3.652 3.122 1.00 0.00 C ATOM 79 OD1 ASP A 367 -4.038 -4.399 2.387 1.00 0.00 O ATOM 80 OD2 ASP A 367 -2.227 -3.229 2.811 1.00 0.00 O ATOM 0 H ASP A 367 -5.719 -5.814 4.859 1.00 0.00 H new ATOM 0 HA ASP A 367 -3.574 -5.249 5.080 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -4.864 -2.677 4.291 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -3.248 -2.559 4.959 1.00 0.00 H new ATOM 85 N MET A 368 -4.475 -4.905 7.723 1.00 0.00 N ATOM 86 CA MET A 368 -4.318 -4.745 9.173 1.00 0.00 C ATOM 87 C MET A 368 -4.097 -3.287 9.587 1.00 0.00 C ATOM 88 O MET A 368 -5.053 -2.556 9.841 1.00 0.00 O ATOM 89 CB MET A 368 -3.168 -5.624 9.676 1.00 0.00 C ATOM 90 CG MET A 368 -3.626 -6.970 10.215 1.00 0.00 C ATOM 91 SD MET A 368 -3.724 -6.999 12.016 1.00 0.00 S ATOM 92 CE MET A 368 -4.548 -5.442 12.334 1.00 0.00 C ATOM 0 H MET A 368 -5.030 -5.720 7.463 1.00 0.00 H new ATOM 0 HA MET A 368 -5.252 -5.064 9.635 1.00 0.00 H new ATOM 0 HB2 MET A 368 -2.463 -5.788 8.861 1.00 0.00 H new ATOM 0 HB3 MET A 368 -2.630 -5.091 10.460 1.00 0.00 H new ATOM 0 HG2 MET A 368 -4.604 -7.211 9.798 1.00 0.00 H new ATOM 0 HG3 MET A 368 -2.937 -7.745 9.880 1.00 0.00 H new ATOM 0 HE1 MET A 368 -4.793 -5.370 13.394 1.00 0.00 H new ATOM 0 HE2 MET A 368 -3.890 -4.619 12.057 1.00 0.00 H new ATOM 0 HE3 MET A 368 -5.464 -5.388 11.745 1.00 0.00 H new ATOM 102 N ASN A 369 -2.835 -2.875 9.661 1.00 0.00 N ATOM 103 CA ASN A 369 -2.499 -1.512 10.051 1.00 0.00 C ATOM 104 C ASN A 369 -1.467 -0.906 9.101 1.00 0.00 C ATOM 105 O ASN A 369 -0.849 0.112 9.412 1.00 0.00 O ATOM 106 CB ASN A 369 -1.986 -1.485 11.499 1.00 0.00 C ATOM 107 CG ASN A 369 -0.482 -1.688 11.613 1.00 0.00 C ATOM 108 OD1 ASN A 369 0.070 -2.557 10.774 1.00 0.00 O flip ATOM 109 ND2 ASN A 369 0.176 -1.066 12.449 1.00 0.00 N flip ATOM 0 H ASN A 369 -2.029 -3.466 9.456 1.00 0.00 H new ATOM 0 HA ASN A 369 -3.403 -0.907 9.989 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -2.251 -0.530 11.953 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.494 -2.262 12.071 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -0.287 -0.407 13.075 1.00 0.00 H new ATOM 0 HD22 ASN A 369 1.184 -1.210 12.515 1.00 0.00 H new ATOM 116 N ALA A 370 -1.288 -1.534 7.945 1.00 0.00 N ATOM 117 CA ALA A 370 -0.335 -1.046 6.960 1.00 0.00 C ATOM 118 C ALA A 370 -0.985 -0.010 6.057 1.00 0.00 C ATOM 119 O ALA A 370 -0.330 0.927 5.600 1.00 0.00 O ATOM 120 CB ALA A 370 0.221 -2.203 6.142 1.00 0.00 C ATOM 0 H ALA A 370 -1.789 -2.379 7.669 1.00 0.00 H new ATOM 0 HA ALA A 370 0.493 -0.568 7.484 1.00 0.00 H new ATOM 0 HB1 ALA A 370 0.932 -1.822 5.409 1.00 0.00 H new ATOM 0 HB2 ALA A 370 0.724 -2.908 6.804 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.595 -2.709 5.626 1.00 0.00 H new ATOM 126 N LYS A 371 -2.282 -0.173 5.810 1.00 0.00 N ATOM 127 CA LYS A 371 -3.012 0.769 4.965 1.00 0.00 C ATOM 128 C LYS A 371 -3.311 2.055 5.726 1.00 0.00 C ATOM 129 O LYS A 371 -3.436 3.124 5.130 1.00 0.00 O ATOM 130 CB LYS A 371 -4.316 0.151 4.457 1.00 0.00 C ATOM 131 CG LYS A 371 -4.545 0.357 2.969 1.00 0.00 C ATOM 132 CD LYS A 371 -5.588 -0.607 2.423 1.00 0.00 C ATOM 133 CE LYS A 371 -6.887 0.108 2.087 1.00 0.00 C ATOM 134 NZ LYS A 371 -7.572 -0.506 0.915 1.00 0.00 N ATOM 0 H LYS A 371 -2.845 -0.940 6.178 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.381 1.004 4.108 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -4.310 -0.918 4.671 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -5.152 0.582 5.008 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -4.867 1.383 2.789 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -3.606 0.219 2.433 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -5.200 -1.097 1.530 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -5.781 -1.389 3.157 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -7.551 0.080 2.951 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -6.680 1.158 1.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -8.453 0.010 0.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -6.949 -0.457 0.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -7.793 -1.501 1.124 1.00 0.00 H new ATOM 148 N ARG A 372 -3.414 1.945 7.046 1.00 0.00 N ATOM 149 CA ARG A 372 -3.688 3.103 7.884 1.00 0.00 C ATOM 150 C ARG A 372 -2.412 3.904 8.103 1.00 0.00 C ATOM 151 O ARG A 372 -2.445 5.128 8.231 1.00 0.00 O ATOM 152 CB ARG A 372 -4.280 2.663 9.227 1.00 0.00 C ATOM 153 CG ARG A 372 -3.271 2.018 10.163 1.00 0.00 C ATOM 154 CD ARG A 372 -2.674 3.036 11.120 1.00 0.00 C ATOM 155 NE ARG A 372 -2.095 2.402 12.303 1.00 0.00 N ATOM 156 CZ ARG A 372 -1.686 3.073 13.377 1.00 0.00 C ATOM 157 NH1 ARG A 372 -1.787 4.396 13.420 1.00 0.00 N ATOM 158 NH2 ARG A 372 -1.175 2.420 14.411 1.00 0.00 N ATOM 0 H ARG A 372 -3.312 1.068 7.556 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.416 3.737 7.378 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -4.717 3.530 9.722 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -5.091 1.959 9.042 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -3.755 1.223 10.730 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -2.476 1.554 9.580 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -1.905 3.611 10.604 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -3.447 3.741 11.428 1.00 0.00 H new ATOM 0 HE ARG A 372 -1.999 1.387 12.305 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -2.180 4.904 12.627 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -1.472 4.905 14.246 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -1.095 1.403 14.383 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -0.861 2.934 15.234 1.00 0.00 H new ATOM 170 N GLN A 373 -1.287 3.199 8.132 1.00 0.00 N ATOM 171 CA GLN A 373 0.007 3.832 8.324 1.00 0.00 C ATOM 172 C GLN A 373 0.398 4.627 7.086 1.00 0.00 C ATOM 173 O GLN A 373 0.880 5.754 7.186 1.00 0.00 O ATOM 174 CB GLN A 373 1.075 2.778 8.626 1.00 0.00 C ATOM 175 CG GLN A 373 1.587 2.834 10.053 1.00 0.00 C ATOM 176 CD GLN A 373 2.730 3.816 10.226 1.00 0.00 C ATOM 177 OE1 GLN A 373 3.770 3.663 9.416 1.00 0.00 O flip ATOM 178 NE2 GLN A 373 2.677 4.704 11.078 1.00 0.00 N flip ATOM 0 H GLN A 373 -1.248 2.185 8.024 1.00 0.00 H new ATOM 0 HA GLN A 373 -0.066 4.514 9.171 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.663 1.788 8.434 1.00 0.00 H new ATOM 0 HB3 GLN A 373 1.912 2.913 7.941 1.00 0.00 H new ATOM 0 HG2 GLN A 373 0.769 3.114 10.717 1.00 0.00 H new ATOM 0 HG3 GLN A 373 1.918 1.840 10.355 1.00 0.00 H new ATOM 0 HE21 GLN A 373 1.857 4.785 11.680 1.00 0.00 H new ATOM 0 HE22 GLN A 373 3.453 5.358 11.182 1.00 0.00 H new ATOM 187 N LEU A 374 0.185 4.030 5.920 1.00 0.00 N ATOM 188 CA LEU A 374 0.513 4.677 4.659 1.00 0.00 C ATOM 189 C LEU A 374 -0.390 5.880 4.413 1.00 0.00 C ATOM 190 O LEU A 374 0.061 6.923 3.941 1.00 0.00 O ATOM 191 CB LEU A 374 0.384 3.677 3.509 1.00 0.00 C ATOM 192 CG LEU A 374 1.320 3.920 2.325 1.00 0.00 C ATOM 193 CD1 LEU A 374 2.773 3.921 2.779 1.00 0.00 C ATOM 194 CD2 LEU A 374 1.093 2.869 1.248 1.00 0.00 C ATOM 0 H LEU A 374 -0.214 3.097 5.823 1.00 0.00 H new ATOM 0 HA LEU A 374 1.543 5.030 4.712 1.00 0.00 H new ATOM 0 HB2 LEU A 374 0.569 2.675 3.898 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.644 3.694 3.148 1.00 0.00 H new ATOM 0 HG LEU A 374 1.097 4.900 1.903 1.00 0.00 H new ATOM 0 HD11 LEU A 374 3.422 4.096 1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 374 2.924 4.711 3.515 1.00 0.00 H new ATOM 0 HD13 LEU A 374 3.015 2.957 3.227 1.00 0.00 H new ATOM 0 HD21 LEU A 374 1.766 3.054 0.411 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.289 1.879 1.659 1.00 0.00 H new ATOM 0 HD23 LEU A 374 0.061 2.920 0.902 1.00 0.00 H new ATOM 206 N TYR A 375 -1.668 5.728 4.734 1.00 0.00 N ATOM 207 CA TYR A 375 -2.634 6.801 4.544 1.00 0.00 C ATOM 208 C TYR A 375 -2.427 7.915 5.564 1.00 0.00 C ATOM 209 O TYR A 375 -2.701 9.082 5.286 1.00 0.00 O ATOM 210 CB TYR A 375 -4.057 6.255 4.655 1.00 0.00 C ATOM 211 CG TYR A 375 -5.022 6.872 3.670 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.328 8.225 3.724 1.00 0.00 C ATOM 213 CD2 TYR A 375 -5.626 6.100 2.688 1.00 0.00 C ATOM 214 CE1 TYR A 375 -6.210 8.791 2.824 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.509 6.658 1.784 1.00 0.00 C ATOM 216 CZ TYR A 375 -6.798 8.004 1.857 1.00 0.00 C ATOM 217 OH TYR A 375 -7.677 8.565 0.959 1.00 0.00 O ATOM 0 H TYR A 375 -2.059 4.872 5.127 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.483 7.216 3.548 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -4.036 5.176 4.502 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.425 6.426 5.667 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.870 8.844 4.481 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.402 5.045 2.629 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -6.438 9.845 2.878 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -6.970 6.044 1.025 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.001 7.875 0.343 1.00 0.00 H new ATOM 227 N SER A 376 -1.945 7.548 6.745 1.00 0.00 N ATOM 228 CA SER A 376 -1.707 8.519 7.805 1.00 0.00 C ATOM 229 C SER A 376 -0.338 9.181 7.658 1.00 0.00 C ATOM 230 O SER A 376 -0.064 10.196 8.296 1.00 0.00 O ATOM 231 CB SER A 376 -1.814 7.843 9.173 1.00 0.00 C ATOM 232 OG SER A 376 -2.001 8.800 10.202 1.00 0.00 O ATOM 0 H SER A 376 -1.712 6.586 6.992 1.00 0.00 H new ATOM 0 HA SER A 376 -2.469 9.295 7.724 1.00 0.00 H new ATOM 0 HB2 SER A 376 -2.647 7.140 9.170 1.00 0.00 H new ATOM 0 HB3 SER A 376 -0.910 7.266 9.369 1.00 0.00 H new ATOM 0 HG SER A 376 -1.521 9.623 9.974 1.00 0.00 H new ATOM 238 N LEU A 377 0.523 8.600 6.825 1.00 0.00 N ATOM 239 CA LEU A 377 1.859 9.145 6.620 1.00 0.00 C ATOM 240 C LEU A 377 1.991 9.854 5.275 1.00 0.00 C ATOM 241 O LEU A 377 2.795 10.776 5.135 1.00 0.00 O ATOM 242 CB LEU A 377 2.911 8.037 6.728 1.00 0.00 C ATOM 243 CG LEU A 377 3.622 7.953 8.079 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.631 7.628 9.186 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.734 6.916 8.034 1.00 0.00 C ATOM 0 H LEU A 377 0.320 7.758 6.286 1.00 0.00 H new ATOM 0 HA LEU A 377 2.027 9.884 7.403 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.431 7.079 6.527 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.659 8.189 5.949 1.00 0.00 H new ATOM 0 HG LEU A 377 4.068 8.924 8.293 1.00 0.00 H new ATOM 0 HD11 LEU A 377 3.156 7.572 10.140 1.00 0.00 H new ATOM 0 HD12 LEU A 377 1.871 8.408 9.235 1.00 0.00 H new ATOM 0 HD13 LEU A 377 2.154 6.670 8.978 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.229 6.870 9.004 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.312 5.940 7.796 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.460 7.194 7.270 1.00 0.00 H new ATOM 257 N ILE A 378 1.221 9.423 4.277 1.00 0.00 N ATOM 258 CA ILE A 378 1.302 10.039 2.958 1.00 0.00 C ATOM 259 C ILE A 378 -0.072 10.370 2.377 1.00 0.00 C ATOM 260 O ILE A 378 -0.205 11.295 1.575 1.00 0.00 O ATOM 261 CB ILE A 378 2.082 9.148 1.968 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.325 7.850 1.681 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.465 8.837 2.519 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.645 7.258 0.327 1.00 0.00 C ATOM 0 H ILE A 378 0.546 8.663 4.355 1.00 0.00 H new ATOM 0 HA ILE A 378 1.840 10.977 3.098 1.00 0.00 H new ATOM 0 HB ILE A 378 2.186 9.694 1.031 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.563 7.120 2.455 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.254 8.041 1.742 1.00 0.00 H new ATOM 0 HG21 ILE A 378 4.005 8.208 1.812 1.00 0.00 H new ATOM 0 HG22 ILE A 378 4.014 9.767 2.671 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.368 8.313 3.470 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.075 6.340 0.188 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.381 7.971 -0.454 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.711 7.036 0.270 1.00 0.00 H new ATOM 276 N GLY A 379 -1.092 9.616 2.775 1.00 0.00 N ATOM 277 CA GLY A 379 -2.430 9.864 2.268 1.00 0.00 C ATOM 278 C GLY A 379 -3.019 11.163 2.786 1.00 0.00 C ATOM 279 O GLY A 379 -3.421 11.252 3.945 1.00 0.00 O ATOM 0 H GLY A 379 -1.017 8.842 3.435 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.403 9.891 1.179 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.081 9.036 2.550 1.00 0.00 H new ATOM 283 N TYR A 380 -3.075 12.175 1.921 1.00 0.00 N ATOM 284 CA TYR A 380 -3.622 13.474 2.294 1.00 0.00 C ATOM 285 C TYR A 380 -4.855 13.805 1.459 1.00 0.00 C ATOM 286 O TYR A 380 -4.953 14.884 0.874 1.00 0.00 O ATOM 287 CB TYR A 380 -2.569 14.575 2.133 1.00 0.00 C ATOM 288 CG TYR A 380 -1.657 14.389 0.939 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.174 14.294 -0.346 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.279 14.314 1.099 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.343 14.129 -1.439 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.558 14.149 0.014 1.00 0.00 C ATOM 293 CZ TYR A 380 0.022 14.057 -1.253 1.00 0.00 C ATOM 294 OH TYR A 380 0.852 13.894 -2.338 1.00 0.00 O ATOM 0 H TYR A 380 -2.747 12.118 0.957 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.915 13.422 3.342 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.075 15.536 2.044 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -1.962 14.617 3.037 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.242 14.350 -0.494 1.00 0.00 H new ATOM 0 HD2 TYR A 380 0.145 14.386 2.090 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -1.760 14.057 -2.433 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.627 14.092 0.157 1.00 0.00 H new ATOM 0 HH TYR A 380 1.583 13.285 -2.102 1.00 0.00 H new ATOM 304 N ALA A 381 -5.793 12.863 1.407 1.00 0.00 N ATOM 305 CA ALA A 381 -7.030 13.038 0.646 1.00 0.00 C ATOM 306 C ALA A 381 -6.789 12.825 -0.844 1.00 0.00 C ATOM 307 O ALA A 381 -7.212 11.817 -1.411 1.00 0.00 O ATOM 308 CB ALA A 381 -7.630 14.417 0.896 1.00 0.00 C ATOM 0 H ALA A 381 -5.720 11.965 1.885 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.741 12.286 0.988 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -8.549 14.524 0.320 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -7.852 14.530 1.957 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -6.919 15.184 0.590 1.00 0.00 H new ATOM 314 N SER A 382 -6.102 13.773 -1.474 1.00 0.00 N ATOM 315 CA SER A 382 -5.801 13.678 -2.900 1.00 0.00 C ATOM 316 C SER A 382 -5.130 12.345 -3.220 1.00 0.00 C ATOM 317 O SER A 382 -5.222 11.843 -4.339 1.00 0.00 O ATOM 318 CB SER A 382 -4.898 14.836 -3.330 1.00 0.00 C ATOM 319 OG SER A 382 -5.663 15.957 -3.735 1.00 0.00 O ATOM 0 H SER A 382 -5.744 14.614 -1.022 1.00 0.00 H new ATOM 0 HA SER A 382 -6.739 13.737 -3.453 1.00 0.00 H new ATOM 0 HB2 SER A 382 -4.244 15.117 -2.504 1.00 0.00 H new ATOM 0 HB3 SER A 382 -4.256 14.515 -4.150 1.00 0.00 H new ATOM 0 HG SER A 382 -5.062 16.683 -4.003 1.00 0.00 H new ATOM 325 N LEU A 383 -4.457 11.779 -2.222 1.00 0.00 N ATOM 326 CA LEU A 383 -3.772 10.504 -2.381 1.00 0.00 C ATOM 327 C LEU A 383 -4.734 9.345 -2.139 1.00 0.00 C ATOM 328 O LEU A 383 -4.776 8.778 -1.048 1.00 0.00 O ATOM 329 CB LEU A 383 -2.590 10.422 -1.404 1.00 0.00 C ATOM 330 CG LEU A 383 -1.181 10.485 -2.018 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.540 9.106 -2.018 1.00 0.00 C ATOM 332 CD2 LEU A 383 -1.207 11.064 -3.429 1.00 0.00 C ATOM 0 H LEU A 383 -4.373 12.187 -1.291 1.00 0.00 H new ATOM 0 HA LEU A 383 -3.398 10.433 -3.402 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -2.685 11.236 -0.686 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.676 9.491 -0.843 1.00 0.00 H new ATOM 0 HG LEU A 383 -0.580 11.152 -1.400 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.456 9.168 -2.456 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.464 8.740 -0.994 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -1.152 8.420 -2.604 1.00 0.00 H new ATOM 0 HD21 LEU A 383 -0.194 11.092 -3.829 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -1.832 10.439 -4.067 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -1.614 12.075 -3.400 1.00 0.00 H new ATOM 344 N ARG A 384 -5.508 9.001 -3.164 1.00 0.00 N ATOM 345 CA ARG A 384 -6.470 7.910 -3.061 1.00 0.00 C ATOM 346 C ARG A 384 -5.756 6.568 -2.940 1.00 0.00 C ATOM 347 O ARG A 384 -5.773 5.757 -3.866 1.00 0.00 O ATOM 348 CB ARG A 384 -7.399 7.904 -4.278 1.00 0.00 C ATOM 349 CG ARG A 384 -8.724 8.607 -4.036 1.00 0.00 C ATOM 350 CD ARG A 384 -8.689 10.048 -4.520 1.00 0.00 C ATOM 351 NE ARG A 384 -9.188 10.977 -3.510 1.00 0.00 N ATOM 352 CZ ARG A 384 -9.197 12.300 -3.659 1.00 0.00 C ATOM 353 NH1 ARG A 384 -8.737 12.852 -4.774 1.00 0.00 N ATOM 354 NH2 ARG A 384 -9.668 13.072 -2.690 1.00 0.00 N ATOM 0 H ARG A 384 -5.488 9.462 -4.074 1.00 0.00 H new ATOM 0 HA ARG A 384 -7.066 8.065 -2.162 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -6.891 8.383 -5.115 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -7.593 6.872 -4.571 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -9.521 8.069 -4.549 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -8.959 8.585 -2.972 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -7.667 10.316 -4.786 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -9.288 10.141 -5.426 1.00 0.00 H new ATOM 0 HE ARG A 384 -9.551 10.590 -2.639 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -8.374 12.262 -5.523 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -8.746 13.866 -4.883 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -10.023 12.652 -1.831 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -9.675 14.086 -2.803 1.00 0.00 H new ATOM 366 N LEU A 385 -5.126 6.341 -1.791 1.00 0.00 N ATOM 367 CA LEU A 385 -4.403 5.100 -1.546 1.00 0.00 C ATOM 368 C LEU A 385 -5.322 3.892 -1.699 1.00 0.00 C ATOM 369 O LEU A 385 -6.120 3.589 -0.812 1.00 0.00 O ATOM 370 CB LEU A 385 -3.782 5.113 -0.147 1.00 0.00 C ATOM 371 CG LEU A 385 -3.085 3.813 0.263 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.823 4.113 1.053 1.00 0.00 C ATOM 373 CD2 LEU A 385 -4.028 2.933 1.070 1.00 0.00 C ATOM 0 H LEU A 385 -5.102 7.002 -1.015 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.608 5.021 -2.287 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -3.060 5.927 -0.094 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.564 5.333 0.579 1.00 0.00 H new ATOM 0 HG LEU A 385 -2.803 3.272 -0.641 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.340 3.178 1.336 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.141 4.702 0.440 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -2.081 4.675 1.951 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.515 2.014 1.353 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -4.342 3.464 1.969 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -4.903 2.690 0.468 1.00 0.00 H new ATOM 385 N HIS A 386 -5.202 3.204 -2.830 1.00 0.00 N ATOM 386 CA HIS A 386 -6.015 2.026 -3.101 1.00 0.00 C ATOM 387 C HIS A 386 -5.138 0.863 -3.550 1.00 0.00 C ATOM 388 O HIS A 386 -4.144 1.058 -4.249 1.00 0.00 O ATOM 389 CB HIS A 386 -7.063 2.336 -4.171 1.00 0.00 C ATOM 390 CG HIS A 386 -6.482 2.875 -5.441 1.00 0.00 C ATOM 391 ND1 HIS A 386 -6.546 4.207 -5.791 1.00 0.00 N ATOM 392 CD2 HIS A 386 -5.821 2.255 -6.447 1.00 0.00 C ATOM 393 CE1 HIS A 386 -5.952 4.382 -6.958 1.00 0.00 C ATOM 394 NE2 HIS A 386 -5.503 3.214 -7.376 1.00 0.00 N ATOM 0 H HIS A 386 -4.547 3.444 -3.575 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.526 1.743 -2.180 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.622 1.427 -4.394 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -7.775 3.058 -3.772 1.00 0.00 H new ATOM 0 HD1 HIS A 386 -6.984 4.942 -5.236 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -5.588 1.202 -6.507 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -5.851 5.322 -7.481 1.00 0.00 H new ATOM 403 N TYR A 387 -5.504 -0.345 -3.137 1.00 0.00 N ATOM 404 CA TYR A 387 -4.741 -1.531 -3.492 1.00 0.00 C ATOM 405 C TYR A 387 -5.445 -2.344 -4.569 1.00 0.00 C ATOM 406 O TYR A 387 -6.623 -2.681 -4.444 1.00 0.00 O ATOM 407 CB TYR A 387 -4.496 -2.394 -2.256 1.00 0.00 C ATOM 408 CG TYR A 387 -3.421 -1.840 -1.354 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.547 -0.574 -0.797 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.277 -2.572 -1.066 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.564 -0.054 0.021 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.291 -2.061 -0.247 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.439 -0.800 0.292 1.00 0.00 C ATOM 414 OH TYR A 387 -0.458 -0.284 1.107 1.00 0.00 O ATOM 0 H TYR A 387 -6.323 -0.527 -2.557 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.782 -1.202 -3.893 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.425 -2.484 -1.693 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.216 -3.399 -2.571 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.429 0.013 -1.007 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.157 -3.558 -1.490 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.677 0.932 0.446 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.409 -2.645 -0.029 1.00 0.00 H new ATOM 0 HH TYR A 387 -0.870 0.251 1.817 1.00 0.00 H new ATOM 424 N VAL A 388 -4.709 -2.656 -5.630 1.00 0.00 N ATOM 425 CA VAL A 388 -5.247 -3.428 -6.736 1.00 0.00 C ATOM 426 C VAL A 388 -4.560 -4.787 -6.831 1.00 0.00 C ATOM 427 O VAL A 388 -3.398 -4.880 -7.226 1.00 0.00 O ATOM 428 CB VAL A 388 -5.077 -2.680 -8.071 1.00 0.00 C ATOM 429 CG1 VAL A 388 -5.714 -3.457 -9.215 1.00 0.00 C ATOM 430 CG2 VAL A 388 -5.667 -1.281 -7.974 1.00 0.00 C ATOM 0 H VAL A 388 -3.733 -2.383 -5.744 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.310 -3.573 -6.545 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.011 -2.591 -8.280 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -5.580 -2.908 -10.147 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.240 -4.435 -9.299 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -6.779 -3.586 -9.019 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -5.539 -0.765 -8.926 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -6.729 -1.350 -7.739 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.156 -0.724 -7.188 1.00 0.00 H new ATOM 440 N THR A 389 -5.284 -5.836 -6.459 1.00 0.00 N ATOM 441 CA THR A 389 -4.742 -7.188 -6.495 1.00 0.00 C ATOM 442 C THR A 389 -4.831 -7.778 -7.899 1.00 0.00 C ATOM 443 O THR A 389 -5.910 -8.156 -8.356 1.00 0.00 O ATOM 444 CB THR A 389 -5.486 -8.085 -5.504 1.00 0.00 C ATOM 445 OG1 THR A 389 -6.779 -8.403 -5.990 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.650 -7.460 -4.136 1.00 0.00 C ATOM 0 H THR A 389 -6.247 -5.776 -6.129 1.00 0.00 H new ATOM 0 HA THR A 389 -3.691 -7.136 -6.211 1.00 0.00 H new ATOM 0 HB THR A 389 -4.870 -8.979 -5.404 1.00 0.00 H new ATOM 0 HG1 THR A 389 -6.837 -8.174 -6.941 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.186 -8.149 -3.483 1.00 0.00 H new ATOM 0 HG22 THR A 389 -4.668 -7.248 -3.713 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.215 -6.532 -4.225 1.00 0.00 H new ATOM 454 N VAL A 390 -3.688 -7.863 -8.573 1.00 0.00 N ATOM 455 CA VAL A 390 -3.634 -8.417 -9.921 1.00 0.00 C ATOM 456 C VAL A 390 -3.471 -9.935 -9.886 1.00 0.00 C ATOM 457 O VAL A 390 -3.437 -10.589 -10.929 1.00 0.00 O ATOM 458 CB VAL A 390 -2.476 -7.807 -10.731 1.00 0.00 C ATOM 459 CG1 VAL A 390 -2.528 -8.275 -12.178 1.00 0.00 C ATOM 460 CG2 VAL A 390 -2.508 -6.288 -10.654 1.00 0.00 C ATOM 0 H VAL A 390 -2.787 -7.555 -8.207 1.00 0.00 H new ATOM 0 HA VAL A 390 -4.578 -8.167 -10.405 1.00 0.00 H new ATOM 0 HB VAL A 390 -1.537 -8.150 -10.296 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -1.701 -7.833 -12.733 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -2.448 -9.362 -12.212 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -3.472 -7.967 -12.626 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -1.681 -5.877 -11.233 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -3.452 -5.923 -11.059 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.414 -5.974 -9.614 1.00 0.00 H new ATOM 470 N LYS A 391 -3.362 -10.488 -8.679 1.00 0.00 N ATOM 471 CA LYS A 391 -3.196 -11.924 -8.495 1.00 0.00 C ATOM 472 C LYS A 391 -4.185 -12.723 -9.340 1.00 0.00 C ATOM 473 O LYS A 391 -5.086 -12.162 -9.965 1.00 0.00 O ATOM 474 CB LYS A 391 -3.378 -12.283 -7.021 1.00 0.00 C ATOM 475 CG LYS A 391 -4.778 -12.007 -6.497 1.00 0.00 C ATOM 476 CD LYS A 391 -5.269 -13.128 -5.594 1.00 0.00 C ATOM 477 CE LYS A 391 -6.548 -12.739 -4.871 1.00 0.00 C ATOM 478 NZ LYS A 391 -7.033 -13.825 -3.974 1.00 0.00 N ATOM 0 H LYS A 391 -3.386 -9.956 -7.809 1.00 0.00 H new ATOM 0 HA LYS A 391 -2.189 -12.184 -8.821 1.00 0.00 H new ATOM 0 HB2 LYS A 391 -3.148 -13.339 -6.882 1.00 0.00 H new ATOM 0 HB3 LYS A 391 -2.659 -11.719 -6.427 1.00 0.00 H new ATOM 0 HG2 LYS A 391 -4.782 -11.067 -5.946 1.00 0.00 H new ATOM 0 HG3 LYS A 391 -5.464 -11.888 -7.336 1.00 0.00 H new ATOM 0 HD2 LYS A 391 -5.444 -14.025 -6.188 1.00 0.00 H new ATOM 0 HD3 LYS A 391 -4.497 -13.374 -4.864 1.00 0.00 H new ATOM 0 HE2 LYS A 391 -6.374 -11.836 -4.286 1.00 0.00 H new ATOM 0 HE3 LYS A 391 -7.320 -12.501 -5.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 -7.907 -13.519 -3.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 -7.224 -14.679 -4.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 -6.307 -14.035 -3.260 1.00 0.00 H new ATOM 492 N LYS A 392 -4.004 -14.038 -9.345 1.00 0.00 N ATOM 493 CA LYS A 392 -4.867 -14.937 -10.100 1.00 0.00 C ATOM 494 C LYS A 392 -4.405 -16.382 -9.924 1.00 0.00 C ATOM 495 O LYS A 392 -3.832 -16.976 -10.837 1.00 0.00 O ATOM 496 CB LYS A 392 -4.867 -14.561 -11.584 1.00 0.00 C ATOM 497 CG LYS A 392 -6.202 -14.802 -12.271 1.00 0.00 C ATOM 498 CD LYS A 392 -7.087 -13.567 -12.217 1.00 0.00 C ATOM 499 CE LYS A 392 -7.779 -13.436 -10.869 1.00 0.00 C ATOM 500 NZ LYS A 392 -8.555 -14.659 -10.522 1.00 0.00 N ATOM 0 H LYS A 392 -3.260 -14.508 -8.830 1.00 0.00 H new ATOM 0 HA LYS A 392 -5.884 -14.842 -9.718 1.00 0.00 H new ATOM 0 HB2 LYS A 392 -4.601 -13.509 -11.684 1.00 0.00 H new ATOM 0 HB3 LYS A 392 -4.095 -15.135 -12.096 1.00 0.00 H new ATOM 0 HG2 LYS A 392 -6.032 -15.084 -13.310 1.00 0.00 H new ATOM 0 HG3 LYS A 392 -6.713 -15.638 -11.793 1.00 0.00 H new ATOM 0 HD2 LYS A 392 -6.485 -12.678 -12.406 1.00 0.00 H new ATOM 0 HD3 LYS A 392 -7.835 -13.619 -13.008 1.00 0.00 H new ATOM 0 HE2 LYS A 392 -7.035 -13.247 -10.096 1.00 0.00 H new ATOM 0 HE3 LYS A 392 -8.447 -12.575 -10.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 -9.439 -14.386 -10.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 -8.776 -15.188 -11.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 -7.992 -15.259 -9.886 1.00 0.00 H new ATOM 514 N PRO A 393 -4.642 -16.964 -8.736 1.00 0.00 N ATOM 515 CA PRO A 393 -4.242 -18.341 -8.438 1.00 0.00 C ATOM 516 C PRO A 393 -4.883 -19.349 -9.384 1.00 0.00 C ATOM 517 O PRO A 393 -6.097 -19.552 -9.367 1.00 0.00 O ATOM 518 CB PRO A 393 -4.729 -18.565 -7.002 1.00 0.00 C ATOM 519 CG PRO A 393 -5.747 -17.503 -6.764 1.00 0.00 C ATOM 520 CD PRO A 393 -5.313 -16.327 -7.591 1.00 0.00 C ATOM 0 HA PRO A 393 -3.168 -18.482 -8.558 1.00 0.00 H new ATOM 0 HB2 PRO A 393 -5.161 -19.559 -6.883 1.00 0.00 H new ATOM 0 HB3 PRO A 393 -3.906 -18.488 -6.291 1.00 0.00 H new ATOM 0 HG2 PRO A 393 -6.741 -17.841 -7.057 1.00 0.00 H new ATOM 0 HG3 PRO A 393 -5.798 -17.240 -5.707 1.00 0.00 H new ATOM 0 HD2 PRO A 393 -6.161 -15.719 -7.906 1.00 0.00 H new ATOM 0 HD3 PRO A 393 -4.638 -15.672 -7.040 1.00 0.00 H new ATOM 528 N THR A 394 -4.051 -19.975 -10.207 1.00 0.00 N ATOM 529 CA THR A 394 -4.511 -20.969 -11.174 1.00 0.00 C ATOM 530 C THR A 394 -3.373 -21.377 -12.100 1.00 0.00 C ATOM 531 O THR A 394 -3.225 -22.549 -12.446 1.00 0.00 O ATOM 532 CB THR A 394 -5.674 -20.417 -12.004 1.00 0.00 C ATOM 533 OG1 THR A 394 -5.988 -21.295 -13.071 1.00 0.00 O ATOM 534 CG2 THR A 394 -5.390 -19.056 -12.600 1.00 0.00 C ATOM 0 H THR A 394 -3.044 -19.811 -10.225 1.00 0.00 H new ATOM 0 HA THR A 394 -4.854 -21.844 -10.621 1.00 0.00 H new ATOM 0 HB THR A 394 -6.508 -20.325 -11.308 1.00 0.00 H new ATOM 0 HG1 THR A 394 -6.734 -20.927 -13.589 1.00 0.00 H new ATOM 0 HG21 THR A 394 -6.254 -18.723 -13.175 1.00 0.00 H new ATOM 0 HG22 THR A 394 -5.190 -18.343 -11.800 1.00 0.00 H new ATOM 0 HG23 THR A 394 -4.521 -19.120 -13.255 1.00 0.00 H new ATOM 542 N ALA A 395 -2.570 -20.395 -12.498 1.00 0.00 N ATOM 543 CA ALA A 395 -1.438 -20.631 -13.387 1.00 0.00 C ATOM 544 C ALA A 395 -0.798 -19.314 -13.810 1.00 0.00 C ATOM 545 O ALA A 395 0.415 -19.234 -14.006 1.00 0.00 O ATOM 546 CB ALA A 395 -1.877 -21.421 -14.614 1.00 0.00 C ATOM 0 H ALA A 395 -2.684 -19.421 -12.216 1.00 0.00 H new ATOM 0 HA ALA A 395 -0.696 -21.215 -12.842 1.00 0.00 H new ATOM 0 HB1 ALA A 395 -1.019 -21.587 -15.266 1.00 0.00 H new ATOM 0 HB2 ALA A 395 -2.287 -22.381 -14.301 1.00 0.00 H new ATOM 0 HB3 ALA A 395 -2.640 -20.860 -15.154 1.00 0.00 H new ATOM 552 N VAL A 396 -1.623 -18.280 -13.950 1.00 0.00 N ATOM 553 CA VAL A 396 -1.141 -16.964 -14.350 1.00 0.00 C ATOM 554 C VAL A 396 -0.439 -16.260 -13.194 1.00 0.00 C ATOM 555 O VAL A 396 0.547 -15.550 -13.393 1.00 0.00 O ATOM 556 CB VAL A 396 -2.291 -16.074 -14.853 1.00 0.00 C ATOM 557 CG1 VAL A 396 -1.746 -14.789 -15.459 1.00 0.00 C ATOM 558 CG2 VAL A 396 -3.148 -16.826 -15.860 1.00 0.00 C ATOM 0 H VAL A 396 -2.629 -18.330 -13.792 1.00 0.00 H new ATOM 0 HA VAL A 396 -0.431 -17.122 -15.162 1.00 0.00 H new ATOM 0 HB VAL A 396 -2.920 -15.809 -14.003 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -2.574 -14.172 -15.809 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -1.180 -14.242 -14.705 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -1.093 -15.031 -16.298 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -3.956 -16.180 -16.204 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -2.534 -17.123 -16.710 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -3.569 -17.714 -15.388 1.00 0.00 H new ATOM 568 N ASP A 397 -0.954 -16.462 -11.987 1.00 0.00 N ATOM 569 CA ASP A 397 -0.377 -15.848 -10.796 1.00 0.00 C ATOM 570 C ASP A 397 -0.546 -16.758 -9.581 1.00 0.00 C ATOM 571 O ASP A 397 -1.485 -16.599 -8.800 1.00 0.00 O ATOM 572 CB ASP A 397 -1.027 -14.489 -10.530 1.00 0.00 C ATOM 573 CG ASP A 397 -0.052 -13.340 -10.693 1.00 0.00 C ATOM 574 OD1 ASP A 397 0.621 -12.988 -9.701 1.00 0.00 O ATOM 575 OD2 ASP A 397 0.040 -12.792 -11.811 1.00 0.00 O ATOM 0 H ASP A 397 -1.770 -17.046 -11.807 1.00 0.00 H new ATOM 0 HA ASP A 397 0.689 -15.701 -10.971 1.00 0.00 H new ATOM 0 HB2 ASP A 397 -1.865 -14.350 -11.213 1.00 0.00 H new ATOM 0 HB3 ASP A 397 -1.434 -14.476 -9.519 1.00 0.00 H new ATOM 580 N PRO A 398 0.365 -17.731 -9.407 1.00 0.00 N ATOM 581 CA PRO A 398 0.313 -18.671 -8.282 1.00 0.00 C ATOM 582 C PRO A 398 0.289 -17.968 -6.929 1.00 0.00 C ATOM 583 O PRO A 398 -0.145 -18.544 -5.930 1.00 0.00 O ATOM 584 CB PRO A 398 1.601 -19.486 -8.435 1.00 0.00 C ATOM 585 CG PRO A 398 1.970 -19.359 -9.872 1.00 0.00 C ATOM 586 CD PRO A 398 1.514 -17.992 -10.294 1.00 0.00 C ATOM 0 HA PRO A 398 -0.596 -19.273 -8.304 1.00 0.00 H new ATOM 0 HB2 PRO A 398 2.390 -19.101 -7.789 1.00 0.00 H new ATOM 0 HB3 PRO A 398 1.443 -20.529 -8.159 1.00 0.00 H new ATOM 0 HG2 PRO A 398 3.045 -19.472 -10.011 1.00 0.00 H new ATOM 0 HG3 PRO A 398 1.488 -20.133 -10.469 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.300 -17.248 -10.165 1.00 0.00 H new ATOM 0 HD3 PRO A 398 1.225 -17.971 -11.345 1.00 0.00 H new ATOM 594 N ASN A 399 0.757 -16.724 -6.896 1.00 0.00 N ATOM 595 CA ASN A 399 0.789 -15.955 -5.660 1.00 0.00 C ATOM 596 C ASN A 399 -0.228 -14.820 -5.691 1.00 0.00 C ATOM 597 O ASN A 399 -0.824 -14.534 -6.731 1.00 0.00 O ATOM 598 CB ASN A 399 2.189 -15.385 -5.427 1.00 0.00 C ATOM 599 CG ASN A 399 2.617 -14.439 -6.534 1.00 0.00 C ATOM 600 OD1 ASN A 399 1.799 -13.717 -7.103 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.907 -14.438 -6.845 1.00 0.00 N ATOM 0 H ASN A 399 1.119 -16.229 -7.711 1.00 0.00 H new ATOM 0 HA ASN A 399 0.531 -16.627 -4.842 1.00 0.00 H new ATOM 0 HB2 ASN A 399 2.210 -14.858 -4.473 1.00 0.00 H new ATOM 0 HB3 ASN A 399 2.905 -16.204 -5.355 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.254 -13.823 -7.581 1.00 0.00 H new ATOM 0 HD22 ASN A 399 4.552 -15.053 -6.348 1.00 0.00 H new ATOM 608 N SER A 400 -0.412 -14.167 -4.549 1.00 0.00 N ATOM 609 CA SER A 400 -1.345 -13.054 -4.448 1.00 0.00 C ATOM 610 C SER A 400 -0.610 -11.732 -4.642 1.00 0.00 C ATOM 611 O SER A 400 -0.200 -11.090 -3.676 1.00 0.00 O ATOM 612 CB SER A 400 -2.054 -13.073 -3.093 1.00 0.00 C ATOM 613 OG SER A 400 -2.291 -14.400 -2.660 1.00 0.00 O ATOM 0 H SER A 400 0.074 -14.390 -3.680 1.00 0.00 H new ATOM 0 HA SER A 400 -2.095 -13.156 -5.232 1.00 0.00 H new ATOM 0 HB2 SER A 400 -1.447 -12.549 -2.354 1.00 0.00 H new ATOM 0 HB3 SER A 400 -3.000 -12.537 -3.167 1.00 0.00 H new ATOM 0 HG SER A 400 -3.222 -14.644 -2.847 1.00 0.00 H new ATOM 619 N ILE A 401 -0.433 -11.342 -5.900 1.00 0.00 N ATOM 620 CA ILE A 401 0.269 -10.108 -6.227 1.00 0.00 C ATOM 621 C ILE A 401 -0.637 -8.886 -6.075 1.00 0.00 C ATOM 622 O ILE A 401 -1.753 -8.857 -6.595 1.00 0.00 O ATOM 623 CB ILE A 401 0.847 -10.167 -7.663 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.217 -9.494 -7.710 1.00 0.00 C ATOM 625 CG2 ILE A 401 -0.099 -9.530 -8.674 1.00 0.00 C ATOM 626 CD1 ILE A 401 2.205 -8.058 -7.231 1.00 0.00 C ATOM 0 H ILE A 401 -0.767 -11.864 -6.710 1.00 0.00 H new ATOM 0 HA ILE A 401 1.092 -10.007 -5.519 1.00 0.00 H new ATOM 0 HB ILE A 401 0.960 -11.216 -7.935 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.914 -10.066 -7.098 1.00 0.00 H new ATOM 0 HG13 ILE A 401 2.592 -9.524 -8.733 1.00 0.00 H new ATOM 0 HG21 ILE A 401 0.339 -9.590 -9.670 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -1.052 -10.059 -8.664 1.00 0.00 H new ATOM 0 HG23 ILE A 401 -0.262 -8.485 -8.411 1.00 0.00 H new ATOM 0 HD11 ILE A 401 3.212 -7.645 -7.293 1.00 0.00 H new ATOM 0 HD12 ILE A 401 1.533 -7.471 -7.857 1.00 0.00 H new ATOM 0 HD13 ILE A 401 1.861 -8.022 -6.197 1.00 0.00 H new ATOM 638 N VAL A 402 -0.142 -7.877 -5.364 1.00 0.00 N ATOM 639 CA VAL A 402 -0.896 -6.650 -5.148 1.00 0.00 C ATOM 640 C VAL A 402 -0.024 -5.426 -5.398 1.00 0.00 C ATOM 641 O VAL A 402 1.199 -5.485 -5.268 1.00 0.00 O ATOM 642 CB VAL A 402 -1.465 -6.582 -3.718 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.367 -5.368 -3.555 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.216 -7.860 -3.381 1.00 0.00 C ATOM 0 H VAL A 402 0.780 -7.887 -4.928 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.725 -6.656 -5.856 1.00 0.00 H new ATOM 0 HB VAL A 402 -0.632 -6.481 -3.022 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -2.758 -5.339 -2.538 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -1.795 -4.461 -3.750 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.195 -5.433 -4.261 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -2.611 -7.794 -2.367 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.039 -7.994 -4.083 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -1.537 -8.710 -3.451 1.00 0.00 H new ATOM 654 N GLU A 403 -0.659 -4.317 -5.761 1.00 0.00 N ATOM 655 CA GLU A 403 0.064 -3.082 -6.033 1.00 0.00 C ATOM 656 C GLU A 403 -0.705 -1.868 -5.521 1.00 0.00 C ATOM 657 O GLU A 403 -1.774 -1.536 -6.032 1.00 0.00 O ATOM 658 CB GLU A 403 0.322 -2.937 -7.534 1.00 0.00 C ATOM 659 CG GLU A 403 1.523 -3.727 -8.026 1.00 0.00 C ATOM 660 CD GLU A 403 1.776 -3.537 -9.508 1.00 0.00 C ATOM 661 OE1 GLU A 403 1.973 -2.379 -9.934 1.00 0.00 O ATOM 662 OE2 GLU A 403 1.777 -4.546 -10.244 1.00 0.00 O ATOM 0 H GLU A 403 -1.670 -4.249 -5.873 1.00 0.00 H new ATOM 0 HA GLU A 403 1.017 -3.131 -5.507 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.564 -3.262 -8.079 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.471 -1.883 -7.768 1.00 0.00 H new ATOM 0 HG2 GLU A 403 2.408 -3.422 -7.468 1.00 0.00 H new ATOM 0 HG3 GLU A 403 1.366 -4.786 -7.820 1.00 0.00 H new ATOM 669 N CYS A 404 -0.147 -1.207 -4.513 1.00 0.00 N ATOM 670 CA CYS A 404 -0.772 -0.025 -3.933 1.00 0.00 C ATOM 671 C CYS A 404 -0.643 1.164 -4.878 1.00 0.00 C ATOM 672 O CYS A 404 0.452 1.684 -5.087 1.00 0.00 O ATOM 673 CB CYS A 404 -0.129 0.307 -2.584 1.00 0.00 C ATOM 674 SG CYS A 404 -0.769 1.808 -1.803 1.00 0.00 S ATOM 0 H CYS A 404 0.738 -1.470 -4.080 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.830 -0.236 -3.778 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.280 -0.533 -1.906 1.00 0.00 H new ATOM 0 HB3 CYS A 404 0.947 0.415 -2.724 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.487 1.486 -0.768 1.00 0.00 H new ATOM 680 N ARG A 405 -1.766 1.592 -5.444 1.00 0.00 N ATOM 681 CA ARG A 405 -1.773 2.719 -6.362 1.00 0.00 C ATOM 682 C ARG A 405 -2.352 3.955 -5.693 1.00 0.00 C ATOM 683 O ARG A 405 -3.313 3.866 -4.927 1.00 0.00 O ATOM 684 CB ARG A 405 -2.575 2.382 -7.618 1.00 0.00 C ATOM 685 CG ARG A 405 -1.864 1.424 -8.558 1.00 0.00 C ATOM 686 CD ARG A 405 -2.853 0.586 -9.352 1.00 0.00 C ATOM 687 NE ARG A 405 -2.180 -0.372 -10.226 1.00 0.00 N ATOM 688 CZ ARG A 405 -1.531 -0.032 -11.338 1.00 0.00 C ATOM 689 NH1 ARG A 405 -1.465 1.240 -11.712 1.00 0.00 N ATOM 690 NH2 ARG A 405 -0.948 -0.966 -12.077 1.00 0.00 N ATOM 0 H ARG A 405 -2.682 1.174 -5.282 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.742 2.928 -6.648 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.529 1.946 -7.323 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.798 3.304 -8.154 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -1.231 1.988 -9.243 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -1.209 0.769 -7.984 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -3.509 0.051 -8.665 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -3.485 1.242 -9.951 1.00 0.00 H new ATOM 0 HE ARG A 405 -2.209 -1.359 -9.969 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -1.912 1.962 -11.147 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -0.967 1.496 -12.565 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -0.997 -1.945 -11.794 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -0.451 -0.706 -12.929 1.00 0.00 H new ATOM 702 N VAL A 406 -1.764 5.107 -5.983 1.00 0.00 N ATOM 703 CA VAL A 406 -2.224 6.360 -5.404 1.00 0.00 C ATOM 704 C VAL A 406 -3.159 7.098 -6.356 1.00 0.00 C ATOM 705 O VAL A 406 -3.232 6.779 -7.544 1.00 0.00 O ATOM 706 CB VAL A 406 -1.043 7.280 -5.038 1.00 0.00 C ATOM 707 CG1 VAL A 406 -0.161 6.622 -3.987 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.233 7.635 -6.279 1.00 0.00 C ATOM 0 H VAL A 406 -0.969 5.199 -6.615 1.00 0.00 H new ATOM 0 HA VAL A 406 -2.768 6.105 -4.494 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.443 8.203 -4.619 1.00 0.00 H new ATOM 0 HG11 VAL A 406 0.668 7.285 -3.740 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -0.748 6.426 -3.090 1.00 0.00 H new ATOM 0 HG13 VAL A 406 0.230 5.682 -4.377 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.596 8.285 -5.999 1.00 0.00 H new ATOM 0 HG22 VAL A 406 0.158 6.724 -6.732 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -0.872 8.151 -6.996 1.00 0.00 H new ATOM 718 N GLY A 407 -3.875 8.086 -5.827 1.00 0.00 N ATOM 719 CA GLY A 407 -4.797 8.852 -6.643 1.00 0.00 C ATOM 720 C GLY A 407 -4.088 9.697 -7.684 1.00 0.00 C ATOM 721 O GLY A 407 -3.993 10.915 -7.545 1.00 0.00 O ATOM 0 H GLY A 407 -3.832 8.369 -4.848 1.00 0.00 H new ATOM 0 HA2 GLY A 407 -5.488 8.172 -7.141 1.00 0.00 H new ATOM 0 HA3 GLY A 407 -5.395 9.499 -6.001 1.00 0.00 H new ATOM 725 N ASP A 408 -3.589 9.045 -8.731 1.00 0.00 N ATOM 726 CA ASP A 408 -2.884 9.743 -9.801 1.00 0.00 C ATOM 727 C ASP A 408 -2.464 8.769 -10.898 1.00 0.00 C ATOM 728 O ASP A 408 -2.552 9.081 -12.086 1.00 0.00 O ATOM 729 CB ASP A 408 -1.657 10.467 -9.244 1.00 0.00 C ATOM 730 CG ASP A 408 -1.846 11.971 -9.196 1.00 0.00 C ATOM 731 OD1 ASP A 408 -2.194 12.559 -10.241 1.00 0.00 O ATOM 732 OD2 ASP A 408 -1.647 12.560 -8.113 1.00 0.00 O ATOM 0 H ASP A 408 -3.660 8.036 -8.861 1.00 0.00 H new ATOM 0 HA ASP A 408 -3.563 10.478 -10.233 1.00 0.00 H new ATOM 0 HB2 ASP A 408 -1.445 10.098 -8.241 1.00 0.00 H new ATOM 0 HB3 ASP A 408 -0.789 10.232 -9.860 1.00 0.00 H new ATOM 737 N GLY A 409 -2.009 7.589 -10.490 1.00 0.00 N ATOM 738 CA GLY A 409 -1.582 6.587 -11.450 1.00 0.00 C ATOM 739 C GLY A 409 -0.140 6.167 -11.245 1.00 0.00 C ATOM 740 O GLY A 409 0.633 6.091 -12.200 1.00 0.00 O ATOM 0 H GLY A 409 -1.928 7.308 -9.513 1.00 0.00 H new ATOM 0 HA2 GLY A 409 -2.227 5.712 -11.369 1.00 0.00 H new ATOM 0 HA3 GLY A 409 -1.703 6.980 -12.459 1.00 0.00 H new ATOM 744 N THR A 410 0.223 5.892 -9.997 1.00 0.00 N ATOM 745 CA THR A 410 1.582 5.478 -9.669 1.00 0.00 C ATOM 746 C THR A 410 1.594 4.574 -8.441 1.00 0.00 C ATOM 747 O THR A 410 1.151 4.968 -7.363 1.00 0.00 O ATOM 748 CB THR A 410 2.465 6.703 -9.422 1.00 0.00 C ATOM 749 OG1 THR A 410 2.479 7.548 -10.558 1.00 0.00 O ATOM 750 CG2 THR A 410 3.901 6.351 -9.094 1.00 0.00 C ATOM 0 H THR A 410 -0.405 5.948 -9.196 1.00 0.00 H new ATOM 0 HA THR A 410 1.978 4.917 -10.515 1.00 0.00 H new ATOM 0 HB THR A 410 2.026 7.206 -8.561 1.00 0.00 H new ATOM 0 HG1 THR A 410 3.047 8.326 -10.380 1.00 0.00 H new ATOM 0 HG21 THR A 410 4.472 7.265 -8.931 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.929 5.740 -8.192 1.00 0.00 H new ATOM 0 HG23 THR A 410 4.338 5.794 -9.923 1.00 0.00 H new ATOM 758 N VAL A 411 2.107 3.359 -8.612 1.00 0.00 N ATOM 759 CA VAL A 411 2.178 2.400 -7.516 1.00 0.00 C ATOM 760 C VAL A 411 3.300 2.761 -6.550 1.00 0.00 C ATOM 761 O VAL A 411 4.476 2.743 -6.912 1.00 0.00 O ATOM 762 CB VAL A 411 2.400 0.965 -8.032 1.00 0.00 C ATOM 763 CG1 VAL A 411 2.194 -0.043 -6.913 1.00 0.00 C ATOM 764 CG2 VAL A 411 1.476 0.668 -9.204 1.00 0.00 C ATOM 0 H VAL A 411 2.479 3.016 -9.498 1.00 0.00 H new ATOM 0 HA VAL A 411 1.221 2.442 -6.995 1.00 0.00 H new ATOM 0 HB VAL A 411 3.429 0.880 -8.381 1.00 0.00 H new ATOM 0 HG11 VAL A 411 2.355 -1.050 -7.297 1.00 0.00 H new ATOM 0 HG12 VAL A 411 2.902 0.157 -6.109 1.00 0.00 H new ATOM 0 HG13 VAL A 411 1.177 0.041 -6.530 1.00 0.00 H new ATOM 0 HG21 VAL A 411 1.648 -0.350 -9.554 1.00 0.00 H new ATOM 0 HG22 VAL A 411 0.439 0.772 -8.885 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.678 1.369 -10.014 1.00 0.00 H new ATOM 774 N LEU A 412 2.926 3.095 -5.320 1.00 0.00 N ATOM 775 CA LEU A 412 3.898 3.468 -4.300 1.00 0.00 C ATOM 776 C LEU A 412 4.262 2.277 -3.418 1.00 0.00 C ATOM 777 O LEU A 412 5.310 2.273 -2.772 1.00 0.00 O ATOM 778 CB LEU A 412 3.348 4.602 -3.437 1.00 0.00 C ATOM 779 CG LEU A 412 4.396 5.589 -2.920 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.522 6.777 -3.861 1.00 0.00 C ATOM 781 CD2 LEU A 412 4.044 6.054 -1.515 1.00 0.00 C ATOM 0 H LEU A 412 1.956 3.115 -5.005 1.00 0.00 H new ATOM 0 HA LEU A 412 4.802 3.805 -4.808 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.607 5.153 -4.017 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.827 4.169 -2.583 1.00 0.00 H new ATOM 0 HG LEU A 412 5.359 5.079 -2.882 1.00 0.00 H new ATOM 0 HD11 LEU A 412 5.272 7.468 -3.476 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.823 6.428 -4.849 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.562 7.287 -3.933 1.00 0.00 H new ATOM 0 HD21 LEU A 412 4.801 6.756 -1.164 1.00 0.00 H new ATOM 0 HD22 LEU A 412 3.071 6.546 -1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.008 5.194 -0.846 1.00 0.00 H new ATOM 793 N GLY A 413 3.391 1.272 -3.383 1.00 0.00 N ATOM 794 CA GLY A 413 3.653 0.102 -2.563 1.00 0.00 C ATOM 795 C GLY A 413 3.258 -1.197 -3.238 1.00 0.00 C ATOM 796 O GLY A 413 2.085 -1.564 -3.256 1.00 0.00 O ATOM 0 H GLY A 413 2.514 1.246 -3.904 1.00 0.00 H new ATOM 0 HA2 GLY A 413 4.714 0.069 -2.317 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.110 0.196 -1.622 1.00 0.00 H new ATOM 800 N THR A 414 4.245 -1.899 -3.788 1.00 0.00 N ATOM 801 CA THR A 414 4.002 -3.168 -4.459 1.00 0.00 C ATOM 802 C THR A 414 4.553 -4.328 -3.633 1.00 0.00 C ATOM 803 O THR A 414 5.682 -4.271 -3.147 1.00 0.00 O ATOM 804 CB THR A 414 4.645 -3.163 -5.846 1.00 0.00 C ATOM 805 OG1 THR A 414 4.099 -2.130 -6.647 1.00 0.00 O ATOM 806 CG2 THR A 414 4.472 -4.466 -6.596 1.00 0.00 C ATOM 0 H THR A 414 5.222 -1.608 -3.781 1.00 0.00 H new ATOM 0 HA THR A 414 2.925 -3.299 -4.566 1.00 0.00 H new ATOM 0 HB THR A 414 5.709 -3.007 -5.668 1.00 0.00 H new ATOM 0 HG1 THR A 414 4.524 -2.141 -7.530 1.00 0.00 H new ATOM 0 HG21 THR A 414 4.953 -4.391 -7.571 1.00 0.00 H new ATOM 0 HG22 THR A 414 4.929 -5.276 -6.028 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.410 -4.671 -6.730 1.00 0.00 H new ATOM 814 N GLY A 415 3.752 -5.378 -3.476 1.00 0.00 N ATOM 815 CA GLY A 415 4.188 -6.527 -2.705 1.00 0.00 C ATOM 816 C GLY A 415 3.332 -7.754 -2.944 1.00 0.00 C ATOM 817 O GLY A 415 2.123 -7.648 -3.155 1.00 0.00 O ATOM 0 H GLY A 415 2.813 -5.453 -3.867 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.223 -6.757 -2.958 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.167 -6.276 -1.644 1.00 0.00 H new ATOM 821 N VAL A 416 3.962 -8.925 -2.908 1.00 0.00 N ATOM 822 CA VAL A 416 3.262 -10.181 -3.118 1.00 0.00 C ATOM 823 C VAL A 416 2.881 -10.818 -1.785 1.00 0.00 C ATOM 824 O VAL A 416 3.423 -10.461 -0.739 1.00 0.00 O ATOM 825 CB VAL A 416 4.134 -11.164 -3.917 1.00 0.00 C ATOM 826 CG1 VAL A 416 3.364 -12.433 -4.245 1.00 0.00 C ATOM 827 CG2 VAL A 416 4.657 -10.504 -5.184 1.00 0.00 C ATOM 0 H VAL A 416 4.962 -9.026 -2.734 1.00 0.00 H new ATOM 0 HA VAL A 416 2.356 -9.963 -3.683 1.00 0.00 H new ATOM 0 HB VAL A 416 4.987 -11.443 -3.298 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.004 -13.111 -4.810 1.00 0.00 H new ATOM 0 HG12 VAL A 416 3.050 -12.917 -3.320 1.00 0.00 H new ATOM 0 HG13 VAL A 416 2.486 -12.182 -4.840 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.272 -11.214 -5.737 1.00 0.00 H new ATOM 0 HG22 VAL A 416 3.817 -10.191 -5.805 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.257 -9.633 -4.920 1.00 0.00 H new ATOM 837 N GLY A 417 1.949 -11.763 -1.829 1.00 0.00 N ATOM 838 CA GLY A 417 1.517 -12.432 -0.615 1.00 0.00 C ATOM 839 C GLY A 417 0.725 -13.694 -0.893 1.00 0.00 C ATOM 840 O GLY A 417 0.317 -13.941 -2.029 1.00 0.00 O ATOM 0 H GLY A 417 1.485 -12.078 -2.681 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.390 -12.681 -0.012 1.00 0.00 H new ATOM 0 HA3 GLY A 417 0.907 -11.748 -0.025 1.00 0.00 H new ATOM 844 N ARG A 418 0.506 -14.493 0.146 1.00 0.00 N ATOM 845 CA ARG A 418 -0.244 -15.736 0.010 1.00 0.00 C ATOM 846 C ARG A 418 -1.726 -15.456 -0.215 1.00 0.00 C ATOM 847 O ARG A 418 -2.424 -16.233 -0.865 1.00 0.00 O ATOM 848 CB ARG A 418 -0.060 -16.606 1.256 1.00 0.00 C ATOM 849 CG ARG A 418 1.324 -17.225 1.368 1.00 0.00 C ATOM 850 CD ARG A 418 2.120 -16.613 2.511 1.00 0.00 C ATOM 851 NE ARG A 418 3.239 -17.461 2.913 1.00 0.00 N ATOM 852 CZ ARG A 418 4.234 -17.053 3.698 1.00 0.00 C ATOM 853 NH1 ARG A 418 4.252 -15.811 4.166 1.00 0.00 N ATOM 854 NH2 ARG A 418 5.212 -17.890 4.016 1.00 0.00 N ATOM 0 H ARG A 418 0.837 -14.302 1.092 1.00 0.00 H new ATOM 0 HA ARG A 418 0.141 -16.271 -0.858 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -0.251 -16.001 2.142 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -0.805 -17.402 1.246 1.00 0.00 H new ATOM 0 HG2 ARG A 418 1.231 -18.300 1.523 1.00 0.00 H new ATOM 0 HG3 ARG A 418 1.863 -17.084 0.431 1.00 0.00 H new ATOM 0 HD2 ARG A 418 2.496 -15.636 2.209 1.00 0.00 H new ATOM 0 HD3 ARG A 418 1.462 -16.451 3.365 1.00 0.00 H new ATOM 0 HE ARG A 418 3.259 -18.422 2.572 1.00 0.00 H new ATOM 0 HH11 ARG A 418 3.501 -15.164 3.925 1.00 0.00 H new ATOM 0 HH12 ARG A 418 5.017 -15.504 4.767 1.00 0.00 H new ATOM 0 HH21 ARG A 418 5.202 -18.846 3.659 1.00 0.00 H new ATOM 0 HH22 ARG A 418 5.975 -17.578 4.617 1.00 0.00 H new ATOM 866 N ASN A 419 -2.200 -14.339 0.328 1.00 0.00 N ATOM 867 CA ASN A 419 -3.599 -13.952 0.186 1.00 0.00 C ATOM 868 C ASN A 419 -3.731 -12.437 0.074 1.00 0.00 C ATOM 869 O ASN A 419 -2.755 -11.705 0.248 1.00 0.00 O ATOM 870 CB ASN A 419 -4.414 -14.462 1.376 1.00 0.00 C ATOM 871 CG ASN A 419 -4.266 -15.956 1.580 1.00 0.00 C ATOM 872 OD1 ASN A 419 -3.340 -16.347 2.448 1.00 0.00 O flip ATOM 873 ND2 ASN A 419 -4.977 -16.752 0.966 1.00 0.00 N flip ATOM 0 H ASN A 419 -1.635 -13.686 0.871 1.00 0.00 H new ATOM 0 HA ASN A 419 -3.987 -14.402 -0.728 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -4.097 -13.942 2.280 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -5.466 -14.222 1.222 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -5.677 -16.408 0.308 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -4.866 -17.755 1.115 1.00 0.00 H new ATOM 880 N ILE A 420 -4.941 -11.971 -0.214 1.00 0.00 N ATOM 881 CA ILE A 420 -5.196 -10.542 -0.347 1.00 0.00 C ATOM 882 C ILE A 420 -4.834 -9.800 0.937 1.00 0.00 C ATOM 883 O ILE A 420 -4.383 -8.655 0.898 1.00 0.00 O ATOM 884 CB ILE A 420 -6.671 -10.263 -0.699 1.00 0.00 C ATOM 885 CG1 ILE A 420 -6.890 -8.767 -0.941 1.00 0.00 C ATOM 886 CG2 ILE A 420 -7.588 -10.767 0.407 1.00 0.00 C ATOM 887 CD1 ILE A 420 -7.746 -8.469 -2.154 1.00 0.00 C ATOM 0 H ILE A 420 -5.760 -12.561 -0.360 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.567 -10.180 -1.160 1.00 0.00 H new ATOM 0 HB ILE A 420 -6.914 -10.799 -1.617 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -7.359 -8.329 -0.059 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -5.922 -8.281 -1.062 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -8.625 -10.562 0.142 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -7.451 -11.841 0.532 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -7.345 -10.259 1.341 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -7.859 -7.390 -2.264 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -7.269 -8.876 -3.045 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -8.728 -8.925 -2.028 1.00 0.00 H new ATOM 899 N LYS A 421 -5.034 -10.463 2.071 1.00 0.00 N ATOM 900 CA LYS A 421 -4.726 -9.870 3.368 1.00 0.00 C ATOM 901 C LYS A 421 -3.224 -9.677 3.534 1.00 0.00 C ATOM 902 O LYS A 421 -2.759 -8.594 3.891 1.00 0.00 O ATOM 903 CB LYS A 421 -5.269 -10.748 4.496 1.00 0.00 C ATOM 904 CG LYS A 421 -6.756 -11.043 4.378 1.00 0.00 C ATOM 905 CD LYS A 421 -7.008 -12.472 3.923 1.00 0.00 C ATOM 906 CE LYS A 421 -8.386 -12.621 3.300 1.00 0.00 C ATOM 907 NZ LYS A 421 -8.729 -14.048 3.048 1.00 0.00 N ATOM 0 H LYS A 421 -5.408 -11.411 2.119 1.00 0.00 H new ATOM 0 HA LYS A 421 -5.206 -8.893 3.416 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.720 -11.690 4.508 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -5.079 -10.257 5.450 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -7.238 -10.877 5.341 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -7.210 -10.350 3.670 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.247 -12.765 3.200 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -6.917 -13.148 4.773 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -9.133 -12.179 3.960 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -8.422 -12.068 2.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -9.676 -14.107 2.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -8.031 -14.463 2.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -8.720 -14.571 3.947 1.00 0.00 H new ATOM 921 N ILE A 422 -2.471 -10.736 3.269 1.00 0.00 N ATOM 922 CA ILE A 422 -1.018 -10.693 3.383 1.00 0.00 C ATOM 923 C ILE A 422 -0.418 -9.783 2.319 1.00 0.00 C ATOM 924 O ILE A 422 0.279 -8.817 2.632 1.00 0.00 O ATOM 925 CB ILE A 422 -0.401 -12.104 3.258 1.00 0.00 C ATOM 926 CG1 ILE A 422 -0.779 -12.957 4.471 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.115 -12.026 3.115 1.00 0.00 C ATOM 928 CD1 ILE A 422 -2.208 -13.452 4.440 1.00 0.00 C ATOM 0 H ILE A 422 -2.843 -11.638 2.973 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.784 -10.295 4.371 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.802 -12.573 2.359 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -0.107 -13.814 4.526 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -0.625 -12.373 5.378 1.00 0.00 H new ATOM 0 HG21 ILE A 422 1.525 -13.032 3.029 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.367 -11.454 2.222 1.00 0.00 H new ATOM 0 HG23 ILE A 422 1.538 -11.536 3.992 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -2.406 -14.049 5.330 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -2.888 -12.600 4.416 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -2.362 -14.064 3.551 1.00 0.00 H new ATOM 940 N ALA A 423 -0.691 -10.101 1.060 1.00 0.00 N ATOM 941 CA ALA A 423 -0.177 -9.316 -0.056 1.00 0.00 C ATOM 942 C ALA A 423 -0.411 -7.827 0.172 1.00 0.00 C ATOM 943 O ALA A 423 0.403 -6.992 -0.220 1.00 0.00 O ATOM 944 CB ALA A 423 -0.819 -9.763 -1.360 1.00 0.00 C ATOM 0 H ALA A 423 -1.266 -10.898 0.786 1.00 0.00 H new ATOM 0 HA ALA A 423 0.898 -9.483 -0.123 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.424 -9.167 -2.183 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.595 -10.815 -1.534 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.899 -9.627 -1.299 1.00 0.00 H new ATOM 950 N GLY A 424 -1.526 -7.506 0.820 1.00 0.00 N ATOM 951 CA GLY A 424 -1.843 -6.120 1.102 1.00 0.00 C ATOM 952 C GLY A 424 -0.868 -5.511 2.089 1.00 0.00 C ATOM 953 O GLY A 424 -0.298 -4.449 1.835 1.00 0.00 O ATOM 0 H GLY A 424 -2.214 -8.181 1.154 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.827 -5.547 0.175 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.855 -6.052 1.501 1.00 0.00 H new ATOM 957 N ILE A 425 -0.669 -6.192 3.213 1.00 0.00 N ATOM 958 CA ILE A 425 0.252 -5.720 4.238 1.00 0.00 C ATOM 959 C ILE A 425 1.679 -5.681 3.697 1.00 0.00 C ATOM 960 O ILE A 425 2.491 -4.857 4.118 1.00 0.00 O ATOM 961 CB ILE A 425 0.200 -6.615 5.496 1.00 0.00 C ATOM 962 CG1 ILE A 425 -1.179 -6.524 6.153 1.00 0.00 C ATOM 963 CG2 ILE A 425 1.284 -6.218 6.490 1.00 0.00 C ATOM 964 CD1 ILE A 425 -1.671 -7.842 6.710 1.00 0.00 C ATOM 0 H ILE A 425 -1.134 -7.072 3.436 1.00 0.00 H new ATOM 0 HA ILE A 425 -0.056 -4.713 4.518 1.00 0.00 H new ATOM 0 HB ILE A 425 0.379 -7.646 5.190 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -1.141 -5.790 6.958 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.898 -6.157 5.421 1.00 0.00 H new ATOM 0 HG21 ILE A 425 1.227 -6.862 7.367 1.00 0.00 H new ATOM 0 HG22 ILE A 425 2.263 -6.326 6.023 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.139 -5.181 6.792 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -2.654 -7.703 7.160 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -1.741 -8.574 5.905 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -0.973 -8.201 7.466 1.00 0.00 H new ATOM 976 N ARG A 426 1.975 -6.574 2.757 1.00 0.00 N ATOM 977 CA ARG A 426 3.300 -6.637 2.153 1.00 0.00 C ATOM 978 C ARG A 426 3.521 -5.450 1.224 1.00 0.00 C ATOM 979 O ARG A 426 4.587 -4.834 1.229 1.00 0.00 O ATOM 980 CB ARG A 426 3.474 -7.950 1.384 1.00 0.00 C ATOM 981 CG ARG A 426 4.594 -8.825 1.924 1.00 0.00 C ATOM 982 CD ARG A 426 4.093 -10.214 2.288 1.00 0.00 C ATOM 983 NE ARG A 426 5.190 -11.166 2.450 1.00 0.00 N ATOM 984 CZ ARG A 426 5.947 -11.602 1.446 1.00 0.00 C ATOM 985 NH1 ARG A 426 5.732 -11.173 0.210 1.00 0.00 N ATOM 986 NH2 ARG A 426 6.924 -12.469 1.679 1.00 0.00 N ATOM 0 H ARG A 426 1.315 -7.263 2.398 1.00 0.00 H new ATOM 0 HA ARG A 426 4.043 -6.597 2.950 1.00 0.00 H new ATOM 0 HB2 ARG A 426 2.539 -8.509 1.418 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.673 -7.725 0.336 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.385 -8.907 1.178 1.00 0.00 H new ATOM 0 HG3 ARG A 426 5.033 -8.354 2.803 1.00 0.00 H new ATOM 0 HD2 ARG A 426 3.519 -10.162 3.213 1.00 0.00 H new ATOM 0 HD3 ARG A 426 3.415 -10.570 1.512 1.00 0.00 H new ATOM 0 HE ARG A 426 5.387 -11.517 3.387 1.00 0.00 H new ATOM 0 HH11 ARG A 426 4.983 -10.505 0.025 1.00 0.00 H new ATOM 0 HH12 ARG A 426 6.315 -11.511 -0.556 1.00 0.00 H new ATOM 0 HH21 ARG A 426 7.095 -12.802 2.628 1.00 0.00 H new ATOM 0 HH22 ARG A 426 7.504 -12.803 0.909 1.00 0.00 H new ATOM 998 N ALA A 427 2.502 -5.130 0.435 1.00 0.00 N ATOM 999 CA ALA A 427 2.580 -4.010 -0.493 1.00 0.00 C ATOM 1000 C ALA A 427 2.798 -2.706 0.259 1.00 0.00 C ATOM 1001 O ALA A 427 3.696 -1.929 -0.066 1.00 0.00 O ATOM 1002 CB ALA A 427 1.318 -3.933 -1.340 1.00 0.00 C ATOM 0 H ALA A 427 1.613 -5.630 0.420 1.00 0.00 H new ATOM 0 HA ALA A 427 3.431 -4.170 -1.155 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.392 -3.091 -2.028 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.204 -4.856 -1.908 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.452 -3.796 -0.692 1.00 0.00 H new ATOM 1008 N ALA A 428 1.978 -2.480 1.278 1.00 0.00 N ATOM 1009 CA ALA A 428 2.087 -1.278 2.094 1.00 0.00 C ATOM 1010 C ALA A 428 3.461 -1.204 2.739 1.00 0.00 C ATOM 1011 O ALA A 428 4.080 -0.142 2.795 1.00 0.00 O ATOM 1012 CB ALA A 428 1.001 -1.257 3.158 1.00 0.00 C ATOM 0 H ALA A 428 1.230 -3.114 1.559 1.00 0.00 H new ATOM 0 HA ALA A 428 1.956 -0.408 1.450 1.00 0.00 H new ATOM 0 HB1 ALA A 428 1.097 -0.352 3.758 1.00 0.00 H new ATOM 0 HB2 ALA A 428 0.022 -1.272 2.679 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.104 -2.131 3.800 1.00 0.00 H new ATOM 1018 N GLU A 429 3.938 -2.350 3.212 1.00 0.00 N ATOM 1019 CA GLU A 429 5.249 -2.428 3.841 1.00 0.00 C ATOM 1020 C GLU A 429 6.326 -2.008 2.850 1.00 0.00 C ATOM 1021 O GLU A 429 7.313 -1.371 3.218 1.00 0.00 O ATOM 1022 CB GLU A 429 5.519 -3.848 4.342 1.00 0.00 C ATOM 1023 CG GLU A 429 5.055 -4.085 5.769 1.00 0.00 C ATOM 1024 CD GLU A 429 5.113 -5.547 6.167 1.00 0.00 C ATOM 1025 OE1 GLU A 429 4.809 -6.407 5.312 1.00 0.00 O ATOM 1026 OE2 GLU A 429 5.463 -5.834 7.331 1.00 0.00 O ATOM 0 H GLU A 429 3.436 -3.237 3.171 1.00 0.00 H new ATOM 0 HA GLU A 429 5.268 -1.751 4.695 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.020 -4.558 3.683 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.588 -4.051 4.277 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.675 -3.502 6.450 1.00 0.00 H new ATOM 0 HG3 GLU A 429 4.033 -3.723 5.879 1.00 0.00 H new ATOM 1033 N ASN A 430 6.115 -2.356 1.585 1.00 0.00 N ATOM 1034 CA ASN A 430 7.053 -2.002 0.529 1.00 0.00 C ATOM 1035 C ASN A 430 7.085 -0.491 0.350 1.00 0.00 C ATOM 1036 O ASN A 430 8.127 0.092 0.048 1.00 0.00 O ATOM 1037 CB ASN A 430 6.658 -2.683 -0.785 1.00 0.00 C ATOM 1038 CG ASN A 430 7.713 -3.659 -1.269 1.00 0.00 C ATOM 1039 OD1 ASN A 430 8.036 -4.631 -0.585 1.00 0.00 O ATOM 1040 ND2 ASN A 430 8.255 -3.406 -2.454 1.00 0.00 N ATOM 0 H ASN A 430 5.302 -2.883 1.267 1.00 0.00 H new ATOM 0 HA ASN A 430 8.048 -2.347 0.812 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.714 -3.211 -0.648 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.491 -1.924 -1.549 1.00 0.00 H new ATOM 0 HD21 ASN A 430 8.969 -4.029 -2.832 1.00 0.00 H new ATOM 0 HD22 ASN A 430 7.957 -2.589 -2.987 1.00 0.00 H new ATOM 1047 N ALA A 431 5.932 0.140 0.556 1.00 0.00 N ATOM 1048 CA ALA A 431 5.817 1.585 0.438 1.00 0.00 C ATOM 1049 C ALA A 431 6.365 2.267 1.686 1.00 0.00 C ATOM 1050 O ALA A 431 6.876 3.385 1.624 1.00 0.00 O ATOM 1051 CB ALA A 431 4.366 1.981 0.205 1.00 0.00 C ATOM 0 H ALA A 431 5.063 -0.332 0.806 1.00 0.00 H new ATOM 0 HA ALA A 431 6.407 1.913 -0.418 1.00 0.00 H new ATOM 0 HB1 ALA A 431 4.294 3.065 0.119 1.00 0.00 H new ATOM 0 HB2 ALA A 431 4.006 1.519 -0.714 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.757 1.643 1.044 1.00 0.00 H new ATOM 1057 N LEU A 432 6.260 1.576 2.819 1.00 0.00 N ATOM 1058 CA LEU A 432 6.751 2.105 4.085 1.00 0.00 C ATOM 1059 C LEU A 432 8.276 2.047 4.137 1.00 0.00 C ATOM 1060 O LEU A 432 8.913 2.827 4.843 1.00 0.00 O ATOM 1061 CB LEU A 432 6.157 1.317 5.257 1.00 0.00 C ATOM 1062 CG LEU A 432 4.856 1.884 5.829 1.00 0.00 C ATOM 1063 CD1 LEU A 432 3.721 1.722 4.831 1.00 0.00 C ATOM 1064 CD2 LEU A 432 4.511 1.206 7.146 1.00 0.00 C ATOM 0 H LEU A 432 5.839 0.649 2.884 1.00 0.00 H new ATOM 0 HA LEU A 432 6.439 3.146 4.164 1.00 0.00 H new ATOM 0 HB2 LEU A 432 5.976 0.293 4.931 1.00 0.00 H new ATOM 0 HB3 LEU A 432 6.897 1.271 6.056 1.00 0.00 H new ATOM 0 HG LEU A 432 4.998 2.948 6.019 1.00 0.00 H new ATOM 0 HD11 LEU A 432 2.803 2.131 5.254 1.00 0.00 H new ATOM 0 HD12 LEU A 432 3.966 2.255 3.912 1.00 0.00 H new ATOM 0 HD13 LEU A 432 3.579 0.664 4.610 1.00 0.00 H new ATOM 0 HD21 LEU A 432 3.583 1.622 7.537 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.388 0.135 6.983 1.00 0.00 H new ATOM 0 HD23 LEU A 432 5.315 1.374 7.863 1.00 0.00 H new ATOM 1076 N ARG A 433 8.854 1.115 3.381 1.00 0.00 N ATOM 1077 CA ARG A 433 10.303 0.954 3.340 1.00 0.00 C ATOM 1078 C ARG A 433 10.971 2.166 2.701 1.00 0.00 C ATOM 1079 O ARG A 433 12.018 2.622 3.158 1.00 0.00 O ATOM 1080 CB ARG A 433 10.674 -0.313 2.566 1.00 0.00 C ATOM 1081 CG ARG A 433 10.579 -1.584 3.394 1.00 0.00 C ATOM 1082 CD ARG A 433 11.465 -2.683 2.829 1.00 0.00 C ATOM 1083 NE ARG A 433 10.960 -3.196 1.558 1.00 0.00 N ATOM 1084 CZ ARG A 433 11.699 -3.880 0.688 1.00 0.00 C ATOM 1085 NH1 ARG A 433 12.975 -4.137 0.948 1.00 0.00 N ATOM 1086 NH2 ARG A 433 11.160 -4.311 -0.445 1.00 0.00 N ATOM 0 H ARG A 433 8.340 0.462 2.790 1.00 0.00 H new ATOM 0 HA ARG A 433 10.661 0.865 4.366 1.00 0.00 H new ATOM 0 HB2 ARG A 433 10.018 -0.404 1.700 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.691 -0.212 2.187 1.00 0.00 H new ATOM 0 HG2 ARG A 433 10.871 -1.372 4.423 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.544 -1.926 3.420 1.00 0.00 H new ATOM 0 HD2 ARG A 433 12.475 -2.298 2.688 1.00 0.00 H new ATOM 0 HD3 ARG A 433 11.532 -3.499 3.548 1.00 0.00 H new ATOM 0 HE ARG A 433 9.983 -3.020 1.323 1.00 0.00 H new ATOM 0 HH11 ARG A 433 13.394 -3.810 1.818 1.00 0.00 H new ATOM 0 HH12 ARG A 433 13.536 -4.662 0.277 1.00 0.00 H new ATOM 0 HH21 ARG A 433 10.179 -4.118 -0.649 1.00 0.00 H new ATOM 0 HH22 ARG A 433 11.726 -4.835 -1.112 1.00 0.00 H new ATOM 1098 N ASP A 434 10.357 2.680 1.641 1.00 0.00 N ATOM 1099 CA ASP A 434 10.892 3.840 0.937 1.00 0.00 C ATOM 1100 C ASP A 434 10.869 5.075 1.833 1.00 0.00 C ATOM 1101 O ASP A 434 9.995 5.931 1.705 1.00 0.00 O ATOM 1102 CB ASP A 434 10.089 4.105 -0.337 1.00 0.00 C ATOM 1103 CG ASP A 434 10.094 2.919 -1.282 1.00 0.00 C ATOM 1104 OD1 ASP A 434 11.196 2.463 -1.656 1.00 0.00 O ATOM 1105 OD2 ASP A 434 8.998 2.445 -1.648 1.00 0.00 O ATOM 0 H ASP A 434 9.489 2.312 1.251 1.00 0.00 H new ATOM 0 HA ASP A 434 11.926 3.626 0.667 1.00 0.00 H new ATOM 0 HB2 ASP A 434 9.061 4.349 -0.071 1.00 0.00 H new ATOM 0 HB3 ASP A 434 10.501 4.975 -0.848 1.00 0.00 H new ATOM 1110 N LYS A 435 11.837 5.157 2.740 1.00 0.00 N ATOM 1111 CA LYS A 435 11.932 6.282 3.664 1.00 0.00 C ATOM 1112 C LYS A 435 11.989 7.607 2.913 1.00 0.00 C ATOM 1113 O LYS A 435 11.421 8.607 3.353 1.00 0.00 O ATOM 1114 CB LYS A 435 13.165 6.133 4.557 1.00 0.00 C ATOM 1115 CG LYS A 435 12.929 6.562 5.997 1.00 0.00 C ATOM 1116 CD LYS A 435 13.175 5.418 6.969 1.00 0.00 C ATOM 1117 CE LYS A 435 12.047 4.400 6.929 1.00 0.00 C ATOM 1118 NZ LYS A 435 12.379 3.171 7.701 1.00 0.00 N ATOM 0 H LYS A 435 12.569 4.456 2.855 1.00 0.00 H new ATOM 0 HA LYS A 435 11.038 6.281 4.287 1.00 0.00 H new ATOM 0 HB2 LYS A 435 13.488 5.092 4.545 1.00 0.00 H new ATOM 0 HB3 LYS A 435 13.980 6.725 4.139 1.00 0.00 H new ATOM 0 HG2 LYS A 435 13.587 7.396 6.241 1.00 0.00 H new ATOM 0 HG3 LYS A 435 11.906 6.921 6.107 1.00 0.00 H new ATOM 0 HD2 LYS A 435 14.117 4.928 6.725 1.00 0.00 H new ATOM 0 HD3 LYS A 435 13.274 5.813 7.980 1.00 0.00 H new ATOM 0 HE2 LYS A 435 11.139 4.848 7.333 1.00 0.00 H new ATOM 0 HE3 LYS A 435 11.836 4.132 5.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 11.584 2.503 7.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 13.230 2.729 7.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 12.555 3.422 8.695 1.00 0.00 H new ATOM 1132 N LYS A 436 12.675 7.607 1.777 1.00 0.00 N ATOM 1133 CA LYS A 436 12.803 8.811 0.964 1.00 0.00 C ATOM 1134 C LYS A 436 11.452 9.219 0.398 1.00 0.00 C ATOM 1135 O LYS A 436 10.998 10.348 0.588 1.00 0.00 O ATOM 1136 CB LYS A 436 13.799 8.586 -0.174 1.00 0.00 C ATOM 1137 CG LYS A 436 15.249 8.560 0.282 1.00 0.00 C ATOM 1138 CD LYS A 436 15.472 7.525 1.371 1.00 0.00 C ATOM 1139 CE LYS A 436 16.950 7.350 1.681 1.00 0.00 C ATOM 1140 NZ LYS A 436 17.222 6.074 2.397 1.00 0.00 N ATOM 0 H LYS A 436 13.151 6.788 1.398 1.00 0.00 H new ATOM 0 HA LYS A 436 13.173 9.614 1.601 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.566 7.643 -0.669 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.674 9.375 -0.916 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.895 8.340 -0.568 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.533 9.545 0.652 1.00 0.00 H new ATOM 0 HD2 LYS A 436 14.943 7.827 2.275 1.00 0.00 H new ATOM 0 HD3 LYS A 436 15.049 6.570 1.059 1.00 0.00 H new ATOM 0 HE2 LYS A 436 17.520 7.373 0.752 1.00 0.00 H new ATOM 0 HE3 LYS A 436 17.295 8.187 2.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 18.241 5.994 2.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 16.698 6.062 3.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 16.917 5.273 1.807 1.00 0.00 H new ATOM 1154 N MET A 437 10.812 8.287 -0.293 1.00 0.00 N ATOM 1155 CA MET A 437 9.505 8.538 -0.886 1.00 0.00 C ATOM 1156 C MET A 437 8.485 8.874 0.195 1.00 0.00 C ATOM 1157 O MET A 437 7.534 9.617 -0.046 1.00 0.00 O ATOM 1158 CB MET A 437 9.041 7.319 -1.685 1.00 0.00 C ATOM 1159 CG MET A 437 7.691 7.510 -2.356 1.00 0.00 C ATOM 1160 SD MET A 437 7.817 7.638 -4.152 1.00 0.00 S ATOM 1161 CE MET A 437 7.802 5.909 -4.617 1.00 0.00 C ATOM 0 H MET A 437 11.176 7.349 -0.457 1.00 0.00 H new ATOM 0 HA MET A 437 9.591 9.389 -1.561 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.786 7.089 -2.446 1.00 0.00 H new ATOM 0 HB3 MET A 437 8.988 6.457 -1.020 1.00 0.00 H new ATOM 0 HG2 MET A 437 7.041 6.673 -2.100 1.00 0.00 H new ATOM 0 HG3 MET A 437 7.219 8.411 -1.964 1.00 0.00 H new ATOM 0 HE1 MET A 437 8.797 5.613 -4.951 1.00 0.00 H new ATOM 0 HE2 MET A 437 7.513 5.304 -3.758 1.00 0.00 H new ATOM 0 HE3 MET A 437 7.088 5.756 -5.426 1.00 0.00 H new ATOM 1171 N LEU A 438 8.694 8.329 1.389 1.00 0.00 N ATOM 1172 CA LEU A 438 7.795 8.581 2.506 1.00 0.00 C ATOM 1173 C LEU A 438 8.059 9.961 3.097 1.00 0.00 C ATOM 1174 O LEU A 438 7.143 10.632 3.570 1.00 0.00 O ATOM 1175 CB LEU A 438 7.958 7.505 3.581 1.00 0.00 C ATOM 1176 CG LEU A 438 6.648 6.966 4.158 1.00 0.00 C ATOM 1177 CD1 LEU A 438 5.897 8.063 4.899 1.00 0.00 C ATOM 1178 CD2 LEU A 438 5.783 6.376 3.053 1.00 0.00 C ATOM 0 H LEU A 438 9.476 7.712 1.606 1.00 0.00 H new ATOM 0 HA LEU A 438 6.770 8.548 2.137 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.521 6.673 3.159 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.556 7.914 4.396 1.00 0.00 H new ATOM 0 HG LEU A 438 6.885 6.175 4.869 1.00 0.00 H new ATOM 0 HD11 LEU A 438 4.968 7.660 5.302 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.514 8.439 5.715 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.671 8.878 4.211 1.00 0.00 H new ATOM 0 HD21 LEU A 438 4.855 5.997 3.481 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.555 7.148 2.318 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.319 5.560 2.568 1.00 0.00 H new ATOM 1190 N ASP A 439 9.319 10.381 3.057 1.00 0.00 N ATOM 1191 CA ASP A 439 9.704 11.685 3.580 1.00 0.00 C ATOM 1192 C ASP A 439 9.095 12.799 2.736 1.00 0.00 C ATOM 1193 O ASP A 439 8.716 13.848 3.254 1.00 0.00 O ATOM 1194 CB ASP A 439 11.228 11.819 3.608 1.00 0.00 C ATOM 1195 CG ASP A 439 11.725 12.505 4.866 1.00 0.00 C ATOM 1196 OD1 ASP A 439 11.047 12.396 5.909 1.00 0.00 O ATOM 1197 OD2 ASP A 439 12.794 13.149 4.807 1.00 0.00 O ATOM 0 H ASP A 439 10.090 9.837 2.668 1.00 0.00 H new ATOM 0 HA ASP A 439 9.326 11.773 4.598 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.678 10.829 3.535 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.556 12.384 2.735 1.00 0.00 H new ATOM 1202 N PHE A 440 9.001 12.558 1.432 1.00 0.00 N ATOM 1203 CA PHE A 440 8.432 13.537 0.514 1.00 0.00 C ATOM 1204 C PHE A 440 6.948 13.745 0.800 1.00 0.00 C ATOM 1205 O PHE A 440 6.444 14.866 0.739 1.00 0.00 O ATOM 1206 CB PHE A 440 8.625 13.082 -0.932 1.00 0.00 C ATOM 1207 CG PHE A 440 9.194 14.147 -1.827 1.00 0.00 C ATOM 1208 CD1 PHE A 440 10.508 14.562 -1.683 1.00 0.00 C ATOM 1209 CD2 PHE A 440 8.413 14.733 -2.810 1.00 0.00 C ATOM 1210 CE1 PHE A 440 11.033 15.542 -2.504 1.00 0.00 C ATOM 1211 CE2 PHE A 440 8.933 15.713 -3.634 1.00 0.00 C ATOM 1212 CZ PHE A 440 10.245 16.118 -3.481 1.00 0.00 C ATOM 0 H PHE A 440 9.311 11.694 0.988 1.00 0.00 H new ATOM 0 HA PHE A 440 8.951 14.484 0.661 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.286 12.216 -0.946 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.665 12.757 -1.333 1.00 0.00 H new ATOM 0 HD1 PHE A 440 11.129 14.115 -0.921 1.00 0.00 H new ATOM 0 HD2 PHE A 440 7.387 14.420 -2.934 1.00 0.00 H new ATOM 0 HE1 PHE A 440 12.059 15.857 -2.382 1.00 0.00 H new ATOM 0 HE2 PHE A 440 8.314 16.162 -4.397 1.00 0.00 H new ATOM 0 HZ PHE A 440 10.654 16.883 -4.124 1.00 0.00 H new ATOM 1222 N TYR A 441 6.256 12.656 1.119 1.00 0.00 N ATOM 1223 CA TYR A 441 4.835 12.715 1.424 1.00 0.00 C ATOM 1224 C TYR A 441 4.625 13.128 2.868 1.00 0.00 C ATOM 1225 O TYR A 441 3.791 13.977 3.164 1.00 0.00 O ATOM 1226 CB TYR A 441 4.178 11.360 1.167 1.00 0.00 C ATOM 1227 CG TYR A 441 3.734 11.162 -0.262 1.00 0.00 C ATOM 1228 CD1 TYR A 441 2.466 11.549 -0.674 1.00 0.00 C ATOM 1229 CD2 TYR A 441 4.582 10.586 -1.200 1.00 0.00 C ATOM 1230 CE1 TYR A 441 2.055 11.369 -1.980 1.00 0.00 C ATOM 1231 CE2 TYR A 441 4.178 10.403 -2.509 1.00 0.00 C ATOM 1232 CZ TYR A 441 2.914 10.796 -2.894 1.00 0.00 C ATOM 1233 OH TYR A 441 2.506 10.615 -4.195 1.00 0.00 O ATOM 0 H TYR A 441 6.660 11.721 1.172 1.00 0.00 H new ATOM 0 HA TYR A 441 4.372 13.457 0.773 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.880 10.570 1.433 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.315 11.254 1.824 1.00 0.00 H new ATOM 0 HD1 TYR A 441 1.790 11.998 0.039 1.00 0.00 H new ATOM 0 HD2 TYR A 441 5.573 10.276 -0.901 1.00 0.00 H new ATOM 0 HE1 TYR A 441 1.065 11.676 -2.284 1.00 0.00 H new ATOM 0 HE2 TYR A 441 4.849 9.954 -3.227 1.00 0.00 H new ATOM 0 HH TYR A 441 3.229 10.200 -4.710 1.00 0.00 H new ATOM 1243 N ALA A 442 5.397 12.531 3.762 1.00 0.00 N ATOM 1244 CA ALA A 442 5.302 12.853 5.178 1.00 0.00 C ATOM 1245 C ALA A 442 5.463 14.356 5.403 1.00 0.00 C ATOM 1246 O ALA A 442 4.969 14.901 6.390 1.00 0.00 O ATOM 1247 CB ALA A 442 6.341 12.077 5.972 1.00 0.00 C ATOM 0 H ALA A 442 6.095 11.823 3.534 1.00 0.00 H new ATOM 0 HA ALA A 442 4.312 12.561 5.530 1.00 0.00 H new ATOM 0 HB1 ALA A 442 6.255 12.330 7.029 1.00 0.00 H new ATOM 0 HB2 ALA A 442 6.175 11.008 5.841 1.00 0.00 H new ATOM 0 HB3 ALA A 442 7.338 12.336 5.617 1.00 0.00 H new ATOM 1253 N LYS A 443 6.148 15.021 4.473 1.00 0.00 N ATOM 1254 CA LYS A 443 6.360 16.462 4.564 1.00 0.00 C ATOM 1255 C LYS A 443 5.219 17.225 3.891 1.00 0.00 C ATOM 1256 O LYS A 443 5.158 18.451 3.954 1.00 0.00 O ATOM 1257 CB LYS A 443 7.695 16.846 3.924 1.00 0.00 C ATOM 1258 CG LYS A 443 8.906 16.451 4.757 1.00 0.00 C ATOM 1259 CD LYS A 443 9.732 17.664 5.156 1.00 0.00 C ATOM 1260 CE LYS A 443 10.474 17.427 6.462 1.00 0.00 C ATOM 1261 NZ LYS A 443 10.597 18.674 7.264 1.00 0.00 N ATOM 0 H LYS A 443 6.564 14.584 3.650 1.00 0.00 H new ATOM 0 HA LYS A 443 6.382 16.734 5.619 1.00 0.00 H new ATOM 0 HB2 LYS A 443 7.768 16.373 2.945 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.713 17.923 3.760 1.00 0.00 H new ATOM 0 HG2 LYS A 443 8.576 15.924 5.653 1.00 0.00 H new ATOM 0 HG3 LYS A 443 9.527 15.758 4.190 1.00 0.00 H new ATOM 0 HD2 LYS A 443 10.447 17.894 4.366 1.00 0.00 H new ATOM 0 HD3 LYS A 443 9.080 18.532 5.259 1.00 0.00 H new ATOM 0 HE2 LYS A 443 9.949 16.670 7.045 1.00 0.00 H new ATOM 0 HE3 LYS A 443 11.468 17.033 6.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 11.109 18.470 8.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 11.120 19.388 6.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 9.649 19.037 7.490 1.00 0.00 H new ATOM 1275 N GLN A 444 4.312 16.487 3.257 1.00 0.00 N ATOM 1276 CA GLN A 444 3.166 17.082 2.588 1.00 0.00 C ATOM 1277 C GLN A 444 1.887 16.700 3.317 1.00 0.00 C ATOM 1278 O GLN A 444 1.012 17.535 3.543 1.00 0.00 O ATOM 1279 CB GLN A 444 3.100 16.628 1.129 1.00 0.00 C ATOM 1280 CG GLN A 444 4.251 17.139 0.278 1.00 0.00 C ATOM 1281 CD GLN A 444 4.365 18.650 0.299 1.00 0.00 C ATOM 1282 OE1 GLN A 444 5.351 19.203 0.788 1.00 0.00 O ATOM 1283 NE2 GLN A 444 3.355 19.327 -0.232 1.00 0.00 N ATOM 0 H GLN A 444 4.352 15.470 3.194 1.00 0.00 H new ATOM 0 HA GLN A 444 3.275 18.166 2.605 1.00 0.00 H new ATOM 0 HB2 GLN A 444 3.092 15.539 1.097 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.160 16.967 0.694 1.00 0.00 H new ATOM 0 HG2 GLN A 444 5.184 16.703 0.635 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.115 16.803 -0.750 1.00 0.00 H new ATOM 0 HE21 GLN A 444 2.558 18.828 -0.626 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.376 20.347 -0.246 1.00 0.00 H new ATOM 1292 N ARG A 445 1.794 15.430 3.695 1.00 0.00 N ATOM 1293 CA ARG A 445 0.631 14.928 4.417 1.00 0.00 C ATOM 1294 C ARG A 445 0.569 15.542 5.810 1.00 0.00 C ATOM 1295 O ARG A 445 -0.457 16.087 6.218 1.00 0.00 O ATOM 1296 CB ARG A 445 0.691 13.402 4.520 1.00 0.00 C ATOM 1297 CG ARG A 445 -0.660 12.721 4.379 1.00 0.00 C ATOM 1298 CD ARG A 445 -1.637 13.189 5.445 1.00 0.00 C ATOM 1299 NE ARG A 445 -1.404 12.530 6.729 1.00 0.00 N ATOM 1300 CZ ARG A 445 -1.886 12.973 7.889 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -2.624 14.075 7.931 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -1.630 12.311 9.009 1.00 0.00 N ATOM 0 H ARG A 445 2.511 14.728 3.513 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.268 15.210 3.868 1.00 0.00 H new ATOM 0 HB2 ARG A 445 1.361 13.022 3.749 1.00 0.00 H new ATOM 0 HB3 ARG A 445 1.125 13.130 5.482 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -1.071 12.929 3.391 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -0.533 11.641 4.450 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -1.548 14.268 5.570 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -2.657 12.990 5.115 1.00 0.00 H new ATOM 0 HE ARG A 445 -0.839 11.681 6.737 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -2.825 14.587 7.072 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -2.991 14.410 8.822 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -1.064 11.463 8.982 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -1.999 12.650 9.897 1.00 0.00 H new ATOM 1314 N ALA A 446 1.680 15.455 6.528 1.00 0.00 N ATOM 1315 CA ALA A 446 1.770 16.002 7.875 1.00 0.00 C ATOM 1316 C ALA A 446 1.826 17.526 7.841 1.00 0.00 C ATOM 1317 O ALA A 446 1.432 18.194 8.797 1.00 0.00 O ATOM 1318 CB ALA A 446 2.992 15.445 8.589 1.00 0.00 C ATOM 0 H ALA A 446 2.536 15.008 6.198 1.00 0.00 H new ATOM 0 HA ALA A 446 0.876 15.706 8.424 1.00 0.00 H new ATOM 0 HB1 ALA A 446 3.047 15.862 9.595 1.00 0.00 H new ATOM 0 HB2 ALA A 446 2.914 14.359 8.650 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.891 15.714 8.035 1.00 0.00 H new ATOM 1324 N ALA A 447 2.325 18.069 6.735 1.00 0.00 N ATOM 1325 CA ALA A 447 2.438 19.511 6.576 1.00 0.00 C ATOM 1326 C ALA A 447 1.162 20.108 5.989 1.00 0.00 C ATOM 1327 O ALA A 447 0.876 21.291 6.174 1.00 0.00 O ATOM 1328 CB ALA A 447 3.634 19.846 5.699 1.00 0.00 C ATOM 0 H ALA A 447 2.657 17.530 5.936 1.00 0.00 H new ATOM 0 HA ALA A 447 2.585 19.950 7.563 1.00 0.00 H new ATOM 0 HB1 ALA A 447 3.711 20.927 5.586 1.00 0.00 H new ATOM 0 HB2 ALA A 447 4.544 19.464 6.163 1.00 0.00 H new ATOM 0 HB3 ALA A 447 3.506 19.387 4.719 1.00 0.00 H new ATOM 1334 N ALA A 448 0.396 19.283 5.278 1.00 0.00 N ATOM 1335 CA ALA A 448 -0.848 19.734 4.664 1.00 0.00 C ATOM 1336 C ALA A 448 -1.818 20.263 5.712 1.00 0.00 C ATOM 1337 O ALA A 448 -2.060 21.467 5.799 1.00 0.00 O ATOM 1338 CB ALA A 448 -1.487 18.602 3.876 1.00 0.00 C ATOM 0 H ALA A 448 0.616 18.301 5.114 1.00 0.00 H new ATOM 0 HA ALA A 448 -0.612 20.550 3.981 1.00 0.00 H new ATOM 0 HB1 ALA A 448 -2.415 18.952 3.423 1.00 0.00 H new ATOM 0 HB2 ALA A 448 -0.803 18.272 3.094 1.00 0.00 H new ATOM 0 HB3 ALA A 448 -1.702 17.769 4.545 1.00 0.00 H new ATOM 1344 N LEU A 449 -2.370 19.354 6.503 1.00 0.00 N ATOM 1345 CA LEU A 449 -3.317 19.722 7.549 1.00 0.00 C ATOM 1346 C LEU A 449 -2.682 20.688 8.544 1.00 0.00 C ATOM 1347 O LEU A 449 -3.365 21.525 9.133 1.00 0.00 O ATOM 1348 CB LEU A 449 -3.815 18.473 8.282 1.00 0.00 C ATOM 1349 CG LEU A 449 -4.214 17.300 7.382 1.00 0.00 C ATOM 1350 CD1 LEU A 449 -4.710 16.131 8.218 1.00 0.00 C ATOM 1351 CD2 LEU A 449 -5.279 17.731 6.384 1.00 0.00 C ATOM 0 H LEU A 449 -2.179 18.354 6.441 1.00 0.00 H new ATOM 0 HA LEU A 449 -4.164 20.219 7.076 1.00 0.00 H new ATOM 0 HB2 LEU A 449 -3.034 18.137 8.964 1.00 0.00 H new ATOM 0 HB3 LEU A 449 -4.674 18.749 8.893 1.00 0.00 H new ATOM 0 HG LEU A 449 -3.333 16.977 6.827 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -4.989 15.307 7.562 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -3.919 15.805 8.893 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -5.578 16.442 8.799 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -5.550 16.885 5.753 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -6.161 18.080 6.921 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -4.890 18.537 5.762 1.00 0.00 H new ATOM 1363 N GLY A 450 -1.370 20.568 8.725 1.00 0.00 N ATOM 1364 CA GLY A 450 -0.666 21.438 9.648 1.00 0.00 C ATOM 1365 C GLY A 450 0.779 21.026 9.846 1.00 0.00 C ATOM 1366 O GLY A 450 1.016 19.988 10.500 1.00 0.00 O ATOM 0 H GLY A 450 -0.783 19.884 8.249 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -0.701 22.462 9.276 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -1.178 21.431 10.610 1.00 0.00 H new TER 1370 GLY A 450