USER MOD reduce.3.24.130724 H: found=0, std=0, add=763, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 774 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 428 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 439 GLN : amide:sc= -2.28! C(o=-2.3!,f=-4!) USER MOD Single : A 411 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 417 SER OG : rot 180:sc= 0 USER MOD Single : A 421 ASN : amide:sc= -4.87 K(o=-4.9,f=-12!) USER MOD Single : A 425 HIS :FLIP no HD1:sc= -4.84! C(o=-6.2!,f=-4.8!) USER MOD Single : A 431 ASN : amide:sc= -2.28! C(o=-2.3!,f=-10!) USER MOD Single : A 432 THR OG1 : rot -75:sc= -8.23! USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 442 GLN :FLIP amide:sc= -0.621 F(o=-2.4,f=-0.62) USER MOD Single : A 444 TYR OH : rot 155:sc= -0.998 USER MOD Single : A 445 THR OG1 : rot 30:sc= 0.0231! USER MOD Single : A 454 ASN : amide:sc= -6.18! C(o=-6.2!,f=-14!) USER MOD Single : A 458 SER OG : rot 180:sc= 0 USER MOD Single : A 459 ASN :FLIP amide:sc= -2.86 F(o=-4.6!,f=-2.9) USER MOD Single : A 462 GLN :FLIP amide:sc= -0.249 F(o=-1,f=-0.25) USER MOD Single : A 463 ASN :FLIP amide:sc= -0.874 F(o=-1.5!,f=-0.87) USER MOD Single : A 466 THR OG1 : rot 180:sc= 0.0309 USER MOD Single : A 470 GLN : amide:sc= -0.242 X(o=-0.24,f=0) USER MOD Single : A 475 GLN :FLIP amide:sc= -4.29! C(o=-11!,f=-4.3!) USER MOD Single : A 479 MET CE :methyl 169:sc= 0 (180deg=-0.141) USER MOD Single : A 482 TYR OH : rot 180:sc= 0 USER MOD Single : A 486 HIS :FLIP no HD1:sc= -5.49 F(o=-7!,f=-5.5) USER MOD Single : A 490 ASN : amide:sc= -1.26 K(o=-1.3,f=-3.3!) USER MOD Single : A 491 THR OG1 : rot 180:sc= 0 USER MOD Single : A 496 SER OG : rot 180:sc= 0 USER MOD Single : A 497 SER OG : rot 36:sc= 0.69 USER MOD Single : A 501 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 502 ASN : amide:sc= -0.181 K(o=-0.18,f=-1.5) USER MOD Single : A 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 510 ASN : amide:sc= -0.373 K(o=-0.37,f=-2.8!) USER MOD Single : A 513 GLN : amide:sc= -0.247 K(o=-0.25,f=-0.89) USER MOD Single : A 518 THR OG1 : rot -67:sc= 0.646 USER MOD Single : A 521 THR OG1 : rot 180:sc= -0.14 USER MOD Single : A 523 HIS : no HD1:sc= 0 X(o=0,f=-2e-05) USER MOD Single : A 526 GLN : amide:sc= -0.218 K(o=-0.22,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 411 3.148 36.484 2.991 1.00 0.00 N ATOM 2 CA GLN A 411 3.274 35.719 4.220 1.00 0.00 C ATOM 3 C GLN A 411 1.908 35.562 4.889 1.00 0.00 C ATOM 4 O GLN A 411 1.055 36.442 4.785 1.00 0.00 O ATOM 5 CB GLN A 411 4.277 36.374 5.172 1.00 0.00 C ATOM 6 CG GLN A 411 5.711 35.967 4.821 1.00 0.00 C ATOM 7 CD GLN A 411 6.724 36.760 5.651 1.00 0.00 C ATOM 8 OE1 GLN A 411 7.299 36.270 6.609 1.00 0.00 O ATOM 9 NE2 GLN A 411 6.907 38.008 5.232 1.00 0.00 N ATOM 0 HA GLN A 411 3.652 34.727 3.971 1.00 0.00 H new ATOM 0 HB2 GLN A 411 4.179 37.458 5.119 1.00 0.00 H new ATOM 0 HB3 GLN A 411 4.053 36.083 6.198 1.00 0.00 H new ATOM 0 HG2 GLN A 411 5.844 34.900 5.000 1.00 0.00 H new ATOM 0 HG3 GLN A 411 5.892 36.137 3.760 1.00 0.00 H new ATOM 0 HE21 GLN A 411 6.393 38.355 4.422 1.00 0.00 H new ATOM 0 HE22 GLN A 411 7.562 38.619 5.720 1.00 0.00 H new ATOM 18 N ASP A 412 1.739 34.431 5.560 1.00 0.00 N ATOM 19 CA ASP A 412 0.490 34.146 6.245 1.00 0.00 C ATOM 20 C ASP A 412 0.792 33.481 7.590 1.00 0.00 C ATOM 21 O ASP A 412 1.952 33.260 7.931 1.00 0.00 O ATOM 22 CB ASP A 412 -0.380 33.190 5.428 1.00 0.00 C ATOM 23 CG ASP A 412 -1.855 33.153 5.833 1.00 0.00 C ATOM 24 OD1 ASP A 412 -2.611 34.103 5.580 1.00 0.00 O ATOM 25 OD2 ASP A 412 -2.228 32.076 6.441 1.00 0.00 O ATOM 0 H ASP A 412 2.447 33.701 5.643 1.00 0.00 H new ATOM 0 HA ASP A 412 -0.042 35.087 6.383 1.00 0.00 H new ATOM 0 HB2 ASP A 412 -0.314 33.471 4.377 1.00 0.00 H new ATOM 0 HB3 ASP A 412 0.031 32.184 5.515 1.00 0.00 H new ATOM 31 N VAL A 413 -0.275 33.179 8.316 1.00 0.00 N ATOM 32 CA VAL A 413 -0.139 32.543 9.616 1.00 0.00 C ATOM 33 C VAL A 413 -0.014 31.029 9.427 1.00 0.00 C ATOM 34 O VAL A 413 -0.576 30.468 8.489 1.00 0.00 O ATOM 35 CB VAL A 413 -1.311 32.937 10.517 1.00 0.00 C ATOM 36 CG1 VAL A 413 -2.418 31.884 10.470 1.00 0.00 C ATOM 37 CG2 VAL A 413 -0.842 33.176 11.953 1.00 0.00 C ATOM 0 H VAL A 413 -1.236 33.363 8.029 1.00 0.00 H new ATOM 0 HA VAL A 413 0.767 32.885 10.116 1.00 0.00 H new ATOM 0 HB VAL A 413 -1.724 33.872 10.139 1.00 0.00 H new ATOM 0 HG11 VAL A 413 -3.238 32.189 11.119 1.00 0.00 H new ATOM 0 HG12 VAL A 413 -2.782 31.784 9.448 1.00 0.00 H new ATOM 0 HG13 VAL A 413 -2.024 30.926 10.810 1.00 0.00 H new ATOM 0 HG21 VAL A 413 -1.694 33.455 12.573 1.00 0.00 H new ATOM 0 HG22 VAL A 413 -0.391 32.264 12.345 1.00 0.00 H new ATOM 0 HG23 VAL A 413 -0.106 33.980 11.966 1.00 0.00 H new ATOM 47 N ASP A 414 0.728 30.411 10.334 1.00 0.00 N ATOM 48 CA ASP A 414 0.935 28.974 10.281 1.00 0.00 C ATOM 49 C ASP A 414 -0.175 28.274 11.067 1.00 0.00 C ATOM 50 O ASP A 414 0.034 27.856 12.204 1.00 0.00 O ATOM 51 CB ASP A 414 2.275 28.587 10.907 1.00 0.00 C ATOM 52 CG ASP A 414 2.827 27.228 10.466 1.00 0.00 C ATOM 53 OD1 ASP A 414 4.045 27.051 10.320 1.00 0.00 O ATOM 54 OD2 ASP A 414 1.935 26.318 10.267 1.00 0.00 O ATOM 0 H ASP A 414 1.194 30.880 11.111 1.00 0.00 H new ATOM 0 HA ASP A 414 0.926 28.670 9.234 1.00 0.00 H new ATOM 0 HB2 ASP A 414 3.008 29.356 10.664 1.00 0.00 H new ATOM 0 HB3 ASP A 414 2.165 28.583 11.991 1.00 0.00 H new ATOM 60 N GLU A 415 -1.332 28.167 10.430 1.00 0.00 N ATOM 61 CA GLU A 415 -2.475 27.525 11.057 1.00 0.00 C ATOM 62 C GLU A 415 -2.121 26.094 11.467 1.00 0.00 C ATOM 63 O GLU A 415 -2.877 25.445 12.187 1.00 0.00 O ATOM 64 CB GLU A 415 -3.692 27.543 10.129 1.00 0.00 C ATOM 65 CG GLU A 415 -4.159 28.977 9.867 1.00 0.00 C ATOM 66 CD GLU A 415 -3.978 29.353 8.394 1.00 0.00 C ATOM 67 OE1 GLU A 415 -3.796 30.538 8.076 1.00 0.00 O ATOM 68 OE2 GLU A 415 -4.030 28.364 7.569 1.00 0.00 O ATOM 0 H GLU A 415 -1.502 28.514 9.486 1.00 0.00 H new ATOM 0 HA GLU A 415 -2.735 28.087 11.954 1.00 0.00 H new ATOM 0 HB2 GLU A 415 -3.441 27.060 9.185 1.00 0.00 H new ATOM 0 HB3 GLU A 415 -4.503 26.968 10.576 1.00 0.00 H new ATOM 0 HG2 GLU A 415 -5.208 29.078 10.145 1.00 0.00 H new ATOM 0 HG3 GLU A 415 -3.595 29.667 10.494 1.00 0.00 H new ATOM 76 N CYS A 416 -0.969 25.643 10.990 1.00 0.00 N ATOM 77 CA CYS A 416 -0.505 24.302 11.298 1.00 0.00 C ATOM 78 C CYS A 416 0.390 24.375 12.536 1.00 0.00 C ATOM 79 O CYS A 416 0.638 23.363 13.190 1.00 0.00 O ATOM 80 CB CYS A 416 0.217 23.665 10.108 1.00 0.00 C ATOM 81 SG CYS A 416 -0.592 22.172 9.429 1.00 0.00 S ATOM 0 H CYS A 416 -0.344 26.184 10.392 1.00 0.00 H new ATOM 0 HA CYS A 416 -1.360 23.659 11.507 1.00 0.00 H new ATOM 0 HB2 CYS A 416 0.304 24.407 9.314 1.00 0.00 H new ATOM 0 HB3 CYS A 416 1.231 23.405 10.413 1.00 0.00 H new ATOM 86 N SER A 417 0.853 25.584 12.823 1.00 0.00 N ATOM 87 CA SER A 417 1.716 25.803 13.970 1.00 0.00 C ATOM 88 C SER A 417 0.871 25.960 15.237 1.00 0.00 C ATOM 89 O SER A 417 1.331 25.654 16.336 1.00 0.00 O ATOM 90 CB SER A 417 2.602 27.034 13.767 1.00 0.00 C ATOM 91 OG SER A 417 3.653 27.100 14.726 1.00 0.00 O ATOM 0 H SER A 417 0.646 26.422 12.280 1.00 0.00 H new ATOM 0 HA SER A 417 2.367 24.935 14.079 1.00 0.00 H new ATOM 0 HB2 SER A 417 3.028 27.013 12.764 1.00 0.00 H new ATOM 0 HB3 SER A 417 1.992 27.935 13.835 1.00 0.00 H new ATOM 0 HG SER A 417 4.196 27.899 14.561 1.00 0.00 H new ATOM 97 N LEU A 418 -0.348 26.439 15.041 1.00 0.00 N ATOM 98 CA LEU A 418 -1.260 26.642 16.154 1.00 0.00 C ATOM 99 C LEU A 418 -1.140 25.466 17.127 1.00 0.00 C ATOM 100 O LEU A 418 -0.965 25.666 18.327 1.00 0.00 O ATOM 101 CB LEU A 418 -2.685 26.874 15.644 1.00 0.00 C ATOM 102 CG LEU A 418 -2.814 27.736 14.387 1.00 0.00 C ATOM 103 CD1 LEU A 418 -4.264 28.174 14.169 1.00 0.00 C ATOM 104 CD2 LEU A 418 -1.856 28.928 14.438 1.00 0.00 C ATOM 0 H LEU A 418 -0.726 26.693 14.128 1.00 0.00 H new ATOM 0 HA LEU A 418 -0.992 27.543 16.706 1.00 0.00 H new ATOM 0 HB2 LEU A 418 -3.141 25.904 15.444 1.00 0.00 H new ATOM 0 HB3 LEU A 418 -3.264 27.340 16.441 1.00 0.00 H new ATOM 0 HG LEU A 418 -2.528 27.131 13.527 1.00 0.00 H new ATOM 0 HD11 LEU A 418 -4.328 28.786 13.269 1.00 0.00 H new ATOM 0 HD12 LEU A 418 -4.897 27.294 14.055 1.00 0.00 H new ATOM 0 HD13 LEU A 418 -4.601 28.755 15.027 1.00 0.00 H new ATOM 0 HD21 LEU A 418 -1.968 29.524 13.532 1.00 0.00 H new ATOM 0 HD22 LEU A 418 -2.086 29.543 15.308 1.00 0.00 H new ATOM 0 HD23 LEU A 418 -0.830 28.567 14.510 1.00 0.00 H new ATOM 116 N GLY A 419 -1.239 24.267 16.571 1.00 0.00 N ATOM 117 CA GLY A 419 -1.142 23.060 17.374 1.00 0.00 C ATOM 118 C GLY A 419 -2.093 21.979 16.854 1.00 0.00 C ATOM 119 O GLY A 419 -1.980 20.815 17.235 1.00 0.00 O ATOM 0 H GLY A 419 -1.385 24.106 15.574 1.00 0.00 H new ATOM 0 HA2 GLY A 419 -0.118 22.688 17.356 1.00 0.00 H new ATOM 0 HA3 GLY A 419 -1.379 23.290 18.413 1.00 0.00 H new ATOM 123 N ALA A 420 -3.006 22.402 15.993 1.00 0.00 N ATOM 124 CA ALA A 420 -3.974 21.485 15.417 1.00 0.00 C ATOM 125 C ALA A 420 -3.393 20.871 14.141 1.00 0.00 C ATOM 126 O ALA A 420 -3.746 21.278 13.036 1.00 0.00 O ATOM 127 CB ALA A 420 -5.288 22.224 15.161 1.00 0.00 C ATOM 0 H ALA A 420 -3.096 23.369 15.680 1.00 0.00 H new ATOM 0 HA ALA A 420 -4.187 20.669 16.108 1.00 0.00 H new ATOM 0 HB1 ALA A 420 -6.014 21.536 14.729 1.00 0.00 H new ATOM 0 HB2 ALA A 420 -5.675 22.616 16.102 1.00 0.00 H new ATOM 0 HB3 ALA A 420 -5.113 23.048 14.470 1.00 0.00 H new ATOM 133 N ASN A 421 -2.511 19.902 14.338 1.00 0.00 N ATOM 134 CA ASN A 421 -1.877 19.228 13.218 1.00 0.00 C ATOM 135 C ASN A 421 -2.816 18.145 12.682 1.00 0.00 C ATOM 136 O ASN A 421 -3.114 17.177 13.379 1.00 0.00 O ATOM 137 CB ASN A 421 -0.573 18.553 13.647 1.00 0.00 C ATOM 138 CG ASN A 421 0.491 18.671 12.554 1.00 0.00 C ATOM 139 OD1 ASN A 421 1.272 19.609 12.511 1.00 0.00 O ATOM 140 ND2 ASN A 421 0.481 17.671 11.677 1.00 0.00 N ATOM 0 H ASN A 421 -2.221 19.568 15.257 1.00 0.00 H new ATOM 0 HA ASN A 421 -1.662 19.975 12.454 1.00 0.00 H new ATOM 0 HB2 ASN A 421 -0.208 19.011 14.566 1.00 0.00 H new ATOM 0 HB3 ASN A 421 -0.759 17.502 13.867 1.00 0.00 H new ATOM 0 HD21 ASN A 421 1.154 17.658 10.911 1.00 0.00 H new ATOM 0 HD22 ASN A 421 -0.200 16.917 11.771 1.00 0.00 H new ATOM 147 N PRO A 422 -3.267 18.352 11.416 1.00 0.00 N ATOM 148 CA PRO A 422 -4.166 17.404 10.778 1.00 0.00 C ATOM 149 C PRO A 422 -3.417 16.144 10.342 1.00 0.00 C ATOM 150 O PRO A 422 -3.957 15.042 10.411 1.00 0.00 O ATOM 151 CB PRO A 422 -4.777 18.166 9.612 1.00 0.00 C ATOM 152 CG PRO A 422 -3.859 19.349 9.361 1.00 0.00 C ATOM 153 CD PRO A 422 -2.936 19.487 10.560 1.00 0.00 C ATOM 0 HA PRO A 422 -4.943 17.042 11.452 1.00 0.00 H new ATOM 0 HB2 PRO A 422 -4.850 17.533 8.727 1.00 0.00 H new ATOM 0 HB3 PRO A 422 -5.787 18.499 9.850 1.00 0.00 H new ATOM 0 HG2 PRO A 422 -3.281 19.196 8.450 1.00 0.00 H new ATOM 0 HG3 PRO A 422 -4.441 20.260 9.220 1.00 0.00 H new ATOM 0 HD2 PRO A 422 -1.889 19.463 10.258 1.00 0.00 H new ATOM 0 HD3 PRO A 422 -3.097 20.433 11.077 1.00 0.00 H new ATOM 161 N CYS A 423 -2.184 16.351 9.904 1.00 0.00 N ATOM 162 CA CYS A 423 -1.354 15.244 9.458 1.00 0.00 C ATOM 163 C CYS A 423 -1.469 14.113 10.481 1.00 0.00 C ATOM 164 O CYS A 423 -1.187 12.958 10.169 1.00 0.00 O ATOM 165 CB CYS A 423 0.099 15.676 9.245 1.00 0.00 C ATOM 166 SG CYS A 423 0.306 17.356 8.549 1.00 0.00 S ATOM 0 H CYS A 423 -1.740 17.267 9.848 1.00 0.00 H new ATOM 0 HA CYS A 423 -1.705 14.891 8.488 1.00 0.00 H new ATOM 0 HB2 CYS A 423 0.622 15.627 10.200 1.00 0.00 H new ATOM 0 HB3 CYS A 423 0.582 14.960 8.580 1.00 0.00 H new ATOM 171 N GLU A 424 -1.884 14.486 11.684 1.00 0.00 N ATOM 172 CA GLU A 424 -2.040 13.517 12.756 1.00 0.00 C ATOM 173 C GLU A 424 -0.709 13.312 13.482 1.00 0.00 C ATOM 174 O GLU A 424 -0.540 13.763 14.615 1.00 0.00 O ATOM 175 CB GLU A 424 -2.582 12.190 12.220 1.00 0.00 C ATOM 176 CG GLU A 424 -3.742 12.424 11.249 1.00 0.00 C ATOM 177 CD GLU A 424 -4.623 11.178 11.138 1.00 0.00 C ATOM 178 OE1 GLU A 424 -4.425 10.210 11.887 1.00 0.00 O ATOM 179 OE2 GLU A 424 -5.543 11.240 10.237 1.00 0.00 O ATOM 0 H GLU A 424 -2.117 15.446 11.939 1.00 0.00 H new ATOM 0 HA GLU A 424 -2.766 13.906 13.470 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -1.785 11.645 11.715 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -2.917 11.568 13.050 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -4.341 13.268 11.589 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -3.351 12.686 10.266 1.00 0.00 H new ATOM 187 N HIS A 425 0.201 12.630 12.803 1.00 0.00 N ATOM 188 CA HIS A 425 1.511 12.359 13.370 1.00 0.00 C ATOM 189 C HIS A 425 2.496 12.022 12.250 1.00 0.00 C ATOM 190 O HIS A 425 3.646 12.459 12.275 1.00 0.00 O ATOM 191 CB HIS A 425 1.427 11.263 14.435 1.00 0.00 C ATOM 192 CG HIS A 425 0.449 11.562 15.546 1.00 0.00 C ATOM 193 ND1 HIS A 425 -0.906 11.410 15.606 1.00 0.00 N flip ATOM 194 CD2 HIS A 425 0.838 12.081 16.769 1.00 0.00 C flip ATOM 195 CE1 HIS A 425 -1.321 11.812 16.801 1.00 0.00 C flip ATOM 196 NE2 HIS A 425 -0.241 12.229 17.524 1.00 0.00 N flip ATOM 0 H HIS A 425 0.057 12.257 11.865 1.00 0.00 H new ATOM 0 HA HIS A 425 1.882 13.250 13.877 1.00 0.00 H new ATOM 0 HB2 HIS A 425 1.142 10.326 13.956 1.00 0.00 H new ATOM 0 HB3 HIS A 425 2.417 11.113 14.866 1.00 0.00 H new ATOM 0 HD2 HIS A 425 1.850 12.324 17.059 1.00 0.00 H new ATOM 0 HE1 HIS A 425 -2.345 11.810 17.145 1.00 0.00 H new ATOM 0 HE2 HIS A 425 -0.261 12.591 18.477 1.00 0.00 H new ATOM 204 N ALA A 426 2.011 11.245 11.293 1.00 0.00 N ATOM 205 CA ALA A 426 2.834 10.843 10.165 1.00 0.00 C ATOM 206 C ALA A 426 2.580 11.791 8.991 1.00 0.00 C ATOM 207 O ALA A 426 1.807 11.475 8.089 1.00 0.00 O ATOM 208 CB ALA A 426 2.539 9.385 9.811 1.00 0.00 C ATOM 0 H ALA A 426 1.058 10.883 11.275 1.00 0.00 H new ATOM 0 HA ALA A 426 3.892 10.909 10.419 1.00 0.00 H new ATOM 0 HB1 ALA A 426 3.157 9.084 8.965 1.00 0.00 H new ATOM 0 HB2 ALA A 426 2.763 8.750 10.668 1.00 0.00 H new ATOM 0 HB3 ALA A 426 1.487 9.280 9.547 1.00 0.00 H new ATOM 214 N GLY A 427 3.246 12.934 9.042 1.00 0.00 N ATOM 215 CA GLY A 427 3.104 13.930 7.994 1.00 0.00 C ATOM 216 C GLY A 427 3.825 15.228 8.366 1.00 0.00 C ATOM 217 O GLY A 427 4.309 15.372 9.489 1.00 0.00 O ATOM 0 H GLY A 427 3.886 13.193 9.793 1.00 0.00 H new ATOM 0 HA2 GLY A 427 3.509 13.540 7.060 1.00 0.00 H new ATOM 0 HA3 GLY A 427 2.047 14.134 7.822 1.00 0.00 H new ATOM 221 N LYS A 428 3.877 16.138 7.405 1.00 0.00 N ATOM 222 CA LYS A 428 4.531 17.417 7.618 1.00 0.00 C ATOM 223 C LYS A 428 3.476 18.524 7.656 1.00 0.00 C ATOM 224 O LYS A 428 2.523 18.504 6.880 1.00 0.00 O ATOM 225 CB LYS A 428 5.623 17.642 6.570 1.00 0.00 C ATOM 226 CG LYS A 428 6.728 18.547 7.116 1.00 0.00 C ATOM 227 CD LYS A 428 8.001 17.746 7.405 1.00 0.00 C ATOM 228 CE LYS A 428 8.746 17.415 6.111 1.00 0.00 C ATOM 229 NZ LYS A 428 9.846 18.378 5.885 1.00 0.00 N ATOM 0 H LYS A 428 3.476 16.014 6.475 1.00 0.00 H new ATOM 0 HA LYS A 428 5.040 17.429 8.582 1.00 0.00 H new ATOM 0 HB2 LYS A 428 6.048 16.684 6.270 1.00 0.00 H new ATOM 0 HB3 LYS A 428 5.188 18.091 5.677 1.00 0.00 H new ATOM 0 HG2 LYS A 428 6.946 19.336 6.396 1.00 0.00 H new ATOM 0 HG3 LYS A 428 6.386 19.035 8.029 1.00 0.00 H new ATOM 0 HD2 LYS A 428 8.652 18.317 8.068 1.00 0.00 H new ATOM 0 HD3 LYS A 428 7.744 16.824 7.927 1.00 0.00 H new ATOM 0 HE2 LYS A 428 9.146 16.403 6.164 1.00 0.00 H new ATOM 0 HE3 LYS A 428 8.054 17.441 5.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 10.341 18.139 5.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 9.456 19.340 5.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 10.515 18.334 6.680 1.00 0.00 H new ATOM 242 N CYS A 429 3.684 19.465 8.565 1.00 0.00 N ATOM 243 CA CYS A 429 2.763 20.578 8.713 1.00 0.00 C ATOM 244 C CYS A 429 3.512 21.869 8.376 1.00 0.00 C ATOM 245 O CYS A 429 4.367 22.312 9.139 1.00 0.00 O ATOM 246 CB CYS A 429 2.151 20.624 10.116 1.00 0.00 C ATOM 247 SG CYS A 429 0.327 20.766 10.153 1.00 0.00 S ATOM 0 H CYS A 429 4.477 19.479 9.206 1.00 0.00 H new ATOM 0 HA CYS A 429 1.926 20.454 8.026 1.00 0.00 H new ATOM 0 HB2 CYS A 429 2.442 19.722 10.654 1.00 0.00 H new ATOM 0 HB3 CYS A 429 2.578 21.469 10.656 1.00 0.00 H new ATOM 252 N ILE A 430 3.161 22.436 7.229 1.00 0.00 N ATOM 253 CA ILE A 430 3.789 23.667 6.782 1.00 0.00 C ATOM 254 C ILE A 430 2.744 24.783 6.743 1.00 0.00 C ATOM 255 O ILE A 430 1.551 24.529 6.908 1.00 0.00 O ATOM 256 CB ILE A 430 4.503 23.447 5.447 1.00 0.00 C ATOM 257 CG1 ILE A 430 4.225 22.047 4.898 1.00 0.00 C ATOM 258 CG2 ILE A 430 6.003 23.725 5.575 1.00 0.00 C ATOM 259 CD1 ILE A 430 4.864 20.974 5.783 1.00 0.00 C ATOM 0 H ILE A 430 2.451 22.065 6.598 1.00 0.00 H new ATOM 0 HA ILE A 430 4.562 23.979 7.485 1.00 0.00 H new ATOM 0 HB ILE A 430 4.103 24.160 4.726 1.00 0.00 H new ATOM 0 HG12 ILE A 430 3.149 21.882 4.840 1.00 0.00 H new ATOM 0 HG13 ILE A 430 4.615 21.966 3.883 1.00 0.00 H new ATOM 0 HG21 ILE A 430 6.487 23.561 4.612 1.00 0.00 H new ATOM 0 HG22 ILE A 430 6.156 24.758 5.887 1.00 0.00 H new ATOM 0 HG23 ILE A 430 6.435 23.054 6.317 1.00 0.00 H new ATOM 0 HD11 ILE A 430 4.651 19.988 5.370 1.00 0.00 H new ATOM 0 HD12 ILE A 430 5.943 21.127 5.819 1.00 0.00 H new ATOM 0 HD13 ILE A 430 4.454 21.042 6.791 1.00 0.00 H new ATOM 271 N ASN A 431 3.228 25.996 6.524 1.00 0.00 N ATOM 272 CA ASN A 431 2.350 27.153 6.463 1.00 0.00 C ATOM 273 C ASN A 431 2.192 27.590 5.006 1.00 0.00 C ATOM 274 O ASN A 431 3.165 27.623 4.255 1.00 0.00 O ATOM 275 CB ASN A 431 2.933 28.329 7.249 1.00 0.00 C ATOM 276 CG ASN A 431 2.160 29.618 6.960 1.00 0.00 C ATOM 277 OD1 ASN A 431 1.068 29.609 6.418 1.00 0.00 O ATOM 278 ND2 ASN A 431 2.789 30.724 7.351 1.00 0.00 N ATOM 0 H ASN A 431 4.217 26.204 6.386 1.00 0.00 H new ATOM 0 HA ASN A 431 1.390 26.871 6.895 1.00 0.00 H new ATOM 0 HB2 ASN A 431 2.898 28.111 8.316 1.00 0.00 H new ATOM 0 HB3 ASN A 431 3.982 28.463 6.986 1.00 0.00 H new ATOM 0 HD21 ASN A 431 2.357 31.636 7.202 1.00 0.00 H new ATOM 0 HD22 ASN A 431 3.703 30.660 7.799 1.00 0.00 H new ATOM 285 N THR A 432 0.958 27.916 4.651 1.00 0.00 N ATOM 286 CA THR A 432 0.659 28.350 3.295 1.00 0.00 C ATOM 287 C THR A 432 -0.105 29.677 3.317 1.00 0.00 C ATOM 288 O THR A 432 -0.481 30.163 4.383 1.00 0.00 O ATOM 289 CB THR A 432 -0.100 27.223 2.595 1.00 0.00 C ATOM 290 OG1 THR A 432 -0.391 26.298 3.639 1.00 0.00 O ATOM 291 CG2 THR A 432 0.786 26.430 1.631 1.00 0.00 C ATOM 0 H THR A 432 0.154 27.889 5.277 1.00 0.00 H new ATOM 0 HA THR A 432 1.571 28.545 2.731 1.00 0.00 H new ATOM 0 HB THR A 432 -0.946 27.641 2.050 1.00 0.00 H new ATOM 0 HG1 THR A 432 0.423 25.806 3.876 1.00 0.00 H new ATOM 0 HG21 THR A 432 0.198 25.642 1.161 1.00 0.00 H new ATOM 0 HG22 THR A 432 1.177 27.098 0.864 1.00 0.00 H new ATOM 0 HG23 THR A 432 1.615 25.985 2.181 1.00 0.00 H new ATOM 299 N LEU A 433 -0.311 30.222 2.127 1.00 0.00 N ATOM 300 CA LEU A 433 -1.022 31.482 1.996 1.00 0.00 C ATOM 301 C LEU A 433 -2.521 31.236 2.177 1.00 0.00 C ATOM 302 O LEU A 433 -3.116 30.444 1.449 1.00 0.00 O ATOM 303 CB LEU A 433 -0.666 32.164 0.674 1.00 0.00 C ATOM 304 CG LEU A 433 0.393 33.266 0.751 1.00 0.00 C ATOM 305 CD1 LEU A 433 0.891 33.646 -0.645 1.00 0.00 C ATOM 306 CD2 LEU A 433 -0.133 34.477 1.522 1.00 0.00 C ATOM 0 H LEU A 433 0.002 29.814 1.246 1.00 0.00 H new ATOM 0 HA LEU A 433 -0.715 32.176 2.778 1.00 0.00 H new ATOM 0 HB2 LEU A 433 -0.318 31.402 -0.023 1.00 0.00 H new ATOM 0 HB3 LEU A 433 -1.576 32.591 0.252 1.00 0.00 H new ATOM 0 HG LEU A 433 1.250 32.880 1.304 1.00 0.00 H new ATOM 0 HD11 LEU A 433 1.643 34.431 -0.562 1.00 0.00 H new ATOM 0 HD12 LEU A 433 1.331 32.772 -1.125 1.00 0.00 H new ATOM 0 HD13 LEU A 433 0.055 34.006 -1.244 1.00 0.00 H new ATOM 0 HD21 LEU A 433 0.639 35.246 1.562 1.00 0.00 H new ATOM 0 HD22 LEU A 433 -1.015 34.874 1.019 1.00 0.00 H new ATOM 0 HD23 LEU A 433 -0.399 34.176 2.535 1.00 0.00 H new ATOM 318 N GLY A 434 -3.090 31.932 3.151 1.00 0.00 N ATOM 319 CA GLY A 434 -4.508 31.800 3.437 1.00 0.00 C ATOM 320 C GLY A 434 -4.783 30.556 4.286 1.00 0.00 C ATOM 321 O GLY A 434 -5.535 30.618 5.258 1.00 0.00 O ATOM 0 H GLY A 434 -2.594 32.590 3.752 1.00 0.00 H new ATOM 0 HA2 GLY A 434 -4.861 32.688 3.961 1.00 0.00 H new ATOM 0 HA3 GLY A 434 -5.067 31.738 2.503 1.00 0.00 H new ATOM 325 N SER A 435 -4.158 29.458 3.889 1.00 0.00 N ATOM 326 CA SER A 435 -4.326 28.203 4.601 1.00 0.00 C ATOM 327 C SER A 435 -2.963 27.548 4.837 1.00 0.00 C ATOM 328 O SER A 435 -1.945 28.032 4.345 1.00 0.00 O ATOM 329 CB SER A 435 -5.246 27.253 3.833 1.00 0.00 C ATOM 330 OG SER A 435 -6.414 27.912 3.354 1.00 0.00 O ATOM 0 H SER A 435 -3.534 29.411 3.083 1.00 0.00 H new ATOM 0 HA SER A 435 -4.791 28.416 5.564 1.00 0.00 H new ATOM 0 HB2 SER A 435 -4.702 26.823 2.992 1.00 0.00 H new ATOM 0 HB3 SER A 435 -5.536 26.426 4.482 1.00 0.00 H new ATOM 0 HG SER A 435 -6.975 27.272 2.868 1.00 0.00 H new ATOM 336 N PHE A 436 -2.989 26.457 5.588 1.00 0.00 N ATOM 337 CA PHE A 436 -1.768 25.731 5.894 1.00 0.00 C ATOM 338 C PHE A 436 -1.619 24.504 4.992 1.00 0.00 C ATOM 339 O PHE A 436 -2.610 23.964 4.503 1.00 0.00 O ATOM 340 CB PHE A 436 -1.874 25.271 7.348 1.00 0.00 C ATOM 341 CG PHE A 436 -3.000 24.266 7.603 1.00 0.00 C ATOM 342 CD1 PHE A 436 -2.765 22.933 7.466 1.00 0.00 C ATOM 343 CD2 PHE A 436 -4.235 24.706 7.965 1.00 0.00 C ATOM 344 CE1 PHE A 436 -3.810 22.001 7.701 1.00 0.00 C ATOM 345 CE2 PHE A 436 -5.279 23.773 8.200 1.00 0.00 C ATOM 346 CZ PHE A 436 -5.045 22.440 8.063 1.00 0.00 C ATOM 0 H PHE A 436 -3.836 26.058 5.993 1.00 0.00 H new ATOM 0 HA PHE A 436 -0.903 26.374 5.733 1.00 0.00 H new ATOM 0 HB2 PHE A 436 -0.926 24.823 7.646 1.00 0.00 H new ATOM 0 HB3 PHE A 436 -2.028 26.143 7.984 1.00 0.00 H new ATOM 0 HD1 PHE A 436 -1.784 22.584 7.179 1.00 0.00 H new ATOM 0 HD2 PHE A 436 -4.421 25.764 8.074 1.00 0.00 H new ATOM 0 HE1 PHE A 436 -3.624 20.943 7.592 1.00 0.00 H new ATOM 0 HE2 PHE A 436 -6.260 24.122 8.488 1.00 0.00 H new ATOM 0 HZ PHE A 436 -5.840 21.731 8.242 1.00 0.00 H new ATOM 356 N GLU A 437 -0.372 24.098 4.799 1.00 0.00 N ATOM 357 CA GLU A 437 -0.080 22.946 3.966 1.00 0.00 C ATOM 358 C GLU A 437 0.525 21.821 4.807 1.00 0.00 C ATOM 359 O GLU A 437 1.203 22.082 5.800 1.00 0.00 O ATOM 360 CB GLU A 437 0.847 23.326 2.808 1.00 0.00 C ATOM 361 CG GLU A 437 1.649 22.115 2.329 1.00 0.00 C ATOM 362 CD GLU A 437 2.111 22.302 0.882 1.00 0.00 C ATOM 363 OE1 GLU A 437 2.305 23.442 0.435 1.00 0.00 O ATOM 364 OE2 GLU A 437 2.270 21.209 0.215 1.00 0.00 O ATOM 0 H GLU A 437 0.448 24.548 5.206 1.00 0.00 H new ATOM 0 HA GLU A 437 -1.015 22.588 3.536 1.00 0.00 H new ATOM 0 HB2 GLU A 437 0.259 23.727 1.983 1.00 0.00 H new ATOM 0 HB3 GLU A 437 1.528 24.115 3.126 1.00 0.00 H new ATOM 0 HG2 GLU A 437 2.515 21.969 2.975 1.00 0.00 H new ATOM 0 HG3 GLU A 437 1.038 21.216 2.406 1.00 0.00 H new ATOM 372 N CYS A 438 0.260 20.595 4.380 1.00 0.00 N ATOM 373 CA CYS A 438 0.771 19.431 5.082 1.00 0.00 C ATOM 374 C CYS A 438 1.260 18.420 4.043 1.00 0.00 C ATOM 375 O CYS A 438 0.570 18.152 3.059 1.00 0.00 O ATOM 376 CB CYS A 438 -0.280 18.828 6.016 1.00 0.00 C ATOM 377 SG CYS A 438 0.115 17.151 6.634 1.00 0.00 S ATOM 0 H CYS A 438 -0.302 20.383 3.556 1.00 0.00 H new ATOM 0 HA CYS A 438 1.604 19.724 5.721 1.00 0.00 H new ATOM 0 HB2 CYS A 438 -0.412 19.493 6.870 1.00 0.00 H new ATOM 0 HB3 CYS A 438 -1.234 18.791 5.491 1.00 0.00 H new ATOM 382 N GLN A 439 2.445 17.885 4.296 1.00 0.00 N ATOM 383 CA GLN A 439 3.034 16.909 3.395 1.00 0.00 C ATOM 384 C GLN A 439 2.412 15.531 3.625 1.00 0.00 C ATOM 385 O GLN A 439 2.110 15.164 4.760 1.00 0.00 O ATOM 386 CB GLN A 439 4.554 16.858 3.559 1.00 0.00 C ATOM 387 CG GLN A 439 5.184 18.219 3.256 1.00 0.00 C ATOM 388 CD GLN A 439 6.710 18.151 3.356 1.00 0.00 C ATOM 389 OE1 GLN A 439 7.319 17.101 3.240 1.00 0.00 O ATOM 390 NE2 GLN A 439 7.289 19.328 3.576 1.00 0.00 N ATOM 0 H GLN A 439 3.014 18.109 5.113 1.00 0.00 H new ATOM 0 HA GLN A 439 2.822 17.216 2.371 1.00 0.00 H new ATOM 0 HB2 GLN A 439 4.804 16.556 4.576 1.00 0.00 H new ATOM 0 HB3 GLN A 439 4.970 16.104 2.891 1.00 0.00 H new ATOM 0 HG2 GLN A 439 4.896 18.543 2.256 1.00 0.00 H new ATOM 0 HG3 GLN A 439 4.803 18.964 3.955 1.00 0.00 H new ATOM 0 HE21 GLN A 439 6.718 20.169 3.663 1.00 0.00 H new ATOM 0 HE22 GLN A 439 8.304 19.390 3.658 1.00 0.00 H new ATOM 399 N CYS A 440 2.238 14.804 2.531 1.00 0.00 N ATOM 400 CA CYS A 440 1.658 13.473 2.601 1.00 0.00 C ATOM 401 C CYS A 440 2.762 12.486 2.976 1.00 0.00 C ATOM 402 O CYS A 440 3.882 12.581 2.476 1.00 0.00 O ATOM 403 CB CYS A 440 0.969 13.089 1.288 1.00 0.00 C ATOM 404 SG CYS A 440 0.418 14.503 0.266 1.00 0.00 S ATOM 0 H CYS A 440 2.488 15.111 1.591 1.00 0.00 H new ATOM 0 HA CYS A 440 0.880 13.451 3.365 1.00 0.00 H new ATOM 0 HB2 CYS A 440 1.655 12.479 0.699 1.00 0.00 H new ATOM 0 HB3 CYS A 440 0.104 12.466 1.517 1.00 0.00 H new ATOM 409 N LEU A 441 2.409 11.558 3.855 1.00 0.00 N ATOM 410 CA LEU A 441 3.357 10.554 4.304 1.00 0.00 C ATOM 411 C LEU A 441 2.988 9.201 3.693 1.00 0.00 C ATOM 412 O LEU A 441 2.079 8.527 4.173 1.00 0.00 O ATOM 413 CB LEU A 441 3.437 10.538 5.832 1.00 0.00 C ATOM 414 CG LEU A 441 4.845 10.535 6.431 1.00 0.00 C ATOM 415 CD1 LEU A 441 5.653 9.337 5.928 1.00 0.00 C ATOM 416 CD2 LEU A 441 5.559 11.861 6.158 1.00 0.00 C ATOM 0 H LEU A 441 1.479 11.481 4.267 1.00 0.00 H new ATOM 0 HA LEU A 441 4.362 10.797 3.958 1.00 0.00 H new ATOM 0 HB2 LEU A 441 2.904 11.409 6.213 1.00 0.00 H new ATOM 0 HB3 LEU A 441 2.908 9.657 6.194 1.00 0.00 H new ATOM 0 HG LEU A 441 4.755 10.432 7.512 1.00 0.00 H new ATOM 0 HD11 LEU A 441 6.650 9.359 6.369 1.00 0.00 H new ATOM 0 HD12 LEU A 441 5.150 8.413 6.214 1.00 0.00 H new ATOM 0 HD13 LEU A 441 5.736 9.384 4.842 1.00 0.00 H new ATOM 0 HD21 LEU A 441 6.558 11.833 6.594 1.00 0.00 H new ATOM 0 HD22 LEU A 441 5.637 12.017 5.082 1.00 0.00 H new ATOM 0 HD23 LEU A 441 4.991 12.678 6.603 1.00 0.00 H new ATOM 428 N GLN A 442 3.712 8.845 2.643 1.00 0.00 N ATOM 429 CA GLN A 442 3.471 7.584 1.961 1.00 0.00 C ATOM 430 C GLN A 442 2.138 7.631 1.213 1.00 0.00 C ATOM 431 O GLN A 442 2.079 8.074 0.068 1.00 0.00 O ATOM 432 CB GLN A 442 3.508 6.412 2.946 1.00 0.00 C ATOM 433 CG GLN A 442 4.854 5.688 2.885 1.00 0.00 C ATOM 434 CD GLN A 442 5.342 5.321 4.288 1.00 0.00 C ATOM 435 OE1 GLN A 442 5.316 6.332 5.151 1.00 0.00 O flip ATOM 436 NE2 GLN A 442 5.718 4.193 4.568 1.00 0.00 N flip ATOM 0 H GLN A 442 4.466 9.407 2.247 1.00 0.00 H new ATOM 0 HA GLN A 442 4.267 7.429 1.233 1.00 0.00 H new ATOM 0 HB2 GLN A 442 3.333 6.777 3.958 1.00 0.00 H new ATOM 0 HB3 GLN A 442 2.704 5.713 2.716 1.00 0.00 H new ATOM 0 HG2 GLN A 442 4.759 4.785 2.281 1.00 0.00 H new ATOM 0 HG3 GLN A 442 5.591 6.323 2.394 1.00 0.00 H new ATOM 0 HE21 GLN A 442 5.712 3.462 3.856 1.00 0.00 H new ATOM 0 HE22 GLN A 442 6.038 3.982 5.513 1.00 0.00 H new ATOM 445 N GLY A 443 1.099 7.165 1.892 1.00 0.00 N ATOM 446 CA GLY A 443 -0.231 7.148 1.306 1.00 0.00 C ATOM 447 C GLY A 443 -1.262 7.732 2.274 1.00 0.00 C ATOM 448 O GLY A 443 -2.028 6.993 2.891 1.00 0.00 O ATOM 0 H GLY A 443 1.152 6.797 2.842 1.00 0.00 H new ATOM 0 HA2 GLY A 443 -0.231 7.721 0.379 1.00 0.00 H new ATOM 0 HA3 GLY A 443 -0.506 6.125 1.049 1.00 0.00 H new ATOM 452 N TYR A 444 -1.252 9.053 2.375 1.00 0.00 N ATOM 453 CA TYR A 444 -2.178 9.744 3.255 1.00 0.00 C ATOM 454 C TYR A 444 -3.332 10.361 2.464 1.00 0.00 C ATOM 455 O TYR A 444 -3.230 10.543 1.252 1.00 0.00 O ATOM 456 CB TYR A 444 -1.374 10.865 3.918 1.00 0.00 C ATOM 457 CG TYR A 444 -1.143 10.662 5.417 1.00 0.00 C ATOM 458 CD1 TYR A 444 -0.294 9.666 5.857 1.00 0.00 C ATOM 459 CD2 TYR A 444 -1.782 11.477 6.330 1.00 0.00 C ATOM 460 CE1 TYR A 444 -0.077 9.477 7.268 1.00 0.00 C ATOM 461 CE2 TYR A 444 -1.565 11.286 7.740 1.00 0.00 C ATOM 462 CZ TYR A 444 -0.724 10.296 8.140 1.00 0.00 C ATOM 463 OH TYR A 444 -0.518 10.117 9.473 1.00 0.00 O ATOM 0 H TYR A 444 -0.616 9.663 1.861 1.00 0.00 H new ATOM 0 HA TYR A 444 -2.606 9.051 3.979 1.00 0.00 H new ATOM 0 HB2 TYR A 444 -0.408 10.949 3.420 1.00 0.00 H new ATOM 0 HB3 TYR A 444 -1.894 11.811 3.766 1.00 0.00 H new ATOM 0 HD1 TYR A 444 0.207 9.029 5.143 1.00 0.00 H new ATOM 0 HD2 TYR A 444 -2.444 12.258 5.986 1.00 0.00 H new ATOM 0 HE1 TYR A 444 0.585 8.702 7.626 1.00 0.00 H new ATOM 0 HE2 TYR A 444 -2.060 11.916 8.465 1.00 0.00 H new ATOM 0 HH TYR A 444 -0.684 10.959 9.946 1.00 0.00 H new ATOM 473 N THR A 445 -4.404 10.665 3.180 1.00 0.00 N ATOM 474 CA THR A 445 -5.576 11.258 2.560 1.00 0.00 C ATOM 475 C THR A 445 -5.656 12.750 2.888 1.00 0.00 C ATOM 476 O THR A 445 -4.676 13.478 2.728 1.00 0.00 O ATOM 477 CB THR A 445 -6.804 10.469 3.018 1.00 0.00 C ATOM 478 OG1 THR A 445 -7.902 11.176 2.451 1.00 0.00 O ATOM 479 CG2 THR A 445 -7.035 10.569 4.527 1.00 0.00 C ATOM 0 H THR A 445 -4.485 10.511 4.185 1.00 0.00 H new ATOM 0 HA THR A 445 -5.520 11.199 1.473 1.00 0.00 H new ATOM 0 HB THR A 445 -6.688 9.422 2.738 1.00 0.00 H new ATOM 0 HG1 THR A 445 -7.620 11.603 1.615 1.00 0.00 H new ATOM 0 HG21 THR A 445 -7.918 9.991 4.799 1.00 0.00 H new ATOM 0 HG22 THR A 445 -6.167 10.174 5.055 1.00 0.00 H new ATOM 0 HG23 THR A 445 -7.185 11.613 4.804 1.00 0.00 H new ATOM 487 N GLY A 446 -6.832 13.163 3.340 1.00 0.00 N ATOM 488 CA GLY A 446 -7.051 14.555 3.689 1.00 0.00 C ATOM 489 C GLY A 446 -7.411 15.382 2.454 1.00 0.00 C ATOM 490 O GLY A 446 -7.120 14.980 1.327 1.00 0.00 O ATOM 0 H GLY A 446 -7.642 12.557 3.472 1.00 0.00 H new ATOM 0 HA2 GLY A 446 -7.852 14.627 4.425 1.00 0.00 H new ATOM 0 HA3 GLY A 446 -6.153 14.962 4.154 1.00 0.00 H new ATOM 494 N PRO A 447 -8.053 16.553 2.712 1.00 0.00 N ATOM 495 CA PRO A 447 -8.454 17.439 1.634 1.00 0.00 C ATOM 496 C PRO A 447 -7.248 18.188 1.062 1.00 0.00 C ATOM 497 O PRO A 447 -7.242 18.557 -0.113 1.00 0.00 O ATOM 498 CB PRO A 447 -9.489 18.366 2.250 1.00 0.00 C ATOM 499 CG PRO A 447 -9.293 18.270 3.753 1.00 0.00 C ATOM 500 CD PRO A 447 -8.414 17.059 4.032 1.00 0.00 C ATOM 0 HA PRO A 447 -8.875 16.902 0.784 1.00 0.00 H new ATOM 0 HB2 PRO A 447 -9.352 19.390 1.903 1.00 0.00 H new ATOM 0 HB3 PRO A 447 -10.498 18.067 1.968 1.00 0.00 H new ATOM 0 HG2 PRO A 447 -8.826 19.177 4.136 1.00 0.00 H new ATOM 0 HG3 PRO A 447 -10.254 18.169 4.258 1.00 0.00 H new ATOM 0 HD2 PRO A 447 -7.529 17.335 4.606 1.00 0.00 H new ATOM 0 HD3 PRO A 447 -8.948 16.307 4.612 1.00 0.00 H new ATOM 508 N ARG A 448 -6.258 18.390 1.917 1.00 0.00 N ATOM 509 CA ARG A 448 -5.050 19.087 1.512 1.00 0.00 C ATOM 510 C ARG A 448 -3.831 18.174 1.667 1.00 0.00 C ATOM 511 O ARG A 448 -2.695 18.616 1.502 1.00 0.00 O ATOM 512 CB ARG A 448 -4.838 20.353 2.346 1.00 0.00 C ATOM 513 CG ARG A 448 -6.135 21.156 2.463 1.00 0.00 C ATOM 514 CD ARG A 448 -6.372 22.002 1.211 1.00 0.00 C ATOM 515 NE ARG A 448 -5.260 22.962 1.032 1.00 0.00 N ATOM 516 CZ ARG A 448 -5.071 23.702 -0.081 1.00 0.00 C ATOM 517 NH1 ARG A 448 -5.920 23.600 -1.124 1.00 0.00 N ATOM 518 NH2 ARG A 448 -4.042 24.528 -0.134 1.00 0.00 N ATOM 0 H ARG A 448 -6.267 18.083 2.890 1.00 0.00 H new ATOM 0 HA ARG A 448 -5.166 19.369 0.466 1.00 0.00 H new ATOM 0 HB2 ARG A 448 -4.483 20.082 3.340 1.00 0.00 H new ATOM 0 HB3 ARG A 448 -4.065 20.969 1.888 1.00 0.00 H new ATOM 0 HG2 ARG A 448 -6.975 20.477 2.612 1.00 0.00 H new ATOM 0 HG3 ARG A 448 -6.089 21.802 3.339 1.00 0.00 H new ATOM 0 HD2 ARG A 448 -6.451 21.357 0.336 1.00 0.00 H new ATOM 0 HD3 ARG A 448 -7.317 22.539 1.298 1.00 0.00 H new ATOM 0 HE ARG A 448 -4.595 23.071 1.798 1.00 0.00 H new ATOM 0 HH11 ARG A 448 -6.713 22.960 -1.076 1.00 0.00 H new ATOM 0 HH12 ARG A 448 -5.769 24.163 -1.961 1.00 0.00 H new ATOM 0 HH21 ARG A 448 -3.404 24.600 0.659 1.00 0.00 H new ATOM 0 HH22 ARG A 448 -3.885 25.094 -0.968 1.00 0.00 H new ATOM 531 N CYS A 449 -4.111 16.917 1.981 1.00 0.00 N ATOM 532 CA CYS A 449 -3.053 15.938 2.159 1.00 0.00 C ATOM 533 C CYS A 449 -2.504 16.077 3.581 1.00 0.00 C ATOM 534 O CYS A 449 -1.319 16.352 3.769 1.00 0.00 O ATOM 535 CB CYS A 449 -1.954 16.093 1.106 1.00 0.00 C ATOM 536 SG CYS A 449 -1.507 14.551 0.230 1.00 0.00 S ATOM 0 H CYS A 449 -5.055 16.555 2.116 1.00 0.00 H new ATOM 0 HA CYS A 449 -3.457 14.935 2.022 1.00 0.00 H new ATOM 0 HB2 CYS A 449 -2.276 16.831 0.371 1.00 0.00 H new ATOM 0 HB3 CYS A 449 -1.062 16.492 1.589 1.00 0.00 H new ATOM 541 N GLU A 450 -3.391 15.882 4.545 1.00 0.00 N ATOM 542 CA GLU A 450 -3.011 15.982 5.944 1.00 0.00 C ATOM 543 C GLU A 450 -3.815 14.988 6.786 1.00 0.00 C ATOM 544 O GLU A 450 -3.813 15.067 8.013 1.00 0.00 O ATOM 545 CB GLU A 450 -3.192 17.410 6.461 1.00 0.00 C ATOM 546 CG GLU A 450 -3.673 18.340 5.344 1.00 0.00 C ATOM 547 CD GLU A 450 -5.136 18.059 4.990 1.00 0.00 C ATOM 548 OE1 GLU A 450 -5.412 17.312 4.042 1.00 0.00 O ATOM 549 OE2 GLU A 450 -6.002 18.649 5.744 1.00 0.00 O ATOM 0 H GLU A 450 -4.372 15.655 4.385 1.00 0.00 H new ATOM 0 HA GLU A 450 -1.954 15.730 6.031 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -3.912 17.416 7.279 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -2.248 17.777 6.864 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -3.564 19.378 5.658 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -3.049 18.207 4.460 1.00 0.00 H new ATOM 557 N ILE A 451 -4.481 14.077 6.092 1.00 0.00 N ATOM 558 CA ILE A 451 -5.288 13.070 6.760 1.00 0.00 C ATOM 559 C ILE A 451 -4.837 11.680 6.307 1.00 0.00 C ATOM 560 O ILE A 451 -4.596 11.456 5.122 1.00 0.00 O ATOM 561 CB ILE A 451 -6.777 13.338 6.532 1.00 0.00 C ATOM 562 CG1 ILE A 451 -7.241 14.562 7.323 1.00 0.00 C ATOM 563 CG2 ILE A 451 -7.612 12.096 6.851 1.00 0.00 C ATOM 564 CD1 ILE A 451 -6.480 15.816 6.890 1.00 0.00 C ATOM 0 H ILE A 451 -4.478 14.015 5.074 1.00 0.00 H new ATOM 0 HA ILE A 451 -5.141 13.118 7.839 1.00 0.00 H new ATOM 0 HB ILE A 451 -6.927 13.563 5.476 1.00 0.00 H new ATOM 0 HG12 ILE A 451 -8.310 14.712 7.174 1.00 0.00 H new ATOM 0 HG13 ILE A 451 -7.089 14.390 8.389 1.00 0.00 H new ATOM 0 HG21 ILE A 451 -8.667 12.313 6.681 1.00 0.00 H new ATOM 0 HG22 ILE A 451 -7.302 11.274 6.206 1.00 0.00 H new ATOM 0 HG23 ILE A 451 -7.463 11.815 7.894 1.00 0.00 H new ATOM 0 HD11 ILE A 451 -6.829 16.671 7.468 1.00 0.00 H new ATOM 0 HD12 ILE A 451 -5.413 15.672 7.063 1.00 0.00 H new ATOM 0 HD13 ILE A 451 -6.654 15.999 5.830 1.00 0.00 H new ATOM 576 N ASP A 452 -4.735 10.781 7.277 1.00 0.00 N ATOM 577 CA ASP A 452 -4.318 9.419 6.992 1.00 0.00 C ATOM 578 C ASP A 452 -5.556 8.535 6.821 1.00 0.00 C ATOM 579 O ASP A 452 -6.442 8.532 7.675 1.00 0.00 O ATOM 580 CB ASP A 452 -3.484 8.848 8.141 1.00 0.00 C ATOM 581 CG ASP A 452 -2.402 7.851 7.722 1.00 0.00 C ATOM 582 OD1 ASP A 452 -1.463 7.571 8.482 1.00 0.00 O ATOM 583 OD2 ASP A 452 -2.553 7.344 6.546 1.00 0.00 O ATOM 0 H ASP A 452 -4.934 10.970 8.259 1.00 0.00 H new ATOM 0 HA ASP A 452 -3.718 9.433 6.082 1.00 0.00 H new ATOM 0 HB2 ASP A 452 -3.010 9.674 8.671 1.00 0.00 H new ATOM 0 HB3 ASP A 452 -4.154 8.358 8.848 1.00 0.00 H new ATOM 589 N VAL A 453 -5.575 7.809 5.713 1.00 0.00 N ATOM 590 CA VAL A 453 -6.690 6.923 5.420 1.00 0.00 C ATOM 591 C VAL A 453 -6.339 5.504 5.871 1.00 0.00 C ATOM 592 O VAL A 453 -5.191 5.220 6.206 1.00 0.00 O ATOM 593 CB VAL A 453 -7.047 7.006 3.935 1.00 0.00 C ATOM 594 CG1 VAL A 453 -5.793 6.916 3.064 1.00 0.00 C ATOM 595 CG2 VAL A 453 -8.062 5.926 3.554 1.00 0.00 C ATOM 0 H VAL A 453 -4.838 7.816 5.008 1.00 0.00 H new ATOM 0 HA VAL A 453 -7.578 7.230 5.972 1.00 0.00 H new ATOM 0 HB VAL A 453 -7.509 7.976 3.754 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -6.075 6.977 2.013 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.121 7.738 3.308 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -5.288 5.968 3.249 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -8.299 6.007 2.493 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -7.640 4.942 3.757 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -8.972 6.059 4.140 1.00 0.00 H new ATOM 605 N ASN A 454 -7.352 4.648 5.866 1.00 0.00 N ATOM 606 CA ASN A 454 -7.166 3.265 6.271 1.00 0.00 C ATOM 607 C ASN A 454 -7.079 2.382 5.024 1.00 0.00 C ATOM 608 O ASN A 454 -8.093 2.098 4.388 1.00 0.00 O ATOM 609 CB ASN A 454 -8.343 2.777 7.117 1.00 0.00 C ATOM 610 CG ASN A 454 -8.020 1.438 7.784 1.00 0.00 C ATOM 611 OD1 ASN A 454 -7.755 0.439 7.135 1.00 0.00 O ATOM 612 ND2 ASN A 454 -8.054 1.475 9.113 1.00 0.00 N ATOM 0 H ASN A 454 -8.304 4.886 5.588 1.00 0.00 H new ATOM 0 HA ASN A 454 -6.250 3.204 6.859 1.00 0.00 H new ATOM 0 HB2 ASN A 454 -8.580 3.519 7.879 1.00 0.00 H new ATOM 0 HB3 ASN A 454 -9.228 2.671 6.489 1.00 0.00 H new ATOM 0 HD21 ASN A 454 -7.851 0.633 9.652 1.00 0.00 H new ATOM 0 HD22 ASN A 454 -8.283 2.345 9.593 1.00 0.00 H new ATOM 619 N GLU A 455 -5.859 1.970 4.714 1.00 0.00 N ATOM 620 CA GLU A 455 -5.626 1.124 3.555 1.00 0.00 C ATOM 621 C GLU A 455 -5.870 -0.344 3.913 1.00 0.00 C ATOM 622 O GLU A 455 -5.987 -1.191 3.028 1.00 0.00 O ATOM 623 CB GLU A 455 -4.215 1.327 3.003 1.00 0.00 C ATOM 624 CG GLU A 455 -3.177 1.293 4.125 1.00 0.00 C ATOM 625 CD GLU A 455 -2.859 2.706 4.622 1.00 0.00 C ATOM 626 OE1 GLU A 455 -1.776 2.939 5.179 1.00 0.00 O ATOM 627 OE2 GLU A 455 -3.785 3.579 4.411 1.00 0.00 O ATOM 0 H GLU A 455 -5.021 2.206 5.245 1.00 0.00 H new ATOM 0 HA GLU A 455 -6.330 1.409 2.773 1.00 0.00 H new ATOM 0 HB2 GLU A 455 -3.991 0.550 2.272 1.00 0.00 H new ATOM 0 HB3 GLU A 455 -4.159 2.282 2.480 1.00 0.00 H new ATOM 0 HG2 GLU A 455 -3.550 0.688 4.952 1.00 0.00 H new ATOM 0 HG3 GLU A 455 -2.265 0.816 3.767 1.00 0.00 H new ATOM 635 N CYS A 456 -5.941 -0.600 5.212 1.00 0.00 N ATOM 636 CA CYS A 456 -6.169 -1.950 5.696 1.00 0.00 C ATOM 637 C CYS A 456 -7.677 -2.163 5.836 1.00 0.00 C ATOM 638 O CYS A 456 -8.118 -3.188 6.353 1.00 0.00 O ATOM 639 CB CYS A 456 -5.431 -2.211 7.011 1.00 0.00 C ATOM 640 SG CYS A 456 -5.199 -3.979 7.423 1.00 0.00 S ATOM 0 H CYS A 456 -5.845 0.105 5.943 1.00 0.00 H new ATOM 0 HA CYS A 456 -5.767 -2.668 4.981 1.00 0.00 H new ATOM 0 HB2 CYS A 456 -4.453 -1.732 6.964 1.00 0.00 H new ATOM 0 HB3 CYS A 456 -5.981 -1.733 7.821 1.00 0.00 H new ATOM 645 N VAL A 457 -8.426 -1.176 5.367 1.00 0.00 N ATOM 646 CA VAL A 457 -9.877 -1.242 5.434 1.00 0.00 C ATOM 647 C VAL A 457 -10.392 -2.172 4.332 1.00 0.00 C ATOM 648 O VAL A 457 -11.055 -3.167 4.616 1.00 0.00 O ATOM 649 CB VAL A 457 -10.469 0.167 5.353 1.00 0.00 C ATOM 650 CG1 VAL A 457 -11.419 0.295 4.161 1.00 0.00 C ATOM 651 CG2 VAL A 457 -11.174 0.540 6.659 1.00 0.00 C ATOM 0 H VAL A 457 -8.056 -0.327 4.939 1.00 0.00 H new ATOM 0 HA VAL A 457 -10.197 -1.660 6.388 1.00 0.00 H new ATOM 0 HB VAL A 457 -9.648 0.868 5.203 1.00 0.00 H new ATOM 0 HG11 VAL A 457 -11.826 1.306 4.127 1.00 0.00 H new ATOM 0 HG12 VAL A 457 -10.875 0.091 3.239 1.00 0.00 H new ATOM 0 HG13 VAL A 457 -12.234 -0.421 4.267 1.00 0.00 H new ATOM 0 HG21 VAL A 457 -11.586 1.546 6.576 1.00 0.00 H new ATOM 0 HG22 VAL A 457 -11.980 -0.168 6.852 1.00 0.00 H new ATOM 0 HG23 VAL A 457 -10.459 0.508 7.481 1.00 0.00 H new ATOM 661 N SER A 458 -10.067 -1.811 3.099 1.00 0.00 N ATOM 662 CA SER A 458 -10.489 -2.600 1.954 1.00 0.00 C ATOM 663 C SER A 458 -9.368 -3.554 1.535 1.00 0.00 C ATOM 664 O SER A 458 -9.482 -4.242 0.522 1.00 0.00 O ATOM 665 CB SER A 458 -10.888 -1.701 0.782 1.00 0.00 C ATOM 666 OG SER A 458 -12.182 -1.133 0.961 1.00 0.00 O ATOM 0 H SER A 458 -9.517 -0.984 2.868 1.00 0.00 H new ATOM 0 HA SER A 458 -11.364 -3.182 2.243 1.00 0.00 H new ATOM 0 HB2 SER A 458 -10.154 -0.903 0.671 1.00 0.00 H new ATOM 0 HB3 SER A 458 -10.871 -2.280 -0.141 1.00 0.00 H new ATOM 0 HG SER A 458 -12.399 -0.565 0.193 1.00 0.00 H new ATOM 672 N ASN A 459 -8.310 -3.561 2.333 1.00 0.00 N ATOM 673 CA ASN A 459 -7.171 -4.418 2.056 1.00 0.00 C ATOM 674 C ASN A 459 -6.643 -4.998 3.370 1.00 0.00 C ATOM 675 O ASN A 459 -5.447 -4.929 3.648 1.00 0.00 O ATOM 676 CB ASN A 459 -6.035 -3.630 1.399 1.00 0.00 C ATOM 677 CG ASN A 459 -6.585 -2.591 0.418 1.00 0.00 C ATOM 678 OD1 ASN A 459 -7.310 -1.635 0.993 1.00 0.00 O flip ATOM 679 ND2 ASN A 459 -6.365 -2.655 -0.780 1.00 0.00 N flip ATOM 0 H ASN A 459 -8.218 -2.987 3.171 1.00 0.00 H new ATOM 0 HA ASN A 459 -7.500 -5.208 1.381 1.00 0.00 H new ATOM 0 HB2 ASN A 459 -5.441 -3.133 2.166 1.00 0.00 H new ATOM 0 HB3 ASN A 459 -5.369 -4.315 0.874 1.00 0.00 H new ATOM 0 HD21 ASN A 459 -5.800 -3.417 -1.155 1.00 0.00 H new ATOM 0 HD22 ASN A 459 -6.746 -1.947 -1.407 1.00 0.00 H new ATOM 686 N PRO A 460 -7.586 -5.570 4.165 1.00 0.00 N ATOM 687 CA PRO A 460 -7.230 -6.162 5.444 1.00 0.00 C ATOM 688 C PRO A 460 -6.527 -7.508 5.249 1.00 0.00 C ATOM 689 O PRO A 460 -6.199 -8.187 6.220 1.00 0.00 O ATOM 690 CB PRO A 460 -8.541 -6.282 6.202 1.00 0.00 C ATOM 691 CG PRO A 460 -9.639 -6.187 5.154 1.00 0.00 C ATOM 692 CD PRO A 460 -9.013 -5.670 3.868 1.00 0.00 C ATOM 0 HA PRO A 460 -6.517 -5.556 6.003 1.00 0.00 H new ATOM 0 HB2 PRO A 460 -8.596 -7.228 6.740 1.00 0.00 H new ATOM 0 HB3 PRO A 460 -8.638 -5.488 6.942 1.00 0.00 H new ATOM 0 HG2 PRO A 460 -10.096 -7.163 4.991 1.00 0.00 H new ATOM 0 HG3 PRO A 460 -10.430 -5.517 5.490 1.00 0.00 H new ATOM 0 HD2 PRO A 460 -9.198 -6.350 3.036 1.00 0.00 H new ATOM 0 HD3 PRO A 460 -9.428 -4.702 3.587 1.00 0.00 H new ATOM 700 N CYS A 461 -6.317 -7.851 3.985 1.00 0.00 N ATOM 701 CA CYS A 461 -5.661 -9.103 3.652 1.00 0.00 C ATOM 702 C CYS A 461 -6.633 -10.248 3.940 1.00 0.00 C ATOM 703 O CYS A 461 -6.215 -11.392 4.119 1.00 0.00 O ATOM 704 CB CYS A 461 -4.341 -9.270 4.408 1.00 0.00 C ATOM 705 SG CYS A 461 -2.858 -8.700 3.500 1.00 0.00 S ATOM 0 H CYS A 461 -6.589 -7.284 3.182 1.00 0.00 H new ATOM 0 HA CYS A 461 -5.400 -9.108 2.594 1.00 0.00 H new ATOM 0 HB2 CYS A 461 -4.406 -8.723 5.349 1.00 0.00 H new ATOM 0 HB3 CYS A 461 -4.213 -10.323 4.659 1.00 0.00 H new ATOM 710 N GLN A 462 -7.911 -9.903 3.976 1.00 0.00 N ATOM 711 CA GLN A 462 -8.946 -10.887 4.241 1.00 0.00 C ATOM 712 C GLN A 462 -9.024 -11.186 5.739 1.00 0.00 C ATOM 713 O GLN A 462 -8.607 -10.371 6.561 1.00 0.00 O ATOM 714 CB GLN A 462 -8.704 -12.167 3.438 1.00 0.00 C ATOM 715 CG GLN A 462 -8.347 -11.843 1.984 1.00 0.00 C ATOM 716 CD GLN A 462 -8.546 -13.065 1.086 1.00 0.00 C ATOM 717 OE1 GLN A 462 -7.773 -14.101 1.401 1.00 0.00 O flip ATOM 718 NE2 GLN A 462 -9.349 -13.068 0.167 1.00 0.00 N flip ATOM 0 H GLN A 462 -8.254 -8.954 3.826 1.00 0.00 H new ATOM 0 HA GLN A 462 -9.903 -10.473 3.923 1.00 0.00 H new ATOM 0 HB2 GLN A 462 -7.898 -12.740 3.895 1.00 0.00 H new ATOM 0 HB3 GLN A 462 -9.596 -12.793 3.467 1.00 0.00 H new ATOM 0 HG2 GLN A 462 -8.967 -11.021 1.628 1.00 0.00 H new ATOM 0 HG3 GLN A 462 -7.311 -11.509 1.926 1.00 0.00 H new ATOM 0 HE21 GLN A 462 -9.912 -12.238 -0.021 1.00 0.00 H new ATOM 0 HE22 GLN A 462 -9.457 -13.900 -0.413 1.00 0.00 H new ATOM 727 N ASN A 463 -9.558 -12.360 6.048 1.00 0.00 N ATOM 728 CA ASN A 463 -9.695 -12.777 7.434 1.00 0.00 C ATOM 729 C ASN A 463 -8.490 -13.633 7.825 1.00 0.00 C ATOM 730 O ASN A 463 -8.235 -13.849 9.008 1.00 0.00 O ATOM 731 CB ASN A 463 -10.958 -13.617 7.633 1.00 0.00 C ATOM 732 CG ASN A 463 -11.012 -14.772 6.630 1.00 0.00 C ATOM 733 OD1 ASN A 463 -11.521 -14.438 5.448 1.00 0.00 O flip ATOM 734 ND2 ASN A 463 -10.616 -15.891 6.912 1.00 0.00 N flip ATOM 0 H ASN A 463 -9.900 -13.034 5.363 1.00 0.00 H new ATOM 0 HA ASN A 463 -9.757 -11.881 8.052 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.980 -14.011 8.649 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -11.840 -12.987 7.516 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -10.236 -16.079 7.840 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -10.665 -16.639 6.220 1.00 0.00 H new ATOM 741 N ASP A 464 -7.780 -14.099 6.807 1.00 0.00 N ATOM 742 CA ASP A 464 -6.607 -14.928 7.031 1.00 0.00 C ATOM 743 C ASP A 464 -5.368 -14.036 7.126 1.00 0.00 C ATOM 744 O ASP A 464 -4.338 -14.331 6.519 1.00 0.00 O ATOM 745 CB ASP A 464 -6.397 -15.908 5.875 1.00 0.00 C ATOM 746 CG ASP A 464 -7.207 -17.202 5.967 1.00 0.00 C ATOM 747 OD1 ASP A 464 -8.388 -17.191 6.348 1.00 0.00 O ATOM 748 OD2 ASP A 464 -6.570 -18.270 5.624 1.00 0.00 O ATOM 0 H ASP A 464 -7.994 -13.918 5.826 1.00 0.00 H new ATOM 0 HA ASP A 464 -6.760 -15.487 7.954 1.00 0.00 H new ATOM 0 HB2 ASP A 464 -6.650 -15.405 4.942 1.00 0.00 H new ATOM 0 HB3 ASP A 464 -5.339 -16.163 5.823 1.00 0.00 H new ATOM 754 N ALA A 465 -5.508 -12.964 7.892 1.00 0.00 N ATOM 755 CA ALA A 465 -4.412 -12.028 8.075 1.00 0.00 C ATOM 756 C ALA A 465 -4.857 -10.907 9.017 1.00 0.00 C ATOM 757 O ALA A 465 -5.862 -10.243 8.767 1.00 0.00 O ATOM 758 CB ALA A 465 -3.960 -11.499 6.712 1.00 0.00 C ATOM 0 H ALA A 465 -6.363 -12.723 8.393 1.00 0.00 H new ATOM 0 HA ALA A 465 -3.556 -12.523 8.533 1.00 0.00 H new ATOM 0 HB1 ALA A 465 -3.138 -10.797 6.849 1.00 0.00 H new ATOM 0 HB2 ALA A 465 -3.627 -12.331 6.091 1.00 0.00 H new ATOM 0 HB3 ALA A 465 -4.793 -10.992 6.224 1.00 0.00 H new ATOM 764 N THR A 466 -4.086 -10.729 10.080 1.00 0.00 N ATOM 765 CA THR A 466 -4.389 -9.701 11.060 1.00 0.00 C ATOM 766 C THR A 466 -4.182 -8.311 10.455 1.00 0.00 C ATOM 767 O THR A 466 -3.049 -7.899 10.205 1.00 0.00 O ATOM 768 CB THR A 466 -3.526 -9.958 12.297 1.00 0.00 C ATOM 769 OG1 THR A 466 -3.543 -11.375 12.444 1.00 0.00 O ATOM 770 CG2 THR A 466 -4.177 -9.443 13.582 1.00 0.00 C ATOM 0 H THR A 466 -3.252 -11.280 10.284 1.00 0.00 H new ATOM 0 HA THR A 466 -5.436 -9.739 11.362 1.00 0.00 H new ATOM 0 HB THR A 466 -2.554 -9.482 12.166 1.00 0.00 H new ATOM 0 HG1 THR A 466 -3.005 -11.630 13.223 1.00 0.00 H new ATOM 0 HG21 THR A 466 -3.524 -9.651 14.429 1.00 0.00 H new ATOM 0 HG22 THR A 466 -4.338 -8.368 13.503 1.00 0.00 H new ATOM 0 HG23 THR A 466 -5.134 -9.943 13.731 1.00 0.00 H new ATOM 778 N CYS A 467 -5.294 -7.625 10.236 1.00 0.00 N ATOM 779 CA CYS A 467 -5.251 -6.289 9.664 1.00 0.00 C ATOM 780 C CYS A 467 -4.659 -5.340 10.708 1.00 0.00 C ATOM 781 O CYS A 467 -5.100 -5.322 11.856 1.00 0.00 O ATOM 782 CB CYS A 467 -6.631 -5.831 9.192 1.00 0.00 C ATOM 783 SG CYS A 467 -6.778 -4.033 8.881 1.00 0.00 S ATOM 0 H CYS A 467 -6.231 -7.969 10.444 1.00 0.00 H new ATOM 0 HA CYS A 467 -4.619 -6.290 8.776 1.00 0.00 H new ATOM 0 HB2 CYS A 467 -6.882 -6.366 8.276 1.00 0.00 H new ATOM 0 HB3 CYS A 467 -7.369 -6.118 9.941 1.00 0.00 H new ATOM 788 N LEU A 468 -3.670 -4.575 10.270 1.00 0.00 N ATOM 789 CA LEU A 468 -3.013 -3.624 11.154 1.00 0.00 C ATOM 790 C LEU A 468 -2.648 -2.368 10.360 1.00 0.00 C ATOM 791 O LEU A 468 -1.506 -2.210 9.931 1.00 0.00 O ATOM 792 CB LEU A 468 -1.819 -4.278 11.853 1.00 0.00 C ATOM 793 CG LEU A 468 -2.148 -5.140 13.074 1.00 0.00 C ATOM 794 CD1 LEU A 468 -0.873 -5.539 13.821 1.00 0.00 C ATOM 795 CD2 LEU A 468 -3.151 -4.435 13.988 1.00 0.00 C ATOM 0 H LEU A 468 -3.307 -4.593 9.317 1.00 0.00 H new ATOM 0 HA LEU A 468 -3.689 -3.314 11.951 1.00 0.00 H new ATOM 0 HB2 LEU A 468 -1.292 -4.897 11.127 1.00 0.00 H new ATOM 0 HB3 LEU A 468 -1.129 -3.493 12.162 1.00 0.00 H new ATOM 0 HG LEU A 468 -2.620 -6.059 12.727 1.00 0.00 H new ATOM 0 HD11 LEU A 468 -1.134 -6.151 14.684 1.00 0.00 H new ATOM 0 HD12 LEU A 468 -0.224 -6.108 13.155 1.00 0.00 H new ATOM 0 HD13 LEU A 468 -0.352 -4.642 14.156 1.00 0.00 H new ATOM 0 HD21 LEU A 468 -3.368 -5.069 14.848 1.00 0.00 H new ATOM 0 HD22 LEU A 468 -2.729 -3.490 14.331 1.00 0.00 H new ATOM 0 HD23 LEU A 468 -4.072 -4.243 13.438 1.00 0.00 H new ATOM 807 N ASP A 469 -3.640 -1.505 10.192 1.00 0.00 N ATOM 808 CA ASP A 469 -3.437 -0.266 9.458 1.00 0.00 C ATOM 809 C ASP A 469 -2.492 0.640 10.249 1.00 0.00 C ATOM 810 O ASP A 469 -2.725 0.910 11.427 1.00 0.00 O ATOM 811 CB ASP A 469 -4.758 0.482 9.265 1.00 0.00 C ATOM 812 CG ASP A 469 -4.793 1.432 8.068 1.00 0.00 C ATOM 813 OD1 ASP A 469 -5.477 1.173 7.066 1.00 0.00 O ATOM 814 OD2 ASP A 469 -4.071 2.493 8.192 1.00 0.00 O ATOM 0 H ASP A 469 -4.585 -1.639 10.551 1.00 0.00 H new ATOM 0 HA ASP A 469 -3.018 -0.515 8.483 1.00 0.00 H new ATOM 0 HB2 ASP A 469 -5.559 -0.249 9.153 1.00 0.00 H new ATOM 0 HB3 ASP A 469 -4.971 1.053 10.169 1.00 0.00 H new ATOM 820 N GLN A 470 -1.445 1.085 9.569 1.00 0.00 N ATOM 821 CA GLN A 470 -0.463 1.956 10.193 1.00 0.00 C ATOM 822 C GLN A 470 -0.439 3.316 9.492 1.00 0.00 C ATOM 823 O GLN A 470 -1.245 3.574 8.601 1.00 0.00 O ATOM 824 CB GLN A 470 0.924 1.311 10.187 1.00 0.00 C ATOM 825 CG GLN A 470 1.242 0.683 11.546 1.00 0.00 C ATOM 826 CD GLN A 470 1.718 -0.762 11.382 1.00 0.00 C ATOM 827 OE1 GLN A 470 2.888 -1.039 11.182 1.00 0.00 O ATOM 828 NE2 GLN A 470 0.746 -1.666 11.480 1.00 0.00 N ATOM 0 H GLN A 470 -1.255 0.859 8.593 1.00 0.00 H new ATOM 0 HA GLN A 470 -0.751 2.110 11.233 1.00 0.00 H new ATOM 0 HB2 GLN A 470 0.971 0.548 9.410 1.00 0.00 H new ATOM 0 HB3 GLN A 470 1.677 2.061 9.944 1.00 0.00 H new ATOM 0 HG2 GLN A 470 2.011 1.268 12.051 1.00 0.00 H new ATOM 0 HG3 GLN A 470 0.355 0.708 12.179 1.00 0.00 H new ATOM 0 HE21 GLN A 470 -0.214 -1.366 11.649 1.00 0.00 H new ATOM 0 HE22 GLN A 470 0.961 -2.659 11.387 1.00 0.00 H new ATOM 837 N ILE A 471 0.496 4.151 9.923 1.00 0.00 N ATOM 838 CA ILE A 471 0.636 5.478 9.347 1.00 0.00 C ATOM 839 C ILE A 471 1.110 5.354 7.899 1.00 0.00 C ATOM 840 O ILE A 471 2.156 4.764 7.632 1.00 0.00 O ATOM 841 CB ILE A 471 1.544 6.346 10.220 1.00 0.00 C ATOM 842 CG1 ILE A 471 2.625 5.502 10.896 1.00 0.00 C ATOM 843 CG2 ILE A 471 0.727 7.150 11.234 1.00 0.00 C ATOM 844 CD1 ILE A 471 3.346 4.615 9.879 1.00 0.00 C ATOM 0 H ILE A 471 1.163 3.934 10.663 1.00 0.00 H new ATOM 0 HA ILE A 471 -0.327 5.987 9.323 1.00 0.00 H new ATOM 0 HB ILE A 471 2.052 7.063 9.575 1.00 0.00 H new ATOM 0 HG12 ILE A 471 3.345 6.155 11.389 1.00 0.00 H new ATOM 0 HG13 ILE A 471 2.175 4.881 11.671 1.00 0.00 H new ATOM 0 HG21 ILE A 471 1.398 7.758 11.841 1.00 0.00 H new ATOM 0 HG22 ILE A 471 0.028 7.798 10.706 1.00 0.00 H new ATOM 0 HG23 ILE A 471 0.173 6.467 11.878 1.00 0.00 H new ATOM 0 HD11 ILE A 471 4.109 4.026 10.387 1.00 0.00 H new ATOM 0 HD12 ILE A 471 2.627 3.947 9.405 1.00 0.00 H new ATOM 0 HD13 ILE A 471 3.816 5.240 9.120 1.00 0.00 H new ATOM 856 N GLY A 472 0.318 5.920 7.001 1.00 0.00 N ATOM 857 CA GLY A 472 0.644 5.880 5.584 1.00 0.00 C ATOM 858 C GLY A 472 1.190 4.507 5.185 1.00 0.00 C ATOM 859 O GLY A 472 1.936 4.389 4.215 1.00 0.00 O ATOM 0 H GLY A 472 -0.549 6.409 7.226 1.00 0.00 H new ATOM 0 HA2 GLY A 472 -0.246 6.106 4.996 1.00 0.00 H new ATOM 0 HA3 GLY A 472 1.382 6.649 5.355 1.00 0.00 H new ATOM 863 N GLU A 473 0.795 3.503 5.955 1.00 0.00 N ATOM 864 CA GLU A 473 1.235 2.143 5.694 1.00 0.00 C ATOM 865 C GLU A 473 0.388 1.149 6.494 1.00 0.00 C ATOM 866 O GLU A 473 -0.169 1.499 7.533 1.00 0.00 O ATOM 867 CB GLU A 473 2.722 1.976 6.012 1.00 0.00 C ATOM 868 CG GLU A 473 2.960 1.942 7.524 1.00 0.00 C ATOM 869 CD GLU A 473 3.153 0.506 8.016 1.00 0.00 C ATOM 870 OE1 GLU A 473 2.361 -0.381 7.664 1.00 0.00 O ATOM 871 OE2 GLU A 473 4.168 0.328 8.790 1.00 0.00 O ATOM 0 H GLU A 473 0.176 3.604 6.759 1.00 0.00 H new ATOM 0 HA GLU A 473 1.099 1.936 4.633 1.00 0.00 H new ATOM 0 HB2 GLU A 473 3.093 1.055 5.561 1.00 0.00 H new ATOM 0 HB3 GLU A 473 3.286 2.797 5.570 1.00 0.00 H new ATOM 0 HG2 GLU A 473 3.840 2.536 7.771 1.00 0.00 H new ATOM 0 HG3 GLU A 473 2.114 2.396 8.039 1.00 0.00 H new ATOM 879 N PHE A 474 0.320 -0.070 5.978 1.00 0.00 N ATOM 880 CA PHE A 474 -0.449 -1.116 6.631 1.00 0.00 C ATOM 881 C PHE A 474 0.267 -2.464 6.532 1.00 0.00 C ATOM 882 O PHE A 474 1.019 -2.704 5.590 1.00 0.00 O ATOM 883 CB PHE A 474 -1.789 -1.209 5.900 1.00 0.00 C ATOM 884 CG PHE A 474 -1.932 -2.451 5.017 1.00 0.00 C ATOM 885 CD1 PHE A 474 -2.054 -3.679 5.589 1.00 0.00 C ATOM 886 CD2 PHE A 474 -1.935 -2.325 3.664 1.00 0.00 C ATOM 887 CE1 PHE A 474 -2.187 -4.832 4.769 1.00 0.00 C ATOM 888 CE2 PHE A 474 -2.068 -3.478 2.844 1.00 0.00 C ATOM 889 CZ PHE A 474 -2.191 -4.707 3.415 1.00 0.00 C ATOM 0 H PHE A 474 0.784 -0.356 5.116 1.00 0.00 H new ATOM 0 HA PHE A 474 -0.578 -0.879 7.687 1.00 0.00 H new ATOM 0 HB2 PHE A 474 -2.593 -1.204 6.635 1.00 0.00 H new ATOM 0 HB3 PHE A 474 -1.917 -0.320 5.282 1.00 0.00 H new ATOM 0 HD1 PHE A 474 -2.050 -3.778 6.664 1.00 0.00 H new ATOM 0 HD2 PHE A 474 -1.836 -1.349 3.212 1.00 0.00 H new ATOM 0 HE1 PHE A 474 -2.285 -5.808 5.221 1.00 0.00 H new ATOM 0 HE2 PHE A 474 -2.071 -3.379 1.769 1.00 0.00 H new ATOM 0 HZ PHE A 474 -2.292 -5.584 2.792 1.00 0.00 H new ATOM 899 N GLN A 475 0.007 -3.310 7.520 1.00 0.00 N ATOM 900 CA GLN A 475 0.618 -4.628 7.556 1.00 0.00 C ATOM 901 C GLN A 475 -0.417 -5.681 7.956 1.00 0.00 C ATOM 902 O GLN A 475 -1.265 -5.431 8.812 1.00 0.00 O ATOM 903 CB GLN A 475 1.818 -4.650 8.505 1.00 0.00 C ATOM 904 CG GLN A 475 1.425 -5.214 9.872 1.00 0.00 C ATOM 905 CD GLN A 475 1.550 -6.738 9.893 1.00 0.00 C ATOM 906 OE1 GLN A 475 0.385 -7.377 9.958 1.00 0.00 O flip ATOM 907 NE2 GLN A 475 2.633 -7.299 9.854 1.00 0.00 N flip ATOM 0 H GLN A 475 -0.618 -3.108 8.300 1.00 0.00 H new ATOM 0 HA GLN A 475 0.983 -4.866 6.557 1.00 0.00 H new ATOM 0 HB2 GLN A 475 2.616 -5.254 8.074 1.00 0.00 H new ATOM 0 HB3 GLN A 475 2.211 -3.640 8.623 1.00 0.00 H new ATOM 0 HG2 GLN A 475 2.062 -4.783 10.644 1.00 0.00 H new ATOM 0 HG3 GLN A 475 0.400 -4.926 10.107 1.00 0.00 H new ATOM 0 HE21 GLN A 475 3.491 -6.749 9.805 1.00 0.00 H new ATOM 0 HE22 GLN A 475 2.681 -8.318 9.871 1.00 0.00 H new ATOM 916 N CYS A 476 -0.317 -6.837 7.316 1.00 0.00 N ATOM 917 CA CYS A 476 -1.233 -7.930 7.594 1.00 0.00 C ATOM 918 C CYS A 476 -0.408 -9.174 7.928 1.00 0.00 C ATOM 919 O CYS A 476 0.380 -9.639 7.106 1.00 0.00 O ATOM 920 CB CYS A 476 -2.191 -8.174 6.427 1.00 0.00 C ATOM 921 SG CYS A 476 -1.397 -8.225 4.779 1.00 0.00 S ATOM 0 H CYS A 476 0.385 -7.040 6.605 1.00 0.00 H new ATOM 0 HA CYS A 476 -1.862 -7.675 8.446 1.00 0.00 H new ATOM 0 HB2 CYS A 476 -2.711 -9.117 6.593 1.00 0.00 H new ATOM 0 HB3 CYS A 476 -2.947 -7.389 6.426 1.00 0.00 H new ATOM 926 N ILE A 477 -0.622 -9.679 9.134 1.00 0.00 N ATOM 927 CA ILE A 477 0.092 -10.863 9.587 1.00 0.00 C ATOM 928 C ILE A 477 -0.384 -12.077 8.786 1.00 0.00 C ATOM 929 O ILE A 477 -1.486 -12.071 8.239 1.00 0.00 O ATOM 930 CB ILE A 477 -0.053 -11.029 11.100 1.00 0.00 C ATOM 931 CG1 ILE A 477 1.001 -10.206 11.845 1.00 0.00 C ATOM 932 CG2 ILE A 477 -0.013 -12.506 11.496 1.00 0.00 C ATOM 933 CD1 ILE A 477 2.411 -10.572 11.380 1.00 0.00 C ATOM 0 H ILE A 477 -1.279 -9.291 9.811 1.00 0.00 H new ATOM 0 HA ILE A 477 1.161 -10.758 9.402 1.00 0.00 H new ATOM 0 HB ILE A 477 -1.029 -10.644 11.394 1.00 0.00 H new ATOM 0 HG12 ILE A 477 0.823 -9.144 11.678 1.00 0.00 H new ATOM 0 HG13 ILE A 477 0.911 -10.379 12.917 1.00 0.00 H new ATOM 0 HG21 ILE A 477 -0.118 -12.596 12.577 1.00 0.00 H new ATOM 0 HG22 ILE A 477 -0.830 -13.036 11.007 1.00 0.00 H new ATOM 0 HG23 ILE A 477 0.938 -12.940 11.187 1.00 0.00 H new ATOM 0 HD11 ILE A 477 3.141 -9.973 11.925 1.00 0.00 H new ATOM 0 HD12 ILE A 477 2.594 -11.629 11.571 1.00 0.00 H new ATOM 0 HD13 ILE A 477 2.505 -10.375 10.312 1.00 0.00 H new ATOM 945 N CYS A 478 0.470 -13.089 8.744 1.00 0.00 N ATOM 946 CA CYS A 478 0.149 -14.306 8.019 1.00 0.00 C ATOM 947 C CYS A 478 -0.002 -15.444 9.033 1.00 0.00 C ATOM 948 O CYS A 478 0.374 -15.296 10.196 1.00 0.00 O ATOM 949 CB CYS A 478 1.203 -14.626 6.957 1.00 0.00 C ATOM 950 SG CYS A 478 1.403 -13.346 5.666 1.00 0.00 S ATOM 0 H CYS A 478 1.383 -13.091 9.200 1.00 0.00 H new ATOM 0 HA CYS A 478 -0.789 -14.174 7.479 1.00 0.00 H new ATOM 0 HB2 CYS A 478 2.163 -14.777 7.451 1.00 0.00 H new ATOM 0 HB3 CYS A 478 0.940 -15.569 6.477 1.00 0.00 H new ATOM 955 N MET A 479 -0.551 -16.550 8.557 1.00 0.00 N ATOM 956 CA MET A 479 -0.755 -17.710 9.407 1.00 0.00 C ATOM 957 C MET A 479 0.250 -18.816 9.078 1.00 0.00 C ATOM 958 O MET A 479 0.712 -18.922 7.943 1.00 0.00 O ATOM 959 CB MET A 479 -2.178 -18.241 9.214 1.00 0.00 C ATOM 960 CG MET A 479 -3.214 -17.170 9.567 1.00 0.00 C ATOM 961 SD MET A 479 -4.719 -17.454 8.652 1.00 0.00 S ATOM 962 CE MET A 479 -5.231 -19.006 9.370 1.00 0.00 C ATOM 0 H MET A 479 -0.861 -16.668 7.593 1.00 0.00 H new ATOM 0 HA MET A 479 -0.607 -17.407 10.443 1.00 0.00 H new ATOM 0 HB2 MET A 479 -2.315 -18.558 8.180 1.00 0.00 H new ATOM 0 HB3 MET A 479 -2.330 -19.120 9.840 1.00 0.00 H new ATOM 0 HG2 MET A 479 -3.420 -17.190 10.637 1.00 0.00 H new ATOM 0 HG3 MET A 479 -2.820 -16.180 9.337 1.00 0.00 H new ATOM 0 HE1 MET A 479 -6.250 -19.234 9.056 1.00 0.00 H new ATOM 0 HE2 MET A 479 -4.563 -19.800 9.036 1.00 0.00 H new ATOM 0 HE3 MET A 479 -5.194 -18.934 10.457 1.00 0.00 H new ATOM 972 N PRO A 480 0.567 -19.633 10.117 1.00 0.00 N ATOM 973 CA PRO A 480 1.509 -20.726 9.951 1.00 0.00 C ATOM 974 C PRO A 480 0.870 -21.888 9.188 1.00 0.00 C ATOM 975 O PRO A 480 0.776 -23.000 9.708 1.00 0.00 O ATOM 976 CB PRO A 480 1.931 -21.101 11.362 1.00 0.00 C ATOM 977 CG PRO A 480 0.867 -20.525 12.283 1.00 0.00 C ATOM 978 CD PRO A 480 0.040 -19.537 11.476 1.00 0.00 C ATOM 0 HA PRO A 480 2.376 -20.447 9.353 1.00 0.00 H new ATOM 0 HB2 PRO A 480 2.000 -22.183 11.474 1.00 0.00 H new ATOM 0 HB3 PRO A 480 2.914 -20.692 11.597 1.00 0.00 H new ATOM 0 HG2 PRO A 480 0.234 -21.319 12.679 1.00 0.00 H new ATOM 0 HG3 PRO A 480 1.329 -20.029 13.137 1.00 0.00 H new ATOM 0 HD2 PRO A 480 -1.020 -19.789 11.508 1.00 0.00 H new ATOM 0 HD3 PRO A 480 0.139 -18.525 11.868 1.00 0.00 H new ATOM 986 N GLY A 481 0.448 -21.592 7.968 1.00 0.00 N ATOM 987 CA GLY A 481 -0.179 -22.599 7.129 1.00 0.00 C ATOM 988 C GLY A 481 -0.296 -22.113 5.683 1.00 0.00 C ATOM 989 O GLY A 481 -0.085 -22.882 4.746 1.00 0.00 O ATOM 0 H GLY A 481 0.528 -20.669 7.540 1.00 0.00 H new ATOM 0 HA2 GLY A 481 0.405 -23.519 7.161 1.00 0.00 H new ATOM 0 HA3 GLY A 481 -1.169 -22.836 7.518 1.00 0.00 H new ATOM 993 N TYR A 482 -0.630 -20.838 5.545 1.00 0.00 N ATOM 994 CA TYR A 482 -0.777 -20.240 4.229 1.00 0.00 C ATOM 995 C TYR A 482 0.108 -18.999 4.090 1.00 0.00 C ATOM 996 O TYR A 482 0.574 -18.449 5.086 1.00 0.00 O ATOM 997 CB TYR A 482 -2.244 -19.820 4.118 1.00 0.00 C ATOM 998 CG TYR A 482 -3.230 -20.989 4.149 1.00 0.00 C ATOM 999 CD1 TYR A 482 -3.338 -21.771 5.282 1.00 0.00 C ATOM 1000 CD2 TYR A 482 -4.010 -21.264 3.044 1.00 0.00 C ATOM 1001 CE1 TYR A 482 -4.266 -22.871 5.311 1.00 0.00 C ATOM 1002 CE2 TYR A 482 -4.938 -22.365 3.074 1.00 0.00 C ATOM 1003 CZ TYR A 482 -5.020 -23.114 4.206 1.00 0.00 C ATOM 1004 OH TYR A 482 -5.896 -24.154 4.234 1.00 0.00 O ATOM 0 H TYR A 482 -0.803 -20.202 6.324 1.00 0.00 H new ATOM 0 HA TYR A 482 -0.484 -20.946 3.451 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -2.479 -19.138 4.935 1.00 0.00 H new ATOM 0 HB3 TYR A 482 -2.383 -19.265 3.190 1.00 0.00 H new ATOM 0 HD1 TYR A 482 -2.726 -21.557 6.146 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -3.924 -20.654 2.157 1.00 0.00 H new ATOM 0 HE1 TYR A 482 -4.361 -23.490 6.191 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -5.555 -22.591 2.217 1.00 0.00 H new ATOM 0 HH TYR A 482 -6.367 -24.208 3.377 1.00 0.00 H new ATOM 1014 N GLU A 483 0.314 -18.596 2.844 1.00 0.00 N ATOM 1015 CA GLU A 483 1.135 -17.432 2.561 1.00 0.00 C ATOM 1016 C GLU A 483 0.597 -16.688 1.336 1.00 0.00 C ATOM 1017 O GLU A 483 -0.411 -17.088 0.755 1.00 0.00 O ATOM 1018 CB GLU A 483 2.599 -17.828 2.362 1.00 0.00 C ATOM 1019 CG GLU A 483 3.534 -16.843 3.069 1.00 0.00 C ATOM 1020 CD GLU A 483 4.881 -17.498 3.384 1.00 0.00 C ATOM 1021 OE1 GLU A 483 4.918 -18.598 3.957 1.00 0.00 O ATOM 1022 OE2 GLU A 483 5.915 -16.823 3.012 1.00 0.00 O ATOM 0 H GLU A 483 -0.074 -19.055 2.020 1.00 0.00 H new ATOM 0 HA GLU A 483 1.088 -16.762 3.419 1.00 0.00 H new ATOM 0 HB2 GLU A 483 2.764 -18.833 2.750 1.00 0.00 H new ATOM 0 HB3 GLU A 483 2.831 -17.855 1.297 1.00 0.00 H new ATOM 0 HG2 GLU A 483 3.690 -15.967 2.439 1.00 0.00 H new ATOM 0 HG3 GLU A 483 3.070 -16.494 3.992 1.00 0.00 H new ATOM 1030 N GLY A 484 1.292 -15.619 0.980 1.00 0.00 N ATOM 1031 CA GLY A 484 0.898 -14.815 -0.164 1.00 0.00 C ATOM 1032 C GLY A 484 0.664 -13.358 0.241 1.00 0.00 C ATOM 1033 O GLY A 484 1.225 -12.889 1.231 1.00 0.00 O ATOM 0 H GLY A 484 2.127 -15.290 1.464 1.00 0.00 H new ATOM 0 HA2 GLY A 484 1.672 -14.863 -0.930 1.00 0.00 H new ATOM 0 HA3 GLY A 484 -0.012 -15.224 -0.604 1.00 0.00 H new ATOM 1037 N VAL A 485 -0.164 -12.685 -0.542 1.00 0.00 N ATOM 1038 CA VAL A 485 -0.480 -11.291 -0.275 1.00 0.00 C ATOM 1039 C VAL A 485 -1.516 -11.212 0.848 1.00 0.00 C ATOM 1040 O VAL A 485 -1.450 -10.324 1.695 1.00 0.00 O ATOM 1041 CB VAL A 485 -0.940 -10.604 -1.562 1.00 0.00 C ATOM 1042 CG1 VAL A 485 -2.456 -10.397 -1.561 1.00 0.00 C ATOM 1043 CG2 VAL A 485 -0.205 -9.279 -1.770 1.00 0.00 C ATOM 0 H VAL A 485 -0.626 -13.078 -1.362 1.00 0.00 H new ATOM 0 HA VAL A 485 0.407 -10.757 0.064 1.00 0.00 H new ATOM 0 HB VAL A 485 -0.692 -11.258 -2.398 1.00 0.00 H new ATOM 0 HG11 VAL A 485 -2.757 -9.907 -2.487 1.00 0.00 H new ATOM 0 HG12 VAL A 485 -2.955 -11.363 -1.483 1.00 0.00 H new ATOM 0 HG13 VAL A 485 -2.738 -9.774 -0.712 1.00 0.00 H new ATOM 0 HG21 VAL A 485 -0.551 -8.812 -2.692 1.00 0.00 H new ATOM 0 HG22 VAL A 485 -0.406 -8.615 -0.929 1.00 0.00 H new ATOM 0 HG23 VAL A 485 0.867 -9.464 -1.837 1.00 0.00 H new ATOM 1053 N HIS A 486 -2.448 -12.154 0.817 1.00 0.00 N ATOM 1054 CA HIS A 486 -3.496 -12.202 1.822 1.00 0.00 C ATOM 1055 C HIS A 486 -3.229 -13.358 2.789 1.00 0.00 C ATOM 1056 O HIS A 486 -3.993 -13.577 3.725 1.00 0.00 O ATOM 1057 CB HIS A 486 -4.875 -12.285 1.166 1.00 0.00 C ATOM 1058 CG HIS A 486 -5.303 -11.014 0.473 1.00 0.00 C ATOM 1059 ND1 HIS A 486 -4.738 -9.773 0.459 1.00 0.00 N flip ATOM 1060 CD2 HIS A 486 -6.439 -10.935 -0.315 1.00 0.00 C flip ATOM 1061 CE1 HIS A 486 -5.487 -8.979 -0.298 1.00 0.00 C flip ATOM 1062 NE2 HIS A 486 -6.543 -9.698 -0.778 1.00 0.00 N flip ATOM 0 H HIS A 486 -2.499 -12.889 0.112 1.00 0.00 H new ATOM 0 HA HIS A 486 -3.489 -11.280 2.403 1.00 0.00 H new ATOM 0 HB2 HIS A 486 -4.873 -13.099 0.441 1.00 0.00 H new ATOM 0 HB3 HIS A 486 -5.613 -12.538 1.927 1.00 0.00 H new ATOM 0 HD2 HIS A 486 -7.124 -11.745 -0.518 1.00 0.00 H new ATOM 0 HE1 HIS A 486 -5.292 -7.936 -0.500 1.00 0.00 H new ATOM 0 HE2 HIS A 486 -7.282 -9.345 -1.386 1.00 0.00 H new ATOM 1070 N CYS A 487 -2.138 -14.066 2.525 1.00 0.00 N ATOM 1071 CA CYS A 487 -1.761 -15.194 3.360 1.00 0.00 C ATOM 1072 C CYS A 487 -2.966 -16.128 3.480 1.00 0.00 C ATOM 1073 O CYS A 487 -3.363 -16.497 4.584 1.00 0.00 O ATOM 1074 CB CYS A 487 -1.254 -14.739 4.729 1.00 0.00 C ATOM 1075 SG CYS A 487 -0.316 -13.167 4.717 1.00 0.00 S ATOM 0 H CYS A 487 -1.506 -13.880 1.747 1.00 0.00 H new ATOM 0 HA CYS A 487 -0.932 -15.730 2.898 1.00 0.00 H new ATOM 0 HB2 CYS A 487 -2.107 -14.632 5.399 1.00 0.00 H new ATOM 0 HB3 CYS A 487 -0.619 -15.522 5.144 1.00 0.00 H new ATOM 1080 N GLU A 488 -3.515 -16.484 2.328 1.00 0.00 N ATOM 1081 CA GLU A 488 -4.668 -17.368 2.290 1.00 0.00 C ATOM 1082 C GLU A 488 -4.440 -18.493 1.275 1.00 0.00 C ATOM 1083 O GLU A 488 -5.331 -19.307 1.038 1.00 0.00 O ATOM 1084 CB GLU A 488 -5.946 -16.591 1.969 1.00 0.00 C ATOM 1085 CG GLU A 488 -7.158 -17.524 1.923 1.00 0.00 C ATOM 1086 CD GLU A 488 -8.394 -16.846 2.519 1.00 0.00 C ATOM 1087 OE1 GLU A 488 -8.375 -16.448 3.694 1.00 0.00 O ATOM 1088 OE2 GLU A 488 -9.397 -16.738 1.717 1.00 0.00 O ATOM 0 H GLU A 488 -3.183 -16.176 1.414 1.00 0.00 H new ATOM 0 HA GLU A 488 -4.792 -17.814 3.277 1.00 0.00 H new ATOM 0 HB2 GLU A 488 -6.105 -15.819 2.722 1.00 0.00 H new ATOM 0 HB3 GLU A 488 -5.836 -16.084 1.010 1.00 0.00 H new ATOM 0 HG2 GLU A 488 -7.359 -17.814 0.892 1.00 0.00 H new ATOM 0 HG3 GLU A 488 -6.939 -18.438 2.474 1.00 0.00 H new ATOM 1096 N VAL A 489 -3.245 -18.499 0.706 1.00 0.00 N ATOM 1097 CA VAL A 489 -2.889 -19.509 -0.276 1.00 0.00 C ATOM 1098 C VAL A 489 -2.269 -20.713 0.437 1.00 0.00 C ATOM 1099 O VAL A 489 -1.359 -20.556 1.249 1.00 0.00 O ATOM 1100 CB VAL A 489 -1.970 -18.905 -1.340 1.00 0.00 C ATOM 1101 CG1 VAL A 489 -2.290 -17.426 -1.566 1.00 0.00 C ATOM 1102 CG2 VAL A 489 -0.498 -19.095 -0.963 1.00 0.00 C ATOM 0 H VAL A 489 -2.510 -17.821 0.906 1.00 0.00 H new ATOM 0 HA VAL A 489 -3.778 -19.863 -0.798 1.00 0.00 H new ATOM 0 HB VAL A 489 -2.149 -19.433 -2.276 1.00 0.00 H new ATOM 0 HG11 VAL A 489 -1.622 -17.021 -2.327 1.00 0.00 H new ATOM 0 HG12 VAL A 489 -3.323 -17.324 -1.898 1.00 0.00 H new ATOM 0 HG13 VAL A 489 -2.153 -16.878 -0.634 1.00 0.00 H new ATOM 0 HG21 VAL A 489 0.135 -18.657 -1.735 1.00 0.00 H new ATOM 0 HG22 VAL A 489 -0.300 -18.604 -0.010 1.00 0.00 H new ATOM 0 HG23 VAL A 489 -0.279 -20.159 -0.875 1.00 0.00 H new ATOM 1112 N ASN A 490 -2.789 -21.886 0.108 1.00 0.00 N ATOM 1113 CA ASN A 490 -2.297 -23.116 0.706 1.00 0.00 C ATOM 1114 C ASN A 490 -0.871 -23.381 0.219 1.00 0.00 C ATOM 1115 O ASN A 490 -0.673 -24.016 -0.815 1.00 0.00 O ATOM 1116 CB ASN A 490 -3.164 -24.309 0.304 1.00 0.00 C ATOM 1117 CG ASN A 490 -3.541 -24.239 -1.178 1.00 0.00 C ATOM 1118 OD1 ASN A 490 -2.895 -23.582 -1.979 1.00 0.00 O ATOM 1119 ND2 ASN A 490 -4.620 -24.948 -1.496 1.00 0.00 N ATOM 0 H ASN A 490 -3.546 -22.011 -0.565 1.00 0.00 H new ATOM 0 HA ASN A 490 -2.326 -22.999 1.789 1.00 0.00 H new ATOM 0 HB2 ASN A 490 -2.627 -25.237 0.503 1.00 0.00 H new ATOM 0 HB3 ASN A 490 -4.068 -24.327 0.912 1.00 0.00 H new ATOM 0 HD21 ASN A 490 -4.954 -24.964 -2.460 1.00 0.00 H new ATOM 0 HD22 ASN A 490 -5.114 -25.476 -0.776 1.00 0.00 H new ATOM 1126 N THR A 491 0.085 -22.881 0.988 1.00 0.00 N ATOM 1127 CA THR A 491 1.487 -23.057 0.647 1.00 0.00 C ATOM 1128 C THR A 491 1.750 -22.594 -0.786 1.00 0.00 C ATOM 1129 O THR A 491 0.812 -22.353 -1.546 1.00 0.00 O ATOM 1130 CB THR A 491 1.853 -24.522 0.890 1.00 0.00 C ATOM 1131 OG1 THR A 491 3.068 -24.459 1.630 1.00 0.00 O ATOM 1132 CG2 THR A 491 2.239 -25.250 -0.400 1.00 0.00 C ATOM 0 H THR A 491 -0.083 -22.354 1.845 1.00 0.00 H new ATOM 0 HA THR A 491 2.127 -22.439 1.277 1.00 0.00 H new ATOM 0 HB THR A 491 1.012 -25.033 1.358 1.00 0.00 H new ATOM 0 HG1 THR A 491 3.376 -25.367 1.832 1.00 0.00 H new ATOM 0 HG21 THR A 491 2.490 -26.286 -0.172 1.00 0.00 H new ATOM 0 HG22 THR A 491 1.401 -25.224 -1.097 1.00 0.00 H new ATOM 0 HG23 THR A 491 3.101 -24.759 -0.851 1.00 0.00 H new ATOM 1140 N ASP A 492 3.028 -22.484 -1.114 1.00 0.00 N ATOM 1141 CA ASP A 492 3.426 -22.054 -2.443 1.00 0.00 C ATOM 1142 C ASP A 492 3.382 -23.251 -3.396 1.00 0.00 C ATOM 1143 O ASP A 492 3.355 -24.398 -2.956 1.00 0.00 O ATOM 1144 CB ASP A 492 4.854 -21.505 -2.442 1.00 0.00 C ATOM 1145 CG ASP A 492 5.109 -20.362 -3.426 1.00 0.00 C ATOM 1146 OD1 ASP A 492 4.702 -19.214 -3.191 1.00 0.00 O ATOM 1147 OD2 ASP A 492 5.765 -20.692 -4.487 1.00 0.00 O ATOM 0 H ASP A 492 3.802 -22.685 -0.482 1.00 0.00 H new ATOM 0 HA ASP A 492 2.739 -21.270 -2.762 1.00 0.00 H new ATOM 0 HB2 ASP A 492 5.093 -21.159 -1.437 1.00 0.00 H new ATOM 0 HB3 ASP A 492 5.541 -22.320 -2.670 1.00 0.00 H new ATOM 1153 N GLU A 493 3.375 -22.942 -4.685 1.00 0.00 N ATOM 1154 CA GLU A 493 3.334 -23.978 -5.702 1.00 0.00 C ATOM 1155 C GLU A 493 4.186 -23.572 -6.907 1.00 0.00 C ATOM 1156 O GLU A 493 3.910 -23.981 -8.034 1.00 0.00 O ATOM 1157 CB GLU A 493 1.894 -24.275 -6.125 1.00 0.00 C ATOM 1158 CG GLU A 493 1.198 -25.177 -5.104 1.00 0.00 C ATOM 1159 CD GLU A 493 0.244 -24.371 -4.219 1.00 0.00 C ATOM 1160 OE1 GLU A 493 0.523 -24.174 -3.027 1.00 0.00 O ATOM 1161 OE2 GLU A 493 -0.816 -23.940 -4.812 1.00 0.00 O ATOM 0 H GLU A 493 3.397 -21.989 -5.048 1.00 0.00 H new ATOM 0 HA GLU A 493 3.749 -24.892 -5.278 1.00 0.00 H new ATOM 0 HB2 GLU A 493 1.341 -23.341 -6.227 1.00 0.00 H new ATOM 0 HB3 GLU A 493 1.890 -24.756 -7.103 1.00 0.00 H new ATOM 0 HG2 GLU A 493 0.644 -25.960 -5.623 1.00 0.00 H new ATOM 0 HG3 GLU A 493 1.944 -25.673 -4.483 1.00 0.00 H new ATOM 1169 N CYS A 494 5.205 -22.772 -6.629 1.00 0.00 N ATOM 1170 CA CYS A 494 6.099 -22.307 -7.674 1.00 0.00 C ATOM 1171 C CYS A 494 7.217 -23.338 -7.845 1.00 0.00 C ATOM 1172 O CYS A 494 7.983 -23.276 -8.807 1.00 0.00 O ATOM 1173 CB CYS A 494 6.652 -20.913 -7.369 1.00 0.00 C ATOM 1174 SG CYS A 494 7.938 -20.325 -8.530 1.00 0.00 S ATOM 0 H CYS A 494 5.431 -22.434 -5.694 1.00 0.00 H new ATOM 0 HA CYS A 494 5.548 -22.211 -8.609 1.00 0.00 H new ATOM 0 HB2 CYS A 494 5.826 -20.201 -7.373 1.00 0.00 H new ATOM 0 HB3 CYS A 494 7.066 -20.915 -6.361 1.00 0.00 H new ATOM 1179 N ALA A 495 7.275 -24.263 -6.897 1.00 0.00 N ATOM 1180 CA ALA A 495 8.286 -25.306 -6.932 1.00 0.00 C ATOM 1181 C ALA A 495 8.088 -26.161 -8.184 1.00 0.00 C ATOM 1182 O ALA A 495 9.051 -26.694 -8.734 1.00 0.00 O ATOM 1183 CB ALA A 495 8.213 -26.130 -5.645 1.00 0.00 C ATOM 0 H ALA A 495 6.639 -24.311 -6.101 1.00 0.00 H new ATOM 0 HA ALA A 495 9.284 -24.872 -6.985 1.00 0.00 H new ATOM 0 HB1 ALA A 495 8.971 -26.913 -5.671 1.00 0.00 H new ATOM 0 HB2 ALA A 495 8.390 -25.481 -4.787 1.00 0.00 H new ATOM 0 HB3 ALA A 495 7.226 -26.584 -5.559 1.00 0.00 H new ATOM 1189 N SER A 496 6.834 -26.268 -8.597 1.00 0.00 N ATOM 1190 CA SER A 496 6.497 -27.050 -9.776 1.00 0.00 C ATOM 1191 C SER A 496 6.622 -26.185 -11.031 1.00 0.00 C ATOM 1192 O SER A 496 5.815 -25.285 -11.252 1.00 0.00 O ATOM 1193 CB SER A 496 5.085 -27.628 -9.667 1.00 0.00 C ATOM 1194 OG SER A 496 5.091 -28.964 -9.173 1.00 0.00 O ATOM 0 H SER A 496 6.038 -25.826 -8.137 1.00 0.00 H new ATOM 0 HA SER A 496 7.197 -27.883 -9.846 1.00 0.00 H new ATOM 0 HB2 SER A 496 4.486 -27.000 -9.007 1.00 0.00 H new ATOM 0 HB3 SER A 496 4.608 -27.606 -10.647 1.00 0.00 H new ATOM 0 HG SER A 496 4.171 -29.296 -9.117 1.00 0.00 H new ATOM 1200 N SER A 497 7.643 -26.489 -11.821 1.00 0.00 N ATOM 1201 CA SER A 497 7.883 -25.751 -13.049 1.00 0.00 C ATOM 1202 C SER A 497 7.591 -24.266 -12.833 1.00 0.00 C ATOM 1203 O SER A 497 6.470 -23.811 -13.057 1.00 0.00 O ATOM 1204 CB SER A 497 7.033 -26.299 -14.197 1.00 0.00 C ATOM 1205 OG SER A 497 5.644 -26.287 -13.883 1.00 0.00 O ATOM 0 H SER A 497 8.312 -27.236 -11.634 1.00 0.00 H new ATOM 0 HA SER A 497 8.932 -25.872 -13.321 1.00 0.00 H new ATOM 0 HB2 SER A 497 7.207 -25.704 -15.094 1.00 0.00 H new ATOM 0 HB3 SER A 497 7.345 -27.318 -14.425 1.00 0.00 H new ATOM 0 HG SER A 497 5.436 -25.491 -13.351 1.00 0.00 H new ATOM 1211 N PRO A 498 8.645 -23.530 -12.387 1.00 0.00 N ATOM 1212 CA PRO A 498 8.510 -22.105 -12.138 1.00 0.00 C ATOM 1213 C PRO A 498 8.473 -21.321 -13.451 1.00 0.00 C ATOM 1214 O PRO A 498 7.916 -20.226 -13.508 1.00 0.00 O ATOM 1215 CB PRO A 498 9.700 -21.745 -11.264 1.00 0.00 C ATOM 1216 CG PRO A 498 10.704 -22.874 -11.439 1.00 0.00 C ATOM 1217 CD PRO A 498 9.986 -24.035 -12.109 1.00 0.00 C ATOM 0 HA PRO A 498 7.575 -21.851 -11.639 1.00 0.00 H new ATOM 0 HB2 PRO A 498 10.130 -20.790 -11.565 1.00 0.00 H new ATOM 0 HB3 PRO A 498 9.402 -21.646 -10.220 1.00 0.00 H new ATOM 0 HG2 PRO A 498 11.547 -22.545 -12.046 1.00 0.00 H new ATOM 0 HG3 PRO A 498 11.107 -23.180 -10.474 1.00 0.00 H new ATOM 0 HD2 PRO A 498 10.493 -24.338 -13.025 1.00 0.00 H new ATOM 0 HD3 PRO A 498 9.953 -24.909 -11.458 1.00 0.00 H new ATOM 1225 N CYS A 499 9.075 -21.910 -14.473 1.00 0.00 N ATOM 1226 CA CYS A 499 9.118 -21.280 -15.781 1.00 0.00 C ATOM 1227 C CYS A 499 9.441 -19.797 -15.590 1.00 0.00 C ATOM 1228 O CYS A 499 8.668 -18.932 -15.999 1.00 0.00 O ATOM 1229 CB CYS A 499 7.811 -21.485 -16.552 1.00 0.00 C ATOM 1230 SG CYS A 499 6.338 -21.759 -15.501 1.00 0.00 S ATOM 0 H CYS A 499 9.537 -22.818 -14.422 1.00 0.00 H new ATOM 0 HA CYS A 499 9.896 -21.745 -16.386 1.00 0.00 H new ATOM 0 HB2 CYS A 499 7.635 -20.612 -17.180 1.00 0.00 H new ATOM 0 HB3 CYS A 499 7.929 -22.339 -17.219 1.00 0.00 H new ATOM 1235 N LEU A 500 10.585 -19.549 -14.968 1.00 0.00 N ATOM 1236 CA LEU A 500 11.021 -18.186 -14.719 1.00 0.00 C ATOM 1237 C LEU A 500 11.266 -17.479 -16.053 1.00 0.00 C ATOM 1238 O LEU A 500 11.720 -18.101 -17.014 1.00 0.00 O ATOM 1239 CB LEU A 500 12.233 -18.172 -13.784 1.00 0.00 C ATOM 1240 CG LEU A 500 11.932 -18.349 -12.294 1.00 0.00 C ATOM 1241 CD1 LEU A 500 13.221 -18.556 -11.496 1.00 0.00 C ATOM 1242 CD2 LEU A 500 11.110 -17.174 -11.759 1.00 0.00 C ATOM 0 H LEU A 500 11.223 -20.269 -14.629 1.00 0.00 H new ATOM 0 HA LEU A 500 10.241 -17.627 -14.201 1.00 0.00 H new ATOM 0 HB2 LEU A 500 12.915 -18.964 -14.093 1.00 0.00 H new ATOM 0 HB3 LEU A 500 12.760 -17.227 -13.918 1.00 0.00 H new ATOM 0 HG LEU A 500 11.328 -19.248 -12.171 1.00 0.00 H new ATOM 0 HD11 LEU A 500 12.980 -18.679 -10.440 1.00 0.00 H new ATOM 0 HD12 LEU A 500 13.734 -19.448 -11.857 1.00 0.00 H new ATOM 0 HD13 LEU A 500 13.870 -17.689 -11.621 1.00 0.00 H new ATOM 0 HD21 LEU A 500 10.909 -17.324 -10.698 1.00 0.00 H new ATOM 0 HD22 LEU A 500 11.668 -16.248 -11.896 1.00 0.00 H new ATOM 0 HD23 LEU A 500 10.167 -17.113 -12.302 1.00 0.00 H new ATOM 1254 N HIS A 501 10.954 -16.192 -16.072 1.00 0.00 N ATOM 1255 CA HIS A 501 11.134 -15.395 -17.273 1.00 0.00 C ATOM 1256 C HIS A 501 10.115 -15.823 -18.330 1.00 0.00 C ATOM 1257 O HIS A 501 9.309 -15.012 -18.784 1.00 0.00 O ATOM 1258 CB HIS A 501 12.578 -15.484 -17.771 1.00 0.00 C ATOM 1259 CG HIS A 501 13.460 -14.349 -17.303 1.00 0.00 C ATOM 1260 ND1 HIS A 501 14.048 -13.449 -18.174 1.00 0.00 N ATOM 1261 CD2 HIS A 501 13.845 -13.979 -16.050 1.00 0.00 C ATOM 1262 CE1 HIS A 501 14.755 -12.582 -17.466 1.00 0.00 C ATOM 1263 NE2 HIS A 501 14.628 -12.912 -16.148 1.00 0.00 N ATOM 0 H HIS A 501 10.577 -15.681 -15.274 1.00 0.00 H new ATOM 0 HA HIS A 501 10.952 -14.344 -17.048 1.00 0.00 H new ATOM 0 HB2 HIS A 501 13.009 -16.428 -17.437 1.00 0.00 H new ATOM 0 HB3 HIS A 501 12.575 -15.503 -18.861 1.00 0.00 H new ATOM 0 HD2 HIS A 501 13.561 -14.471 -15.132 1.00 0.00 H new ATOM 0 HE1 HIS A 501 15.331 -11.759 -17.862 1.00 0.00 H new ATOM 0 HE2 HIS A 501 15.063 -12.420 -15.367 1.00 0.00 H new ATOM 1271 N ASN A 502 10.185 -17.096 -18.694 1.00 0.00 N ATOM 1272 CA ASN A 502 9.278 -17.641 -19.689 1.00 0.00 C ATOM 1273 C ASN A 502 7.873 -17.742 -19.091 1.00 0.00 C ATOM 1274 O ASN A 502 6.918 -18.071 -19.795 1.00 0.00 O ATOM 1275 CB ASN A 502 9.712 -19.043 -20.120 1.00 0.00 C ATOM 1276 CG ASN A 502 10.986 -18.987 -20.965 1.00 0.00 C ATOM 1277 OD1 ASN A 502 12.008 -18.457 -20.560 1.00 0.00 O ATOM 1278 ND2 ASN A 502 10.869 -19.562 -22.159 1.00 0.00 N ATOM 0 H ASN A 502 10.856 -17.765 -18.317 1.00 0.00 H new ATOM 0 HA ASN A 502 9.289 -16.979 -20.555 1.00 0.00 H new ATOM 0 HB2 ASN A 502 9.883 -19.662 -19.239 1.00 0.00 H new ATOM 0 HB3 ASN A 502 8.913 -19.515 -20.691 1.00 0.00 H new ATOM 0 HD21 ASN A 502 11.664 -19.577 -22.798 1.00 0.00 H new ATOM 0 HD22 ASN A 502 9.984 -19.988 -22.436 1.00 0.00 H new ATOM 1285 N GLY A 503 7.791 -17.457 -17.800 1.00 0.00 N ATOM 1286 CA GLY A 503 6.519 -17.513 -17.101 1.00 0.00 C ATOM 1287 C GLY A 503 6.647 -16.949 -15.684 1.00 0.00 C ATOM 1288 O GLY A 503 7.745 -16.894 -15.130 1.00 0.00 O ATOM 0 H GLY A 503 8.585 -17.187 -17.220 1.00 0.00 H new ATOM 0 HA2 GLY A 503 5.770 -16.947 -17.655 1.00 0.00 H new ATOM 0 HA3 GLY A 503 6.170 -18.545 -17.056 1.00 0.00 H new ATOM 1292 N ARG A 504 5.510 -16.543 -15.138 1.00 0.00 N ATOM 1293 CA ARG A 504 5.481 -15.985 -13.798 1.00 0.00 C ATOM 1294 C ARG A 504 4.703 -16.906 -12.856 1.00 0.00 C ATOM 1295 O ARG A 504 3.557 -17.255 -13.131 1.00 0.00 O ATOM 1296 CB ARG A 504 4.835 -14.598 -13.791 1.00 0.00 C ATOM 1297 CG ARG A 504 5.895 -13.500 -13.674 1.00 0.00 C ATOM 1298 CD ARG A 504 6.010 -13.003 -12.231 1.00 0.00 C ATOM 1299 NE ARG A 504 5.069 -11.882 -12.007 1.00 0.00 N ATOM 1300 CZ ARG A 504 5.186 -10.668 -12.583 1.00 0.00 C ATOM 1301 NH1 ARG A 504 6.207 -10.405 -13.427 1.00 0.00 N ATOM 1302 NH2 ARG A 504 4.288 -9.741 -12.310 1.00 0.00 N ATOM 0 H ARG A 504 4.602 -16.590 -15.600 1.00 0.00 H new ATOM 0 HA ARG A 504 6.512 -15.895 -13.455 1.00 0.00 H new ATOM 0 HB2 ARG A 504 4.259 -14.457 -14.706 1.00 0.00 H new ATOM 0 HB3 ARG A 504 4.135 -14.523 -12.959 1.00 0.00 H new ATOM 0 HG2 ARG A 504 6.859 -13.883 -14.009 1.00 0.00 H new ATOM 0 HG3 ARG A 504 5.637 -12.668 -14.330 1.00 0.00 H new ATOM 0 HD2 ARG A 504 5.792 -13.816 -11.539 1.00 0.00 H new ATOM 0 HD3 ARG A 504 7.031 -12.678 -12.029 1.00 0.00 H new ATOM 0 HE ARG A 504 4.282 -12.038 -11.377 1.00 0.00 H new ATOM 0 HH11 ARG A 504 6.897 -11.127 -13.633 1.00 0.00 H new ATOM 0 HH12 ARG A 504 6.288 -9.484 -13.858 1.00 0.00 H new ATOM 0 HH21 ARG A 504 3.520 -9.947 -11.672 1.00 0.00 H new ATOM 0 HH22 ARG A 504 4.362 -8.818 -12.737 1.00 0.00 H new ATOM 1315 N CYS A 505 5.357 -17.273 -11.763 1.00 0.00 N ATOM 1316 CA CYS A 505 4.741 -18.146 -10.779 1.00 0.00 C ATOM 1317 C CYS A 505 3.488 -17.452 -10.239 1.00 0.00 C ATOM 1318 O CYS A 505 3.495 -16.244 -10.006 1.00 0.00 O ATOM 1319 CB CYS A 505 5.718 -18.515 -9.661 1.00 0.00 C ATOM 1320 SG CYS A 505 7.098 -19.601 -10.173 1.00 0.00 S ATOM 0 H CYS A 505 6.308 -16.981 -11.538 1.00 0.00 H new ATOM 0 HA CYS A 505 4.458 -19.088 -11.249 1.00 0.00 H new ATOM 0 HB2 CYS A 505 6.132 -17.598 -9.243 1.00 0.00 H new ATOM 0 HB3 CYS A 505 5.164 -19.008 -8.862 1.00 0.00 H new ATOM 1325 N LEU A 506 2.445 -18.246 -10.054 1.00 0.00 N ATOM 1326 CA LEU A 506 1.188 -17.725 -9.546 1.00 0.00 C ATOM 1327 C LEU A 506 0.769 -18.528 -8.313 1.00 0.00 C ATOM 1328 O LEU A 506 0.774 -19.758 -8.339 1.00 0.00 O ATOM 1329 CB LEU A 506 0.132 -17.698 -10.651 1.00 0.00 C ATOM 1330 CG LEU A 506 -0.861 -16.535 -10.603 1.00 0.00 C ATOM 1331 CD1 LEU A 506 -0.192 -15.225 -11.026 1.00 0.00 C ATOM 1332 CD2 LEU A 506 -2.105 -16.839 -11.440 1.00 0.00 C ATOM 0 H LEU A 506 2.444 -19.248 -10.247 1.00 0.00 H new ATOM 0 HA LEU A 506 1.307 -16.689 -9.227 1.00 0.00 H new ATOM 0 HB2 LEU A 506 0.643 -17.674 -11.614 1.00 0.00 H new ATOM 0 HB3 LEU A 506 -0.430 -18.631 -10.612 1.00 0.00 H new ATOM 0 HG LEU A 506 -1.190 -16.411 -9.571 1.00 0.00 H new ATOM 0 HD11 LEU A 506 -0.920 -14.414 -10.983 1.00 0.00 H new ATOM 0 HD12 LEU A 506 0.636 -15.005 -10.352 1.00 0.00 H new ATOM 0 HD13 LEU A 506 0.185 -15.321 -12.044 1.00 0.00 H new ATOM 0 HD21 LEU A 506 -2.794 -15.996 -11.388 1.00 0.00 H new ATOM 0 HD22 LEU A 506 -1.814 -17.006 -12.477 1.00 0.00 H new ATOM 0 HD23 LEU A 506 -2.595 -17.732 -11.052 1.00 0.00 H new ATOM 1344 N ASP A 507 0.414 -17.801 -7.265 1.00 0.00 N ATOM 1345 CA ASP A 507 -0.009 -18.431 -6.024 1.00 0.00 C ATOM 1346 C ASP A 507 -1.536 -18.471 -5.972 1.00 0.00 C ATOM 1347 O ASP A 507 -2.173 -17.487 -5.602 1.00 0.00 O ATOM 1348 CB ASP A 507 0.486 -17.644 -4.810 1.00 0.00 C ATOM 1349 CG ASP A 507 1.030 -18.499 -3.663 1.00 0.00 C ATOM 1350 OD1 ASP A 507 1.939 -18.081 -2.931 1.00 0.00 O ATOM 1351 OD2 ASP A 507 0.472 -19.654 -3.533 1.00 0.00 O ATOM 0 H ASP A 507 0.410 -16.781 -7.248 1.00 0.00 H new ATOM 0 HA ASP A 507 0.411 -19.437 -5.997 1.00 0.00 H new ATOM 0 HB2 ASP A 507 1.269 -16.958 -5.135 1.00 0.00 H new ATOM 0 HB3 ASP A 507 -0.335 -17.035 -4.431 1.00 0.00 H new ATOM 1357 N LYS A 508 -2.081 -19.618 -6.348 1.00 0.00 N ATOM 1358 CA LYS A 508 -3.522 -19.799 -6.349 1.00 0.00 C ATOM 1359 C LYS A 508 -3.916 -20.725 -5.196 1.00 0.00 C ATOM 1360 O LYS A 508 -3.103 -21.517 -4.725 1.00 0.00 O ATOM 1361 CB LYS A 508 -4.002 -20.284 -7.718 1.00 0.00 C ATOM 1362 CG LYS A 508 -3.539 -19.337 -8.827 1.00 0.00 C ATOM 1363 CD LYS A 508 -4.396 -18.070 -8.859 1.00 0.00 C ATOM 1364 CE LYS A 508 -5.336 -18.074 -10.066 1.00 0.00 C ATOM 1365 NZ LYS A 508 -6.734 -17.859 -9.632 1.00 0.00 N ATOM 0 H LYS A 508 -1.549 -20.433 -6.655 1.00 0.00 H new ATOM 0 HA LYS A 508 -4.025 -18.847 -6.181 1.00 0.00 H new ATOM 0 HB2 LYS A 508 -3.619 -21.287 -7.908 1.00 0.00 H new ATOM 0 HB3 LYS A 508 -5.090 -20.352 -7.723 1.00 0.00 H new ATOM 0 HG2 LYS A 508 -2.494 -19.070 -8.669 1.00 0.00 H new ATOM 0 HG3 LYS A 508 -3.596 -19.844 -9.790 1.00 0.00 H new ATOM 0 HD2 LYS A 508 -4.978 -17.997 -7.940 1.00 0.00 H new ATOM 0 HD3 LYS A 508 -3.752 -17.192 -8.898 1.00 0.00 H new ATOM 0 HE2 LYS A 508 -5.042 -17.293 -10.767 1.00 0.00 H new ATOM 0 HE3 LYS A 508 -5.255 -19.024 -10.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 508 -7.360 -17.864 -10.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 508 -7.016 -18.619 -8.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 508 -6.810 -16.942 -9.147 1.00 0.00 H new ATOM 1378 N ILE A 509 -5.166 -20.594 -4.775 1.00 0.00 N ATOM 1379 CA ILE A 509 -5.679 -21.409 -3.686 1.00 0.00 C ATOM 1380 C ILE A 509 -6.244 -22.713 -4.253 1.00 0.00 C ATOM 1381 O ILE A 509 -7.446 -22.961 -4.171 1.00 0.00 O ATOM 1382 CB ILE A 509 -6.685 -20.615 -2.850 1.00 0.00 C ATOM 1383 CG1 ILE A 509 -7.686 -19.885 -3.746 1.00 0.00 C ATOM 1384 CG2 ILE A 509 -5.970 -19.661 -1.892 1.00 0.00 C ATOM 1385 CD1 ILE A 509 -9.032 -19.714 -3.040 1.00 0.00 C ATOM 0 H ILE A 509 -5.839 -19.936 -5.168 1.00 0.00 H new ATOM 0 HA ILE A 509 -4.875 -21.680 -3.002 1.00 0.00 H new ATOM 0 HB ILE A 509 -7.252 -21.318 -2.240 1.00 0.00 H new ATOM 0 HG12 ILE A 509 -7.289 -18.908 -4.020 1.00 0.00 H new ATOM 0 HG13 ILE A 509 -7.825 -20.443 -4.672 1.00 0.00 H new ATOM 0 HG21 ILE A 509 -6.708 -19.109 -1.310 1.00 0.00 H new ATOM 0 HG22 ILE A 509 -5.331 -20.233 -1.219 1.00 0.00 H new ATOM 0 HG23 ILE A 509 -5.361 -18.961 -2.463 1.00 0.00 H new ATOM 0 HD11 ILE A 509 -9.725 -19.192 -3.700 1.00 0.00 H new ATOM 0 HD12 ILE A 509 -9.438 -20.694 -2.789 1.00 0.00 H new ATOM 0 HD13 ILE A 509 -8.893 -19.134 -2.127 1.00 0.00 H new ATOM 1397 N ASN A 510 -5.349 -23.513 -4.815 1.00 0.00 N ATOM 1398 CA ASN A 510 -5.744 -24.785 -5.396 1.00 0.00 C ATOM 1399 C ASN A 510 -4.560 -25.379 -6.163 1.00 0.00 C ATOM 1400 O ASN A 510 -4.395 -26.598 -6.210 1.00 0.00 O ATOM 1401 CB ASN A 510 -6.902 -24.608 -6.379 1.00 0.00 C ATOM 1402 CG ASN A 510 -8.097 -25.477 -5.982 1.00 0.00 C ATOM 1403 OD1 ASN A 510 -8.181 -25.995 -4.880 1.00 0.00 O ATOM 1404 ND2 ASN A 510 -9.014 -25.605 -6.936 1.00 0.00 N ATOM 0 H ASN A 510 -4.353 -23.305 -4.880 1.00 0.00 H new ATOM 0 HA ASN A 510 -6.058 -25.442 -4.585 1.00 0.00 H new ATOM 0 HB2 ASN A 510 -7.203 -23.561 -6.407 1.00 0.00 H new ATOM 0 HB3 ASN A 510 -6.574 -24.872 -7.384 1.00 0.00 H new ATOM 0 HD21 ASN A 510 -9.851 -26.164 -6.768 1.00 0.00 H new ATOM 0 HD22 ASN A 510 -8.881 -25.144 -7.836 1.00 0.00 H new ATOM 1411 N GLU A 511 -3.767 -24.492 -6.744 1.00 0.00 N ATOM 1412 CA GLU A 511 -2.604 -24.913 -7.506 1.00 0.00 C ATOM 1413 C GLU A 511 -1.748 -23.701 -7.882 1.00 0.00 C ATOM 1414 O GLU A 511 -1.930 -22.616 -7.336 1.00 0.00 O ATOM 1415 CB GLU A 511 -3.019 -25.699 -8.752 1.00 0.00 C ATOM 1416 CG GLU A 511 -3.727 -24.791 -9.760 1.00 0.00 C ATOM 1417 CD GLU A 511 -5.239 -24.781 -9.523 1.00 0.00 C ATOM 1418 OE1 GLU A 511 -5.832 -25.838 -9.259 1.00 0.00 O ATOM 1419 OE2 GLU A 511 -5.798 -23.624 -9.619 1.00 0.00 O ATOM 0 H GLU A 511 -3.907 -23.482 -6.703 1.00 0.00 H new ATOM 0 HA GLU A 511 -2.006 -25.576 -6.881 1.00 0.00 H new ATOM 0 HB2 GLU A 511 -2.139 -26.146 -9.215 1.00 0.00 H new ATOM 0 HB3 GLU A 511 -3.680 -26.518 -8.467 1.00 0.00 H new ATOM 0 HG2 GLU A 511 -3.336 -23.777 -9.678 1.00 0.00 H new ATOM 0 HG3 GLU A 511 -3.517 -25.133 -10.773 1.00 0.00 H new ATOM 1427 N PHE A 512 -0.833 -23.929 -8.814 1.00 0.00 N ATOM 1428 CA PHE A 512 0.050 -22.871 -9.269 1.00 0.00 C ATOM 1429 C PHE A 512 -0.197 -22.546 -10.743 1.00 0.00 C ATOM 1430 O PHE A 512 -0.507 -23.435 -11.535 1.00 0.00 O ATOM 1431 CB PHE A 512 1.483 -23.382 -9.105 1.00 0.00 C ATOM 1432 CG PHE A 512 2.417 -22.995 -10.254 1.00 0.00 C ATOM 1433 CD1 PHE A 512 2.278 -23.582 -11.473 1.00 0.00 C ATOM 1434 CD2 PHE A 512 3.388 -22.063 -10.057 1.00 0.00 C ATOM 1435 CE1 PHE A 512 3.144 -23.223 -12.538 1.00 0.00 C ATOM 1436 CE2 PHE A 512 4.254 -21.704 -11.122 1.00 0.00 C ATOM 1437 CZ PHE A 512 4.114 -22.291 -12.340 1.00 0.00 C ATOM 0 H PHE A 512 -0.685 -24.832 -9.266 1.00 0.00 H new ATOM 0 HA PHE A 512 -0.127 -21.965 -8.690 1.00 0.00 H new ATOM 0 HB2 PHE A 512 1.892 -22.994 -8.172 1.00 0.00 H new ATOM 0 HB3 PHE A 512 1.463 -24.468 -9.017 1.00 0.00 H new ATOM 0 HD1 PHE A 512 1.508 -24.322 -11.630 1.00 0.00 H new ATOM 0 HD2 PHE A 512 3.500 -21.596 -9.090 1.00 0.00 H new ATOM 0 HE1 PHE A 512 3.033 -23.690 -13.506 1.00 0.00 H new ATOM 0 HE2 PHE A 512 5.025 -20.964 -10.965 1.00 0.00 H new ATOM 0 HZ PHE A 512 4.773 -22.017 -13.150 1.00 0.00 H new ATOM 1447 N GLN A 513 -0.052 -21.270 -11.068 1.00 0.00 N ATOM 1448 CA GLN A 513 -0.257 -20.817 -12.433 1.00 0.00 C ATOM 1449 C GLN A 513 1.045 -20.252 -13.006 1.00 0.00 C ATOM 1450 O GLN A 513 1.705 -19.434 -12.367 1.00 0.00 O ATOM 1451 CB GLN A 513 -1.381 -19.782 -12.506 1.00 0.00 C ATOM 1452 CG GLN A 513 -2.253 -20.005 -13.743 1.00 0.00 C ATOM 1453 CD GLN A 513 -3.704 -20.290 -13.348 1.00 0.00 C ATOM 1454 OE1 GLN A 513 -4.403 -19.449 -12.808 1.00 0.00 O ATOM 1455 NE2 GLN A 513 -4.113 -21.519 -13.646 1.00 0.00 N ATOM 0 H GLN A 513 0.205 -20.535 -10.409 1.00 0.00 H new ATOM 0 HA GLN A 513 -0.557 -21.673 -13.037 1.00 0.00 H new ATOM 0 HB2 GLN A 513 -1.995 -19.843 -11.608 1.00 0.00 H new ATOM 0 HB3 GLN A 513 -0.955 -18.779 -12.533 1.00 0.00 H new ATOM 0 HG2 GLN A 513 -2.213 -19.124 -14.384 1.00 0.00 H new ATOM 0 HG3 GLN A 513 -1.860 -20.840 -14.324 1.00 0.00 H new ATOM 0 HE21 GLN A 513 -3.475 -22.173 -14.099 1.00 0.00 H new ATOM 0 HE22 GLN A 513 -5.065 -21.808 -13.422 1.00 0.00 H new ATOM 1464 N CYS A 514 1.376 -20.711 -14.204 1.00 0.00 N ATOM 1465 CA CYS A 514 2.587 -20.262 -14.871 1.00 0.00 C ATOM 1466 C CYS A 514 2.216 -19.124 -15.824 1.00 0.00 C ATOM 1467 O CYS A 514 1.961 -19.357 -17.004 1.00 0.00 O ATOM 1468 CB CYS A 514 3.292 -21.409 -15.596 1.00 0.00 C ATOM 1469 SG CYS A 514 4.773 -20.918 -16.551 1.00 0.00 S ATOM 0 H CYS A 514 0.826 -21.390 -14.731 1.00 0.00 H new ATOM 0 HA CYS A 514 3.299 -19.897 -14.131 1.00 0.00 H new ATOM 0 HB2 CYS A 514 3.583 -22.160 -14.862 1.00 0.00 H new ATOM 0 HB3 CYS A 514 2.581 -21.884 -16.273 1.00 0.00 H new ATOM 1474 N GLU A 515 2.201 -17.918 -15.277 1.00 0.00 N ATOM 1475 CA GLU A 515 1.867 -16.744 -16.065 1.00 0.00 C ATOM 1476 C GLU A 515 2.671 -16.730 -17.366 1.00 0.00 C ATOM 1477 O GLU A 515 3.648 -17.466 -17.503 1.00 0.00 O ATOM 1478 CB GLU A 515 2.098 -15.461 -15.263 1.00 0.00 C ATOM 1479 CG GLU A 515 0.782 -14.916 -14.708 1.00 0.00 C ATOM 1480 CD GLU A 515 -0.160 -14.496 -15.839 1.00 0.00 C ATOM 1481 OE1 GLU A 515 -0.185 -13.316 -16.218 1.00 0.00 O ATOM 1482 OE2 GLU A 515 -0.881 -15.447 -16.329 1.00 0.00 O ATOM 0 H GLU A 515 2.415 -17.728 -14.298 1.00 0.00 H new ATOM 0 HA GLU A 515 0.808 -16.790 -16.317 1.00 0.00 H new ATOM 0 HB2 GLU A 515 2.788 -15.660 -14.443 1.00 0.00 H new ATOM 0 HB3 GLU A 515 2.567 -14.710 -15.899 1.00 0.00 H new ATOM 0 HG2 GLU A 515 0.301 -15.676 -14.093 1.00 0.00 H new ATOM 0 HG3 GLU A 515 0.982 -14.062 -14.061 1.00 0.00 H new ATOM 1490 N CYS A 516 2.232 -15.887 -18.287 1.00 0.00 N ATOM 1491 CA CYS A 516 2.901 -15.768 -19.572 1.00 0.00 C ATOM 1492 C CYS A 516 3.559 -14.389 -19.647 1.00 0.00 C ATOM 1493 O CYS A 516 2.940 -13.382 -19.302 1.00 0.00 O ATOM 1494 CB CYS A 516 1.935 -16.002 -20.736 1.00 0.00 C ATOM 1495 SG CYS A 516 0.244 -15.353 -20.473 1.00 0.00 S ATOM 0 H CYS A 516 1.421 -15.279 -18.170 1.00 0.00 H new ATOM 0 HA CYS A 516 3.666 -16.539 -19.658 1.00 0.00 H new ATOM 0 HB2 CYS A 516 2.350 -15.542 -21.632 1.00 0.00 H new ATOM 0 HB3 CYS A 516 1.872 -17.073 -20.928 1.00 0.00 H new ATOM 1500 N PRO A 517 4.837 -14.387 -20.108 1.00 0.00 N ATOM 1501 CA PRO A 517 5.586 -13.147 -20.232 1.00 0.00 C ATOM 1502 C PRO A 517 5.112 -12.337 -21.440 1.00 0.00 C ATOM 1503 O PRO A 517 4.022 -12.573 -21.960 1.00 0.00 O ATOM 1504 CB PRO A 517 7.041 -13.575 -20.339 1.00 0.00 C ATOM 1505 CG PRO A 517 7.015 -15.042 -20.737 1.00 0.00 C ATOM 1506 CD PRO A 517 5.601 -15.559 -20.524 1.00 0.00 C ATOM 0 HA PRO A 517 5.441 -12.482 -19.380 1.00 0.00 H new ATOM 0 HB2 PRO A 517 7.570 -12.978 -21.082 1.00 0.00 H new ATOM 0 HB3 PRO A 517 7.560 -13.437 -19.390 1.00 0.00 H new ATOM 0 HG2 PRO A 517 7.311 -15.160 -21.779 1.00 0.00 H new ATOM 0 HG3 PRO A 517 7.724 -15.613 -20.137 1.00 0.00 H new ATOM 0 HD2 PRO A 517 5.196 -15.992 -21.439 1.00 0.00 H new ATOM 0 HD3 PRO A 517 5.575 -16.339 -19.763 1.00 0.00 H new ATOM 1514 N THR A 518 5.953 -11.400 -21.851 1.00 0.00 N ATOM 1515 CA THR A 518 5.632 -10.554 -22.988 1.00 0.00 C ATOM 1516 C THR A 518 6.911 -9.981 -23.602 1.00 0.00 C ATOM 1517 O THR A 518 6.991 -8.783 -23.871 1.00 0.00 O ATOM 1518 CB THR A 518 4.649 -9.480 -22.517 1.00 0.00 C ATOM 1519 OG1 THR A 518 4.328 -8.760 -23.703 1.00 0.00 O ATOM 1520 CG2 THR A 518 5.311 -8.436 -21.615 1.00 0.00 C ATOM 0 H THR A 518 6.856 -11.208 -21.417 1.00 0.00 H new ATOM 0 HA THR A 518 5.153 -11.125 -23.784 1.00 0.00 H new ATOM 0 HB THR A 518 3.825 -9.952 -21.982 1.00 0.00 H new ATOM 0 HG1 THR A 518 5.121 -8.276 -24.017 1.00 0.00 H new ATOM 0 HG21 THR A 518 4.570 -7.697 -21.309 1.00 0.00 H new ATOM 0 HG22 THR A 518 5.721 -8.926 -20.732 1.00 0.00 H new ATOM 0 HG23 THR A 518 6.114 -7.940 -22.161 1.00 0.00 H new ATOM 1528 N GLY A 519 7.879 -10.862 -23.807 1.00 0.00 N ATOM 1529 CA GLY A 519 9.150 -10.458 -24.384 1.00 0.00 C ATOM 1530 C GLY A 519 9.532 -11.365 -25.555 1.00 0.00 C ATOM 1531 O GLY A 519 9.999 -10.886 -26.589 1.00 0.00 O ATOM 0 H GLY A 519 7.809 -11.855 -23.584 1.00 0.00 H new ATOM 0 HA2 GLY A 519 9.087 -9.425 -24.725 1.00 0.00 H new ATOM 0 HA3 GLY A 519 9.928 -10.495 -23.622 1.00 0.00 H new ATOM 1535 N PHE A 520 9.320 -12.657 -25.355 1.00 0.00 N ATOM 1536 CA PHE A 520 9.637 -13.635 -26.384 1.00 0.00 C ATOM 1537 C PHE A 520 8.774 -13.421 -27.628 1.00 0.00 C ATOM 1538 O PHE A 520 9.264 -13.528 -28.753 1.00 0.00 O ATOM 1539 CB PHE A 520 9.332 -15.015 -25.797 1.00 0.00 C ATOM 1540 CG PHE A 520 10.084 -15.321 -24.500 1.00 0.00 C ATOM 1541 CD1 PHE A 520 11.314 -15.898 -24.548 1.00 0.00 C ATOM 1542 CD2 PHE A 520 9.523 -15.015 -23.300 1.00 0.00 C ATOM 1543 CE1 PHE A 520 12.013 -16.182 -23.344 1.00 0.00 C ATOM 1544 CE2 PHE A 520 10.222 -15.298 -22.096 1.00 0.00 C ATOM 1545 CZ PHE A 520 11.451 -15.876 -22.143 1.00 0.00 C ATOM 0 H PHE A 520 8.933 -13.050 -24.497 1.00 0.00 H new ATOM 0 HA PHE A 520 10.682 -13.540 -26.679 1.00 0.00 H new ATOM 0 HB2 PHE A 520 8.261 -15.090 -25.610 1.00 0.00 H new ATOM 0 HB3 PHE A 520 9.580 -15.776 -26.537 1.00 0.00 H new ATOM 0 HD1 PHE A 520 11.760 -16.141 -25.501 1.00 0.00 H new ATOM 0 HD2 PHE A 520 8.546 -14.557 -23.262 1.00 0.00 H new ATOM 0 HE1 PHE A 520 12.990 -16.641 -23.382 1.00 0.00 H new ATOM 0 HE2 PHE A 520 9.776 -15.054 -21.143 1.00 0.00 H new ATOM 0 HZ PHE A 520 11.982 -16.092 -21.228 1.00 0.00 H new ATOM 1555 N THR A 521 7.507 -13.121 -27.387 1.00 0.00 N ATOM 1556 CA THR A 521 6.572 -12.891 -28.476 1.00 0.00 C ATOM 1557 C THR A 521 6.593 -14.068 -29.454 1.00 0.00 C ATOM 1558 O THR A 521 7.485 -14.912 -29.396 1.00 0.00 O ATOM 1559 CB THR A 521 6.926 -11.554 -29.127 1.00 0.00 C ATOM 1560 OG1 THR A 521 5.833 -11.296 -30.005 1.00 0.00 O ATOM 1561 CG2 THR A 521 8.136 -11.656 -30.057 1.00 0.00 C ATOM 0 H THR A 521 7.105 -13.032 -26.454 1.00 0.00 H new ATOM 0 HA THR A 521 5.547 -12.830 -28.112 1.00 0.00 H new ATOM 0 HB THR A 521 7.127 -10.815 -28.351 1.00 0.00 H new ATOM 0 HG1 THR A 521 5.979 -10.445 -30.468 1.00 0.00 H new ATOM 0 HG21 THR A 521 8.344 -10.679 -30.492 1.00 0.00 H new ATOM 0 HG22 THR A 521 9.004 -11.992 -29.489 1.00 0.00 H new ATOM 0 HG23 THR A 521 7.924 -12.370 -30.853 1.00 0.00 H new ATOM 1569 N GLY A 522 5.598 -14.084 -30.329 1.00 0.00 N ATOM 1570 CA GLY A 522 5.491 -15.144 -31.318 1.00 0.00 C ATOM 1571 C GLY A 522 4.320 -16.075 -31.000 1.00 0.00 C ATOM 1572 O GLY A 522 3.465 -16.316 -31.851 1.00 0.00 O ATOM 0 H GLY A 522 4.860 -13.381 -30.374 1.00 0.00 H new ATOM 0 HA2 GLY A 522 5.356 -14.710 -32.309 1.00 0.00 H new ATOM 0 HA3 GLY A 522 6.418 -15.716 -31.345 1.00 0.00 H new ATOM 1576 N HIS A 523 4.317 -16.572 -29.772 1.00 0.00 N ATOM 1577 CA HIS A 523 3.265 -17.472 -29.331 1.00 0.00 C ATOM 1578 C HIS A 523 2.040 -16.660 -28.908 1.00 0.00 C ATOM 1579 O HIS A 523 0.929 -16.923 -29.366 1.00 0.00 O ATOM 1580 CB HIS A 523 3.772 -18.400 -28.225 1.00 0.00 C ATOM 1581 CG HIS A 523 3.485 -19.862 -28.470 1.00 0.00 C ATOM 1582 ND1 HIS A 523 2.200 -20.363 -28.598 1.00 0.00 N ATOM 1583 CD2 HIS A 523 4.328 -20.924 -28.611 1.00 0.00 C ATOM 1584 CE1 HIS A 523 2.279 -21.668 -28.804 1.00 0.00 C ATOM 1585 NE2 HIS A 523 3.599 -22.015 -28.812 1.00 0.00 N ATOM 0 H HIS A 523 5.027 -16.368 -29.068 1.00 0.00 H new ATOM 0 HA HIS A 523 2.963 -18.117 -30.156 1.00 0.00 H new ATOM 0 HB2 HIS A 523 4.848 -18.265 -28.116 1.00 0.00 H new ATOM 0 HB3 HIS A 523 3.317 -18.104 -27.280 1.00 0.00 H new ATOM 0 HD2 HIS A 523 5.406 -20.884 -28.567 1.00 0.00 H new ATOM 0 HE1 HIS A 523 1.445 -22.340 -28.942 1.00 0.00 H new ATOM 0 HE2 HIS A 523 3.965 -22.957 -28.950 1.00 0.00 H new ATOM 1593 N LEU A 524 2.283 -15.690 -28.039 1.00 0.00 N ATOM 1594 CA LEU A 524 1.213 -14.837 -27.550 1.00 0.00 C ATOM 1595 C LEU A 524 0.307 -15.647 -26.619 1.00 0.00 C ATOM 1596 O LEU A 524 -0.123 -16.745 -26.969 1.00 0.00 O ATOM 1597 CB LEU A 524 0.471 -14.185 -28.717 1.00 0.00 C ATOM 1598 CG LEU A 524 0.627 -12.668 -28.848 1.00 0.00 C ATOM 1599 CD1 LEU A 524 1.485 -12.307 -30.061 1.00 0.00 C ATOM 1600 CD2 LEU A 524 -0.739 -11.979 -28.886 1.00 0.00 C ATOM 0 H LEU A 524 3.206 -15.476 -27.661 1.00 0.00 H new ATOM 0 HA LEU A 524 1.620 -14.014 -26.963 1.00 0.00 H new ATOM 0 HB2 LEU A 524 0.814 -14.647 -29.643 1.00 0.00 H new ATOM 0 HB3 LEU A 524 -0.590 -14.414 -28.620 1.00 0.00 H new ATOM 0 HG LEU A 524 1.149 -12.301 -27.965 1.00 0.00 H new ATOM 0 HD11 LEU A 524 1.580 -11.223 -30.130 1.00 0.00 H new ATOM 0 HD12 LEU A 524 2.474 -12.751 -29.952 1.00 0.00 H new ATOM 0 HD13 LEU A 524 1.014 -12.689 -30.967 1.00 0.00 H new ATOM 0 HD21 LEU A 524 -0.601 -10.902 -28.979 1.00 0.00 H new ATOM 0 HD22 LEU A 524 -1.309 -12.347 -29.739 1.00 0.00 H new ATOM 0 HD23 LEU A 524 -1.282 -12.197 -27.966 1.00 0.00 H new ATOM 1612 N CYS A 525 0.045 -15.074 -25.455 1.00 0.00 N ATOM 1613 CA CYS A 525 -0.802 -15.729 -24.472 1.00 0.00 C ATOM 1614 C CYS A 525 -1.813 -14.705 -23.951 1.00 0.00 C ATOM 1615 O CYS A 525 -3.017 -14.855 -24.157 1.00 0.00 O ATOM 1616 CB CYS A 525 0.019 -16.347 -23.340 1.00 0.00 C ATOM 1617 SG CYS A 525 -0.886 -16.559 -21.763 1.00 0.00 S ATOM 0 H CYS A 525 0.404 -14.163 -25.169 1.00 0.00 H new ATOM 0 HA CYS A 525 -1.334 -16.557 -24.940 1.00 0.00 H new ATOM 0 HB2 CYS A 525 0.386 -17.320 -23.666 1.00 0.00 H new ATOM 0 HB3 CYS A 525 0.893 -15.721 -23.160 1.00 0.00 H new ATOM 1622 N GLN A 526 -1.287 -13.686 -23.287 1.00 0.00 N ATOM 1623 CA GLN A 526 -2.128 -12.638 -22.736 1.00 0.00 C ATOM 1624 C GLN A 526 -3.097 -13.222 -21.706 1.00 0.00 C ATOM 1625 O GLN A 526 -2.747 -13.377 -20.536 1.00 0.00 O ATOM 1626 CB GLN A 526 -2.884 -11.901 -23.842 1.00 0.00 C ATOM 1627 CG GLN A 526 -2.906 -10.393 -23.582 1.00 0.00 C ATOM 1628 CD GLN A 526 -2.905 -9.610 -24.896 1.00 0.00 C ATOM 1629 OE1 GLN A 526 -2.535 -10.108 -25.946 1.00 0.00 O ATOM 1630 NE2 GLN A 526 -3.340 -8.359 -24.780 1.00 0.00 N ATOM 0 H GLN A 526 -0.288 -13.564 -23.118 1.00 0.00 H new ATOM 0 HA GLN A 526 -1.487 -11.913 -22.235 1.00 0.00 H new ATOM 0 HB2 GLN A 526 -2.413 -12.101 -24.804 1.00 0.00 H new ATOM 0 HB3 GLN A 526 -3.905 -12.278 -23.903 1.00 0.00 H new ATOM 0 HG2 GLN A 526 -3.791 -10.134 -23.001 1.00 0.00 H new ATOM 0 HG3 GLN A 526 -2.038 -10.111 -22.986 1.00 0.00 H new ATOM 0 HE21 GLN A 526 -3.635 -8.004 -23.871 1.00 0.00 H new ATOM 0 HE22 GLN A 526 -3.378 -7.754 -25.601 1.00 0.00 H new TER 1639 GLN A 526