USER MOD reduce.3.24.130724 H: found=0, std=0, add=701, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 700 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 476 GLN :FLIP amide:sc= 0.764 F(o=-0.067,f=1.6) USER MOD Set 1.2: A 497 SER OG : rot -113:sc= 0.859 USER MOD Set 2.1: A 496 TYR OH : rot 30:sc= 0.881 USER MOD Set 2.2: A 505 TYR OH : rot 30:sc= 1.37 USER MOD Set 3.1: A 464 TYR OH : rot 180:sc= -0.118 USER MOD Set 3.2: A 506 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 440 HIS : no HE2:sc= -9.96! C(o=-9.6!,f=-14!) USER MOD Set 4.2: A 449 THR OG1 : rot -123:sc= 0.38 USER MOD Set 5.1: A 435 ASN : amide:sc= -4.06! C(o=-3.6!,f=-12!) USER MOD Set 5.2: A 436 SER OG : rot 57:sc= 0.453 USER MOD Single : A 422 THR OG1 : rot 69:sc= -1.06! USER MOD Single : A 424 ASN : amide:sc= -4.06! C(o=-4.1!,f=-4.2!) USER MOD Single : A 425 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 427 THR OG1 : rot 180:sc= -1.57! USER MOD Single : A 429 TYR OH : rot 180:sc= -0.319 USER MOD Single : A 430 TYR OH : rot -145:sc= 0.399 USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 432 LYS NZ :NH3+ 142:sc= 0.623 (180deg=-0.269) USER MOD Single : A 438 TYR OH : rot 180:sc= 0 USER MOD Single : A 441 TYR OH : rot 180:sc= -0.0132 USER MOD Single : A 447 SER OG : rot 180:sc= 0 USER MOD Single : A 455 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 456 MET CE :methyl 163:sc= -3.35! (180deg=-4.59!) USER MOD Single : A 457 GLN : amide:sc=-0.00144 X(o=-0.0014,f=-0.018) USER MOD Single : A 462 SER OG : rot 65:sc= 1.11 USER MOD Single : A 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 468 THR OG1 : rot 180:sc= 0 USER MOD Single : A 473 SER OG : rot 180:sc= 0 USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD Single : A 482 ASN : amide:sc= -8.05! C(o=-8!,f=-14!) USER MOD Single : A 485 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 486 ASN :FLIP amide:sc= -0.0314 F(o=-1,f=-0.031) USER MOD Single : A 487 ASN : amide:sc= 0.306 X(o=0.31,f=0) USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 491 ASN : amide:sc= 0.0738 K(o=0.074,f=-0.81) USER MOD Single : A 492 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 493 THR OG1 : rot -65:sc= 1.13 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 495 ASN : amide:sc= -9.67! C(o=-9.7!,f=-11!) USER MOD Single : A 499 SER OG : rot 180:sc= 0.0202 USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 THR OG1 : rot 180:sc= -0.0197 USER MOD Single : A 503 SER OG : rot 180:sc= -1.01 USER MOD Single : A 504 THR OG1 : rot 70:sc= -1.2 USER MOD Single : A 509 ASN :FLIP amide:sc= -0.878 F(o=-1.5!,f=-0.88) USER MOD Single : A 510 SER OG : rot 180:sc= 0 USER MOD Single : A 512 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 515 THR OG1 : rot 50:sc= 0.538 USER MOD Single : A 517 THR OG1 : rot 180:sc= 0 USER MOD Single : A 518 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 420 -14.342 -11.757 8.015 1.00 0.00 N ATOM 2 CA GLY A 420 -15.185 -10.600 7.768 1.00 0.00 C ATOM 3 C GLY A 420 -15.439 -9.821 9.060 1.00 0.00 C ATOM 4 O GLY A 420 -15.162 -10.315 10.152 1.00 0.00 O ATOM 0 HA2 GLY A 420 -14.710 -9.949 7.034 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -16.135 -10.922 7.341 1.00 0.00 H new ATOM 8 N GLY A 421 -15.963 -8.615 8.894 1.00 0.00 N ATOM 9 CA GLY A 421 -16.257 -7.763 10.033 1.00 0.00 C ATOM 10 C GLY A 421 -15.268 -6.598 10.116 1.00 0.00 C ATOM 11 O GLY A 421 -14.057 -6.801 10.042 1.00 0.00 O ATOM 0 H GLY A 421 -16.191 -8.208 7.987 1.00 0.00 H new ATOM 0 HA2 GLY A 421 -17.273 -7.377 9.950 1.00 0.00 H new ATOM 0 HA3 GLY A 421 -16.212 -8.349 10.951 1.00 0.00 H new ATOM 15 N THR A 422 -15.821 -5.404 10.268 1.00 0.00 N ATOM 16 CA THR A 422 -15.003 -4.207 10.361 1.00 0.00 C ATOM 17 C THR A 422 -14.588 -3.956 11.812 1.00 0.00 C ATOM 18 O THR A 422 -15.100 -4.598 12.728 1.00 0.00 O ATOM 19 CB THR A 422 -15.790 -3.048 9.745 1.00 0.00 C ATOM 20 OG1 THR A 422 -14.921 -1.927 9.883 1.00 0.00 O ATOM 21 CG2 THR A 422 -17.020 -2.670 10.573 1.00 0.00 C ATOM 0 H THR A 422 -16.826 -5.240 10.329 1.00 0.00 H new ATOM 0 HA THR A 422 -14.072 -4.320 9.805 1.00 0.00 H new ATOM 0 HB THR A 422 -16.101 -3.316 8.735 1.00 0.00 H new ATOM 0 HG1 THR A 422 -14.146 -2.039 9.294 1.00 0.00 H new ATOM 0 HG21 THR A 422 -17.542 -1.843 10.092 1.00 0.00 H new ATOM 0 HG22 THR A 422 -17.688 -3.528 10.645 1.00 0.00 H new ATOM 0 HG23 THR A 422 -16.707 -2.369 11.573 1.00 0.00 H new ATOM 29 N GLY A 423 -13.664 -3.021 11.976 1.00 0.00 N ATOM 30 CA GLY A 423 -13.173 -2.678 13.300 1.00 0.00 C ATOM 31 C GLY A 423 -11.850 -1.914 13.214 1.00 0.00 C ATOM 32 O GLY A 423 -11.798 -0.720 13.506 1.00 0.00 O ATOM 0 H GLY A 423 -13.242 -2.490 11.214 1.00 0.00 H new ATOM 0 HA2 GLY A 423 -13.914 -2.071 13.821 1.00 0.00 H new ATOM 0 HA3 GLY A 423 -13.035 -3.586 13.887 1.00 0.00 H new ATOM 36 N ASN A 424 -10.813 -2.634 12.811 1.00 0.00 N ATOM 37 CA ASN A 424 -9.494 -2.040 12.683 1.00 0.00 C ATOM 38 C ASN A 424 -9.356 -1.408 11.296 1.00 0.00 C ATOM 39 O ASN A 424 -10.007 -1.840 10.346 1.00 0.00 O ATOM 40 CB ASN A 424 -8.397 -3.096 12.833 1.00 0.00 C ATOM 41 CG ASN A 424 -8.220 -3.498 14.298 1.00 0.00 C ATOM 42 OD1 ASN A 424 -8.297 -4.660 14.664 1.00 0.00 O ATOM 43 ND2 ASN A 424 -7.979 -2.477 15.115 1.00 0.00 N ATOM 0 H ASN A 424 -10.860 -3.624 12.569 1.00 0.00 H new ATOM 0 HA ASN A 424 -9.384 -1.292 13.468 1.00 0.00 H new ATOM 0 HB2 ASN A 424 -8.649 -3.974 12.239 1.00 0.00 H new ATOM 0 HB3 ASN A 424 -7.457 -2.707 12.443 1.00 0.00 H new ATOM 0 HD21 ASN A 424 -7.846 -2.643 16.113 1.00 0.00 H new ATOM 0 HD22 ASN A 424 -7.927 -1.528 14.744 1.00 0.00 H new ATOM 50 N LYS A 425 -8.504 -0.396 11.224 1.00 0.00 N ATOM 51 CA LYS A 425 -8.272 0.299 9.969 1.00 0.00 C ATOM 52 C LYS A 425 -6.770 0.345 9.686 1.00 0.00 C ATOM 53 O LYS A 425 -5.962 0.428 10.610 1.00 0.00 O ATOM 54 CB LYS A 425 -8.937 1.677 9.990 1.00 0.00 C ATOM 55 CG LYS A 425 -10.423 1.575 9.640 1.00 0.00 C ATOM 56 CD LYS A 425 -10.659 1.873 8.158 1.00 0.00 C ATOM 57 CE LYS A 425 -11.219 3.283 7.964 1.00 0.00 C ATOM 58 NZ LYS A 425 -12.675 3.303 8.228 1.00 0.00 N ATOM 0 H LYS A 425 -7.966 -0.041 12.014 1.00 0.00 H new ATOM 0 HA LYS A 425 -8.735 -0.241 9.143 1.00 0.00 H new ATOM 0 HB2 LYS A 425 -8.822 2.125 10.977 1.00 0.00 H new ATOM 0 HB3 LYS A 425 -8.437 2.337 9.281 1.00 0.00 H new ATOM 0 HG2 LYS A 425 -10.788 0.576 9.876 1.00 0.00 H new ATOM 0 HG3 LYS A 425 -10.993 2.275 10.251 1.00 0.00 H new ATOM 0 HD2 LYS A 425 -9.723 1.771 7.609 1.00 0.00 H new ATOM 0 HD3 LYS A 425 -11.353 1.142 7.743 1.00 0.00 H new ATOM 0 HE2 LYS A 425 -10.712 3.977 8.634 1.00 0.00 H new ATOM 0 HE3 LYS A 425 -11.023 3.622 6.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 425 -13.039 4.268 8.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 425 -13.156 2.655 7.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 425 -12.855 3.000 9.207 1.00 0.00 H new ATOM 71 N VAL A 426 -6.439 0.288 8.404 1.00 0.00 N ATOM 72 CA VAL A 426 -5.048 0.322 7.987 1.00 0.00 C ATOM 73 C VAL A 426 -4.882 1.341 6.858 1.00 0.00 C ATOM 74 O VAL A 426 -5.559 1.253 5.834 1.00 0.00 O ATOM 75 CB VAL A 426 -4.584 -1.083 7.598 1.00 0.00 C ATOM 76 CG1 VAL A 426 -3.065 -1.129 7.418 1.00 0.00 C ATOM 77 CG2 VAL A 426 -5.046 -2.117 8.626 1.00 0.00 C ATOM 0 H VAL A 426 -7.111 0.218 7.640 1.00 0.00 H new ATOM 0 HA VAL A 426 -4.411 0.644 8.810 1.00 0.00 H new ATOM 0 HB VAL A 426 -5.042 -1.334 6.641 1.00 0.00 H new ATOM 0 HG11 VAL A 426 -2.762 -2.139 7.142 1.00 0.00 H new ATOM 0 HG12 VAL A 426 -2.771 -0.434 6.632 1.00 0.00 H new ATOM 0 HG13 VAL A 426 -2.579 -0.847 8.352 1.00 0.00 H new ATOM 0 HG21 VAL A 426 -4.703 -3.107 8.326 1.00 0.00 H new ATOM 0 HG22 VAL A 426 -4.630 -1.870 9.603 1.00 0.00 H new ATOM 0 HG23 VAL A 426 -6.134 -2.112 8.683 1.00 0.00 H new ATOM 87 N THR A 427 -3.979 2.284 7.082 1.00 0.00 N ATOM 88 CA THR A 427 -3.716 3.318 6.096 1.00 0.00 C ATOM 89 C THR A 427 -2.316 3.148 5.504 1.00 0.00 C ATOM 90 O THR A 427 -1.353 2.917 6.235 1.00 0.00 O ATOM 91 CB THR A 427 -3.932 4.676 6.767 1.00 0.00 C ATOM 92 OG1 THR A 427 -5.309 4.668 7.133 1.00 0.00 O ATOM 93 CG2 THR A 427 -3.815 5.841 5.782 1.00 0.00 C ATOM 0 H THR A 427 -3.420 2.354 7.932 1.00 0.00 H new ATOM 0 HA THR A 427 -4.402 3.243 5.252 1.00 0.00 H new ATOM 0 HB THR A 427 -3.205 4.804 7.569 1.00 0.00 H new ATOM 0 HG1 THR A 427 -5.534 5.512 7.577 1.00 0.00 H new ATOM 0 HG21 THR A 427 -3.977 6.781 6.309 1.00 0.00 H new ATOM 0 HG22 THR A 427 -2.821 5.842 5.336 1.00 0.00 H new ATOM 0 HG23 THR A 427 -4.564 5.731 4.998 1.00 0.00 H new ATOM 101 N ILE A 428 -2.246 3.268 4.187 1.00 0.00 N ATOM 102 CA ILE A 428 -0.980 3.129 3.488 1.00 0.00 C ATOM 103 C ILE A 428 -0.815 4.291 2.506 1.00 0.00 C ATOM 104 O ILE A 428 -1.657 4.494 1.633 1.00 0.00 O ATOM 105 CB ILE A 428 -0.876 1.750 2.834 1.00 0.00 C ATOM 106 CG1 ILE A 428 -0.400 0.700 3.839 1.00 0.00 C ATOM 107 CG2 ILE A 428 0.014 1.799 1.591 1.00 0.00 C ATOM 108 CD1 ILE A 428 -1.587 -0.007 4.496 1.00 0.00 C ATOM 0 H ILE A 428 -3.046 3.460 3.585 1.00 0.00 H new ATOM 0 HA ILE A 428 -0.149 3.184 4.191 1.00 0.00 H new ATOM 0 HB ILE A 428 -1.872 1.452 2.506 1.00 0.00 H new ATOM 0 HG12 ILE A 428 0.230 -0.032 3.334 1.00 0.00 H new ATOM 0 HG13 ILE A 428 0.214 1.175 4.604 1.00 0.00 H new ATOM 0 HG21 ILE A 428 0.071 0.806 1.145 1.00 0.00 H new ATOM 0 HG22 ILE A 428 -0.408 2.497 0.868 1.00 0.00 H new ATOM 0 HG23 ILE A 428 1.014 2.129 1.872 1.00 0.00 H new ATOM 0 HD11 ILE A 428 -1.221 -0.749 5.206 1.00 0.00 H new ATOM 0 HD12 ILE A 428 -2.202 0.725 5.020 1.00 0.00 H new ATOM 0 HD13 ILE A 428 -2.185 -0.502 3.731 1.00 0.00 H new ATOM 120 N TYR A 429 0.276 5.022 2.681 1.00 0.00 N ATOM 121 CA TYR A 429 0.562 6.157 1.821 1.00 0.00 C ATOM 122 C TYR A 429 1.819 5.908 0.984 1.00 0.00 C ATOM 123 O TYR A 429 2.926 5.861 1.518 1.00 0.00 O ATOM 124 CB TYR A 429 0.814 7.342 2.756 1.00 0.00 C ATOM 125 CG TYR A 429 -0.423 7.794 3.534 1.00 0.00 C ATOM 126 CD1 TYR A 429 -1.654 7.234 3.259 1.00 0.00 C ATOM 127 CD2 TYR A 429 -0.309 8.763 4.510 1.00 0.00 C ATOM 128 CE1 TYR A 429 -2.819 7.660 3.991 1.00 0.00 C ATOM 129 CE2 TYR A 429 -1.473 9.189 5.242 1.00 0.00 C ATOM 130 CZ TYR A 429 -2.671 8.617 4.946 1.00 0.00 C ATOM 131 OH TYR A 429 -3.771 9.019 5.638 1.00 0.00 O ATOM 0 H TYR A 429 0.973 4.850 3.406 1.00 0.00 H new ATOM 0 HA TYR A 429 -0.265 6.335 1.133 1.00 0.00 H new ATOM 0 HB2 TYR A 429 1.598 7.073 3.464 1.00 0.00 H new ATOM 0 HB3 TYR A 429 1.189 8.181 2.170 1.00 0.00 H new ATOM 0 HD1 TYR A 429 -1.744 6.476 2.495 1.00 0.00 H new ATOM 0 HD2 TYR A 429 0.654 9.202 4.725 1.00 0.00 H new ATOM 0 HE1 TYR A 429 -3.788 7.229 3.786 1.00 0.00 H new ATOM 0 HE2 TYR A 429 -1.397 9.946 6.009 1.00 0.00 H new ATOM 0 HH TYR A 429 -3.515 9.706 6.288 1.00 0.00 H new ATOM 141 N TYR A 430 1.605 5.756 -0.315 1.00 0.00 N ATOM 142 CA TYR A 430 2.706 5.513 -1.231 1.00 0.00 C ATOM 143 C TYR A 430 2.996 6.752 -2.081 1.00 0.00 C ATOM 144 O TYR A 430 2.074 7.426 -2.536 1.00 0.00 O ATOM 145 CB TYR A 430 2.248 4.376 -2.148 1.00 0.00 C ATOM 146 CG TYR A 430 2.687 4.537 -3.605 1.00 0.00 C ATOM 147 CD1 TYR A 430 1.944 5.315 -4.468 1.00 0.00 C ATOM 148 CD2 TYR A 430 3.827 3.902 -4.056 1.00 0.00 C ATOM 149 CE1 TYR A 430 2.357 5.466 -5.839 1.00 0.00 C ATOM 150 CE2 TYR A 430 4.241 4.053 -5.427 1.00 0.00 C ATOM 151 CZ TYR A 430 3.485 4.828 -6.251 1.00 0.00 C ATOM 152 OH TYR A 430 3.875 4.970 -7.546 1.00 0.00 O ATOM 0 H TYR A 430 0.685 5.796 -0.754 1.00 0.00 H new ATOM 0 HA TYR A 430 3.615 5.268 -0.682 1.00 0.00 H new ATOM 0 HB2 TYR A 430 2.638 3.433 -1.764 1.00 0.00 H new ATOM 0 HB3 TYR A 430 1.161 4.309 -2.112 1.00 0.00 H new ATOM 0 HD1 TYR A 430 1.052 5.811 -4.115 1.00 0.00 H new ATOM 0 HD2 TYR A 430 4.408 3.292 -3.381 1.00 0.00 H new ATOM 0 HE1 TYR A 430 1.784 6.072 -6.525 1.00 0.00 H new ATOM 0 HE2 TYR A 430 5.131 3.562 -5.793 1.00 0.00 H new ATOM 0 HH TYR A 430 4.271 4.131 -7.862 1.00 0.00 H new ATOM 162 N LYS A 431 4.281 7.013 -2.269 1.00 0.00 N ATOM 163 CA LYS A 431 4.705 8.159 -3.055 1.00 0.00 C ATOM 164 C LYS A 431 4.210 7.996 -4.493 1.00 0.00 C ATOM 165 O LYS A 431 4.243 6.896 -5.044 1.00 0.00 O ATOM 166 CB LYS A 431 6.218 8.356 -2.944 1.00 0.00 C ATOM 167 CG LYS A 431 6.661 9.624 -3.676 1.00 0.00 C ATOM 168 CD LYS A 431 7.449 9.279 -4.942 1.00 0.00 C ATOM 169 CE LYS A 431 8.036 10.538 -5.582 1.00 0.00 C ATOM 170 NZ LYS A 431 9.488 10.373 -5.815 1.00 0.00 N ATOM 0 H LYS A 431 5.043 6.450 -1.890 1.00 0.00 H new ATOM 0 HA LYS A 431 4.259 9.074 -2.665 1.00 0.00 H new ATOM 0 HB2 LYS A 431 6.504 8.419 -1.894 1.00 0.00 H new ATOM 0 HB3 LYS A 431 6.733 7.491 -3.363 1.00 0.00 H new ATOM 0 HG2 LYS A 431 5.787 10.221 -3.938 1.00 0.00 H new ATOM 0 HG3 LYS A 431 7.277 10.234 -3.015 1.00 0.00 H new ATOM 0 HD2 LYS A 431 8.251 8.583 -4.697 1.00 0.00 H new ATOM 0 HD3 LYS A 431 6.796 8.775 -5.655 1.00 0.00 H new ATOM 0 HE2 LYS A 431 7.531 10.742 -6.526 1.00 0.00 H new ATOM 0 HE3 LYS A 431 7.861 11.397 -4.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 9.870 11.237 -6.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 9.968 10.200 -4.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 9.648 9.566 -6.451 1.00 0.00 H new ATOM 183 N LYS A 432 3.763 9.106 -5.062 1.00 0.00 N ATOM 184 CA LYS A 432 3.262 9.100 -6.425 1.00 0.00 C ATOM 185 C LYS A 432 4.436 8.952 -7.395 1.00 0.00 C ATOM 186 O LYS A 432 5.286 9.836 -7.486 1.00 0.00 O ATOM 187 CB LYS A 432 2.402 10.339 -6.686 1.00 0.00 C ATOM 188 CG LYS A 432 1.415 10.090 -7.828 1.00 0.00 C ATOM 189 CD LYS A 432 0.131 10.898 -7.628 1.00 0.00 C ATOM 190 CE LYS A 432 -0.911 10.089 -6.852 1.00 0.00 C ATOM 191 NZ LYS A 432 -2.044 9.723 -7.731 1.00 0.00 N ATOM 0 H LYS A 432 3.738 10.016 -4.603 1.00 0.00 H new ATOM 0 HA LYS A 432 2.605 8.245 -6.585 1.00 0.00 H new ATOM 0 HB2 LYS A 432 1.857 10.605 -5.781 1.00 0.00 H new ATOM 0 HB3 LYS A 432 3.043 11.186 -6.932 1.00 0.00 H new ATOM 0 HG2 LYS A 432 1.876 10.362 -8.778 1.00 0.00 H new ATOM 0 HG3 LYS A 432 1.176 9.028 -7.882 1.00 0.00 H new ATOM 0 HD2 LYS A 432 0.357 11.819 -7.090 1.00 0.00 H new ATOM 0 HD3 LYS A 432 -0.276 11.187 -8.597 1.00 0.00 H new ATOM 0 HE2 LYS A 432 -0.452 9.187 -6.447 1.00 0.00 H new ATOM 0 HE3 LYS A 432 -1.274 10.670 -6.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 432 -2.367 8.762 -7.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 432 -2.825 10.394 -7.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 432 -1.737 9.755 -8.724 1.00 0.00 H new ATOM 204 N GLY A 433 4.446 7.827 -8.095 1.00 0.00 N ATOM 205 CA GLY A 433 5.502 7.551 -9.054 1.00 0.00 C ATOM 206 C GLY A 433 4.922 7.260 -10.440 1.00 0.00 C ATOM 207 O GLY A 433 5.663 6.979 -11.380 1.00 0.00 O ATOM 0 H GLY A 433 3.739 7.096 -8.017 1.00 0.00 H new ATOM 0 HA2 GLY A 433 6.179 8.404 -9.111 1.00 0.00 H new ATOM 0 HA3 GLY A 433 6.091 6.699 -8.716 1.00 0.00 H new ATOM 211 N PHE A 434 3.602 7.338 -10.522 1.00 0.00 N ATOM 212 CA PHE A 434 2.914 7.086 -11.776 1.00 0.00 C ATOM 213 C PHE A 434 1.829 8.135 -12.027 1.00 0.00 C ATOM 214 O PHE A 434 1.948 8.951 -12.940 1.00 0.00 O ATOM 215 CB PHE A 434 2.257 5.709 -11.658 1.00 0.00 C ATOM 216 CG PHE A 434 2.957 4.615 -12.467 1.00 0.00 C ATOM 217 CD1 PHE A 434 4.112 4.064 -12.009 1.00 0.00 C ATOM 218 CD2 PHE A 434 2.422 4.193 -13.645 1.00 0.00 C ATOM 219 CE1 PHE A 434 4.761 3.048 -12.760 1.00 0.00 C ATOM 220 CE2 PHE A 434 3.072 3.178 -14.396 1.00 0.00 C ATOM 221 CZ PHE A 434 4.227 2.627 -13.937 1.00 0.00 C ATOM 0 H PHE A 434 2.991 7.572 -9.740 1.00 0.00 H new ATOM 0 HA PHE A 434 3.622 7.129 -12.603 1.00 0.00 H new ATOM 0 HB2 PHE A 434 2.239 5.415 -10.609 1.00 0.00 H new ATOM 0 HB3 PHE A 434 1.220 5.783 -11.987 1.00 0.00 H new ATOM 0 HD1 PHE A 434 4.536 4.399 -11.074 1.00 0.00 H new ATOM 0 HD2 PHE A 434 1.504 4.630 -14.009 1.00 0.00 H new ATOM 0 HE1 PHE A 434 5.679 2.610 -12.396 1.00 0.00 H new ATOM 0 HE2 PHE A 434 2.649 2.844 -15.332 1.00 0.00 H new ATOM 0 HZ PHE A 434 4.721 1.854 -14.508 1.00 0.00 H new ATOM 231 N ASN A 435 0.795 8.080 -11.200 1.00 0.00 N ATOM 232 CA ASN A 435 -0.311 9.015 -11.321 1.00 0.00 C ATOM 233 C ASN A 435 -1.583 8.368 -10.771 1.00 0.00 C ATOM 234 O ASN A 435 -2.472 9.059 -10.276 1.00 0.00 O ATOM 235 CB ASN A 435 -0.563 9.384 -12.784 1.00 0.00 C ATOM 236 CG ASN A 435 -0.407 8.163 -13.692 1.00 0.00 C ATOM 237 OD1 ASN A 435 -0.696 7.038 -13.319 1.00 0.00 O ATOM 238 ND2 ASN A 435 0.066 8.446 -14.903 1.00 0.00 N ATOM 0 H ASN A 435 0.700 7.402 -10.443 1.00 0.00 H new ATOM 0 HA ASN A 435 -0.054 9.914 -10.761 1.00 0.00 H new ATOM 0 HB2 ASN A 435 -1.567 9.796 -12.891 1.00 0.00 H new ATOM 0 HB3 ASN A 435 0.135 10.162 -13.092 1.00 0.00 H new ATOM 0 HD21 ASN A 435 0.206 7.699 -15.583 1.00 0.00 H new ATOM 0 HD22 ASN A 435 0.288 9.410 -15.151 1.00 0.00 H new ATOM 245 N SER A 436 -1.630 7.048 -10.876 1.00 0.00 N ATOM 246 CA SER A 436 -2.779 6.299 -10.396 1.00 0.00 C ATOM 247 C SER A 436 -2.425 4.816 -10.275 1.00 0.00 C ATOM 248 O SER A 436 -3.038 3.972 -10.927 1.00 0.00 O ATOM 249 CB SER A 436 -3.983 6.484 -11.322 1.00 0.00 C ATOM 250 OG SER A 436 -3.742 5.955 -12.623 1.00 0.00 O ATOM 0 H SER A 436 -0.891 6.478 -11.287 1.00 0.00 H new ATOM 0 HA SER A 436 -3.049 6.682 -9.412 1.00 0.00 H new ATOM 0 HB2 SER A 436 -4.854 5.994 -10.887 1.00 0.00 H new ATOM 0 HB3 SER A 436 -4.221 7.545 -11.400 1.00 0.00 H new ATOM 0 HG SER A 436 -3.502 5.008 -12.552 1.00 0.00 H new ATOM 256 N PRO A 437 -1.409 4.536 -9.415 1.00 0.00 N ATOM 257 CA PRO A 437 -0.965 3.169 -9.201 1.00 0.00 C ATOM 258 C PRO A 437 -1.961 2.399 -8.331 1.00 0.00 C ATOM 259 O PRO A 437 -2.770 3.000 -7.626 1.00 0.00 O ATOM 260 CB PRO A 437 0.407 3.297 -8.561 1.00 0.00 C ATOM 261 CG PRO A 437 0.483 4.714 -8.016 1.00 0.00 C ATOM 262 CD PRO A 437 -0.660 5.509 -8.626 1.00 0.00 C ATOM 0 HA PRO A 437 -0.906 2.596 -10.126 1.00 0.00 H new ATOM 0 HB2 PRO A 437 0.536 2.565 -7.764 1.00 0.00 H new ATOM 0 HB3 PRO A 437 1.197 3.116 -9.290 1.00 0.00 H new ATOM 0 HG2 PRO A 437 0.407 4.709 -6.929 1.00 0.00 H new ATOM 0 HG3 PRO A 437 1.441 5.169 -8.267 1.00 0.00 H new ATOM 0 HD2 PRO A 437 -1.285 5.959 -7.855 1.00 0.00 H new ATOM 0 HD3 PRO A 437 -0.288 6.322 -9.249 1.00 0.00 H new ATOM 270 N TYR A 438 -1.870 1.079 -8.410 1.00 0.00 N ATOM 271 CA TYR A 438 -2.753 0.221 -7.639 1.00 0.00 C ATOM 272 C TYR A 438 -2.015 -0.400 -6.452 1.00 0.00 C ATOM 273 O TYR A 438 -0.805 -0.615 -6.511 1.00 0.00 O ATOM 274 CB TYR A 438 -3.193 -0.894 -8.590 1.00 0.00 C ATOM 275 CG TYR A 438 -3.832 -0.390 -9.886 1.00 0.00 C ATOM 276 CD1 TYR A 438 -3.040 0.143 -10.883 1.00 0.00 C ATOM 277 CD2 TYR A 438 -5.199 -0.469 -10.058 1.00 0.00 C ATOM 278 CE1 TYR A 438 -3.641 0.617 -12.103 1.00 0.00 C ATOM 279 CE2 TYR A 438 -5.799 0.005 -11.278 1.00 0.00 C ATOM 280 CZ TYR A 438 -4.991 0.525 -12.241 1.00 0.00 C ATOM 281 OH TYR A 438 -5.558 0.972 -13.393 1.00 0.00 O ATOM 0 H TYR A 438 -1.198 0.583 -8.996 1.00 0.00 H new ATOM 0 HA TYR A 438 -3.594 0.791 -7.245 1.00 0.00 H new ATOM 0 HB2 TYR A 438 -2.328 -1.508 -8.839 1.00 0.00 H new ATOM 0 HB3 TYR A 438 -3.904 -1.539 -8.073 1.00 0.00 H new ATOM 0 HD1 TYR A 438 -1.970 0.205 -10.748 1.00 0.00 H new ATOM 0 HD2 TYR A 438 -5.818 -0.886 -9.278 1.00 0.00 H new ATOM 0 HE1 TYR A 438 -3.033 1.036 -12.891 1.00 0.00 H new ATOM 0 HE2 TYR A 438 -6.867 -0.051 -11.425 1.00 0.00 H new ATOM 0 HH TYR A 438 -6.528 0.842 -13.352 1.00 0.00 H new ATOM 291 N ILE A 439 -2.774 -0.672 -5.400 1.00 0.00 N ATOM 292 CA ILE A 439 -2.207 -1.263 -4.200 1.00 0.00 C ATOM 293 C ILE A 439 -3.068 -2.452 -3.767 1.00 0.00 C ATOM 294 O ILE A 439 -4.250 -2.289 -3.466 1.00 0.00 O ATOM 295 CB ILE A 439 -2.031 -0.203 -3.112 1.00 0.00 C ATOM 296 CG1 ILE A 439 -0.807 -0.506 -2.244 1.00 0.00 C ATOM 297 CG2 ILE A 439 -3.304 -0.057 -2.276 1.00 0.00 C ATOM 298 CD1 ILE A 439 -1.071 -1.698 -1.322 1.00 0.00 C ATOM 0 H ILE A 439 -3.777 -0.494 -5.354 1.00 0.00 H new ATOM 0 HA ILE A 439 -1.207 -1.649 -4.401 1.00 0.00 H new ATOM 0 HB ILE A 439 -1.853 0.757 -3.597 1.00 0.00 H new ATOM 0 HG12 ILE A 439 0.052 -0.718 -2.881 1.00 0.00 H new ATOM 0 HG13 ILE A 439 -0.553 0.371 -1.648 1.00 0.00 H new ATOM 0 HG21 ILE A 439 -3.151 0.703 -1.510 1.00 0.00 H new ATOM 0 HG22 ILE A 439 -4.131 0.239 -2.921 1.00 0.00 H new ATOM 0 HG23 ILE A 439 -3.538 -1.009 -1.800 1.00 0.00 H new ATOM 0 HD11 ILE A 439 -0.186 -1.892 -0.716 1.00 0.00 H new ATOM 0 HD12 ILE A 439 -1.915 -1.474 -0.670 1.00 0.00 H new ATOM 0 HD13 ILE A 439 -1.300 -2.578 -1.922 1.00 0.00 H new ATOM 310 N HIS A 440 -2.443 -3.619 -3.749 1.00 0.00 N ATOM 311 CA HIS A 440 -3.137 -4.834 -3.358 1.00 0.00 C ATOM 312 C HIS A 440 -2.955 -5.069 -1.857 1.00 0.00 C ATOM 313 O HIS A 440 -1.829 -5.146 -1.369 1.00 0.00 O ATOM 314 CB HIS A 440 -2.674 -6.022 -4.204 1.00 0.00 C ATOM 315 CG HIS A 440 -3.762 -7.024 -4.504 1.00 0.00 C ATOM 316 ND1 HIS A 440 -3.745 -7.837 -5.625 1.00 0.00 N ATOM 317 CD2 HIS A 440 -4.899 -7.337 -3.819 1.00 0.00 C ATOM 318 CE1 HIS A 440 -4.828 -8.600 -5.605 1.00 0.00 C ATOM 319 NE2 HIS A 440 -5.542 -8.288 -4.485 1.00 0.00 N ATOM 0 H HIS A 440 -1.463 -3.750 -3.999 1.00 0.00 H new ATOM 0 HA HIS A 440 -4.205 -4.723 -3.547 1.00 0.00 H new ATOM 0 HB2 HIS A 440 -2.269 -5.649 -5.145 1.00 0.00 H new ATOM 0 HB3 HIS A 440 -1.860 -6.529 -3.685 1.00 0.00 H new ATOM 0 HD1 HIS A 440 -3.022 -7.847 -6.344 1.00 0.00 H new ATOM 0 HD2 HIS A 440 -5.222 -6.887 -2.892 1.00 0.00 H new ATOM 0 HE1 HIS A 440 -5.098 -9.339 -6.345 1.00 0.00 H new ATOM 327 N TYR A 441 -4.081 -5.176 -1.166 1.00 0.00 N ATOM 328 CA TYR A 441 -4.060 -5.400 0.269 1.00 0.00 C ATOM 329 C TYR A 441 -4.891 -6.628 0.645 1.00 0.00 C ATOM 330 O TYR A 441 -5.852 -6.966 -0.044 1.00 0.00 O ATOM 331 CB TYR A 441 -4.693 -4.158 0.899 1.00 0.00 C ATOM 332 CG TYR A 441 -6.153 -3.933 0.499 1.00 0.00 C ATOM 333 CD1 TYR A 441 -7.131 -4.801 0.941 1.00 0.00 C ATOM 334 CD2 TYR A 441 -6.491 -2.863 -0.304 1.00 0.00 C ATOM 335 CE1 TYR A 441 -8.505 -4.589 0.565 1.00 0.00 C ATOM 336 CE2 TYR A 441 -7.865 -2.651 -0.680 1.00 0.00 C ATOM 337 CZ TYR A 441 -8.804 -3.525 -0.227 1.00 0.00 C ATOM 338 OH TYR A 441 -10.102 -3.325 -0.583 1.00 0.00 O ATOM 0 H TYR A 441 -5.014 -5.112 -1.574 1.00 0.00 H new ATOM 0 HA TYR A 441 -3.041 -5.571 0.616 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -4.633 -4.243 1.984 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -4.110 -3.282 0.615 1.00 0.00 H new ATOM 0 HD1 TYR A 441 -6.866 -5.639 1.569 1.00 0.00 H new ATOM 0 HD2 TYR A 441 -5.725 -2.185 -0.650 1.00 0.00 H new ATOM 0 HE1 TYR A 441 -9.280 -5.260 0.904 1.00 0.00 H new ATOM 0 HE2 TYR A 441 -8.144 -1.817 -1.307 1.00 0.00 H new ATOM 0 HH TYR A 441 -10.167 -2.527 -1.149 1.00 0.00 H new ATOM 348 N ARG A 442 -4.491 -7.263 1.737 1.00 0.00 N ATOM 349 CA ARG A 442 -5.186 -8.446 2.212 1.00 0.00 C ATOM 350 C ARG A 442 -5.029 -8.582 3.728 1.00 0.00 C ATOM 351 O ARG A 442 -3.911 -8.638 4.237 1.00 0.00 O ATOM 352 CB ARG A 442 -4.649 -9.710 1.536 1.00 0.00 C ATOM 353 CG ARG A 442 -4.922 -10.948 2.392 1.00 0.00 C ATOM 354 CD ARG A 442 -4.341 -12.204 1.740 1.00 0.00 C ATOM 355 NE ARG A 442 -3.483 -12.925 2.706 1.00 0.00 N ATOM 356 CZ ARG A 442 -2.790 -14.046 2.413 1.00 0.00 C ATOM 357 NH1 ARG A 442 -2.848 -14.584 1.176 1.00 0.00 N ATOM 358 NH2 ARG A 442 -2.054 -14.608 3.354 1.00 0.00 N ATOM 0 H ARG A 442 -3.694 -6.980 2.306 1.00 0.00 H new ATOM 0 HA ARG A 442 -6.241 -8.333 1.961 1.00 0.00 H new ATOM 0 HB2 ARG A 442 -5.115 -9.830 0.558 1.00 0.00 H new ATOM 0 HB3 ARG A 442 -3.577 -9.609 1.368 1.00 0.00 H new ATOM 0 HG2 ARG A 442 -4.487 -10.813 3.382 1.00 0.00 H new ATOM 0 HG3 ARG A 442 -5.996 -11.069 2.530 1.00 0.00 H new ATOM 0 HD2 ARG A 442 -5.148 -12.854 1.402 1.00 0.00 H new ATOM 0 HD3 ARG A 442 -3.761 -11.931 0.859 1.00 0.00 H new ATOM 0 HE ARG A 442 -3.411 -12.552 3.652 1.00 0.00 H new ATOM 0 HH11 ARG A 442 -3.419 -14.143 0.454 1.00 0.00 H new ATOM 0 HH12 ARG A 442 -2.321 -15.431 0.963 1.00 0.00 H new ATOM 0 HH21 ARG A 442 -2.015 -14.195 4.286 1.00 0.00 H new ATOM 0 HH22 ARG A 442 -1.524 -15.455 3.149 1.00 0.00 H new ATOM 371 N PRO A 443 -6.197 -8.631 4.424 1.00 0.00 N ATOM 372 CA PRO A 443 -6.199 -8.758 5.872 1.00 0.00 C ATOM 373 C PRO A 443 -5.845 -10.184 6.297 1.00 0.00 C ATOM 374 O PRO A 443 -6.372 -11.149 5.746 1.00 0.00 O ATOM 375 CB PRO A 443 -7.596 -8.340 6.301 1.00 0.00 C ATOM 376 CG PRO A 443 -8.462 -8.440 5.056 1.00 0.00 C ATOM 377 CD PRO A 443 -7.539 -8.566 3.855 1.00 0.00 C ATOM 0 HA PRO A 443 -5.446 -8.132 6.351 1.00 0.00 H new ATOM 0 HB2 PRO A 443 -7.972 -8.989 7.092 1.00 0.00 H new ATOM 0 HB3 PRO A 443 -7.596 -7.324 6.696 1.00 0.00 H new ATOM 0 HG2 PRO A 443 -9.125 -9.303 5.120 1.00 0.00 H new ATOM 0 HG3 PRO A 443 -9.095 -7.558 4.960 1.00 0.00 H new ATOM 0 HD2 PRO A 443 -7.766 -9.459 3.273 1.00 0.00 H new ATOM 0 HD3 PRO A 443 -7.644 -7.713 3.184 1.00 0.00 H new ATOM 385 N ALA A 444 -4.955 -10.272 7.275 1.00 0.00 N ATOM 386 CA ALA A 444 -4.524 -11.564 7.780 1.00 0.00 C ATOM 387 C ALA A 444 -5.752 -12.392 8.165 1.00 0.00 C ATOM 388 O ALA A 444 -6.312 -12.214 9.245 1.00 0.00 O ATOM 389 CB ALA A 444 -3.568 -11.359 8.957 1.00 0.00 C ATOM 0 H ALA A 444 -4.521 -9.469 7.731 1.00 0.00 H new ATOM 0 HA ALA A 444 -3.982 -12.115 7.011 1.00 0.00 H new ATOM 0 HB1 ALA A 444 -3.245 -12.328 9.336 1.00 0.00 H new ATOM 0 HB2 ALA A 444 -2.699 -10.791 8.625 1.00 0.00 H new ATOM 0 HB3 ALA A 444 -4.079 -10.812 9.749 1.00 0.00 H new ATOM 395 N GLY A 445 -6.135 -13.280 7.259 1.00 0.00 N ATOM 396 CA GLY A 445 -7.286 -14.136 7.489 1.00 0.00 C ATOM 397 C GLY A 445 -8.442 -13.761 6.560 1.00 0.00 C ATOM 398 O GLY A 445 -9.531 -14.325 6.659 1.00 0.00 O ATOM 0 H GLY A 445 -5.668 -13.425 6.364 1.00 0.00 H new ATOM 0 HA2 GLY A 445 -7.008 -15.177 7.327 1.00 0.00 H new ATOM 0 HA3 GLY A 445 -7.606 -14.050 8.527 1.00 0.00 H new ATOM 402 N GLY A 446 -8.166 -12.812 5.677 1.00 0.00 N ATOM 403 CA GLY A 446 -9.170 -12.355 4.731 1.00 0.00 C ATOM 404 C GLY A 446 -8.839 -12.821 3.312 1.00 0.00 C ATOM 405 O GLY A 446 -8.211 -13.863 3.128 1.00 0.00 O ATOM 0 H GLY A 446 -7.262 -12.347 5.597 1.00 0.00 H new ATOM 0 HA2 GLY A 446 -10.149 -12.734 5.023 1.00 0.00 H new ATOM 0 HA3 GLY A 446 -9.229 -11.267 4.756 1.00 0.00 H new ATOM 409 N SER A 447 -9.275 -12.027 2.346 1.00 0.00 N ATOM 410 CA SER A 447 -9.033 -12.346 0.949 1.00 0.00 C ATOM 411 C SER A 447 -8.344 -11.168 0.255 1.00 0.00 C ATOM 412 O SER A 447 -8.450 -10.029 0.707 1.00 0.00 O ATOM 413 CB SER A 447 -10.337 -12.696 0.230 1.00 0.00 C ATOM 414 OG SER A 447 -11.481 -12.410 1.030 1.00 0.00 O ATOM 0 H SER A 447 -9.794 -11.163 2.503 1.00 0.00 H new ATOM 0 HA SER A 447 -8.380 -13.218 0.905 1.00 0.00 H new ATOM 0 HB2 SER A 447 -10.398 -12.136 -0.703 1.00 0.00 H new ATOM 0 HB3 SER A 447 -10.334 -13.754 -0.033 1.00 0.00 H new ATOM 0 HG SER A 447 -12.293 -12.646 0.535 1.00 0.00 H new ATOM 420 N TRP A 448 -7.655 -11.484 -0.831 1.00 0.00 N ATOM 421 CA TRP A 448 -6.949 -10.466 -1.591 1.00 0.00 C ATOM 422 C TRP A 448 -7.990 -9.603 -2.305 1.00 0.00 C ATOM 423 O TRP A 448 -9.132 -10.023 -2.486 1.00 0.00 O ATOM 424 CB TRP A 448 -5.939 -11.100 -2.549 1.00 0.00 C ATOM 425 CG TRP A 448 -4.566 -11.360 -1.925 1.00 0.00 C ATOM 426 CD1 TRP A 448 -3.966 -12.540 -1.713 1.00 0.00 C ATOM 427 CD2 TRP A 448 -3.642 -10.366 -1.436 1.00 0.00 C ATOM 428 NE1 TRP A 448 -2.728 -12.379 -1.126 1.00 0.00 N ATOM 429 CE2 TRP A 448 -2.524 -11.015 -0.952 1.00 0.00 C ATOM 430 CE3 TRP A 448 -3.746 -8.964 -1.403 1.00 0.00 C ATOM 431 CZ2 TRP A 448 -1.426 -10.344 -0.401 1.00 0.00 C ATOM 432 CZ3 TRP A 448 -2.641 -8.308 -0.850 1.00 0.00 C ATOM 433 CH2 TRP A 448 -1.508 -8.947 -0.358 1.00 0.00 C ATOM 0 H TRP A 448 -7.570 -12.430 -1.203 1.00 0.00 H new ATOM 0 HA TRP A 448 -6.362 -9.828 -0.930 1.00 0.00 H new ATOM 0 HB2 TRP A 448 -6.344 -12.043 -2.916 1.00 0.00 H new ATOM 0 HB3 TRP A 448 -5.816 -10.448 -3.414 1.00 0.00 H new ATOM 0 HD1 TRP A 448 -4.398 -13.496 -1.969 1.00 0.00 H new ATOM 0 HE1 TRP A 448 -2.081 -13.124 -0.867 1.00 0.00 H new ATOM 0 HE3 TRP A 448 -4.611 -8.435 -1.775 1.00 0.00 H new ATOM 0 HZ2 TRP A 448 -0.562 -10.875 -0.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 448 -2.670 -7.229 -0.802 1.00 0.00 H new ATOM 0 HH2 TRP A 448 -0.695 -8.368 0.055 1.00 0.00 H new ATOM 444 N THR A 449 -7.559 -8.411 -2.692 1.00 0.00 N ATOM 445 CA THR A 449 -8.439 -7.484 -3.383 1.00 0.00 C ATOM 446 C THR A 449 -8.506 -7.822 -4.873 1.00 0.00 C ATOM 447 O THR A 449 -7.882 -8.781 -5.325 1.00 0.00 O ATOM 448 CB THR A 449 -7.944 -6.064 -3.103 1.00 0.00 C ATOM 449 OG1 THR A 449 -7.310 -6.161 -1.831 1.00 0.00 O ATOM 450 CG2 THR A 449 -9.091 -5.078 -2.874 1.00 0.00 C ATOM 0 H THR A 449 -6.611 -8.066 -2.540 1.00 0.00 H new ATOM 0 HA THR A 449 -9.463 -7.564 -3.018 1.00 0.00 H new ATOM 0 HB THR A 449 -7.333 -5.722 -3.939 1.00 0.00 H new ATOM 0 HG1 THR A 449 -7.727 -5.529 -1.209 1.00 0.00 H new ATOM 0 HG21 THR A 449 -8.684 -4.086 -2.680 1.00 0.00 H new ATOM 0 HG22 THR A 449 -9.724 -5.044 -3.761 1.00 0.00 H new ATOM 0 HG23 THR A 449 -9.683 -5.401 -2.018 1.00 0.00 H new ATOM 458 N ALA A 450 -9.269 -7.016 -5.597 1.00 0.00 N ATOM 459 CA ALA A 450 -9.426 -7.217 -7.027 1.00 0.00 C ATOM 460 C ALA A 450 -8.196 -6.669 -7.753 1.00 0.00 C ATOM 461 O ALA A 450 -8.089 -5.464 -7.977 1.00 0.00 O ATOM 462 CB ALA A 450 -10.724 -6.556 -7.497 1.00 0.00 C ATOM 0 H ALA A 450 -9.786 -6.222 -5.219 1.00 0.00 H new ATOM 0 HA ALA A 450 -9.499 -8.279 -7.259 1.00 0.00 H new ATOM 0 HB1 ALA A 450 -10.841 -6.707 -8.570 1.00 0.00 H new ATOM 0 HB2 ALA A 450 -11.570 -7.002 -6.973 1.00 0.00 H new ATOM 0 HB3 ALA A 450 -10.687 -5.488 -7.283 1.00 0.00 H new ATOM 468 N ALA A 451 -7.299 -7.580 -8.100 1.00 0.00 N ATOM 469 CA ALA A 451 -6.080 -7.203 -8.796 1.00 0.00 C ATOM 470 C ALA A 451 -6.443 -6.473 -10.091 1.00 0.00 C ATOM 471 O ALA A 451 -7.387 -6.856 -10.780 1.00 0.00 O ATOM 472 CB ALA A 451 -5.229 -8.449 -9.047 1.00 0.00 C ATOM 0 H ALA A 451 -7.392 -8.578 -7.912 1.00 0.00 H new ATOM 0 HA ALA A 451 -5.486 -6.520 -8.188 1.00 0.00 H new ATOM 0 HB1 ALA A 451 -4.315 -8.166 -9.569 1.00 0.00 H new ATOM 0 HB2 ALA A 451 -4.974 -8.913 -8.094 1.00 0.00 H new ATOM 0 HB3 ALA A 451 -5.791 -9.157 -9.657 1.00 0.00 H new ATOM 478 N PRO A 452 -5.652 -5.408 -10.392 1.00 0.00 N ATOM 479 CA PRO A 452 -4.554 -5.023 -9.522 1.00 0.00 C ATOM 480 C PRO A 452 -5.071 -4.327 -8.261 1.00 0.00 C ATOM 481 O PRO A 452 -5.726 -3.289 -8.345 1.00 0.00 O ATOM 482 CB PRO A 452 -3.672 -4.126 -10.376 1.00 0.00 C ATOM 483 CG PRO A 452 -4.542 -3.668 -11.535 1.00 0.00 C ATOM 484 CD PRO A 452 -5.782 -4.546 -11.563 1.00 0.00 C ATOM 0 HA PRO A 452 -3.990 -5.879 -9.152 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -3.308 -3.275 -9.801 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -2.796 -4.667 -10.735 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -4.819 -2.621 -11.414 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -3.997 -3.747 -12.476 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -6.692 -3.948 -11.515 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -5.833 -5.131 -12.482 1.00 0.00 H new ATOM 492 N GLY A 453 -4.756 -4.926 -7.122 1.00 0.00 N ATOM 493 CA GLY A 453 -5.182 -4.377 -5.846 1.00 0.00 C ATOM 494 C GLY A 453 -6.293 -3.343 -6.037 1.00 0.00 C ATOM 495 O GLY A 453 -7.281 -3.607 -6.719 1.00 0.00 O ATOM 0 H GLY A 453 -4.211 -5.786 -7.056 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -5.536 -5.181 -5.200 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -4.333 -3.915 -5.343 1.00 0.00 H new ATOM 499 N VAL A 454 -6.094 -2.187 -5.421 1.00 0.00 N ATOM 500 CA VAL A 454 -7.067 -1.112 -5.514 1.00 0.00 C ATOM 501 C VAL A 454 -6.345 0.197 -5.841 1.00 0.00 C ATOM 502 O VAL A 454 -5.268 0.465 -5.310 1.00 0.00 O ATOM 503 CB VAL A 454 -7.888 -1.036 -4.225 1.00 0.00 C ATOM 504 CG1 VAL A 454 -7.020 -0.585 -3.048 1.00 0.00 C ATOM 505 CG2 VAL A 454 -9.098 -0.116 -4.398 1.00 0.00 C ATOM 0 H VAL A 454 -5.273 -1.971 -4.855 1.00 0.00 H new ATOM 0 HA VAL A 454 -7.773 -1.305 -6.322 1.00 0.00 H new ATOM 0 HB VAL A 454 -8.258 -2.037 -4.004 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -7.628 -0.539 -2.144 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -6.206 -1.296 -2.903 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -6.607 0.402 -3.258 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -9.664 -0.080 -3.467 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -8.758 0.887 -4.655 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -9.735 -0.499 -5.195 1.00 0.00 H new ATOM 515 N LYS A 455 -6.968 0.977 -6.712 1.00 0.00 N ATOM 516 CA LYS A 455 -6.398 2.251 -7.116 1.00 0.00 C ATOM 517 C LYS A 455 -6.238 3.146 -5.886 1.00 0.00 C ATOM 518 O LYS A 455 -7.214 3.443 -5.198 1.00 0.00 O ATOM 519 CB LYS A 455 -7.234 2.882 -8.232 1.00 0.00 C ATOM 520 CG LYS A 455 -6.651 4.231 -8.657 1.00 0.00 C ATOM 521 CD LYS A 455 -7.680 5.051 -9.438 1.00 0.00 C ATOM 522 CE LYS A 455 -8.343 6.098 -8.540 1.00 0.00 C ATOM 523 NZ LYS A 455 -9.149 7.039 -9.349 1.00 0.00 N ATOM 0 H LYS A 455 -7.862 0.751 -7.149 1.00 0.00 H new ATOM 0 HA LYS A 455 -5.403 2.107 -7.537 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -7.269 2.210 -9.090 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -8.260 3.017 -7.891 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -6.331 4.787 -7.776 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -5.765 4.071 -9.272 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -7.194 5.544 -10.280 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -8.440 4.388 -9.852 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -8.979 5.605 -7.805 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -7.581 6.646 -7.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -9.592 7.743 -8.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -8.534 7.523 -10.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -9.888 6.514 -9.858 1.00 0.00 H new ATOM 536 N MET A 456 -5.000 3.552 -5.646 1.00 0.00 N ATOM 537 CA MET A 456 -4.699 4.407 -4.511 1.00 0.00 C ATOM 538 C MET A 456 -5.246 5.820 -4.728 1.00 0.00 C ATOM 539 O MET A 456 -5.141 6.368 -5.824 1.00 0.00 O ATOM 540 CB MET A 456 -3.184 4.472 -4.307 1.00 0.00 C ATOM 541 CG MET A 456 -2.673 3.217 -3.597 1.00 0.00 C ATOM 542 SD MET A 456 -0.943 3.403 -3.197 1.00 0.00 S ATOM 543 CE MET A 456 -1.072 3.908 -1.490 1.00 0.00 C ATOM 0 H MET A 456 -4.193 3.304 -6.219 1.00 0.00 H new ATOM 0 HA MET A 456 -5.176 3.985 -3.626 1.00 0.00 H new ATOM 0 HB2 MET A 456 -2.688 4.576 -5.272 1.00 0.00 H new ATOM 0 HB3 MET A 456 -2.930 5.355 -3.721 1.00 0.00 H new ATOM 0 HG2 MET A 456 -3.248 3.044 -2.688 1.00 0.00 H new ATOM 0 HG3 MET A 456 -2.815 2.345 -4.235 1.00 0.00 H new ATOM 0 HE1 MET A 456 -0.108 3.778 -0.998 1.00 0.00 H new ATOM 0 HE2 MET A 456 -1.366 4.957 -1.442 1.00 0.00 H new ATOM 0 HE3 MET A 456 -1.821 3.298 -0.986 1.00 0.00 H new ATOM 553 N GLN A 457 -5.817 6.369 -3.667 1.00 0.00 N ATOM 554 CA GLN A 457 -6.381 7.707 -3.728 1.00 0.00 C ATOM 555 C GLN A 457 -5.266 8.747 -3.844 1.00 0.00 C ATOM 556 O GLN A 457 -4.085 8.409 -3.771 1.00 0.00 O ATOM 557 CB GLN A 457 -7.266 7.985 -2.511 1.00 0.00 C ATOM 558 CG GLN A 457 -8.285 6.862 -2.305 1.00 0.00 C ATOM 559 CD GLN A 457 -9.366 6.898 -3.387 1.00 0.00 C ATOM 560 OE1 GLN A 457 -9.242 6.302 -4.445 1.00 0.00 O ATOM 561 NE2 GLN A 457 -10.429 7.629 -3.065 1.00 0.00 N ATOM 0 H GLN A 457 -5.902 5.912 -2.759 1.00 0.00 H new ATOM 0 HA GLN A 457 -7.009 7.776 -4.616 1.00 0.00 H new ATOM 0 HB2 GLN A 457 -6.645 8.085 -1.621 1.00 0.00 H new ATOM 0 HB3 GLN A 457 -7.787 8.933 -2.645 1.00 0.00 H new ATOM 0 HG2 GLN A 457 -7.778 5.897 -2.325 1.00 0.00 H new ATOM 0 HG3 GLN A 457 -8.746 6.960 -1.322 1.00 0.00 H new ATOM 0 HE21 GLN A 457 -10.468 8.102 -2.162 1.00 0.00 H new ATOM 0 HE22 GLN A 457 -11.205 7.717 -3.721 1.00 0.00 H new ATOM 570 N ASP A 458 -5.679 9.993 -4.025 1.00 0.00 N ATOM 571 CA ASP A 458 -4.730 11.086 -4.153 1.00 0.00 C ATOM 572 C ASP A 458 -4.277 11.529 -2.760 1.00 0.00 C ATOM 573 O ASP A 458 -5.097 11.676 -1.855 1.00 0.00 O ATOM 574 CB ASP A 458 -5.367 12.290 -4.848 1.00 0.00 C ATOM 575 CG ASP A 458 -6.611 11.973 -5.680 1.00 0.00 C ATOM 576 OD1 ASP A 458 -7.740 12.315 -5.297 1.00 0.00 O ATOM 577 OD2 ASP A 458 -6.384 11.339 -6.780 1.00 0.00 O ATOM 0 H ASP A 458 -6.659 10.270 -4.086 1.00 0.00 H new ATOM 0 HA ASP A 458 -3.887 10.732 -4.746 1.00 0.00 H new ATOM 0 HB2 ASP A 458 -5.633 13.028 -4.092 1.00 0.00 H new ATOM 0 HB3 ASP A 458 -4.623 12.752 -5.497 1.00 0.00 H new ATOM 583 N ALA A 459 -2.974 11.729 -2.632 1.00 0.00 N ATOM 584 CA ALA A 459 -2.403 12.151 -1.364 1.00 0.00 C ATOM 585 C ALA A 459 -1.896 13.589 -1.493 1.00 0.00 C ATOM 586 O ALA A 459 -0.867 13.834 -2.121 1.00 0.00 O ATOM 587 CB ALA A 459 -1.297 11.177 -0.952 1.00 0.00 C ATOM 0 H ALA A 459 -2.297 11.607 -3.385 1.00 0.00 H new ATOM 0 HA ALA A 459 -3.158 12.136 -0.578 1.00 0.00 H new ATOM 0 HB1 ALA A 459 -0.869 11.494 -0.001 1.00 0.00 H new ATOM 0 HB2 ALA A 459 -1.715 10.176 -0.846 1.00 0.00 H new ATOM 0 HB3 ALA A 459 -0.518 11.167 -1.715 1.00 0.00 H new ATOM 593 N GLU A 460 -2.640 14.502 -0.887 1.00 0.00 N ATOM 594 CA GLU A 460 -2.279 15.909 -0.926 1.00 0.00 C ATOM 595 C GLU A 460 -0.910 16.123 -0.277 1.00 0.00 C ATOM 596 O GLU A 460 -0.311 17.188 -0.422 1.00 0.00 O ATOM 597 CB GLU A 460 -3.348 16.768 -0.247 1.00 0.00 C ATOM 598 CG GLU A 460 -3.418 16.474 1.252 1.00 0.00 C ATOM 599 CD GLU A 460 -4.500 17.319 1.927 1.00 0.00 C ATOM 600 OE1 GLU A 460 -4.215 18.430 2.398 1.00 0.00 O ATOM 601 OE2 GLU A 460 -5.673 16.783 1.952 1.00 0.00 O ATOM 0 H GLU A 460 -3.492 14.295 -0.366 1.00 0.00 H new ATOM 0 HA GLU A 460 -2.218 16.220 -1.969 1.00 0.00 H new ATOM 0 HB2 GLU A 460 -3.125 17.823 -0.404 1.00 0.00 H new ATOM 0 HB3 GLU A 460 -4.318 16.576 -0.704 1.00 0.00 H new ATOM 0 HG2 GLU A 460 -3.627 15.416 1.409 1.00 0.00 H new ATOM 0 HG3 GLU A 460 -2.451 16.680 1.712 1.00 0.00 H new ATOM 609 N ILE A 461 -0.455 15.095 0.423 1.00 0.00 N ATOM 610 CA ILE A 461 0.832 15.158 1.094 1.00 0.00 C ATOM 611 C ILE A 461 1.788 16.027 0.275 1.00 0.00 C ATOM 612 O ILE A 461 2.472 16.890 0.823 1.00 0.00 O ATOM 613 CB ILE A 461 1.364 13.749 1.367 1.00 0.00 C ATOM 614 CG1 ILE A 461 0.368 12.939 2.200 1.00 0.00 C ATOM 615 CG2 ILE A 461 2.747 13.802 2.019 1.00 0.00 C ATOM 616 CD1 ILE A 461 -0.426 13.848 3.141 1.00 0.00 C ATOM 0 H ILE A 461 -0.955 14.213 0.540 1.00 0.00 H new ATOM 0 HA ILE A 461 0.729 15.630 2.071 1.00 0.00 H new ATOM 0 HB ILE A 461 1.478 13.236 0.412 1.00 0.00 H new ATOM 0 HG12 ILE A 461 -0.316 12.407 1.539 1.00 0.00 H new ATOM 0 HG13 ILE A 461 0.901 12.186 2.780 1.00 0.00 H new ATOM 0 HG21 ILE A 461 3.102 12.788 2.202 1.00 0.00 H new ATOM 0 HG22 ILE A 461 3.443 14.316 1.355 1.00 0.00 H new ATOM 0 HG23 ILE A 461 2.683 14.340 2.965 1.00 0.00 H new ATOM 0 HD11 ILE A 461 -1.127 13.248 3.721 1.00 0.00 H new ATOM 0 HD12 ILE A 461 0.259 14.360 3.816 1.00 0.00 H new ATOM 0 HD13 ILE A 461 -0.977 14.585 2.556 1.00 0.00 H new ATOM 628 N SER A 462 1.805 15.769 -1.025 1.00 0.00 N ATOM 629 CA SER A 462 2.666 16.518 -1.925 1.00 0.00 C ATOM 630 C SER A 462 3.001 15.669 -3.154 1.00 0.00 C ATOM 631 O SER A 462 4.154 15.617 -3.580 1.00 0.00 O ATOM 632 CB SER A 462 3.949 16.960 -1.219 1.00 0.00 C ATOM 633 OG SER A 462 3.833 18.271 -0.673 1.00 0.00 O ATOM 0 H SER A 462 1.237 15.052 -1.476 1.00 0.00 H new ATOM 0 HA SER A 462 2.133 17.414 -2.244 1.00 0.00 H new ATOM 0 HB2 SER A 462 4.186 16.255 -0.422 1.00 0.00 H new ATOM 0 HB3 SER A 462 4.779 16.933 -1.925 1.00 0.00 H new ATOM 0 HG SER A 462 3.160 18.270 0.039 1.00 0.00 H new ATOM 639 N GLY A 463 1.973 15.027 -3.688 1.00 0.00 N ATOM 640 CA GLY A 463 2.145 14.183 -4.859 1.00 0.00 C ATOM 641 C GLY A 463 2.320 12.717 -4.457 1.00 0.00 C ATOM 642 O GLY A 463 3.234 12.045 -4.933 1.00 0.00 O ATOM 0 H GLY A 463 1.018 15.074 -3.332 1.00 0.00 H new ATOM 0 HA2 GLY A 463 1.280 14.283 -5.514 1.00 0.00 H new ATOM 0 HA3 GLY A 463 3.015 14.515 -5.426 1.00 0.00 H new ATOM 646 N TYR A 464 1.430 12.265 -3.586 1.00 0.00 N ATOM 647 CA TYR A 464 1.476 10.891 -3.115 1.00 0.00 C ATOM 648 C TYR A 464 0.108 10.218 -3.254 1.00 0.00 C ATOM 649 O TYR A 464 -0.836 10.822 -3.761 1.00 0.00 O ATOM 650 CB TYR A 464 1.847 10.965 -1.633 1.00 0.00 C ATOM 651 CG TYR A 464 3.346 10.830 -1.359 1.00 0.00 C ATOM 652 CD1 TYR A 464 4.240 11.677 -1.982 1.00 0.00 C ATOM 653 CD2 TYR A 464 3.804 9.862 -0.489 1.00 0.00 C ATOM 654 CE1 TYR A 464 5.651 11.550 -1.724 1.00 0.00 C ATOM 655 CE2 TYR A 464 5.215 9.735 -0.231 1.00 0.00 C ATOM 656 CZ TYR A 464 6.069 10.585 -0.861 1.00 0.00 C ATOM 657 OH TYR A 464 7.401 10.465 -0.618 1.00 0.00 O ATOM 0 H TYR A 464 0.673 12.825 -3.194 1.00 0.00 H new ATOM 0 HA TYR A 464 2.192 10.310 -3.696 1.00 0.00 H new ATOM 0 HB2 TYR A 464 1.498 11.915 -1.229 1.00 0.00 H new ATOM 0 HB3 TYR A 464 1.318 10.177 -1.097 1.00 0.00 H new ATOM 0 HD1 TYR A 464 3.881 12.435 -2.663 1.00 0.00 H new ATOM 0 HD2 TYR A 464 3.104 9.199 -0.001 1.00 0.00 H new ATOM 0 HE1 TYR A 464 6.361 12.206 -2.205 1.00 0.00 H new ATOM 0 HE2 TYR A 464 5.587 8.982 0.448 1.00 0.00 H new ATOM 0 HH TYR A 464 7.553 9.735 0.018 1.00 0.00 H new ATOM 667 N ALA A 465 0.045 8.978 -2.793 1.00 0.00 N ATOM 668 CA ALA A 465 -1.190 8.217 -2.859 1.00 0.00 C ATOM 669 C ALA A 465 -1.552 7.716 -1.459 1.00 0.00 C ATOM 670 O ALA A 465 -0.670 7.477 -0.635 1.00 0.00 O ATOM 671 CB ALA A 465 -1.034 7.074 -3.865 1.00 0.00 C ATOM 0 H ALA A 465 0.830 8.481 -2.372 1.00 0.00 H new ATOM 0 HA ALA A 465 -2.009 8.847 -3.206 1.00 0.00 H new ATOM 0 HB1 ALA A 465 -1.961 6.503 -3.914 1.00 0.00 H new ATOM 0 HB2 ALA A 465 -0.808 7.484 -4.849 1.00 0.00 H new ATOM 0 HB3 ALA A 465 -0.222 6.420 -3.549 1.00 0.00 H new ATOM 677 N LYS A 466 -2.849 7.571 -1.234 1.00 0.00 N ATOM 678 CA LYS A 466 -3.337 7.103 0.052 1.00 0.00 C ATOM 679 C LYS A 466 -4.316 5.947 -0.169 1.00 0.00 C ATOM 680 O LYS A 466 -5.016 5.907 -1.179 1.00 0.00 O ATOM 681 CB LYS A 466 -3.928 8.263 0.856 1.00 0.00 C ATOM 682 CG LYS A 466 -2.866 9.327 1.143 1.00 0.00 C ATOM 683 CD LYS A 466 -3.510 10.694 1.384 1.00 0.00 C ATOM 684 CE LYS A 466 -4.232 10.729 2.733 1.00 0.00 C ATOM 685 NZ LYS A 466 -4.765 12.083 3.000 1.00 0.00 N ATOM 0 H LYS A 466 -3.577 7.769 -1.920 1.00 0.00 H new ATOM 0 HA LYS A 466 -2.514 6.715 0.653 1.00 0.00 H new ATOM 0 HB2 LYS A 466 -4.755 8.709 0.304 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -4.336 7.889 1.795 1.00 0.00 H new ATOM 0 HG2 LYS A 466 -2.282 9.037 2.017 1.00 0.00 H new ATOM 0 HG3 LYS A 466 -2.173 9.390 0.304 1.00 0.00 H new ATOM 0 HD2 LYS A 466 -2.745 11.470 1.356 1.00 0.00 H new ATOM 0 HD3 LYS A 466 -4.216 10.914 0.583 1.00 0.00 H new ATOM 0 HE2 LYS A 466 -5.046 10.004 2.735 1.00 0.00 H new ATOM 0 HE3 LYS A 466 -3.545 10.439 3.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 -5.252 12.089 3.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 -3.982 12.767 3.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 -5.437 12.346 2.251 1.00 0.00 H new ATOM 698 N ILE A 467 -4.333 5.037 0.793 1.00 0.00 N ATOM 699 CA ILE A 467 -5.214 3.883 0.716 1.00 0.00 C ATOM 700 C ILE A 467 -5.588 3.438 2.131 1.00 0.00 C ATOM 701 O ILE A 467 -4.716 3.254 2.979 1.00 0.00 O ATOM 702 CB ILE A 467 -4.577 2.778 -0.128 1.00 0.00 C ATOM 703 CG1 ILE A 467 -5.647 1.938 -0.829 1.00 0.00 C ATOM 704 CG2 ILE A 467 -3.634 1.918 0.715 1.00 0.00 C ATOM 705 CD1 ILE A 467 -6.347 2.744 -1.924 1.00 0.00 C ATOM 0 H ILE A 467 -3.751 5.075 1.630 1.00 0.00 H new ATOM 0 HA ILE A 467 -6.142 4.145 0.208 1.00 0.00 H new ATOM 0 HB ILE A 467 -3.975 3.247 -0.906 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.190 1.049 -1.263 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -6.381 1.595 -0.100 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -3.195 1.140 0.090 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -2.842 2.543 1.127 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -4.193 1.457 1.530 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -7.102 2.123 -2.406 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -6.824 3.619 -1.483 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -5.614 3.065 -2.665 1.00 0.00 H new ATOM 717 N THR A 468 -6.886 3.276 2.343 1.00 0.00 N ATOM 718 CA THR A 468 -7.386 2.856 3.641 1.00 0.00 C ATOM 719 C THR A 468 -8.178 1.553 3.511 1.00 0.00 C ATOM 720 O THR A 468 -9.184 1.502 2.806 1.00 0.00 O ATOM 721 CB THR A 468 -8.204 4.008 4.228 1.00 0.00 C ATOM 722 OG1 THR A 468 -7.501 5.178 3.817 1.00 0.00 O ATOM 723 CG2 THR A 468 -8.139 4.052 5.756 1.00 0.00 C ATOM 0 H THR A 468 -7.607 3.428 1.637 1.00 0.00 H new ATOM 0 HA THR A 468 -6.568 2.636 4.328 1.00 0.00 H new ATOM 0 HB THR A 468 -9.243 3.914 3.911 1.00 0.00 H new ATOM 0 HG1 THR A 468 -7.964 5.973 4.154 1.00 0.00 H new ATOM 0 HG21 THR A 468 -8.736 4.887 6.122 1.00 0.00 H new ATOM 0 HG22 THR A 468 -8.531 3.120 6.164 1.00 0.00 H new ATOM 0 HG23 THR A 468 -7.104 4.180 6.073 1.00 0.00 H new ATOM 731 N VAL A 469 -7.692 0.532 4.202 1.00 0.00 N ATOM 732 CA VAL A 469 -8.342 -0.767 4.172 1.00 0.00 C ATOM 733 C VAL A 469 -8.548 -1.263 5.605 1.00 0.00 C ATOM 734 O VAL A 469 -7.609 -1.282 6.400 1.00 0.00 O ATOM 735 CB VAL A 469 -7.529 -1.739 3.315 1.00 0.00 C ATOM 736 CG1 VAL A 469 -8.274 -3.063 3.131 1.00 0.00 C ATOM 737 CG2 VAL A 469 -7.177 -1.116 1.963 1.00 0.00 C ATOM 0 H VAL A 469 -6.857 0.578 4.785 1.00 0.00 H new ATOM 0 HA VAL A 469 -9.326 -0.691 3.709 1.00 0.00 H new ATOM 0 HB VAL A 469 -6.597 -1.949 3.840 1.00 0.00 H new ATOM 0 HG11 VAL A 469 -7.674 -3.736 2.518 1.00 0.00 H new ATOM 0 HG12 VAL A 469 -8.450 -3.520 4.105 1.00 0.00 H new ATOM 0 HG13 VAL A 469 -9.229 -2.878 2.639 1.00 0.00 H new ATOM 0 HG21 VAL A 469 -6.599 -1.828 1.374 1.00 0.00 H new ATOM 0 HG22 VAL A 469 -8.093 -0.863 1.430 1.00 0.00 H new ATOM 0 HG23 VAL A 469 -6.588 -0.213 2.121 1.00 0.00 H new ATOM 747 N ASP A 470 -9.782 -1.651 5.891 1.00 0.00 N ATOM 748 CA ASP A 470 -10.123 -2.145 7.214 1.00 0.00 C ATOM 749 C ASP A 470 -9.769 -3.630 7.307 1.00 0.00 C ATOM 750 O ASP A 470 -9.865 -4.358 6.320 1.00 0.00 O ATOM 751 CB ASP A 470 -11.621 -1.998 7.488 1.00 0.00 C ATOM 752 CG ASP A 470 -12.118 -2.689 8.759 1.00 0.00 C ATOM 753 OD1 ASP A 470 -12.156 -3.926 8.840 1.00 0.00 O ATOM 754 OD2 ASP A 470 -12.480 -1.893 9.707 1.00 0.00 O ATOM 0 H ASP A 470 -10.558 -1.633 5.229 1.00 0.00 H new ATOM 0 HA ASP A 470 -9.564 -1.562 7.945 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -11.861 -0.937 7.552 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -12.172 -2.398 6.636 1.00 0.00 H new ATOM 760 N ILE A 471 -9.366 -4.036 8.502 1.00 0.00 N ATOM 761 CA ILE A 471 -8.997 -5.422 8.736 1.00 0.00 C ATOM 762 C ILE A 471 -9.900 -6.010 9.822 1.00 0.00 C ATOM 763 O ILE A 471 -9.897 -7.218 10.051 1.00 0.00 O ATOM 764 CB ILE A 471 -7.504 -5.532 9.053 1.00 0.00 C ATOM 765 CG1 ILE A 471 -7.205 -5.031 10.467 1.00 0.00 C ATOM 766 CG2 ILE A 471 -6.665 -4.808 7.998 1.00 0.00 C ATOM 767 CD1 ILE A 471 -5.700 -5.039 10.745 1.00 0.00 C ATOM 0 H ILE A 471 -9.287 -3.430 9.318 1.00 0.00 H new ATOM 0 HA ILE A 471 -9.154 -6.015 7.835 1.00 0.00 H new ATOM 0 HB ILE A 471 -7.224 -6.585 9.020 1.00 0.00 H new ATOM 0 HG12 ILE A 471 -7.596 -4.021 10.589 1.00 0.00 H new ATOM 0 HG13 ILE A 471 -7.716 -5.660 11.195 1.00 0.00 H new ATOM 0 HG21 ILE A 471 -5.608 -4.901 8.247 1.00 0.00 H new ATOM 0 HG22 ILE A 471 -6.848 -5.252 7.020 1.00 0.00 H new ATOM 0 HG23 ILE A 471 -6.940 -3.754 7.975 1.00 0.00 H new ATOM 0 HD11 ILE A 471 -5.515 -4.678 11.757 1.00 0.00 H new ATOM 0 HD12 ILE A 471 -5.317 -6.055 10.646 1.00 0.00 H new ATOM 0 HD13 ILE A 471 -5.195 -4.390 10.030 1.00 0.00 H new ATOM 779 N GLY A 472 -10.654 -5.127 10.462 1.00 0.00 N ATOM 780 CA GLY A 472 -11.560 -5.544 11.518 1.00 0.00 C ATOM 781 C GLY A 472 -10.790 -5.922 12.785 1.00 0.00 C ATOM 782 O GLY A 472 -10.375 -5.050 13.547 1.00 0.00 O ATOM 0 H GLY A 472 -10.656 -4.125 10.269 1.00 0.00 H new ATOM 0 HA2 GLY A 472 -12.260 -4.739 11.740 1.00 0.00 H new ATOM 0 HA3 GLY A 472 -12.151 -6.395 11.180 1.00 0.00 H new ATOM 786 N SER A 473 -10.621 -7.223 12.970 1.00 0.00 N ATOM 787 CA SER A 473 -9.908 -7.727 14.131 1.00 0.00 C ATOM 788 C SER A 473 -8.510 -8.197 13.724 1.00 0.00 C ATOM 789 O SER A 473 -7.652 -8.419 14.577 1.00 0.00 O ATOM 790 CB SER A 473 -10.678 -8.869 14.798 1.00 0.00 C ATOM 791 OG SER A 473 -11.091 -8.534 16.120 1.00 0.00 O ATOM 0 H SER A 473 -10.966 -7.943 12.335 1.00 0.00 H new ATOM 0 HA SER A 473 -9.816 -6.916 14.853 1.00 0.00 H new ATOM 0 HB2 SER A 473 -11.553 -9.116 14.197 1.00 0.00 H new ATOM 0 HB3 SER A 473 -10.051 -9.760 14.829 1.00 0.00 H new ATOM 0 HG SER A 473 -11.580 -9.288 16.511 1.00 0.00 H new ATOM 797 N ALA A 474 -8.324 -8.335 12.419 1.00 0.00 N ATOM 798 CA ALA A 474 -7.045 -8.775 11.888 1.00 0.00 C ATOM 799 C ALA A 474 -5.915 -8.111 12.677 1.00 0.00 C ATOM 800 O ALA A 474 -5.922 -6.898 12.878 1.00 0.00 O ATOM 801 CB ALA A 474 -6.977 -8.458 10.393 1.00 0.00 C ATOM 0 H ALA A 474 -9.038 -8.150 11.714 1.00 0.00 H new ATOM 0 HA ALA A 474 -6.934 -9.854 11.998 1.00 0.00 H new ATOM 0 HB1 ALA A 474 -6.018 -8.788 9.994 1.00 0.00 H new ATOM 0 HB2 ALA A 474 -7.783 -8.976 9.874 1.00 0.00 H new ATOM 0 HB3 ALA A 474 -7.082 -7.383 10.244 1.00 0.00 H new ATOM 807 N SER A 475 -4.970 -8.936 13.103 1.00 0.00 N ATOM 808 CA SER A 475 -3.835 -8.445 13.866 1.00 0.00 C ATOM 809 C SER A 475 -2.872 -7.692 12.945 1.00 0.00 C ATOM 810 O SER A 475 -2.083 -6.869 13.406 1.00 0.00 O ATOM 811 CB SER A 475 -3.108 -9.590 14.572 1.00 0.00 C ATOM 812 OG SER A 475 -1.694 -9.407 14.570 1.00 0.00 O ATOM 0 H SER A 475 -4.967 -9.942 12.934 1.00 0.00 H new ATOM 0 HA SER A 475 -4.207 -7.762 14.630 1.00 0.00 H new ATOM 0 HB2 SER A 475 -3.462 -9.665 15.600 1.00 0.00 H new ATOM 0 HB3 SER A 475 -3.352 -10.532 14.081 1.00 0.00 H new ATOM 0 HG SER A 475 -1.266 -10.158 15.032 1.00 0.00 H new ATOM 818 N GLN A 476 -2.969 -8.001 11.661 1.00 0.00 N ATOM 819 CA GLN A 476 -2.116 -7.364 10.671 1.00 0.00 C ATOM 820 C GLN A 476 -2.760 -7.443 9.286 1.00 0.00 C ATOM 821 O GLN A 476 -3.675 -8.236 9.067 1.00 0.00 O ATOM 822 CB GLN A 476 -0.721 -7.993 10.664 1.00 0.00 C ATOM 823 CG GLN A 476 0.283 -7.107 11.403 1.00 0.00 C ATOM 824 CD GLN A 476 1.600 -7.849 11.638 1.00 0.00 C ATOM 825 OE1 GLN A 476 2.018 -8.554 10.591 1.00 0.00 O flip ATOM 826 NE2 GLN A 476 2.197 -7.786 12.700 1.00 0.00 N flip ATOM 0 H GLN A 476 -3.625 -8.684 11.282 1.00 0.00 H new ATOM 0 HA GLN A 476 -2.004 -6.313 10.938 1.00 0.00 H new ATOM 0 HB2 GLN A 476 -0.759 -8.976 11.134 1.00 0.00 H new ATOM 0 HB3 GLN A 476 -0.391 -8.144 9.636 1.00 0.00 H new ATOM 0 HG2 GLN A 476 0.469 -6.202 10.825 1.00 0.00 H new ATOM 0 HG3 GLN A 476 -0.137 -6.794 12.359 1.00 0.00 H new ATOM 0 HE21 GLN A 476 1.820 -7.226 13.464 1.00 0.00 H new ATOM 0 HE22 GLN A 476 3.073 -8.294 12.824 1.00 0.00 H new ATOM 835 N LEU A 477 -2.257 -6.611 8.386 1.00 0.00 N ATOM 836 CA LEU A 477 -2.772 -6.576 7.028 1.00 0.00 C ATOM 837 C LEU A 477 -1.602 -6.494 6.045 1.00 0.00 C ATOM 838 O LEU A 477 -0.617 -5.805 6.304 1.00 0.00 O ATOM 839 CB LEU A 477 -3.789 -5.444 6.869 1.00 0.00 C ATOM 840 CG LEU A 477 -3.772 -4.710 5.527 1.00 0.00 C ATOM 841 CD1 LEU A 477 -2.384 -4.136 5.233 1.00 0.00 C ATOM 842 CD2 LEU A 477 -4.267 -5.618 4.399 1.00 0.00 C ATOM 0 H LEU A 477 -1.498 -5.956 8.571 1.00 0.00 H new ATOM 0 HA LEU A 477 -3.314 -7.494 6.803 1.00 0.00 H new ATOM 0 HB2 LEU A 477 -4.787 -5.855 7.023 1.00 0.00 H new ATOM 0 HB3 LEU A 477 -3.618 -4.715 7.661 1.00 0.00 H new ATOM 0 HG LEU A 477 -4.462 -3.868 5.590 1.00 0.00 H new ATOM 0 HD11 LEU A 477 -2.400 -3.619 4.273 1.00 0.00 H new ATOM 0 HD12 LEU A 477 -2.107 -3.433 6.019 1.00 0.00 H new ATOM 0 HD13 LEU A 477 -1.655 -4.946 5.197 1.00 0.00 H new ATOM 0 HD21 LEU A 477 -4.245 -5.072 3.456 1.00 0.00 H new ATOM 0 HD22 LEU A 477 -3.621 -6.493 4.327 1.00 0.00 H new ATOM 0 HD23 LEU A 477 -5.288 -5.937 4.610 1.00 0.00 H new ATOM 854 N GLU A 478 -1.750 -7.207 4.938 1.00 0.00 N ATOM 855 CA GLU A 478 -0.718 -7.224 3.916 1.00 0.00 C ATOM 856 C GLU A 478 -1.063 -6.240 2.797 1.00 0.00 C ATOM 857 O GLU A 478 -2.228 -6.093 2.431 1.00 0.00 O ATOM 858 CB GLU A 478 -0.518 -8.636 3.362 1.00 0.00 C ATOM 859 CG GLU A 478 0.622 -9.354 4.086 1.00 0.00 C ATOM 860 CD GLU A 478 0.088 -10.489 4.962 1.00 0.00 C ATOM 861 OE1 GLU A 478 -0.346 -10.244 6.097 1.00 0.00 O ATOM 862 OE2 GLU A 478 0.134 -11.660 4.424 1.00 0.00 O ATOM 0 H GLU A 478 -2.569 -7.777 4.727 1.00 0.00 H new ATOM 0 HA GLU A 478 0.222 -6.911 4.371 1.00 0.00 H new ATOM 0 HB2 GLU A 478 -1.440 -9.207 3.472 1.00 0.00 H new ATOM 0 HB3 GLU A 478 -0.300 -8.584 2.295 1.00 0.00 H new ATOM 0 HG2 GLU A 478 1.326 -9.754 3.356 1.00 0.00 H new ATOM 0 HG3 GLU A 478 1.171 -8.642 4.702 1.00 0.00 H new ATOM 870 N ALA A 479 -0.028 -5.590 2.284 1.00 0.00 N ATOM 871 CA ALA A 479 -0.207 -4.623 1.214 1.00 0.00 C ATOM 872 C ALA A 479 0.844 -4.868 0.130 1.00 0.00 C ATOM 873 O ALA A 479 1.901 -5.435 0.402 1.00 0.00 O ATOM 874 CB ALA A 479 -0.135 -3.207 1.788 1.00 0.00 C ATOM 0 H ALA A 479 0.937 -5.714 2.590 1.00 0.00 H new ATOM 0 HA ALA A 479 -1.188 -4.738 0.753 1.00 0.00 H new ATOM 0 HB1 ALA A 479 -0.269 -2.482 0.985 1.00 0.00 H new ATOM 0 HB2 ALA A 479 -0.921 -3.075 2.531 1.00 0.00 H new ATOM 0 HB3 ALA A 479 0.837 -3.053 2.257 1.00 0.00 H new ATOM 880 N ALA A 480 0.519 -4.427 -1.076 1.00 0.00 N ATOM 881 CA ALA A 480 1.422 -4.591 -2.202 1.00 0.00 C ATOM 882 C ALA A 480 1.292 -3.384 -3.134 1.00 0.00 C ATOM 883 O ALA A 480 0.211 -2.814 -3.271 1.00 0.00 O ATOM 884 CB ALA A 480 1.118 -5.912 -2.912 1.00 0.00 C ATOM 0 H ALA A 480 -0.358 -3.956 -1.298 1.00 0.00 H new ATOM 0 HA ALA A 480 2.457 -4.635 -1.862 1.00 0.00 H new ATOM 0 HB1 ALA A 480 1.795 -6.035 -3.757 1.00 0.00 H new ATOM 0 HB2 ALA A 480 1.253 -6.739 -2.215 1.00 0.00 H new ATOM 0 HB3 ALA A 480 0.089 -5.904 -3.270 1.00 0.00 H new ATOM 890 N PHE A 481 2.410 -3.031 -3.751 1.00 0.00 N ATOM 891 CA PHE A 481 2.435 -1.903 -4.666 1.00 0.00 C ATOM 892 C PHE A 481 2.611 -2.373 -6.112 1.00 0.00 C ATOM 893 O PHE A 481 3.395 -3.280 -6.382 1.00 0.00 O ATOM 894 CB PHE A 481 3.634 -1.036 -4.275 1.00 0.00 C ATOM 895 CG PHE A 481 4.056 -0.035 -5.352 1.00 0.00 C ATOM 896 CD1 PHE A 481 3.115 0.703 -6.001 1.00 0.00 C ATOM 897 CD2 PHE A 481 5.371 0.118 -5.662 1.00 0.00 C ATOM 898 CE1 PHE A 481 3.506 1.633 -7.000 1.00 0.00 C ATOM 899 CE2 PHE A 481 5.762 1.048 -6.661 1.00 0.00 C ATOM 900 CZ PHE A 481 4.822 1.786 -7.309 1.00 0.00 C ATOM 0 H PHE A 481 3.305 -3.506 -3.635 1.00 0.00 H new ATOM 0 HA PHE A 481 1.496 -1.352 -4.603 1.00 0.00 H new ATOM 0 HB2 PHE A 481 3.393 -0.492 -3.362 1.00 0.00 H new ATOM 0 HB3 PHE A 481 4.479 -1.685 -4.046 1.00 0.00 H new ATOM 0 HD1 PHE A 481 2.070 0.581 -5.756 1.00 0.00 H new ATOM 0 HD2 PHE A 481 6.118 -0.468 -5.148 1.00 0.00 H new ATOM 0 HE1 PHE A 481 2.759 2.219 -7.515 1.00 0.00 H new ATOM 0 HE2 PHE A 481 6.807 1.169 -6.906 1.00 0.00 H new ATOM 0 HZ PHE A 481 5.120 2.493 -8.069 1.00 0.00 H new ATOM 910 N ASN A 482 1.867 -1.733 -7.003 1.00 0.00 N ATOM 911 CA ASN A 482 1.930 -2.075 -8.414 1.00 0.00 C ATOM 912 C ASN A 482 1.322 -0.937 -9.237 1.00 0.00 C ATOM 913 O ASN A 482 0.265 -0.412 -8.892 1.00 0.00 O ATOM 914 CB ASN A 482 1.135 -3.348 -8.708 1.00 0.00 C ATOM 915 CG ASN A 482 -0.370 -3.071 -8.694 1.00 0.00 C ATOM 916 OD1 ASN A 482 -1.028 -3.024 -9.720 1.00 0.00 O ATOM 917 ND2 ASN A 482 -0.876 -2.892 -7.477 1.00 0.00 N ATOM 0 H ASN A 482 1.218 -0.980 -6.775 1.00 0.00 H new ATOM 0 HA ASN A 482 2.976 -2.235 -8.676 1.00 0.00 H new ATOM 0 HB2 ASN A 482 1.426 -3.746 -9.680 1.00 0.00 H new ATOM 0 HB3 ASN A 482 1.375 -4.110 -7.967 1.00 0.00 H new ATOM 0 HD21 ASN A 482 -1.871 -2.702 -7.361 1.00 0.00 H new ATOM 0 HD22 ASN A 482 -0.269 -2.945 -6.659 1.00 0.00 H new ATOM 924 N ASP A 483 2.017 -0.590 -10.310 1.00 0.00 N ATOM 925 CA ASP A 483 1.559 0.476 -11.185 1.00 0.00 C ATOM 926 C ASP A 483 0.330 0.000 -11.961 1.00 0.00 C ATOM 927 O ASP A 483 -0.302 0.782 -12.671 1.00 0.00 O ATOM 928 CB ASP A 483 2.639 0.859 -12.199 1.00 0.00 C ATOM 929 CG ASP A 483 3.246 -0.315 -12.971 1.00 0.00 C ATOM 930 OD1 ASP A 483 3.887 -0.129 -14.016 1.00 0.00 O ATOM 931 OD2 ASP A 483 3.036 -1.477 -12.451 1.00 0.00 O ATOM 0 H ASP A 483 2.894 -1.028 -10.593 1.00 0.00 H new ATOM 0 HA ASP A 483 1.322 1.342 -10.566 1.00 0.00 H new ATOM 0 HB2 ASP A 483 2.212 1.563 -12.914 1.00 0.00 H new ATOM 0 HB3 ASP A 483 3.439 1.382 -11.675 1.00 0.00 H new ATOM 937 N GLY A 484 0.026 -1.279 -11.800 1.00 0.00 N ATOM 938 CA GLY A 484 -1.116 -1.868 -12.477 1.00 0.00 C ATOM 939 C GLY A 484 -0.756 -2.277 -13.907 1.00 0.00 C ATOM 940 O GLY A 484 -1.477 -3.050 -14.536 1.00 0.00 O ATOM 0 H GLY A 484 0.551 -1.924 -11.210 1.00 0.00 H new ATOM 0 HA2 GLY A 484 -1.462 -2.740 -11.922 1.00 0.00 H new ATOM 0 HA3 GLY A 484 -1.940 -1.154 -12.496 1.00 0.00 H new ATOM 944 N ASN A 485 0.360 -1.739 -14.379 1.00 0.00 N ATOM 945 CA ASN A 485 0.824 -2.038 -15.722 1.00 0.00 C ATOM 946 C ASN A 485 1.442 -3.438 -15.745 1.00 0.00 C ATOM 947 O ASN A 485 0.784 -4.404 -16.128 1.00 0.00 O ATOM 948 CB ASN A 485 1.896 -1.041 -16.169 1.00 0.00 C ATOM 949 CG ASN A 485 1.391 -0.172 -17.322 1.00 0.00 C ATOM 950 OD1 ASN A 485 1.903 -0.204 -18.428 1.00 0.00 O ATOM 951 ND2 ASN A 485 0.359 0.604 -17.002 1.00 0.00 N ATOM 0 H ASN A 485 0.956 -1.098 -13.855 1.00 0.00 H new ATOM 0 HA ASN A 485 -0.031 -1.975 -16.395 1.00 0.00 H new ATOM 0 HB2 ASN A 485 2.181 -0.407 -15.329 1.00 0.00 H new ATOM 0 HB3 ASN A 485 2.791 -1.579 -16.480 1.00 0.00 H new ATOM 0 HD21 ASN A 485 -0.052 1.221 -17.703 1.00 0.00 H new ATOM 0 HD22 ASN A 485 -0.022 0.582 -16.056 1.00 0.00 H new ATOM 958 N ASN A 486 2.698 -3.502 -15.328 1.00 0.00 N ATOM 959 CA ASN A 486 3.411 -4.768 -15.296 1.00 0.00 C ATOM 960 C ASN A 486 4.557 -4.677 -14.286 1.00 0.00 C ATOM 961 O ASN A 486 5.485 -5.483 -14.321 1.00 0.00 O ATOM 962 CB ASN A 486 4.012 -5.096 -16.664 1.00 0.00 C ATOM 963 CG ASN A 486 3.899 -6.591 -16.968 1.00 0.00 C ATOM 964 OD1 ASN A 486 3.986 -7.370 -15.894 1.00 0.00 O flip ATOM 965 ND2 ASN A 486 3.744 -7.010 -18.104 1.00 0.00 N flip ATOM 0 H ASN A 486 3.240 -2.699 -15.010 1.00 0.00 H new ATOM 0 HA ASN A 486 2.702 -5.548 -15.017 1.00 0.00 H new ATOM 0 HB2 ASN A 486 3.499 -4.524 -17.437 1.00 0.00 H new ATOM 0 HB3 ASN A 486 5.059 -4.795 -16.687 1.00 0.00 H new ATOM 0 HD21 ASN A 486 3.685 -6.357 -18.885 1.00 0.00 H new ATOM 0 HD22 ASN A 486 3.673 -8.014 -18.272 1.00 0.00 H new ATOM 972 N ASN A 487 4.454 -3.688 -13.410 1.00 0.00 N ATOM 973 CA ASN A 487 5.470 -3.482 -12.392 1.00 0.00 C ATOM 974 C ASN A 487 4.827 -3.585 -11.008 1.00 0.00 C ATOM 975 O ASN A 487 3.944 -2.797 -10.669 1.00 0.00 O ATOM 976 CB ASN A 487 6.101 -2.094 -12.518 1.00 0.00 C ATOM 977 CG ASN A 487 7.022 -2.019 -13.737 1.00 0.00 C ATOM 978 OD1 ASN A 487 8.192 -2.363 -13.686 1.00 0.00 O ATOM 979 ND2 ASN A 487 6.432 -1.552 -14.834 1.00 0.00 N ATOM 0 H ASN A 487 3.683 -3.021 -13.384 1.00 0.00 H new ATOM 0 HA ASN A 487 6.240 -4.242 -12.525 1.00 0.00 H new ATOM 0 HB2 ASN A 487 5.318 -1.341 -12.603 1.00 0.00 H new ATOM 0 HB3 ASN A 487 6.667 -1.865 -11.615 1.00 0.00 H new ATOM 0 HD21 ASN A 487 6.963 -1.464 -15.701 1.00 0.00 H new ATOM 0 HD22 ASN A 487 5.449 -1.282 -14.809 1.00 0.00 H new ATOM 986 N TRP A 488 5.294 -4.562 -10.244 1.00 0.00 N ATOM 987 CA TRP A 488 4.776 -4.778 -8.904 1.00 0.00 C ATOM 988 C TRP A 488 5.907 -4.509 -7.910 1.00 0.00 C ATOM 989 O TRP A 488 7.052 -4.301 -8.309 1.00 0.00 O ATOM 990 CB TRP A 488 4.179 -6.180 -8.767 1.00 0.00 C ATOM 991 CG TRP A 488 3.025 -6.463 -9.731 1.00 0.00 C ATOM 992 CD1 TRP A 488 3.065 -6.530 -11.068 1.00 0.00 C ATOM 993 CD2 TRP A 488 1.650 -6.716 -9.374 1.00 0.00 C ATOM 994 NE1 TRP A 488 1.821 -6.806 -11.598 1.00 0.00 N ATOM 995 CE2 TRP A 488 0.933 -6.923 -10.535 1.00 0.00 C ATOM 996 CE3 TRP A 488 1.032 -6.768 -8.112 1.00 0.00 C ATOM 997 CZ2 TRP A 488 -0.440 -7.196 -10.550 1.00 0.00 C ATOM 998 CZ3 TRP A 488 -0.341 -7.042 -8.144 1.00 0.00 C ATOM 999 CH2 TRP A 488 -1.077 -7.253 -9.304 1.00 0.00 C ATOM 0 H TRP A 488 6.026 -5.213 -10.528 1.00 0.00 H new ATOM 0 HA TRP A 488 3.957 -4.091 -8.692 1.00 0.00 H new ATOM 0 HB2 TRP A 488 4.966 -6.916 -8.932 1.00 0.00 H new ATOM 0 HB3 TRP A 488 3.826 -6.315 -7.745 1.00 0.00 H new ATOM 0 HD1 TRP A 488 3.959 -6.386 -11.657 1.00 0.00 H new ATOM 0 HE1 TRP A 488 1.595 -6.906 -12.588 1.00 0.00 H new ATOM 0 HE3 TRP A 488 1.573 -6.609 -7.191 1.00 0.00 H new ATOM 0 HZ2 TRP A 488 -0.979 -7.354 -11.473 1.00 0.00 H new ATOM 0 HZ3 TRP A 488 -0.865 -7.093 -7.201 1.00 0.00 H new ATOM 0 HH2 TRP A 488 -2.135 -7.460 -9.245 1.00 0.00 H new ATOM 1010 N ASP A 489 5.547 -4.523 -6.635 1.00 0.00 N ATOM 1011 CA ASP A 489 6.518 -4.283 -5.581 1.00 0.00 C ATOM 1012 C ASP A 489 5.942 -4.757 -4.245 1.00 0.00 C ATOM 1013 O ASP A 489 5.260 -4.000 -3.556 1.00 0.00 O ATOM 1014 CB ASP A 489 6.838 -2.792 -5.456 1.00 0.00 C ATOM 1015 CG ASP A 489 8.261 -2.400 -5.858 1.00 0.00 C ATOM 1016 OD1 ASP A 489 8.471 -1.686 -6.850 1.00 0.00 O ATOM 1017 OD2 ASP A 489 9.191 -2.866 -5.094 1.00 0.00 O ATOM 0 H ASP A 489 4.597 -4.697 -6.308 1.00 0.00 H new ATOM 0 HA ASP A 489 7.429 -4.827 -5.831 1.00 0.00 H new ATOM 0 HB2 ASP A 489 6.135 -2.232 -6.073 1.00 0.00 H new ATOM 0 HB3 ASP A 489 6.671 -2.485 -4.424 1.00 0.00 H new ATOM 1023 N SER A 490 6.238 -6.007 -3.920 1.00 0.00 N ATOM 1024 CA SER A 490 5.757 -6.590 -2.679 1.00 0.00 C ATOM 1025 C SER A 490 6.895 -7.331 -1.974 1.00 0.00 C ATOM 1026 O SER A 490 7.458 -8.278 -2.522 1.00 0.00 O ATOM 1027 CB SER A 490 4.584 -7.539 -2.935 1.00 0.00 C ATOM 1028 OG SER A 490 4.325 -7.705 -4.326 1.00 0.00 O ATOM 0 H SER A 490 6.804 -6.632 -4.494 1.00 0.00 H new ATOM 0 HA SER A 490 5.404 -5.784 -2.036 1.00 0.00 H new ATOM 0 HB2 SER A 490 4.799 -8.510 -2.488 1.00 0.00 H new ATOM 0 HB3 SER A 490 3.691 -7.152 -2.444 1.00 0.00 H new ATOM 0 HG SER A 490 3.571 -8.319 -4.447 1.00 0.00 H new ATOM 1034 N ASN A 491 7.200 -6.873 -0.769 1.00 0.00 N ATOM 1035 CA ASN A 491 8.261 -7.480 0.017 1.00 0.00 C ATOM 1036 C ASN A 491 9.325 -8.048 -0.924 1.00 0.00 C ATOM 1037 O ASN A 491 9.831 -9.147 -0.703 1.00 0.00 O ATOM 1038 CB ASN A 491 7.724 -8.629 0.872 1.00 0.00 C ATOM 1039 CG ASN A 491 8.554 -8.799 2.146 1.00 0.00 C ATOM 1040 OD1 ASN A 491 9.728 -8.472 2.201 1.00 0.00 O ATOM 1041 ND2 ASN A 491 7.881 -9.327 3.164 1.00 0.00 N ATOM 0 H ASN A 491 6.731 -6.088 -0.317 1.00 0.00 H new ATOM 0 HA ASN A 491 8.681 -6.712 0.667 1.00 0.00 H new ATOM 0 HB2 ASN A 491 6.684 -8.436 1.134 1.00 0.00 H new ATOM 0 HB3 ASN A 491 7.741 -9.554 0.296 1.00 0.00 H new ATOM 0 HD21 ASN A 491 8.347 -9.480 4.058 1.00 0.00 H new ATOM 0 HD22 ASN A 491 6.899 -9.579 3.050 1.00 0.00 H new ATOM 1048 N ASN A 492 9.632 -7.274 -1.954 1.00 0.00 N ATOM 1049 CA ASN A 492 10.627 -7.686 -2.930 1.00 0.00 C ATOM 1050 C ASN A 492 9.948 -8.507 -4.028 1.00 0.00 C ATOM 1051 O ASN A 492 10.214 -8.306 -5.212 1.00 0.00 O ATOM 1052 CB ASN A 492 11.703 -8.560 -2.284 1.00 0.00 C ATOM 1053 CG ASN A 492 12.995 -8.535 -3.103 1.00 0.00 C ATOM 1054 OD1 ASN A 492 13.203 -9.326 -4.008 1.00 0.00 O ATOM 1055 ND2 ASN A 492 13.850 -7.585 -2.735 1.00 0.00 N ATOM 0 H ASN A 492 9.209 -6.363 -2.134 1.00 0.00 H new ATOM 0 HA ASN A 492 11.090 -6.788 -3.340 1.00 0.00 H new ATOM 0 HB2 ASN A 492 11.903 -8.208 -1.272 1.00 0.00 H new ATOM 0 HB3 ASN A 492 11.342 -9.585 -2.200 1.00 0.00 H new ATOM 0 HD21 ASN A 492 14.742 -7.486 -3.219 1.00 0.00 H new ATOM 0 HD22 ASN A 492 13.614 -6.955 -1.968 1.00 0.00 H new ATOM 1062 N THR A 493 9.084 -9.413 -3.597 1.00 0.00 N ATOM 1063 CA THR A 493 8.365 -10.265 -4.528 1.00 0.00 C ATOM 1064 C THR A 493 7.469 -11.248 -3.771 1.00 0.00 C ATOM 1065 O THR A 493 7.357 -12.412 -4.152 1.00 0.00 O ATOM 1066 CB THR A 493 9.392 -10.952 -5.431 1.00 0.00 C ATOM 1067 OG1 THR A 493 8.636 -11.935 -6.133 1.00 0.00 O ATOM 1068 CG2 THR A 493 10.417 -11.765 -4.638 1.00 0.00 C ATOM 0 H THR A 493 8.865 -9.576 -2.614 1.00 0.00 H new ATOM 0 HA THR A 493 7.694 -9.682 -5.159 1.00 0.00 H new ATOM 0 HB THR A 493 9.909 -10.202 -6.029 1.00 0.00 H new ATOM 0 HG1 THR A 493 8.297 -12.601 -5.499 1.00 0.00 H new ATOM 0 HG21 THR A 493 11.122 -12.232 -5.326 1.00 0.00 H new ATOM 0 HG22 THR A 493 10.956 -11.106 -3.957 1.00 0.00 H new ATOM 0 HG23 THR A 493 9.904 -12.537 -4.065 1.00 0.00 H new ATOM 1076 N LYS A 494 6.855 -10.742 -2.711 1.00 0.00 N ATOM 1077 CA LYS A 494 5.973 -11.561 -1.897 1.00 0.00 C ATOM 1078 C LYS A 494 4.756 -10.733 -1.480 1.00 0.00 C ATOM 1079 O LYS A 494 3.660 -10.926 -2.006 1.00 0.00 O ATOM 1080 CB LYS A 494 6.739 -12.164 -0.717 1.00 0.00 C ATOM 1081 CG LYS A 494 8.030 -12.836 -1.188 1.00 0.00 C ATOM 1082 CD LYS A 494 8.433 -13.971 -0.245 1.00 0.00 C ATOM 1083 CE LYS A 494 8.677 -15.267 -1.021 1.00 0.00 C ATOM 1084 NZ LYS A 494 9.821 -16.009 -0.443 1.00 0.00 N ATOM 0 H LYS A 494 6.951 -9.776 -2.398 1.00 0.00 H new ATOM 0 HA LYS A 494 5.601 -12.408 -2.473 1.00 0.00 H new ATOM 0 HB2 LYS A 494 6.974 -11.383 0.006 1.00 0.00 H new ATOM 0 HB3 LYS A 494 6.111 -12.893 -0.205 1.00 0.00 H new ATOM 0 HG2 LYS A 494 7.894 -13.227 -2.196 1.00 0.00 H new ATOM 0 HG3 LYS A 494 8.831 -12.098 -1.238 1.00 0.00 H new ATOM 0 HD2 LYS A 494 9.336 -13.693 0.299 1.00 0.00 H new ATOM 0 HD3 LYS A 494 7.649 -14.129 0.496 1.00 0.00 H new ATOM 0 HE2 LYS A 494 7.782 -15.888 -0.994 1.00 0.00 H new ATOM 0 HE3 LYS A 494 8.875 -15.039 -2.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 9.973 -16.886 -0.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 10.677 -15.420 -0.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 9.617 -16.243 0.550 1.00 0.00 H new ATOM 1097 N ASN A 495 4.988 -9.829 -0.540 1.00 0.00 N ATOM 1098 CA ASN A 495 3.924 -8.971 -0.047 1.00 0.00 C ATOM 1099 C ASN A 495 4.324 -8.402 1.316 1.00 0.00 C ATOM 1100 O ASN A 495 4.891 -9.111 2.146 1.00 0.00 O ATOM 1101 CB ASN A 495 2.622 -9.755 0.131 1.00 0.00 C ATOM 1102 CG ASN A 495 1.566 -9.302 -0.879 1.00 0.00 C ATOM 1103 OD1 ASN A 495 1.227 -8.134 -0.979 1.00 0.00 O ATOM 1104 ND2 ASN A 495 1.067 -10.287 -1.619 1.00 0.00 N ATOM 0 H ASN A 495 5.898 -9.672 -0.106 1.00 0.00 H new ATOM 0 HA ASN A 495 3.768 -8.174 -0.775 1.00 0.00 H new ATOM 0 HB2 ASN A 495 2.815 -10.821 0.007 1.00 0.00 H new ATOM 0 HB3 ASN A 495 2.245 -9.615 1.144 1.00 0.00 H new ATOM 0 HD21 ASN A 495 0.356 -10.087 -2.322 1.00 0.00 H new ATOM 0 HD22 ASN A 495 1.395 -11.243 -1.484 1.00 0.00 H new ATOM 1111 N TYR A 496 4.012 -7.128 1.504 1.00 0.00 N ATOM 1112 CA TYR A 496 4.332 -6.456 2.752 1.00 0.00 C ATOM 1113 C TYR A 496 3.262 -6.727 3.811 1.00 0.00 C ATOM 1114 O TYR A 496 2.131 -7.081 3.480 1.00 0.00 O ATOM 1115 CB TYR A 496 4.349 -4.960 2.433 1.00 0.00 C ATOM 1116 CG TYR A 496 5.493 -4.533 1.510 1.00 0.00 C ATOM 1117 CD1 TYR A 496 6.795 -4.862 1.828 1.00 0.00 C ATOM 1118 CD2 TYR A 496 5.222 -3.820 0.360 1.00 0.00 C ATOM 1119 CE1 TYR A 496 7.871 -4.460 0.960 1.00 0.00 C ATOM 1120 CE2 TYR A 496 6.298 -3.418 -0.508 1.00 0.00 C ATOM 1121 CZ TYR A 496 7.570 -3.758 -0.165 1.00 0.00 C ATOM 1122 OH TYR A 496 8.586 -3.379 -0.985 1.00 0.00 O ATOM 0 H TYR A 496 3.541 -6.544 0.813 1.00 0.00 H new ATOM 0 HA TYR A 496 5.285 -6.811 3.145 1.00 0.00 H new ATOM 0 HB2 TYR A 496 3.401 -4.687 1.970 1.00 0.00 H new ATOM 0 HB3 TYR A 496 4.421 -4.401 3.366 1.00 0.00 H new ATOM 0 HD1 TYR A 496 7.007 -5.421 2.728 1.00 0.00 H new ATOM 0 HD2 TYR A 496 4.203 -3.564 0.111 1.00 0.00 H new ATOM 0 HE1 TYR A 496 8.894 -4.710 1.197 1.00 0.00 H new ATOM 0 HE2 TYR A 496 6.100 -2.859 -1.411 1.00 0.00 H new ATOM 0 HH TYR A 496 9.315 -4.032 -0.926 1.00 0.00 H new ATOM 1132 N SER A 497 3.656 -6.552 5.064 1.00 0.00 N ATOM 1133 CA SER A 497 2.745 -6.773 6.173 1.00 0.00 C ATOM 1134 C SER A 497 2.806 -5.593 7.145 1.00 0.00 C ATOM 1135 O SER A 497 3.886 -5.201 7.584 1.00 0.00 O ATOM 1136 CB SER A 497 3.072 -8.078 6.902 1.00 0.00 C ATOM 1137 OG SER A 497 2.134 -8.361 7.937 1.00 0.00 O ATOM 0 H SER A 497 4.595 -6.259 5.335 1.00 0.00 H new ATOM 0 HA SER A 497 1.734 -6.854 5.774 1.00 0.00 H new ATOM 0 HB2 SER A 497 3.081 -8.900 6.187 1.00 0.00 H new ATOM 0 HB3 SER A 497 4.073 -8.014 7.328 1.00 0.00 H new ATOM 0 HG SER A 497 2.579 -8.297 8.808 1.00 0.00 H new ATOM 1143 N PHE A 498 1.632 -5.059 7.451 1.00 0.00 N ATOM 1144 CA PHE A 498 1.539 -3.931 8.362 1.00 0.00 C ATOM 1145 C PHE A 498 0.446 -4.160 9.408 1.00 0.00 C ATOM 1146 O PHE A 498 -0.532 -4.858 9.146 1.00 0.00 O ATOM 1147 CB PHE A 498 1.175 -2.706 7.521 1.00 0.00 C ATOM 1148 CG PHE A 498 1.961 -2.592 6.213 1.00 0.00 C ATOM 1149 CD1 PHE A 498 3.303 -2.814 6.206 1.00 0.00 C ATOM 1150 CD2 PHE A 498 1.319 -2.269 5.059 1.00 0.00 C ATOM 1151 CE1 PHE A 498 4.033 -2.709 4.992 1.00 0.00 C ATOM 1152 CE2 PHE A 498 2.049 -2.164 3.846 1.00 0.00 C ATOM 1153 CZ PHE A 498 3.391 -2.386 3.838 1.00 0.00 C ATOM 0 H PHE A 498 0.738 -5.387 7.084 1.00 0.00 H new ATOM 0 HA PHE A 498 2.485 -3.798 8.887 1.00 0.00 H new ATOM 0 HB2 PHE A 498 0.110 -2.740 7.291 1.00 0.00 H new ATOM 0 HB3 PHE A 498 1.345 -1.807 8.114 1.00 0.00 H new ATOM 0 HD1 PHE A 498 3.813 -3.070 7.123 1.00 0.00 H new ATOM 0 HD2 PHE A 498 0.254 -2.092 5.065 1.00 0.00 H new ATOM 0 HE1 PHE A 498 5.098 -2.886 4.986 1.00 0.00 H new ATOM 0 HE2 PHE A 498 1.539 -1.908 2.929 1.00 0.00 H new ATOM 0 HZ PHE A 498 3.946 -2.306 2.915 1.00 0.00 H new ATOM 1163 N SER A 499 0.649 -3.558 10.571 1.00 0.00 N ATOM 1164 CA SER A 499 -0.306 -3.688 11.658 1.00 0.00 C ATOM 1165 C SER A 499 -1.194 -2.444 11.726 1.00 0.00 C ATOM 1166 O SER A 499 -0.760 -1.348 11.373 1.00 0.00 O ATOM 1167 CB SER A 499 0.406 -3.906 12.994 1.00 0.00 C ATOM 1168 OG SER A 499 1.794 -3.595 12.916 1.00 0.00 O ATOM 0 H SER A 499 1.461 -2.979 10.784 1.00 0.00 H new ATOM 0 HA SER A 499 -0.929 -4.561 11.463 1.00 0.00 H new ATOM 0 HB2 SER A 499 -0.062 -3.287 13.759 1.00 0.00 H new ATOM 0 HB3 SER A 499 0.284 -4.944 13.305 1.00 0.00 H new ATOM 0 HG SER A 499 2.213 -3.745 13.789 1.00 0.00 H new ATOM 1174 N THR A 500 -2.420 -2.654 12.182 1.00 0.00 N ATOM 1175 CA THR A 500 -3.372 -1.563 12.300 1.00 0.00 C ATOM 1176 C THR A 500 -2.639 -0.236 12.508 1.00 0.00 C ATOM 1177 O THR A 500 -1.651 -0.176 13.238 1.00 0.00 O ATOM 1178 CB THR A 500 -4.344 -1.905 13.432 1.00 0.00 C ATOM 1179 OG1 THR A 500 -3.497 -2.217 14.534 1.00 0.00 O ATOM 1180 CG2 THR A 500 -5.112 -3.202 13.172 1.00 0.00 C ATOM 0 H THR A 500 -2.776 -3.564 12.474 1.00 0.00 H new ATOM 0 HA THR A 500 -3.948 -1.439 11.383 1.00 0.00 H new ATOM 0 HB THR A 500 -5.051 -1.086 13.564 1.00 0.00 H new ATOM 0 HG1 THR A 500 -4.045 -2.449 15.313 1.00 0.00 H new ATOM 0 HG21 THR A 500 -5.787 -3.398 14.005 1.00 0.00 H new ATOM 0 HG22 THR A 500 -5.689 -3.105 12.252 1.00 0.00 H new ATOM 0 HG23 THR A 500 -4.408 -4.028 13.073 1.00 0.00 H new ATOM 1188 N GLY A 501 -3.152 0.795 11.854 1.00 0.00 N ATOM 1189 CA GLY A 501 -2.559 2.117 11.957 1.00 0.00 C ATOM 1190 C GLY A 501 -2.308 2.716 10.572 1.00 0.00 C ATOM 1191 O GLY A 501 -3.052 2.444 9.630 1.00 0.00 O ATOM 0 H GLY A 501 -3.972 0.742 11.250 1.00 0.00 H new ATOM 0 HA2 GLY A 501 -3.219 2.772 12.526 1.00 0.00 H new ATOM 0 HA3 GLY A 501 -1.619 2.056 12.506 1.00 0.00 H new ATOM 1195 N THR A 502 -1.258 3.520 10.491 1.00 0.00 N ATOM 1196 CA THR A 502 -0.901 4.160 9.236 1.00 0.00 C ATOM 1197 C THR A 502 0.568 3.893 8.901 1.00 0.00 C ATOM 1198 O THR A 502 1.428 3.946 9.778 1.00 0.00 O ATOM 1199 CB THR A 502 -1.236 5.648 9.352 1.00 0.00 C ATOM 1200 OG1 THR A 502 -2.569 5.665 9.857 1.00 0.00 O ATOM 1201 CG2 THR A 502 -1.346 6.331 7.987 1.00 0.00 C ATOM 0 H THR A 502 -0.643 3.743 11.274 1.00 0.00 H new ATOM 0 HA THR A 502 -1.473 3.747 8.405 1.00 0.00 H new ATOM 0 HB THR A 502 -0.471 6.147 9.947 1.00 0.00 H new ATOM 0 HG1 THR A 502 -2.866 6.593 9.964 1.00 0.00 H new ATOM 0 HG21 THR A 502 -1.585 7.385 8.126 1.00 0.00 H new ATOM 0 HG22 THR A 502 -0.398 6.241 7.457 1.00 0.00 H new ATOM 0 HG23 THR A 502 -2.134 5.854 7.404 1.00 0.00 H new ATOM 1209 N SER A 503 0.810 3.611 7.629 1.00 0.00 N ATOM 1210 CA SER A 503 2.159 3.335 7.167 1.00 0.00 C ATOM 1211 C SER A 503 2.420 4.065 5.848 1.00 0.00 C ATOM 1212 O SER A 503 1.501 4.277 5.059 1.00 0.00 O ATOM 1213 CB SER A 503 2.386 1.831 6.995 1.00 0.00 C ATOM 1214 OG SER A 503 1.195 1.153 6.603 1.00 0.00 O ATOM 0 H SER A 503 0.094 3.568 6.904 1.00 0.00 H new ATOM 0 HA SER A 503 2.859 3.697 7.920 1.00 0.00 H new ATOM 0 HB2 SER A 503 3.161 1.664 6.247 1.00 0.00 H new ATOM 0 HB3 SER A 503 2.751 1.410 7.932 1.00 0.00 H new ATOM 0 HG SER A 503 1.381 0.196 6.502 1.00 0.00 H new ATOM 1220 N THR A 504 3.679 4.429 5.649 1.00 0.00 N ATOM 1221 CA THR A 504 4.072 5.132 4.440 1.00 0.00 C ATOM 1222 C THR A 504 5.038 4.277 3.617 1.00 0.00 C ATOM 1223 O THR A 504 5.929 3.633 4.170 1.00 0.00 O ATOM 1224 CB THR A 504 4.656 6.486 4.848 1.00 0.00 C ATOM 1225 OG1 THR A 504 3.512 7.282 5.143 1.00 0.00 O ATOM 1226 CG2 THR A 504 5.324 7.212 3.679 1.00 0.00 C ATOM 0 H THR A 504 4.439 4.250 6.305 1.00 0.00 H new ATOM 0 HA THR A 504 3.215 5.314 3.792 1.00 0.00 H new ATOM 0 HB THR A 504 5.382 6.342 5.648 1.00 0.00 H new ATOM 0 HG1 THR A 504 3.091 6.957 5.966 1.00 0.00 H new ATOM 0 HG21 THR A 504 5.721 8.167 4.023 1.00 0.00 H new ATOM 0 HG22 THR A 504 6.137 6.600 3.288 1.00 0.00 H new ATOM 0 HG23 THR A 504 4.590 7.387 2.892 1.00 0.00 H new ATOM 1234 N TYR A 505 4.830 4.298 2.309 1.00 0.00 N ATOM 1235 CA TYR A 505 5.671 3.532 1.404 1.00 0.00 C ATOM 1236 C TYR A 505 6.381 4.450 0.407 1.00 0.00 C ATOM 1237 O TYR A 505 5.738 5.245 -0.277 1.00 0.00 O ATOM 1238 CB TYR A 505 4.729 2.600 0.640 1.00 0.00 C ATOM 1239 CG TYR A 505 5.446 1.525 -0.179 1.00 0.00 C ATOM 1240 CD1 TYR A 505 6.447 0.771 0.399 1.00 0.00 C ATOM 1241 CD2 TYR A 505 5.093 1.310 -1.495 1.00 0.00 C ATOM 1242 CE1 TYR A 505 7.123 -0.241 -0.371 1.00 0.00 C ATOM 1243 CE2 TYR A 505 5.768 0.298 -2.266 1.00 0.00 C ATOM 1244 CZ TYR A 505 6.750 -0.427 -1.666 1.00 0.00 C ATOM 1245 OH TYR A 505 7.387 -1.383 -2.394 1.00 0.00 O ATOM 0 H TYR A 505 4.091 4.834 1.854 1.00 0.00 H new ATOM 0 HA TYR A 505 6.437 2.989 1.958 1.00 0.00 H new ATOM 0 HB2 TYR A 505 4.060 2.115 1.350 1.00 0.00 H new ATOM 0 HB3 TYR A 505 4.107 3.196 -0.028 1.00 0.00 H new ATOM 0 HD1 TYR A 505 6.724 0.940 1.429 1.00 0.00 H new ATOM 0 HD2 TYR A 505 4.310 1.901 -1.947 1.00 0.00 H new ATOM 0 HE1 TYR A 505 7.908 -0.838 0.069 1.00 0.00 H new ATOM 0 HE2 TYR A 505 5.501 0.119 -3.297 1.00 0.00 H new ATOM 0 HH TYR A 505 7.681 -2.105 -1.800 1.00 0.00 H new ATOM 1255 N THR A 506 7.698 4.310 0.357 1.00 0.00 N ATOM 1256 CA THR A 506 8.502 5.117 -0.545 1.00 0.00 C ATOM 1257 C THR A 506 9.411 4.224 -1.392 1.00 0.00 C ATOM 1258 O THR A 506 9.860 3.176 -0.933 1.00 0.00 O ATOM 1259 CB THR A 506 9.269 6.142 0.294 1.00 0.00 C ATOM 1260 OG1 THR A 506 8.306 7.157 0.567 1.00 0.00 O ATOM 1261 CG2 THR A 506 10.353 6.862 -0.509 1.00 0.00 C ATOM 0 H THR A 506 8.228 3.650 0.926 1.00 0.00 H new ATOM 0 HA THR A 506 7.877 5.659 -1.255 1.00 0.00 H new ATOM 0 HB THR A 506 9.723 5.644 1.150 1.00 0.00 H new ATOM 0 HG1 THR A 506 8.718 7.862 1.109 1.00 0.00 H new ATOM 0 HG21 THR A 506 10.866 7.578 0.133 1.00 0.00 H new ATOM 0 HG22 THR A 506 11.070 6.133 -0.887 1.00 0.00 H new ATOM 0 HG23 THR A 506 9.896 7.389 -1.347 1.00 0.00 H new ATOM 1269 N PRO A 507 9.660 4.685 -2.648 1.00 0.00 N ATOM 1270 CA PRO A 507 10.506 3.940 -3.564 1.00 0.00 C ATOM 1271 C PRO A 507 11.982 4.078 -3.183 1.00 0.00 C ATOM 1272 O PRO A 507 12.412 5.136 -2.726 1.00 0.00 O ATOM 1273 CB PRO A 507 10.192 4.506 -4.939 1.00 0.00 C ATOM 1274 CG PRO A 507 9.533 5.854 -4.694 1.00 0.00 C ATOM 1275 CD PRO A 507 9.144 5.922 -3.226 1.00 0.00 C ATOM 0 HA PRO A 507 10.313 2.868 -3.536 1.00 0.00 H new ATOM 0 HB2 PRO A 507 11.100 4.617 -5.532 1.00 0.00 H new ATOM 0 HB3 PRO A 507 9.529 3.842 -5.493 1.00 0.00 H new ATOM 0 HG2 PRO A 507 10.217 6.665 -4.946 1.00 0.00 H new ATOM 0 HG3 PRO A 507 8.654 5.970 -5.328 1.00 0.00 H new ATOM 0 HD2 PRO A 507 9.578 6.797 -2.741 1.00 0.00 H new ATOM 0 HD3 PRO A 507 8.063 5.995 -3.106 1.00 0.00 H new ATOM 1283 N GLY A 508 12.716 2.994 -3.385 1.00 0.00 N ATOM 1284 CA GLY A 508 14.134 2.981 -3.068 1.00 0.00 C ATOM 1285 C GLY A 508 14.976 3.294 -4.307 1.00 0.00 C ATOM 1286 O GLY A 508 14.697 4.253 -5.025 1.00 0.00 O ATOM 0 H GLY A 508 12.356 2.118 -3.764 1.00 0.00 H new ATOM 0 HA2 GLY A 508 14.343 3.713 -2.288 1.00 0.00 H new ATOM 0 HA3 GLY A 508 14.413 2.005 -2.672 1.00 0.00 H new ATOM 1290 N ASN A 509 15.989 2.467 -4.519 1.00 0.00 N ATOM 1291 CA ASN A 509 16.873 2.643 -5.658 1.00 0.00 C ATOM 1292 C ASN A 509 18.128 1.789 -5.462 1.00 0.00 C ATOM 1293 O ASN A 509 19.060 2.199 -4.771 1.00 0.00 O ATOM 1294 CB ASN A 509 17.311 4.102 -5.795 1.00 0.00 C ATOM 1295 CG ASN A 509 18.530 4.226 -6.712 1.00 0.00 C ATOM 1296 OD1 ASN A 509 19.694 4.224 -6.068 1.00 0.00 O flip ATOM 1297 ND2 ASN A 509 18.421 4.316 -7.923 1.00 0.00 N flip ATOM 0 H ASN A 509 16.217 1.673 -3.921 1.00 0.00 H new ATOM 0 HA ASN A 509 16.330 2.343 -6.555 1.00 0.00 H new ATOM 0 HB2 ASN A 509 16.489 4.696 -6.195 1.00 0.00 H new ATOM 0 HB3 ASN A 509 17.549 4.508 -4.812 1.00 0.00 H new ATOM 0 HD21 ASN A 509 17.496 4.311 -8.354 1.00 0.00 H new ATOM 0 HD22 ASN A 509 19.254 4.396 -8.506 1.00 0.00 H new ATOM 1304 N SER A 510 18.111 0.618 -6.081 1.00 0.00 N ATOM 1305 CA SER A 510 19.235 -0.297 -5.982 1.00 0.00 C ATOM 1306 C SER A 510 19.438 -0.722 -4.526 1.00 0.00 C ATOM 1307 O SER A 510 18.919 -1.752 -4.099 1.00 0.00 O ATOM 1308 CB SER A 510 20.513 0.339 -6.532 1.00 0.00 C ATOM 1309 OG SER A 510 20.879 -0.204 -7.797 1.00 0.00 O ATOM 0 H SER A 510 17.336 0.282 -6.653 1.00 0.00 H new ATOM 0 HA SER A 510 19.012 -1.178 -6.583 1.00 0.00 H new ATOM 0 HB2 SER A 510 20.370 1.415 -6.627 1.00 0.00 H new ATOM 0 HB3 SER A 510 21.327 0.187 -5.823 1.00 0.00 H new ATOM 0 HG SER A 510 21.699 0.230 -8.114 1.00 0.00 H new ATOM 1315 N GLY A 511 20.193 0.093 -3.805 1.00 0.00 N ATOM 1316 CA GLY A 511 20.471 -0.186 -2.406 1.00 0.00 C ATOM 1317 C GLY A 511 19.174 -0.311 -1.604 1.00 0.00 C ATOM 1318 O GLY A 511 19.099 -1.090 -0.656 1.00 0.00 O ATOM 0 H GLY A 511 20.621 0.947 -4.163 1.00 0.00 H new ATOM 0 HA2 GLY A 511 21.045 -1.109 -2.323 1.00 0.00 H new ATOM 0 HA3 GLY A 511 21.086 0.611 -1.988 1.00 0.00 H new ATOM 1322 N ASN A 512 18.185 0.470 -2.014 1.00 0.00 N ATOM 1323 CA ASN A 512 16.895 0.457 -1.345 1.00 0.00 C ATOM 1324 C ASN A 512 15.913 -0.392 -2.155 1.00 0.00 C ATOM 1325 O ASN A 512 16.131 -0.636 -3.341 1.00 0.00 O ATOM 1326 CB ASN A 512 16.318 1.869 -1.233 1.00 0.00 C ATOM 1327 CG ASN A 512 17.148 2.726 -0.275 1.00 0.00 C ATOM 1328 OD1 ASN A 512 17.995 3.508 -0.674 1.00 0.00 O ATOM 1329 ND2 ASN A 512 16.858 2.536 1.009 1.00 0.00 N ATOM 0 H ASN A 512 18.251 1.116 -2.801 1.00 0.00 H new ATOM 0 HA ASN A 512 17.038 0.046 -0.346 1.00 0.00 H new ATOM 0 HB2 ASN A 512 16.296 2.336 -2.218 1.00 0.00 H new ATOM 0 HB3 ASN A 512 15.288 1.818 -0.881 1.00 0.00 H new ATOM 0 HD21 ASN A 512 17.357 3.061 1.728 1.00 0.00 H new ATOM 0 HD22 ASN A 512 16.137 1.865 1.275 1.00 0.00 H new ATOM 1336 N ALA A 513 14.854 -0.819 -1.483 1.00 0.00 N ATOM 1337 CA ALA A 513 13.839 -1.635 -2.126 1.00 0.00 C ATOM 1338 C ALA A 513 12.510 -1.463 -1.388 1.00 0.00 C ATOM 1339 O ALA A 513 12.271 -2.112 -0.371 1.00 0.00 O ATOM 1340 CB ALA A 513 14.302 -3.093 -2.160 1.00 0.00 C ATOM 0 H ALA A 513 14.677 -0.615 -0.499 1.00 0.00 H new ATOM 0 HA ALA A 513 13.687 -1.317 -3.157 1.00 0.00 H new ATOM 0 HB1 ALA A 513 13.540 -3.705 -2.643 1.00 0.00 H new ATOM 0 HB2 ALA A 513 15.234 -3.166 -2.720 1.00 0.00 H new ATOM 0 HB3 ALA A 513 14.462 -3.448 -1.142 1.00 0.00 H new ATOM 1346 N GLY A 514 11.679 -0.584 -1.930 1.00 0.00 N ATOM 1347 CA GLY A 514 10.380 -0.317 -1.336 1.00 0.00 C ATOM 1348 C GLY A 514 10.490 -0.179 0.184 1.00 0.00 C ATOM 1349 O GLY A 514 10.477 -1.176 0.904 1.00 0.00 O ATOM 0 H GLY A 514 11.880 -0.048 -2.774 1.00 0.00 H new ATOM 0 HA2 GLY A 514 9.964 0.598 -1.759 1.00 0.00 H new ATOM 0 HA3 GLY A 514 9.691 -1.124 -1.582 1.00 0.00 H new ATOM 1353 N THR A 515 10.596 1.065 0.627 1.00 0.00 N ATOM 1354 CA THR A 515 10.709 1.347 2.048 1.00 0.00 C ATOM 1355 C THR A 515 9.326 1.591 2.654 1.00 0.00 C ATOM 1356 O THR A 515 8.491 2.266 2.054 1.00 0.00 O ATOM 1357 CB THR A 515 11.666 2.528 2.221 1.00 0.00 C ATOM 1358 OG1 THR A 515 11.531 3.265 1.009 1.00 0.00 O ATOM 1359 CG2 THR A 515 13.134 2.096 2.233 1.00 0.00 C ATOM 0 H THR A 515 10.606 1.890 0.027 1.00 0.00 H new ATOM 0 HA THR A 515 11.121 0.495 2.589 1.00 0.00 H new ATOM 0 HB THR A 515 11.434 3.050 3.149 1.00 0.00 H new ATOM 0 HG1 THR A 515 10.581 3.420 0.825 1.00 0.00 H new ATOM 0 HG21 THR A 515 13.770 2.972 2.358 1.00 0.00 H new ATOM 0 HG22 THR A 515 13.303 1.404 3.058 1.00 0.00 H new ATOM 0 HG23 THR A 515 13.376 1.604 1.291 1.00 0.00 H new ATOM 1367 N ILE A 516 9.127 1.030 3.838 1.00 0.00 N ATOM 1368 CA ILE A 516 7.859 1.178 4.532 1.00 0.00 C ATOM 1369 C ILE A 516 8.110 1.769 5.921 1.00 0.00 C ATOM 1370 O ILE A 516 9.071 1.398 6.594 1.00 0.00 O ATOM 1371 CB ILE A 516 7.103 -0.152 4.557 1.00 0.00 C ATOM 1372 CG1 ILE A 516 7.162 -0.841 3.192 1.00 0.00 C ATOM 1373 CG2 ILE A 516 5.664 0.044 5.039 1.00 0.00 C ATOM 1374 CD1 ILE A 516 7.565 -2.310 3.337 1.00 0.00 C ATOM 0 H ILE A 516 9.822 0.472 4.334 1.00 0.00 H new ATOM 0 HA ILE A 516 7.212 1.875 4.000 1.00 0.00 H new ATOM 0 HB ILE A 516 7.595 -0.811 5.272 1.00 0.00 H new ATOM 0 HG12 ILE A 516 6.190 -0.773 2.704 1.00 0.00 H new ATOM 0 HG13 ILE A 516 7.877 -0.325 2.551 1.00 0.00 H new ATOM 0 HG21 ILE A 516 5.149 -0.917 5.047 1.00 0.00 H new ATOM 0 HG22 ILE A 516 5.671 0.461 6.046 1.00 0.00 H new ATOM 0 HG23 ILE A 516 5.145 0.728 4.367 1.00 0.00 H new ATOM 0 HD11 ILE A 516 7.600 -2.777 2.353 1.00 0.00 H new ATOM 0 HD12 ILE A 516 8.548 -2.373 3.803 1.00 0.00 H new ATOM 0 HD13 ILE A 516 6.835 -2.828 3.959 1.00 0.00 H new ATOM 1386 N THR A 517 7.228 2.678 6.310 1.00 0.00 N ATOM 1387 CA THR A 517 7.342 3.324 7.607 1.00 0.00 C ATOM 1388 C THR A 517 6.011 3.251 8.358 1.00 0.00 C ATOM 1389 O THR A 517 4.967 3.005 7.756 1.00 0.00 O ATOM 1390 CB THR A 517 7.833 4.755 7.381 1.00 0.00 C ATOM 1391 OG1 THR A 517 7.564 5.001 6.003 1.00 0.00 O ATOM 1392 CG2 THR A 517 9.355 4.876 7.490 1.00 0.00 C ATOM 0 H THR A 517 6.432 2.982 5.750 1.00 0.00 H new ATOM 0 HA THR A 517 8.066 2.812 8.241 1.00 0.00 H new ATOM 0 HB THR A 517 7.363 5.419 8.107 1.00 0.00 H new ATOM 0 HG1 THR A 517 7.850 5.909 5.771 1.00 0.00 H new ATOM 0 HG21 THR A 517 9.651 5.911 7.321 1.00 0.00 H new ATOM 0 HG22 THR A 517 9.674 4.565 8.485 1.00 0.00 H new ATOM 0 HG23 THR A 517 9.825 4.238 6.742 1.00 0.00 H new ATOM 1400 N SER A 518 6.091 3.468 9.662 1.00 0.00 N ATOM 1401 CA SER A 518 4.906 3.429 10.502 1.00 0.00 C ATOM 1402 C SER A 518 4.512 4.848 10.917 1.00 0.00 C ATOM 1403 O SER A 518 5.020 5.373 11.906 1.00 0.00 O ATOM 1404 CB SER A 518 5.136 2.559 11.739 1.00 0.00 C ATOM 1405 OG SER A 518 4.828 1.189 11.493 1.00 0.00 O ATOM 0 H SER A 518 6.959 3.672 10.158 1.00 0.00 H new ATOM 0 HA SER A 518 4.093 2.987 9.926 1.00 0.00 H new ATOM 0 HB2 SER A 518 6.176 2.646 12.055 1.00 0.00 H new ATOM 0 HB3 SER A 518 4.521 2.927 12.560 1.00 0.00 H new ATOM 0 HG SER A 518 4.989 0.666 12.306 1.00 0.00 H new ATOM 1411 N GLY A 519 3.609 5.428 10.140 1.00 0.00 N ATOM 1412 CA GLY A 519 3.141 6.776 10.415 1.00 0.00 C ATOM 1413 C GLY A 519 3.157 7.631 9.146 1.00 0.00 C ATOM 1414 O GLY A 519 4.129 7.612 8.392 1.00 0.00 O ATOM 0 H GLY A 519 3.189 4.989 9.320 1.00 0.00 H new ATOM 0 HA2 GLY A 519 2.130 6.738 10.820 1.00 0.00 H new ATOM 0 HA3 GLY A 519 3.772 7.236 11.176 1.00 0.00 H new ATOM 1418 N ALA A 520 2.069 8.361 8.949 1.00 0.00 N ATOM 1419 CA ALA A 520 1.946 9.221 7.784 1.00 0.00 C ATOM 1420 C ALA A 520 3.085 10.243 7.787 1.00 0.00 C ATOM 1421 O ALA A 520 3.643 10.552 8.839 1.00 0.00 O ATOM 1422 CB ALA A 520 0.567 9.884 7.782 1.00 0.00 C ATOM 0 H ALA A 520 1.265 8.375 9.576 1.00 0.00 H new ATOM 0 HA ALA A 520 2.029 8.638 6.866 1.00 0.00 H new ATOM 0 HB1 ALA A 520 0.475 10.529 6.908 1.00 0.00 H new ATOM 0 HB2 ALA A 520 -0.206 9.116 7.749 1.00 0.00 H new ATOM 0 HB3 ALA A 520 0.448 10.480 8.687 1.00 0.00 H new ATOM 1428 N PRO A 521 3.403 10.753 6.568 1.00 0.00 N ATOM 1429 CA PRO A 521 4.465 11.734 6.420 1.00 0.00 C ATOM 1430 C PRO A 521 4.013 13.110 6.916 1.00 0.00 C ATOM 1431 O PRO A 521 2.830 13.440 6.849 1.00 0.00 O ATOM 1432 CB PRO A 521 4.811 11.721 4.940 1.00 0.00 C ATOM 1433 CG PRO A 521 3.623 11.079 4.241 1.00 0.00 C ATOM 1434 CD PRO A 521 2.763 10.411 5.301 1.00 0.00 C ATOM 0 HA PRO A 521 5.342 11.497 7.022 1.00 0.00 H new ATOM 0 HB2 PRO A 521 4.983 12.732 4.570 1.00 0.00 H new ATOM 0 HB3 PRO A 521 5.725 11.155 4.757 1.00 0.00 H new ATOM 0 HG2 PRO A 521 3.047 11.830 3.700 1.00 0.00 H new ATOM 0 HG3 PRO A 521 3.962 10.347 3.507 1.00 0.00 H new ATOM 0 HD2 PRO A 521 1.736 10.775 5.265 1.00 0.00 H new ATOM 0 HD3 PRO A 521 2.723 9.331 5.156 1.00 0.00 H new ATOM 1442 N ALA A 522 4.979 13.875 7.403 1.00 0.00 N ATOM 1443 CA ALA A 522 4.696 15.207 7.910 1.00 0.00 C ATOM 1444 C ALA A 522 5.404 16.242 7.034 1.00 0.00 C ATOM 1445 O ALA A 522 6.207 17.033 7.528 1.00 0.00 O ATOM 1446 CB ALA A 522 5.120 15.295 9.377 1.00 0.00 C ATOM 0 H ALA A 522 5.959 13.598 7.457 1.00 0.00 H new ATOM 0 HA ALA A 522 3.627 15.416 7.867 1.00 0.00 H new ATOM 0 HB1 ALA A 522 4.908 16.294 9.758 1.00 0.00 H new ATOM 0 HB2 ALA A 522 4.567 14.559 9.960 1.00 0.00 H new ATOM 0 HB3 ALA A 522 6.188 15.094 9.460 1.00 0.00 H new ATOM 1452 N GLY A 523 5.082 16.204 5.750 1.00 0.00 N ATOM 1453 CA GLY A 523 5.677 17.130 4.801 1.00 0.00 C ATOM 1454 C GLY A 523 5.408 18.580 5.207 1.00 0.00 C ATOM 1455 O GLY A 523 4.310 18.910 5.652 1.00 0.00 O ATOM 0 H GLY A 523 4.416 15.546 5.344 1.00 0.00 H new ATOM 0 HA2 GLY A 523 6.752 16.958 4.745 1.00 0.00 H new ATOM 0 HA3 GLY A 523 5.272 16.946 3.806 1.00 0.00 H new TER 1459 GLY A 523