USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 556 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 Single : A 519 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 522 THR OG1 : rot 180:sc= 0 USER MOD Single : A 523 SER OG : rot 108:sc= 0.522 USER MOD Single : A 524 ASN : amide:sc= -0.733 K(o=-0.73,f=-2.4!) USER MOD Single : A 526 THR OG1 : rot 43:sc=-0.00935 USER MOD Single : A 530 THR OG1 : rot 180:sc= 0.00498 USER MOD Single : A 531 TYR OH : rot 180:sc= 0 USER MOD Single : A 532 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 535 MET CE :methyl -120:sc= -2.21 (180deg=-6.39!) USER MOD Single : A 536 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 544 MET CE :methyl 158:sc= -5.16! (180deg=-6.39!) USER MOD Single : A 545 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 549 MET CE :methyl 177:sc= -5.44! (180deg=-5.61!) USER MOD Single : A 550 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 551 SER OG : rot -76:sc= 1.25 USER MOD Single : A 554 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 555 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 557 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.48) USER MOD Single : A 558 GLN : amide:sc=-0.00164 K(o=-0.0016,f=-0.85) USER MOD Single : A 559 ASN : amide:sc= -0.203 X(o=-0.2,f=-0.028) USER MOD Single : A 564 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 566 HIS : no HD1:sc= -7.79! C(o=-7.8!,f=-10!) USER MOD Single : A 567 MET CE :methyl -153:sc= -0.22 (180deg=-1.34!) USER MOD Single : A 568 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 569 ASN : amide:sc= -1.47 K(o=-1.5,f=-2) USER MOD Single : A 574 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 575 LYS NZ :NH3+ -133:sc= 0.0272 (180deg=-1.65) USER MOD Single : A 577 GLN : amide:sc= -5.42 X(o=-5.4,f=-5.5!) USER MOD Single : A 578 THR OG1 : rot 89:sc= 1.21 USER MOD Single : A 587 THR OG1 : rot 180:sc= -1.22 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 519 76.149 9.561 17.335 1.00 0.00 N ATOM 2 CA GLN A 519 75.153 8.527 17.070 1.00 0.00 C ATOM 3 C GLN A 519 75.766 7.389 16.252 1.00 0.00 C ATOM 4 O GLN A 519 76.696 7.614 15.473 1.00 0.00 O ATOM 5 CB GLN A 519 73.966 9.122 16.312 1.00 0.00 C ATOM 6 CG GLN A 519 73.080 9.908 17.280 1.00 0.00 C ATOM 7 CD GLN A 519 71.736 10.211 16.629 1.00 0.00 C ATOM 8 OE1 GLN A 519 70.747 9.528 16.895 1.00 0.00 O ATOM 9 NE2 GLN A 519 71.638 11.202 15.786 1.00 0.00 N ATOM 0 HA GLN A 519 74.808 8.130 18.025 1.00 0.00 H new ATOM 0 HB2 GLN A 519 74.321 9.776 15.516 1.00 0.00 H new ATOM 0 HB3 GLN A 519 73.389 8.328 15.838 1.00 0.00 H new ATOM 0 HG2 GLN A 519 72.929 9.335 18.195 1.00 0.00 H new ATOM 0 HG3 GLN A 519 73.573 10.838 17.564 1.00 0.00 H new ATOM 0 HE21 GLN A 519 72.458 11.767 15.566 1.00 0.00 H new ATOM 0 HE22 GLN A 519 70.741 11.411 15.347 1.00 0.00 H new ATOM 18 N PRO A 520 75.269 6.178 16.408 1.00 0.00 N ATOM 19 CA PRO A 520 75.837 4.993 15.691 1.00 0.00 C ATOM 20 C PRO A 520 75.591 5.061 14.184 1.00 0.00 C ATOM 21 O PRO A 520 76.409 4.586 13.393 1.00 0.00 O ATOM 22 CB PRO A 520 75.113 3.796 16.313 1.00 0.00 C ATOM 23 CG PRO A 520 73.832 4.342 16.843 1.00 0.00 C ATOM 24 CD PRO A 520 74.109 5.790 17.238 1.00 0.00 C ATOM 0 HA PRO A 520 76.920 4.935 15.799 1.00 0.00 H new ATOM 0 HB2 PRO A 520 74.932 3.018 15.572 1.00 0.00 H new ATOM 0 HB3 PRO A 520 75.708 3.347 17.108 1.00 0.00 H new ATOM 0 HG2 PRO A 520 73.046 4.289 16.089 1.00 0.00 H new ATOM 0 HG3 PRO A 520 73.490 3.764 17.702 1.00 0.00 H new ATOM 0 HD2 PRO A 520 73.247 6.428 17.041 1.00 0.00 H new ATOM 0 HD3 PRO A 520 74.333 5.877 18.301 1.00 0.00 H new ATOM 32 N GLY A 521 74.461 5.651 13.796 1.00 0.00 N ATOM 33 CA GLY A 521 74.115 5.770 12.383 1.00 0.00 C ATOM 34 C GLY A 521 73.234 6.990 12.136 1.00 0.00 C ATOM 35 O GLY A 521 72.729 7.601 13.079 1.00 0.00 O ATOM 0 H GLY A 521 73.775 6.051 14.436 1.00 0.00 H new ATOM 0 HA2 GLY A 521 75.025 5.848 11.788 1.00 0.00 H new ATOM 0 HA3 GLY A 521 73.595 4.870 12.055 1.00 0.00 H new ATOM 39 N THR A 522 73.053 7.337 10.862 1.00 0.00 N ATOM 40 CA THR A 522 72.231 8.488 10.496 1.00 0.00 C ATOM 41 C THR A 522 70.770 8.076 10.317 1.00 0.00 C ATOM 42 O THR A 522 69.860 8.848 10.622 1.00 0.00 O ATOM 43 CB THR A 522 72.750 9.112 9.199 1.00 0.00 C ATOM 44 OG1 THR A 522 72.702 8.147 8.159 1.00 0.00 O ATOM 45 CG2 THR A 522 74.192 9.584 9.397 1.00 0.00 C ATOM 0 H THR A 522 73.462 6.840 10.071 1.00 0.00 H new ATOM 0 HA THR A 522 72.292 9.220 11.301 1.00 0.00 H new ATOM 0 HB THR A 522 72.127 9.965 8.931 1.00 0.00 H new ATOM 0 HG1 THR A 522 73.033 8.546 7.327 1.00 0.00 H new ATOM 0 HG21 THR A 522 74.560 10.028 8.472 1.00 0.00 H new ATOM 0 HG22 THR A 522 74.226 10.326 10.194 1.00 0.00 H new ATOM 0 HG23 THR A 522 74.819 8.734 9.666 1.00 0.00 H new ATOM 53 N SER A 523 70.554 6.856 9.819 1.00 0.00 N ATOM 54 CA SER A 523 69.199 6.353 9.597 1.00 0.00 C ATOM 55 C SER A 523 68.876 5.227 10.575 1.00 0.00 C ATOM 56 O SER A 523 69.750 4.437 10.933 1.00 0.00 O ATOM 57 CB SER A 523 69.064 5.838 8.164 1.00 0.00 C ATOM 58 OG SER A 523 69.912 4.710 7.989 1.00 0.00 O ATOM 0 H SER A 523 71.295 6.203 9.564 1.00 0.00 H new ATOM 0 HA SER A 523 68.497 7.171 9.759 1.00 0.00 H new ATOM 0 HB2 SER A 523 68.029 5.565 7.959 1.00 0.00 H new ATOM 0 HB3 SER A 523 69.332 6.623 7.456 1.00 0.00 H new ATOM 0 HG SER A 523 69.367 3.898 7.925 1.00 0.00 H new ATOM 64 N ASN A 524 67.614 5.163 11.002 1.00 0.00 N ATOM 65 CA ASN A 524 67.183 4.137 11.949 1.00 0.00 C ATOM 66 C ASN A 524 67.233 2.752 11.307 1.00 0.00 C ATOM 67 O ASN A 524 67.648 1.781 11.942 1.00 0.00 O ATOM 68 CB ASN A 524 65.757 4.428 12.426 1.00 0.00 C ATOM 69 CG ASN A 524 65.425 3.576 13.648 1.00 0.00 C ATOM 70 OD1 ASN A 524 65.914 2.453 13.777 1.00 0.00 O ATOM 71 ND2 ASN A 524 64.618 4.047 14.558 1.00 0.00 N ATOM 0 H ASN A 524 66.878 5.805 10.709 1.00 0.00 H new ATOM 0 HA ASN A 524 67.862 4.153 12.801 1.00 0.00 H new ATOM 0 HB2 ASN A 524 65.657 5.485 12.673 1.00 0.00 H new ATOM 0 HB3 ASN A 524 65.048 4.219 11.625 1.00 0.00 H new ATOM 0 HD21 ASN A 524 64.391 3.485 15.378 1.00 0.00 H new ATOM 0 HD22 ASN A 524 64.214 4.977 14.449 1.00 0.00 H new ATOM 78 N GLU A 525 66.808 2.671 10.046 1.00 0.00 N ATOM 79 CA GLU A 525 66.778 1.395 9.335 1.00 0.00 C ATOM 80 C GLU A 525 68.055 1.197 8.524 1.00 0.00 C ATOM 81 O GLU A 525 68.488 2.097 7.808 1.00 0.00 O ATOM 82 CB GLU A 525 65.566 1.346 8.402 1.00 0.00 C ATOM 83 CG GLU A 525 64.281 1.464 9.224 1.00 0.00 C ATOM 84 CD GLU A 525 63.062 1.327 8.317 1.00 0.00 C ATOM 85 OE1 GLU A 525 63.095 0.489 7.430 1.00 0.00 O ATOM 86 OE2 GLU A 525 62.110 2.063 8.522 1.00 0.00 O ATOM 0 H GLU A 525 66.482 3.468 9.500 1.00 0.00 H new ATOM 0 HA GLU A 525 66.704 0.595 10.071 1.00 0.00 H new ATOM 0 HB2 GLU A 525 65.621 2.157 7.675 1.00 0.00 H new ATOM 0 HB3 GLU A 525 65.565 0.413 7.839 1.00 0.00 H new ATOM 0 HG2 GLU A 525 64.260 0.692 9.993 1.00 0.00 H new ATOM 0 HG3 GLU A 525 64.256 2.425 9.737 1.00 0.00 H new ATOM 93 N THR A 526 68.653 0.012 8.656 1.00 0.00 N ATOM 94 CA THR A 526 69.859 -0.327 7.900 1.00 0.00 C ATOM 95 C THR A 526 69.511 -0.711 6.456 1.00 0.00 C ATOM 96 O THR A 526 68.792 -1.687 6.235 1.00 0.00 O ATOM 97 CB THR A 526 70.579 -1.498 8.575 1.00 0.00 C ATOM 98 OG1 THR A 526 69.620 -2.444 9.028 1.00 0.00 O ATOM 99 CG2 THR A 526 71.393 -0.984 9.764 1.00 0.00 C ATOM 0 H THR A 526 68.323 -0.727 9.277 1.00 0.00 H new ATOM 0 HA THR A 526 70.508 0.548 7.882 1.00 0.00 H new ATOM 0 HB THR A 526 71.249 -1.974 7.859 1.00 0.00 H new ATOM 0 HG1 THR A 526 68.936 -2.572 8.338 1.00 0.00 H new ATOM 0 HG21 THR A 526 71.905 -1.819 10.243 1.00 0.00 H new ATOM 0 HG22 THR A 526 72.129 -0.260 9.415 1.00 0.00 H new ATOM 0 HG23 THR A 526 70.726 -0.507 10.482 1.00 0.00 H new ATOM 107 N PRO A 527 69.990 0.032 5.474 1.00 0.00 N ATOM 108 CA PRO A 527 69.908 -0.406 4.044 1.00 0.00 C ATOM 109 C PRO A 527 70.763 -1.646 3.782 1.00 0.00 C ATOM 110 O PRO A 527 70.424 -2.484 2.944 1.00 0.00 O ATOM 111 CB PRO A 527 70.432 0.798 3.242 1.00 0.00 C ATOM 112 CG PRO A 527 70.406 1.950 4.187 1.00 0.00 C ATOM 113 CD PRO A 527 70.627 1.358 5.572 1.00 0.00 C ATOM 0 HA PRO A 527 68.892 -0.687 3.765 1.00 0.00 H new ATOM 0 HB2 PRO A 527 71.442 0.615 2.875 1.00 0.00 H new ATOM 0 HB3 PRO A 527 69.806 0.991 2.371 1.00 0.00 H new ATOM 0 HG2 PRO A 527 71.184 2.673 3.943 1.00 0.00 H new ATOM 0 HG3 PRO A 527 69.453 2.477 4.135 1.00 0.00 H new ATOM 0 HD2 PRO A 527 71.687 1.279 5.812 1.00 0.00 H new ATOM 0 HD3 PRO A 527 70.169 1.969 6.350 1.00 0.00 H new ATOM 121 N GLU A 528 71.862 -1.768 4.530 1.00 0.00 N ATOM 122 CA GLU A 528 72.792 -2.882 4.346 1.00 0.00 C ATOM 123 C GLU A 528 72.100 -4.222 4.586 1.00 0.00 C ATOM 124 O GLU A 528 72.399 -5.212 3.914 1.00 0.00 O ATOM 125 CB GLU A 528 73.976 -2.741 5.309 1.00 0.00 C ATOM 126 CG GLU A 528 74.791 -1.495 4.948 1.00 0.00 C ATOM 127 CD GLU A 528 75.499 -1.693 3.609 1.00 0.00 C ATOM 128 OE1 GLU A 528 75.996 -2.783 3.377 1.00 0.00 O ATOM 129 OE2 GLU A 528 75.534 -0.750 2.835 1.00 0.00 O ATOM 0 H GLU A 528 72.128 -1.112 5.265 1.00 0.00 H new ATOM 0 HA GLU A 528 73.149 -2.855 3.317 1.00 0.00 H new ATOM 0 HB2 GLU A 528 73.616 -2.667 6.335 1.00 0.00 H new ATOM 0 HB3 GLU A 528 74.607 -3.628 5.256 1.00 0.00 H new ATOM 0 HG2 GLU A 528 74.135 -0.626 4.895 1.00 0.00 H new ATOM 0 HG3 GLU A 528 75.525 -1.293 5.729 1.00 0.00 H new ATOM 136 N GLU A 529 71.134 -4.238 5.508 1.00 0.00 N ATOM 137 CA GLU A 529 70.452 -5.476 5.866 1.00 0.00 C ATOM 138 C GLU A 529 69.623 -5.986 4.689 1.00 0.00 C ATOM 139 O GLU A 529 69.696 -7.163 4.328 1.00 0.00 O ATOM 140 CB GLU A 529 69.536 -5.227 7.063 1.00 0.00 C ATOM 141 CG GLU A 529 69.278 -6.547 7.797 1.00 0.00 C ATOM 142 CD GLU A 529 68.286 -6.327 8.934 1.00 0.00 C ATOM 143 OE1 GLU A 529 68.412 -5.327 9.623 1.00 0.00 O ATOM 144 OE2 GLU A 529 67.413 -7.163 9.102 1.00 0.00 O ATOM 0 H GLU A 529 70.811 -3.413 6.014 1.00 0.00 H new ATOM 0 HA GLU A 529 71.199 -6.227 6.124 1.00 0.00 H new ATOM 0 HB2 GLU A 529 69.994 -4.506 7.740 1.00 0.00 H new ATOM 0 HB3 GLU A 529 68.593 -4.795 6.728 1.00 0.00 H new ATOM 0 HG2 GLU A 529 68.887 -7.289 7.101 1.00 0.00 H new ATOM 0 HG3 GLU A 529 70.214 -6.942 8.192 1.00 0.00 H new ATOM 151 N THR A 530 68.861 -5.082 4.072 1.00 0.00 N ATOM 152 CA THR A 530 67.984 -5.451 2.961 1.00 0.00 C ATOM 153 C THR A 530 68.787 -6.027 1.797 1.00 0.00 C ATOM 154 O THR A 530 68.413 -7.050 1.224 1.00 0.00 O ATOM 155 CB THR A 530 67.203 -4.226 2.482 1.00 0.00 C ATOM 156 OG1 THR A 530 66.699 -3.519 3.606 1.00 0.00 O ATOM 157 CG2 THR A 530 66.038 -4.671 1.594 1.00 0.00 C ATOM 0 H THR A 530 68.833 -4.093 4.322 1.00 0.00 H new ATOM 0 HA THR A 530 67.291 -6.213 3.317 1.00 0.00 H new ATOM 0 HB THR A 530 67.865 -3.577 1.909 1.00 0.00 H new ATOM 0 HG1 THR A 530 66.200 -2.733 3.301 1.00 0.00 H new ATOM 0 HG21 THR A 530 65.484 -3.796 1.255 1.00 0.00 H new ATOM 0 HG22 THR A 530 66.425 -5.213 0.731 1.00 0.00 H new ATOM 0 HG23 THR A 530 65.375 -5.322 2.163 1.00 0.00 H new ATOM 165 N TYR A 531 69.906 -5.379 1.468 1.00 0.00 N ATOM 166 CA TYR A 531 70.742 -5.820 0.354 1.00 0.00 C ATOM 167 C TYR A 531 71.251 -7.248 0.570 1.00 0.00 C ATOM 168 O TYR A 531 71.159 -8.084 -0.327 1.00 0.00 O ATOM 169 CB TYR A 531 71.932 -4.871 0.178 1.00 0.00 C ATOM 170 CG TYR A 531 71.600 -3.628 -0.615 1.00 0.00 C ATOM 171 CD1 TYR A 531 70.577 -2.754 -0.173 1.00 0.00 C ATOM 172 CD2 TYR A 531 72.314 -3.338 -1.803 1.00 0.00 C ATOM 173 CE1 TYR A 531 70.269 -1.590 -0.918 1.00 0.00 C ATOM 174 CE2 TYR A 531 72.006 -2.173 -2.548 1.00 0.00 C ATOM 175 CZ TYR A 531 70.983 -1.299 -2.106 1.00 0.00 C ATOM 176 OH TYR A 531 70.683 -0.166 -2.832 1.00 0.00 O ATOM 0 H TYR A 531 70.251 -4.552 1.955 1.00 0.00 H new ATOM 0 HA TYR A 531 70.129 -5.807 -0.547 1.00 0.00 H new ATOM 0 HB2 TYR A 531 72.301 -4.578 1.161 1.00 0.00 H new ATOM 0 HB3 TYR A 531 72.741 -5.405 -0.320 1.00 0.00 H new ATOM 0 HD1 TYR A 531 70.032 -2.975 0.733 1.00 0.00 H new ATOM 0 HD2 TYR A 531 73.093 -4.005 -2.141 1.00 0.00 H new ATOM 0 HE1 TYR A 531 69.489 -0.924 -0.580 1.00 0.00 H new ATOM 0 HE2 TYR A 531 72.552 -1.951 -3.453 1.00 0.00 H new ATOM 0 HH TYR A 531 71.267 -0.117 -3.617 1.00 0.00 H new ATOM 186 N GLN A 532 71.759 -7.531 1.772 1.00 0.00 N ATOM 187 CA GLN A 532 72.287 -8.865 2.080 1.00 0.00 C ATOM 188 C GLN A 532 71.217 -9.943 1.895 1.00 0.00 C ATOM 189 O GLN A 532 71.461 -10.973 1.257 1.00 0.00 O ATOM 190 CB GLN A 532 72.810 -8.905 3.518 1.00 0.00 C ATOM 191 CG GLN A 532 74.035 -7.995 3.644 1.00 0.00 C ATOM 192 CD GLN A 532 74.523 -7.959 5.091 1.00 0.00 C ATOM 193 OE1 GLN A 532 73.741 -8.161 6.021 1.00 0.00 O ATOM 194 NE2 GLN A 532 75.780 -7.710 5.338 1.00 0.00 N ATOM 0 H GLN A 532 71.816 -6.864 2.541 1.00 0.00 H new ATOM 0 HA GLN A 532 73.104 -9.068 1.387 1.00 0.00 H new ATOM 0 HB2 GLN A 532 72.031 -8.581 4.208 1.00 0.00 H new ATOM 0 HB3 GLN A 532 73.074 -9.927 3.792 1.00 0.00 H new ATOM 0 HG2 GLN A 532 74.832 -8.355 2.993 1.00 0.00 H new ATOM 0 HG3 GLN A 532 73.783 -6.987 3.313 1.00 0.00 H new ATOM 0 HE21 GLN A 532 76.428 -7.543 4.568 1.00 0.00 H new ATOM 0 HE22 GLN A 532 76.115 -7.683 6.301 1.00 0.00 H new ATOM 203 N ARG A 533 70.007 -9.673 2.389 1.00 0.00 N ATOM 204 CA ARG A 533 68.910 -10.636 2.269 1.00 0.00 C ATOM 205 C ARG A 533 68.634 -10.944 0.799 1.00 0.00 C ATOM 206 O ARG A 533 68.671 -12.102 0.383 1.00 0.00 O ATOM 207 CB ARG A 533 67.643 -10.077 2.923 1.00 0.00 C ATOM 208 CG ARG A 533 67.868 -9.930 4.429 1.00 0.00 C ATOM 209 CD ARG A 533 66.568 -9.484 5.099 1.00 0.00 C ATOM 210 NE ARG A 533 66.805 -9.172 6.509 1.00 0.00 N ATOM 211 CZ ARG A 533 66.986 -10.125 7.434 1.00 0.00 C ATOM 212 NH1 ARG A 533 66.957 -11.398 7.117 1.00 0.00 N ATOM 213 NH2 ARG A 533 67.193 -9.780 8.675 1.00 0.00 N ATOM 0 H ARG A 533 69.763 -8.807 2.870 1.00 0.00 H new ATOM 0 HA ARG A 533 69.200 -11.556 2.777 1.00 0.00 H new ATOM 0 HB2 ARG A 533 67.392 -9.111 2.486 1.00 0.00 H new ATOM 0 HB3 ARG A 533 66.800 -10.741 2.734 1.00 0.00 H new ATOM 0 HG2 ARG A 533 68.201 -10.878 4.852 1.00 0.00 H new ATOM 0 HG3 ARG A 533 68.656 -9.202 4.620 1.00 0.00 H new ATOM 0 HD2 ARG A 533 66.169 -8.608 4.588 1.00 0.00 H new ATOM 0 HD3 ARG A 533 65.819 -10.271 5.015 1.00 0.00 H new ATOM 0 HE ARG A 533 66.833 -8.194 6.798 1.00 0.00 H new ATOM 0 HH11 ARG A 533 66.794 -11.679 6.150 1.00 0.00 H new ATOM 0 HH12 ARG A 533 67.097 -12.106 7.837 1.00 0.00 H new ATOM 0 HH21 ARG A 533 67.216 -8.793 8.933 1.00 0.00 H new ATOM 0 HH22 ARG A 533 67.332 -10.497 9.387 1.00 0.00 H new ATOM 227 N ALA A 534 68.509 -9.887 -0.003 1.00 0.00 N ATOM 228 CA ALA A 534 68.266 -10.041 -1.439 1.00 0.00 C ATOM 229 C ALA A 534 69.421 -10.785 -2.115 1.00 0.00 C ATOM 230 O ALA A 534 69.211 -11.556 -3.052 1.00 0.00 O ATOM 231 CB ALA A 534 68.107 -8.663 -2.086 1.00 0.00 C ATOM 0 H ALA A 534 68.571 -8.919 0.314 1.00 0.00 H new ATOM 0 HA ALA A 534 67.353 -10.622 -1.569 1.00 0.00 H new ATOM 0 HB1 ALA A 534 67.926 -8.781 -3.154 1.00 0.00 H new ATOM 0 HB2 ALA A 534 67.264 -8.142 -1.631 1.00 0.00 H new ATOM 0 HB3 ALA A 534 69.017 -8.083 -1.934 1.00 0.00 H new ATOM 237 N MET A 535 70.637 -10.559 -1.615 1.00 0.00 N ATOM 238 CA MET A 535 71.836 -11.149 -2.209 1.00 0.00 C ATOM 239 C MET A 535 71.789 -12.678 -2.143 1.00 0.00 C ATOM 240 O MET A 535 72.327 -13.359 -3.018 1.00 0.00 O ATOM 241 CB MET A 535 73.090 -10.630 -1.482 1.00 0.00 C ATOM 242 CG MET A 535 74.120 -10.122 -2.500 1.00 0.00 C ATOM 243 SD MET A 535 73.805 -8.375 -2.872 1.00 0.00 S ATOM 244 CE MET A 535 72.904 -8.615 -4.424 1.00 0.00 C ATOM 0 H MET A 535 70.817 -9.972 -0.801 1.00 0.00 H new ATOM 0 HA MET A 535 71.877 -10.855 -3.258 1.00 0.00 H new ATOM 0 HB2 MET A 535 72.817 -9.826 -0.798 1.00 0.00 H new ATOM 0 HB3 MET A 535 73.526 -11.427 -0.879 1.00 0.00 H new ATOM 0 HG2 MET A 535 75.128 -10.243 -2.103 1.00 0.00 H new ATOM 0 HG3 MET A 535 74.064 -10.714 -3.414 1.00 0.00 H new ATOM 0 HE1 MET A 535 73.434 -8.113 -5.234 1.00 0.00 H new ATOM 0 HE2 MET A 535 72.833 -9.680 -4.643 1.00 0.00 H new ATOM 0 HE3 MET A 535 71.902 -8.197 -4.331 1.00 0.00 H new ATOM 254 N LYS A 536 71.147 -13.211 -1.102 1.00 0.00 N ATOM 255 CA LYS A 536 70.990 -14.659 -0.971 1.00 0.00 C ATOM 256 C LYS A 536 69.965 -15.193 -1.976 1.00 0.00 C ATOM 257 O LYS A 536 69.982 -16.378 -2.313 1.00 0.00 O ATOM 258 CB LYS A 536 70.557 -15.017 0.452 1.00 0.00 C ATOM 259 CG LYS A 536 71.665 -14.635 1.434 1.00 0.00 C ATOM 260 CD LYS A 536 71.282 -15.099 2.841 1.00 0.00 C ATOM 261 CE LYS A 536 72.327 -14.606 3.844 1.00 0.00 C ATOM 262 NZ LYS A 536 71.727 -14.565 5.206 1.00 0.00 N ATOM 0 H LYS A 536 70.732 -12.668 -0.345 1.00 0.00 H new ATOM 0 HA LYS A 536 71.953 -15.124 -1.181 1.00 0.00 H new ATOM 0 HB2 LYS A 536 69.635 -14.493 0.706 1.00 0.00 H new ATOM 0 HB3 LYS A 536 70.347 -16.084 0.522 1.00 0.00 H new ATOM 0 HG2 LYS A 536 72.607 -15.093 1.132 1.00 0.00 H new ATOM 0 HG3 LYS A 536 71.818 -13.556 1.424 1.00 0.00 H new ATOM 0 HD2 LYS A 536 70.298 -14.714 3.107 1.00 0.00 H new ATOM 0 HD3 LYS A 536 71.218 -16.187 2.872 1.00 0.00 H new ATOM 0 HE2 LYS A 536 73.194 -15.267 3.837 1.00 0.00 H new ATOM 0 HE3 LYS A 536 72.680 -13.614 3.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 536 72.437 -14.230 5.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 536 70.913 -13.918 5.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 536 71.411 -15.519 5.475 1.00 0.00 H new ATOM 276 N ASP A 537 69.075 -14.319 -2.447 1.00 0.00 N ATOM 277 CA ASP A 537 68.100 -14.701 -3.463 1.00 0.00 C ATOM 278 C ASP A 537 68.745 -14.675 -4.857 1.00 0.00 C ATOM 279 O ASP A 537 69.117 -13.605 -5.342 1.00 0.00 O ATOM 280 CB ASP A 537 66.910 -13.735 -3.430 1.00 0.00 C ATOM 281 CG ASP A 537 65.761 -14.250 -4.303 1.00 0.00 C ATOM 282 OD1 ASP A 537 65.827 -15.389 -4.746 1.00 0.00 O ATOM 283 OD2 ASP A 537 64.828 -13.494 -4.518 1.00 0.00 O ATOM 0 H ASP A 537 69.011 -13.348 -2.142 1.00 0.00 H new ATOM 0 HA ASP A 537 67.753 -15.712 -3.252 1.00 0.00 H new ATOM 0 HB2 ASP A 537 66.565 -13.612 -2.403 1.00 0.00 H new ATOM 0 HB3 ASP A 537 67.225 -12.752 -3.780 1.00 0.00 H new ATOM 288 N PRO A 538 68.883 -15.816 -5.511 1.00 0.00 N ATOM 289 CA PRO A 538 69.632 -15.897 -6.810 1.00 0.00 C ATOM 290 C PRO A 538 69.051 -14.971 -7.880 1.00 0.00 C ATOM 291 O PRO A 538 69.784 -14.462 -8.731 1.00 0.00 O ATOM 292 CB PRO A 538 69.506 -17.366 -7.238 1.00 0.00 C ATOM 293 CG PRO A 538 69.118 -18.114 -6.009 1.00 0.00 C ATOM 294 CD PRO A 538 68.341 -17.137 -5.136 1.00 0.00 C ATOM 0 HA PRO A 538 70.667 -15.577 -6.688 1.00 0.00 H new ATOM 0 HB2 PRO A 538 68.756 -17.483 -8.020 1.00 0.00 H new ATOM 0 HB3 PRO A 538 70.448 -17.738 -7.642 1.00 0.00 H new ATOM 0 HG2 PRO A 538 68.507 -18.981 -6.259 1.00 0.00 H new ATOM 0 HG3 PRO A 538 69.999 -18.485 -5.486 1.00 0.00 H new ATOM 0 HD2 PRO A 538 67.269 -17.197 -5.325 1.00 0.00 H new ATOM 0 HD3 PRO A 538 68.489 -17.343 -4.076 1.00 0.00 H new ATOM 302 N GLU A 539 67.744 -14.715 -7.804 1.00 0.00 N ATOM 303 CA GLU A 539 67.086 -13.869 -8.798 1.00 0.00 C ATOM 304 C GLU A 539 67.590 -12.432 -8.685 1.00 0.00 C ATOM 305 O GLU A 539 67.807 -11.762 -9.693 1.00 0.00 O ATOM 306 CB GLU A 539 65.567 -13.898 -8.609 1.00 0.00 C ATOM 307 CG GLU A 539 65.060 -15.338 -8.733 1.00 0.00 C ATOM 308 CD GLU A 539 63.537 -15.369 -8.647 1.00 0.00 C ATOM 309 OE1 GLU A 539 62.910 -14.489 -9.215 1.00 0.00 O ATOM 310 OE2 GLU A 539 63.019 -16.274 -8.014 1.00 0.00 O ATOM 0 H GLU A 539 67.128 -15.076 -7.075 1.00 0.00 H new ATOM 0 HA GLU A 539 67.325 -14.257 -9.788 1.00 0.00 H new ATOM 0 HB2 GLU A 539 65.304 -13.492 -7.632 1.00 0.00 H new ATOM 0 HB3 GLU A 539 65.086 -13.267 -9.356 1.00 0.00 H new ATOM 0 HG2 GLU A 539 65.387 -15.766 -9.681 1.00 0.00 H new ATOM 0 HG3 GLU A 539 65.489 -15.952 -7.941 1.00 0.00 H new ATOM 317 N VAL A 540 67.865 -11.998 -7.457 1.00 0.00 N ATOM 318 CA VAL A 540 68.363 -10.644 -7.224 1.00 0.00 C ATOM 319 C VAL A 540 69.747 -10.481 -7.850 1.00 0.00 C ATOM 320 O VAL A 540 70.006 -9.509 -8.559 1.00 0.00 O ATOM 321 CB VAL A 540 68.440 -10.368 -5.716 1.00 0.00 C ATOM 322 CG1 VAL A 540 68.898 -8.928 -5.464 1.00 0.00 C ATOM 323 CG2 VAL A 540 67.060 -10.580 -5.084 1.00 0.00 C ATOM 0 H VAL A 540 67.753 -12.560 -6.613 1.00 0.00 H new ATOM 0 HA VAL A 540 67.678 -9.932 -7.684 1.00 0.00 H new ATOM 0 HB VAL A 540 69.159 -11.054 -5.269 1.00 0.00 H new ATOM 0 HG11 VAL A 540 68.949 -8.745 -4.391 1.00 0.00 H new ATOM 0 HG12 VAL A 540 69.883 -8.777 -5.905 1.00 0.00 H new ATOM 0 HG13 VAL A 540 68.188 -8.236 -5.917 1.00 0.00 H new ATOM 0 HG21 VAL A 540 67.116 -10.384 -4.013 1.00 0.00 H new ATOM 0 HG22 VAL A 540 66.342 -9.899 -5.541 1.00 0.00 H new ATOM 0 HG23 VAL A 540 66.739 -11.609 -5.248 1.00 0.00 H new ATOM 333 N ALA A 541 70.619 -11.457 -7.607 1.00 0.00 N ATOM 334 CA ALA A 541 72.003 -11.380 -8.079 1.00 0.00 C ATOM 335 C ALA A 541 72.044 -11.226 -9.599 1.00 0.00 C ATOM 336 O ALA A 541 72.724 -10.346 -10.133 1.00 0.00 O ATOM 337 CB ALA A 541 72.755 -12.653 -7.673 1.00 0.00 C ATOM 0 H ALA A 541 70.395 -12.307 -7.089 1.00 0.00 H new ATOM 0 HA ALA A 541 72.479 -10.510 -7.626 1.00 0.00 H new ATOM 0 HB1 ALA A 541 73.785 -12.595 -8.025 1.00 0.00 H new ATOM 0 HB2 ALA A 541 72.747 -12.750 -6.587 1.00 0.00 H new ATOM 0 HB3 ALA A 541 72.268 -13.521 -8.118 1.00 0.00 H new ATOM 343 N ALA A 542 71.256 -12.052 -10.280 1.00 0.00 N ATOM 344 CA ALA A 542 71.276 -12.094 -11.744 1.00 0.00 C ATOM 345 C ALA A 542 70.830 -10.763 -12.348 1.00 0.00 C ATOM 346 O ALA A 542 71.456 -10.257 -13.280 1.00 0.00 O ATOM 347 CB ALA A 542 70.360 -13.212 -12.247 1.00 0.00 C ATOM 0 H ALA A 542 70.598 -12.700 -9.847 1.00 0.00 H new ATOM 0 HA ALA A 542 72.302 -12.286 -12.057 1.00 0.00 H new ATOM 0 HB1 ALA A 542 70.380 -13.237 -13.337 1.00 0.00 H new ATOM 0 HB2 ALA A 542 70.705 -14.169 -11.856 1.00 0.00 H new ATOM 0 HB3 ALA A 542 69.341 -13.028 -11.907 1.00 0.00 H new ATOM 353 N ILE A 543 69.749 -10.200 -11.810 1.00 0.00 N ATOM 354 CA ILE A 543 69.182 -8.965 -12.356 1.00 0.00 C ATOM 355 C ILE A 543 70.133 -7.785 -12.127 1.00 0.00 C ATOM 356 O ILE A 543 70.279 -6.923 -12.995 1.00 0.00 O ATOM 357 CB ILE A 543 67.816 -8.689 -11.701 1.00 0.00 C ATOM 358 CG1 ILE A 543 66.897 -9.898 -11.907 1.00 0.00 C ATOM 359 CG2 ILE A 543 67.164 -7.461 -12.352 1.00 0.00 C ATOM 360 CD1 ILE A 543 65.639 -9.741 -11.049 1.00 0.00 C ATOM 0 H ILE A 543 69.251 -10.575 -11.003 1.00 0.00 H new ATOM 0 HA ILE A 543 69.045 -9.085 -13.431 1.00 0.00 H new ATOM 0 HB ILE A 543 67.964 -8.507 -10.637 1.00 0.00 H new ATOM 0 HG12 ILE A 543 66.623 -9.984 -12.959 1.00 0.00 H new ATOM 0 HG13 ILE A 543 67.421 -10.815 -11.638 1.00 0.00 H new ATOM 0 HG21 ILE A 543 66.198 -7.271 -11.884 1.00 0.00 H new ATOM 0 HG22 ILE A 543 67.809 -6.593 -12.218 1.00 0.00 H new ATOM 0 HG23 ILE A 543 67.021 -7.646 -13.417 1.00 0.00 H new ATOM 0 HD11 ILE A 543 64.987 -10.602 -11.198 1.00 0.00 H new ATOM 0 HD12 ILE A 543 65.921 -9.676 -9.998 1.00 0.00 H new ATOM 0 HD13 ILE A 543 65.111 -8.832 -11.340 1.00 0.00 H new ATOM 372 N MET A 544 70.776 -7.752 -10.958 1.00 0.00 N ATOM 373 CA MET A 544 71.697 -6.660 -10.622 1.00 0.00 C ATOM 374 C MET A 544 72.872 -6.612 -11.598 1.00 0.00 C ATOM 375 O MET A 544 73.361 -5.535 -11.940 1.00 0.00 O ATOM 376 CB MET A 544 72.227 -6.835 -9.199 1.00 0.00 C ATOM 377 CG MET A 544 71.141 -6.445 -8.196 1.00 0.00 C ATOM 378 SD MET A 544 71.859 -6.369 -6.537 1.00 0.00 S ATOM 379 CE MET A 544 70.674 -5.199 -5.829 1.00 0.00 C ATOM 0 H MET A 544 70.679 -8.462 -10.232 1.00 0.00 H new ATOM 0 HA MET A 544 71.144 -5.723 -10.694 1.00 0.00 H new ATOM 0 HB2 MET A 544 72.531 -7.869 -9.038 1.00 0.00 H new ATOM 0 HB3 MET A 544 73.112 -6.216 -9.051 1.00 0.00 H new ATOM 0 HG2 MET A 544 70.712 -5.479 -8.464 1.00 0.00 H new ATOM 0 HG3 MET A 544 70.329 -7.172 -8.220 1.00 0.00 H new ATOM 0 HE1 MET A 544 70.672 -5.295 -4.743 1.00 0.00 H new ATOM 0 HE2 MET A 544 70.958 -4.183 -6.103 1.00 0.00 H new ATOM 0 HE3 MET A 544 69.677 -5.413 -6.214 1.00 0.00 H new ATOM 389 N GLN A 545 73.317 -7.787 -12.039 1.00 0.00 N ATOM 390 CA GLN A 545 74.388 -7.870 -13.031 1.00 0.00 C ATOM 391 C GLN A 545 73.864 -7.713 -14.466 1.00 0.00 C ATOM 392 O GLN A 545 74.633 -7.825 -15.422 1.00 0.00 O ATOM 393 CB GLN A 545 75.106 -9.213 -12.904 1.00 0.00 C ATOM 394 CG GLN A 545 76.172 -9.127 -11.809 1.00 0.00 C ATOM 395 CD GLN A 545 76.944 -10.440 -11.731 1.00 0.00 C ATOM 396 OE1 GLN A 545 77.861 -10.670 -12.519 1.00 0.00 O ATOM 397 NE2 GLN A 545 76.626 -11.320 -10.821 1.00 0.00 N ATOM 0 H GLN A 545 72.956 -8.689 -11.728 1.00 0.00 H new ATOM 0 HA GLN A 545 75.077 -7.049 -12.834 1.00 0.00 H new ATOM 0 HB2 GLN A 545 74.389 -9.999 -12.666 1.00 0.00 H new ATOM 0 HB3 GLN A 545 75.568 -9.481 -13.854 1.00 0.00 H new ATOM 0 HG2 GLN A 545 76.856 -8.305 -12.019 1.00 0.00 H new ATOM 0 HG3 GLN A 545 75.703 -8.913 -10.849 1.00 0.00 H new ATOM 0 HE21 GLN A 545 75.866 -11.127 -10.169 1.00 0.00 H new ATOM 0 HE22 GLN A 545 77.138 -12.200 -10.762 1.00 0.00 H new ATOM 406 N ASP A 546 72.567 -7.456 -14.613 1.00 0.00 N ATOM 407 CA ASP A 546 71.961 -7.291 -15.932 1.00 0.00 C ATOM 408 C ASP A 546 71.761 -5.793 -16.224 1.00 0.00 C ATOM 409 O ASP A 546 71.149 -5.085 -15.423 1.00 0.00 O ATOM 410 CB ASP A 546 70.602 -8.012 -15.947 1.00 0.00 C ATOM 411 CG ASP A 546 70.255 -8.537 -17.345 1.00 0.00 C ATOM 412 OD1 ASP A 546 71.114 -8.513 -18.210 1.00 0.00 O ATOM 413 OD2 ASP A 546 69.126 -8.957 -17.527 1.00 0.00 O ATOM 0 H ASP A 546 71.915 -7.357 -13.835 1.00 0.00 H new ATOM 0 HA ASP A 546 72.611 -7.717 -16.696 1.00 0.00 H new ATOM 0 HB2 ASP A 546 70.623 -8.842 -15.241 1.00 0.00 H new ATOM 0 HB3 ASP A 546 69.823 -7.327 -15.611 1.00 0.00 H new ATOM 418 N PRO A 547 72.249 -5.298 -17.347 1.00 0.00 N ATOM 419 CA PRO A 547 72.366 -3.822 -17.578 1.00 0.00 C ATOM 420 C PRO A 547 71.013 -3.135 -17.807 1.00 0.00 C ATOM 421 O PRO A 547 70.920 -1.905 -17.762 1.00 0.00 O ATOM 422 CB PRO A 547 73.254 -3.720 -18.815 1.00 0.00 C ATOM 423 CG PRO A 547 72.986 -4.964 -19.588 1.00 0.00 C ATOM 424 CD PRO A 547 72.618 -6.045 -18.570 1.00 0.00 C ATOM 0 HA PRO A 547 72.775 -3.313 -16.706 1.00 0.00 H new ATOM 0 HB2 PRO A 547 73.014 -2.833 -19.401 1.00 0.00 H new ATOM 0 HB3 PRO A 547 74.306 -3.646 -18.540 1.00 0.00 H new ATOM 0 HG2 PRO A 547 72.174 -4.810 -20.299 1.00 0.00 H new ATOM 0 HG3 PRO A 547 73.863 -5.258 -20.164 1.00 0.00 H new ATOM 0 HD2 PRO A 547 71.789 -6.658 -18.925 1.00 0.00 H new ATOM 0 HD3 PRO A 547 73.456 -6.717 -18.386 1.00 0.00 H new ATOM 432 N VAL A 548 69.963 -3.927 -18.050 1.00 0.00 N ATOM 433 CA VAL A 548 68.665 -3.376 -18.456 1.00 0.00 C ATOM 434 C VAL A 548 68.167 -2.342 -17.441 1.00 0.00 C ATOM 435 O VAL A 548 67.758 -1.245 -17.817 1.00 0.00 O ATOM 436 CB VAL A 548 67.640 -4.518 -18.601 1.00 0.00 C ATOM 437 CG1 VAL A 548 66.231 -3.958 -18.846 1.00 0.00 C ATOM 438 CG2 VAL A 548 68.041 -5.406 -19.782 1.00 0.00 C ATOM 0 H VAL A 548 69.985 -4.944 -17.973 1.00 0.00 H new ATOM 0 HA VAL A 548 68.785 -2.874 -19.416 1.00 0.00 H new ATOM 0 HB VAL A 548 67.630 -5.098 -17.678 1.00 0.00 H new ATOM 0 HG11 VAL A 548 65.524 -4.782 -18.945 1.00 0.00 H new ATOM 0 HG12 VAL A 548 65.939 -3.328 -18.006 1.00 0.00 H new ATOM 0 HG13 VAL A 548 66.229 -3.366 -19.761 1.00 0.00 H new ATOM 0 HG21 VAL A 548 67.320 -6.216 -19.890 1.00 0.00 H new ATOM 0 HG22 VAL A 548 68.058 -4.811 -20.695 1.00 0.00 H new ATOM 0 HG23 VAL A 548 69.032 -5.824 -19.603 1.00 0.00 H new ATOM 448 N MET A 549 68.257 -2.670 -16.158 1.00 0.00 N ATOM 449 CA MET A 549 67.666 -1.822 -15.124 1.00 0.00 C ATOM 450 C MET A 549 68.326 -0.447 -15.090 1.00 0.00 C ATOM 451 O MET A 549 67.653 0.563 -14.880 1.00 0.00 O ATOM 452 CB MET A 549 67.789 -2.485 -13.758 1.00 0.00 C ATOM 453 CG MET A 549 66.858 -3.690 -13.704 1.00 0.00 C ATOM 454 SD MET A 549 66.779 -4.297 -12.007 1.00 0.00 S ATOM 455 CE MET A 549 65.126 -3.676 -11.614 1.00 0.00 C ATOM 0 H MET A 549 68.727 -3.505 -15.809 1.00 0.00 H new ATOM 0 HA MET A 549 66.612 -1.691 -15.367 1.00 0.00 H new ATOM 0 HB2 MET A 549 68.819 -2.797 -13.583 1.00 0.00 H new ATOM 0 HB3 MET A 549 67.532 -1.776 -12.971 1.00 0.00 H new ATOM 0 HG2 MET A 549 65.863 -3.412 -14.051 1.00 0.00 H new ATOM 0 HG3 MET A 549 67.220 -4.475 -14.368 1.00 0.00 H new ATOM 0 HE1 MET A 549 64.849 -3.991 -10.608 1.00 0.00 H new ATOM 0 HE2 MET A 549 65.124 -2.587 -11.667 1.00 0.00 H new ATOM 0 HE3 MET A 549 64.408 -4.075 -12.330 1.00 0.00 H new ATOM 465 N GLN A 550 69.638 -0.405 -15.328 1.00 0.00 N ATOM 466 CA GLN A 550 70.354 0.871 -15.384 1.00 0.00 C ATOM 467 C GLN A 550 69.771 1.766 -16.479 1.00 0.00 C ATOM 468 O GLN A 550 69.528 2.953 -16.259 1.00 0.00 O ATOM 469 CB GLN A 550 71.840 0.625 -15.663 1.00 0.00 C ATOM 470 CG GLN A 550 72.631 1.909 -15.399 1.00 0.00 C ATOM 471 CD GLN A 550 74.117 1.674 -15.660 1.00 0.00 C ATOM 472 OE1 GLN A 550 74.619 0.566 -15.465 1.00 0.00 O ATOM 473 NE2 GLN A 550 74.856 2.659 -16.093 1.00 0.00 N ATOM 0 H GLN A 550 70.220 -1.228 -15.483 1.00 0.00 H new ATOM 0 HA GLN A 550 70.242 1.371 -14.422 1.00 0.00 H new ATOM 0 HB2 GLN A 550 72.211 -0.180 -15.029 1.00 0.00 H new ATOM 0 HB3 GLN A 550 71.979 0.306 -16.696 1.00 0.00 H new ATOM 0 HG2 GLN A 550 72.264 2.710 -16.041 1.00 0.00 H new ATOM 0 HG3 GLN A 550 72.482 2.232 -14.369 1.00 0.00 H new ATOM 0 HE21 GLN A 550 74.440 3.576 -16.254 1.00 0.00 H new ATOM 0 HE22 GLN A 550 75.850 2.512 -16.270 1.00 0.00 H new ATOM 482 N SER A 551 69.522 1.175 -17.648 1.00 0.00 N ATOM 483 CA SER A 551 68.958 1.923 -18.772 1.00 0.00 C ATOM 484 C SER A 551 67.568 2.477 -18.440 1.00 0.00 C ATOM 485 O SER A 551 67.247 3.604 -18.816 1.00 0.00 O ATOM 486 CB SER A 551 68.883 1.037 -20.021 1.00 0.00 C ATOM 487 OG SER A 551 67.782 0.144 -19.912 1.00 0.00 O ATOM 0 H SER A 551 69.700 0.189 -17.841 1.00 0.00 H new ATOM 0 HA SER A 551 69.619 2.767 -18.969 1.00 0.00 H new ATOM 0 HB2 SER A 551 68.774 1.656 -20.911 1.00 0.00 H new ATOM 0 HB3 SER A 551 69.810 0.474 -20.135 1.00 0.00 H new ATOM 0 HG SER A 551 68.009 -0.581 -19.293 1.00 0.00 H new ATOM 493 N ILE A 552 66.756 1.705 -17.711 1.00 0.00 N ATOM 494 CA ILE A 552 65.404 2.152 -17.348 1.00 0.00 C ATOM 495 C ILE A 552 65.472 3.411 -16.484 1.00 0.00 C ATOM 496 O ILE A 552 64.779 4.392 -16.749 1.00 0.00 O ATOM 497 CB ILE A 552 64.653 1.042 -16.584 1.00 0.00 C ATOM 498 CG1 ILE A 552 64.675 -0.256 -17.402 1.00 0.00 C ATOM 499 CG2 ILE A 552 63.188 1.465 -16.342 1.00 0.00 C ATOM 500 CD1 ILE A 552 64.153 -1.413 -16.547 1.00 0.00 C ATOM 0 H ILE A 552 67.005 0.779 -17.364 1.00 0.00 H new ATOM 0 HA ILE A 552 64.864 2.378 -18.267 1.00 0.00 H new ATOM 0 HB ILE A 552 65.145 0.880 -15.625 1.00 0.00 H new ATOM 0 HG12 ILE A 552 64.060 -0.145 -18.295 1.00 0.00 H new ATOM 0 HG13 ILE A 552 65.690 -0.468 -17.738 1.00 0.00 H new ATOM 0 HG21 ILE A 552 62.666 0.675 -15.802 1.00 0.00 H new ATOM 0 HG22 ILE A 552 63.167 2.382 -15.754 1.00 0.00 H new ATOM 0 HG23 ILE A 552 62.696 1.637 -17.299 1.00 0.00 H new ATOM 0 HD11 ILE A 552 64.170 -2.333 -17.131 1.00 0.00 H new ATOM 0 HD12 ILE A 552 64.786 -1.530 -15.667 1.00 0.00 H new ATOM 0 HD13 ILE A 552 63.131 -1.201 -16.233 1.00 0.00 H new ATOM 512 N LEU A 553 66.328 3.381 -15.463 1.00 0.00 N ATOM 513 CA LEU A 553 66.464 4.517 -14.544 1.00 0.00 C ATOM 514 C LEU A 553 66.856 5.792 -15.294 1.00 0.00 C ATOM 515 O LEU A 553 66.190 6.824 -15.172 1.00 0.00 O ATOM 516 CB LEU A 553 67.520 4.206 -13.480 1.00 0.00 C ATOM 517 CG LEU A 553 67.074 3.002 -12.646 1.00 0.00 C ATOM 518 CD1 LEU A 553 68.231 2.542 -11.757 1.00 0.00 C ATOM 519 CD2 LEU A 553 65.886 3.399 -11.765 1.00 0.00 C ATOM 0 H LEU A 553 66.935 2.590 -15.250 1.00 0.00 H new ATOM 0 HA LEU A 553 65.498 4.680 -14.067 1.00 0.00 H new ATOM 0 HB2 LEU A 553 68.478 3.996 -13.955 1.00 0.00 H new ATOM 0 HB3 LEU A 553 67.667 5.073 -12.835 1.00 0.00 H new ATOM 0 HG LEU A 553 66.778 2.191 -13.312 1.00 0.00 H new ATOM 0 HD11 LEU A 553 67.915 1.685 -11.163 1.00 0.00 H new ATOM 0 HD12 LEU A 553 69.079 2.258 -12.381 1.00 0.00 H new ATOM 0 HD13 LEU A 553 68.525 3.355 -11.093 1.00 0.00 H new ATOM 0 HD21 LEU A 553 65.570 2.541 -11.172 1.00 0.00 H new ATOM 0 HD22 LEU A 553 66.181 4.211 -11.100 1.00 0.00 H new ATOM 0 HD23 LEU A 553 65.060 3.729 -12.395 1.00 0.00 H new ATOM 531 N GLN A 554 67.900 5.701 -16.118 1.00 0.00 N ATOM 532 CA GLN A 554 68.365 6.858 -16.887 1.00 0.00 C ATOM 533 C GLN A 554 67.240 7.414 -17.762 1.00 0.00 C ATOM 534 O GLN A 554 66.881 8.587 -17.656 1.00 0.00 O ATOM 535 CB GLN A 554 69.551 6.458 -17.769 1.00 0.00 C ATOM 536 CG GLN A 554 70.232 7.714 -18.317 1.00 0.00 C ATOM 537 CD GLN A 554 71.331 7.326 -19.300 1.00 0.00 C ATOM 538 OE1 GLN A 554 71.054 6.720 -20.336 1.00 0.00 O ATOM 539 NE2 GLN A 554 72.570 7.639 -19.036 1.00 0.00 N ATOM 0 H GLN A 554 68.436 4.847 -16.270 1.00 0.00 H new ATOM 0 HA GLN A 554 68.678 7.632 -16.186 1.00 0.00 H new ATOM 0 HB2 GLN A 554 70.263 5.869 -17.192 1.00 0.00 H new ATOM 0 HB3 GLN A 554 69.209 5.829 -18.591 1.00 0.00 H new ATOM 0 HG2 GLN A 554 69.497 8.349 -18.812 1.00 0.00 H new ATOM 0 HG3 GLN A 554 70.655 8.295 -17.497 1.00 0.00 H new ATOM 0 HE21 GLN A 554 72.797 8.141 -18.178 1.00 0.00 H new ATOM 0 HE22 GLN A 554 73.311 7.382 -19.688 1.00 0.00 H new ATOM 548 N GLN A 555 66.595 6.529 -18.523 1.00 0.00 N ATOM 549 CA GLN A 555 65.559 6.944 -19.469 1.00 0.00 C ATOM 550 C GLN A 555 64.407 7.651 -18.756 1.00 0.00 C ATOM 551 O GLN A 555 63.847 8.614 -19.278 1.00 0.00 O ATOM 552 CB GLN A 555 65.022 5.723 -20.219 1.00 0.00 C ATOM 553 CG GLN A 555 66.082 5.219 -21.200 1.00 0.00 C ATOM 554 CD GLN A 555 65.558 4.003 -21.959 1.00 0.00 C ATOM 555 OE1 GLN A 555 64.368 3.924 -22.265 1.00 0.00 O ATOM 556 NE2 GLN A 555 66.382 3.043 -22.281 1.00 0.00 N ATOM 0 H GLN A 555 66.771 5.524 -18.503 1.00 0.00 H new ATOM 0 HA GLN A 555 66.008 7.644 -20.174 1.00 0.00 H new ATOM 0 HB2 GLN A 555 64.761 4.935 -19.513 1.00 0.00 H new ATOM 0 HB3 GLN A 555 64.110 5.985 -20.756 1.00 0.00 H new ATOM 0 HG2 GLN A 555 66.344 6.010 -21.902 1.00 0.00 H new ATOM 0 HG3 GLN A 555 66.992 4.956 -20.661 1.00 0.00 H new ATOM 0 HE21 GLN A 555 67.368 3.110 -22.027 1.00 0.00 H new ATOM 0 HE22 GLN A 555 66.040 2.226 -22.787 1.00 0.00 H new ATOM 565 N ALA A 556 64.050 7.158 -17.569 1.00 0.00 N ATOM 566 CA ALA A 556 62.949 7.739 -16.799 1.00 0.00 C ATOM 567 C ALA A 556 63.258 9.175 -16.381 1.00 0.00 C ATOM 568 O ALA A 556 62.356 10.012 -16.317 1.00 0.00 O ATOM 569 CB ALA A 556 62.677 6.895 -15.552 1.00 0.00 C ATOM 0 H ALA A 556 64.504 6.362 -17.122 1.00 0.00 H new ATOM 0 HA ALA A 556 62.066 7.748 -17.438 1.00 0.00 H new ATOM 0 HB1 ALA A 556 61.856 7.336 -14.986 1.00 0.00 H new ATOM 0 HB2 ALA A 556 62.409 5.881 -15.850 1.00 0.00 H new ATOM 0 HB3 ALA A 556 63.572 6.866 -14.930 1.00 0.00 H new ATOM 575 N GLN A 557 64.531 9.458 -16.099 1.00 0.00 N ATOM 576 CA GLN A 557 64.933 10.807 -15.697 1.00 0.00 C ATOM 577 C GLN A 557 64.732 11.781 -16.856 1.00 0.00 C ATOM 578 O GLN A 557 64.222 12.886 -16.672 1.00 0.00 O ATOM 579 CB GLN A 557 66.407 10.809 -15.276 1.00 0.00 C ATOM 580 CG GLN A 557 66.740 12.129 -14.577 1.00 0.00 C ATOM 581 CD GLN A 557 66.095 12.165 -13.195 1.00 0.00 C ATOM 582 OE1 GLN A 557 66.219 11.210 -12.427 1.00 0.00 O ATOM 583 NE2 GLN A 557 65.410 13.214 -12.831 1.00 0.00 N ATOM 0 H GLN A 557 65.293 8.781 -16.141 1.00 0.00 H new ATOM 0 HA GLN A 557 64.317 11.121 -14.855 1.00 0.00 H new ATOM 0 HB2 GLN A 557 66.606 9.972 -14.607 1.00 0.00 H new ATOM 0 HB3 GLN A 557 67.045 10.677 -16.150 1.00 0.00 H new ATOM 0 HG2 GLN A 557 67.821 12.239 -14.486 1.00 0.00 H new ATOM 0 HG3 GLN A 557 66.383 12.967 -15.176 1.00 0.00 H new ATOM 0 HE21 GLN A 557 65.309 14.004 -13.469 1.00 0.00 H new ATOM 0 HE22 GLN A 557 64.976 13.245 -11.909 1.00 0.00 H new ATOM 592 N GLN A 558 65.142 11.350 -18.048 1.00 0.00 N ATOM 593 CA GLN A 558 64.928 12.138 -19.259 1.00 0.00 C ATOM 594 C GLN A 558 63.459 12.097 -19.692 1.00 0.00 C ATOM 595 O GLN A 558 62.965 13.038 -20.313 1.00 0.00 O ATOM 596 CB GLN A 558 65.808 11.604 -20.392 1.00 0.00 C ATOM 597 CG GLN A 558 67.282 11.778 -20.018 1.00 0.00 C ATOM 598 CD GLN A 558 68.171 11.306 -21.164 1.00 0.00 C ATOM 599 OE1 GLN A 558 67.830 11.489 -22.332 1.00 0.00 O ATOM 600 NE2 GLN A 558 69.299 10.706 -20.896 1.00 0.00 N ATOM 0 H GLN A 558 65.622 10.463 -18.200 1.00 0.00 H new ATOM 0 HA GLN A 558 65.196 13.172 -19.040 1.00 0.00 H new ATOM 0 HB2 GLN A 558 65.589 10.551 -20.572 1.00 0.00 H new ATOM 0 HB3 GLN A 558 65.591 12.137 -21.318 1.00 0.00 H new ATOM 0 HG2 GLN A 558 67.488 12.825 -19.795 1.00 0.00 H new ATOM 0 HG3 GLN A 558 67.506 11.210 -19.115 1.00 0.00 H new ATOM 0 HE21 GLN A 558 69.579 10.556 -19.927 1.00 0.00 H new ATOM 0 HE22 GLN A 558 69.900 10.388 -21.656 1.00 0.00 H new ATOM 609 N ASN A 559 62.767 11.004 -19.359 1.00 0.00 N ATOM 610 CA ASN A 559 61.386 10.813 -19.790 1.00 0.00 C ATOM 611 C ASN A 559 60.710 9.728 -18.939 1.00 0.00 C ATOM 612 O ASN A 559 60.852 8.538 -19.225 1.00 0.00 O ATOM 613 CB ASN A 559 61.359 10.400 -21.263 1.00 0.00 C ATOM 614 CG ASN A 559 60.021 10.782 -21.890 1.00 0.00 C ATOM 615 OD1 ASN A 559 59.337 9.932 -22.458 1.00 0.00 O ATOM 616 ND2 ASN A 559 59.608 12.018 -21.819 1.00 0.00 N ATOM 0 H ASN A 559 63.142 10.242 -18.794 1.00 0.00 H new ATOM 0 HA ASN A 559 60.844 11.751 -19.664 1.00 0.00 H new ATOM 0 HB2 ASN A 559 62.173 10.886 -21.800 1.00 0.00 H new ATOM 0 HB3 ASN A 559 61.517 9.325 -21.350 1.00 0.00 H new ATOM 0 HD21 ASN A 559 58.715 12.282 -22.235 1.00 0.00 H new ATOM 0 HD22 ASN A 559 60.178 12.720 -21.347 1.00 0.00 H new ATOM 623 N PRO A 560 59.979 10.109 -17.911 1.00 0.00 N ATOM 624 CA PRO A 560 59.553 9.143 -16.845 1.00 0.00 C ATOM 625 C PRO A 560 58.630 8.035 -17.369 1.00 0.00 C ATOM 626 O PRO A 560 58.474 7.001 -16.721 1.00 0.00 O ATOM 627 CB PRO A 560 58.827 10.017 -15.817 1.00 0.00 C ATOM 628 CG PRO A 560 58.373 11.220 -16.569 1.00 0.00 C ATOM 629 CD PRO A 560 59.401 11.448 -17.674 1.00 0.00 C ATOM 0 HA PRO A 560 60.410 8.610 -16.432 1.00 0.00 H new ATOM 0 HB2 PRO A 560 57.982 9.487 -15.378 1.00 0.00 H new ATOM 0 HB3 PRO A 560 59.491 10.293 -14.998 1.00 0.00 H new ATOM 0 HG2 PRO A 560 57.379 11.064 -16.989 1.00 0.00 H new ATOM 0 HG3 PRO A 560 58.309 12.088 -15.912 1.00 0.00 H new ATOM 0 HD2 PRO A 560 58.935 11.846 -18.575 1.00 0.00 H new ATOM 0 HD3 PRO A 560 60.164 12.163 -17.367 1.00 0.00 H new ATOM 637 N ALA A 561 58.026 8.255 -18.538 1.00 0.00 N ATOM 638 CA ALA A 561 57.062 7.298 -19.084 1.00 0.00 C ATOM 639 C ALA A 561 57.734 5.969 -19.430 1.00 0.00 C ATOM 640 O ALA A 561 57.123 4.904 -19.303 1.00 0.00 O ATOM 641 CB ALA A 561 56.396 7.877 -20.335 1.00 0.00 C ATOM 0 H ALA A 561 58.185 9.078 -19.120 1.00 0.00 H new ATOM 0 HA ALA A 561 56.307 7.113 -18.320 1.00 0.00 H new ATOM 0 HB1 ALA A 561 55.681 7.157 -20.733 1.00 0.00 H new ATOM 0 HB2 ALA A 561 55.876 8.800 -20.077 1.00 0.00 H new ATOM 0 HB3 ALA A 561 57.156 8.087 -21.088 1.00 0.00 H new ATOM 647 N ALA A 562 58.994 6.031 -19.864 1.00 0.00 N ATOM 648 CA ALA A 562 59.734 4.821 -20.239 1.00 0.00 C ATOM 649 C ALA A 562 59.769 3.802 -19.098 1.00 0.00 C ATOM 650 O ALA A 562 59.708 2.594 -19.335 1.00 0.00 O ATOM 651 CB ALA A 562 61.167 5.189 -20.633 1.00 0.00 C ATOM 0 H ALA A 562 59.522 6.898 -19.965 1.00 0.00 H new ATOM 0 HA ALA A 562 59.217 4.367 -21.085 1.00 0.00 H new ATOM 0 HB1 ALA A 562 61.711 4.286 -20.910 1.00 0.00 H new ATOM 0 HB2 ALA A 562 61.147 5.875 -21.480 1.00 0.00 H new ATOM 0 HB3 ALA A 562 61.665 5.668 -19.790 1.00 0.00 H new ATOM 657 N LEU A 563 59.818 4.287 -17.859 1.00 0.00 N ATOM 658 CA LEU A 563 59.945 3.390 -16.713 1.00 0.00 C ATOM 659 C LEU A 563 58.659 2.567 -16.556 1.00 0.00 C ATOM 660 O LEU A 563 58.700 1.377 -16.235 1.00 0.00 O ATOM 661 CB LEU A 563 60.307 4.220 -15.447 1.00 0.00 C ATOM 662 CG LEU A 563 59.082 4.721 -14.648 1.00 0.00 C ATOM 663 CD1 LEU A 563 58.372 3.552 -13.939 1.00 0.00 C ATOM 664 CD2 LEU A 563 59.555 5.743 -13.610 1.00 0.00 C ATOM 0 H LEU A 563 59.773 5.279 -17.625 1.00 0.00 H new ATOM 0 HA LEU A 563 60.754 2.676 -16.866 1.00 0.00 H new ATOM 0 HB2 LEU A 563 60.930 3.610 -14.792 1.00 0.00 H new ATOM 0 HB3 LEU A 563 60.907 5.079 -15.748 1.00 0.00 H new ATOM 0 HG LEU A 563 58.373 5.181 -15.336 1.00 0.00 H new ATOM 0 HD11 LEU A 563 57.514 3.931 -13.384 1.00 0.00 H new ATOM 0 HD12 LEU A 563 58.034 2.828 -14.680 1.00 0.00 H new ATOM 0 HD13 LEU A 563 59.065 3.069 -13.250 1.00 0.00 H new ATOM 0 HD21 LEU A 563 58.700 6.104 -13.039 1.00 0.00 H new ATOM 0 HD22 LEU A 563 60.269 5.272 -12.935 1.00 0.00 H new ATOM 0 HD23 LEU A 563 60.034 6.581 -14.116 1.00 0.00 H new ATOM 676 N GLN A 564 57.518 3.212 -16.813 1.00 0.00 N ATOM 677 CA GLN A 564 56.222 2.540 -16.709 1.00 0.00 C ATOM 678 C GLN A 564 56.132 1.375 -17.694 1.00 0.00 C ATOM 679 O GLN A 564 55.961 0.225 -17.286 1.00 0.00 O ATOM 680 CB GLN A 564 55.093 3.534 -16.994 1.00 0.00 C ATOM 681 CG GLN A 564 55.077 4.614 -15.909 1.00 0.00 C ATOM 682 CD GLN A 564 53.984 5.637 -16.205 1.00 0.00 C ATOM 683 OE1 GLN A 564 53.716 5.944 -17.367 1.00 0.00 O ATOM 684 NE2 GLN A 564 53.334 6.186 -15.217 1.00 0.00 N ATOM 0 H GLN A 564 57.466 4.192 -17.093 1.00 0.00 H new ATOM 0 HA GLN A 564 56.122 2.151 -15.696 1.00 0.00 H new ATOM 0 HB2 GLN A 564 55.234 3.990 -17.974 1.00 0.00 H new ATOM 0 HB3 GLN A 564 54.135 3.015 -17.019 1.00 0.00 H new ATOM 0 HG2 GLN A 564 54.905 4.158 -14.934 1.00 0.00 H new ATOM 0 HG3 GLN A 564 56.047 5.109 -15.863 1.00 0.00 H new ATOM 0 HE21 GLN A 564 53.557 5.931 -14.255 1.00 0.00 H new ATOM 0 HE22 GLN A 564 52.602 6.871 -15.406 1.00 0.00 H new ATOM 693 N GLU A 565 56.399 1.655 -18.971 1.00 0.00 N ATOM 694 CA GLU A 565 56.308 0.622 -20.010 1.00 0.00 C ATOM 695 C GLU A 565 57.276 -0.533 -19.733 1.00 0.00 C ATOM 696 O GLU A 565 57.029 -1.670 -20.139 1.00 0.00 O ATOM 697 CB GLU A 565 56.597 1.229 -21.388 1.00 0.00 C ATOM 698 CG GLU A 565 57.987 1.872 -21.405 1.00 0.00 C ATOM 699 CD GLU A 565 58.380 2.227 -22.834 1.00 0.00 C ATOM 700 OE1 GLU A 565 58.624 1.313 -23.605 1.00 0.00 O ATOM 701 OE2 GLU A 565 58.430 3.407 -23.137 1.00 0.00 O ATOM 0 H GLU A 565 56.677 2.576 -19.310 1.00 0.00 H new ATOM 0 HA GLU A 565 55.293 0.224 -19.998 1.00 0.00 H new ATOM 0 HB2 GLU A 565 56.537 0.455 -22.153 1.00 0.00 H new ATOM 0 HB3 GLU A 565 55.841 1.976 -21.630 1.00 0.00 H new ATOM 0 HG2 GLU A 565 57.990 2.769 -20.785 1.00 0.00 H new ATOM 0 HG3 GLU A 565 58.719 1.187 -20.977 1.00 0.00 H new ATOM 708 N HIS A 566 58.375 -0.229 -19.042 1.00 0.00 N ATOM 709 CA HIS A 566 59.337 -1.259 -18.650 1.00 0.00 C ATOM 710 C HIS A 566 58.700 -2.259 -17.685 1.00 0.00 C ATOM 711 O HIS A 566 58.816 -3.469 -17.873 1.00 0.00 O ATOM 712 CB HIS A 566 60.563 -0.619 -17.998 1.00 0.00 C ATOM 713 CG HIS A 566 61.591 -0.166 -18.998 1.00 0.00 C ATOM 714 ND1 HIS A 566 61.990 1.157 -19.101 1.00 0.00 N ATOM 715 CD2 HIS A 566 62.298 -0.847 -19.958 1.00 0.00 C ATOM 716 CE1 HIS A 566 62.900 1.230 -20.090 1.00 0.00 C ATOM 717 NE2 HIS A 566 63.124 0.037 -20.646 1.00 0.00 N ATOM 0 H HIS A 566 58.620 0.715 -18.744 1.00 0.00 H new ATOM 0 HA HIS A 566 59.647 -1.792 -19.549 1.00 0.00 H new ATOM 0 HB2 HIS A 566 60.245 0.235 -17.400 1.00 0.00 H new ATOM 0 HB3 HIS A 566 61.020 -1.335 -17.315 1.00 0.00 H new ATOM 0 HD2 HIS A 566 62.224 -1.907 -20.150 1.00 0.00 H new ATOM 0 HE1 HIS A 566 63.389 2.143 -20.397 1.00 0.00 H new ATOM 0 HE2 HIS A 566 63.763 -0.180 -21.411 1.00 0.00 H new ATOM 725 N MET A 567 57.975 -1.751 -16.689 1.00 0.00 N ATOM 726 CA MET A 567 57.319 -2.622 -15.712 1.00 0.00 C ATOM 727 C MET A 567 56.277 -3.507 -16.397 1.00 0.00 C ATOM 728 O MET A 567 56.117 -4.675 -16.042 1.00 0.00 O ATOM 729 CB MET A 567 56.640 -1.777 -14.628 1.00 0.00 C ATOM 730 CG MET A 567 56.247 -2.672 -13.452 1.00 0.00 C ATOM 731 SD MET A 567 55.269 -1.715 -12.267 1.00 0.00 S ATOM 732 CE MET A 567 56.553 -0.519 -11.825 1.00 0.00 C ATOM 0 H MET A 567 57.827 -0.753 -16.537 1.00 0.00 H new ATOM 0 HA MET A 567 58.077 -3.258 -15.255 1.00 0.00 H new ATOM 0 HB2 MET A 567 57.315 -0.990 -14.290 1.00 0.00 H new ATOM 0 HB3 MET A 567 55.756 -1.286 -15.036 1.00 0.00 H new ATOM 0 HG2 MET A 567 55.672 -3.527 -13.808 1.00 0.00 H new ATOM 0 HG3 MET A 567 57.140 -3.068 -12.968 1.00 0.00 H new ATOM 0 HE1 MET A 567 56.373 -0.148 -10.816 1.00 0.00 H new ATOM 0 HE2 MET A 567 57.529 -1.002 -11.865 1.00 0.00 H new ATOM 0 HE3 MET A 567 56.531 0.314 -12.527 1.00 0.00 H new ATOM 742 N LYS A 568 55.592 -2.953 -17.397 1.00 0.00 N ATOM 743 CA LYS A 568 54.604 -3.719 -18.158 1.00 0.00 C ATOM 744 C LYS A 568 55.294 -4.743 -19.062 1.00 0.00 C ATOM 745 O LYS A 568 54.770 -5.835 -19.284 1.00 0.00 O ATOM 746 CB LYS A 568 53.748 -2.777 -19.006 1.00 0.00 C ATOM 747 CG LYS A 568 52.940 -1.855 -18.089 1.00 0.00 C ATOM 748 CD LYS A 568 52.001 -0.992 -18.933 1.00 0.00 C ATOM 749 CE LYS A 568 51.288 0.018 -18.032 1.00 0.00 C ATOM 750 NZ LYS A 568 50.116 -0.635 -17.383 1.00 0.00 N ATOM 0 H LYS A 568 55.701 -1.984 -17.698 1.00 0.00 H new ATOM 0 HA LYS A 568 53.965 -4.250 -17.452 1.00 0.00 H new ATOM 0 HB2 LYS A 568 54.383 -2.186 -19.665 1.00 0.00 H new ATOM 0 HB3 LYS A 568 53.077 -3.353 -19.643 1.00 0.00 H new ATOM 0 HG2 LYS A 568 52.365 -2.446 -17.376 1.00 0.00 H new ATOM 0 HG3 LYS A 568 53.611 -1.221 -17.510 1.00 0.00 H new ATOM 0 HD2 LYS A 568 52.566 -0.471 -19.706 1.00 0.00 H new ATOM 0 HD3 LYS A 568 51.270 -1.621 -19.441 1.00 0.00 H new ATOM 0 HE2 LYS A 568 51.975 0.393 -17.273 1.00 0.00 H new ATOM 0 HE3 LYS A 568 50.961 0.877 -18.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 568 49.631 0.052 -16.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 568 49.458 -0.972 -18.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 568 50.440 -1.441 -16.811 1.00 0.00 H new ATOM 764 N ASN A 569 56.470 -4.380 -19.580 1.00 0.00 N ATOM 765 CA ASN A 569 57.249 -5.285 -20.434 1.00 0.00 C ATOM 766 C ASN A 569 57.574 -6.590 -19.690 1.00 0.00 C ATOM 767 O ASN A 569 57.958 -6.552 -18.524 1.00 0.00 O ATOM 768 CB ASN A 569 58.553 -4.594 -20.856 1.00 0.00 C ATOM 769 CG ASN A 569 59.005 -5.094 -22.224 1.00 0.00 C ATOM 770 OD1 ASN A 569 59.852 -5.982 -22.313 1.00 0.00 O ATOM 771 ND2 ASN A 569 58.486 -4.573 -23.303 1.00 0.00 N ATOM 0 H ASN A 569 56.904 -3.470 -19.425 1.00 0.00 H new ATOM 0 HA ASN A 569 56.657 -5.528 -21.317 1.00 0.00 H new ATOM 0 HB2 ASN A 569 58.406 -3.514 -20.888 1.00 0.00 H new ATOM 0 HB3 ASN A 569 59.330 -4.788 -20.117 1.00 0.00 H new ATOM 0 HD21 ASN A 569 58.783 -4.902 -24.222 1.00 0.00 H new ATOM 0 HD22 ASN A 569 57.784 -3.837 -23.227 1.00 0.00 H new ATOM 778 N PRO A 570 57.422 -7.736 -20.330 1.00 0.00 N ATOM 779 CA PRO A 570 57.465 -9.050 -19.610 1.00 0.00 C ATOM 780 C PRO A 570 58.834 -9.338 -18.990 1.00 0.00 C ATOM 781 O PRO A 570 58.929 -9.677 -17.807 1.00 0.00 O ATOM 782 CB PRO A 570 57.121 -10.083 -20.688 1.00 0.00 C ATOM 783 CG PRO A 570 57.449 -9.430 -21.985 1.00 0.00 C ATOM 784 CD PRO A 570 57.236 -7.933 -21.783 1.00 0.00 C ATOM 0 HA PRO A 570 56.772 -9.065 -18.769 1.00 0.00 H new ATOM 0 HB2 PRO A 570 57.698 -10.998 -20.553 1.00 0.00 H new ATOM 0 HB3 PRO A 570 56.068 -10.360 -20.644 1.00 0.00 H new ATOM 0 HG2 PRO A 570 58.479 -9.640 -22.275 1.00 0.00 H new ATOM 0 HG3 PRO A 570 56.810 -9.809 -22.782 1.00 0.00 H new ATOM 0 HD2 PRO A 570 57.952 -7.347 -22.360 1.00 0.00 H new ATOM 0 HD3 PRO A 570 56.241 -7.625 -22.103 1.00 0.00 H new ATOM 792 N GLU A 571 59.896 -9.156 -19.774 1.00 0.00 N ATOM 793 CA GLU A 571 61.241 -9.490 -19.310 1.00 0.00 C ATOM 794 C GLU A 571 61.662 -8.532 -18.197 1.00 0.00 C ATOM 795 O GLU A 571 62.171 -8.952 -17.153 1.00 0.00 O ATOM 796 CB GLU A 571 62.237 -9.408 -20.472 1.00 0.00 C ATOM 797 CG GLU A 571 63.573 -10.026 -20.051 1.00 0.00 C ATOM 798 CD GLU A 571 64.612 -9.829 -21.150 1.00 0.00 C ATOM 799 OE1 GLU A 571 64.650 -8.749 -21.719 1.00 0.00 O ATOM 800 OE2 GLU A 571 65.356 -10.761 -21.409 1.00 0.00 O ATOM 0 H GLU A 571 59.853 -8.783 -20.723 1.00 0.00 H new ATOM 0 HA GLU A 571 61.235 -10.508 -18.921 1.00 0.00 H new ATOM 0 HB2 GLU A 571 61.840 -9.933 -21.341 1.00 0.00 H new ATOM 0 HB3 GLU A 571 62.383 -8.369 -20.766 1.00 0.00 H new ATOM 0 HG2 GLU A 571 63.920 -9.566 -19.126 1.00 0.00 H new ATOM 0 HG3 GLU A 571 63.443 -11.089 -19.849 1.00 0.00 H new ATOM 807 N VAL A 572 61.358 -7.254 -18.389 1.00 0.00 N ATOM 808 CA VAL A 572 61.687 -6.250 -17.389 1.00 0.00 C ATOM 809 C VAL A 572 60.749 -6.388 -16.188 1.00 0.00 C ATOM 810 O VAL A 572 61.156 -6.171 -15.054 1.00 0.00 O ATOM 811 CB VAL A 572 61.585 -4.844 -17.997 1.00 0.00 C ATOM 812 CG1 VAL A 572 61.983 -3.789 -16.959 1.00 0.00 C ATOM 813 CG2 VAL A 572 62.527 -4.740 -19.200 1.00 0.00 C ATOM 0 H VAL A 572 60.889 -6.893 -19.220 1.00 0.00 H new ATOM 0 HA VAL A 572 62.712 -6.403 -17.051 1.00 0.00 H new ATOM 0 HB VAL A 572 60.556 -4.670 -18.312 1.00 0.00 H new ATOM 0 HG11 VAL A 572 61.907 -2.796 -17.402 1.00 0.00 H new ATOM 0 HG12 VAL A 572 61.316 -3.855 -16.099 1.00 0.00 H new ATOM 0 HG13 VAL A 572 63.009 -3.965 -16.637 1.00 0.00 H new ATOM 0 HG21 VAL A 572 62.456 -3.742 -19.633 1.00 0.00 H new ATOM 0 HG22 VAL A 572 63.552 -4.923 -18.877 1.00 0.00 H new ATOM 0 HG23 VAL A 572 62.245 -5.481 -19.948 1.00 0.00 H new ATOM 823 N PHE A 573 59.501 -6.799 -16.441 1.00 0.00 N ATOM 824 CA PHE A 573 58.518 -6.983 -15.365 1.00 0.00 C ATOM 825 C PHE A 573 59.072 -7.907 -14.276 1.00 0.00 C ATOM 826 O PHE A 573 59.003 -7.586 -13.090 1.00 0.00 O ATOM 827 CB PHE A 573 57.222 -7.570 -15.956 1.00 0.00 C ATOM 828 CG PHE A 573 56.192 -8.010 -14.933 1.00 0.00 C ATOM 829 CD1 PHE A 573 55.494 -7.049 -14.161 1.00 0.00 C ATOM 830 CD2 PHE A 573 55.915 -9.389 -14.763 1.00 0.00 C ATOM 831 CE1 PHE A 573 54.523 -7.467 -13.219 1.00 0.00 C ATOM 832 CE2 PHE A 573 54.946 -9.807 -13.821 1.00 0.00 C ATOM 833 CZ PHE A 573 54.249 -8.847 -13.048 1.00 0.00 C ATOM 0 H PHE A 573 59.149 -7.010 -17.375 1.00 0.00 H new ATOM 0 HA PHE A 573 58.305 -6.016 -14.909 1.00 0.00 H new ATOM 0 HB2 PHE A 573 56.768 -6.824 -16.609 1.00 0.00 H new ATOM 0 HB3 PHE A 573 57.480 -8.425 -16.580 1.00 0.00 H new ATOM 0 HD1 PHE A 573 55.703 -5.997 -14.291 1.00 0.00 H new ATOM 0 HD2 PHE A 573 56.444 -10.122 -15.353 1.00 0.00 H new ATOM 0 HE1 PHE A 573 53.991 -6.734 -12.631 1.00 0.00 H new ATOM 0 HE2 PHE A 573 54.738 -10.859 -13.691 1.00 0.00 H new ATOM 0 HZ PHE A 573 53.509 -9.166 -12.329 1.00 0.00 H new ATOM 843 N LYS A 574 59.680 -9.019 -14.694 1.00 0.00 N ATOM 844 CA LYS A 574 60.317 -9.937 -13.747 1.00 0.00 C ATOM 845 C LYS A 574 61.438 -9.233 -12.977 1.00 0.00 C ATOM 846 O LYS A 574 61.509 -9.315 -11.750 1.00 0.00 O ATOM 847 CB LYS A 574 60.898 -11.137 -14.498 1.00 0.00 C ATOM 848 CG LYS A 574 59.762 -11.934 -15.143 1.00 0.00 C ATOM 849 CD LYS A 574 60.330 -13.197 -15.794 1.00 0.00 C ATOM 850 CE LYS A 574 59.216 -13.931 -16.543 1.00 0.00 C ATOM 851 NZ LYS A 574 59.698 -15.280 -16.953 1.00 0.00 N ATOM 0 H LYS A 574 59.745 -9.304 -15.671 1.00 0.00 H new ATOM 0 HA LYS A 574 59.561 -10.275 -13.038 1.00 0.00 H new ATOM 0 HB2 LYS A 574 61.598 -10.798 -15.262 1.00 0.00 H new ATOM 0 HB3 LYS A 574 61.458 -11.772 -13.812 1.00 0.00 H new ATOM 0 HG2 LYS A 574 59.019 -12.202 -14.392 1.00 0.00 H new ATOM 0 HG3 LYS A 574 59.254 -11.324 -15.890 1.00 0.00 H new ATOM 0 HD2 LYS A 574 61.133 -12.934 -16.482 1.00 0.00 H new ATOM 0 HD3 LYS A 574 60.762 -13.848 -15.034 1.00 0.00 H new ATOM 0 HE2 LYS A 574 58.336 -14.025 -15.906 1.00 0.00 H new ATOM 0 HE3 LYS A 574 58.915 -13.359 -17.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 574 58.941 -15.779 -17.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 574 60.525 -15.179 -17.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 574 59.965 -15.825 -16.108 1.00 0.00 H new ATOM 865 N LYS A 575 62.272 -8.489 -13.705 1.00 0.00 N ATOM 866 CA LYS A 575 63.442 -7.842 -13.105 1.00 0.00 C ATOM 867 C LYS A 575 63.035 -6.775 -12.087 1.00 0.00 C ATOM 868 O LYS A 575 63.445 -6.816 -10.921 1.00 0.00 O ATOM 869 CB LYS A 575 64.285 -7.193 -14.201 1.00 0.00 C ATOM 870 CG LYS A 575 64.929 -8.279 -15.064 1.00 0.00 C ATOM 871 CD LYS A 575 65.830 -7.629 -16.115 1.00 0.00 C ATOM 872 CE LYS A 575 66.250 -8.679 -17.145 1.00 0.00 C ATOM 873 NZ LYS A 575 66.792 -7.998 -18.355 1.00 0.00 N ATOM 0 H LYS A 575 62.161 -8.319 -14.705 1.00 0.00 H new ATOM 0 HA LYS A 575 64.018 -8.608 -12.586 1.00 0.00 H new ATOM 0 HB2 LYS A 575 63.662 -6.546 -14.818 1.00 0.00 H new ATOM 0 HB3 LYS A 575 65.056 -6.563 -13.756 1.00 0.00 H new ATOM 0 HG2 LYS A 575 65.511 -8.957 -14.440 1.00 0.00 H new ATOM 0 HG3 LYS A 575 64.158 -8.877 -15.550 1.00 0.00 H new ATOM 0 HD2 LYS A 575 65.302 -6.812 -16.607 1.00 0.00 H new ATOM 0 HD3 LYS A 575 66.711 -7.198 -15.639 1.00 0.00 H new ATOM 0 HE2 LYS A 575 67.004 -9.341 -16.719 1.00 0.00 H new ATOM 0 HE3 LYS A 575 65.396 -9.300 -17.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 575 66.369 -8.417 -19.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 575 66.561 -6.985 -18.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 575 67.825 -8.116 -18.387 1.00 0.00 H new ATOM 887 N ILE A 576 62.195 -5.843 -12.528 1.00 0.00 N ATOM 888 CA ILE A 576 61.773 -4.718 -11.686 1.00 0.00 C ATOM 889 C ILE A 576 61.101 -5.237 -10.403 1.00 0.00 C ATOM 890 O ILE A 576 61.436 -4.805 -9.297 1.00 0.00 O ATOM 891 CB ILE A 576 60.801 -3.808 -12.471 1.00 0.00 C ATOM 892 CG1 ILE A 576 61.454 -3.333 -13.791 1.00 0.00 C ATOM 893 CG2 ILE A 576 60.404 -2.592 -11.618 1.00 0.00 C ATOM 894 CD1 ILE A 576 62.605 -2.353 -13.533 1.00 0.00 C ATOM 0 H ILE A 576 61.790 -5.841 -13.464 1.00 0.00 H new ATOM 0 HA ILE A 576 62.651 -4.136 -11.406 1.00 0.00 H new ATOM 0 HB ILE A 576 59.906 -4.383 -12.708 1.00 0.00 H new ATOM 0 HG12 ILE A 576 61.827 -4.195 -14.344 1.00 0.00 H new ATOM 0 HG13 ILE A 576 60.702 -2.854 -14.418 1.00 0.00 H new ATOM 0 HG21 ILE A 576 59.719 -1.959 -12.183 1.00 0.00 H new ATOM 0 HG22 ILE A 576 59.915 -2.932 -10.705 1.00 0.00 H new ATOM 0 HG23 ILE A 576 61.296 -2.021 -11.360 1.00 0.00 H new ATOM 0 HD11 ILE A 576 63.038 -2.042 -14.484 1.00 0.00 H new ATOM 0 HD12 ILE A 576 62.227 -1.479 -13.003 1.00 0.00 H new ATOM 0 HD13 ILE A 576 63.369 -2.841 -12.928 1.00 0.00 H new ATOM 906 N GLN A 577 60.209 -6.217 -10.556 1.00 0.00 N ATOM 907 CA GLN A 577 59.483 -6.776 -9.412 1.00 0.00 C ATOM 908 C GLN A 577 60.437 -7.374 -8.375 1.00 0.00 C ATOM 909 O GLN A 577 60.279 -7.146 -7.177 1.00 0.00 O ATOM 910 CB GLN A 577 58.515 -7.861 -9.884 1.00 0.00 C ATOM 911 CG GLN A 577 57.295 -7.210 -10.537 1.00 0.00 C ATOM 912 CD GLN A 577 56.220 -8.260 -10.785 1.00 0.00 C ATOM 913 OE1 GLN A 577 56.488 -9.291 -11.401 1.00 0.00 O ATOM 914 NE2 GLN A 577 55.011 -8.059 -10.339 1.00 0.00 N ATOM 0 H GLN A 577 59.972 -6.638 -11.454 1.00 0.00 H new ATOM 0 HA GLN A 577 58.932 -5.960 -8.945 1.00 0.00 H new ATOM 0 HB2 GLN A 577 59.012 -8.522 -10.595 1.00 0.00 H new ATOM 0 HB3 GLN A 577 58.203 -8.477 -9.040 1.00 0.00 H new ATOM 0 HG2 GLN A 577 56.904 -6.421 -9.894 1.00 0.00 H new ATOM 0 HG3 GLN A 577 57.582 -6.741 -11.478 1.00 0.00 H new ATOM 0 HE21 GLN A 577 54.791 -7.204 -9.829 1.00 0.00 H new ATOM 0 HE22 GLN A 577 54.285 -8.757 -10.501 1.00 0.00 H new ATOM 923 N THR A 578 61.435 -8.128 -8.846 1.00 0.00 N ATOM 924 CA THR A 578 62.328 -8.861 -7.948 1.00 0.00 C ATOM 925 C THR A 578 62.992 -7.928 -6.933 1.00 0.00 C ATOM 926 O THR A 578 62.916 -8.168 -5.726 1.00 0.00 O ATOM 927 CB THR A 578 63.405 -9.599 -8.756 1.00 0.00 C ATOM 928 OG1 THR A 578 62.786 -10.334 -9.800 1.00 0.00 O ATOM 929 CG2 THR A 578 64.178 -10.564 -7.846 1.00 0.00 C ATOM 0 H THR A 578 61.643 -8.246 -9.838 1.00 0.00 H new ATOM 0 HA THR A 578 61.725 -9.585 -7.400 1.00 0.00 H new ATOM 0 HB THR A 578 64.099 -8.870 -9.175 1.00 0.00 H new ATOM 0 HG1 THR A 578 62.701 -9.766 -10.594 1.00 0.00 H new ATOM 0 HG21 THR A 578 64.939 -11.082 -8.429 1.00 0.00 H new ATOM 0 HG22 THR A 578 64.655 -10.003 -7.043 1.00 0.00 H new ATOM 0 HG23 THR A 578 63.489 -11.293 -7.420 1.00 0.00 H new ATOM 937 N LEU A 579 63.594 -6.841 -7.411 1.00 0.00 N ATOM 938 CA LEU A 579 64.355 -5.969 -6.512 1.00 0.00 C ATOM 939 C LEU A 579 63.438 -5.226 -5.541 1.00 0.00 C ATOM 940 O LEU A 579 63.811 -4.998 -4.389 1.00 0.00 O ATOM 941 CB LEU A 579 65.198 -4.959 -7.297 1.00 0.00 C ATOM 942 CG LEU A 579 66.144 -5.671 -8.281 1.00 0.00 C ATOM 943 CD1 LEU A 579 67.125 -4.648 -8.847 1.00 0.00 C ATOM 944 CD2 LEU A 579 66.943 -6.777 -7.576 1.00 0.00 C ATOM 0 H LEU A 579 63.574 -6.546 -8.387 1.00 0.00 H new ATOM 0 HA LEU A 579 65.021 -6.613 -5.938 1.00 0.00 H new ATOM 0 HB2 LEU A 579 64.543 -4.281 -7.844 1.00 0.00 H new ATOM 0 HB3 LEU A 579 65.780 -4.350 -6.605 1.00 0.00 H new ATOM 0 HG LEU A 579 65.546 -6.121 -9.074 1.00 0.00 H new ATOM 0 HD11 LEU A 579 67.801 -5.140 -9.546 1.00 0.00 H new ATOM 0 HD12 LEU A 579 66.574 -3.864 -9.366 1.00 0.00 H new ATOM 0 HD13 LEU A 579 67.702 -4.208 -8.033 1.00 0.00 H new ATOM 0 HD21 LEU A 579 67.603 -7.263 -8.294 1.00 0.00 H new ATOM 0 HD22 LEU A 579 67.538 -6.341 -6.774 1.00 0.00 H new ATOM 0 HD23 LEU A 579 66.256 -7.513 -7.159 1.00 0.00 H new ATOM 956 N ILE A 580 62.240 -4.846 -6.000 1.00 0.00 N ATOM 957 CA ILE A 580 61.297 -4.124 -5.140 1.00 0.00 C ATOM 958 C ILE A 580 60.854 -5.008 -3.970 1.00 0.00 C ATOM 959 O ILE A 580 60.833 -4.564 -2.821 1.00 0.00 O ATOM 960 CB ILE A 580 60.076 -3.671 -5.959 1.00 0.00 C ATOM 961 CG1 ILE A 580 60.543 -2.773 -7.110 1.00 0.00 C ATOM 962 CG2 ILE A 580 59.113 -2.877 -5.066 1.00 0.00 C ATOM 963 CD1 ILE A 580 59.380 -2.519 -8.073 1.00 0.00 C ATOM 0 H ILE A 580 61.905 -5.023 -6.947 1.00 0.00 H new ATOM 0 HA ILE A 580 61.797 -3.243 -4.737 1.00 0.00 H new ATOM 0 HB ILE A 580 59.565 -4.549 -6.353 1.00 0.00 H new ATOM 0 HG12 ILE A 580 60.916 -1.827 -6.717 1.00 0.00 H new ATOM 0 HG13 ILE A 580 61.370 -3.246 -7.640 1.00 0.00 H new ATOM 0 HG21 ILE A 580 58.251 -2.560 -5.653 1.00 0.00 H new ATOM 0 HG22 ILE A 580 58.779 -3.507 -4.241 1.00 0.00 H new ATOM 0 HG23 ILE A 580 59.624 -2.000 -4.669 1.00 0.00 H new ATOM 0 HD11 ILE A 580 59.717 -1.880 -8.890 1.00 0.00 H new ATOM 0 HD12 ILE A 580 59.028 -3.468 -8.476 1.00 0.00 H new ATOM 0 HD13 ILE A 580 58.567 -2.027 -7.539 1.00 0.00 H new ATOM 975 N ALA A 581 60.501 -6.259 -4.273 1.00 0.00 N ATOM 976 CA ALA A 581 60.135 -7.225 -3.237 1.00 0.00 C ATOM 977 C ALA A 581 61.304 -7.468 -2.279 1.00 0.00 C ATOM 978 O ALA A 581 61.105 -7.704 -1.086 1.00 0.00 O ATOM 979 CB ALA A 581 59.724 -8.551 -3.881 1.00 0.00 C ATOM 0 H ALA A 581 60.461 -6.625 -5.224 1.00 0.00 H new ATOM 0 HA ALA A 581 59.298 -6.815 -2.672 1.00 0.00 H new ATOM 0 HB1 ALA A 581 59.453 -9.265 -3.103 1.00 0.00 H new ATOM 0 HB2 ALA A 581 58.869 -8.387 -4.537 1.00 0.00 H new ATOM 0 HB3 ALA A 581 60.557 -8.947 -4.462 1.00 0.00 H new ATOM 985 N ALA A 582 62.521 -7.407 -2.818 1.00 0.00 N ATOM 986 CA ALA A 582 63.728 -7.598 -2.016 1.00 0.00 C ATOM 987 C ALA A 582 64.047 -6.368 -1.151 1.00 0.00 C ATOM 988 O ALA A 582 64.977 -6.410 -0.344 1.00 0.00 O ATOM 989 CB ALA A 582 64.915 -7.901 -2.934 1.00 0.00 C ATOM 0 H ALA A 582 62.697 -7.227 -3.806 1.00 0.00 H new ATOM 0 HA ALA A 582 63.548 -8.438 -1.345 1.00 0.00 H new ATOM 0 HB1 ALA A 582 65.813 -8.043 -2.333 1.00 0.00 H new ATOM 0 HB2 ALA A 582 64.712 -8.808 -3.503 1.00 0.00 H new ATOM 0 HB3 ALA A 582 65.066 -7.068 -3.621 1.00 0.00 H new ATOM 995 N GLY A 583 63.286 -5.279 -1.315 1.00 0.00 N ATOM 996 CA GLY A 583 63.513 -4.071 -0.524 1.00 0.00 C ATOM 997 C GLY A 583 64.792 -3.343 -0.942 1.00 0.00 C ATOM 998 O GLY A 583 65.361 -2.583 -0.157 1.00 0.00 O ATOM 0 H GLY A 583 62.517 -5.212 -1.981 1.00 0.00 H new ATOM 0 HA2 GLY A 583 62.661 -3.400 -0.635 1.00 0.00 H new ATOM 0 HA3 GLY A 583 63.575 -4.335 0.532 1.00 0.00 H new ATOM 1002 N ILE A 584 65.230 -3.561 -2.184 1.00 0.00 N ATOM 1003 CA ILE A 584 66.451 -2.923 -2.676 1.00 0.00 C ATOM 1004 C ILE A 584 66.137 -1.572 -3.321 1.00 0.00 C ATOM 1005 O ILE A 584 66.965 -0.661 -3.300 1.00 0.00 O ATOM 1006 CB ILE A 584 67.159 -3.820 -3.702 1.00 0.00 C ATOM 1007 CG1 ILE A 584 67.241 -5.260 -3.166 1.00 0.00 C ATOM 1008 CG2 ILE A 584 68.575 -3.283 -3.943 1.00 0.00 C ATOM 1009 CD1 ILE A 584 67.856 -6.194 -4.219 1.00 0.00 C ATOM 0 H ILE A 584 64.764 -4.167 -2.859 1.00 0.00 H new ATOM 0 HA ILE A 584 67.108 -2.767 -1.821 1.00 0.00 H new ATOM 0 HB ILE A 584 66.598 -3.818 -4.637 1.00 0.00 H new ATOM 0 HG12 ILE A 584 67.842 -5.282 -2.257 1.00 0.00 H new ATOM 0 HG13 ILE A 584 66.245 -5.611 -2.898 1.00 0.00 H new ATOM 0 HG21 ILE A 584 69.085 -3.915 -4.671 1.00 0.00 H new ATOM 0 HG22 ILE A 584 68.517 -2.264 -4.325 1.00 0.00 H new ATOM 0 HG23 ILE A 584 69.131 -3.289 -3.005 1.00 0.00 H new ATOM 0 HD11 ILE A 584 67.906 -7.208 -3.822 1.00 0.00 H new ATOM 0 HD12 ILE A 584 67.239 -6.186 -5.117 1.00 0.00 H new ATOM 0 HD13 ILE A 584 68.861 -5.852 -4.466 1.00 0.00 H new ATOM 1021 N ILE A 585 64.935 -1.449 -3.889 1.00 0.00 N ATOM 1022 CA ILE A 585 64.538 -0.226 -4.583 1.00 0.00 C ATOM 1023 C ILE A 585 63.197 0.262 -4.037 1.00 0.00 C ATOM 1024 O ILE A 585 62.341 -0.543 -3.668 1.00 0.00 O ATOM 1025 CB ILE A 585 64.430 -0.492 -6.092 1.00 0.00 C ATOM 1026 CG1 ILE A 585 65.757 -1.060 -6.610 1.00 0.00 C ATOM 1027 CG2 ILE A 585 64.118 0.817 -6.831 1.00 0.00 C ATOM 1028 CD1 ILE A 585 65.581 -1.558 -8.048 1.00 0.00 C ATOM 0 H ILE A 585 64.223 -2.180 -3.881 1.00 0.00 H new ATOM 0 HA ILE A 585 65.291 0.544 -4.416 1.00 0.00 H new ATOM 0 HB ILE A 585 63.629 -1.209 -6.271 1.00 0.00 H new ATOM 0 HG12 ILE A 585 66.531 -0.293 -6.573 1.00 0.00 H new ATOM 0 HG13 ILE A 585 66.088 -1.878 -5.970 1.00 0.00 H new ATOM 0 HG21 ILE A 585 64.043 0.622 -7.901 1.00 0.00 H new ATOM 0 HG22 ILE A 585 63.174 1.223 -6.469 1.00 0.00 H new ATOM 0 HG23 ILE A 585 64.916 1.537 -6.649 1.00 0.00 H new ATOM 0 HD11 ILE A 585 66.526 -1.961 -8.412 1.00 0.00 H new ATOM 0 HD12 ILE A 585 64.821 -2.339 -8.072 1.00 0.00 H new ATOM 0 HD13 ILE A 585 65.271 -0.729 -8.685 1.00 0.00 H new ATOM 1040 N ARG A 586 63.022 1.583 -3.991 1.00 0.00 N ATOM 1041 CA ARG A 586 61.802 2.166 -3.440 1.00 0.00 C ATOM 1042 C ARG A 586 60.785 2.443 -4.550 1.00 0.00 C ATOM 1043 O ARG A 586 60.695 3.562 -5.052 1.00 0.00 O ATOM 1044 CB ARG A 586 62.133 3.464 -2.697 1.00 0.00 C ATOM 1045 CG ARG A 586 63.032 3.151 -1.500 1.00 0.00 C ATOM 1046 CD ARG A 586 63.277 4.431 -0.697 1.00 0.00 C ATOM 1047 NE ARG A 586 64.289 4.198 0.335 1.00 0.00 N ATOM 1048 CZ ARG A 586 64.479 5.044 1.358 1.00 0.00 C ATOM 1049 NH1 ARG A 586 63.762 6.136 1.484 1.00 0.00 N ATOM 1050 NH2 ARG A 586 65.397 4.777 2.246 1.00 0.00 N ATOM 0 H ARG A 586 63.704 2.263 -4.326 1.00 0.00 H new ATOM 0 HA ARG A 586 61.364 1.454 -2.741 1.00 0.00 H new ATOM 0 HB2 ARG A 586 62.633 4.162 -3.368 1.00 0.00 H new ATOM 0 HB3 ARG A 586 61.216 3.947 -2.360 1.00 0.00 H new ATOM 0 HG2 ARG A 586 62.564 2.396 -0.868 1.00 0.00 H new ATOM 0 HG3 ARG A 586 63.980 2.737 -1.842 1.00 0.00 H new ATOM 0 HD2 ARG A 586 63.604 5.229 -1.363 1.00 0.00 H new ATOM 0 HD3 ARG A 586 62.347 4.762 -0.235 1.00 0.00 H new ATOM 0 HE ARG A 586 64.870 3.362 0.274 1.00 0.00 H new ATOM 0 HH11 ARG A 586 63.042 6.356 0.795 1.00 0.00 H new ATOM 0 HH12 ARG A 586 63.924 6.765 2.271 1.00 0.00 H new ATOM 0 HH21 ARG A 586 65.961 3.932 2.158 1.00 0.00 H new ATOM 0 HH22 ARG A 586 65.550 5.413 3.028 1.00 0.00 H new ATOM 1064 N THR A 587 60.056 1.393 -4.946 1.00 0.00 N ATOM 1065 CA THR A 587 58.959 1.510 -5.917 1.00 0.00 C ATOM 1066 C THR A 587 59.407 2.179 -7.225 1.00 0.00 C ATOM 1067 O THR A 587 59.742 1.489 -8.190 1.00 0.00 O ATOM 1068 CB THR A 587 57.778 2.274 -5.300 1.00 0.00 C ATOM 1069 OG1 THR A 587 58.215 3.543 -4.835 1.00 0.00 O ATOM 1070 CG2 THR A 587 57.205 1.469 -4.134 1.00 0.00 C ATOM 0 H THR A 587 60.208 0.443 -4.606 1.00 0.00 H new ATOM 0 HA THR A 587 58.640 0.498 -6.167 1.00 0.00 H new ATOM 0 HB THR A 587 57.007 2.418 -6.057 1.00 0.00 H new ATOM 0 HG1 THR A 587 57.458 4.027 -4.444 1.00 0.00 H new ATOM 0 HG21 THR A 587 56.367 2.010 -3.695 1.00 0.00 H new ATOM 0 HG22 THR A 587 56.862 0.499 -4.495 1.00 0.00 H new ATOM 0 HG23 THR A 587 57.977 1.322 -3.379 1.00 0.00 H new ATOM 1078 N GLY A 588 59.415 3.513 -7.256 1.00 0.00 N ATOM 1079 CA GLY A 588 59.726 4.243 -8.481 1.00 0.00 C ATOM 1080 C GLY A 588 59.292 5.702 -8.372 1.00 0.00 C ATOM 1081 O GLY A 588 59.002 6.189 -7.278 1.00 0.00 O ATOM 0 H GLY A 588 59.211 4.105 -6.451 1.00 0.00 H new ATOM 0 HA2 GLY A 588 60.797 4.192 -8.677 1.00 0.00 H new ATOM 0 HA3 GLY A 588 59.224 3.773 -9.327 1.00 0.00 H new ATOM 1085 N ARG A 589 59.251 6.391 -9.511 1.00 0.00 N ATOM 1086 CA ARG A 589 58.847 7.794 -9.536 1.00 0.00 C ATOM 1087 C ARG A 589 58.180 8.134 -10.865 1.00 0.00 C ATOM 1088 O ARG A 589 58.820 7.959 -11.888 1.00 0.00 O ATOM 1089 CB ARG A 589 60.066 8.696 -9.329 1.00 0.00 C ATOM 1090 CG ARG A 589 60.617 8.496 -7.915 1.00 0.00 C ATOM 1091 CD ARG A 589 61.719 9.523 -7.649 1.00 0.00 C ATOM 1092 NE ARG A 589 62.376 9.245 -6.369 1.00 0.00 N ATOM 1093 CZ ARG A 589 63.501 9.870 -5.990 1.00 0.00 C ATOM 1094 NH1 ARG A 589 64.073 10.770 -6.755 1.00 0.00 N ATOM 1095 NH2 ARG A 589 64.036 9.577 -4.837 1.00 0.00 N ATOM 1096 OXT ARG A 589 57.040 8.566 -10.839 1.00 0.00 O ATOM 0 H ARG A 589 59.491 6.003 -10.423 1.00 0.00 H new ATOM 0 HA ARG A 589 58.133 7.961 -8.729 1.00 0.00 H new ATOM 0 HB2 ARG A 589 60.834 8.462 -10.066 1.00 0.00 H new ATOM 0 HB3 ARG A 589 59.789 9.740 -9.478 1.00 0.00 H new ATOM 0 HG2 ARG A 589 59.818 8.606 -7.182 1.00 0.00 H new ATOM 0 HG3 ARG A 589 61.012 7.486 -7.806 1.00 0.00 H new ATOM 0 HD2 ARG A 589 62.452 9.496 -8.455 1.00 0.00 H new ATOM 0 HD3 ARG A 589 61.295 10.527 -7.637 1.00 0.00 H new ATOM 0 HE ARG A 589 61.964 8.552 -5.744 1.00 0.00 H new ATOM 0 HH11 ARG A 589 63.662 11.007 -7.658 1.00 0.00 H new ATOM 0 HH12 ARG A 589 64.928 11.233 -6.446 1.00 0.00 H new ATOM 0 HH21 ARG A 589 63.599 8.879 -4.235 1.00 0.00 H new ATOM 0 HH22 ARG A 589 64.891 10.045 -4.538 1.00 0.00 H new TER 1110 ARG A 589