USER MOD reduce.3.24.130724 H: found=0, std=0, add=799, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 799 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 506 THR OG1 : rot 116:sc= 1.23 USER MOD Single : A 512 THR OG1 : rot 180:sc= 0 USER MOD Single : A 513 HIS : no HD1:sc= -0.0112 X(o=-0.011,f=-0.011) USER MOD Single : A 515 SER OG : rot 180:sc= 0.0375 USER MOD Single : A 517 SER OG : rot -40:sc= 0.505 USER MOD Single : A 521 MET CE :methyl -113:sc= -0.211 (180deg=-4.84!) USER MOD Single : A 524 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 528 THR OG1 : rot -126:sc= -0.739! USER MOD Single : A 529 SER OG : rot 180:sc= 0 USER MOD Single : A 534 ASN :FLIP amide:sc= -0.824 F(o=-2.2,f=-0.82) USER MOD Single : A 539 TYR OH : rot 180:sc= 0 USER MOD Single : A 540 LYS NZ :NH3+ -112:sc= 1.04 (180deg=0.746) USER MOD Single : A 541 THR OG1 : rot 105:sc= 1.37 USER MOD Single : A 545 THR OG1 : rot -26:sc= 0.269 USER MOD Single : A 556 THR OG1 : rot 180:sc= 0 USER MOD Single : A 557 CYS SG : rot 180:sc= 0 USER MOD Single : A 563 GLN : amide:sc= -0.0143 X(o=-0.014,f=-0.22) USER MOD Single : A 564 ASN : amide:sc= 0.226! C(o=0.23!,f=-6.3!) USER MOD Single : A 569 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 570 THR OG1 : rot 160:sc= 1.24 USER MOD Single : A 572 SER OG : rot 40:sc= 0.0629 USER MOD Single : A 574 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 585 LYS NZ :NH3+ 171:sc= 0.95 (180deg=0.816) USER MOD Single : A 586 THR OG1 : rot 28:sc= 0.667 USER MOD Single : A 639 HIS : no HD1:sc= 0 X(o=0,f=-0.00021) USER MOD Single : A 640 THR OG1 : rot 50:sc= 0.0445 USER MOD Single : A 641 LYS NZ :NH3+ -107:sc= -0.58 (180deg=-2.56!) USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 502 3.087 -2.461 0.272 1.00 23.31 N ATOM 19 CA ALA A 502 2.961 -3.632 -0.580 1.00 25.05 C ATOM 20 C ALA A 502 1.495 -3.841 -0.881 1.00 40.31 C ATOM 21 O ALA A 502 1.079 -3.919 -2.038 1.00 14.11 O ATOM 22 CB ALA A 502 3.496 -4.876 0.107 1.00 62.11 C ATOM 0 HA ALA A 502 3.537 -3.467 -1.490 1.00 25.05 H new ATOM 0 HB1 ALA A 502 3.387 -5.734 -0.557 1.00 62.11 H new ATOM 0 HB2 ALA A 502 4.550 -4.734 0.347 1.00 62.11 H new ATOM 0 HB3 ALA A 502 2.936 -5.054 1.025 1.00 62.11 H new ATOM 28 N GLY A 503 0.712 -3.905 0.171 1.00 3.31 N ATOM 29 CA GLY A 503 -0.694 -4.145 0.051 1.00 65.10 C ATOM 30 C GLY A 503 -1.245 -4.635 1.354 1.00 10.30 C ATOM 31 O GLY A 503 -0.706 -4.292 2.400 1.00 60.43 O ATOM 0 H GLY A 503 1.039 -3.791 1.131 1.00 3.31 H new ATOM 0 HA2 GLY A 503 -1.203 -3.228 -0.246 1.00 65.10 H new ATOM 0 HA3 GLY A 503 -0.880 -4.881 -0.731 1.00 65.10 H new ATOM 35 N ILE A 504 -2.265 -5.469 1.300 1.00 41.24 N ATOM 36 CA ILE A 504 -2.964 -5.919 2.493 1.00 42.32 C ATOM 37 C ILE A 504 -2.953 -7.445 2.584 1.00 31.34 C ATOM 38 O ILE A 504 -3.243 -8.129 1.615 1.00 3.41 O ATOM 39 CB ILE A 504 -4.483 -5.445 2.520 1.00 50.33 C ATOM 40 CG1 ILE A 504 -4.663 -3.914 2.513 1.00 15.43 C ATOM 41 CG2 ILE A 504 -5.259 -6.058 3.663 1.00 4.40 C ATOM 42 CD1 ILE A 504 -4.428 -3.250 1.167 1.00 11.22 C ATOM 0 H ILE A 504 -2.634 -5.855 0.431 1.00 41.24 H new ATOM 0 HA ILE A 504 -2.435 -5.476 3.337 1.00 42.32 H new ATOM 0 HB ILE A 504 -4.897 -5.815 1.582 1.00 50.33 H new ATOM 0 HG12 ILE A 504 -5.674 -3.680 2.846 1.00 15.43 H new ATOM 0 HG13 ILE A 504 -3.979 -3.479 3.241 1.00 15.43 H new ATOM 0 HG21 ILE A 504 -6.289 -5.702 3.636 1.00 4.40 H new ATOM 0 HG22 ILE A 504 -5.248 -7.144 3.569 1.00 4.40 H new ATOM 0 HG23 ILE A 504 -4.801 -5.771 4.609 1.00 4.40 H new ATOM 0 HD11 ILE A 504 -4.578 -2.174 1.261 1.00 11.22 H new ATOM 0 HD12 ILE A 504 -3.408 -3.447 0.837 1.00 11.22 H new ATOM 0 HD13 ILE A 504 -5.130 -3.651 0.436 1.00 11.22 H new ATOM 54 N PHE A 505 -2.570 -7.947 3.725 1.00 41.03 N ATOM 55 CA PHE A 505 -2.712 -9.354 4.045 1.00 70.54 C ATOM 56 C PHE A 505 -3.742 -9.494 5.149 1.00 74.33 C ATOM 57 O PHE A 505 -3.750 -8.695 6.095 1.00 40.55 O ATOM 58 CB PHE A 505 -1.386 -9.984 4.496 1.00 34.13 C ATOM 59 CG PHE A 505 -0.420 -10.287 3.389 1.00 30.40 C ATOM 60 CD1 PHE A 505 -0.500 -11.494 2.715 1.00 4.20 C ATOM 61 CD2 PHE A 505 0.572 -9.392 3.032 1.00 71.53 C ATOM 62 CE1 PHE A 505 0.383 -11.802 1.705 1.00 74.11 C ATOM 63 CE2 PHE A 505 1.464 -9.697 2.021 1.00 1.10 C ATOM 64 CZ PHE A 505 1.367 -10.908 1.358 1.00 52.45 C ATOM 0 H PHE A 505 -2.146 -7.393 4.470 1.00 41.03 H new ATOM 0 HA PHE A 505 -3.029 -9.880 3.145 1.00 70.54 H new ATOM 0 HB2 PHE A 505 -0.904 -9.311 5.205 1.00 34.13 H new ATOM 0 HB3 PHE A 505 -1.604 -10.908 5.031 1.00 34.13 H new ATOM 0 HD1 PHE A 505 -1.267 -12.205 2.986 1.00 4.20 H new ATOM 0 HD2 PHE A 505 0.650 -8.446 3.548 1.00 71.53 H new ATOM 0 HE1 PHE A 505 0.302 -12.746 1.186 1.00 74.11 H new ATOM 0 HE2 PHE A 505 2.235 -8.992 1.749 1.00 1.10 H new ATOM 0 HZ PHE A 505 2.064 -11.150 0.569 1.00 52.45 H new ATOM 74 N THR A 506 -4.623 -10.455 5.023 1.00 44.31 N ATOM 75 CA THR A 506 -5.634 -10.708 6.021 1.00 42.11 C ATOM 76 C THR A 506 -6.338 -12.021 5.686 1.00 53.23 C ATOM 77 O THR A 506 -5.992 -12.665 4.707 1.00 33.31 O ATOM 78 CB THR A 506 -6.668 -9.531 6.146 1.00 10.52 C ATOM 79 OG1 THR A 506 -7.548 -9.774 7.262 1.00 21.11 O ATOM 80 CG2 THR A 506 -7.495 -9.379 4.868 1.00 33.44 C ATOM 0 H THR A 506 -4.660 -11.086 4.223 1.00 44.31 H new ATOM 0 HA THR A 506 -5.145 -10.783 6.992 1.00 42.11 H new ATOM 0 HB THR A 506 -6.111 -8.607 6.305 1.00 10.52 H new ATOM 0 HG1 THR A 506 -7.418 -9.077 7.939 1.00 21.11 H new ATOM 0 HG21 THR A 506 -8.201 -8.557 4.987 1.00 33.44 H new ATOM 0 HG22 THR A 506 -6.832 -9.170 4.028 1.00 33.44 H new ATOM 0 HG23 THR A 506 -8.042 -10.302 4.677 1.00 33.44 H new ATOM 88 N PHE A 507 -7.296 -12.405 6.477 1.00 62.45 N ATOM 89 CA PHE A 507 -8.011 -13.630 6.256 1.00 4.32 C ATOM 90 C PHE A 507 -9.117 -13.417 5.252 1.00 34.32 C ATOM 91 O PHE A 507 -9.587 -12.287 5.069 1.00 65.20 O ATOM 92 CB PHE A 507 -8.585 -14.165 7.557 1.00 2.21 C ATOM 93 CG PHE A 507 -7.558 -14.660 8.519 1.00 53.21 C ATOM 94 CD1 PHE A 507 -7.101 -15.953 8.424 1.00 1.13 C ATOM 95 CD2 PHE A 507 -7.067 -13.851 9.529 1.00 73.25 C ATOM 96 CE1 PHE A 507 -6.178 -16.447 9.306 1.00 23.55 C ATOM 97 CE2 PHE A 507 -6.133 -14.332 10.422 1.00 75.32 C ATOM 98 CZ PHE A 507 -5.690 -15.636 10.311 1.00 11.13 C ATOM 0 H PHE A 507 -7.605 -11.879 7.294 1.00 62.45 H new ATOM 0 HA PHE A 507 -7.310 -14.365 5.861 1.00 4.32 H new ATOM 0 HB2 PHE A 507 -9.166 -13.377 8.036 1.00 2.21 H new ATOM 0 HB3 PHE A 507 -9.276 -14.977 7.330 1.00 2.21 H new ATOM 0 HD1 PHE A 507 -7.477 -16.591 7.638 1.00 1.13 H new ATOM 0 HD2 PHE A 507 -7.419 -12.834 9.618 1.00 73.25 H new ATOM 0 HE1 PHE A 507 -5.833 -17.467 9.216 1.00 23.55 H new ATOM 0 HE2 PHE A 507 -5.750 -13.693 11.204 1.00 75.32 H new ATOM 0 HZ PHE A 507 -4.962 -16.021 11.010 1.00 11.13 H new ATOM 108 N GLU A 508 -9.514 -14.487 4.588 1.00 30.34 N ATOM 109 CA GLU A 508 -10.584 -14.435 3.614 1.00 1.11 C ATOM 110 C GLU A 508 -11.876 -14.080 4.364 1.00 1.24 C ATOM 111 O GLU A 508 -12.620 -13.177 3.973 1.00 33.51 O ATOM 112 CB GLU A 508 -10.660 -15.801 2.893 1.00 22.04 C ATOM 113 CG GLU A 508 -11.319 -15.802 1.510 1.00 5.12 C ATOM 114 CD GLU A 508 -12.828 -15.721 1.518 1.00 30.41 C ATOM 115 OE1 GLU A 508 -13.383 -14.618 1.516 1.00 2.43 O ATOM 116 OE2 GLU A 508 -13.491 -16.790 1.484 1.00 22.13 O ATOM 0 H GLU A 508 -9.104 -15.413 4.709 1.00 30.34 H new ATOM 0 HA GLU A 508 -10.417 -13.677 2.849 1.00 1.11 H new ATOM 0 HB2 GLU A 508 -9.647 -16.190 2.790 1.00 22.04 H new ATOM 0 HB3 GLU A 508 -11.205 -16.496 3.532 1.00 22.04 H new ATOM 0 HG2 GLU A 508 -10.929 -14.960 0.938 1.00 5.12 H new ATOM 0 HG3 GLU A 508 -11.022 -16.709 0.984 1.00 5.12 H new ATOM 123 N GLU A 509 -12.082 -14.731 5.474 1.00 72.53 N ATOM 124 CA GLU A 509 -13.194 -14.443 6.325 1.00 24.30 C ATOM 125 C GLU A 509 -12.672 -14.139 7.718 1.00 41.32 C ATOM 126 O GLU A 509 -11.658 -14.677 8.116 1.00 42.13 O ATOM 127 CB GLU A 509 -14.221 -15.601 6.375 1.00 41.25 C ATOM 128 CG GLU A 509 -13.686 -16.963 6.841 1.00 23.31 C ATOM 129 CD GLU A 509 -12.931 -17.720 5.784 1.00 41.40 C ATOM 130 OE1 GLU A 509 -11.707 -17.555 5.658 1.00 41.20 O ATOM 131 OE2 GLU A 509 -13.567 -18.529 5.059 1.00 0.30 O ATOM 0 H GLU A 509 -11.478 -15.480 5.813 1.00 72.53 H new ATOM 0 HA GLU A 509 -13.722 -13.581 5.917 1.00 24.30 H new ATOM 0 HB2 GLU A 509 -15.035 -15.308 7.038 1.00 41.25 H new ATOM 0 HB3 GLU A 509 -14.648 -15.723 5.380 1.00 41.25 H new ATOM 0 HG2 GLU A 509 -13.033 -16.810 7.700 1.00 23.31 H new ATOM 0 HG3 GLU A 509 -14.523 -17.573 7.182 1.00 23.31 H new ATOM 138 N PRO A 510 -13.316 -13.239 8.460 1.00 61.54 N ATOM 139 CA PRO A 510 -12.907 -12.936 9.834 1.00 22.33 C ATOM 140 C PRO A 510 -13.355 -14.030 10.823 1.00 11.24 C ATOM 141 O PRO A 510 -12.859 -14.117 11.955 1.00 34.40 O ATOM 142 CB PRO A 510 -13.621 -11.615 10.127 1.00 63.32 C ATOM 143 CG PRO A 510 -14.824 -11.626 9.250 1.00 51.22 C ATOM 144 CD PRO A 510 -14.445 -12.394 8.012 1.00 13.45 C ATOM 0 HA PRO A 510 -11.824 -12.880 9.943 1.00 22.33 H new ATOM 0 HB2 PRO A 510 -13.899 -11.541 11.178 1.00 63.32 H new ATOM 0 HB3 PRO A 510 -12.979 -10.762 9.907 1.00 63.32 H new ATOM 0 HG2 PRO A 510 -15.668 -12.096 9.755 1.00 51.22 H new ATOM 0 HG3 PRO A 510 -15.129 -10.610 8.998 1.00 51.22 H new ATOM 0 HD2 PRO A 510 -15.275 -12.996 7.644 1.00 13.45 H new ATOM 0 HD3 PRO A 510 -14.150 -11.728 7.201 1.00 13.45 H new ATOM 152 N VAL A 511 -14.300 -14.843 10.394 1.00 13.31 N ATOM 153 CA VAL A 511 -14.836 -15.935 11.187 1.00 1.45 C ATOM 154 C VAL A 511 -15.081 -17.112 10.257 1.00 23.40 C ATOM 155 O VAL A 511 -15.747 -16.957 9.235 1.00 41.20 O ATOM 156 CB VAL A 511 -16.199 -15.564 11.866 1.00 54.13 C ATOM 157 CG1 VAL A 511 -16.723 -16.725 12.693 1.00 62.42 C ATOM 158 CG2 VAL A 511 -16.099 -14.302 12.725 1.00 62.42 C ATOM 0 H VAL A 511 -14.725 -14.763 9.470 1.00 13.31 H new ATOM 0 HA VAL A 511 -14.118 -16.168 11.973 1.00 1.45 H new ATOM 0 HB VAL A 511 -16.904 -15.353 11.062 1.00 54.13 H new ATOM 0 HG11 VAL A 511 -17.670 -16.445 13.155 1.00 62.42 H new ATOM 0 HG12 VAL A 511 -16.876 -17.591 12.049 1.00 62.42 H new ATOM 0 HG13 VAL A 511 -16.000 -16.974 13.470 1.00 62.42 H new ATOM 0 HG21 VAL A 511 -17.070 -14.089 13.173 1.00 62.42 H new ATOM 0 HG22 VAL A 511 -15.362 -14.456 13.513 1.00 62.42 H new ATOM 0 HG23 VAL A 511 -15.794 -13.461 12.102 1.00 62.42 H new ATOM 168 N THR A 512 -14.564 -18.260 10.599 1.00 34.44 N ATOM 169 CA THR A 512 -14.742 -19.431 9.797 1.00 32.42 C ATOM 170 C THR A 512 -15.369 -20.535 10.644 1.00 11.31 C ATOM 171 O THR A 512 -15.066 -20.678 11.842 1.00 1.41 O ATOM 172 CB THR A 512 -13.402 -19.920 9.141 1.00 41.41 C ATOM 173 OG1 THR A 512 -13.657 -21.001 8.226 1.00 22.43 O ATOM 174 CG2 THR A 512 -12.406 -20.392 10.185 1.00 21.33 C ATOM 0 H THR A 512 -14.008 -18.406 11.442 1.00 34.44 H new ATOM 0 HA THR A 512 -15.410 -19.176 8.975 1.00 32.42 H new ATOM 0 HB THR A 512 -12.977 -19.069 8.609 1.00 41.41 H new ATOM 0 HG1 THR A 512 -12.813 -21.295 7.823 1.00 22.43 H new ATOM 0 HG21 THR A 512 -11.492 -20.723 9.692 1.00 21.33 H new ATOM 0 HG22 THR A 512 -12.176 -19.572 10.865 1.00 21.33 H new ATOM 0 HG23 THR A 512 -12.835 -21.221 10.748 1.00 21.33 H new ATOM 182 N HIS A 513 -16.263 -21.260 10.057 1.00 10.23 N ATOM 183 CA HIS A 513 -16.898 -22.358 10.722 1.00 75.34 C ATOM 184 C HIS A 513 -16.421 -23.659 10.125 1.00 10.11 C ATOM 185 O HIS A 513 -16.556 -23.894 8.930 1.00 72.00 O ATOM 186 CB HIS A 513 -18.445 -22.227 10.724 1.00 64.01 C ATOM 187 CG HIS A 513 -19.087 -21.874 9.397 1.00 31.24 C ATOM 188 ND1 HIS A 513 -19.600 -20.626 9.112 1.00 21.20 N ATOM 189 CD2 HIS A 513 -19.324 -22.630 8.294 1.00 55.12 C ATOM 190 CE1 HIS A 513 -20.121 -20.659 7.883 1.00 10.22 C ATOM 191 NE2 HIS A 513 -19.980 -21.857 7.338 1.00 64.22 N ATOM 0 H HIS A 513 -16.578 -21.110 9.098 1.00 10.23 H new ATOM 0 HA HIS A 513 -16.608 -22.344 11.773 1.00 75.34 H new ATOM 0 HB2 HIS A 513 -18.869 -23.170 11.070 1.00 64.01 H new ATOM 0 HB3 HIS A 513 -18.724 -21.466 11.453 1.00 64.01 H new ATOM 0 HD2 HIS A 513 -19.047 -23.667 8.176 1.00 55.12 H new ATOM 0 HE1 HIS A 513 -20.595 -19.819 7.398 1.00 10.22 H new ATOM 0 HE2 HIS A 513 -20.287 -22.153 6.411 1.00 64.22 H new ATOM 199 N VAL A 514 -15.816 -24.467 10.937 1.00 14.32 N ATOM 200 CA VAL A 514 -15.279 -25.720 10.490 1.00 11.33 C ATOM 201 C VAL A 514 -16.023 -26.844 11.180 1.00 4.23 C ATOM 202 O VAL A 514 -16.695 -26.621 12.196 1.00 44.54 O ATOM 203 CB VAL A 514 -13.739 -25.832 10.743 1.00 55.53 C ATOM 204 CG1 VAL A 514 -13.001 -24.668 10.086 1.00 13.15 C ATOM 205 CG2 VAL A 514 -13.411 -25.899 12.228 1.00 70.12 C ATOM 0 H VAL A 514 -15.679 -24.280 11.930 1.00 14.32 H new ATOM 0 HA VAL A 514 -15.417 -25.789 9.411 1.00 11.33 H new ATOM 0 HB VAL A 514 -13.402 -26.765 10.290 1.00 55.53 H new ATOM 0 HG11 VAL A 514 -11.931 -24.763 10.273 1.00 13.15 H new ATOM 0 HG12 VAL A 514 -13.184 -24.681 9.012 1.00 13.15 H new ATOM 0 HG13 VAL A 514 -13.360 -23.727 10.504 1.00 13.15 H new ATOM 0 HG21 VAL A 514 -12.332 -25.976 12.359 1.00 70.12 H new ATOM 0 HG22 VAL A 514 -13.773 -24.997 12.722 1.00 70.12 H new ATOM 0 HG23 VAL A 514 -13.893 -26.772 12.668 1.00 70.12 H new ATOM 215 N SER A 515 -15.922 -28.025 10.646 1.00 71.12 N ATOM 216 CA SER A 515 -16.641 -29.136 11.183 1.00 45.34 C ATOM 217 C SER A 515 -15.851 -29.819 12.285 1.00 41.44 C ATOM 218 O SER A 515 -14.624 -29.823 12.287 1.00 13.11 O ATOM 219 CB SER A 515 -16.951 -30.149 10.082 1.00 55.30 C ATOM 220 OG SER A 515 -17.878 -31.135 10.527 1.00 44.32 O ATOM 0 H SER A 515 -15.344 -28.242 9.834 1.00 71.12 H new ATOM 0 HA SER A 515 -17.572 -28.756 11.604 1.00 45.34 H new ATOM 0 HB2 SER A 515 -17.358 -29.631 9.213 1.00 55.30 H new ATOM 0 HB3 SER A 515 -16.029 -30.633 9.761 1.00 55.30 H new ATOM 0 HG SER A 515 -18.057 -31.767 9.800 1.00 44.32 H new ATOM 226 N GLU A 516 -16.583 -30.380 13.208 1.00 34.54 N ATOM 227 CA GLU A 516 -16.074 -31.225 14.274 1.00 71.30 C ATOM 228 C GLU A 516 -15.386 -32.467 13.654 1.00 42.24 C ATOM 229 O GLU A 516 -14.429 -32.996 14.182 1.00 14.35 O ATOM 230 CB GLU A 516 -17.290 -31.662 15.101 1.00 14.12 C ATOM 231 CG GLU A 516 -17.053 -32.605 16.270 1.00 11.24 C ATOM 232 CD GLU A 516 -16.381 -31.986 17.476 1.00 50.03 C ATOM 233 OE1 GLU A 516 -16.960 -31.053 18.085 1.00 43.54 O ATOM 234 OE2 GLU A 516 -15.319 -32.472 17.884 1.00 50.23 O ATOM 0 H GLU A 516 -17.595 -30.261 13.247 1.00 34.54 H new ATOM 0 HA GLU A 516 -15.347 -30.700 14.893 1.00 71.30 H new ATOM 0 HB2 GLU A 516 -17.772 -30.764 15.488 1.00 14.12 H new ATOM 0 HB3 GLU A 516 -18.000 -32.139 14.425 1.00 14.12 H new ATOM 0 HG2 GLU A 516 -18.012 -33.018 16.582 1.00 11.24 H new ATOM 0 HG3 GLU A 516 -16.443 -33.440 15.924 1.00 11.24 H new ATOM 241 N SER A 517 -15.867 -32.869 12.487 1.00 54.13 N ATOM 242 CA SER A 517 -15.394 -34.071 11.847 1.00 32.34 C ATOM 243 C SER A 517 -14.704 -33.753 10.494 1.00 2.32 C ATOM 244 O SER A 517 -14.622 -34.606 9.613 1.00 15.42 O ATOM 245 CB SER A 517 -16.607 -35.018 11.660 1.00 54.44 C ATOM 246 OG SER A 517 -16.244 -36.291 11.124 1.00 31.12 O ATOM 0 H SER A 517 -16.590 -32.371 11.967 1.00 54.13 H new ATOM 0 HA SER A 517 -14.640 -34.555 12.468 1.00 32.34 H new ATOM 0 HB2 SER A 517 -17.100 -35.162 12.621 1.00 54.44 H new ATOM 0 HB3 SER A 517 -17.332 -34.544 10.998 1.00 54.44 H new ATOM 0 HG SER A 517 -15.558 -36.172 10.435 1.00 31.12 H new ATOM 252 N ILE A 518 -14.166 -32.547 10.344 1.00 1.53 N ATOM 253 CA ILE A 518 -13.504 -32.206 9.083 1.00 60.24 C ATOM 254 C ILE A 518 -12.077 -32.784 9.034 1.00 55.24 C ATOM 255 O ILE A 518 -11.569 -33.126 7.970 1.00 33.32 O ATOM 256 CB ILE A 518 -13.467 -30.663 8.810 1.00 71.21 C ATOM 257 CG1 ILE A 518 -12.842 -30.371 7.441 1.00 11.03 C ATOM 258 CG2 ILE A 518 -12.726 -29.916 9.907 1.00 71.30 C ATOM 259 CD1 ILE A 518 -12.698 -28.903 7.136 1.00 5.14 C ATOM 0 H ILE A 518 -14.171 -31.811 11.050 1.00 1.53 H new ATOM 0 HA ILE A 518 -14.104 -32.659 8.294 1.00 60.24 H new ATOM 0 HB ILE A 518 -14.497 -30.306 8.807 1.00 71.21 H new ATOM 0 HG12 ILE A 518 -11.859 -30.840 7.394 1.00 11.03 H new ATOM 0 HG13 ILE A 518 -13.454 -30.835 6.667 1.00 11.03 H new ATOM 0 HG21 ILE A 518 -12.722 -28.849 9.682 1.00 71.30 H new ATOM 0 HG22 ILE A 518 -13.224 -30.083 10.862 1.00 71.30 H new ATOM 0 HG23 ILE A 518 -11.700 -30.279 9.965 1.00 71.30 H new ATOM 0 HD11 ILE A 518 -12.248 -28.778 6.151 1.00 5.14 H new ATOM 0 HD12 ILE A 518 -13.680 -28.431 7.149 1.00 5.14 H new ATOM 0 HD13 ILE A 518 -12.061 -28.436 7.887 1.00 5.14 H new ATOM 271 N GLY A 519 -11.448 -32.909 10.181 1.00 23.43 N ATOM 272 CA GLY A 519 -10.095 -33.395 10.207 1.00 61.24 C ATOM 273 C GLY A 519 -9.114 -32.279 10.060 1.00 1.03 C ATOM 274 O GLY A 519 -8.537 -31.822 11.037 1.00 54.05 O ATOM 0 H GLY A 519 -11.847 -32.684 11.092 1.00 23.43 H new ATOM 0 HA2 GLY A 519 -9.913 -33.921 11.144 1.00 61.24 H new ATOM 0 HA3 GLY A 519 -9.950 -34.117 9.404 1.00 61.24 H new ATOM 278 N ILE A 520 -8.965 -31.810 8.860 1.00 72.44 N ATOM 279 CA ILE A 520 -8.042 -30.744 8.554 1.00 10.10 C ATOM 280 C ILE A 520 -8.807 -29.639 7.905 1.00 24.43 C ATOM 281 O ILE A 520 -9.514 -29.862 6.921 1.00 31.02 O ATOM 282 CB ILE A 520 -6.909 -31.194 7.581 1.00 32.44 C ATOM 283 CG1 ILE A 520 -6.023 -32.285 8.191 1.00 74.24 C ATOM 284 CG2 ILE A 520 -6.057 -30.004 7.113 1.00 51.04 C ATOM 285 CD1 ILE A 520 -5.236 -31.836 9.401 1.00 72.13 C ATOM 0 H ILE A 520 -9.483 -32.155 8.052 1.00 72.44 H new ATOM 0 HA ILE A 520 -7.573 -30.428 9.486 1.00 10.10 H new ATOM 0 HB ILE A 520 -7.403 -31.621 6.708 1.00 32.44 H new ATOM 0 HG12 ILE A 520 -6.649 -33.132 8.472 1.00 74.24 H new ATOM 0 HG13 ILE A 520 -5.328 -32.641 7.431 1.00 74.24 H new ATOM 0 HG21 ILE A 520 -5.279 -30.357 6.437 1.00 51.04 H new ATOM 0 HG22 ILE A 520 -6.690 -29.285 6.593 1.00 51.04 H new ATOM 0 HG23 ILE A 520 -5.597 -29.524 7.977 1.00 51.04 H new ATOM 0 HD11 ILE A 520 -4.635 -32.666 9.773 1.00 72.13 H new ATOM 0 HD12 ILE A 520 -4.582 -31.010 9.123 1.00 72.13 H new ATOM 0 HD13 ILE A 520 -5.923 -31.508 10.181 1.00 72.13 H new ATOM 297 N MET A 521 -8.707 -28.486 8.448 1.00 22.40 N ATOM 298 CA MET A 521 -9.358 -27.355 7.872 1.00 25.43 C ATOM 299 C MET A 521 -8.307 -26.442 7.296 1.00 25.43 C ATOM 300 O MET A 521 -7.177 -26.413 7.806 1.00 55.54 O ATOM 301 CB MET A 521 -10.228 -26.647 8.922 1.00 41.52 C ATOM 302 CG MET A 521 -9.488 -25.894 10.027 1.00 72.41 C ATOM 303 SD MET A 521 -9.036 -24.228 9.516 1.00 32.43 S ATOM 304 CE MET A 521 -8.558 -23.511 11.068 1.00 32.30 C ATOM 0 H MET A 521 -8.178 -28.291 9.298 1.00 22.40 H new ATOM 0 HA MET A 521 -10.027 -27.667 7.070 1.00 25.43 H new ATOM 0 HB2 MET A 521 -10.879 -25.941 8.406 1.00 41.52 H new ATOM 0 HB3 MET A 521 -10.872 -27.392 9.389 1.00 41.52 H new ATOM 0 HG2 MET A 521 -10.117 -25.843 10.916 1.00 72.41 H new ATOM 0 HG3 MET A 521 -8.589 -26.446 10.303 1.00 72.41 H new ATOM 0 HE1 MET A 521 -9.269 -22.732 11.343 1.00 32.30 H new ATOM 0 HE2 MET A 521 -8.549 -24.283 11.838 1.00 32.30 H new ATOM 0 HE3 MET A 521 -7.562 -23.077 10.977 1.00 32.30 H new ATOM 314 N GLU A 522 -8.644 -25.760 6.227 1.00 13.43 N ATOM 315 CA GLU A 522 -7.754 -24.814 5.606 1.00 62.42 C ATOM 316 C GLU A 522 -8.383 -23.459 5.514 1.00 65.31 C ATOM 317 O GLU A 522 -9.554 -23.319 5.150 1.00 53.20 O ATOM 318 CB GLU A 522 -7.289 -25.258 4.224 1.00 3.20 C ATOM 319 CG GLU A 522 -6.192 -26.297 4.237 1.00 33.45 C ATOM 320 CD GLU A 522 -5.804 -26.738 2.857 1.00 63.05 C ATOM 321 OE1 GLU A 522 -6.602 -27.435 2.204 1.00 5.34 O ATOM 322 OE2 GLU A 522 -4.701 -26.385 2.387 1.00 61.11 O ATOM 0 H GLU A 522 -9.548 -25.848 5.763 1.00 13.43 H new ATOM 0 HA GLU A 522 -6.875 -24.762 6.249 1.00 62.42 H new ATOM 0 HB2 GLU A 522 -8.144 -25.657 3.678 1.00 3.20 H new ATOM 0 HB3 GLU A 522 -6.939 -24.384 3.674 1.00 3.20 H new ATOM 0 HG2 GLU A 522 -5.317 -25.891 4.745 1.00 33.45 H new ATOM 0 HG3 GLU A 522 -6.522 -27.162 4.812 1.00 33.45 H new ATOM 329 N VAL A 523 -7.630 -22.479 5.876 1.00 14.23 N ATOM 330 CA VAL A 523 -8.053 -21.105 5.786 1.00 73.00 C ATOM 331 C VAL A 523 -7.115 -20.392 4.851 1.00 72.11 C ATOM 332 O VAL A 523 -5.894 -20.462 5.037 1.00 70.22 O ATOM 333 CB VAL A 523 -8.015 -20.421 7.170 1.00 75.51 C ATOM 334 CG1 VAL A 523 -8.452 -18.968 7.078 1.00 50.43 C ATOM 335 CG2 VAL A 523 -8.897 -21.166 8.138 1.00 55.03 C ATOM 0 H VAL A 523 -6.689 -22.600 6.249 1.00 14.23 H new ATOM 0 HA VAL A 523 -9.079 -21.065 5.419 1.00 73.00 H new ATOM 0 HB VAL A 523 -6.986 -20.442 7.530 1.00 75.51 H new ATOM 0 HG11 VAL A 523 -8.415 -18.513 8.068 1.00 50.43 H new ATOM 0 HG12 VAL A 523 -7.784 -18.429 6.406 1.00 50.43 H new ATOM 0 HG13 VAL A 523 -9.471 -18.918 6.694 1.00 50.43 H new ATOM 0 HG21 VAL A 523 -8.864 -20.676 9.111 1.00 55.03 H new ATOM 0 HG22 VAL A 523 -9.922 -21.169 7.768 1.00 55.03 H new ATOM 0 HG23 VAL A 523 -8.544 -22.193 8.236 1.00 55.03 H new ATOM 345 N LYS A 524 -7.660 -19.765 3.838 1.00 22.31 N ATOM 346 CA LYS A 524 -6.877 -19.048 2.885 1.00 32.21 C ATOM 347 C LYS A 524 -6.641 -17.641 3.360 1.00 30.34 C ATOM 348 O LYS A 524 -7.566 -16.954 3.819 1.00 3.40 O ATOM 349 CB LYS A 524 -7.548 -19.006 1.530 1.00 30.24 C ATOM 350 CG LYS A 524 -7.941 -20.358 0.981 1.00 41.24 C ATOM 351 CD LYS A 524 -8.148 -20.312 -0.518 1.00 60.41 C ATOM 352 CE LYS A 524 -9.088 -19.206 -0.929 1.00 14.21 C ATOM 353 NZ LYS A 524 -9.439 -19.274 -2.362 1.00 32.22 N ATOM 0 H LYS A 524 -8.664 -19.743 3.658 1.00 22.31 H new ATOM 0 HA LYS A 524 -5.927 -19.572 2.785 1.00 32.21 H new ATOM 0 HB2 LYS A 524 -8.440 -18.384 1.600 1.00 30.24 H new ATOM 0 HB3 LYS A 524 -6.876 -18.522 0.821 1.00 30.24 H new ATOM 0 HG2 LYS A 524 -7.167 -21.087 1.220 1.00 41.24 H new ATOM 0 HG3 LYS A 524 -8.857 -20.696 1.465 1.00 41.24 H new ATOM 0 HD2 LYS A 524 -7.186 -20.172 -1.012 1.00 60.41 H new ATOM 0 HD3 LYS A 524 -8.544 -21.269 -0.858 1.00 60.41 H new ATOM 0 HE2 LYS A 524 -9.998 -19.264 -0.331 1.00 14.21 H new ATOM 0 HE3 LYS A 524 -8.627 -18.242 -0.715 1.00 14.21 H new ATOM 0 HZ1 LYS A 524 -10.086 -18.495 -2.598 1.00 32.22 H new ATOM 0 HZ2 LYS A 524 -8.575 -19.192 -2.935 1.00 32.22 H new ATOM 0 HZ3 LYS A 524 -9.903 -20.183 -2.563 1.00 32.22 H new ATOM 367 N VAL A 525 -5.426 -17.223 3.269 1.00 24.33 N ATOM 368 CA VAL A 525 -5.048 -15.895 3.665 1.00 32.11 C ATOM 369 C VAL A 525 -4.907 -15.050 2.419 1.00 22.32 C ATOM 370 O VAL A 525 -4.120 -15.386 1.526 1.00 33.45 O ATOM 371 CB VAL A 525 -3.718 -15.907 4.451 1.00 25.12 C ATOM 372 CG1 VAL A 525 -3.367 -14.525 4.986 1.00 3.11 C ATOM 373 CG2 VAL A 525 -3.795 -16.908 5.575 1.00 41.12 C ATOM 0 H VAL A 525 -4.655 -17.791 2.916 1.00 24.33 H new ATOM 0 HA VAL A 525 -5.814 -15.481 4.320 1.00 32.11 H new ATOM 0 HB VAL A 525 -2.923 -16.200 3.765 1.00 25.12 H new ATOM 0 HG11 VAL A 525 -2.425 -14.575 5.533 1.00 3.11 H new ATOM 0 HG12 VAL A 525 -3.267 -13.827 4.154 1.00 3.11 H new ATOM 0 HG13 VAL A 525 -4.157 -14.182 5.654 1.00 3.11 H new ATOM 0 HG21 VAL A 525 -2.854 -16.911 6.125 1.00 41.12 H new ATOM 0 HG22 VAL A 525 -4.608 -16.637 6.249 1.00 41.12 H new ATOM 0 HG23 VAL A 525 -3.979 -17.901 5.166 1.00 41.12 H new ATOM 383 N LEU A 526 -5.684 -13.991 2.355 1.00 41.51 N ATOM 384 CA LEU A 526 -5.707 -13.097 1.225 1.00 64.41 C ATOM 385 C LEU A 526 -4.366 -12.430 1.063 1.00 53.42 C ATOM 386 O LEU A 526 -3.798 -11.881 2.025 1.00 41.21 O ATOM 387 CB LEU A 526 -6.821 -12.049 1.366 1.00 60.34 C ATOM 388 CG LEU A 526 -8.265 -12.577 1.365 1.00 52.21 C ATOM 389 CD1 LEU A 526 -9.247 -11.436 1.574 1.00 11.21 C ATOM 390 CD2 LEU A 526 -8.574 -13.301 0.057 1.00 14.11 C ATOM 0 H LEU A 526 -6.327 -13.725 3.101 1.00 41.51 H new ATOM 0 HA LEU A 526 -5.917 -13.684 0.331 1.00 64.41 H new ATOM 0 HB2 LEU A 526 -6.659 -11.502 2.295 1.00 60.34 H new ATOM 0 HB3 LEU A 526 -6.720 -11.332 0.551 1.00 60.34 H new ATOM 0 HG LEU A 526 -8.369 -13.286 2.187 1.00 52.21 H new ATOM 0 HD11 LEU A 526 -10.265 -11.827 1.571 1.00 11.21 H new ATOM 0 HD12 LEU A 526 -9.046 -10.954 2.531 1.00 11.21 H new ATOM 0 HD13 LEU A 526 -9.135 -10.708 0.771 1.00 11.21 H new ATOM 0 HD21 LEU A 526 -9.601 -13.667 0.077 1.00 14.11 H new ATOM 0 HD22 LEU A 526 -8.451 -12.612 -0.778 1.00 14.11 H new ATOM 0 HD23 LEU A 526 -7.892 -14.142 -0.063 1.00 14.11 H new ATOM 402 N ARG A 527 -3.867 -12.503 -0.131 1.00 41.34 N ATOM 403 CA ARG A 527 -2.590 -11.980 -0.475 1.00 53.43 C ATOM 404 C ARG A 527 -2.729 -10.497 -0.810 1.00 4.40 C ATOM 405 O ARG A 527 -3.817 -10.029 -1.155 1.00 31.30 O ATOM 406 CB ARG A 527 -2.043 -12.753 -1.685 1.00 34.32 C ATOM 407 CG ARG A 527 -0.623 -12.403 -2.097 1.00 24.44 C ATOM 408 CD ARG A 527 -0.294 -12.991 -3.450 1.00 45.13 C ATOM 409 NE ARG A 527 -1.128 -12.392 -4.508 1.00 62.42 N ATOM 410 CZ ARG A 527 -0.954 -12.559 -5.825 1.00 62.34 C ATOM 411 NH1 ARG A 527 -0.092 -13.447 -6.280 1.00 42.11 N ATOM 412 NH2 ARG A 527 -1.683 -11.864 -6.681 1.00 25.34 N ATOM 0 H ARG A 527 -4.354 -12.941 -0.913 1.00 41.34 H new ATOM 0 HA ARG A 527 -1.899 -12.090 0.361 1.00 53.43 H new ATOM 0 HB2 ARG A 527 -2.086 -13.819 -1.463 1.00 34.32 H new ATOM 0 HB3 ARG A 527 -2.703 -12.578 -2.535 1.00 34.32 H new ATOM 0 HG2 ARG A 527 -0.506 -11.320 -2.128 1.00 24.44 H new ATOM 0 HG3 ARG A 527 0.079 -12.778 -1.352 1.00 24.44 H new ATOM 0 HD2 ARG A 527 0.759 -12.825 -3.676 1.00 45.13 H new ATOM 0 HD3 ARG A 527 -0.449 -14.070 -3.428 1.00 45.13 H new ATOM 0 HE ARG A 527 -1.904 -11.800 -4.211 1.00 62.42 H new ATOM 0 HH11 ARG A 527 0.449 -14.014 -5.627 1.00 42.11 H new ATOM 0 HH12 ARG A 527 0.034 -13.567 -7.285 1.00 42.11 H new ATOM 0 HH21 ARG A 527 -2.378 -11.201 -6.338 1.00 25.34 H new ATOM 0 HH22 ARG A 527 -1.551 -11.991 -7.684 1.00 25.34 H new ATOM 426 N THR A 528 -1.625 -9.800 -0.722 1.00 53.04 N ATOM 427 CA THR A 528 -1.519 -8.390 -1.005 1.00 21.43 C ATOM 428 C THR A 528 -2.001 -8.026 -2.424 1.00 44.01 C ATOM 429 O THR A 528 -1.884 -8.828 -3.371 1.00 61.15 O ATOM 430 CB THR A 528 -0.038 -7.936 -0.811 1.00 64.41 C ATOM 431 OG1 THR A 528 0.172 -6.637 -1.331 1.00 43.42 O ATOM 432 CG2 THR A 528 0.928 -8.894 -1.471 1.00 13.41 C ATOM 0 H THR A 528 -0.738 -10.216 -0.439 1.00 53.04 H new ATOM 0 HA THR A 528 -2.173 -7.866 -0.308 1.00 21.43 H new ATOM 0 HB THR A 528 0.149 -7.929 0.263 1.00 64.41 H new ATOM 0 HG1 THR A 528 0.917 -6.656 -1.968 1.00 43.42 H new ATOM 0 HG21 THR A 528 1.949 -8.546 -1.315 1.00 13.41 H new ATOM 0 HG22 THR A 528 0.812 -9.886 -1.034 1.00 13.41 H new ATOM 0 HG23 THR A 528 0.720 -8.942 -2.540 1.00 13.41 H new ATOM 440 N SER A 529 -2.562 -6.820 -2.536 1.00 4.43 N ATOM 441 CA SER A 529 -3.031 -6.244 -3.773 1.00 3.12 C ATOM 442 C SER A 529 -1.856 -6.149 -4.761 1.00 4.13 C ATOM 443 O SER A 529 -2.003 -6.375 -5.971 1.00 52.22 O ATOM 444 CB SER A 529 -3.633 -4.844 -3.488 1.00 75.22 C ATOM 445 OG SER A 529 -4.255 -4.285 -4.633 1.00 23.40 O ATOM 0 H SER A 529 -2.702 -6.206 -1.733 1.00 4.43 H new ATOM 0 HA SER A 529 -3.807 -6.870 -4.214 1.00 3.12 H new ATOM 0 HB2 SER A 529 -4.362 -4.921 -2.682 1.00 75.22 H new ATOM 0 HB3 SER A 529 -2.845 -4.175 -3.142 1.00 75.22 H new ATOM 0 HG SER A 529 -4.622 -3.404 -4.409 1.00 23.40 H new ATOM 451 N GLY A 530 -0.692 -5.873 -4.217 1.00 53.13 N ATOM 452 CA GLY A 530 0.505 -5.806 -4.993 1.00 1.32 C ATOM 453 C GLY A 530 1.495 -6.794 -4.455 1.00 0.04 C ATOM 454 O GLY A 530 2.136 -6.541 -3.426 1.00 55.44 O ATOM 0 H GLY A 530 -0.559 -5.690 -3.222 1.00 53.13 H new ATOM 0 HA2 GLY A 530 0.288 -6.023 -6.039 1.00 1.32 H new ATOM 0 HA3 GLY A 530 0.921 -4.799 -4.956 1.00 1.32 H new ATOM 458 N ALA A 531 1.574 -7.945 -5.075 1.00 52.15 N ATOM 459 CA ALA A 531 2.492 -8.964 -4.637 1.00 43.21 C ATOM 460 C ALA A 531 3.795 -8.793 -5.344 1.00 35.24 C ATOM 461 O ALA A 531 3.908 -9.074 -6.520 1.00 74.52 O ATOM 462 CB ALA A 531 1.935 -10.354 -4.877 1.00 72.03 C ATOM 0 H ALA A 531 1.011 -8.199 -5.887 1.00 52.15 H new ATOM 0 HA ALA A 531 2.643 -8.856 -3.563 1.00 43.21 H new ATOM 0 HB1 ALA A 531 2.654 -11.098 -4.535 1.00 72.03 H new ATOM 0 HB2 ALA A 531 1.001 -10.472 -4.327 1.00 72.03 H new ATOM 0 HB3 ALA A 531 1.749 -10.492 -5.942 1.00 72.03 H new ATOM 468 N ARG A 532 4.752 -8.271 -4.652 1.00 24.35 N ATOM 469 CA ARG A 532 6.043 -8.051 -5.221 1.00 32.43 C ATOM 470 C ARG A 532 7.102 -8.745 -4.411 1.00 32.54 C ATOM 471 O ARG A 532 7.236 -8.508 -3.212 1.00 51.12 O ATOM 472 CB ARG A 532 6.326 -6.547 -5.358 1.00 11.14 C ATOM 473 CG ARG A 532 5.425 -5.842 -6.367 1.00 54.43 C ATOM 474 CD ARG A 532 5.596 -6.425 -7.770 1.00 65.44 C ATOM 475 NE ARG A 532 4.718 -5.778 -8.745 1.00 44.11 N ATOM 476 CZ ARG A 532 4.340 -6.305 -9.921 1.00 55.23 C ATOM 477 NH1 ARG A 532 4.700 -7.545 -10.268 1.00 54.53 N ATOM 478 NH2 ARG A 532 3.573 -5.596 -10.734 1.00 71.41 N ATOM 0 H ARG A 532 4.663 -7.985 -3.677 1.00 24.35 H new ATOM 0 HA ARG A 532 6.061 -8.480 -6.223 1.00 32.43 H new ATOM 0 HB2 ARG A 532 6.205 -6.074 -4.384 1.00 11.14 H new ATOM 0 HB3 ARG A 532 7.366 -6.408 -5.653 1.00 11.14 H new ATOM 0 HG2 ARG A 532 4.384 -5.937 -6.056 1.00 54.43 H new ATOM 0 HG3 ARG A 532 5.657 -4.777 -6.383 1.00 54.43 H new ATOM 0 HD2 ARG A 532 6.633 -6.312 -8.085 1.00 65.44 H new ATOM 0 HD3 ARG A 532 5.385 -7.494 -7.746 1.00 65.44 H new ATOM 0 HE ARG A 532 4.364 -4.850 -8.512 1.00 44.11 H new ATOM 0 HH11 ARG A 532 5.270 -8.106 -9.636 1.00 54.53 H new ATOM 0 HH12 ARG A 532 4.404 -7.930 -11.165 1.00 54.53 H new ATOM 0 HH21 ARG A 532 3.275 -4.658 -10.465 1.00 71.41 H new ATOM 0 HH22 ARG A 532 3.280 -5.987 -11.629 1.00 71.41 H new ATOM 492 N GLY A 533 7.797 -9.644 -5.055 1.00 62.51 N ATOM 493 CA GLY A 533 8.889 -10.327 -4.427 1.00 54.01 C ATOM 494 C GLY A 533 8.458 -11.554 -3.676 1.00 51.14 C ATOM 495 O GLY A 533 7.638 -12.338 -4.161 1.00 5.03 O ATOM 0 H GLY A 533 7.622 -9.920 -6.021 1.00 62.51 H new ATOM 0 HA2 GLY A 533 9.619 -10.610 -5.186 1.00 54.01 H new ATOM 0 HA3 GLY A 533 9.391 -9.645 -3.741 1.00 54.01 H new ATOM 499 N ASN A 534 9.005 -11.712 -2.503 1.00 50.42 N ATOM 500 CA ASN A 534 8.720 -12.832 -1.634 1.00 53.34 C ATOM 501 C ASN A 534 8.467 -12.296 -0.249 1.00 52.41 C ATOM 502 O ASN A 534 9.268 -11.521 0.284 1.00 60.53 O ATOM 503 CB ASN A 534 9.891 -13.836 -1.628 1.00 23.04 C ATOM 504 CG ASN A 534 9.703 -15.035 -0.683 1.00 40.41 C ATOM 505 OD1 ASN A 534 8.490 -15.493 -0.492 1.00 11.24 O flip ATOM 506 ND2 ASN A 534 10.665 -15.561 -0.151 1.00 30.00 N flip ATOM 0 H ASN A 534 9.678 -11.053 -2.111 1.00 50.42 H new ATOM 0 HA ASN A 534 7.841 -13.367 -1.993 1.00 53.34 H new ATOM 0 HB2 ASN A 534 10.038 -14.209 -2.642 1.00 23.04 H new ATOM 0 HB3 ASN A 534 10.803 -13.309 -1.347 1.00 23.04 H new ATOM 0 HD21 ASN A 534 11.602 -15.191 -0.311 1.00 30.00 H new ATOM 0 HD22 ASN A 534 10.533 -16.371 0.454 1.00 30.00 H new ATOM 513 N VAL A 535 7.347 -12.664 0.310 1.00 63.41 N ATOM 514 CA VAL A 535 6.921 -12.189 1.593 1.00 32.12 C ATOM 515 C VAL A 535 6.490 -13.367 2.438 1.00 50.35 C ATOM 516 O VAL A 535 5.777 -14.252 1.970 1.00 61.42 O ATOM 517 CB VAL A 535 5.728 -11.201 1.445 1.00 22.11 C ATOM 518 CG1 VAL A 535 5.279 -10.660 2.789 1.00 24.13 C ATOM 519 CG2 VAL A 535 6.087 -10.070 0.508 1.00 41.41 C ATOM 0 H VAL A 535 6.693 -13.316 -0.124 1.00 63.41 H new ATOM 0 HA VAL A 535 7.751 -11.666 2.068 1.00 32.12 H new ATOM 0 HB VAL A 535 4.892 -11.756 1.018 1.00 22.11 H new ATOM 0 HG11 VAL A 535 4.445 -9.974 2.645 1.00 24.13 H new ATOM 0 HG12 VAL A 535 4.964 -11.486 3.427 1.00 24.13 H new ATOM 0 HG13 VAL A 535 6.106 -10.131 3.263 1.00 24.13 H new ATOM 0 HG21 VAL A 535 5.240 -9.390 0.417 1.00 41.41 H new ATOM 0 HG22 VAL A 535 6.946 -9.529 0.904 1.00 41.41 H new ATOM 0 HG23 VAL A 535 6.334 -10.475 -0.473 1.00 41.41 H new ATOM 529 N ILE A 536 6.936 -13.394 3.645 1.00 33.41 N ATOM 530 CA ILE A 536 6.568 -14.434 4.550 1.00 33.22 C ATOM 531 C ILE A 536 5.557 -13.893 5.543 1.00 4.23 C ATOM 532 O ILE A 536 5.699 -12.763 6.032 1.00 73.22 O ATOM 533 CB ILE A 536 7.797 -15.015 5.301 1.00 71.12 C ATOM 534 CG1 ILE A 536 8.768 -15.705 4.343 1.00 60.25 C ATOM 535 CG2 ILE A 536 7.370 -15.968 6.369 1.00 41.22 C ATOM 536 CD1 ILE A 536 8.155 -16.813 3.526 1.00 44.51 C ATOM 0 H ILE A 536 7.568 -12.696 4.037 1.00 33.41 H new ATOM 0 HA ILE A 536 6.130 -15.248 3.973 1.00 33.22 H new ATOM 0 HB ILE A 536 8.316 -14.176 5.765 1.00 71.12 H new ATOM 0 HG12 ILE A 536 9.184 -14.958 3.666 1.00 60.25 H new ATOM 0 HG13 ILE A 536 9.600 -16.112 4.918 1.00 60.25 H new ATOM 0 HG21 ILE A 536 8.250 -16.360 6.879 1.00 41.22 H new ATOM 0 HG22 ILE A 536 6.735 -15.449 7.087 1.00 41.22 H new ATOM 0 HG23 ILE A 536 6.813 -16.791 5.921 1.00 41.22 H new ATOM 0 HD11 ILE A 536 8.913 -17.247 2.874 1.00 44.51 H new ATOM 0 HD12 ILE A 536 7.765 -17.583 4.192 1.00 44.51 H new ATOM 0 HD13 ILE A 536 7.343 -16.412 2.920 1.00 44.51 H new ATOM 548 N VAL A 537 4.529 -14.656 5.803 1.00 51.21 N ATOM 549 CA VAL A 537 3.526 -14.259 6.753 1.00 62.12 C ATOM 550 C VAL A 537 3.431 -15.296 7.877 1.00 61.31 C ATOM 551 O VAL A 537 2.995 -16.427 7.645 1.00 11.24 O ATOM 552 CB VAL A 537 2.134 -14.073 6.092 1.00 2.43 C ATOM 553 CG1 VAL A 537 1.117 -13.539 7.098 1.00 63.05 C ATOM 554 CG2 VAL A 537 2.236 -13.146 4.897 1.00 4.43 C ATOM 0 H VAL A 537 4.364 -15.563 5.366 1.00 51.21 H new ATOM 0 HA VAL A 537 3.828 -13.295 7.162 1.00 62.12 H new ATOM 0 HB VAL A 537 1.789 -15.048 5.749 1.00 2.43 H new ATOM 0 HG11 VAL A 537 0.150 -13.418 6.609 1.00 63.05 H new ATOM 0 HG12 VAL A 537 1.020 -14.242 7.925 1.00 63.05 H new ATOM 0 HG13 VAL A 537 1.454 -12.575 7.479 1.00 63.05 H new ATOM 0 HG21 VAL A 537 1.252 -13.026 4.445 1.00 4.43 H new ATOM 0 HG22 VAL A 537 2.607 -12.174 5.221 1.00 4.43 H new ATOM 0 HG23 VAL A 537 2.922 -13.571 4.165 1.00 4.43 H new ATOM 564 N PRO A 538 3.902 -14.952 9.081 1.00 11.43 N ATOM 565 CA PRO A 538 3.813 -15.838 10.246 1.00 51.52 C ATOM 566 C PRO A 538 2.383 -15.928 10.789 1.00 25.23 C ATOM 567 O PRO A 538 1.564 -15.036 10.553 1.00 12.41 O ATOM 568 CB PRO A 538 4.732 -15.176 11.280 1.00 34.20 C ATOM 569 CG PRO A 538 4.810 -13.744 10.880 1.00 55.42 C ATOM 570 CD PRO A 538 4.575 -13.679 9.398 1.00 23.32 C ATOM 0 HA PRO A 538 4.099 -16.861 10.001 1.00 51.52 H new ATOM 0 HB2 PRO A 538 4.330 -15.281 12.288 1.00 34.20 H new ATOM 0 HB3 PRO A 538 5.719 -15.638 11.281 1.00 34.20 H new ATOM 0 HG2 PRO A 538 4.064 -13.155 11.413 1.00 55.42 H new ATOM 0 HG3 PRO A 538 5.785 -13.327 11.133 1.00 55.42 H new ATOM 0 HD2 PRO A 538 3.955 -12.824 9.131 1.00 23.32 H new ATOM 0 HD3 PRO A 538 5.512 -13.577 8.851 1.00 23.32 H new ATOM 578 N TYR A 539 2.081 -16.996 11.492 1.00 52.22 N ATOM 579 CA TYR A 539 0.769 -17.185 12.079 1.00 21.55 C ATOM 580 C TYR A 539 0.864 -18.082 13.293 1.00 3.25 C ATOM 581 O TYR A 539 1.859 -18.821 13.456 1.00 1.41 O ATOM 582 CB TYR A 539 -0.225 -17.777 11.060 1.00 3.23 C ATOM 583 CG TYR A 539 0.125 -19.162 10.545 1.00 40.53 C ATOM 584 CD1 TYR A 539 -0.296 -20.308 11.214 1.00 32.30 C ATOM 585 CD2 TYR A 539 0.864 -19.319 9.387 1.00 45.54 C ATOM 586 CE1 TYR A 539 0.016 -21.561 10.741 1.00 42.12 C ATOM 587 CE2 TYR A 539 1.175 -20.570 8.910 1.00 52.11 C ATOM 588 CZ TYR A 539 0.750 -21.684 9.587 1.00 73.12 C ATOM 589 OH TYR A 539 1.059 -22.926 9.102 1.00 13.11 O ATOM 0 H TYR A 539 2.734 -17.758 11.674 1.00 52.22 H new ATOM 0 HA TYR A 539 0.396 -16.207 12.383 1.00 21.55 H new ATOM 0 HB2 TYR A 539 -1.212 -17.817 11.520 1.00 3.23 H new ATOM 0 HB3 TYR A 539 -0.297 -17.098 10.210 1.00 3.23 H new ATOM 0 HD1 TYR A 539 -0.877 -20.211 12.119 1.00 32.30 H new ATOM 0 HD2 TYR A 539 1.202 -18.446 8.849 1.00 45.54 H new ATOM 0 HE1 TYR A 539 -0.314 -22.441 11.273 1.00 42.12 H new ATOM 0 HE2 TYR A 539 1.753 -20.675 8.004 1.00 52.11 H new ATOM 0 HH TYR A 539 1.582 -22.835 8.278 1.00 13.11 H new ATOM 599 N LYS A 540 -0.151 -18.033 14.126 1.00 12.30 N ATOM 600 CA LYS A 540 -0.215 -18.859 15.316 1.00 15.44 C ATOM 601 C LYS A 540 -1.659 -19.102 15.728 1.00 20.14 C ATOM 602 O LYS A 540 -2.561 -18.297 15.410 1.00 65.32 O ATOM 603 CB LYS A 540 0.534 -18.212 16.482 1.00 4.42 C ATOM 604 CG LYS A 540 -0.039 -16.872 16.890 1.00 0.23 C ATOM 605 CD LYS A 540 0.513 -16.408 18.211 1.00 34.42 C ATOM 606 CE LYS A 540 -0.130 -15.106 18.614 1.00 53.43 C ATOM 607 NZ LYS A 540 0.285 -13.996 17.742 1.00 33.55 N ATOM 0 H LYS A 540 -0.957 -17.420 14.000 1.00 12.30 H new ATOM 0 HA LYS A 540 0.259 -19.810 15.073 1.00 15.44 H new ATOM 0 HB2 LYS A 540 0.511 -18.886 17.339 1.00 4.42 H new ATOM 0 HB3 LYS A 540 1.581 -18.083 16.206 1.00 4.42 H new ATOM 0 HG2 LYS A 540 0.185 -16.132 16.122 1.00 0.23 H new ATOM 0 HG3 LYS A 540 -1.125 -16.945 16.955 1.00 0.23 H new ATOM 0 HD2 LYS A 540 0.331 -17.164 18.975 1.00 34.42 H new ATOM 0 HD3 LYS A 540 1.593 -16.282 18.138 1.00 34.42 H new ATOM 0 HE2 LYS A 540 -1.214 -15.210 18.578 1.00 53.43 H new ATOM 0 HE3 LYS A 540 0.134 -14.875 19.646 1.00 53.43 H new ATOM 0 HZ1 LYS A 540 0.872 -13.330 18.284 1.00 33.55 H new ATOM 0 HZ2 LYS A 540 0.834 -14.370 16.942 1.00 33.55 H new ATOM 0 HZ3 LYS A 540 -0.557 -13.503 17.383 1.00 33.55 H new ATOM 621 N THR A 541 -1.869 -20.196 16.406 1.00 34.12 N ATOM 622 CA THR A 541 -3.143 -20.548 16.957 1.00 20.24 C ATOM 623 C THR A 541 -3.326 -19.935 18.356 1.00 54.32 C ATOM 624 O THR A 541 -2.390 -19.904 19.166 1.00 15.22 O ATOM 625 CB THR A 541 -3.282 -22.082 17.026 1.00 70.24 C ATOM 626 OG1 THR A 541 -2.020 -22.673 17.431 1.00 71.01 O ATOM 627 CG2 THR A 541 -3.720 -22.660 15.689 1.00 3.02 C ATOM 0 H THR A 541 -1.139 -20.883 16.594 1.00 34.12 H new ATOM 0 HA THR A 541 -3.920 -20.147 16.307 1.00 20.24 H new ATOM 0 HB THR A 541 -4.050 -22.319 17.763 1.00 70.24 H new ATOM 0 HG1 THR A 541 -2.081 -22.968 18.363 1.00 71.01 H new ATOM 0 HG21 THR A 541 -3.808 -23.743 15.772 1.00 3.02 H new ATOM 0 HG22 THR A 541 -4.685 -22.238 15.409 1.00 3.02 H new ATOM 0 HG23 THR A 541 -2.981 -22.414 14.927 1.00 3.02 H new ATOM 635 N ILE A 542 -4.494 -19.398 18.604 1.00 53.24 N ATOM 636 CA ILE A 542 -4.842 -18.834 19.889 1.00 54.43 C ATOM 637 C ILE A 542 -5.872 -19.742 20.540 1.00 51.43 C ATOM 638 O ILE A 542 -6.925 -20.015 19.945 1.00 41.34 O ATOM 639 CB ILE A 542 -5.476 -17.430 19.717 1.00 41.12 C ATOM 640 CG1 ILE A 542 -4.539 -16.505 18.933 1.00 12.41 C ATOM 641 CG2 ILE A 542 -5.820 -16.818 21.081 1.00 33.42 C ATOM 642 CD1 ILE A 542 -5.156 -15.177 18.568 1.00 5.25 C ATOM 0 H ILE A 542 -5.241 -19.338 17.912 1.00 53.24 H new ATOM 0 HA ILE A 542 -3.942 -18.747 20.497 1.00 54.43 H new ATOM 0 HB ILE A 542 -6.400 -17.542 19.150 1.00 41.12 H new ATOM 0 HG12 ILE A 542 -3.641 -16.327 19.525 1.00 12.41 H new ATOM 0 HG13 ILE A 542 -4.224 -17.011 18.021 1.00 12.41 H new ATOM 0 HG21 ILE A 542 -6.264 -15.833 20.936 1.00 33.42 H new ATOM 0 HG22 ILE A 542 -6.529 -17.463 21.601 1.00 33.42 H new ATOM 0 HG23 ILE A 542 -4.912 -16.723 21.677 1.00 33.42 H new ATOM 0 HD11 ILE A 542 -4.432 -14.579 18.015 1.00 5.25 H new ATOM 0 HD12 ILE A 542 -6.037 -15.343 17.949 1.00 5.25 H new ATOM 0 HD13 ILE A 542 -5.445 -14.648 19.476 1.00 5.25 H new ATOM 654 N GLU A 543 -5.579 -20.209 21.729 1.00 2.31 N ATOM 655 CA GLU A 543 -6.481 -21.082 22.454 1.00 65.53 C ATOM 656 C GLU A 543 -7.625 -20.272 23.037 1.00 61.14 C ATOM 657 O GLU A 543 -7.435 -19.510 23.987 1.00 10.25 O ATOM 658 CB GLU A 543 -5.741 -21.803 23.576 1.00 63.24 C ATOM 659 CG GLU A 543 -4.605 -22.684 23.104 1.00 52.33 C ATOM 660 CD GLU A 543 -3.768 -23.180 24.246 1.00 23.53 C ATOM 661 OE1 GLU A 543 -2.992 -22.383 24.803 1.00 31.24 O ATOM 662 OE2 GLU A 543 -3.843 -24.377 24.598 1.00 75.24 O ATOM 0 H GLU A 543 -4.712 -19.998 22.224 1.00 2.31 H new ATOM 0 HA GLU A 543 -6.877 -21.824 21.761 1.00 65.53 H new ATOM 0 HB2 GLU A 543 -5.346 -21.062 24.271 1.00 63.24 H new ATOM 0 HB3 GLU A 543 -6.453 -22.414 24.132 1.00 63.24 H new ATOM 0 HG2 GLU A 543 -5.009 -23.534 22.555 1.00 52.33 H new ATOM 0 HG3 GLU A 543 -3.977 -22.125 22.410 1.00 52.33 H new ATOM 669 N GLY A 544 -8.780 -20.397 22.441 1.00 55.44 N ATOM 670 CA GLY A 544 -9.945 -19.714 22.937 1.00 24.14 C ATOM 671 C GLY A 544 -10.665 -20.587 23.931 1.00 31.35 C ATOM 672 O GLY A 544 -10.084 -20.991 24.940 1.00 43.14 O ATOM 0 H GLY A 544 -8.940 -20.966 21.610 1.00 55.44 H new ATOM 0 HA2 GLY A 544 -9.654 -18.775 23.408 1.00 24.14 H new ATOM 0 HA3 GLY A 544 -10.610 -19.464 22.111 1.00 24.14 H new ATOM 676 N THR A 545 -11.901 -20.916 23.642 1.00 22.52 N ATOM 677 CA THR A 545 -12.661 -21.812 24.481 1.00 44.13 C ATOM 678 C THR A 545 -12.372 -23.266 24.066 1.00 33.52 C ATOM 679 O THR A 545 -12.832 -24.225 24.689 1.00 60.24 O ATOM 680 CB THR A 545 -14.175 -21.492 24.456 1.00 55.04 C ATOM 681 OG1 THR A 545 -14.894 -22.298 25.409 1.00 24.53 O ATOM 682 CG2 THR A 545 -14.698 -21.755 23.112 1.00 14.31 C ATOM 0 H THR A 545 -12.406 -20.573 22.825 1.00 22.52 H new ATOM 0 HA THR A 545 -12.346 -21.672 25.515 1.00 44.13 H new ATOM 0 HB THR A 545 -14.311 -20.443 24.721 1.00 55.04 H new ATOM 0 HG1 THR A 545 -14.404 -23.132 25.568 1.00 24.53 H new ATOM 0 HG21 THR A 545 -15.765 -21.532 23.087 1.00 14.31 H new ATOM 0 HG22 THR A 545 -14.178 -21.126 22.390 1.00 14.31 H new ATOM 0 HG23 THR A 545 -14.541 -22.804 22.859 1.00 14.31 H new ATOM 690 N ALA A 546 -11.624 -23.405 22.997 1.00 60.24 N ATOM 691 CA ALA A 546 -11.145 -24.676 22.559 1.00 22.41 C ATOM 692 C ALA A 546 -9.726 -24.831 23.069 1.00 74.13 C ATOM 693 O ALA A 546 -8.943 -23.879 23.036 1.00 10.54 O ATOM 694 CB ALA A 546 -11.199 -24.789 21.044 1.00 2.32 C ATOM 0 H ALA A 546 -11.333 -22.625 22.407 1.00 60.24 H new ATOM 0 HA ALA A 546 -11.776 -25.473 22.953 1.00 22.41 H new ATOM 0 HB1 ALA A 546 -10.828 -25.767 20.739 1.00 2.32 H new ATOM 0 HB2 ALA A 546 -12.229 -24.670 20.707 1.00 2.32 H new ATOM 0 HB3 ALA A 546 -10.579 -24.011 20.599 1.00 2.32 H new ATOM 700 N ARG A 547 -9.425 -25.990 23.554 1.00 71.20 N ATOM 701 CA ARG A 547 -8.154 -26.301 24.148 1.00 3.11 C ATOM 702 C ARG A 547 -7.158 -26.729 23.113 1.00 5.55 C ATOM 703 O ARG A 547 -7.468 -27.533 22.209 1.00 1.01 O ATOM 704 CB ARG A 547 -8.357 -27.396 25.144 1.00 4.54 C ATOM 705 CG ARG A 547 -9.192 -26.958 26.306 1.00 64.34 C ATOM 706 CD ARG A 547 -9.758 -28.150 27.029 1.00 22.34 C ATOM 707 NE ARG A 547 -10.630 -28.942 26.132 1.00 50.30 N ATOM 708 CZ ARG A 547 -11.375 -30.001 26.466 1.00 35.05 C ATOM 709 NH1 ARG A 547 -11.428 -30.427 27.719 1.00 5.50 N ATOM 710 NH2 ARG A 547 -12.072 -30.627 25.521 1.00 20.32 N ATOM 0 H ARG A 547 -10.074 -26.777 23.551 1.00 71.20 H new ATOM 0 HA ARG A 547 -7.758 -25.409 24.634 1.00 3.11 H new ATOM 0 HB2 ARG A 547 -8.835 -28.245 24.655 1.00 4.54 H new ATOM 0 HB3 ARG A 547 -7.388 -27.740 25.505 1.00 4.54 H new ATOM 0 HG2 ARG A 547 -8.588 -26.363 26.991 1.00 64.34 H new ATOM 0 HG3 ARG A 547 -10.003 -26.318 25.958 1.00 64.34 H new ATOM 0 HD2 ARG A 547 -8.946 -28.775 27.400 1.00 22.34 H new ATOM 0 HD3 ARG A 547 -10.327 -27.818 27.897 1.00 22.34 H new ATOM 0 HE ARG A 547 -10.666 -28.649 25.156 1.00 50.30 H new ATOM 0 HH11 ARG A 547 -10.896 -29.946 28.444 1.00 5.50 H new ATOM 0 HH12 ARG A 547 -12.001 -31.236 27.959 1.00 5.50 H new ATOM 0 HH21 ARG A 547 -12.034 -30.298 24.556 1.00 20.32 H new ATOM 0 HH22 ARG A 547 -12.645 -31.436 25.761 1.00 20.32 H new ATOM 724 N GLY A 548 -5.974 -26.235 23.248 1.00 71.11 N ATOM 725 CA GLY A 548 -4.935 -26.533 22.301 1.00 23.13 C ATOM 726 C GLY A 548 -4.130 -27.731 22.720 1.00 24.22 C ATOM 727 O GLY A 548 -4.551 -28.496 23.580 1.00 5.13 O ATOM 0 H GLY A 548 -5.693 -25.617 24.009 1.00 71.11 H new ATOM 0 HA2 GLY A 548 -5.377 -26.715 21.321 1.00 23.13 H new ATOM 0 HA3 GLY A 548 -4.277 -25.670 22.198 1.00 23.13 H new ATOM 731 N GLY A 549 -2.987 -27.899 22.113 1.00 13.24 N ATOM 732 CA GLY A 549 -2.093 -28.990 22.428 1.00 4.34 C ATOM 733 C GLY A 549 -2.573 -30.328 21.908 1.00 33.32 C ATOM 734 O GLY A 549 -2.059 -31.368 22.316 1.00 75.13 O ATOM 0 H GLY A 549 -2.643 -27.280 21.379 1.00 13.24 H new ATOM 0 HA2 GLY A 549 -1.110 -28.777 22.009 1.00 4.34 H new ATOM 0 HA3 GLY A 549 -1.972 -29.051 23.510 1.00 4.34 H new ATOM 738 N GLY A 550 -3.549 -30.302 21.009 1.00 33.11 N ATOM 739 CA GLY A 550 -4.099 -31.532 20.480 1.00 15.12 C ATOM 740 C GLY A 550 -5.234 -32.035 21.343 1.00 64.21 C ATOM 741 O GLY A 550 -5.539 -33.225 21.359 1.00 65.13 O ATOM 0 H GLY A 550 -3.969 -29.450 20.638 1.00 33.11 H new ATOM 0 HA2 GLY A 550 -4.456 -31.367 19.464 1.00 15.12 H new ATOM 0 HA3 GLY A 550 -3.317 -32.289 20.424 1.00 15.12 H new ATOM 745 N GLU A 551 -5.861 -31.122 22.060 1.00 35.14 N ATOM 746 CA GLU A 551 -6.925 -31.472 22.973 1.00 33.51 C ATOM 747 C GLU A 551 -8.277 -31.271 22.278 1.00 75.33 C ATOM 748 O GLU A 551 -9.069 -32.194 22.189 1.00 53.10 O ATOM 749 CB GLU A 551 -6.774 -30.636 24.236 1.00 33.33 C ATOM 750 CG GLU A 551 -7.385 -31.228 25.488 1.00 51.22 C ATOM 751 CD GLU A 551 -6.847 -30.549 26.725 1.00 73.31 C ATOM 752 OE1 GLU A 551 -5.607 -30.299 26.788 1.00 2.41 O ATOM 753 OE2 GLU A 551 -7.606 -30.272 27.657 1.00 54.23 O ATOM 0 H GLU A 551 -5.647 -30.125 22.025 1.00 35.14 H new ATOM 0 HA GLU A 551 -6.872 -32.521 23.263 1.00 33.51 H new ATOM 0 HB2 GLU A 551 -5.712 -30.469 24.415 1.00 33.33 H new ATOM 0 HB3 GLU A 551 -7.225 -29.659 24.060 1.00 33.33 H new ATOM 0 HG2 GLU A 551 -8.469 -31.122 25.453 1.00 51.22 H new ATOM 0 HG3 GLU A 551 -7.170 -32.296 25.532 1.00 51.22 H new ATOM 760 N ASP A 552 -8.534 -30.067 21.795 1.00 65.20 N ATOM 761 CA ASP A 552 -9.720 -29.822 20.948 1.00 1.12 C ATOM 762 C ASP A 552 -9.261 -29.522 19.565 1.00 75.42 C ATOM 763 O ASP A 552 -9.916 -29.838 18.583 1.00 13.14 O ATOM 764 CB ASP A 552 -10.585 -28.660 21.420 1.00 15.20 C ATOM 765 CG ASP A 552 -11.221 -28.888 22.745 1.00 25.51 C ATOM 766 OD1 ASP A 552 -11.940 -29.863 22.921 1.00 34.31 O ATOM 767 OD2 ASP A 552 -11.016 -28.079 23.640 1.00 44.23 O ATOM 0 H ASP A 552 -7.954 -29.245 21.964 1.00 65.20 H new ATOM 0 HA ASP A 552 -10.332 -30.722 21.001 1.00 1.12 H new ATOM 0 HB2 ASP A 552 -9.972 -27.760 21.471 1.00 15.20 H new ATOM 0 HB3 ASP A 552 -11.364 -28.474 20.680 1.00 15.20 H new ATOM 772 N PHE A 553 -8.131 -28.893 19.480 1.00 35.41 N ATOM 773 CA PHE A 553 -7.536 -28.619 18.225 1.00 30.02 C ATOM 774 C PHE A 553 -6.056 -28.827 18.350 1.00 52.43 C ATOM 775 O PHE A 553 -5.478 -28.694 19.450 1.00 64.13 O ATOM 776 CB PHE A 553 -7.868 -27.196 17.712 1.00 32.11 C ATOM 777 CG PHE A 553 -7.251 -26.063 18.491 1.00 14.13 C ATOM 778 CD1 PHE A 553 -7.876 -25.547 19.610 1.00 63.31 C ATOM 779 CD2 PHE A 553 -6.045 -25.512 18.089 1.00 10.12 C ATOM 780 CE1 PHE A 553 -7.306 -24.504 20.313 1.00 41.11 C ATOM 781 CE2 PHE A 553 -5.476 -24.474 18.786 1.00 62.31 C ATOM 782 CZ PHE A 553 -6.105 -23.967 19.899 1.00 55.12 C ATOM 0 H PHE A 553 -7.600 -28.558 20.284 1.00 35.41 H new ATOM 0 HA PHE A 553 -7.946 -29.302 17.481 1.00 30.02 H new ATOM 0 HB2 PHE A 553 -7.544 -27.118 16.674 1.00 32.11 H new ATOM 0 HB3 PHE A 553 -8.951 -27.070 17.718 1.00 32.11 H new ATOM 0 HD1 PHE A 553 -8.818 -25.963 19.937 1.00 63.31 H new ATOM 0 HD2 PHE A 553 -5.545 -25.904 17.215 1.00 10.12 H new ATOM 0 HE1 PHE A 553 -7.801 -24.109 21.188 1.00 41.11 H new ATOM 0 HE2 PHE A 553 -4.535 -24.056 18.460 1.00 62.31 H new ATOM 0 HZ PHE A 553 -5.660 -23.150 20.448 1.00 55.12 H new ATOM 792 N GLU A 554 -5.472 -29.210 17.281 1.00 24.35 N ATOM 793 CA GLU A 554 -4.065 -29.417 17.194 1.00 0.45 C ATOM 794 C GLU A 554 -3.458 -28.066 16.790 1.00 52.00 C ATOM 795 O GLU A 554 -3.869 -27.475 15.778 1.00 60.45 O ATOM 796 CB GLU A 554 -3.850 -30.479 16.121 1.00 32.01 C ATOM 797 CG GLU A 554 -2.578 -31.297 16.193 1.00 33.43 C ATOM 798 CD GLU A 554 -1.325 -30.517 15.970 1.00 63.31 C ATOM 799 OE1 GLU A 554 -1.097 -30.058 14.845 1.00 71.32 O ATOM 800 OE2 GLU A 554 -0.540 -30.370 16.915 1.00 23.14 O ATOM 0 H GLU A 554 -5.969 -29.396 16.410 1.00 24.35 H new ATOM 0 HA GLU A 554 -3.603 -29.754 18.122 1.00 0.45 H new ATOM 0 HB2 GLU A 554 -4.695 -31.167 16.154 1.00 32.01 H new ATOM 0 HB3 GLU A 554 -3.879 -29.986 15.149 1.00 32.01 H new ATOM 0 HG2 GLU A 554 -2.524 -31.775 17.171 1.00 33.43 H new ATOM 0 HG3 GLU A 554 -2.631 -32.094 15.451 1.00 33.43 H new ATOM 807 N ASP A 555 -2.534 -27.570 17.586 1.00 21.53 N ATOM 808 CA ASP A 555 -1.935 -26.248 17.351 1.00 24.23 C ATOM 809 C ASP A 555 -1.090 -26.210 16.119 1.00 42.10 C ATOM 810 O ASP A 555 -0.550 -27.221 15.685 1.00 71.14 O ATOM 811 CB ASP A 555 -1.081 -25.772 18.526 1.00 42.13 C ATOM 812 CG ASP A 555 -1.870 -25.229 19.670 1.00 51.13 C ATOM 813 OD1 ASP A 555 -2.242 -24.041 19.630 1.00 70.14 O ATOM 814 OD2 ASP A 555 -2.083 -25.952 20.648 1.00 2.23 O ATOM 0 H ASP A 555 -2.172 -28.055 18.407 1.00 21.53 H new ATOM 0 HA ASP A 555 -2.787 -25.580 17.227 1.00 24.23 H new ATOM 0 HB2 ASP A 555 -0.473 -26.604 18.880 1.00 42.13 H new ATOM 0 HB3 ASP A 555 -0.394 -25.002 18.174 1.00 42.13 H new ATOM 819 N THR A 556 -0.968 -25.049 15.563 1.00 4.12 N ATOM 820 CA THR A 556 -0.133 -24.855 14.448 1.00 23.35 C ATOM 821 C THR A 556 0.437 -23.458 14.500 1.00 23.43 C ATOM 822 O THR A 556 -0.237 -22.492 14.893 1.00 63.33 O ATOM 823 CB THR A 556 -0.832 -25.143 13.091 1.00 35.24 C ATOM 824 OG1 THR A 556 0.100 -25.012 12.004 1.00 25.22 O ATOM 825 CG2 THR A 556 -2.007 -24.222 12.861 1.00 34.32 C ATOM 0 H THR A 556 -1.453 -24.210 15.880 1.00 4.12 H new ATOM 0 HA THR A 556 0.675 -25.585 14.504 1.00 23.35 H new ATOM 0 HB THR A 556 -1.202 -26.167 13.131 1.00 35.24 H new ATOM 0 HG1 THR A 556 -0.357 -25.198 11.157 1.00 25.22 H new ATOM 0 HG21 THR A 556 -2.469 -24.455 11.902 1.00 34.32 H new ATOM 0 HG22 THR A 556 -2.738 -24.358 13.658 1.00 34.32 H new ATOM 0 HG23 THR A 556 -1.663 -23.188 12.857 1.00 34.32 H new ATOM 833 N CYS A 557 1.664 -23.373 14.167 1.00 63.31 N ATOM 834 CA CYS A 557 2.399 -22.158 14.177 1.00 61.21 C ATOM 835 C CYS A 557 3.428 -22.252 13.085 1.00 41.54 C ATOM 836 O CYS A 557 3.928 -23.351 12.802 1.00 11.12 O ATOM 837 CB CYS A 557 3.048 -21.984 15.552 1.00 41.40 C ATOM 838 SG CYS A 557 3.962 -23.446 16.126 1.00 50.22 S ATOM 0 H CYS A 557 2.214 -24.178 13.866 1.00 63.31 H new ATOM 0 HA CYS A 557 1.762 -21.291 13.999 1.00 61.21 H new ATOM 0 HB2 CYS A 557 3.728 -21.133 15.517 1.00 41.40 H new ATOM 0 HB3 CYS A 557 2.274 -21.743 16.280 1.00 41.40 H new ATOM 0 HG CYS A 557 4.477 -23.204 17.295 1.00 50.22 H new ATOM 844 N GLY A 558 3.704 -21.176 12.427 1.00 5.52 N ATOM 845 CA GLY A 558 4.654 -21.219 11.382 1.00 72.51 C ATOM 846 C GLY A 558 4.506 -20.048 10.499 1.00 22.13 C ATOM 847 O GLY A 558 3.905 -19.049 10.900 1.00 24.20 O ATOM 0 H GLY A 558 3.284 -20.262 12.598 1.00 5.52 H new ATOM 0 HA2 GLY A 558 5.661 -21.242 11.799 1.00 72.51 H new ATOM 0 HA3 GLY A 558 4.527 -22.135 10.805 1.00 72.51 H new ATOM 851 N GLU A 559 4.997 -20.162 9.297 1.00 42.22 N ATOM 852 CA GLU A 559 5.021 -19.062 8.379 1.00 0.53 C ATOM 853 C GLU A 559 4.612 -19.512 6.974 1.00 74.03 C ATOM 854 O GLU A 559 4.978 -20.602 6.529 1.00 62.53 O ATOM 855 CB GLU A 559 6.423 -18.454 8.360 1.00 74.03 C ATOM 856 CG GLU A 559 6.885 -17.858 9.691 1.00 50.50 C ATOM 857 CD GLU A 559 8.272 -17.267 9.631 1.00 14.25 C ATOM 858 OE1 GLU A 559 9.262 -18.028 9.728 1.00 52.13 O ATOM 859 OE2 GLU A 559 8.411 -16.030 9.509 1.00 40.14 O ATOM 0 H GLU A 559 5.393 -21.026 8.926 1.00 42.22 H new ATOM 0 HA GLU A 559 4.303 -18.310 8.707 1.00 0.53 H new ATOM 0 HB2 GLU A 559 7.133 -19.224 8.057 1.00 74.03 H new ATOM 0 HB3 GLU A 559 6.455 -17.674 7.599 1.00 74.03 H new ATOM 0 HG2 GLU A 559 6.181 -17.085 9.999 1.00 50.50 H new ATOM 0 HG3 GLU A 559 6.861 -18.634 10.456 1.00 50.50 H new ATOM 866 N LEU A 560 3.843 -18.682 6.305 1.00 3.23 N ATOM 867 CA LEU A 560 3.378 -18.936 4.952 1.00 72.02 C ATOM 868 C LEU A 560 4.221 -18.160 3.968 1.00 41.44 C ATOM 869 O LEU A 560 4.565 -16.999 4.221 1.00 64.21 O ATOM 870 CB LEU A 560 1.921 -18.508 4.810 1.00 44.35 C ATOM 871 CG LEU A 560 0.916 -19.256 5.674 1.00 72.24 C ATOM 872 CD1 LEU A 560 -0.464 -18.659 5.510 1.00 64.15 C ATOM 873 CD2 LEU A 560 0.903 -20.739 5.323 1.00 43.22 C ATOM 0 H LEU A 560 3.516 -17.796 6.689 1.00 3.23 H new ATOM 0 HA LEU A 560 3.463 -20.003 4.747 1.00 72.02 H new ATOM 0 HB2 LEU A 560 1.851 -17.446 5.044 1.00 44.35 H new ATOM 0 HB3 LEU A 560 1.630 -18.624 3.766 1.00 44.35 H new ATOM 0 HG LEU A 560 1.216 -19.156 6.717 1.00 72.24 H new ATOM 0 HD11 LEU A 560 -1.173 -19.204 6.134 1.00 64.15 H new ATOM 0 HD12 LEU A 560 -0.446 -17.612 5.812 1.00 64.15 H new ATOM 0 HD13 LEU A 560 -0.770 -18.731 4.466 1.00 64.15 H new ATOM 0 HD21 LEU A 560 0.178 -21.255 5.952 1.00 43.22 H new ATOM 0 HD22 LEU A 560 0.628 -20.863 4.276 1.00 43.22 H new ATOM 0 HD23 LEU A 560 1.894 -21.161 5.490 1.00 43.22 H new ATOM 885 N GLU A 561 4.549 -18.782 2.858 1.00 10.43 N ATOM 886 CA GLU A 561 5.384 -18.154 1.868 1.00 12.12 C ATOM 887 C GLU A 561 4.558 -17.608 0.702 1.00 64.45 C ATOM 888 O GLU A 561 3.989 -18.369 -0.092 1.00 64.43 O ATOM 889 CB GLU A 561 6.427 -19.139 1.355 1.00 60.24 C ATOM 890 CG GLU A 561 7.513 -18.504 0.502 1.00 55.12 C ATOM 891 CD GLU A 561 8.471 -19.516 -0.089 1.00 55.54 C ATOM 892 OE1 GLU A 561 8.015 -20.509 -0.697 1.00 62.21 O ATOM 893 OE2 GLU A 561 9.700 -19.328 0.030 1.00 60.34 O ATOM 0 H GLU A 561 4.247 -19.727 2.621 1.00 10.43 H new ATOM 0 HA GLU A 561 5.888 -17.313 2.344 1.00 12.12 H new ATOM 0 HB2 GLU A 561 6.892 -19.635 2.207 1.00 60.24 H new ATOM 0 HB3 GLU A 561 5.926 -19.911 0.771 1.00 60.24 H new ATOM 0 HG2 GLU A 561 7.048 -17.938 -0.305 1.00 55.12 H new ATOM 0 HG3 GLU A 561 8.074 -17.793 1.108 1.00 55.12 H new ATOM 900 N PHE A 562 4.483 -16.305 0.616 1.00 73.31 N ATOM 901 CA PHE A 562 3.807 -15.642 -0.472 1.00 50.44 C ATOM 902 C PHE A 562 4.823 -15.014 -1.386 1.00 21.31 C ATOM 903 O PHE A 562 5.897 -14.603 -0.946 1.00 35.33 O ATOM 904 CB PHE A 562 2.855 -14.559 0.029 1.00 73.31 C ATOM 905 CG PHE A 562 1.622 -15.066 0.699 1.00 75.42 C ATOM 906 CD1 PHE A 562 0.484 -15.305 -0.044 1.00 52.21 C ATOM 907 CD2 PHE A 562 1.585 -15.276 2.064 1.00 24.33 C ATOM 908 CE1 PHE A 562 -0.669 -15.747 0.558 1.00 3.32 C ATOM 909 CE2 PHE A 562 0.430 -15.717 2.675 1.00 53.52 C ATOM 910 CZ PHE A 562 -0.699 -15.951 1.917 1.00 22.12 C ATOM 0 H PHE A 562 4.891 -15.670 1.302 1.00 73.31 H new ATOM 0 HA PHE A 562 3.222 -16.392 -1.005 1.00 50.44 H new ATOM 0 HB2 PHE A 562 3.393 -13.918 0.728 1.00 73.31 H new ATOM 0 HB3 PHE A 562 2.562 -13.935 -0.815 1.00 73.31 H new ATOM 0 HD1 PHE A 562 0.500 -15.143 -1.112 1.00 52.21 H new ATOM 0 HD2 PHE A 562 2.468 -15.093 2.658 1.00 24.33 H new ATOM 0 HE1 PHE A 562 -1.551 -15.934 -0.036 1.00 3.32 H new ATOM 0 HE2 PHE A 562 0.409 -15.879 3.743 1.00 53.52 H new ATOM 0 HZ PHE A 562 -1.606 -16.294 2.392 1.00 22.12 H new ATOM 920 N GLN A 563 4.512 -14.941 -2.641 1.00 62.34 N ATOM 921 CA GLN A 563 5.392 -14.343 -3.610 1.00 61.31 C ATOM 922 C GLN A 563 4.563 -13.623 -4.635 1.00 51.14 C ATOM 923 O GLN A 563 3.335 -13.586 -4.523 1.00 32.04 O ATOM 924 CB GLN A 563 6.276 -15.385 -4.322 1.00 71.03 C ATOM 925 CG GLN A 563 7.139 -16.239 -3.416 1.00 50.11 C ATOM 926 CD GLN A 563 8.100 -17.105 -4.183 1.00 2.12 C ATOM 927 OE1 GLN A 563 7.789 -18.240 -4.555 1.00 31.23 O ATOM 928 NE2 GLN A 563 9.262 -16.580 -4.440 1.00 3.32 N ATOM 0 H GLN A 563 3.638 -15.294 -3.030 1.00 62.34 H new ATOM 0 HA GLN A 563 6.053 -13.656 -3.082 1.00 61.31 H new ATOM 0 HB2 GLN A 563 5.633 -16.042 -4.907 1.00 71.03 H new ATOM 0 HB3 GLN A 563 6.924 -14.864 -5.027 1.00 71.03 H new ATOM 0 HG2 GLN A 563 7.698 -15.594 -2.738 1.00 50.11 H new ATOM 0 HG3 GLN A 563 6.499 -16.870 -2.799 1.00 50.11 H new ATOM 0 HE21 GLN A 563 9.479 -15.638 -4.114 1.00 3.32 H new ATOM 0 HE22 GLN A 563 9.956 -17.110 -4.967 1.00 3.32 H new ATOM 937 N ASN A 564 5.231 -13.068 -5.625 1.00 24.21 N ATOM 938 CA ASN A 564 4.587 -12.374 -6.741 1.00 71.42 C ATOM 939 C ASN A 564 3.829 -13.396 -7.578 1.00 22.31 C ATOM 940 O ASN A 564 2.730 -13.129 -8.078 1.00 51.21 O ATOM 941 CB ASN A 564 5.678 -11.686 -7.606 1.00 12.55 C ATOM 942 CG ASN A 564 5.177 -10.718 -8.716 1.00 12.01 C ATOM 943 OD1 ASN A 564 5.860 -9.743 -9.037 1.00 22.44 O ATOM 944 ND2 ASN A 564 4.043 -10.967 -9.319 1.00 24.23 N ATOM 0 H ASN A 564 6.249 -13.082 -5.686 1.00 24.21 H new ATOM 0 HA ASN A 564 3.894 -11.619 -6.371 1.00 71.42 H new ATOM 0 HB2 ASN A 564 6.339 -11.130 -6.942 1.00 12.55 H new ATOM 0 HB3 ASN A 564 6.280 -12.463 -8.077 1.00 12.55 H new ATOM 0 HD21 ASN A 564 3.715 -10.351 -10.063 1.00 24.23 H new ATOM 0 HD22 ASN A 564 3.487 -11.777 -9.045 1.00 24.23 H new ATOM 951 N ASP A 565 4.423 -14.557 -7.723 1.00 73.13 N ATOM 952 CA ASP A 565 3.838 -15.622 -8.519 1.00 13.21 C ATOM 953 C ASP A 565 2.844 -16.457 -7.708 1.00 12.11 C ATOM 954 O ASP A 565 1.796 -16.850 -8.222 1.00 43.33 O ATOM 955 CB ASP A 565 4.936 -16.515 -9.090 1.00 31.05 C ATOM 956 CG ASP A 565 4.415 -17.577 -10.024 1.00 45.45 C ATOM 957 OD1 ASP A 565 4.268 -17.300 -11.235 1.00 3.14 O ATOM 958 OD2 ASP A 565 4.155 -18.709 -9.575 1.00 44.01 O ATOM 0 H ASP A 565 5.319 -14.794 -7.298 1.00 73.13 H new ATOM 0 HA ASP A 565 3.288 -15.159 -9.338 1.00 13.21 H new ATOM 0 HB2 ASP A 565 5.658 -15.896 -9.622 1.00 31.05 H new ATOM 0 HB3 ASP A 565 5.470 -16.993 -8.269 1.00 31.05 H new ATOM 963 N GLU A 566 3.161 -16.697 -6.436 1.00 61.11 N ATOM 964 CA GLU A 566 2.327 -17.505 -5.549 1.00 24.45 C ATOM 965 C GLU A 566 0.940 -16.910 -5.370 1.00 64.31 C ATOM 966 O GLU A 566 0.807 -15.710 -5.146 1.00 65.34 O ATOM 967 CB GLU A 566 2.992 -17.651 -4.198 1.00 52.41 C ATOM 968 CG GLU A 566 4.281 -18.439 -4.215 1.00 52.20 C ATOM 969 CD GLU A 566 4.095 -19.826 -4.753 1.00 4.24 C ATOM 970 OE1 GLU A 566 3.502 -20.655 -4.074 1.00 62.12 O ATOM 971 OE2 GLU A 566 4.533 -20.106 -5.883 1.00 54.21 O ATOM 0 H GLU A 566 4.005 -16.336 -5.992 1.00 61.11 H new ATOM 0 HA GLU A 566 2.214 -18.484 -6.015 1.00 24.45 H new ATOM 0 HB2 GLU A 566 3.194 -16.658 -3.797 1.00 52.41 H new ATOM 0 HB3 GLU A 566 2.294 -18.135 -3.514 1.00 52.41 H new ATOM 0 HG2 GLU A 566 5.018 -17.912 -4.822 1.00 52.20 H new ATOM 0 HG3 GLU A 566 4.683 -18.495 -3.203 1.00 52.20 H new ATOM 978 N ILE A 567 -0.063 -17.759 -5.442 1.00 71.25 N ATOM 979 CA ILE A 567 -1.455 -17.344 -5.361 1.00 74.11 C ATOM 980 C ILE A 567 -1.939 -17.054 -3.925 1.00 0.13 C ATOM 981 O ILE A 567 -1.932 -15.902 -3.488 1.00 72.53 O ATOM 982 CB ILE A 567 -2.426 -18.330 -6.087 1.00 11.21 C ATOM 983 CG1 ILE A 567 -2.064 -19.805 -5.797 1.00 41.30 C ATOM 984 CG2 ILE A 567 -2.434 -18.064 -7.586 1.00 1.02 C ATOM 985 CD1 ILE A 567 -3.138 -20.784 -6.174 1.00 24.32 C ATOM 0 H ILE A 567 0.061 -18.765 -5.559 1.00 71.25 H new ATOM 0 HA ILE A 567 -1.483 -16.395 -5.896 1.00 74.11 H new ATOM 0 HB ILE A 567 -3.428 -18.155 -5.695 1.00 11.21 H new ATOM 0 HG12 ILE A 567 -1.151 -20.057 -6.337 1.00 41.30 H new ATOM 0 HG13 ILE A 567 -1.846 -19.912 -4.735 1.00 41.30 H new ATOM 0 HG21 ILE A 567 -3.116 -18.760 -8.075 1.00 1.02 H new ATOM 0 HG22 ILE A 567 -2.763 -17.042 -7.772 1.00 1.02 H new ATOM 0 HG23 ILE A 567 -1.429 -18.200 -7.985 1.00 1.02 H new ATOM 0 HD11 ILE A 567 -2.807 -21.796 -5.939 1.00 24.32 H new ATOM 0 HD12 ILE A 567 -4.047 -20.561 -5.615 1.00 24.32 H new ATOM 0 HD13 ILE A 567 -3.341 -20.708 -7.242 1.00 24.32 H new ATOM 997 N VAL A 568 -2.342 -18.081 -3.205 1.00 5.34 N ATOM 998 CA VAL A 568 -2.869 -17.940 -1.875 1.00 13.55 C ATOM 999 C VAL A 568 -2.393 -19.124 -1.035 1.00 2.21 C ATOM 1000 O VAL A 568 -2.143 -20.205 -1.577 1.00 33.51 O ATOM 1001 CB VAL A 568 -4.442 -17.855 -1.907 1.00 21.31 C ATOM 1002 CG1 VAL A 568 -5.089 -19.116 -2.453 1.00 41.53 C ATOM 1003 CG2 VAL A 568 -5.031 -17.517 -0.559 1.00 33.14 C ATOM 0 H VAL A 568 -2.310 -19.045 -3.536 1.00 5.34 H new ATOM 0 HA VAL A 568 -2.507 -17.014 -1.428 1.00 13.55 H new ATOM 0 HB VAL A 568 -4.667 -17.038 -2.592 1.00 21.31 H new ATOM 0 HG11 VAL A 568 -6.173 -18.999 -2.451 1.00 41.53 H new ATOM 0 HG12 VAL A 568 -4.745 -19.290 -3.473 1.00 41.53 H new ATOM 0 HG13 VAL A 568 -4.815 -19.966 -1.828 1.00 41.53 H new ATOM 0 HG21 VAL A 568 -6.117 -17.471 -0.638 1.00 33.14 H new ATOM 0 HG22 VAL A 568 -4.752 -18.284 0.163 1.00 33.14 H new ATOM 0 HG23 VAL A 568 -4.650 -16.551 -0.227 1.00 33.14 H new ATOM 1013 N LYS A 569 -2.244 -18.919 0.250 1.00 74.04 N ATOM 1014 CA LYS A 569 -1.783 -19.958 1.152 1.00 52.41 C ATOM 1015 C LYS A 569 -2.878 -20.343 2.097 1.00 4.44 C ATOM 1016 O LYS A 569 -3.818 -19.572 2.328 1.00 3.24 O ATOM 1017 CB LYS A 569 -0.601 -19.472 1.978 1.00 44.15 C ATOM 1018 CG LYS A 569 0.701 -19.279 1.229 1.00 41.11 C ATOM 1019 CD LYS A 569 1.640 -20.475 1.327 1.00 32.00 C ATOM 1020 CE LYS A 569 1.120 -21.697 0.590 1.00 71.34 C ATOM 1021 NZ LYS A 569 2.103 -22.791 0.598 1.00 72.34 N ATOM 0 H LYS A 569 -2.438 -18.027 0.706 1.00 74.04 H new ATOM 0 HA LYS A 569 -1.484 -20.813 0.545 1.00 52.41 H new ATOM 0 HB2 LYS A 569 -0.873 -18.524 2.442 1.00 44.15 H new ATOM 0 HB3 LYS A 569 -0.430 -20.185 2.785 1.00 44.15 H new ATOM 0 HG2 LYS A 569 0.482 -19.084 0.179 1.00 41.11 H new ATOM 0 HG3 LYS A 569 1.208 -18.396 1.618 1.00 41.11 H new ATOM 0 HD2 LYS A 569 2.614 -20.200 0.922 1.00 32.00 H new ATOM 0 HD3 LYS A 569 1.791 -20.727 2.377 1.00 32.00 H new ATOM 0 HE2 LYS A 569 0.194 -22.036 1.054 1.00 71.34 H new ATOM 0 HE3 LYS A 569 0.882 -21.428 -0.439 1.00 71.34 H new ATOM 0 HZ1 LYS A 569 1.716 -23.609 0.086 1.00 72.34 H new ATOM 0 HZ2 LYS A 569 2.978 -22.475 0.133 1.00 72.34 H new ATOM 0 HZ3 LYS A 569 2.311 -23.063 1.580 1.00 72.34 H new ATOM 1035 N THR A 570 -2.742 -21.503 2.653 1.00 54.03 N ATOM 1036 CA THR A 570 -3.690 -22.031 3.593 1.00 42.35 C ATOM 1037 C THR A 570 -3.023 -22.513 4.865 1.00 51.20 C ATOM 1038 O THR A 570 -1.864 -22.946 4.850 1.00 52.21 O ATOM 1039 CB THR A 570 -4.471 -23.203 2.985 1.00 42.12 C ATOM 1040 OG1 THR A 570 -3.599 -24.005 2.165 1.00 61.53 O ATOM 1041 CG2 THR A 570 -5.666 -22.732 2.189 1.00 43.11 C ATOM 0 H THR A 570 -1.956 -22.125 2.466 1.00 54.03 H new ATOM 0 HA THR A 570 -4.368 -21.212 3.835 1.00 42.35 H new ATOM 0 HB THR A 570 -4.851 -23.812 3.806 1.00 42.12 H new ATOM 0 HG1 THR A 570 -3.987 -24.898 2.051 1.00 61.53 H new ATOM 0 HG21 THR A 570 -6.191 -23.594 1.776 1.00 43.11 H new ATOM 0 HG22 THR A 570 -6.340 -22.174 2.840 1.00 43.11 H new ATOM 0 HG23 THR A 570 -5.331 -22.088 1.376 1.00 43.11 H new ATOM 1049 N ILE A 571 -3.726 -22.382 5.958 1.00 21.41 N ATOM 1050 CA ILE A 571 -3.299 -22.963 7.205 1.00 74.25 C ATOM 1051 C ILE A 571 -4.081 -24.242 7.380 1.00 23.25 C ATOM 1052 O ILE A 571 -5.301 -24.220 7.268 1.00 63.23 O ATOM 1053 CB ILE A 571 -3.552 -22.049 8.464 1.00 1.31 C ATOM 1054 CG1 ILE A 571 -2.768 -20.741 8.412 1.00 64.34 C ATOM 1055 CG2 ILE A 571 -3.205 -22.779 9.743 1.00 15.25 C ATOM 1056 CD1 ILE A 571 -3.332 -19.701 7.494 1.00 75.54 C ATOM 0 H ILE A 571 -4.608 -21.872 6.011 1.00 21.41 H new ATOM 0 HA ILE A 571 -2.221 -23.113 7.151 1.00 74.25 H new ATOM 0 HB ILE A 571 -4.615 -21.808 8.449 1.00 1.31 H new ATOM 0 HG12 ILE A 571 -2.716 -20.326 9.419 1.00 64.34 H new ATOM 0 HG13 ILE A 571 -1.746 -20.960 8.104 1.00 64.34 H new ATOM 0 HG21 ILE A 571 -3.389 -22.126 10.596 1.00 15.25 H new ATOM 0 HG22 ILE A 571 -3.823 -23.673 9.831 1.00 15.25 H new ATOM 0 HG23 ILE A 571 -2.153 -23.065 9.725 1.00 15.25 H new ATOM 0 HD11 ILE A 571 -2.706 -18.809 7.526 1.00 75.54 H new ATOM 0 HD12 ILE A 571 -3.358 -20.090 6.476 1.00 75.54 H new ATOM 0 HD13 ILE A 571 -4.343 -19.446 7.811 1.00 75.54 H new ATOM 1068 N SER A 572 -3.396 -25.327 7.602 1.00 30.34 N ATOM 1069 CA SER A 572 -4.018 -26.604 7.821 1.00 73.22 C ATOM 1070 C SER A 572 -4.033 -26.899 9.317 1.00 30.04 C ATOM 1071 O SER A 572 -2.976 -26.986 9.954 1.00 70.45 O ATOM 1072 CB SER A 572 -3.253 -27.680 7.025 1.00 53.42 C ATOM 1073 OG SER A 572 -1.845 -27.562 7.208 1.00 25.41 O ATOM 0 H SER A 572 -2.377 -25.351 7.637 1.00 30.34 H new ATOM 0 HA SER A 572 -5.050 -26.601 7.470 1.00 73.22 H new ATOM 0 HB2 SER A 572 -3.580 -28.670 7.342 1.00 53.42 H new ATOM 0 HB3 SER A 572 -3.492 -27.589 5.965 1.00 53.42 H new ATOM 0 HG SER A 572 -1.654 -27.349 8.145 1.00 25.41 H new ATOM 1079 N VAL A 573 -5.212 -26.981 9.891 1.00 10.54 N ATOM 1080 CA VAL A 573 -5.340 -27.233 11.318 1.00 13.44 C ATOM 1081 C VAL A 573 -6.098 -28.523 11.546 1.00 24.50 C ATOM 1082 O VAL A 573 -7.164 -28.733 10.944 1.00 2.01 O ATOM 1083 CB VAL A 573 -6.078 -26.063 12.049 1.00 53.54 C ATOM 1084 CG1 VAL A 573 -6.190 -26.303 13.548 1.00 54.11 C ATOM 1085 CG2 VAL A 573 -5.390 -24.743 11.791 1.00 73.32 C ATOM 0 H VAL A 573 -6.098 -26.878 9.397 1.00 10.54 H new ATOM 0 HA VAL A 573 -4.334 -27.311 11.731 1.00 13.44 H new ATOM 0 HB VAL A 573 -7.087 -26.025 11.639 1.00 53.54 H new ATOM 0 HG11 VAL A 573 -6.709 -25.465 14.013 1.00 54.11 H new ATOM 0 HG12 VAL A 573 -6.749 -27.221 13.729 1.00 54.11 H new ATOM 0 HG13 VAL A 573 -5.192 -26.395 13.977 1.00 54.11 H new ATOM 0 HG21 VAL A 573 -5.923 -23.947 12.311 1.00 73.32 H new ATOM 0 HG22 VAL A 573 -4.364 -24.790 12.155 1.00 73.32 H new ATOM 0 HG23 VAL A 573 -5.386 -24.538 10.720 1.00 73.32 H new ATOM 1095 N LYS A 574 -5.544 -29.385 12.378 1.00 33.52 N ATOM 1096 CA LYS A 574 -6.189 -30.629 12.743 1.00 4.01 C ATOM 1097 C LYS A 574 -7.191 -30.386 13.863 1.00 62.01 C ATOM 1098 O LYS A 574 -6.851 -29.857 14.930 1.00 72.12 O ATOM 1099 CB LYS A 574 -5.148 -31.699 13.155 1.00 72.25 C ATOM 1100 CG LYS A 574 -5.726 -32.964 13.823 1.00 11.33 C ATOM 1101 CD LYS A 574 -6.475 -33.897 12.869 1.00 2.21 C ATOM 1102 CE LYS A 574 -5.524 -34.613 11.924 1.00 24.31 C ATOM 1103 NZ LYS A 574 -6.213 -35.626 11.095 1.00 10.42 N ATOM 0 H LYS A 574 -4.635 -29.241 12.818 1.00 33.52 H new ATOM 0 HA LYS A 574 -6.723 -31.010 11.872 1.00 4.01 H new ATOM 0 HB2 LYS A 574 -4.591 -32.000 12.268 1.00 72.25 H new ATOM 0 HB3 LYS A 574 -4.434 -31.242 13.840 1.00 72.25 H new ATOM 0 HG2 LYS A 574 -4.911 -33.518 14.289 1.00 11.33 H new ATOM 0 HG3 LYS A 574 -6.403 -32.661 14.622 1.00 11.33 H new ATOM 0 HD2 LYS A 574 -7.038 -34.632 13.445 1.00 2.21 H new ATOM 0 HD3 LYS A 574 -7.199 -33.322 12.291 1.00 2.21 H new ATOM 0 HE2 LYS A 574 -5.042 -33.882 11.275 1.00 24.31 H new ATOM 0 HE3 LYS A 574 -4.735 -35.095 12.502 1.00 24.31 H new ATOM 0 HZ1 LYS A 574 -5.524 -36.087 10.467 1.00 10.42 H new ATOM 0 HZ2 LYS A 574 -6.651 -36.339 11.712 1.00 10.42 H new ATOM 0 HZ3 LYS A 574 -6.948 -35.164 10.523 1.00 10.42 H new ATOM 1117 N VAL A 575 -8.410 -30.733 13.597 1.00 45.12 N ATOM 1118 CA VAL A 575 -9.473 -30.635 14.558 1.00 73.32 C ATOM 1119 C VAL A 575 -9.522 -31.935 15.335 1.00 62.24 C ATOM 1120 O VAL A 575 -9.609 -33.013 14.737 1.00 34.01 O ATOM 1121 CB VAL A 575 -10.837 -30.385 13.860 1.00 3.03 C ATOM 1122 CG1 VAL A 575 -11.967 -30.334 14.876 1.00 33.42 C ATOM 1123 CG2 VAL A 575 -10.793 -29.093 13.052 1.00 52.24 C ATOM 0 H VAL A 575 -8.704 -31.099 12.692 1.00 45.12 H new ATOM 0 HA VAL A 575 -9.285 -29.793 15.225 1.00 73.32 H new ATOM 0 HB VAL A 575 -11.027 -31.216 13.181 1.00 3.03 H new ATOM 0 HG11 VAL A 575 -12.911 -30.158 14.361 1.00 33.42 H new ATOM 0 HG12 VAL A 575 -12.017 -31.282 15.412 1.00 33.42 H new ATOM 0 HG13 VAL A 575 -11.783 -29.526 15.584 1.00 33.42 H new ATOM 0 HG21 VAL A 575 -11.757 -28.933 12.569 1.00 52.24 H new ATOM 0 HG22 VAL A 575 -10.576 -28.256 13.716 1.00 52.24 H new ATOM 0 HG23 VAL A 575 -10.014 -29.165 12.293 1.00 52.24 H new ATOM 1133 N ILE A 576 -9.407 -31.848 16.631 1.00 45.22 N ATOM 1134 CA ILE A 576 -9.421 -33.020 17.467 1.00 14.05 C ATOM 1135 C ILE A 576 -10.841 -33.330 17.882 1.00 75.12 C ATOM 1136 O ILE A 576 -11.592 -32.446 18.315 1.00 72.44 O ATOM 1137 CB ILE A 576 -8.546 -32.824 18.726 1.00 60.22 C ATOM 1138 CG1 ILE A 576 -7.145 -32.326 18.349 1.00 65.32 C ATOM 1139 CG2 ILE A 576 -8.455 -34.113 19.542 1.00 2.33 C ATOM 1140 CD1 ILE A 576 -6.339 -33.280 17.498 1.00 13.54 C ATOM 0 H ILE A 576 -9.301 -30.969 17.137 1.00 45.22 H new ATOM 0 HA ILE A 576 -9.010 -33.851 16.893 1.00 14.05 H new ATOM 0 HB ILE A 576 -9.024 -32.065 19.345 1.00 60.22 H new ATOM 0 HG12 ILE A 576 -7.243 -31.380 17.816 1.00 65.32 H new ATOM 0 HG13 ILE A 576 -6.590 -32.120 19.264 1.00 65.32 H new ATOM 0 HG21 ILE A 576 -7.833 -33.944 20.421 1.00 2.33 H new ATOM 0 HG22 ILE A 576 -9.454 -34.416 19.857 1.00 2.33 H new ATOM 0 HG23 ILE A 576 -8.013 -34.900 18.931 1.00 2.33 H new ATOM 0 HD11 ILE A 576 -5.365 -32.841 17.283 1.00 13.54 H new ATOM 0 HD12 ILE A 576 -6.204 -34.220 18.033 1.00 13.54 H new ATOM 0 HD13 ILE A 576 -6.867 -33.468 16.563 1.00 13.54 H new ATOM 1278 N LYS A 585 -16.844 -25.207 20.536 1.00 61.23 N ATOM 1279 CA LYS A 585 -15.400 -25.156 20.461 1.00 1.03 C ATOM 1280 C LYS A 585 -14.997 -24.084 19.473 1.00 70.24 C ATOM 1281 O LYS A 585 -15.371 -24.146 18.319 1.00 11.51 O ATOM 1282 CB LYS A 585 -14.851 -26.494 19.961 1.00 42.23 C ATOM 1283 CG LYS A 585 -15.236 -27.712 20.772 1.00 71.33 C ATOM 1284 CD LYS A 585 -14.685 -27.682 22.176 1.00 1.52 C ATOM 1285 CE LYS A 585 -15.019 -28.971 22.916 1.00 64.14 C ATOM 1286 NZ LYS A 585 -14.442 -30.160 22.251 1.00 34.30 N ATOM 0 HA LYS A 585 -15.002 -24.941 21.453 1.00 1.03 H new ATOM 0 HB2 LYS A 585 -15.189 -26.643 18.936 1.00 42.23 H new ATOM 0 HB3 LYS A 585 -13.763 -26.430 19.932 1.00 42.23 H new ATOM 0 HG2 LYS A 585 -16.323 -27.784 20.815 1.00 71.33 H new ATOM 0 HG3 LYS A 585 -14.877 -28.608 20.265 1.00 71.33 H new ATOM 0 HD2 LYS A 585 -13.604 -27.545 22.144 1.00 1.52 H new ATOM 0 HD3 LYS A 585 -15.099 -26.830 22.716 1.00 1.52 H new ATOM 0 HE2 LYS A 585 -14.644 -28.910 23.938 1.00 64.14 H new ATOM 0 HE3 LYS A 585 -16.101 -29.082 22.980 1.00 64.14 H new ATOM 0 HZ1 LYS A 585 -14.561 -30.992 22.863 1.00 34.30 H new ATOM 0 HZ2 LYS A 585 -14.929 -30.323 21.347 1.00 34.30 H new ATOM 0 HZ3 LYS A 585 -13.429 -30.002 22.075 1.00 34.30 H new ATOM 1300 N THR A 586 -14.260 -23.113 19.905 1.00 22.35 N ATOM 1301 CA THR A 586 -13.784 -22.106 19.005 1.00 61.14 C ATOM 1302 C THR A 586 -12.445 -21.563 19.492 1.00 4.00 C ATOM 1303 O THR A 586 -12.176 -21.526 20.710 1.00 34.40 O ATOM 1304 CB THR A 586 -14.845 -20.964 18.750 1.00 24.11 C ATOM 1305 OG1 THR A 586 -14.371 -20.033 17.782 1.00 60.25 O ATOM 1306 CG2 THR A 586 -15.197 -20.211 20.007 1.00 60.01 C ATOM 0 H THR A 586 -13.973 -22.993 20.876 1.00 22.35 H new ATOM 0 HA THR A 586 -13.628 -22.571 18.032 1.00 61.14 H new ATOM 0 HB THR A 586 -15.741 -21.464 18.383 1.00 24.11 H new ATOM 0 HG1 THR A 586 -13.754 -20.484 17.169 1.00 60.25 H new ATOM 0 HG21 THR A 586 -15.930 -19.438 19.775 1.00 60.01 H new ATOM 0 HG22 THR A 586 -15.617 -20.901 20.739 1.00 60.01 H new ATOM 0 HG23 THR A 586 -14.299 -19.749 20.418 1.00 60.01 H new ATOM 1314 N PHE A 587 -11.593 -21.239 18.558 1.00 75.24 N ATOM 1315 CA PHE A 587 -10.293 -20.703 18.833 1.00 24.32 C ATOM 1316 C PHE A 587 -10.017 -19.626 17.811 1.00 24.35 C ATOM 1317 O PHE A 587 -10.812 -19.438 16.890 1.00 61.34 O ATOM 1318 CB PHE A 587 -9.207 -21.807 18.799 1.00 2.33 C ATOM 1319 CG PHE A 587 -8.975 -22.469 17.460 1.00 22.11 C ATOM 1320 CD1 PHE A 587 -9.761 -23.530 17.042 1.00 2.33 C ATOM 1321 CD2 PHE A 587 -7.951 -22.037 16.633 1.00 2.04 C ATOM 1322 CE1 PHE A 587 -9.528 -24.140 15.827 1.00 73.54 C ATOM 1323 CE2 PHE A 587 -7.717 -22.642 15.419 1.00 52.43 C ATOM 1324 CZ PHE A 587 -8.506 -23.694 15.016 1.00 32.31 C ATOM 0 H PHE A 587 -11.790 -21.344 17.563 1.00 75.24 H new ATOM 0 HA PHE A 587 -10.267 -20.281 19.838 1.00 24.32 H new ATOM 0 HB2 PHE A 587 -8.265 -21.373 19.135 1.00 2.33 H new ATOM 0 HB3 PHE A 587 -9.478 -22.578 19.521 1.00 2.33 H new ATOM 0 HD1 PHE A 587 -10.563 -23.883 17.673 1.00 2.33 H new ATOM 0 HD2 PHE A 587 -7.327 -21.213 16.946 1.00 2.04 H new ATOM 0 HE1 PHE A 587 -10.146 -24.967 15.511 1.00 73.54 H new ATOM 0 HE2 PHE A 587 -6.916 -22.292 14.785 1.00 52.43 H new ATOM 0 HZ PHE A 587 -8.325 -24.171 14.064 1.00 32.31 H new ATOM 1334 N PHE A 588 -8.917 -18.950 17.930 1.00 54.03 N ATOM 1335 CA PHE A 588 -8.633 -17.860 17.040 1.00 14.11 C ATOM 1336 C PHE A 588 -7.339 -18.085 16.330 1.00 25.14 C ATOM 1337 O PHE A 588 -6.472 -18.814 16.812 1.00 33.42 O ATOM 1338 CB PHE A 588 -8.622 -16.511 17.780 1.00 61.43 C ATOM 1339 CG PHE A 588 -9.950 -16.111 18.336 1.00 13.14 C ATOM 1340 CD1 PHE A 588 -10.388 -16.603 19.553 1.00 74.45 C ATOM 1341 CD2 PHE A 588 -10.766 -15.251 17.635 1.00 62.12 C ATOM 1342 CE1 PHE A 588 -11.617 -16.241 20.058 1.00 71.42 C ATOM 1343 CE2 PHE A 588 -11.994 -14.884 18.132 1.00 71.01 C ATOM 1344 CZ PHE A 588 -12.422 -15.380 19.345 1.00 44.32 C ATOM 0 H PHE A 588 -8.200 -19.131 18.632 1.00 54.03 H new ATOM 0 HA PHE A 588 -9.433 -17.821 16.300 1.00 14.11 H new ATOM 0 HB2 PHE A 588 -7.899 -16.561 18.594 1.00 61.43 H new ATOM 0 HB3 PHE A 588 -8.278 -15.736 17.095 1.00 61.43 H new ATOM 0 HD1 PHE A 588 -9.759 -17.279 20.113 1.00 74.45 H new ATOM 0 HD2 PHE A 588 -10.437 -14.860 16.683 1.00 62.12 H new ATOM 0 HE1 PHE A 588 -11.948 -16.631 21.009 1.00 71.42 H new ATOM 0 HE2 PHE A 588 -12.623 -14.208 17.573 1.00 71.01 H new ATOM 0 HZ PHE A 588 -13.387 -15.094 19.736 1.00 44.32 H new ATOM 1354 N LEU A 589 -7.222 -17.507 15.189 1.00 34.32 N ATOM 1355 CA LEU A 589 -6.026 -17.590 14.418 1.00 3.41 C ATOM 1356 C LEU A 589 -5.557 -16.171 14.209 1.00 4.30 C ATOM 1357 O LEU A 589 -6.351 -15.303 13.798 1.00 13.34 O ATOM 1358 CB LEU A 589 -6.322 -18.253 13.063 1.00 51.24 C ATOM 1359 CG LEU A 589 -5.254 -19.199 12.466 1.00 62.20 C ATOM 1360 CD1 LEU A 589 -3.900 -18.533 12.298 1.00 13.24 C ATOM 1361 CD2 LEU A 589 -5.141 -20.461 13.292 1.00 40.44 C ATOM 0 H LEU A 589 -7.962 -16.955 14.755 1.00 34.32 H new ATOM 0 HA LEU A 589 -5.267 -18.188 14.923 1.00 3.41 H new ATOM 0 HB2 LEU A 589 -7.249 -18.818 13.164 1.00 51.24 H new ATOM 0 HB3 LEU A 589 -6.509 -17.461 12.338 1.00 51.24 H new ATOM 0 HG LEU A 589 -5.591 -19.463 11.463 1.00 62.20 H new ATOM 0 HD11 LEU A 589 -3.193 -19.247 11.875 1.00 13.24 H new ATOM 0 HD12 LEU A 589 -3.996 -17.678 11.629 1.00 13.24 H new ATOM 0 HD13 LEU A 589 -3.538 -18.195 13.269 1.00 13.24 H new ATOM 0 HD21 LEU A 589 -4.385 -21.114 12.857 1.00 40.44 H new ATOM 0 HD22 LEU A 589 -4.855 -20.204 14.312 1.00 40.44 H new ATOM 0 HD23 LEU A 589 -6.102 -20.976 13.304 1.00 40.44 H new ATOM 1373 N GLU A 590 -4.324 -15.916 14.519 1.00 40.10 N ATOM 1374 CA GLU A 590 -3.770 -14.611 14.343 1.00 42.31 C ATOM 1375 C GLU A 590 -2.541 -14.718 13.483 1.00 4.42 C ATOM 1376 O GLU A 590 -1.699 -15.601 13.692 1.00 74.32 O ATOM 1377 CB GLU A 590 -3.437 -13.972 15.696 1.00 11.55 C ATOM 1378 CG GLU A 590 -2.907 -12.547 15.612 1.00 44.14 C ATOM 1379 CD GLU A 590 -2.588 -11.963 16.966 1.00 31.31 C ATOM 1380 OE1 GLU A 590 -3.487 -11.378 17.602 1.00 52.10 O ATOM 1381 OE2 GLU A 590 -1.423 -12.062 17.414 1.00 43.34 O ATOM 0 H GLU A 590 -3.675 -16.605 14.900 1.00 40.10 H new ATOM 0 HA GLU A 590 -4.501 -13.969 13.852 1.00 42.31 H new ATOM 0 HB2 GLU A 590 -4.334 -13.976 16.315 1.00 11.55 H new ATOM 0 HB3 GLU A 590 -2.697 -14.591 16.203 1.00 11.55 H new ATOM 0 HG2 GLU A 590 -2.009 -12.534 14.995 1.00 44.14 H new ATOM 0 HG3 GLU A 590 -3.645 -11.918 15.114 1.00 44.14 H new ATOM 1388 N ILE A 591 -2.468 -13.875 12.498 1.00 35.05 N ATOM 1389 CA ILE A 591 -1.332 -13.817 11.631 1.00 31.30 C ATOM 1390 C ILE A 591 -0.461 -12.668 12.051 1.00 23.44 C ATOM 1391 O ILE A 591 -0.960 -11.666 12.574 1.00 54.24 O ATOM 1392 CB ILE A 591 -1.727 -13.683 10.133 1.00 64.13 C ATOM 1393 CG1 ILE A 591 -2.700 -12.500 9.910 1.00 64.12 C ATOM 1394 CG2 ILE A 591 -2.315 -14.993 9.626 1.00 12.22 C ATOM 1395 CD1 ILE A 591 -3.141 -12.311 8.470 1.00 64.11 C ATOM 0 H ILE A 591 -3.201 -13.203 12.272 1.00 35.05 H new ATOM 0 HA ILE A 591 -0.789 -14.758 11.721 1.00 31.30 H new ATOM 0 HB ILE A 591 -0.827 -13.467 9.557 1.00 64.13 H new ATOM 0 HG12 ILE A 591 -3.583 -12.651 10.531 1.00 64.12 H new ATOM 0 HG13 ILE A 591 -2.222 -11.583 10.254 1.00 64.12 H new ATOM 0 HG21 ILE A 591 -2.588 -14.887 8.576 1.00 12.22 H new ATOM 0 HG22 ILE A 591 -1.577 -15.788 9.731 1.00 12.22 H new ATOM 0 HG23 ILE A 591 -3.202 -15.243 10.208 1.00 12.22 H new ATOM 0 HD11 ILE A 591 -3.820 -11.461 8.406 1.00 64.11 H new ATOM 0 HD12 ILE A 591 -2.268 -12.126 7.844 1.00 64.11 H new ATOM 0 HD13 ILE A 591 -3.651 -13.210 8.125 1.00 64.11 H new ATOM 1407 N GLY A 592 0.808 -12.821 11.884 1.00 64.03 N ATOM 1408 CA GLY A 592 1.721 -11.790 12.241 1.00 53.24 C ATOM 1409 C GLY A 592 1.934 -10.880 11.086 1.00 61.22 C ATOM 1410 O GLY A 592 1.452 -11.155 9.977 1.00 51.14 O ATOM 0 H GLY A 592 1.241 -13.660 11.498 1.00 64.03 H new ATOM 0 HA2 GLY A 592 1.334 -11.228 13.091 1.00 53.24 H new ATOM 0 HA3 GLY A 592 2.671 -12.225 12.552 1.00 53.24 H new ATOM 1414 N GLU A 593 2.636 -9.811 11.312 1.00 10.20 N ATOM 1415 CA GLU A 593 2.877 -8.866 10.272 1.00 35.42 C ATOM 1416 C GLU A 593 3.819 -9.437 9.233 1.00 24.33 C ATOM 1417 O GLU A 593 4.859 -10.026 9.576 1.00 50.15 O ATOM 1418 CB GLU A 593 3.364 -7.544 10.829 1.00 53.33 C ATOM 1419 CG GLU A 593 2.308 -6.854 11.659 1.00 11.23 C ATOM 1420 CD GLU A 593 2.768 -5.539 12.197 1.00 15.14 C ATOM 1421 OE1 GLU A 593 2.669 -4.534 11.467 1.00 55.51 O ATOM 1422 OE2 GLU A 593 3.252 -5.490 13.338 1.00 63.24 O ATOM 0 H GLU A 593 3.052 -9.574 12.212 1.00 10.20 H new ATOM 0 HA GLU A 593 1.931 -8.662 9.770 1.00 35.42 H new ATOM 0 HB2 GLU A 593 4.251 -7.713 11.439 1.00 53.33 H new ATOM 0 HB3 GLU A 593 3.662 -6.893 10.007 1.00 53.33 H new ATOM 0 HG2 GLU A 593 1.416 -6.702 11.051 1.00 11.23 H new ATOM 0 HG3 GLU A 593 2.022 -7.502 12.488 1.00 11.23 H new ATOM 1429 N PRO A 594 3.443 -9.301 7.959 1.00 61.10 N ATOM 1430 CA PRO A 594 4.196 -9.846 6.842 1.00 42.33 C ATOM 1431 C PRO A 594 5.615 -9.287 6.781 1.00 63.43 C ATOM 1432 O PRO A 594 5.848 -8.086 6.986 1.00 63.44 O ATOM 1433 CB PRO A 594 3.388 -9.425 5.608 1.00 60.14 C ATOM 1434 CG PRO A 594 2.519 -8.323 6.076 1.00 20.24 C ATOM 1435 CD PRO A 594 2.245 -8.582 7.513 1.00 50.30 C ATOM 0 HA PRO A 594 4.319 -10.926 6.923 1.00 42.33 H new ATOM 0 HB2 PRO A 594 4.043 -9.096 4.801 1.00 60.14 H new ATOM 0 HB3 PRO A 594 2.798 -10.256 5.221 1.00 60.14 H new ATOM 0 HG2 PRO A 594 3.010 -7.359 5.942 1.00 20.24 H new ATOM 0 HG3 PRO A 594 1.592 -8.291 5.504 1.00 20.24 H new ATOM 0 HD2 PRO A 594 2.101 -7.655 8.069 1.00 50.30 H new ATOM 0 HD3 PRO A 594 1.343 -9.179 7.650 1.00 50.30 H new ATOM 1443 N ARG A 595 6.541 -10.155 6.530 1.00 55.14 N ATOM 1444 CA ARG A 595 7.940 -9.815 6.482 1.00 51.21 C ATOM 1445 C ARG A 595 8.488 -10.050 5.085 1.00 54.43 C ATOM 1446 O ARG A 595 8.317 -11.131 4.510 1.00 65.42 O ATOM 1447 CB ARG A 595 8.724 -10.617 7.547 1.00 23.43 C ATOM 1448 CG ARG A 595 8.392 -12.103 7.544 1.00 52.41 C ATOM 1449 CD ARG A 595 9.187 -12.901 8.560 1.00 63.52 C ATOM 1450 NE ARG A 595 10.606 -12.977 8.212 1.00 42.53 N ATOM 1451 CZ ARG A 595 11.341 -14.101 8.238 1.00 73.33 C ATOM 1452 NH1 ARG A 595 10.800 -15.267 8.592 1.00 73.22 N ATOM 1453 NH2 ARG A 595 12.615 -14.046 7.913 1.00 24.41 N ATOM 0 H ARG A 595 6.350 -11.140 6.348 1.00 55.14 H new ATOM 0 HA ARG A 595 8.060 -8.756 6.712 1.00 51.21 H new ATOM 0 HB2 ARG A 595 9.793 -10.490 7.374 1.00 23.43 H new ATOM 0 HB3 ARG A 595 8.509 -10.205 8.533 1.00 23.43 H new ATOM 0 HG2 ARG A 595 7.328 -12.230 7.745 1.00 52.41 H new ATOM 0 HG3 ARG A 595 8.579 -12.507 6.549 1.00 52.41 H new ATOM 0 HD2 ARG A 595 9.079 -12.444 9.544 1.00 63.52 H new ATOM 0 HD3 ARG A 595 8.777 -13.908 8.630 1.00 63.52 H new ATOM 0 HE ARG A 595 11.071 -12.114 7.929 1.00 42.53 H new ATOM 0 HH11 ARG A 595 9.814 -15.315 8.848 1.00 73.22 H new ATOM 0 HH12 ARG A 595 11.372 -16.111 8.606 1.00 73.22 H new ATOM 0 HH21 ARG A 595 13.035 -13.156 7.645 1.00 24.41 H new ATOM 0 HH22 ARG A 595 13.183 -14.893 7.929 1.00 24.41 H new ATOM 1467 N LEU A 596 9.079 -9.019 4.522 1.00 52.25 N ATOM 1468 CA LEU A 596 9.676 -9.080 3.210 1.00 23.01 C ATOM 1469 C LEU A 596 10.929 -9.949 3.299 1.00 63.53 C ATOM 1470 O LEU A 596 11.696 -9.856 4.273 1.00 61.40 O ATOM 1471 CB LEU A 596 10.015 -7.635 2.757 1.00 24.22 C ATOM 1472 CG LEU A 596 10.180 -7.345 1.246 1.00 34.03 C ATOM 1473 CD1 LEU A 596 11.431 -7.963 0.672 1.00 64.33 C ATOM 1474 CD2 LEU A 596 8.965 -7.825 0.492 1.00 73.22 C ATOM 0 H LEU A 596 9.158 -8.106 4.969 1.00 52.25 H new ATOM 0 HA LEU A 596 8.998 -9.519 2.477 1.00 23.01 H new ATOM 0 HB2 LEU A 596 9.231 -6.979 3.135 1.00 24.22 H new ATOM 0 HB3 LEU A 596 10.941 -7.343 3.252 1.00 24.22 H new ATOM 0 HG LEU A 596 10.278 -6.265 1.133 1.00 34.03 H new ATOM 0 HD11 LEU A 596 11.498 -7.729 -0.390 1.00 64.33 H new ATOM 0 HD12 LEU A 596 12.304 -7.563 1.187 1.00 64.33 H new ATOM 0 HD13 LEU A 596 11.396 -9.044 0.804 1.00 64.33 H new ATOM 0 HD21 LEU A 596 9.090 -7.617 -0.571 1.00 73.22 H new ATOM 0 HD22 LEU A 596 8.846 -8.898 0.640 1.00 73.22 H new ATOM 0 HD23 LEU A 596 8.080 -7.307 0.861 1.00 73.22 H new ATOM 1486 N VAL A 597 11.108 -10.814 2.339 1.00 35.03 N ATOM 1487 CA VAL A 597 12.250 -11.698 2.342 1.00 21.43 C ATOM 1488 C VAL A 597 13.392 -11.110 1.530 1.00 52.42 C ATOM 1489 O VAL A 597 13.442 -11.229 0.286 1.00 65.50 O ATOM 1490 CB VAL A 597 11.901 -13.094 1.817 1.00 21.31 C ATOM 1491 CG1 VAL A 597 13.070 -14.046 1.997 1.00 72.12 C ATOM 1492 CG2 VAL A 597 10.677 -13.621 2.520 1.00 44.10 C ATOM 0 H VAL A 597 10.480 -10.929 1.543 1.00 35.03 H new ATOM 0 HA VAL A 597 12.565 -11.802 3.380 1.00 21.43 H new ATOM 0 HB VAL A 597 11.688 -13.019 0.751 1.00 21.31 H new ATOM 0 HG11 VAL A 597 12.799 -15.031 1.617 1.00 72.12 H new ATOM 0 HG12 VAL A 597 13.933 -13.670 1.448 1.00 72.12 H new ATOM 0 HG13 VAL A 597 13.318 -14.121 3.056 1.00 72.12 H new ATOM 0 HG21 VAL A 597 10.438 -14.614 2.139 1.00 44.10 H new ATOM 0 HG22 VAL A 597 10.870 -13.680 3.591 1.00 44.10 H new ATOM 0 HG23 VAL A 597 9.837 -12.951 2.339 1.00 44.10 H new ATOM 2079 N PRO A 634 5.849 -4.931 3.433 1.00 52.50 N ATOM 2080 CA PRO A 634 4.464 -5.398 3.341 1.00 31.03 C ATOM 2081 C PRO A 634 3.751 -5.353 4.674 1.00 63.10 C ATOM 2082 O PRO A 634 4.328 -5.701 5.704 1.00 63.41 O ATOM 2083 CB PRO A 634 4.600 -6.844 2.856 1.00 4.01 C ATOM 2084 CG PRO A 634 6.003 -7.214 3.186 1.00 52.01 C ATOM 2085 CD PRO A 634 6.787 -5.965 3.009 1.00 31.33 C ATOM 0 HA PRO A 634 3.869 -4.769 2.678 1.00 31.03 H new ATOM 0 HB2 PRO A 634 3.888 -7.500 3.357 1.00 4.01 H new ATOM 0 HB3 PRO A 634 4.409 -6.924 1.786 1.00 4.01 H new ATOM 0 HG2 PRO A 634 6.082 -7.587 4.207 1.00 52.01 H new ATOM 0 HG3 PRO A 634 6.367 -8.004 2.529 1.00 52.01 H new ATOM 0 HD2 PRO A 634 7.691 -5.965 3.618 1.00 31.33 H new ATOM 0 HD3 PRO A 634 7.100 -5.827 1.974 1.00 31.33 H new ATOM 2093 N ILE A 635 2.506 -4.951 4.664 1.00 22.24 N ATOM 2094 CA ILE A 635 1.758 -4.818 5.866 1.00 43.30 C ATOM 2095 C ILE A 635 0.498 -5.642 5.784 1.00 73.41 C ATOM 2096 O ILE A 635 0.217 -6.277 4.756 1.00 20.14 O ATOM 2097 CB ILE A 635 1.343 -3.366 6.092 1.00 21.32 C ATOM 2098 CG1 ILE A 635 0.555 -2.879 4.886 1.00 53.40 C ATOM 2099 CG2 ILE A 635 2.573 -2.497 6.312 1.00 12.10 C ATOM 2100 CD1 ILE A 635 -0.575 -1.983 5.228 1.00 15.20 C ATOM 0 H ILE A 635 1.991 -4.709 3.817 1.00 22.24 H new ATOM 0 HA ILE A 635 2.392 -5.157 6.685 1.00 43.30 H new ATOM 0 HB ILE A 635 0.716 -3.299 6.981 1.00 21.32 H new ATOM 0 HG12 ILE A 635 1.231 -2.354 4.211 1.00 53.40 H new ATOM 0 HG13 ILE A 635 0.170 -3.742 4.343 1.00 53.40 H new ATOM 0 HG21 ILE A 635 2.265 -1.464 6.472 1.00 12.10 H new ATOM 0 HG22 ILE A 635 3.118 -2.853 7.186 1.00 12.10 H new ATOM 0 HG23 ILE A 635 3.218 -2.551 5.435 1.00 12.10 H new ATOM 0 HD11 ILE A 635 -1.087 -1.679 4.315 1.00 15.20 H new ATOM 0 HD12 ILE A 635 -1.274 -2.510 5.878 1.00 15.20 H new ATOM 0 HD13 ILE A 635 -0.196 -1.100 5.743 1.00 15.20 H new ATOM 2112 N LEU A 636 -0.241 -5.640 6.842 1.00 41.05 N ATOM 2113 CA LEU A 636 -1.470 -6.337 6.882 1.00 15.41 C ATOM 2114 C LEU A 636 -2.658 -5.403 7.007 1.00 52.41 C ATOM 2115 O LEU A 636 -2.495 -4.182 7.144 1.00 44.21 O ATOM 2116 CB LEU A 636 -1.467 -7.497 7.910 1.00 11.52 C ATOM 2117 CG LEU A 636 -0.930 -7.232 9.337 1.00 52.11 C ATOM 2118 CD1 LEU A 636 -1.713 -6.154 10.061 1.00 33.53 C ATOM 2119 CD2 LEU A 636 -0.962 -8.515 10.140 1.00 1.23 C ATOM 0 H LEU A 636 -0.003 -5.151 7.705 1.00 41.05 H new ATOM 0 HA LEU A 636 -1.589 -6.824 5.914 1.00 15.41 H new ATOM 0 HB2 LEU A 636 -2.492 -7.855 8.005 1.00 11.52 H new ATOM 0 HB3 LEU A 636 -0.882 -8.313 7.484 1.00 11.52 H new ATOM 0 HG LEU A 636 0.095 -6.875 9.238 1.00 52.11 H new ATOM 0 HD11 LEU A 636 -1.295 -6.008 11.057 1.00 33.53 H new ATOM 0 HD12 LEU A 636 -1.651 -5.221 9.501 1.00 33.53 H new ATOM 0 HD13 LEU A 636 -2.756 -6.457 10.146 1.00 33.53 H new ATOM 0 HD21 LEU A 636 -0.583 -8.325 11.144 1.00 1.23 H new ATOM 0 HD22 LEU A 636 -1.987 -8.880 10.202 1.00 1.23 H new ATOM 0 HD23 LEU A 636 -0.339 -9.265 9.653 1.00 1.23 H new ATOM 2131 N GLY A 637 -3.833 -5.976 6.937 1.00 70.35 N ATOM 2132 CA GLY A 637 -5.046 -5.218 6.966 1.00 54.45 C ATOM 2133 C GLY A 637 -5.397 -4.679 8.328 1.00 31.21 C ATOM 2134 O GLY A 637 -4.759 -5.012 9.333 1.00 12.24 O ATOM 0 H GLY A 637 -3.970 -6.984 6.858 1.00 70.35 H new ATOM 0 HA2 GLY A 637 -4.959 -4.385 6.268 1.00 54.45 H new ATOM 0 HA3 GLY A 637 -5.864 -5.846 6.613 1.00 54.45 H new ATOM 2138 N GLU A 638 -6.436 -3.884 8.353 1.00 21.32 N ATOM 2139 CA GLU A 638 -6.913 -3.211 9.543 1.00 62.11 C ATOM 2140 C GLU A 638 -7.451 -4.224 10.547 1.00 2.21 C ATOM 2141 O GLU A 638 -7.324 -4.055 11.758 1.00 71.42 O ATOM 2142 CB GLU A 638 -7.980 -2.203 9.130 1.00 71.03 C ATOM 2143 CG GLU A 638 -8.538 -1.351 10.244 1.00 20.53 C ATOM 2144 CD GLU A 638 -9.474 -0.312 9.714 1.00 13.53 C ATOM 2145 OE1 GLU A 638 -10.657 -0.607 9.498 1.00 71.11 O ATOM 2146 OE2 GLU A 638 -9.027 0.831 9.470 1.00 70.41 O ATOM 0 H GLU A 638 -6.993 -3.678 7.523 1.00 21.32 H new ATOM 0 HA GLU A 638 -6.096 -2.682 10.033 1.00 62.11 H new ATOM 0 HB2 GLU A 638 -7.558 -1.545 8.370 1.00 71.03 H new ATOM 0 HB3 GLU A 638 -8.803 -2.743 8.663 1.00 71.03 H new ATOM 0 HG2 GLU A 638 -9.061 -1.983 10.962 1.00 20.53 H new ATOM 0 HG3 GLU A 638 -7.721 -0.868 10.780 1.00 20.53 H new ATOM 2153 N HIS A 639 -8.042 -5.268 10.041 1.00 60.02 N ATOM 2154 CA HIS A 639 -8.510 -6.346 10.865 1.00 0.55 C ATOM 2155 C HIS A 639 -7.899 -7.628 10.397 1.00 43.33 C ATOM 2156 O HIS A 639 -8.020 -7.989 9.223 1.00 11.34 O ATOM 2157 CB HIS A 639 -10.043 -6.452 10.879 1.00 41.11 C ATOM 2158 CG HIS A 639 -10.731 -5.409 11.711 1.00 24.25 C ATOM 2159 ND1 HIS A 639 -11.299 -5.670 12.939 1.00 50.42 N ATOM 2160 CD2 HIS A 639 -10.946 -4.094 11.476 1.00 73.42 C ATOM 2161 CE1 HIS A 639 -11.826 -4.541 13.406 1.00 62.24 C ATOM 2162 NE2 HIS A 639 -11.640 -3.543 12.553 1.00 71.22 N ATOM 0 H HIS A 639 -8.213 -5.396 9.044 1.00 60.02 H new ATOM 0 HA HIS A 639 -8.203 -6.141 11.891 1.00 0.55 H new ATOM 0 HB2 HIS A 639 -10.409 -6.381 9.855 1.00 41.11 H new ATOM 0 HB3 HIS A 639 -10.323 -7.438 11.250 1.00 41.11 H new ATOM 0 HD2 HIS A 639 -10.630 -3.556 10.594 1.00 73.42 H new ATOM 0 HE1 HIS A 639 -12.337 -4.450 14.353 1.00 62.24 H new ATOM 0 HE2 HIS A 639 -11.941 -2.575 12.662 1.00 71.22 H new ATOM 2170 N THR A 640 -7.195 -8.277 11.283 1.00 51.10 N ATOM 2171 CA THR A 640 -6.580 -9.541 11.014 1.00 64.10 C ATOM 2172 C THR A 640 -6.826 -10.492 12.165 1.00 60.23 C ATOM 2173 O THR A 640 -6.118 -10.461 13.179 1.00 73.33 O ATOM 2174 CB THR A 640 -5.066 -9.400 10.741 1.00 30.52 C ATOM 2175 OG1 THR A 640 -4.464 -8.489 11.690 1.00 30.12 O ATOM 2176 CG2 THR A 640 -4.810 -8.916 9.333 1.00 53.05 C ATOM 0 H THR A 640 -7.031 -7.933 12.229 1.00 51.10 H new ATOM 0 HA THR A 640 -7.034 -9.946 10.110 1.00 64.10 H new ATOM 0 HB THR A 640 -4.614 -10.385 10.855 1.00 30.52 H new ATOM 0 HG1 THR A 640 -4.729 -8.742 12.599 1.00 30.12 H new ATOM 0 HG21 THR A 640 -3.736 -8.826 9.169 1.00 53.05 H new ATOM 0 HG22 THR A 640 -5.227 -9.629 8.622 1.00 53.05 H new ATOM 0 HG23 THR A 640 -5.282 -7.944 9.191 1.00 53.05 H new ATOM 2184 N LYS A 641 -7.844 -11.297 12.031 1.00 45.42 N ATOM 2185 CA LYS A 641 -8.234 -12.220 13.073 1.00 43.35 C ATOM 2186 C LYS A 641 -9.196 -13.194 12.481 1.00 33.14 C ATOM 2187 O LYS A 641 -9.997 -12.819 11.620 1.00 14.01 O ATOM 2188 CB LYS A 641 -8.930 -11.486 14.225 1.00 53.30 C ATOM 2189 CG LYS A 641 -9.224 -12.364 15.443 1.00 51.22 C ATOM 2190 CD LYS A 641 -10.121 -11.689 16.500 1.00 25.13 C ATOM 2191 CE LYS A 641 -9.505 -10.446 17.173 1.00 32.43 C ATOM 2192 NZ LYS A 641 -9.453 -9.253 16.293 1.00 50.32 N ATOM 0 H LYS A 641 -8.430 -11.335 11.197 1.00 45.42 H new ATOM 0 HA LYS A 641 -7.347 -12.717 13.465 1.00 43.35 H new ATOM 0 HB2 LYS A 641 -8.306 -10.649 14.537 1.00 53.30 H new ATOM 0 HB3 LYS A 641 -9.867 -11.066 13.860 1.00 53.30 H new ATOM 0 HG2 LYS A 641 -9.704 -13.284 15.108 1.00 51.22 H new ATOM 0 HG3 LYS A 641 -8.281 -12.648 15.910 1.00 51.22 H new ATOM 0 HD2 LYS A 641 -11.061 -11.401 16.028 1.00 25.13 H new ATOM 0 HD3 LYS A 641 -10.363 -12.420 17.271 1.00 25.13 H new ATOM 0 HE2 LYS A 641 -10.083 -10.203 18.065 1.00 32.43 H new ATOM 0 HE3 LYS A 641 -8.495 -10.686 17.504 1.00 32.43 H new ATOM 0 HZ1 LYS A 641 -8.470 -9.081 15.998 1.00 50.32 H new ATOM 0 HZ2 LYS A 641 -10.043 -9.416 15.452 1.00 50.32 H new ATOM 0 HZ3 LYS A 641 -9.809 -8.424 16.811 1.00 50.32 H new ATOM 2206 N LEU A 642 -9.112 -14.409 12.902 1.00 64.32 N ATOM 2207 CA LEU A 642 -9.987 -15.421 12.434 1.00 11.44 C ATOM 2208 C LEU A 642 -10.587 -16.159 13.610 1.00 23.44 C ATOM 2209 O LEU A 642 -9.856 -16.772 14.388 1.00 62.00 O ATOM 2210 CB LEU A 642 -9.194 -16.393 11.606 1.00 45.20 C ATOM 2211 CG LEU A 642 -9.959 -17.535 10.983 1.00 71.32 C ATOM 2212 CD1 LEU A 642 -10.803 -17.068 9.823 1.00 63.44 C ATOM 2213 CD2 LEU A 642 -9.012 -18.609 10.567 1.00 53.32 C ATOM 0 H LEU A 642 -8.427 -14.728 13.587 1.00 64.32 H new ATOM 0 HA LEU A 642 -10.784 -14.973 11.841 1.00 11.44 H new ATOM 0 HB2 LEU A 642 -8.702 -15.838 10.808 1.00 45.20 H new ATOM 0 HB3 LEU A 642 -8.408 -16.813 12.234 1.00 45.20 H new ATOM 0 HG LEU A 642 -10.643 -17.941 11.728 1.00 71.32 H new ATOM 0 HD11 LEU A 642 -11.340 -17.917 9.399 1.00 63.44 H new ATOM 0 HD12 LEU A 642 -11.519 -16.323 10.170 1.00 63.44 H new ATOM 0 HD13 LEU A 642 -10.161 -16.627 9.060 1.00 63.44 H new ATOM 0 HD21 LEU A 642 -9.569 -19.431 10.118 1.00 53.32 H new ATOM 0 HD22 LEU A 642 -8.305 -18.209 9.840 1.00 53.32 H new ATOM 0 HD23 LEU A 642 -8.468 -18.973 11.439 1.00 53.32 H new ATOM 2225 N GLU A 643 -11.880 -16.067 13.764 1.00 71.04 N ATOM 2226 CA GLU A 643 -12.570 -16.839 14.772 1.00 73.41 C ATOM 2227 C GLU A 643 -12.906 -18.180 14.138 1.00 21.04 C ATOM 2228 O GLU A 643 -13.685 -18.244 13.191 1.00 14.51 O ATOM 2229 CB GLU A 643 -13.859 -16.117 15.243 1.00 43.03 C ATOM 2230 CG GLU A 643 -14.607 -16.833 16.377 1.00 34.23 C ATOM 2231 CD GLU A 643 -15.879 -16.116 16.824 1.00 55.31 C ATOM 2232 OE1 GLU A 643 -15.817 -15.253 17.736 1.00 34.12 O ATOM 2233 OE2 GLU A 643 -16.968 -16.412 16.295 1.00 25.34 O ATOM 0 H GLU A 643 -12.482 -15.464 13.204 1.00 71.04 H new ATOM 0 HA GLU A 643 -11.944 -16.968 15.655 1.00 73.41 H new ATOM 0 HB2 GLU A 643 -13.598 -15.112 15.574 1.00 43.03 H new ATOM 0 HB3 GLU A 643 -14.532 -16.008 14.392 1.00 43.03 H new ATOM 0 HG2 GLU A 643 -14.864 -17.841 16.051 1.00 34.23 H new ATOM 0 HG3 GLU A 643 -13.939 -16.936 17.232 1.00 34.23 H new ATOM 2240 N VAL A 644 -12.266 -19.221 14.581 1.00 3.13 N ATOM 2241 CA VAL A 644 -12.507 -20.528 14.029 1.00 44.23 C ATOM 2242 C VAL A 644 -13.440 -21.267 14.934 1.00 43.24 C ATOM 2243 O VAL A 644 -13.065 -21.659 16.043 1.00 55.53 O ATOM 2244 CB VAL A 644 -11.218 -21.361 13.868 1.00 24.14 C ATOM 2245 CG1 VAL A 644 -11.534 -22.709 13.236 1.00 72.10 C ATOM 2246 CG2 VAL A 644 -10.185 -20.619 13.047 1.00 73.12 C ATOM 0 H VAL A 644 -11.570 -19.194 15.326 1.00 3.13 H new ATOM 0 HA VAL A 644 -12.932 -20.387 13.035 1.00 44.23 H new ATOM 0 HB VAL A 644 -10.799 -21.529 14.860 1.00 24.14 H new ATOM 0 HG11 VAL A 644 -10.615 -23.285 13.129 1.00 72.10 H new ATOM 0 HG12 VAL A 644 -12.232 -23.254 13.871 1.00 72.10 H new ATOM 0 HG13 VAL A 644 -11.982 -22.555 12.254 1.00 72.10 H new ATOM 0 HG21 VAL A 644 -9.288 -21.231 12.951 1.00 73.12 H new ATOM 0 HG22 VAL A 644 -10.589 -20.410 12.057 1.00 73.12 H new ATOM 0 HG23 VAL A 644 -9.933 -19.681 13.541 1.00 73.12 H new ATOM 2256 N ILE A 645 -14.636 -21.428 14.498 1.00 0.31 N ATOM 2257 CA ILE A 645 -15.635 -22.094 15.270 1.00 45.45 C ATOM 2258 C ILE A 645 -15.746 -23.526 14.778 1.00 42.50 C ATOM 2259 O ILE A 645 -15.995 -23.762 13.598 1.00 44.43 O ATOM 2260 CB ILE A 645 -16.995 -21.398 15.099 1.00 53.34 C ATOM 2261 CG1 ILE A 645 -16.843 -19.891 15.282 1.00 11.43 C ATOM 2262 CG2 ILE A 645 -17.991 -21.942 16.113 1.00 10.52 C ATOM 2263 CD1 ILE A 645 -18.069 -19.116 14.884 1.00 73.35 C ATOM 0 H ILE A 645 -14.958 -21.100 13.587 1.00 0.31 H new ATOM 0 HA ILE A 645 -15.357 -22.068 16.324 1.00 45.45 H new ATOM 0 HB ILE A 645 -17.365 -21.597 14.093 1.00 53.34 H new ATOM 0 HG12 ILE A 645 -16.612 -19.680 16.326 1.00 11.43 H new ATOM 0 HG13 ILE A 645 -15.995 -19.544 14.692 1.00 11.43 H new ATOM 0 HG21 ILE A 645 -18.951 -21.443 15.984 1.00 10.52 H new ATOM 0 HG22 ILE A 645 -18.116 -23.014 15.961 1.00 10.52 H new ATOM 0 HG23 ILE A 645 -17.620 -21.759 17.122 1.00 10.52 H new ATOM 0 HD11 ILE A 645 -17.893 -18.052 15.039 1.00 73.35 H new ATOM 0 HD12 ILE A 645 -18.289 -19.298 13.832 1.00 73.35 H new ATOM 0 HD13 ILE A 645 -18.915 -19.436 15.492 1.00 73.35 H new ATOM 2275 N ILE A 646 -15.530 -24.451 15.657 1.00 21.34 N ATOM 2276 CA ILE A 646 -15.621 -25.846 15.348 1.00 73.15 C ATOM 2277 C ILE A 646 -16.993 -26.311 15.783 1.00 61.31 C ATOM 2278 O ILE A 646 -17.276 -26.394 16.987 1.00 5.32 O ATOM 2279 CB ILE A 646 -14.563 -26.670 16.125 1.00 62.54 C ATOM 2280 CG1 ILE A 646 -13.143 -26.126 15.891 1.00 72.34 C ATOM 2281 CG2 ILE A 646 -14.647 -28.142 15.735 1.00 72.04 C ATOM 2282 CD1 ILE A 646 -12.090 -26.779 16.771 1.00 52.43 C ATOM 0 H ILE A 646 -15.281 -24.257 16.627 1.00 21.34 H new ATOM 0 HA ILE A 646 -15.450 -25.990 14.281 1.00 73.15 H new ATOM 0 HB ILE A 646 -14.780 -26.576 17.189 1.00 62.54 H new ATOM 0 HG12 ILE A 646 -12.874 -26.274 14.845 1.00 72.34 H new ATOM 0 HG13 ILE A 646 -13.140 -25.051 16.072 1.00 72.34 H new ATOM 0 HG21 ILE A 646 -13.898 -28.708 16.289 1.00 72.04 H new ATOM 0 HG22 ILE A 646 -15.640 -28.525 15.972 1.00 72.04 H new ATOM 0 HG23 ILE A 646 -14.463 -28.246 14.666 1.00 72.04 H new ATOM 0 HD11 ILE A 646 -11.114 -26.347 16.552 1.00 52.43 H new ATOM 0 HD12 ILE A 646 -12.335 -26.609 17.819 1.00 52.43 H new ATOM 0 HD13 ILE A 646 -12.065 -27.851 16.574 1.00 52.43 H new ATOM 2294 N GLU A 647 -17.848 -26.566 14.844 1.00 1.43 N ATOM 2295 CA GLU A 647 -19.185 -26.997 15.153 1.00 71.32 C ATOM 2296 C GLU A 647 -19.395 -28.348 14.554 1.00 12.20 C ATOM 2297 O GLU A 647 -18.828 -28.646 13.487 1.00 34.22 O ATOM 2298 CB GLU A 647 -20.218 -26.038 14.556 1.00 64.51 C ATOM 2299 CG GLU A 647 -20.045 -24.594 14.963 1.00 11.55 C ATOM 2300 CD GLU A 647 -21.158 -23.721 14.458 1.00 14.32 C ATOM 2301 OE1 GLU A 647 -21.169 -23.367 13.259 1.00 63.13 O ATOM 2302 OE2 GLU A 647 -22.047 -23.372 15.251 1.00 60.52 O ATOM 0 H GLU A 647 -17.647 -26.484 13.847 1.00 1.43 H new ATOM 0 HA GLU A 647 -19.308 -27.020 16.236 1.00 71.32 H new ATOM 0 HB2 GLU A 647 -20.170 -26.104 13.469 1.00 64.51 H new ATOM 0 HB3 GLU A 647 -21.214 -26.368 14.851 1.00 64.51 H new ATOM 0 HG2 GLU A 647 -20.000 -24.528 16.050 1.00 11.55 H new ATOM 0 HG3 GLU A 647 -19.094 -24.223 14.581 1.00 11.55 H new