USER MOD reduce.3.24.130724 H: found=0, std=0, add=684, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 684 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 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 158:sc= 0.496 (180deg=0.273) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot -57:sc= 0.525 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 CYS SG : rot -179:sc= -0.449 USER MOD Single : A 22 SER OG : rot -160:sc= -1.83 USER MOD Single : A 39 TYR OH : rot -14:sc= -0.904 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -1.72 K(o=-1.7,f=-0.47) USER MOD Single : A 47 THR OG1 : rot -63:sc= -0.819 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -1.98 K(o=-2,f=-12!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0343 USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 79:sc= 1.27 USER MOD Single : A 78 ASN : amide:sc= -8.34! C(o=-8.3!,f=-11!) USER MOD Single : A 80 SER OG : rot 140:sc= -4.02! USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot -87:sc= 0.704 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 62.545 15.450 4.374 1.00 0.00 N ATOM 2 CA MET A 1 62.807 13.987 4.274 1.00 0.00 C ATOM 3 C MET A 1 63.458 13.679 2.929 1.00 0.00 C ATOM 4 O MET A 1 62.786 13.595 1.901 1.00 0.00 O ATOM 5 CB MET A 1 61.486 13.222 4.388 1.00 0.00 C ATOM 6 CG MET A 1 61.194 12.926 5.860 1.00 0.00 C ATOM 7 SD MET A 1 60.397 14.364 6.618 1.00 0.00 S ATOM 8 CE MET A 1 59.734 13.515 8.072 1.00 0.00 C ATOM 0 H1 MET A 1 61.797 15.622 5.076 1.00 0.00 H new ATOM 0 H2 MET A 1 63.415 15.939 4.668 1.00 0.00 H new ATOM 0 H3 MET A 1 62.240 15.812 3.448 1.00 0.00 H new ATOM 0 HA MET A 1 63.474 13.681 5.080 1.00 0.00 H new ATOM 0 HB2 MET A 1 60.675 13.809 3.956 1.00 0.00 H new ATOM 0 HB3 MET A 1 61.542 12.292 3.823 1.00 0.00 H new ATOM 0 HG2 MET A 1 60.548 12.052 5.945 1.00 0.00 H new ATOM 0 HG3 MET A 1 62.120 12.691 6.385 1.00 0.00 H new ATOM 0 HE1 MET A 1 59.192 14.228 8.694 1.00 0.00 H new ATOM 0 HE2 MET A 1 59.056 12.723 7.753 1.00 0.00 H new ATOM 0 HE3 MET A 1 60.554 13.082 8.646 1.00 0.00 H new ATOM 20 N THR A 2 64.778 13.514 2.949 1.00 0.00 N ATOM 21 CA THR A 2 65.517 13.216 1.725 1.00 0.00 C ATOM 22 C THR A 2 65.215 11.798 1.252 1.00 0.00 C ATOM 23 O THR A 2 64.406 11.088 1.847 1.00 0.00 O ATOM 24 CB THR A 2 67.022 13.353 1.961 1.00 0.00 C ATOM 25 OG1 THR A 2 67.441 12.381 2.909 1.00 0.00 O ATOM 26 CG2 THR A 2 67.333 14.754 2.492 1.00 0.00 C ATOM 0 H THR A 2 65.353 13.581 3.789 1.00 0.00 H new ATOM 0 HA THR A 2 65.204 13.928 0.962 1.00 0.00 H new ATOM 0 HB THR A 2 67.553 13.198 1.022 1.00 0.00 H new ATOM 0 HG1 THR A 2 68.406 12.466 3.060 1.00 0.00 H new ATOM 0 HG21 THR A 2 68.406 14.850 2.660 1.00 0.00 H new ATOM 0 HG22 THR A 2 67.012 15.499 1.764 1.00 0.00 H new ATOM 0 HG23 THR A 2 66.803 14.913 3.431 1.00 0.00 H new ATOM 34 N LEU A 3 65.878 11.396 0.171 1.00 0.00 N ATOM 35 CA LEU A 3 65.679 10.059 -0.382 1.00 0.00 C ATOM 36 C LEU A 3 66.947 9.220 -0.207 1.00 0.00 C ATOM 37 O LEU A 3 67.827 9.571 0.580 1.00 0.00 O ATOM 38 CB LEU A 3 65.304 10.152 -1.862 1.00 0.00 C ATOM 39 CG LEU A 3 66.424 10.602 -2.804 1.00 0.00 C ATOM 40 CD1 LEU A 3 66.155 10.061 -4.209 1.00 0.00 C ATOM 41 CD2 LEU A 3 66.462 12.132 -2.846 1.00 0.00 C ATOM 0 H LEU A 3 66.552 11.970 -0.336 1.00 0.00 H new ATOM 0 HA LEU A 3 64.864 9.574 0.155 1.00 0.00 H new ATOM 0 HB2 LEU A 3 64.949 9.175 -2.190 1.00 0.00 H new ATOM 0 HB3 LEU A 3 64.469 10.845 -1.963 1.00 0.00 H new ATOM 0 HG LEU A 3 67.380 10.221 -2.446 1.00 0.00 H new ATOM 0 HD11 LEU A 3 66.952 10.381 -4.881 1.00 0.00 H new ATOM 0 HD12 LEU A 3 66.121 8.972 -4.179 1.00 0.00 H new ATOM 0 HD13 LEU A 3 65.201 10.444 -4.570 1.00 0.00 H new ATOM 0 HD21 LEU A 3 67.258 12.458 -3.516 1.00 0.00 H new ATOM 0 HD22 LEU A 3 65.506 12.510 -3.208 1.00 0.00 H new ATOM 0 HD23 LEU A 3 66.649 12.519 -1.844 1.00 0.00 H new ATOM 53 N LEU A 4 67.036 8.107 -0.936 1.00 0.00 N ATOM 54 CA LEU A 4 68.211 7.239 -0.828 1.00 0.00 C ATOM 55 C LEU A 4 68.844 7.025 -2.201 1.00 0.00 C ATOM 56 O LEU A 4 68.228 7.300 -3.230 1.00 0.00 O ATOM 57 CB LEU A 4 67.822 5.887 -0.222 1.00 0.00 C ATOM 58 CG LEU A 4 68.970 5.111 0.435 1.00 0.00 C ATOM 59 CD1 LEU A 4 68.468 4.421 1.707 1.00 0.00 C ATOM 60 CD2 LEU A 4 69.492 4.051 -0.538 1.00 0.00 C ATOM 0 H LEU A 4 66.325 7.789 -1.595 1.00 0.00 H new ATOM 0 HA LEU A 4 68.936 7.725 -0.175 1.00 0.00 H new ATOM 0 HB2 LEU A 4 67.043 6.051 0.523 1.00 0.00 H new ATOM 0 HB3 LEU A 4 67.388 5.267 -1.006 1.00 0.00 H new ATOM 0 HG LEU A 4 69.771 5.805 0.690 1.00 0.00 H new ATOM 0 HD11 LEU A 4 69.287 3.871 2.170 1.00 0.00 H new ATOM 0 HD12 LEU A 4 68.094 5.171 2.404 1.00 0.00 H new ATOM 0 HD13 LEU A 4 67.665 3.729 1.453 1.00 0.00 H new ATOM 0 HD21 LEU A 4 70.308 3.499 -0.071 1.00 0.00 H new ATOM 0 HD22 LEU A 4 68.686 3.362 -0.792 1.00 0.00 H new ATOM 0 HD23 LEU A 4 69.854 4.536 -1.445 1.00 0.00 H new ATOM 72 N THR A 5 70.085 6.543 -2.209 1.00 0.00 N ATOM 73 CA THR A 5 70.787 6.315 -3.472 1.00 0.00 C ATOM 74 C THR A 5 71.650 5.059 -3.408 1.00 0.00 C ATOM 75 O THR A 5 71.711 4.379 -2.383 1.00 0.00 O ATOM 76 CB THR A 5 71.681 7.510 -3.801 1.00 0.00 C ATOM 77 OG1 THR A 5 72.379 7.914 -2.630 1.00 0.00 O ATOM 78 CG2 THR A 5 70.820 8.665 -4.307 1.00 0.00 C ATOM 0 H THR A 5 70.618 6.306 -1.372 1.00 0.00 H new ATOM 0 HA THR A 5 70.032 6.186 -4.248 1.00 0.00 H new ATOM 0 HB THR A 5 72.398 7.228 -4.572 1.00 0.00 H new ATOM 0 HG1 THR A 5 71.736 8.117 -1.919 1.00 0.00 H new ATOM 0 HG21 THR A 5 71.457 9.518 -4.542 1.00 0.00 H new ATOM 0 HG22 THR A 5 70.285 8.354 -5.204 1.00 0.00 H new ATOM 0 HG23 THR A 5 70.103 8.949 -3.537 1.00 0.00 H new ATOM 86 N LEU A 6 72.319 4.762 -4.523 1.00 0.00 N ATOM 87 CA LEU A 6 73.183 3.584 -4.591 1.00 0.00 C ATOM 88 C LEU A 6 74.406 3.773 -3.704 1.00 0.00 C ATOM 89 O LEU A 6 74.906 2.825 -3.097 1.00 0.00 O ATOM 90 CB LEU A 6 73.646 3.321 -6.029 1.00 0.00 C ATOM 91 CG LEU A 6 74.241 4.531 -6.771 1.00 0.00 C ATOM 92 CD1 LEU A 6 75.525 4.116 -7.495 1.00 0.00 C ATOM 93 CD2 LEU A 6 73.230 5.051 -7.798 1.00 0.00 C ATOM 0 H LEU A 6 72.280 5.313 -5.381 1.00 0.00 H new ATOM 0 HA LEU A 6 72.603 2.729 -4.243 1.00 0.00 H new ATOM 0 HB2 LEU A 6 74.392 2.526 -6.011 1.00 0.00 H new ATOM 0 HB3 LEU A 6 72.797 2.948 -6.602 1.00 0.00 H new ATOM 0 HG LEU A 6 74.468 5.315 -6.049 1.00 0.00 H new ATOM 0 HD11 LEU A 6 75.942 4.976 -8.019 1.00 0.00 H new ATOM 0 HD12 LEU A 6 76.249 3.747 -6.769 1.00 0.00 H new ATOM 0 HD13 LEU A 6 75.299 3.328 -8.214 1.00 0.00 H new ATOM 0 HD21 LEU A 6 73.652 5.908 -8.323 1.00 0.00 H new ATOM 0 HD22 LEU A 6 73.002 4.263 -8.515 1.00 0.00 H new ATOM 0 HD23 LEU A 6 72.315 5.353 -7.288 1.00 0.00 H new ATOM 105 N SER A 7 74.878 5.012 -3.629 1.00 0.00 N ATOM 106 CA SER A 7 76.042 5.324 -2.807 1.00 0.00 C ATOM 107 C SER A 7 75.729 5.074 -1.336 1.00 0.00 C ATOM 108 O SER A 7 76.602 4.698 -0.554 1.00 0.00 O ATOM 109 CB SER A 7 76.452 6.785 -2.989 1.00 0.00 C ATOM 110 OG SER A 7 77.369 6.885 -4.070 1.00 0.00 O ATOM 0 H SER A 7 74.478 5.810 -4.122 1.00 0.00 H new ATOM 0 HA SER A 7 76.862 4.679 -3.122 1.00 0.00 H new ATOM 0 HB2 SER A 7 75.573 7.399 -3.185 1.00 0.00 H new ATOM 0 HB3 SER A 7 76.908 7.163 -2.074 1.00 0.00 H new ATOM 0 HG SER A 7 77.632 7.821 -4.190 1.00 0.00 H new ATOM 116 N ASP A 8 74.468 5.285 -0.973 1.00 0.00 N ATOM 117 CA ASP A 8 74.036 5.081 0.400 1.00 0.00 C ATOM 118 C ASP A 8 73.991 3.593 0.725 1.00 0.00 C ATOM 119 O ASP A 8 74.780 3.091 1.522 1.00 0.00 O ATOM 120 CB ASP A 8 72.641 5.676 0.601 1.00 0.00 C ATOM 121 CG ASP A 8 72.720 7.197 0.538 1.00 0.00 C ATOM 122 OD1 ASP A 8 73.569 7.755 1.214 1.00 0.00 O ATOM 123 OD2 ASP A 8 71.929 7.780 -0.184 1.00 0.00 O ATOM 0 H ASP A 8 73.733 5.595 -1.608 1.00 0.00 H new ATOM 0 HA ASP A 8 74.747 5.575 1.062 1.00 0.00 H new ATOM 0 HB2 ASP A 8 71.962 5.305 -0.167 1.00 0.00 H new ATOM 0 HB3 ASP A 8 72.236 5.362 1.563 1.00 0.00 H new ATOM 128 N LEU A 9 73.054 2.893 0.089 1.00 0.00 N ATOM 129 CA LEU A 9 72.886 1.451 0.303 1.00 0.00 C ATOM 130 C LEU A 9 74.215 0.706 0.186 1.00 0.00 C ATOM 131 O LEU A 9 74.410 -0.341 0.800 1.00 0.00 O ATOM 132 CB LEU A 9 71.910 0.877 -0.724 1.00 0.00 C ATOM 133 CG LEU A 9 71.645 -0.625 -0.597 1.00 0.00 C ATOM 134 CD1 LEU A 9 70.928 -0.910 0.724 1.00 0.00 C ATOM 135 CD2 LEU A 9 70.767 -1.086 -1.762 1.00 0.00 C ATOM 0 H LEU A 9 72.398 3.298 -0.579 1.00 0.00 H new ATOM 0 HA LEU A 9 72.496 1.316 1.312 1.00 0.00 H new ATOM 0 HB2 LEU A 9 70.961 1.407 -0.637 1.00 0.00 H new ATOM 0 HB3 LEU A 9 72.297 1.079 -1.723 1.00 0.00 H new ATOM 0 HG LEU A 9 72.593 -1.163 -0.618 1.00 0.00 H new ATOM 0 HD11 LEU A 9 70.740 -1.980 0.813 1.00 0.00 H new ATOM 0 HD12 LEU A 9 71.552 -0.581 1.555 1.00 0.00 H new ATOM 0 HD13 LEU A 9 69.980 -0.372 0.747 1.00 0.00 H new ATOM 0 HD21 LEU A 9 70.577 -2.156 -1.673 1.00 0.00 H new ATOM 0 HD22 LEU A 9 69.820 -0.546 -1.740 1.00 0.00 H new ATOM 0 HD23 LEU A 9 71.277 -0.885 -2.704 1.00 0.00 H new ATOM 147 N LEU A 10 75.118 1.252 -0.621 1.00 0.00 N ATOM 148 CA LEU A 10 76.419 0.625 -0.824 1.00 0.00 C ATOM 149 C LEU A 10 77.300 0.743 0.419 1.00 0.00 C ATOM 150 O LEU A 10 77.804 -0.255 0.932 1.00 0.00 O ATOM 151 CB LEU A 10 77.138 1.262 -2.016 1.00 0.00 C ATOM 152 CG LEU A 10 76.833 0.618 -3.373 1.00 0.00 C ATOM 153 CD1 LEU A 10 77.001 1.657 -4.490 1.00 0.00 C ATOM 154 CD2 LEU A 10 77.797 -0.549 -3.607 1.00 0.00 C ATOM 0 H LEU A 10 74.976 2.118 -1.140 1.00 0.00 H new ATOM 0 HA LEU A 10 76.243 -0.432 -1.023 1.00 0.00 H new ATOM 0 HB2 LEU A 10 76.869 2.317 -2.062 1.00 0.00 H new ATOM 0 HB3 LEU A 10 78.213 1.215 -1.841 1.00 0.00 H new ATOM 0 HG LEU A 10 75.807 0.251 -3.378 1.00 0.00 H new ATOM 0 HD11 LEU A 10 76.783 1.195 -5.453 1.00 0.00 H new ATOM 0 HD12 LEU A 10 76.314 2.486 -4.322 1.00 0.00 H new ATOM 0 HD13 LEU A 10 78.026 2.029 -4.490 1.00 0.00 H new ATOM 0 HD21 LEU A 10 77.583 -1.010 -4.571 1.00 0.00 H new ATOM 0 HD22 LEU A 10 78.823 -0.181 -3.600 1.00 0.00 H new ATOM 0 HD23 LEU A 10 77.672 -1.288 -2.816 1.00 0.00 H new ATOM 166 N THR A 11 77.496 1.973 0.890 1.00 0.00 N ATOM 167 CA THR A 11 78.339 2.202 2.066 1.00 0.00 C ATOM 168 C THR A 11 77.809 1.430 3.280 1.00 0.00 C ATOM 169 O THR A 11 78.555 0.719 3.950 1.00 0.00 O ATOM 170 CB THR A 11 78.461 3.719 2.363 1.00 0.00 C ATOM 171 OG1 THR A 11 79.687 3.963 3.036 1.00 0.00 O ATOM 172 CG2 THR A 11 77.303 4.245 3.226 1.00 0.00 C ATOM 0 H THR A 11 77.090 2.816 0.484 1.00 0.00 H new ATOM 0 HA THR A 11 79.339 1.824 1.852 1.00 0.00 H new ATOM 0 HB THR A 11 78.425 4.244 1.408 1.00 0.00 H new ATOM 0 HG1 THR A 11 79.771 4.921 3.225 1.00 0.00 H new ATOM 0 HG21 THR A 11 77.437 5.312 3.404 1.00 0.00 H new ATOM 0 HG22 THR A 11 76.359 4.080 2.707 1.00 0.00 H new ATOM 0 HG23 THR A 11 77.291 3.717 4.179 1.00 0.00 H new ATOM 180 N LEU A 12 76.512 1.575 3.552 1.00 0.00 N ATOM 181 CA LEU A 12 75.907 0.875 4.690 1.00 0.00 C ATOM 182 C LEU A 12 76.107 -0.626 4.542 1.00 0.00 C ATOM 183 O LEU A 12 76.358 -1.334 5.518 1.00 0.00 O ATOM 184 CB LEU A 12 74.412 1.192 4.829 1.00 0.00 C ATOM 185 CG LEU A 12 73.603 1.223 3.520 1.00 0.00 C ATOM 186 CD1 LEU A 12 72.723 -0.027 3.421 1.00 0.00 C ATOM 187 CD2 LEU A 12 72.709 2.470 3.502 1.00 0.00 C ATOM 0 H LEU A 12 75.870 2.157 3.014 1.00 0.00 H new ATOM 0 HA LEU A 12 76.404 1.225 5.595 1.00 0.00 H new ATOM 0 HB2 LEU A 12 73.964 0.452 5.492 1.00 0.00 H new ATOM 0 HB3 LEU A 12 74.310 2.161 5.318 1.00 0.00 H new ATOM 0 HG LEU A 12 74.292 1.249 2.676 1.00 0.00 H new ATOM 0 HD11 LEU A 12 72.153 0.002 2.492 1.00 0.00 H new ATOM 0 HD12 LEU A 12 73.352 -0.917 3.433 1.00 0.00 H new ATOM 0 HD13 LEU A 12 72.036 -0.056 4.267 1.00 0.00 H new ATOM 0 HD21 LEU A 12 72.135 2.493 2.575 1.00 0.00 H new ATOM 0 HD22 LEU A 12 72.026 2.440 4.351 1.00 0.00 H new ATOM 0 HD23 LEU A 12 73.330 3.364 3.567 1.00 0.00 H new ATOM 199 N LEU A 13 76.041 -1.099 3.303 1.00 0.00 N ATOM 200 CA LEU A 13 76.270 -2.510 3.041 1.00 0.00 C ATOM 201 C LEU A 13 77.754 -2.797 3.242 1.00 0.00 C ATOM 202 O LEU A 13 78.141 -3.843 3.763 1.00 0.00 O ATOM 203 CB LEU A 13 75.863 -2.880 1.610 1.00 0.00 C ATOM 204 CG LEU A 13 74.467 -3.494 1.471 1.00 0.00 C ATOM 205 CD1 LEU A 13 74.044 -3.481 0.002 1.00 0.00 C ATOM 206 CD2 LEU A 13 74.496 -4.938 1.978 1.00 0.00 C ATOM 0 H LEU A 13 75.834 -0.535 2.478 1.00 0.00 H new ATOM 0 HA LEU A 13 75.665 -3.106 3.724 1.00 0.00 H new ATOM 0 HB2 LEU A 13 75.912 -1.984 0.991 1.00 0.00 H new ATOM 0 HB3 LEU A 13 76.594 -3.583 1.211 1.00 0.00 H new ATOM 0 HG LEU A 13 73.755 -2.913 2.058 1.00 0.00 H new ATOM 0 HD11 LEU A 13 73.050 -3.918 -0.094 1.00 0.00 H new ATOM 0 HD12 LEU A 13 74.025 -2.454 -0.362 1.00 0.00 H new ATOM 0 HD13 LEU A 13 74.755 -4.062 -0.586 1.00 0.00 H new ATOM 0 HD21 LEU A 13 73.503 -5.378 1.880 1.00 0.00 H new ATOM 0 HD22 LEU A 13 75.209 -5.516 1.390 1.00 0.00 H new ATOM 0 HD23 LEU A 13 74.797 -4.950 3.026 1.00 0.00 H new ATOM 218 N ARG A 14 78.578 -1.832 2.829 1.00 0.00 N ATOM 219 CA ARG A 14 80.022 -1.953 2.969 1.00 0.00 C ATOM 220 C ARG A 14 80.390 -2.042 4.457 1.00 0.00 C ATOM 221 O ARG A 14 81.238 -2.841 4.855 1.00 0.00 O ATOM 222 CB ARG A 14 80.706 -0.758 2.243 1.00 0.00 C ATOM 223 CG ARG A 14 81.394 0.243 3.197 1.00 0.00 C ATOM 224 CD ARG A 14 82.729 -0.331 3.676 1.00 0.00 C ATOM 225 NE ARG A 14 83.702 0.743 3.895 1.00 0.00 N ATOM 226 CZ ARG A 14 83.634 1.561 4.955 1.00 0.00 C ATOM 227 NH1 ARG A 14 82.685 1.435 5.852 1.00 0.00 N ATOM 228 NH2 ARG A 14 84.528 2.500 5.097 1.00 0.00 N ATOM 0 H ARG A 14 78.267 -0.962 2.397 1.00 0.00 H new ATOM 0 HA ARG A 14 80.383 -2.868 2.500 1.00 0.00 H new ATOM 0 HB2 ARG A 14 81.447 -1.146 1.544 1.00 0.00 H new ATOM 0 HB3 ARG A 14 79.958 -0.228 1.653 1.00 0.00 H new ATOM 0 HG2 ARG A 14 81.558 1.192 2.686 1.00 0.00 H new ATOM 0 HG3 ARG A 14 80.748 0.448 4.051 1.00 0.00 H new ATOM 0 HD2 ARG A 14 82.581 -0.889 4.601 1.00 0.00 H new ATOM 0 HD3 ARG A 14 83.115 -1.034 2.938 1.00 0.00 H new ATOM 0 HE ARG A 14 84.455 0.872 3.219 1.00 0.00 H new ATOM 0 HH11 ARG A 14 81.981 0.704 5.750 1.00 0.00 H new ATOM 0 HH12 ARG A 14 82.651 2.068 6.651 1.00 0.00 H new ATOM 0 HH21 ARG A 14 85.270 2.607 4.405 1.00 0.00 H new ATOM 0 HH22 ARG A 14 84.485 3.128 5.900 1.00 0.00 H new ATOM 242 N GLU A 15 79.733 -1.213 5.269 1.00 0.00 N ATOM 243 CA GLU A 15 79.989 -1.208 6.707 1.00 0.00 C ATOM 244 C GLU A 15 79.626 -2.565 7.298 1.00 0.00 C ATOM 245 O GLU A 15 80.384 -3.154 8.068 1.00 0.00 O ATOM 246 CB GLU A 15 79.156 -0.118 7.393 1.00 0.00 C ATOM 247 CG GLU A 15 79.500 -0.055 8.889 1.00 0.00 C ATOM 248 CD GLU A 15 80.160 1.283 9.216 1.00 0.00 C ATOM 249 OE1 GLU A 15 81.302 1.468 8.826 1.00 0.00 O ATOM 250 OE2 GLU A 15 79.515 2.100 9.851 1.00 0.00 O ATOM 0 H GLU A 15 79.028 -0.544 4.959 1.00 0.00 H new ATOM 0 HA GLU A 15 81.047 -1.005 6.872 1.00 0.00 H new ATOM 0 HB2 GLU A 15 79.351 0.847 6.926 1.00 0.00 H new ATOM 0 HB3 GLU A 15 78.094 -0.326 7.264 1.00 0.00 H new ATOM 0 HG2 GLU A 15 78.595 -0.179 9.484 1.00 0.00 H new ATOM 0 HG3 GLU A 15 80.169 -0.874 9.152 1.00 0.00 H new ATOM 257 N CYS A 16 78.456 -3.051 6.909 1.00 0.00 N ATOM 258 CA CYS A 16 77.974 -4.347 7.380 1.00 0.00 C ATOM 259 C CYS A 16 78.923 -5.449 6.936 1.00 0.00 C ATOM 260 O CYS A 16 79.246 -6.363 7.695 1.00 0.00 O ATOM 261 CB CYS A 16 76.591 -4.637 6.806 1.00 0.00 C ATOM 262 SG CYS A 16 75.748 -5.850 7.849 1.00 0.00 S ATOM 0 H CYS A 16 77.822 -2.571 6.270 1.00 0.00 H new ATOM 0 HA CYS A 16 77.922 -4.317 8.468 1.00 0.00 H new ATOM 0 HB2 CYS A 16 76.007 -3.718 6.754 1.00 0.00 H new ATOM 0 HB3 CYS A 16 76.680 -5.016 5.788 1.00 0.00 H new ATOM 0 HG CYS A 16 74.574 -6.107 7.353 1.00 0.00 H new ATOM 268 N ALA A 17 79.365 -5.346 5.688 1.00 0.00 N ATOM 269 CA ALA A 17 80.283 -6.335 5.129 1.00 0.00 C ATOM 270 C ALA A 17 81.584 -6.355 5.921 1.00 0.00 C ATOM 271 O ALA A 17 82.153 -7.414 6.185 1.00 0.00 O ATOM 272 CB ALA A 17 80.594 -6.011 3.667 1.00 0.00 C ATOM 0 H ALA A 17 79.106 -4.595 5.048 1.00 0.00 H new ATOM 0 HA ALA A 17 79.804 -7.312 5.188 1.00 0.00 H new ATOM 0 HB1 ALA A 17 81.279 -6.758 3.267 1.00 0.00 H new ATOM 0 HB2 ALA A 17 79.670 -6.019 3.088 1.00 0.00 H new ATOM 0 HB3 ALA A 17 81.054 -5.025 3.603 1.00 0.00 H new ATOM 278 N GLY A 18 82.048 -5.165 6.302 1.00 0.00 N ATOM 279 CA GLY A 18 83.288 -5.044 7.073 1.00 0.00 C ATOM 280 C GLY A 18 84.452 -5.739 6.368 1.00 0.00 C ATOM 281 O GLY A 18 85.379 -6.237 7.008 1.00 0.00 O ATOM 0 H GLY A 18 81.590 -4.278 6.093 1.00 0.00 H new ATOM 0 HA2 GLY A 18 83.526 -3.990 7.219 1.00 0.00 H new ATOM 0 HA3 GLY A 18 83.147 -5.480 8.062 1.00 0.00 H new ATOM 285 N GLU A 19 84.390 -5.770 5.040 1.00 0.00 N ATOM 286 CA GLU A 19 85.439 -6.407 4.251 1.00 0.00 C ATOM 287 C GLU A 19 85.229 -6.122 2.767 1.00 0.00 C ATOM 288 O GLU A 19 85.442 -6.982 1.911 1.00 0.00 O ATOM 289 CB GLU A 19 85.438 -7.921 4.483 1.00 0.00 C ATOM 290 CG GLU A 19 84.053 -8.490 4.163 1.00 0.00 C ATOM 291 CD GLU A 19 83.747 -9.649 5.105 1.00 0.00 C ATOM 292 OE1 GLU A 19 84.035 -9.520 6.283 1.00 0.00 O ATOM 293 OE2 GLU A 19 83.228 -10.648 4.635 1.00 0.00 O ATOM 0 H GLU A 19 83.631 -5.365 4.492 1.00 0.00 H new ATOM 0 HA GLU A 19 86.399 -5.998 4.565 1.00 0.00 H new ATOM 0 HB2 GLU A 19 86.191 -8.396 3.854 1.00 0.00 H new ATOM 0 HB3 GLU A 19 85.702 -8.141 5.517 1.00 0.00 H new ATOM 0 HG2 GLU A 19 83.296 -7.713 4.268 1.00 0.00 H new ATOM 0 HG3 GLU A 19 84.019 -8.830 3.128 1.00 0.00 H new ATOM 300 N GLU A 20 84.806 -4.896 2.479 1.00 0.00 N ATOM 301 CA GLU A 20 84.555 -4.473 1.110 1.00 0.00 C ATOM 302 C GLU A 20 84.083 -3.024 1.113 1.00 0.00 C ATOM 303 O GLU A 20 82.960 -2.730 1.513 1.00 0.00 O ATOM 304 CB GLU A 20 83.483 -5.350 0.461 1.00 0.00 C ATOM 305 CG GLU A 20 83.365 -4.989 -1.017 1.00 0.00 C ATOM 306 CD GLU A 20 82.536 -6.046 -1.738 1.00 0.00 C ATOM 307 OE1 GLU A 20 81.397 -6.246 -1.346 1.00 0.00 O ATOM 308 OE2 GLU A 20 83.051 -6.639 -2.671 1.00 0.00 O ATOM 0 H GLU A 20 84.630 -4.176 3.180 1.00 0.00 H new ATOM 0 HA GLU A 20 85.478 -4.568 0.538 1.00 0.00 H new ATOM 0 HB2 GLU A 20 83.742 -6.403 0.571 1.00 0.00 H new ATOM 0 HB3 GLU A 20 82.525 -5.204 0.961 1.00 0.00 H new ATOM 0 HG2 GLU A 20 82.899 -4.010 -1.126 1.00 0.00 H new ATOM 0 HG3 GLU A 20 84.356 -4.922 -1.465 1.00 0.00 H new ATOM 315 N GLU A 21 84.964 -2.124 0.676 1.00 0.00 N ATOM 316 CA GLU A 21 84.655 -0.686 0.639 1.00 0.00 C ATOM 317 C GLU A 21 83.267 -0.409 0.051 1.00 0.00 C ATOM 318 O GLU A 21 82.612 -1.303 -0.485 1.00 0.00 O ATOM 319 CB GLU A 21 85.700 0.056 -0.199 1.00 0.00 C ATOM 320 CG GLU A 21 85.893 1.468 0.358 1.00 0.00 C ATOM 321 CD GLU A 21 87.334 1.911 0.132 1.00 0.00 C ATOM 322 OE1 GLU A 21 88.170 1.581 0.957 1.00 0.00 O ATOM 323 OE2 GLU A 21 87.580 2.575 -0.861 1.00 0.00 O ATOM 0 H GLU A 21 85.898 -2.361 0.342 1.00 0.00 H new ATOM 0 HA GLU A 21 84.670 -0.331 1.669 1.00 0.00 H new ATOM 0 HB2 GLU A 21 86.646 -0.485 -0.182 1.00 0.00 H new ATOM 0 HB3 GLU A 21 85.379 0.105 -1.240 1.00 0.00 H new ATOM 0 HG2 GLU A 21 85.208 2.160 -0.131 1.00 0.00 H new ATOM 0 HG3 GLU A 21 85.658 1.486 1.422 1.00 0.00 H new ATOM 330 N SER A 22 82.832 0.851 0.167 1.00 0.00 N ATOM 331 CA SER A 22 81.518 1.278 -0.341 1.00 0.00 C ATOM 332 C SER A 22 81.239 0.714 -1.732 1.00 0.00 C ATOM 333 O SER A 22 80.288 -0.041 -1.935 1.00 0.00 O ATOM 334 CB SER A 22 81.452 2.804 -0.407 1.00 0.00 C ATOM 335 OG SER A 22 80.101 3.211 -0.582 1.00 0.00 O ATOM 0 H SER A 22 83.370 1.596 0.609 1.00 0.00 H new ATOM 0 HA SER A 22 80.765 0.895 0.347 1.00 0.00 H new ATOM 0 HB2 SER A 22 81.858 3.236 0.507 1.00 0.00 H new ATOM 0 HB3 SER A 22 82.063 3.170 -1.232 1.00 0.00 H new ATOM 0 HG SER A 22 80.078 4.124 -0.936 1.00 0.00 H new ATOM 341 N ILE A 23 82.082 1.089 -2.682 1.00 0.00 N ATOM 342 CA ILE A 23 81.927 0.620 -4.053 1.00 0.00 C ATOM 343 C ILE A 23 83.221 -0.056 -4.505 1.00 0.00 C ATOM 344 O ILE A 23 84.024 0.517 -5.242 1.00 0.00 O ATOM 345 CB ILE A 23 81.567 1.794 -4.986 1.00 0.00 C ATOM 346 CG1 ILE A 23 80.143 2.276 -4.674 1.00 0.00 C ATOM 347 CG2 ILE A 23 81.618 1.347 -6.454 1.00 0.00 C ATOM 348 CD1 ILE A 23 80.105 2.992 -3.319 1.00 0.00 C ATOM 0 H ILE A 23 82.875 1.712 -2.532 1.00 0.00 H new ATOM 0 HA ILE A 23 81.114 -0.104 -4.098 1.00 0.00 H new ATOM 0 HB ILE A 23 82.286 2.597 -4.825 1.00 0.00 H new ATOM 0 HG12 ILE A 23 79.801 2.951 -5.459 1.00 0.00 H new ATOM 0 HG13 ILE A 23 79.459 1.427 -4.663 1.00 0.00 H new ATOM 0 HG21 ILE A 23 81.361 2.187 -7.099 1.00 0.00 H new ATOM 0 HG22 ILE A 23 82.623 0.999 -6.694 1.00 0.00 H new ATOM 0 HG23 ILE A 23 80.906 0.537 -6.613 1.00 0.00 H new ATOM 0 HD11 ILE A 23 79.089 3.327 -3.113 1.00 0.00 H new ATOM 0 HD12 ILE A 23 80.426 2.306 -2.536 1.00 0.00 H new ATOM 0 HD13 ILE A 23 80.773 3.853 -3.344 1.00 0.00 H new ATOM 360 N ASP A 24 83.401 -1.287 -4.047 1.00 0.00 N ATOM 361 CA ASP A 24 84.587 -2.064 -4.395 1.00 0.00 C ATOM 362 C ASP A 24 84.272 -3.078 -5.496 1.00 0.00 C ATOM 363 O ASP A 24 85.165 -3.529 -6.212 1.00 0.00 O ATOM 364 CB ASP A 24 85.114 -2.811 -3.168 1.00 0.00 C ATOM 365 CG ASP A 24 86.568 -3.209 -3.400 1.00 0.00 C ATOM 366 OD1 ASP A 24 87.288 -2.427 -3.996 1.00 0.00 O ATOM 367 OD2 ASP A 24 86.939 -4.292 -2.977 1.00 0.00 O ATOM 0 H ASP A 24 82.744 -1.770 -3.435 1.00 0.00 H new ATOM 0 HA ASP A 24 85.345 -1.368 -4.755 1.00 0.00 H new ATOM 0 HB2 ASP A 24 85.036 -2.179 -2.283 1.00 0.00 H new ATOM 0 HB3 ASP A 24 84.508 -3.698 -2.981 1.00 0.00 H new ATOM 372 N LEU A 25 82.989 -3.433 -5.627 1.00 0.00 N ATOM 373 CA LEU A 25 82.565 -4.395 -6.646 1.00 0.00 C ATOM 374 C LEU A 25 83.043 -3.975 -8.038 1.00 0.00 C ATOM 375 O LEU A 25 83.225 -4.811 -8.923 1.00 0.00 O ATOM 376 CB LEU A 25 81.037 -4.499 -6.653 1.00 0.00 C ATOM 377 CG LEU A 25 80.406 -5.322 -5.517 1.00 0.00 C ATOM 378 CD1 LEU A 25 80.525 -6.813 -5.836 1.00 0.00 C ATOM 379 CD2 LEU A 25 81.107 -5.035 -4.181 1.00 0.00 C ATOM 0 H LEU A 25 82.233 -3.071 -5.045 1.00 0.00 H new ATOM 0 HA LEU A 25 83.008 -5.361 -6.402 1.00 0.00 H new ATOM 0 HB2 LEU A 25 80.625 -3.491 -6.615 1.00 0.00 H new ATOM 0 HB3 LEU A 25 80.728 -4.934 -7.603 1.00 0.00 H new ATOM 0 HG LEU A 25 79.356 -5.041 -5.431 1.00 0.00 H new ATOM 0 HD11 LEU A 25 80.077 -7.394 -5.030 1.00 0.00 H new ATOM 0 HD12 LEU A 25 80.006 -7.028 -6.770 1.00 0.00 H new ATOM 0 HD13 LEU A 25 81.577 -7.081 -5.936 1.00 0.00 H new ATOM 0 HD21 LEU A 25 80.644 -5.628 -3.392 1.00 0.00 H new ATOM 0 HD22 LEU A 25 82.162 -5.297 -4.260 1.00 0.00 H new ATOM 0 HD23 LEU A 25 81.013 -3.976 -3.941 1.00 0.00 H new ATOM 391 N GLY A 26 83.248 -2.671 -8.219 1.00 0.00 N ATOM 392 CA GLY A 26 83.711 -2.153 -9.505 1.00 0.00 C ATOM 393 C GLY A 26 82.655 -1.267 -10.168 1.00 0.00 C ATOM 394 O GLY A 26 82.686 -1.050 -11.379 1.00 0.00 O ATOM 0 H GLY A 26 83.103 -1.961 -7.501 1.00 0.00 H new ATOM 0 HA2 GLY A 26 84.627 -1.581 -9.359 1.00 0.00 H new ATOM 0 HA3 GLY A 26 83.956 -2.984 -10.166 1.00 0.00 H new ATOM 398 N GLY A 27 81.718 -0.750 -9.367 1.00 0.00 N ATOM 399 CA GLY A 27 80.663 0.115 -9.898 1.00 0.00 C ATOM 400 C GLY A 27 79.897 -0.573 -11.024 1.00 0.00 C ATOM 401 O GLY A 27 79.987 -0.177 -12.187 1.00 0.00 O ATOM 0 H GLY A 27 81.669 -0.913 -8.361 1.00 0.00 H new ATOM 0 HA2 GLY A 27 79.974 0.384 -9.098 1.00 0.00 H new ATOM 0 HA3 GLY A 27 81.101 1.042 -10.267 1.00 0.00 H new ATOM 405 N ASP A 28 79.140 -1.608 -10.669 1.00 0.00 N ATOM 406 CA ASP A 28 78.361 -2.343 -11.660 1.00 0.00 C ATOM 407 C ASP A 28 77.536 -3.439 -10.989 1.00 0.00 C ATOM 408 O ASP A 28 77.406 -4.548 -11.508 1.00 0.00 O ATOM 409 CB ASP A 28 79.284 -2.975 -12.706 1.00 0.00 C ATOM 410 CG ASP A 28 78.532 -3.125 -14.024 1.00 0.00 C ATOM 411 OD1 ASP A 28 78.547 -2.184 -14.801 1.00 0.00 O ATOM 412 OD2 ASP A 28 77.954 -4.178 -14.238 1.00 0.00 O ATOM 0 H ASP A 28 79.050 -1.953 -9.713 1.00 0.00 H new ATOM 0 HA ASP A 28 77.690 -1.638 -12.150 1.00 0.00 H new ATOM 0 HB2 ASP A 28 80.169 -2.354 -12.848 1.00 0.00 H new ATOM 0 HB3 ASP A 28 79.630 -3.949 -12.360 1.00 0.00 H new ATOM 417 N VAL A 29 76.975 -3.112 -9.829 1.00 0.00 N ATOM 418 CA VAL A 29 76.158 -4.076 -9.093 1.00 0.00 C ATOM 419 C VAL A 29 74.795 -3.481 -8.730 1.00 0.00 C ATOM 420 O VAL A 29 74.115 -3.974 -7.830 1.00 0.00 O ATOM 421 CB VAL A 29 76.868 -4.506 -7.809 1.00 0.00 C ATOM 422 CG1 VAL A 29 78.147 -5.268 -8.162 1.00 0.00 C ATOM 423 CG2 VAL A 29 77.226 -3.268 -6.984 1.00 0.00 C ATOM 0 H VAL A 29 77.068 -2.200 -9.381 1.00 0.00 H new ATOM 0 HA VAL A 29 76.008 -4.940 -9.740 1.00 0.00 H new ATOM 0 HB VAL A 29 76.208 -5.152 -7.230 1.00 0.00 H new ATOM 0 HG11 VAL A 29 78.653 -5.574 -7.246 1.00 0.00 H new ATOM 0 HG12 VAL A 29 77.894 -6.151 -8.749 1.00 0.00 H new ATOM 0 HG13 VAL A 29 78.807 -4.623 -8.742 1.00 0.00 H new ATOM 0 HG21 VAL A 29 77.732 -3.575 -6.069 1.00 0.00 H new ATOM 0 HG22 VAL A 29 77.885 -2.622 -7.564 1.00 0.00 H new ATOM 0 HG23 VAL A 29 76.316 -2.724 -6.731 1.00 0.00 H new ATOM 433 N GLU A 30 74.399 -2.421 -9.435 1.00 0.00 N ATOM 434 CA GLU A 30 73.121 -1.780 -9.171 1.00 0.00 C ATOM 435 C GLU A 30 71.963 -2.675 -9.609 1.00 0.00 C ATOM 436 O GLU A 30 70.877 -2.622 -9.045 1.00 0.00 O ATOM 437 CB GLU A 30 73.053 -0.437 -9.912 1.00 0.00 C ATOM 438 CG GLU A 30 73.092 -0.663 -11.429 1.00 0.00 C ATOM 439 CD GLU A 30 73.986 0.383 -12.087 1.00 0.00 C ATOM 440 OE1 GLU A 30 73.744 1.560 -11.872 1.00 0.00 O ATOM 441 OE2 GLU A 30 74.900 -0.007 -12.794 1.00 0.00 O ATOM 0 H GLU A 30 74.943 -1.995 -10.186 1.00 0.00 H new ATOM 0 HA GLU A 30 73.034 -1.608 -8.098 1.00 0.00 H new ATOM 0 HB2 GLU A 30 72.139 0.090 -9.640 1.00 0.00 H new ATOM 0 HB3 GLU A 30 73.888 0.195 -9.610 1.00 0.00 H new ATOM 0 HG2 GLU A 30 73.467 -1.663 -11.647 1.00 0.00 H new ATOM 0 HG3 GLU A 30 72.084 -0.603 -11.840 1.00 0.00 H new ATOM 448 N ASP A 31 72.205 -3.497 -10.622 1.00 0.00 N ATOM 449 CA ASP A 31 71.169 -4.390 -11.124 1.00 0.00 C ATOM 450 C ASP A 31 71.620 -5.844 -11.032 1.00 0.00 C ATOM 451 O ASP A 31 71.188 -6.694 -11.811 1.00 0.00 O ATOM 452 CB ASP A 31 70.838 -4.051 -12.576 1.00 0.00 C ATOM 453 CG ASP A 31 69.899 -2.851 -12.616 1.00 0.00 C ATOM 454 OD1 ASP A 31 68.868 -2.907 -11.964 1.00 0.00 O ATOM 455 OD2 ASP A 31 70.222 -1.893 -13.299 1.00 0.00 O ATOM 0 H ASP A 31 73.099 -3.564 -11.108 1.00 0.00 H new ATOM 0 HA ASP A 31 70.279 -4.257 -10.509 1.00 0.00 H new ATOM 0 HB2 ASP A 31 71.752 -3.829 -13.126 1.00 0.00 H new ATOM 0 HB3 ASP A 31 70.372 -4.907 -13.064 1.00 0.00 H new ATOM 460 N VAL A 32 72.479 -6.123 -10.056 1.00 0.00 N ATOM 461 CA VAL A 32 72.968 -7.480 -9.849 1.00 0.00 C ATOM 462 C VAL A 32 72.408 -8.024 -8.541 1.00 0.00 C ATOM 463 O VAL A 32 72.381 -7.326 -7.526 1.00 0.00 O ATOM 464 CB VAL A 32 74.498 -7.499 -9.791 1.00 0.00 C ATOM 465 CG1 VAL A 32 74.992 -8.944 -9.718 1.00 0.00 C ATOM 466 CG2 VAL A 32 75.062 -6.833 -11.048 1.00 0.00 C ATOM 0 H VAL A 32 72.848 -5.433 -9.401 1.00 0.00 H new ATOM 0 HA VAL A 32 72.641 -8.101 -10.683 1.00 0.00 H new ATOM 0 HB VAL A 32 74.833 -6.957 -8.907 1.00 0.00 H new ATOM 0 HG11 VAL A 32 76.081 -8.955 -9.677 1.00 0.00 H new ATOM 0 HG12 VAL A 32 74.590 -9.421 -8.824 1.00 0.00 H new ATOM 0 HG13 VAL A 32 74.657 -9.488 -10.601 1.00 0.00 H new ATOM 0 HG21 VAL A 32 76.151 -6.845 -11.009 1.00 0.00 H new ATOM 0 HG22 VAL A 32 74.724 -7.377 -11.930 1.00 0.00 H new ATOM 0 HG23 VAL A 32 74.713 -5.802 -11.101 1.00 0.00 H new ATOM 476 N ALA A 33 71.955 -9.275 -8.570 1.00 0.00 N ATOM 477 CA ALA A 33 71.388 -9.896 -7.372 1.00 0.00 C ATOM 478 C ALA A 33 72.390 -9.859 -6.221 1.00 0.00 C ATOM 479 O ALA A 33 73.596 -10.001 -6.423 1.00 0.00 O ATOM 480 CB ALA A 33 71.004 -11.350 -7.646 1.00 0.00 C ATOM 0 H ALA A 33 71.968 -9.873 -9.396 1.00 0.00 H new ATOM 0 HA ALA A 33 70.497 -9.331 -7.098 1.00 0.00 H new ATOM 0 HB1 ALA A 33 70.585 -11.792 -6.742 1.00 0.00 H new ATOM 0 HB2 ALA A 33 70.263 -11.386 -8.445 1.00 0.00 H new ATOM 0 HB3 ALA A 33 71.890 -11.910 -7.947 1.00 0.00 H new ATOM 486 N PHE A 34 71.874 -9.662 -5.007 1.00 0.00 N ATOM 487 CA PHE A 34 72.730 -9.602 -3.815 1.00 0.00 C ATOM 488 C PHE A 34 73.677 -10.801 -3.755 1.00 0.00 C ATOM 489 O PHE A 34 74.866 -10.661 -3.476 1.00 0.00 O ATOM 490 CB PHE A 34 71.877 -9.585 -2.548 1.00 0.00 C ATOM 491 CG PHE A 34 71.123 -8.280 -2.467 1.00 0.00 C ATOM 492 CD1 PHE A 34 71.816 -7.089 -2.214 1.00 0.00 C ATOM 493 CD2 PHE A 34 69.736 -8.257 -2.646 1.00 0.00 C ATOM 494 CE1 PHE A 34 71.121 -5.877 -2.140 1.00 0.00 C ATOM 495 CE2 PHE A 34 69.041 -7.043 -2.572 1.00 0.00 C ATOM 496 CZ PHE A 34 69.733 -5.854 -2.318 1.00 0.00 C ATOM 0 H PHE A 34 70.878 -9.542 -4.821 1.00 0.00 H new ATOM 0 HA PHE A 34 73.317 -8.686 -3.879 1.00 0.00 H new ATOM 0 HB2 PHE A 34 71.178 -10.421 -2.556 1.00 0.00 H new ATOM 0 HB3 PHE A 34 72.510 -9.707 -1.669 1.00 0.00 H new ATOM 0 HD1 PHE A 34 72.887 -7.106 -2.076 1.00 0.00 H new ATOM 0 HD2 PHE A 34 69.201 -9.175 -2.841 1.00 0.00 H new ATOM 0 HE1 PHE A 34 71.656 -4.959 -1.945 1.00 0.00 H new ATOM 0 HE2 PHE A 34 67.970 -7.025 -2.711 1.00 0.00 H new ATOM 0 HZ PHE A 34 69.196 -4.919 -2.259 1.00 0.00 H new ATOM 506 N ASP A 35 73.133 -11.982 -4.030 1.00 0.00 N ATOM 507 CA ASP A 35 73.931 -13.198 -4.015 1.00 0.00 C ATOM 508 C ASP A 35 74.894 -13.231 -5.204 1.00 0.00 C ATOM 509 O ASP A 35 75.913 -13.920 -5.170 1.00 0.00 O ATOM 510 CB ASP A 35 73.020 -14.422 -4.078 1.00 0.00 C ATOM 511 CG ASP A 35 72.051 -14.397 -2.900 1.00 0.00 C ATOM 512 OD1 ASP A 35 72.520 -14.385 -1.774 1.00 0.00 O ATOM 513 OD2 ASP A 35 70.856 -14.390 -3.141 1.00 0.00 O ATOM 0 H ASP A 35 72.150 -12.121 -4.264 1.00 0.00 H new ATOM 0 HA ASP A 35 74.507 -13.212 -3.090 1.00 0.00 H new ATOM 0 HB2 ASP A 35 72.467 -14.429 -5.017 1.00 0.00 H new ATOM 0 HB3 ASP A 35 73.616 -15.334 -4.053 1.00 0.00 H new ATOM 518 N ALA A 36 74.556 -12.491 -6.260 1.00 0.00 N ATOM 519 CA ALA A 36 75.392 -12.457 -7.453 1.00 0.00 C ATOM 520 C ALA A 36 76.625 -11.578 -7.248 1.00 0.00 C ATOM 521 O ALA A 36 77.645 -11.765 -7.912 1.00 0.00 O ATOM 522 CB ALA A 36 74.596 -11.920 -8.646 1.00 0.00 C ATOM 0 H ALA A 36 73.717 -11.913 -6.311 1.00 0.00 H new ATOM 0 HA ALA A 36 75.716 -13.479 -7.650 1.00 0.00 H new ATOM 0 HB1 ALA A 36 75.234 -11.900 -9.530 1.00 0.00 H new ATOM 0 HB2 ALA A 36 73.738 -12.566 -8.832 1.00 0.00 H new ATOM 0 HB3 ALA A 36 74.249 -10.910 -8.427 1.00 0.00 H new ATOM 528 N LEU A 37 76.531 -10.613 -6.333 1.00 0.00 N ATOM 529 CA LEU A 37 77.661 -9.723 -6.081 1.00 0.00 C ATOM 530 C LEU A 37 78.490 -10.208 -4.891 1.00 0.00 C ATOM 531 O LEU A 37 79.693 -9.957 -4.819 1.00 0.00 O ATOM 532 CB LEU A 37 77.183 -8.284 -5.838 1.00 0.00 C ATOM 533 CG LEU A 37 76.565 -8.003 -4.462 1.00 0.00 C ATOM 534 CD1 LEU A 37 77.672 -7.628 -3.468 1.00 0.00 C ATOM 535 CD2 LEU A 37 75.560 -6.848 -4.581 1.00 0.00 C ATOM 0 H LEU A 37 75.703 -10.431 -5.766 1.00 0.00 H new ATOM 0 HA LEU A 37 78.292 -9.735 -6.969 1.00 0.00 H new ATOM 0 HB2 LEU A 37 78.030 -7.613 -5.978 1.00 0.00 H new ATOM 0 HB3 LEU A 37 76.448 -8.033 -6.602 1.00 0.00 H new ATOM 0 HG LEU A 37 76.050 -8.895 -4.104 1.00 0.00 H new ATOM 0 HD11 LEU A 37 77.232 -7.429 -2.491 1.00 0.00 H new ATOM 0 HD12 LEU A 37 78.381 -8.452 -3.385 1.00 0.00 H new ATOM 0 HD13 LEU A 37 78.191 -6.737 -3.821 1.00 0.00 H new ATOM 0 HD21 LEU A 37 75.120 -6.647 -3.604 1.00 0.00 H new ATOM 0 HD22 LEU A 37 76.073 -5.955 -4.939 1.00 0.00 H new ATOM 0 HD23 LEU A 37 74.773 -7.121 -5.284 1.00 0.00 H new ATOM 547 N GLY A 38 77.844 -10.916 -3.965 1.00 0.00 N ATOM 548 CA GLY A 38 78.561 -11.432 -2.800 1.00 0.00 C ATOM 549 C GLY A 38 77.755 -11.301 -1.503 1.00 0.00 C ATOM 550 O GLY A 38 78.176 -11.805 -0.460 1.00 0.00 O ATOM 0 H GLY A 38 76.850 -11.141 -3.996 1.00 0.00 H new ATOM 0 HA2 GLY A 38 78.807 -12.481 -2.965 1.00 0.00 H new ATOM 0 HA3 GLY A 38 79.504 -10.896 -2.692 1.00 0.00 H new ATOM 554 N TYR A 39 76.603 -10.629 -1.555 1.00 0.00 N ATOM 555 CA TYR A 39 75.789 -10.468 -0.354 1.00 0.00 C ATOM 556 C TYR A 39 74.924 -11.704 -0.134 1.00 0.00 C ATOM 557 O TYR A 39 74.385 -12.276 -1.081 1.00 0.00 O ATOM 558 CB TYR A 39 74.890 -9.238 -0.483 1.00 0.00 C ATOM 559 CG TYR A 39 75.726 -7.980 -0.409 1.00 0.00 C ATOM 560 CD1 TYR A 39 76.640 -7.798 0.637 1.00 0.00 C ATOM 561 CD2 TYR A 39 75.583 -6.994 -1.390 1.00 0.00 C ATOM 562 CE1 TYR A 39 77.409 -6.632 0.700 1.00 0.00 C ATOM 563 CE2 TYR A 39 76.352 -5.827 -1.329 1.00 0.00 C ATOM 564 CZ TYR A 39 77.266 -5.645 -0.284 1.00 0.00 C ATOM 565 OH TYR A 39 78.027 -4.495 -0.225 1.00 0.00 O ATOM 0 H TYR A 39 76.221 -10.197 -2.397 1.00 0.00 H new ATOM 0 HA TYR A 39 76.456 -10.338 0.498 1.00 0.00 H new ATOM 0 HB2 TYR A 39 74.348 -9.270 -1.428 1.00 0.00 H new ATOM 0 HB3 TYR A 39 74.144 -9.237 0.312 1.00 0.00 H new ATOM 0 HD1 TYR A 39 76.751 -8.559 1.395 1.00 0.00 H new ATOM 0 HD2 TYR A 39 74.878 -7.134 -2.196 1.00 0.00 H new ATOM 0 HE1 TYR A 39 78.113 -6.492 1.507 1.00 0.00 H new ATOM 0 HE2 TYR A 39 76.241 -5.067 -2.088 1.00 0.00 H new ATOM 0 HH TYR A 39 78.439 -4.421 0.661 1.00 0.00 H new ATOM 575 N ASP A 40 74.797 -12.115 1.126 1.00 0.00 N ATOM 576 CA ASP A 40 73.994 -13.290 1.448 1.00 0.00 C ATOM 577 C ASP A 40 72.571 -12.873 1.793 1.00 0.00 C ATOM 578 O ASP A 40 71.642 -13.057 1.006 1.00 0.00 O ATOM 579 CB ASP A 40 74.604 -14.051 2.629 1.00 0.00 C ATOM 580 CG ASP A 40 75.860 -14.783 2.167 1.00 0.00 C ATOM 581 OD1 ASP A 40 75.771 -15.521 1.201 1.00 0.00 O ATOM 582 OD2 ASP A 40 76.893 -14.593 2.789 1.00 0.00 O ATOM 0 H ASP A 40 75.232 -11.660 1.928 1.00 0.00 H new ATOM 0 HA ASP A 40 73.978 -13.944 0.576 1.00 0.00 H new ATOM 0 HB2 ASP A 40 74.849 -13.358 3.434 1.00 0.00 H new ATOM 0 HB3 ASP A 40 73.882 -14.763 3.029 1.00 0.00 H new ATOM 587 N SER A 41 72.417 -12.307 2.981 1.00 0.00 N ATOM 588 CA SER A 41 71.115 -11.853 3.452 1.00 0.00 C ATOM 589 C SER A 41 71.256 -11.315 4.865 1.00 0.00 C ATOM 590 O SER A 41 70.694 -10.280 5.216 1.00 0.00 O ATOM 591 CB SER A 41 70.099 -12.999 3.452 1.00 0.00 C ATOM 592 OG SER A 41 68.813 -12.488 3.122 1.00 0.00 O ATOM 0 H SER A 41 73.180 -12.150 3.639 1.00 0.00 H new ATOM 0 HA SER A 41 70.758 -11.073 2.780 1.00 0.00 H new ATOM 0 HB2 SER A 41 70.395 -13.763 2.733 1.00 0.00 H new ATOM 0 HB3 SER A 41 70.073 -13.477 4.431 1.00 0.00 H new ATOM 0 HG SER A 41 68.161 -13.220 3.120 1.00 0.00 H new ATOM 598 N LEU A 42 72.036 -12.036 5.669 1.00 0.00 N ATOM 599 CA LEU A 42 72.273 -11.642 7.058 1.00 0.00 C ATOM 600 C LEU A 42 72.797 -10.208 7.130 1.00 0.00 C ATOM 601 O LEU A 42 72.359 -9.411 7.961 1.00 0.00 O ATOM 602 CB LEU A 42 73.288 -12.583 7.712 1.00 0.00 C ATOM 603 CG LEU A 42 73.016 -12.907 9.182 1.00 0.00 C ATOM 604 CD1 LEU A 42 74.079 -13.880 9.696 1.00 0.00 C ATOM 605 CD2 LEU A 42 73.066 -11.619 10.006 1.00 0.00 C ATOM 0 H LEU A 42 72.513 -12.892 5.385 1.00 0.00 H new ATOM 0 HA LEU A 42 71.325 -11.703 7.592 1.00 0.00 H new ATOM 0 HB2 LEU A 42 73.312 -13.516 7.148 1.00 0.00 H new ATOM 0 HB3 LEU A 42 74.279 -12.137 7.631 1.00 0.00 H new ATOM 0 HG LEU A 42 72.030 -13.362 9.276 1.00 0.00 H new ATOM 0 HD11 LEU A 42 73.885 -14.111 10.743 1.00 0.00 H new ATOM 0 HD12 LEU A 42 74.045 -14.798 9.110 1.00 0.00 H new ATOM 0 HD13 LEU A 42 75.065 -13.425 9.601 1.00 0.00 H new ATOM 0 HD21 LEU A 42 72.872 -11.850 11.054 1.00 0.00 H new ATOM 0 HD22 LEU A 42 74.052 -11.164 9.911 1.00 0.00 H new ATOM 0 HD23 LEU A 42 72.309 -10.924 9.641 1.00 0.00 H new ATOM 617 N ALA A 43 73.733 -9.888 6.242 1.00 0.00 N ATOM 618 CA ALA A 43 74.300 -8.546 6.209 1.00 0.00 C ATOM 619 C ALA A 43 73.250 -7.551 5.745 1.00 0.00 C ATOM 620 O ALA A 43 73.123 -6.465 6.304 1.00 0.00 O ATOM 621 CB ALA A 43 75.500 -8.489 5.264 1.00 0.00 C ATOM 0 H ALA A 43 74.110 -10.530 5.545 1.00 0.00 H new ATOM 0 HA ALA A 43 74.630 -8.290 7.216 1.00 0.00 H new ATOM 0 HB1 ALA A 43 75.908 -7.478 5.254 1.00 0.00 H new ATOM 0 HB2 ALA A 43 76.265 -9.186 5.605 1.00 0.00 H new ATOM 0 HB3 ALA A 43 75.184 -8.762 4.257 1.00 0.00 H new ATOM 627 N LEU A 44 72.493 -7.943 4.726 1.00 0.00 N ATOM 628 CA LEU A 44 71.443 -7.082 4.193 1.00 0.00 C ATOM 629 C LEU A 44 70.384 -6.836 5.257 1.00 0.00 C ATOM 630 O LEU A 44 69.894 -5.721 5.428 1.00 0.00 O ATOM 631 CB LEU A 44 70.798 -7.733 2.973 1.00 0.00 C ATOM 632 CG LEU A 44 71.518 -7.454 1.656 1.00 0.00 C ATOM 633 CD1 LEU A 44 70.959 -8.358 0.555 1.00 0.00 C ATOM 634 CD2 LEU A 44 71.309 -5.989 1.278 1.00 0.00 C ATOM 0 H LEU A 44 72.585 -8.843 4.256 1.00 0.00 H new ATOM 0 HA LEU A 44 71.887 -6.131 3.898 1.00 0.00 H new ATOM 0 HB2 LEU A 44 70.758 -8.811 3.130 1.00 0.00 H new ATOM 0 HB3 LEU A 44 69.769 -7.384 2.892 1.00 0.00 H new ATOM 0 HG LEU A 44 72.583 -7.657 1.770 1.00 0.00 H new ATOM 0 HD11 LEU A 44 71.477 -8.153 -0.382 1.00 0.00 H new ATOM 0 HD12 LEU A 44 71.107 -9.402 0.831 1.00 0.00 H new ATOM 0 HD13 LEU A 44 69.894 -8.163 0.430 1.00 0.00 H new ATOM 0 HD21 LEU A 44 71.820 -5.779 0.338 1.00 0.00 H new ATOM 0 HD22 LEU A 44 70.243 -5.791 1.164 1.00 0.00 H new ATOM 0 HD23 LEU A 44 71.715 -5.350 2.062 1.00 0.00 H new ATOM 646 N LEU A 45 70.055 -7.900 5.979 1.00 0.00 N ATOM 647 CA LEU A 45 69.062 -7.824 7.053 1.00 0.00 C ATOM 648 C LEU A 45 69.441 -6.724 8.046 1.00 0.00 C ATOM 649 O LEU A 45 68.598 -5.937 8.479 1.00 0.00 O ATOM 650 CB LEU A 45 68.976 -9.175 7.783 1.00 0.00 C ATOM 651 CG LEU A 45 68.227 -9.174 9.123 1.00 0.00 C ATOM 652 CD1 LEU A 45 66.857 -8.515 8.949 1.00 0.00 C ATOM 653 CD2 LEU A 45 68.039 -10.616 9.600 1.00 0.00 C ATOM 0 H LEU A 45 70.459 -8.827 5.844 1.00 0.00 H new ATOM 0 HA LEU A 45 68.091 -7.588 6.617 1.00 0.00 H new ATOM 0 HB2 LEU A 45 68.492 -9.892 7.120 1.00 0.00 H new ATOM 0 HB3 LEU A 45 69.990 -9.536 7.957 1.00 0.00 H new ATOM 0 HG LEU A 45 68.805 -8.615 9.859 1.00 0.00 H new ATOM 0 HD11 LEU A 45 66.329 -8.516 9.902 1.00 0.00 H new ATOM 0 HD12 LEU A 45 66.988 -7.488 8.608 1.00 0.00 H new ATOM 0 HD13 LEU A 45 66.277 -9.071 8.212 1.00 0.00 H new ATOM 0 HD21 LEU A 45 67.507 -10.618 10.552 1.00 0.00 H new ATOM 0 HD22 LEU A 45 67.462 -11.171 8.861 1.00 0.00 H new ATOM 0 HD23 LEU A 45 69.014 -11.087 9.728 1.00 0.00 H new ATOM 665 N ASN A 46 70.723 -6.678 8.389 1.00 0.00 N ATOM 666 CA ASN A 46 71.215 -5.672 9.320 1.00 0.00 C ATOM 667 C ASN A 46 71.175 -4.292 8.673 1.00 0.00 C ATOM 668 O ASN A 46 70.661 -3.335 9.252 1.00 0.00 O ATOM 669 CB ASN A 46 72.650 -5.981 9.742 1.00 0.00 C ATOM 670 CG ASN A 46 72.701 -7.348 10.413 1.00 0.00 C ATOM 671 OD1 ASN A 46 71.972 -7.605 11.371 1.00 0.00 O ATOM 672 ND2 ASN A 46 73.529 -8.249 9.962 1.00 0.00 N ATOM 0 H ASN A 46 71.435 -7.320 8.040 1.00 0.00 H new ATOM 0 HA ASN A 46 70.572 -5.685 10.200 1.00 0.00 H new ATOM 0 HB2 ASN A 46 73.307 -5.967 8.872 1.00 0.00 H new ATOM 0 HB3 ASN A 46 73.012 -5.214 10.427 1.00 0.00 H new ATOM 0 HD21 ASN A 46 73.573 -9.168 10.403 1.00 0.00 H new ATOM 0 HD22 ASN A 46 74.133 -8.035 9.168 1.00 0.00 H new ATOM 679 N THR A 47 71.730 -4.196 7.463 1.00 0.00 N ATOM 680 CA THR A 47 71.753 -2.915 6.746 1.00 0.00 C ATOM 681 C THR A 47 70.338 -2.365 6.568 1.00 0.00 C ATOM 682 O THR A 47 70.052 -1.227 6.937 1.00 0.00 O ATOM 683 CB THR A 47 72.417 -3.059 5.359 1.00 0.00 C ATOM 684 OG1 THR A 47 72.645 -4.427 5.076 1.00 0.00 O ATOM 685 CG2 THR A 47 73.753 -2.312 5.340 1.00 0.00 C ATOM 0 H THR A 47 72.163 -4.973 6.964 1.00 0.00 H new ATOM 0 HA THR A 47 72.339 -2.221 7.349 1.00 0.00 H new ATOM 0 HB THR A 47 71.753 -2.636 4.605 1.00 0.00 H new ATOM 0 HG1 THR A 47 73.269 -4.798 5.735 1.00 0.00 H new ATOM 0 HG21 THR A 47 74.215 -2.418 4.359 1.00 0.00 H new ATOM 0 HG22 THR A 47 73.582 -1.256 5.548 1.00 0.00 H new ATOM 0 HG23 THR A 47 74.414 -2.729 6.100 1.00 0.00 H new ATOM 693 N VAL A 48 69.456 -3.190 6.002 1.00 0.00 N ATOM 694 CA VAL A 48 68.060 -2.784 5.770 1.00 0.00 C ATOM 695 C VAL A 48 67.438 -2.218 7.048 1.00 0.00 C ATOM 696 O VAL A 48 66.748 -1.199 7.017 1.00 0.00 O ATOM 697 CB VAL A 48 67.227 -3.977 5.277 1.00 0.00 C ATOM 698 CG1 VAL A 48 65.797 -3.521 4.960 1.00 0.00 C ATOM 699 CG2 VAL A 48 67.864 -4.556 4.007 1.00 0.00 C ATOM 0 H VAL A 48 69.676 -4.138 5.696 1.00 0.00 H new ATOM 0 HA VAL A 48 68.061 -2.007 5.005 1.00 0.00 H new ATOM 0 HB VAL A 48 67.199 -4.738 6.057 1.00 0.00 H new ATOM 0 HG11 VAL A 48 65.213 -4.372 4.611 1.00 0.00 H new ATOM 0 HG12 VAL A 48 65.338 -3.110 5.859 1.00 0.00 H new ATOM 0 HG13 VAL A 48 65.823 -2.756 4.184 1.00 0.00 H new ATOM 0 HG21 VAL A 48 67.273 -5.402 3.657 1.00 0.00 H new ATOM 0 HG22 VAL A 48 67.894 -3.789 3.233 1.00 0.00 H new ATOM 0 HG23 VAL A 48 68.878 -4.888 4.228 1.00 0.00 H new ATOM 709 N GLY A 49 67.699 -2.881 8.170 1.00 0.00 N ATOM 710 CA GLY A 49 67.166 -2.416 9.449 1.00 0.00 C ATOM 711 C GLY A 49 67.702 -1.022 9.759 1.00 0.00 C ATOM 712 O GLY A 49 67.006 -0.179 10.329 1.00 0.00 O ATOM 0 H GLY A 49 68.266 -3.727 8.223 1.00 0.00 H new ATOM 0 HA2 GLY A 49 66.077 -2.397 9.413 1.00 0.00 H new ATOM 0 HA3 GLY A 49 67.447 -3.108 10.243 1.00 0.00 H new ATOM 716 N ARG A 50 68.950 -0.792 9.360 1.00 0.00 N ATOM 717 CA ARG A 50 69.585 0.498 9.583 1.00 0.00 C ATOM 718 C ARG A 50 68.915 1.570 8.734 1.00 0.00 C ATOM 719 O ARG A 50 68.777 2.715 9.157 1.00 0.00 O ATOM 720 CB ARG A 50 71.071 0.434 9.227 1.00 0.00 C ATOM 721 CG ARG A 50 71.777 1.685 9.755 1.00 0.00 C ATOM 722 CD ARG A 50 71.819 2.751 8.659 1.00 0.00 C ATOM 723 NE ARG A 50 72.932 3.675 8.879 1.00 0.00 N ATOM 724 CZ ARG A 50 73.359 4.517 7.926 1.00 0.00 C ATOM 725 NH1 ARG A 50 72.793 4.549 6.743 1.00 0.00 N ATOM 726 NH2 ARG A 50 74.357 5.320 8.180 1.00 0.00 N ATOM 0 H ARG A 50 69.536 -1.478 8.884 1.00 0.00 H new ATOM 0 HA ARG A 50 69.478 0.749 10.638 1.00 0.00 H new ATOM 0 HB2 ARG A 50 71.521 -0.460 9.659 1.00 0.00 H new ATOM 0 HB3 ARG A 50 71.194 0.363 8.146 1.00 0.00 H new ATOM 0 HG2 ARG A 50 71.253 2.069 10.630 1.00 0.00 H new ATOM 0 HG3 ARG A 50 72.789 1.436 10.074 1.00 0.00 H new ATOM 0 HD2 ARG A 50 71.923 2.274 7.684 1.00 0.00 H new ATOM 0 HD3 ARG A 50 70.879 3.303 8.645 1.00 0.00 H new ATOM 0 HE ARG A 50 73.398 3.679 9.786 1.00 0.00 H new ATOM 0 HH11 ARG A 50 72.013 3.926 6.534 1.00 0.00 H new ATOM 0 HH12 ARG A 50 73.133 5.197 6.032 1.00 0.00 H new ATOM 0 HH21 ARG A 50 74.805 5.303 9.096 1.00 0.00 H new ATOM 0 HH22 ARG A 50 74.689 5.964 7.462 1.00 0.00 H new ATOM 740 N ILE A 51 68.489 1.189 7.531 1.00 0.00 N ATOM 741 CA ILE A 51 67.825 2.140 6.643 1.00 0.00 C ATOM 742 C ILE A 51 66.473 2.524 7.218 1.00 0.00 C ATOM 743 O ILE A 51 66.180 3.698 7.424 1.00 0.00 O ATOM 744 CB ILE A 51 67.606 1.557 5.237 1.00 0.00 C ATOM 745 CG1 ILE A 51 68.864 0.829 4.736 1.00 0.00 C ATOM 746 CG2 ILE A 51 67.265 2.694 4.272 1.00 0.00 C ATOM 747 CD1 ILE A 51 70.075 1.769 4.740 1.00 0.00 C ATOM 0 H ILE A 51 68.589 0.246 7.154 1.00 0.00 H new ATOM 0 HA ILE A 51 68.474 3.012 6.562 1.00 0.00 H new ATOM 0 HB ILE A 51 66.788 0.838 5.284 1.00 0.00 H new ATOM 0 HG12 ILE A 51 69.066 -0.035 5.369 1.00 0.00 H new ATOM 0 HG13 ILE A 51 68.694 0.452 3.728 1.00 0.00 H new ATOM 0 HG21 ILE A 51 67.108 2.288 3.273 1.00 0.00 H new ATOM 0 HG22 ILE A 51 66.357 3.195 4.607 1.00 0.00 H new ATOM 0 HG23 ILE A 51 68.087 3.410 4.248 1.00 0.00 H new ATOM 0 HD11 ILE A 51 70.953 1.232 4.382 1.00 0.00 H new ATOM 0 HD12 ILE A 51 69.878 2.619 4.087 1.00 0.00 H new ATOM 0 HD13 ILE A 51 70.256 2.125 5.754 1.00 0.00 H new ATOM 759 N GLU A 52 65.647 1.517 7.474 1.00 0.00 N ATOM 760 CA GLU A 52 64.318 1.765 8.025 1.00 0.00 C ATOM 761 C GLU A 52 64.397 2.519 9.356 1.00 0.00 C ATOM 762 O GLU A 52 63.422 3.132 9.785 1.00 0.00 O ATOM 763 CB GLU A 52 63.566 0.450 8.238 1.00 0.00 C ATOM 764 CG GLU A 52 64.374 -0.463 9.165 1.00 0.00 C ATOM 765 CD GLU A 52 63.626 -1.776 9.364 1.00 0.00 C ATOM 766 OE1 GLU A 52 62.720 -1.801 10.181 1.00 0.00 O ATOM 767 OE2 GLU A 52 63.970 -2.738 8.697 1.00 0.00 O ATOM 0 H GLU A 52 65.868 0.534 7.312 1.00 0.00 H new ATOM 0 HA GLU A 52 63.780 2.380 7.303 1.00 0.00 H new ATOM 0 HB2 GLU A 52 62.585 0.647 8.670 1.00 0.00 H new ATOM 0 HB3 GLU A 52 63.399 -0.044 7.281 1.00 0.00 H new ATOM 0 HG2 GLU A 52 65.358 -0.654 8.737 1.00 0.00 H new ATOM 0 HG3 GLU A 52 64.534 0.026 10.126 1.00 0.00 H new ATOM 774 N ARG A 53 65.559 2.466 10.012 1.00 0.00 N ATOM 775 CA ARG A 53 65.717 3.155 11.289 1.00 0.00 C ATOM 776 C ARG A 53 66.353 4.530 11.094 1.00 0.00 C ATOM 777 O ARG A 53 65.927 5.518 11.693 1.00 0.00 O ATOM 778 CB ARG A 53 66.589 2.332 12.239 1.00 0.00 C ATOM 779 CG ARG A 53 66.192 2.631 13.686 1.00 0.00 C ATOM 780 CD ARG A 53 64.855 1.957 14.002 1.00 0.00 C ATOM 781 NE ARG A 53 64.069 2.774 14.929 1.00 0.00 N ATOM 782 CZ ARG A 53 64.433 2.952 16.207 1.00 0.00 C ATOM 783 NH1 ARG A 53 65.518 2.395 16.689 1.00 0.00 N ATOM 784 NH2 ARG A 53 63.693 3.693 16.986 1.00 0.00 N ATOM 0 H ARG A 53 66.386 1.964 9.687 1.00 0.00 H new ATOM 0 HA ARG A 53 64.724 3.279 11.721 1.00 0.00 H new ATOM 0 HB2 ARG A 53 66.469 1.269 12.030 1.00 0.00 H new ATOM 0 HB3 ARG A 53 67.641 2.571 12.083 1.00 0.00 H new ATOM 0 HG2 ARG A 53 66.963 2.270 14.367 1.00 0.00 H new ATOM 0 HG3 ARG A 53 66.112 3.708 13.837 1.00 0.00 H new ATOM 0 HD2 ARG A 53 64.294 1.802 13.081 1.00 0.00 H new ATOM 0 HD3 ARG A 53 65.032 0.973 14.437 1.00 0.00 H new ATOM 0 HE ARG A 53 63.217 3.222 14.591 1.00 0.00 H new ATOM 0 HH11 ARG A 53 66.103 1.814 16.089 1.00 0.00 H new ATOM 0 HH12 ARG A 53 65.777 2.543 17.664 1.00 0.00 H new ATOM 0 HH21 ARG A 53 62.847 4.130 16.621 1.00 0.00 H new ATOM 0 HH22 ARG A 53 63.961 3.835 17.960 1.00 0.00 H new ATOM 798 N ASP A 54 67.382 4.581 10.256 1.00 0.00 N ATOM 799 CA ASP A 54 68.079 5.834 9.991 1.00 0.00 C ATOM 800 C ASP A 54 67.243 6.744 9.099 1.00 0.00 C ATOM 801 O ASP A 54 67.235 7.964 9.268 1.00 0.00 O ATOM 802 CB ASP A 54 69.416 5.563 9.302 1.00 0.00 C ATOM 803 CG ASP A 54 70.441 5.108 10.334 1.00 0.00 C ATOM 804 OD1 ASP A 54 70.166 4.142 11.028 1.00 0.00 O ATOM 805 OD2 ASP A 54 71.486 5.731 10.416 1.00 0.00 O ATOM 0 H ASP A 54 67.750 3.775 9.751 1.00 0.00 H new ATOM 0 HA ASP A 54 68.249 6.327 10.948 1.00 0.00 H new ATOM 0 HB2 ASP A 54 69.293 4.798 8.535 1.00 0.00 H new ATOM 0 HB3 ASP A 54 69.767 6.464 8.799 1.00 0.00 H new ATOM 810 N TYR A 55 66.542 6.141 8.146 1.00 0.00 N ATOM 811 CA TYR A 55 65.708 6.908 7.229 1.00 0.00 C ATOM 812 C TYR A 55 64.261 6.950 7.720 1.00 0.00 C ATOM 813 O TYR A 55 63.499 7.845 7.355 1.00 0.00 O ATOM 814 CB TYR A 55 65.742 6.295 5.824 1.00 0.00 C ATOM 815 CG TYR A 55 67.050 6.636 5.144 1.00 0.00 C ATOM 816 CD1 TYR A 55 68.264 6.233 5.715 1.00 0.00 C ATOM 817 CD2 TYR A 55 67.047 7.350 3.939 1.00 0.00 C ATOM 818 CE1 TYR A 55 69.474 6.546 5.082 1.00 0.00 C ATOM 819 CE2 TYR A 55 68.257 7.661 3.306 1.00 0.00 C ATOM 820 CZ TYR A 55 69.470 7.260 3.878 1.00 0.00 C ATOM 821 OH TYR A 55 70.663 7.567 3.254 1.00 0.00 O ATOM 0 H TYR A 55 66.534 5.133 7.989 1.00 0.00 H new ATOM 0 HA TYR A 55 66.106 7.922 7.191 1.00 0.00 H new ATOM 0 HB2 TYR A 55 65.626 5.213 5.887 1.00 0.00 H new ATOM 0 HB3 TYR A 55 64.906 6.671 5.234 1.00 0.00 H new ATOM 0 HD1 TYR A 55 68.267 5.681 6.643 1.00 0.00 H new ATOM 0 HD2 TYR A 55 66.111 7.661 3.498 1.00 0.00 H new ATOM 0 HE1 TYR A 55 70.410 6.236 5.523 1.00 0.00 H new ATOM 0 HE2 TYR A 55 68.254 8.210 2.376 1.00 0.00 H new ATOM 0 HH TYR A 55 70.482 8.064 2.429 1.00 0.00 H new ATOM 831 N GLY A 56 63.882 5.972 8.547 1.00 0.00 N ATOM 832 CA GLY A 56 62.516 5.926 9.064 1.00 0.00 C ATOM 833 C GLY A 56 61.529 5.736 7.922 1.00 0.00 C ATOM 834 O GLY A 56 60.483 6.385 7.869 1.00 0.00 O ATOM 0 H GLY A 56 64.489 5.217 8.866 1.00 0.00 H new ATOM 0 HA2 GLY A 56 62.417 5.110 9.779 1.00 0.00 H new ATOM 0 HA3 GLY A 56 62.291 6.848 9.600 1.00 0.00 H new ATOM 838 N VAL A 57 61.880 4.847 6.997 1.00 0.00 N ATOM 839 CA VAL A 57 61.021 4.587 5.842 1.00 0.00 C ATOM 840 C VAL A 57 60.990 3.102 5.504 1.00 0.00 C ATOM 841 O VAL A 57 62.006 2.409 5.577 1.00 0.00 O ATOM 842 CB VAL A 57 61.511 5.366 4.619 1.00 0.00 C ATOM 843 CG1 VAL A 57 61.215 6.852 4.818 1.00 0.00 C ATOM 844 CG2 VAL A 57 63.020 5.165 4.439 1.00 0.00 C ATOM 0 H VAL A 57 62.741 4.300 7.021 1.00 0.00 H new ATOM 0 HA VAL A 57 60.015 4.914 6.104 1.00 0.00 H new ATOM 0 HB VAL A 57 60.996 5.002 3.730 1.00 0.00 H new ATOM 0 HG11 VAL A 57 61.562 7.412 3.949 1.00 0.00 H new ATOM 0 HG12 VAL A 57 60.141 6.996 4.937 1.00 0.00 H new ATOM 0 HG13 VAL A 57 61.730 7.209 5.710 1.00 0.00 H new ATOM 0 HG21 VAL A 57 63.360 5.723 3.566 1.00 0.00 H new ATOM 0 HG22 VAL A 57 63.543 5.524 5.325 1.00 0.00 H new ATOM 0 HG23 VAL A 57 63.232 4.105 4.297 1.00 0.00 H new ATOM 854 N GLN A 58 59.805 2.622 5.130 1.00 0.00 N ATOM 855 CA GLN A 58 59.634 1.219 4.778 1.00 0.00 C ATOM 856 C GLN A 58 58.187 0.958 4.356 1.00 0.00 C ATOM 857 O GLN A 58 57.259 1.112 5.150 1.00 0.00 O ATOM 858 CB GLN A 58 59.984 0.332 5.981 1.00 0.00 C ATOM 859 CG GLN A 58 61.001 -0.740 5.569 1.00 0.00 C ATOM 860 CD GLN A 58 60.286 -2.057 5.284 1.00 0.00 C ATOM 861 OE1 GLN A 58 59.165 -2.278 5.741 1.00 0.00 O ATOM 862 NE2 GLN A 58 60.880 -2.957 4.549 1.00 0.00 N ATOM 0 H GLN A 58 58.955 3.183 5.064 1.00 0.00 H new ATOM 0 HA GLN A 58 60.299 0.981 3.948 1.00 0.00 H new ATOM 0 HB2 GLN A 58 60.394 0.943 6.786 1.00 0.00 H new ATOM 0 HB3 GLN A 58 59.082 -0.142 6.368 1.00 0.00 H new ATOM 0 HG2 GLN A 58 61.546 -0.414 4.683 1.00 0.00 H new ATOM 0 HG3 GLN A 58 61.735 -0.880 6.362 1.00 0.00 H new ATOM 0 HE21 GLN A 58 61.809 -2.774 4.170 1.00 0.00 H new ATOM 0 HE22 GLN A 58 60.415 -3.844 4.353 1.00 0.00 H new ATOM 871 N LEU A 59 58.002 0.569 3.096 1.00 0.00 N ATOM 872 CA LEU A 59 56.655 0.300 2.586 1.00 0.00 C ATOM 873 C LEU A 59 56.161 -1.067 3.057 1.00 0.00 C ATOM 874 O LEU A 59 54.960 -1.280 3.227 1.00 0.00 O ATOM 875 CB LEU A 59 56.622 0.322 1.048 1.00 0.00 C ATOM 876 CG LEU A 59 57.689 1.180 0.359 1.00 0.00 C ATOM 877 CD1 LEU A 59 57.384 1.263 -1.140 1.00 0.00 C ATOM 878 CD2 LEU A 59 57.686 2.588 0.960 1.00 0.00 C ATOM 0 H LEU A 59 58.752 0.434 2.418 1.00 0.00 H new ATOM 0 HA LEU A 59 56.007 1.086 2.973 1.00 0.00 H new ATOM 0 HB2 LEU A 59 56.722 -0.702 0.689 1.00 0.00 H new ATOM 0 HB3 LEU A 59 55.641 0.676 0.732 1.00 0.00 H new ATOM 0 HG LEU A 59 58.669 0.727 0.508 1.00 0.00 H new ATOM 0 HD11 LEU A 59 58.142 1.873 -1.632 1.00 0.00 H new ATOM 0 HD12 LEU A 59 57.390 0.261 -1.569 1.00 0.00 H new ATOM 0 HD13 LEU A 59 56.403 1.715 -1.287 1.00 0.00 H new ATOM 0 HD21 LEU A 59 58.446 3.195 0.468 1.00 0.00 H new ATOM 0 HD22 LEU A 59 56.707 3.044 0.814 1.00 0.00 H new ATOM 0 HD23 LEU A 59 57.904 2.529 2.026 1.00 0.00 H new ATOM 890 N GLY A 60 57.094 -1.993 3.261 1.00 0.00 N ATOM 891 CA GLY A 60 56.730 -3.332 3.706 1.00 0.00 C ATOM 892 C GLY A 60 57.967 -4.126 4.106 1.00 0.00 C ATOM 893 O GLY A 60 58.944 -4.203 3.360 1.00 0.00 O ATOM 0 H GLY A 60 58.094 -1.843 3.127 1.00 0.00 H new ATOM 0 HA2 GLY A 60 56.046 -3.265 4.552 1.00 0.00 H new ATOM 0 HA3 GLY A 60 56.200 -3.853 2.909 1.00 0.00 H new ATOM 897 N ASP A 61 57.911 -4.715 5.297 1.00 0.00 N ATOM 898 CA ASP A 61 59.029 -5.508 5.813 1.00 0.00 C ATOM 899 C ASP A 61 59.436 -6.606 4.828 1.00 0.00 C ATOM 900 O ASP A 61 60.577 -7.071 4.838 1.00 0.00 O ATOM 901 CB ASP A 61 58.649 -6.158 7.146 1.00 0.00 C ATOM 902 CG ASP A 61 58.241 -5.077 8.140 1.00 0.00 C ATOM 903 OD1 ASP A 61 57.170 -4.517 7.972 1.00 0.00 O ATOM 904 OD2 ASP A 61 59.006 -4.824 9.057 1.00 0.00 O ATOM 0 H ASP A 61 57.108 -4.660 5.923 1.00 0.00 H new ATOM 0 HA ASP A 61 59.871 -4.830 5.954 1.00 0.00 H new ATOM 0 HB2 ASP A 61 57.829 -6.861 6.999 1.00 0.00 H new ATOM 0 HB3 ASP A 61 59.491 -6.728 7.538 1.00 0.00 H new ATOM 909 N ASP A 62 58.498 -7.017 3.976 1.00 0.00 N ATOM 910 CA ASP A 62 58.786 -8.060 2.998 1.00 0.00 C ATOM 911 C ASP A 62 59.567 -7.512 1.801 1.00 0.00 C ATOM 912 O ASP A 62 59.945 -8.267 0.901 1.00 0.00 O ATOM 913 CB ASP A 62 57.493 -8.701 2.495 1.00 0.00 C ATOM 914 CG ASP A 62 56.557 -7.616 1.972 1.00 0.00 C ATOM 915 OD1 ASP A 62 56.881 -7.021 0.958 1.00 0.00 O ATOM 916 OD2 ASP A 62 55.530 -7.397 2.593 1.00 0.00 O ATOM 0 H ASP A 62 57.547 -6.649 3.944 1.00 0.00 H new ATOM 0 HA ASP A 62 59.397 -8.809 3.503 1.00 0.00 H new ATOM 0 HB2 ASP A 62 57.714 -9.418 1.704 1.00 0.00 H new ATOM 0 HB3 ASP A 62 57.011 -9.254 3.301 1.00 0.00 H new ATOM 921 N ALA A 63 59.829 -6.200 1.794 1.00 0.00 N ATOM 922 CA ALA A 63 60.588 -5.593 0.704 1.00 0.00 C ATOM 923 C ALA A 63 61.946 -6.273 0.579 1.00 0.00 C ATOM 924 O ALA A 63 62.488 -6.423 -0.515 1.00 0.00 O ATOM 925 CB ALA A 63 60.806 -4.106 0.974 1.00 0.00 C ATOM 0 H ALA A 63 59.530 -5.550 2.521 1.00 0.00 H new ATOM 0 HA ALA A 63 60.023 -5.716 -0.220 1.00 0.00 H new ATOM 0 HB1 ALA A 63 61.373 -3.667 0.153 1.00 0.00 H new ATOM 0 HB2 ALA A 63 59.841 -3.606 1.057 1.00 0.00 H new ATOM 0 HB3 ALA A 63 61.360 -3.983 1.905 1.00 0.00 H new ATOM 931 N VAL A 64 62.477 -6.694 1.724 1.00 0.00 N ATOM 932 CA VAL A 64 63.764 -7.376 1.750 1.00 0.00 C ATOM 933 C VAL A 64 63.643 -8.745 1.075 1.00 0.00 C ATOM 934 O VAL A 64 64.605 -9.256 0.501 1.00 0.00 O ATOM 935 CB VAL A 64 64.249 -7.544 3.200 1.00 0.00 C ATOM 936 CG1 VAL A 64 63.249 -8.393 3.992 1.00 0.00 C ATOM 937 CG2 VAL A 64 65.622 -8.225 3.217 1.00 0.00 C ATOM 0 H VAL A 64 62.039 -6.576 2.638 1.00 0.00 H new ATOM 0 HA VAL A 64 64.492 -6.774 1.206 1.00 0.00 H new ATOM 0 HB VAL A 64 64.329 -6.559 3.660 1.00 0.00 H new ATOM 0 HG11 VAL A 64 63.600 -8.507 5.018 1.00 0.00 H new ATOM 0 HG12 VAL A 64 62.276 -7.902 3.994 1.00 0.00 H new ATOM 0 HG13 VAL A 64 63.158 -9.375 3.528 1.00 0.00 H new ATOM 0 HG21 VAL A 64 65.958 -8.340 4.247 1.00 0.00 H new ATOM 0 HG22 VAL A 64 65.547 -9.206 2.748 1.00 0.00 H new ATOM 0 HG23 VAL A 64 66.338 -7.614 2.668 1.00 0.00 H new ATOM 947 N GLU A 65 62.447 -9.329 1.147 1.00 0.00 N ATOM 948 CA GLU A 65 62.211 -10.632 0.536 1.00 0.00 C ATOM 949 C GLU A 65 62.332 -10.529 -0.979 1.00 0.00 C ATOM 950 O GLU A 65 63.110 -11.248 -1.607 1.00 0.00 O ATOM 951 CB GLU A 65 60.816 -11.148 0.893 1.00 0.00 C ATOM 952 CG GLU A 65 60.670 -12.595 0.420 1.00 0.00 C ATOM 953 CD GLU A 65 61.194 -13.540 1.496 1.00 0.00 C ATOM 954 OE1 GLU A 65 60.527 -13.681 2.508 1.00 0.00 O ATOM 955 OE2 GLU A 65 62.255 -14.108 1.293 1.00 0.00 O ATOM 0 H GLU A 65 61.637 -8.925 1.617 1.00 0.00 H new ATOM 0 HA GLU A 65 62.959 -11.327 0.917 1.00 0.00 H new ATOM 0 HB2 GLU A 65 60.660 -11.089 1.970 1.00 0.00 H new ATOM 0 HB3 GLU A 65 60.055 -10.523 0.426 1.00 0.00 H new ATOM 0 HG2 GLU A 65 59.624 -12.815 0.207 1.00 0.00 H new ATOM 0 HG3 GLU A 65 61.222 -12.742 -0.508 1.00 0.00 H new ATOM 962 N LYS A 66 61.551 -9.622 -1.560 1.00 0.00 N ATOM 963 CA LYS A 66 61.573 -9.424 -3.004 1.00 0.00 C ATOM 964 C LYS A 66 62.839 -8.682 -3.430 1.00 0.00 C ATOM 965 O LYS A 66 63.318 -8.839 -4.554 1.00 0.00 O ATOM 966 CB LYS A 66 60.350 -8.623 -3.453 1.00 0.00 C ATOM 967 CG LYS A 66 59.078 -9.314 -2.958 1.00 0.00 C ATOM 968 CD LYS A 66 57.857 -8.667 -3.614 1.00 0.00 C ATOM 969 CE LYS A 66 57.352 -7.522 -2.735 1.00 0.00 C ATOM 970 NZ LYS A 66 56.019 -7.070 -3.225 1.00 0.00 N ATOM 0 H LYS A 66 60.901 -9.018 -1.057 1.00 0.00 H new ATOM 0 HA LYS A 66 61.558 -10.407 -3.475 1.00 0.00 H new ATOM 0 HB2 LYS A 66 60.402 -7.608 -3.059 1.00 0.00 H new ATOM 0 HB3 LYS A 66 60.334 -8.543 -4.540 1.00 0.00 H new ATOM 0 HG2 LYS A 66 59.112 -10.377 -3.197 1.00 0.00 H new ATOM 0 HG3 LYS A 66 59.006 -9.234 -1.873 1.00 0.00 H new ATOM 0 HD2 LYS A 66 58.119 -8.292 -4.603 1.00 0.00 H new ATOM 0 HD3 LYS A 66 57.070 -9.408 -3.752 1.00 0.00 H new ATOM 0 HE2 LYS A 66 57.278 -7.851 -1.698 1.00 0.00 H new ATOM 0 HE3 LYS A 66 58.060 -6.693 -2.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 55.675 -6.291 -2.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 56.104 -6.741 -4.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 55.346 -7.862 -3.182 1.00 0.00 H new ATOM 984 N ALA A 67 63.374 -7.866 -2.522 1.00 0.00 N ATOM 985 CA ALA A 67 64.584 -7.097 -2.811 1.00 0.00 C ATOM 986 C ALA A 67 65.739 -8.015 -3.205 1.00 0.00 C ATOM 987 O ALA A 67 66.411 -8.591 -2.349 1.00 0.00 O ATOM 988 CB ALA A 67 65.002 -6.283 -1.586 1.00 0.00 C ATOM 0 H ALA A 67 62.992 -7.721 -1.587 1.00 0.00 H new ATOM 0 HA ALA A 67 64.357 -6.430 -3.642 1.00 0.00 H new ATOM 0 HB1 ALA A 67 65.904 -5.716 -1.816 1.00 0.00 H new ATOM 0 HB2 ALA A 67 64.201 -5.596 -1.315 1.00 0.00 H new ATOM 0 HB3 ALA A 67 65.200 -6.956 -0.752 1.00 0.00 H new ATOM 994 N THR A 68 65.969 -8.133 -4.509 1.00 0.00 N ATOM 995 CA THR A 68 67.058 -8.970 -5.007 1.00 0.00 C ATOM 996 C THR A 68 68.242 -8.097 -5.427 1.00 0.00 C ATOM 997 O THR A 68 69.398 -8.509 -5.342 1.00 0.00 O ATOM 998 CB THR A 68 66.596 -9.826 -6.197 1.00 0.00 C ATOM 999 OG1 THR A 68 67.652 -10.692 -6.589 1.00 0.00 O ATOM 1000 CG2 THR A 68 66.208 -8.931 -7.378 1.00 0.00 C ATOM 0 H THR A 68 65.424 -7.666 -5.234 1.00 0.00 H new ATOM 0 HA THR A 68 67.367 -9.637 -4.202 1.00 0.00 H new ATOM 0 HB THR A 68 65.726 -10.411 -5.897 1.00 0.00 H new ATOM 0 HG1 THR A 68 67.361 -11.241 -7.347 1.00 0.00 H new ATOM 0 HG21 THR A 68 65.883 -9.551 -8.213 1.00 0.00 H new ATOM 0 HG22 THR A 68 65.395 -8.268 -7.081 1.00 0.00 H new ATOM 0 HG23 THR A 68 67.069 -8.336 -7.682 1.00 0.00 H new ATOM 1008 N THR A 69 67.936 -6.879 -5.874 1.00 0.00 N ATOM 1009 CA THR A 69 68.976 -5.944 -6.294 1.00 0.00 C ATOM 1010 C THR A 69 68.920 -4.706 -5.396 1.00 0.00 C ATOM 1011 O THR A 69 67.961 -4.530 -4.643 1.00 0.00 O ATOM 1012 CB THR A 69 68.774 -5.519 -7.763 1.00 0.00 C ATOM 1013 OG1 THR A 69 67.486 -5.921 -8.206 1.00 0.00 O ATOM 1014 CG2 THR A 69 69.842 -6.168 -8.652 1.00 0.00 C ATOM 0 H THR A 69 66.985 -6.520 -5.954 1.00 0.00 H new ATOM 0 HA THR A 69 69.946 -6.434 -6.208 1.00 0.00 H new ATOM 0 HB THR A 69 68.862 -4.435 -7.830 1.00 0.00 H new ATOM 0 HG1 THR A 69 67.361 -5.648 -9.139 1.00 0.00 H new ATOM 0 HG21 THR A 69 69.690 -5.861 -9.687 1.00 0.00 H new ATOM 0 HG22 THR A 69 70.832 -5.852 -8.322 1.00 0.00 H new ATOM 0 HG23 THR A 69 69.765 -7.253 -8.580 1.00 0.00 H new ATOM 1022 N PRO A 70 69.923 -3.821 -5.462 1.00 0.00 N ATOM 1023 CA PRO A 70 69.921 -2.609 -4.629 1.00 0.00 C ATOM 1024 C PRO A 70 68.794 -1.661 -5.014 1.00 0.00 C ATOM 1025 O PRO A 70 68.138 -1.086 -4.146 1.00 0.00 O ATOM 1026 CB PRO A 70 71.300 -2.018 -4.883 1.00 0.00 C ATOM 1027 CG PRO A 70 71.768 -2.584 -6.209 1.00 0.00 C ATOM 1028 CD PRO A 70 71.091 -3.944 -6.362 1.00 0.00 C ATOM 0 HA PRO A 70 69.742 -2.809 -3.573 1.00 0.00 H new ATOM 0 HB2 PRO A 70 71.256 -0.929 -4.919 1.00 0.00 H new ATOM 0 HB3 PRO A 70 71.990 -2.283 -4.082 1.00 0.00 H new ATOM 0 HG2 PRO A 70 71.498 -1.921 -7.031 1.00 0.00 H new ATOM 0 HG3 PRO A 70 72.853 -2.686 -6.226 1.00 0.00 H new ATOM 0 HD2 PRO A 70 70.791 -4.135 -7.392 1.00 0.00 H new ATOM 0 HD3 PRO A 70 71.749 -4.761 -6.065 1.00 0.00 H new ATOM 1036 N ARG A 71 68.537 -1.518 -6.324 1.00 0.00 N ATOM 1037 CA ARG A 71 67.435 -0.645 -6.766 1.00 0.00 C ATOM 1038 C ARG A 71 66.146 -1.003 -6.025 1.00 0.00 C ATOM 1039 O ARG A 71 65.300 -0.149 -5.784 1.00 0.00 O ATOM 1040 CB ARG A 71 67.145 -0.782 -8.272 1.00 0.00 C ATOM 1041 CG ARG A 71 68.429 -0.679 -9.101 1.00 0.00 C ATOM 1042 CD ARG A 71 69.193 0.605 -8.763 1.00 0.00 C ATOM 1043 NE ARG A 71 70.436 0.269 -8.074 1.00 0.00 N ATOM 1044 CZ ARG A 71 70.967 1.052 -7.124 1.00 0.00 C ATOM 1045 NH1 ARG A 71 70.467 2.235 -6.854 1.00 0.00 N ATOM 1046 NH2 ARG A 71 72.027 0.643 -6.481 1.00 0.00 N ATOM 0 H ARG A 71 69.056 -1.977 -7.073 1.00 0.00 H new ATOM 0 HA ARG A 71 67.751 0.376 -6.550 1.00 0.00 H new ATOM 0 HB2 ARG A 71 66.661 -1.740 -8.465 1.00 0.00 H new ATOM 0 HB3 ARG A 71 66.447 -0.004 -8.582 1.00 0.00 H new ATOM 0 HG2 ARG A 71 69.062 -1.545 -8.909 1.00 0.00 H new ATOM 0 HG3 ARG A 71 68.184 -0.693 -10.163 1.00 0.00 H new ATOM 0 HD2 ARG A 71 69.410 1.162 -9.675 1.00 0.00 H new ATOM 0 HD3 ARG A 71 68.580 1.250 -8.134 1.00 0.00 H new ATOM 0 HE ARG A 71 70.918 -0.594 -8.325 1.00 0.00 H new ATOM 0 HH11 ARG A 71 69.657 2.577 -7.372 1.00 0.00 H new ATOM 0 HH12 ARG A 71 70.888 2.813 -6.127 1.00 0.00 H new ATOM 0 HH21 ARG A 71 72.441 -0.262 -6.704 1.00 0.00 H new ATOM 0 HH22 ARG A 71 72.441 1.229 -5.756 1.00 0.00 H new ATOM 1060 N ALA A 72 66.015 -2.281 -5.668 1.00 0.00 N ATOM 1061 CA ALA A 72 64.825 -2.747 -4.960 1.00 0.00 C ATOM 1062 C ALA A 72 64.698 -2.062 -3.608 1.00 0.00 C ATOM 1063 O ALA A 72 63.750 -1.318 -3.354 1.00 0.00 O ATOM 1064 CB ALA A 72 64.891 -4.255 -4.737 1.00 0.00 C ATOM 0 H ALA A 72 66.710 -3.004 -5.855 1.00 0.00 H new ATOM 0 HA ALA A 72 63.959 -2.502 -5.575 1.00 0.00 H new ATOM 0 HB1 ALA A 72 63.996 -4.584 -4.208 1.00 0.00 H new ATOM 0 HB2 ALA A 72 64.951 -4.763 -5.700 1.00 0.00 H new ATOM 0 HB3 ALA A 72 65.773 -4.497 -4.144 1.00 0.00 H new ATOM 1070 N LEU A 73 65.670 -2.328 -2.743 1.00 0.00 N ATOM 1071 CA LEU A 73 65.679 -1.743 -1.400 1.00 0.00 C ATOM 1072 C LEU A 73 65.640 -0.224 -1.478 1.00 0.00 C ATOM 1073 O LEU A 73 64.876 0.431 -0.769 1.00 0.00 O ATOM 1074 CB LEU A 73 66.939 -2.158 -0.638 1.00 0.00 C ATOM 1075 CG LEU A 73 67.203 -3.663 -0.585 1.00 0.00 C ATOM 1076 CD1 LEU A 73 68.613 -3.915 -0.050 1.00 0.00 C ATOM 1077 CD2 LEU A 73 66.183 -4.325 0.343 1.00 0.00 C ATOM 0 H LEU A 73 66.460 -2.941 -2.943 1.00 0.00 H new ATOM 0 HA LEU A 73 64.796 -2.109 -0.876 1.00 0.00 H new ATOM 0 HB2 LEU A 73 67.799 -1.671 -1.098 1.00 0.00 H new ATOM 0 HB3 LEU A 73 66.867 -1.782 0.383 1.00 0.00 H new ATOM 0 HG LEU A 73 67.113 -4.083 -1.587 1.00 0.00 H new ATOM 0 HD11 LEU A 73 68.801 -4.988 -0.012 1.00 0.00 H new ATOM 0 HD12 LEU A 73 69.342 -3.442 -0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 73 68.702 -3.495 0.952 1.00 0.00 H new ATOM 0 HD21 LEU A 73 66.370 -5.398 0.382 1.00 0.00 H new ATOM 0 HD22 LEU A 73 66.275 -3.904 1.344 1.00 0.00 H new ATOM 0 HD23 LEU A 73 65.177 -4.145 -0.035 1.00 0.00 H new ATOM 1089 N ILE A 74 66.470 0.327 -2.355 1.00 0.00 N ATOM 1090 CA ILE A 74 66.518 1.774 -2.525 1.00 0.00 C ATOM 1091 C ILE A 74 65.172 2.280 -3.040 1.00 0.00 C ATOM 1092 O ILE A 74 64.691 3.332 -2.622 1.00 0.00 O ATOM 1093 CB ILE A 74 67.635 2.166 -3.499 1.00 0.00 C ATOM 1094 CG1 ILE A 74 68.964 1.615 -2.973 1.00 0.00 C ATOM 1095 CG2 ILE A 74 67.720 3.694 -3.602 1.00 0.00 C ATOM 1096 CD1 ILE A 74 70.084 1.905 -3.973 1.00 0.00 C ATOM 0 H ILE A 74 67.110 -0.197 -2.952 1.00 0.00 H new ATOM 0 HA ILE A 74 66.728 2.232 -1.558 1.00 0.00 H new ATOM 0 HB ILE A 74 67.425 1.754 -4.486 1.00 0.00 H new ATOM 0 HG12 ILE A 74 69.199 2.068 -2.010 1.00 0.00 H new ATOM 0 HG13 ILE A 74 68.882 0.541 -2.808 1.00 0.00 H new ATOM 0 HG21 ILE A 74 68.515 3.968 -4.295 1.00 0.00 H new ATOM 0 HG22 ILE A 74 66.771 4.088 -3.965 1.00 0.00 H new ATOM 0 HG23 ILE A 74 67.935 4.114 -2.619 1.00 0.00 H new ATOM 0 HD11 ILE A 74 71.025 1.510 -3.590 1.00 0.00 H new ATOM 0 HD12 ILE A 74 69.852 1.431 -4.927 1.00 0.00 H new ATOM 0 HD13 ILE A 74 70.174 2.982 -4.116 1.00 0.00 H new ATOM 1108 N GLU A 75 64.557 1.510 -3.936 1.00 0.00 N ATOM 1109 CA GLU A 75 63.256 1.891 -4.478 1.00 0.00 C ATOM 1110 C GLU A 75 62.229 1.963 -3.358 1.00 0.00 C ATOM 1111 O GLU A 75 61.490 2.940 -3.228 1.00 0.00 O ATOM 1112 CB GLU A 75 62.775 0.878 -5.515 1.00 0.00 C ATOM 1113 CG GLU A 75 63.266 1.295 -6.903 1.00 0.00 C ATOM 1114 CD GLU A 75 63.050 0.150 -7.887 1.00 0.00 C ATOM 1115 OE1 GLU A 75 63.354 -0.977 -7.530 1.00 0.00 O ATOM 1116 OE2 GLU A 75 62.586 0.416 -8.983 1.00 0.00 O ATOM 0 H GLU A 75 64.932 0.633 -4.297 1.00 0.00 H new ATOM 0 HA GLU A 75 63.366 2.865 -4.954 1.00 0.00 H new ATOM 0 HB2 GLU A 75 63.149 -0.116 -5.269 1.00 0.00 H new ATOM 0 HB3 GLU A 75 61.687 0.820 -5.505 1.00 0.00 H new ATOM 0 HG2 GLU A 75 62.729 2.182 -7.238 1.00 0.00 H new ATOM 0 HG3 GLU A 75 64.323 1.558 -6.862 1.00 0.00 H new ATOM 1123 N MET A 76 62.198 0.914 -2.543 1.00 0.00 N ATOM 1124 CA MET A 76 61.267 0.859 -1.425 1.00 0.00 C ATOM 1125 C MET A 76 61.553 1.993 -0.446 1.00 0.00 C ATOM 1126 O MET A 76 60.637 2.640 0.069 1.00 0.00 O ATOM 1127 CB MET A 76 61.393 -0.478 -0.696 1.00 0.00 C ATOM 1128 CG MET A 76 60.599 -1.548 -1.448 1.00 0.00 C ATOM 1129 SD MET A 76 58.897 -1.583 -0.835 1.00 0.00 S ATOM 1130 CE MET A 76 58.232 -2.719 -2.077 1.00 0.00 C ATOM 0 H MET A 76 62.802 0.097 -2.635 1.00 0.00 H new ATOM 0 HA MET A 76 60.255 0.963 -1.816 1.00 0.00 H new ATOM 0 HB2 MET A 76 62.441 -0.769 -0.628 1.00 0.00 H new ATOM 0 HB3 MET A 76 61.021 -0.384 0.324 1.00 0.00 H new ATOM 0 HG2 MET A 76 60.607 -1.337 -2.517 1.00 0.00 H new ATOM 0 HG3 MET A 76 61.065 -2.524 -1.312 1.00 0.00 H new ATOM 0 HE1 MET A 76 57.172 -2.886 -1.887 1.00 0.00 H new ATOM 0 HE2 MET A 76 58.359 -2.287 -3.070 1.00 0.00 H new ATOM 0 HE3 MET A 76 58.764 -3.669 -2.023 1.00 0.00 H new ATOM 1140 N THR A 77 62.839 2.230 -0.200 1.00 0.00 N ATOM 1141 CA THR A 77 63.244 3.289 0.717 1.00 0.00 C ATOM 1142 C THR A 77 62.932 4.656 0.120 1.00 0.00 C ATOM 1143 O THR A 77 62.612 5.599 0.832 1.00 0.00 O ATOM 1144 CB THR A 77 64.743 3.203 1.010 1.00 0.00 C ATOM 1145 OG1 THR A 77 65.074 1.870 1.377 1.00 0.00 O ATOM 1146 CG2 THR A 77 65.102 4.154 2.155 1.00 0.00 C ATOM 0 H THR A 77 63.610 1.709 -0.618 1.00 0.00 H new ATOM 0 HA THR A 77 62.687 3.161 1.645 1.00 0.00 H new ATOM 0 HB THR A 77 65.303 3.488 0.119 1.00 0.00 H new ATOM 0 HG1 THR A 77 65.135 1.315 0.572 1.00 0.00 H new ATOM 0 HG21 THR A 77 66.171 4.089 2.360 1.00 0.00 H new ATOM 0 HG22 THR A 77 64.848 5.176 1.873 1.00 0.00 H new ATOM 0 HG23 THR A 77 64.543 3.875 3.048 1.00 0.00 H new ATOM 1154 N ASN A 78 63.026 4.749 -1.201 1.00 0.00 N ATOM 1155 CA ASN A 78 62.749 6.008 -1.887 1.00 0.00 C ATOM 1156 C ASN A 78 61.247 6.217 -2.030 1.00 0.00 C ATOM 1157 O ASN A 78 60.762 7.346 -2.033 1.00 0.00 O ATOM 1158 CB ASN A 78 63.370 6.004 -3.283 1.00 0.00 C ATOM 1159 CG ASN A 78 64.816 6.474 -3.205 1.00 0.00 C ATOM 1160 OD1 ASN A 78 65.149 7.568 -3.654 1.00 0.00 O ATOM 1161 ND2 ASN A 78 65.705 5.707 -2.653 1.00 0.00 N ATOM 0 H ASN A 78 63.289 3.978 -1.814 1.00 0.00 H new ATOM 0 HA ASN A 78 63.180 6.813 -1.292 1.00 0.00 H new ATOM 0 HB2 ASN A 78 63.326 5.001 -3.708 1.00 0.00 H new ATOM 0 HB3 ASN A 78 62.801 6.656 -3.946 1.00 0.00 H new ATOM 0 HD21 ASN A 78 66.676 6.013 -2.593 1.00 0.00 H new ATOM 0 HD22 ASN A 78 65.433 4.798 -2.279 1.00 0.00 H new ATOM 1168 N ALA A 79 60.524 5.111 -2.157 1.00 0.00 N ATOM 1169 CA ALA A 79 59.075 5.162 -2.318 1.00 0.00 C ATOM 1170 C ALA A 79 58.418 5.753 -1.081 1.00 0.00 C ATOM 1171 O ALA A 79 57.457 6.518 -1.178 1.00 0.00 O ATOM 1172 CB ALA A 79 58.517 3.759 -2.553 1.00 0.00 C ATOM 0 H ALA A 79 60.916 4.169 -2.152 1.00 0.00 H new ATOM 0 HA ALA A 79 58.856 5.793 -3.179 1.00 0.00 H new ATOM 0 HB1 ALA A 79 57.435 3.813 -2.671 1.00 0.00 H new ATOM 0 HB2 ALA A 79 58.960 3.338 -3.455 1.00 0.00 H new ATOM 0 HB3 ALA A 79 58.758 3.124 -1.700 1.00 0.00 H new ATOM 1178 N SER A 80 58.944 5.395 0.084 1.00 0.00 N ATOM 1179 CA SER A 80 58.386 5.913 1.327 1.00 0.00 C ATOM 1180 C SER A 80 58.853 7.353 1.537 1.00 0.00 C ATOM 1181 O SER A 80 58.063 8.230 1.887 1.00 0.00 O ATOM 1182 CB SER A 80 58.772 5.024 2.525 1.00 0.00 C ATOM 1183 OG SER A 80 58.943 5.817 3.697 1.00 0.00 O ATOM 0 H SER A 80 59.737 4.763 0.195 1.00 0.00 H new ATOM 0 HA SER A 80 57.298 5.902 1.255 1.00 0.00 H new ATOM 0 HB2 SER A 80 57.998 4.275 2.695 1.00 0.00 H new ATOM 0 HB3 SER A 80 59.694 4.486 2.305 1.00 0.00 H new ATOM 0 HG SER A 80 58.564 5.346 4.469 1.00 0.00 H new ATOM 1189 N LEU A 81 60.143 7.587 1.315 1.00 0.00 N ATOM 1190 CA LEU A 81 60.699 8.922 1.478 1.00 0.00 C ATOM 1191 C LEU A 81 60.053 9.910 0.510 1.00 0.00 C ATOM 1192 O LEU A 81 59.650 11.004 0.903 1.00 0.00 O ATOM 1193 CB LEU A 81 62.203 8.886 1.236 1.00 0.00 C ATOM 1194 CG LEU A 81 62.968 8.003 2.214 1.00 0.00 C ATOM 1195 CD1 LEU A 81 64.345 7.665 1.646 1.00 0.00 C ATOM 1196 CD2 LEU A 81 63.123 8.747 3.531 1.00 0.00 C ATOM 0 H LEU A 81 60.815 6.877 1.025 1.00 0.00 H new ATOM 0 HA LEU A 81 60.494 9.253 2.496 1.00 0.00 H new ATOM 0 HB2 LEU A 81 62.389 8.533 0.222 1.00 0.00 H new ATOM 0 HB3 LEU A 81 62.595 9.901 1.297 1.00 0.00 H new ATOM 0 HG LEU A 81 62.419 7.075 2.376 1.00 0.00 H new ATOM 0 HD11 LEU A 81 64.885 7.034 2.352 1.00 0.00 H new ATOM 0 HD12 LEU A 81 64.229 7.135 0.701 1.00 0.00 H new ATOM 0 HD13 LEU A 81 64.906 8.585 1.480 1.00 0.00 H new ATOM 0 HD21 LEU A 81 63.669 8.124 4.239 1.00 0.00 H new ATOM 0 HD22 LEU A 81 63.673 9.673 3.363 1.00 0.00 H new ATOM 0 HD23 LEU A 81 62.138 8.978 3.936 1.00 0.00 H new ATOM 1208 N THR A 82 59.958 9.520 -0.761 1.00 0.00 N ATOM 1209 CA THR A 82 59.357 10.404 -1.761 1.00 0.00 C ATOM 1210 C THR A 82 57.889 10.670 -1.426 1.00 0.00 C ATOM 1211 O THR A 82 57.379 11.770 -1.639 1.00 0.00 O ATOM 1212 CB THR A 82 59.466 9.800 -3.173 1.00 0.00 C ATOM 1213 OG1 THR A 82 58.983 10.741 -4.121 1.00 0.00 O ATOM 1214 CG2 THR A 82 58.642 8.511 -3.273 1.00 0.00 C ATOM 0 H THR A 82 60.281 8.620 -1.117 1.00 0.00 H new ATOM 0 HA THR A 82 59.905 11.346 -1.744 1.00 0.00 H new ATOM 0 HB THR A 82 60.511 9.564 -3.376 1.00 0.00 H new ATOM 0 HG1 THR A 82 59.052 10.362 -5.022 1.00 0.00 H new ATOM 0 HG21 THR A 82 58.732 8.099 -4.278 1.00 0.00 H new ATOM 0 HG22 THR A 82 59.012 7.785 -2.549 1.00 0.00 H new ATOM 0 HG23 THR A 82 57.595 8.731 -3.063 1.00 0.00 H new ATOM 1222 N GLY A 83 57.218 9.647 -0.899 1.00 0.00 N ATOM 1223 CA GLY A 83 55.808 9.778 -0.537 1.00 0.00 C ATOM 1224 C GLY A 83 55.611 10.881 0.500 1.00 0.00 C ATOM 1225 O GLY A 83 54.578 11.550 0.527 1.00 0.00 O ATOM 0 H GLY A 83 57.622 8.729 -0.715 1.00 0.00 H new ATOM 0 HA2 GLY A 83 55.219 10.001 -1.427 1.00 0.00 H new ATOM 0 HA3 GLY A 83 55.441 8.831 -0.141 1.00 0.00 H new ATOM 1229 N ALA A 84 56.615 11.060 1.354 1.00 0.00 N ATOM 1230 CA ALA A 84 56.548 12.079 2.390 1.00 0.00 C ATOM 1231 C ALA A 84 57.537 13.204 2.099 1.00 0.00 C ATOM 1232 O ALA A 84 58.133 13.780 3.010 1.00 0.00 O ATOM 1233 CB ALA A 84 56.864 11.474 3.760 1.00 0.00 C ATOM 0 H ALA A 84 57.478 10.516 1.348 1.00 0.00 H new ATOM 0 HA ALA A 84 55.535 12.482 2.399 1.00 0.00 H new ATOM 0 HB1 ALA A 84 56.809 12.251 4.522 1.00 0.00 H new ATOM 0 HB2 ALA A 84 56.141 10.691 3.987 1.00 0.00 H new ATOM 0 HB3 ALA A 84 57.867 11.049 3.747 1.00 0.00 H new ATOM 1239 N SER A 85 57.704 13.513 0.816 1.00 0.00 N ATOM 1240 CA SER A 85 58.625 14.572 0.412 1.00 0.00 C ATOM 1241 C SER A 85 57.891 15.914 0.322 1.00 0.00 C ATOM 1242 O SER A 85 56.673 15.948 0.143 1.00 0.00 O ATOM 1243 CB SER A 85 59.244 14.251 -0.950 1.00 0.00 C ATOM 1244 OG SER A 85 58.269 14.444 -1.966 1.00 0.00 O ATOM 0 H SER A 85 57.220 13.051 0.046 1.00 0.00 H new ATOM 0 HA SER A 85 59.412 14.638 1.163 1.00 0.00 H new ATOM 0 HB2 SER A 85 60.106 14.893 -1.131 1.00 0.00 H new ATOM 0 HB3 SER A 85 59.604 13.222 -0.966 1.00 0.00 H new ATOM 0 HG SER A 85 57.748 13.622 -2.080 1.00 0.00 H new ATOM 1250 N PRO A 86 58.617 17.040 0.443 1.00 0.00 N ATOM 1251 CA PRO A 86 57.999 18.376 0.371 1.00 0.00 C ATOM 1252 C PRO A 86 57.788 18.848 -1.067 1.00 0.00 C ATOM 1253 O PRO A 86 56.668 19.150 -1.478 1.00 0.00 O ATOM 1254 CB PRO A 86 59.029 19.248 1.079 1.00 0.00 C ATOM 1255 CG PRO A 86 60.371 18.531 0.976 1.00 0.00 C ATOM 1256 CD PRO A 86 60.083 17.060 0.659 1.00 0.00 C ATOM 0 HA PRO A 86 57.004 18.402 0.815 1.00 0.00 H new ATOM 0 HB2 PRO A 86 59.082 20.234 0.616 1.00 0.00 H new ATOM 0 HB3 PRO A 86 58.753 19.400 2.122 1.00 0.00 H new ATOM 0 HG2 PRO A 86 60.986 18.978 0.195 1.00 0.00 H new ATOM 0 HG3 PRO A 86 60.926 18.621 1.910 1.00 0.00 H new ATOM 0 HD2 PRO A 86 60.625 16.725 -0.226 1.00 0.00 H new ATOM 0 HD3 PRO A 86 60.378 16.406 1.480 1.00 0.00 H new ATOM 1264 N SER A 87 58.880 18.908 -1.824 1.00 0.00 N ATOM 1265 CA SER A 87 58.808 19.344 -3.216 1.00 0.00 C ATOM 1266 C SER A 87 59.865 18.634 -4.053 1.00 0.00 C ATOM 1267 O SER A 87 59.546 17.855 -4.953 1.00 0.00 O ATOM 1268 CB SER A 87 59.025 20.854 -3.316 1.00 0.00 C ATOM 1269 OG SER A 87 58.334 21.354 -4.453 1.00 0.00 O ATOM 0 H SER A 87 59.816 18.663 -1.502 1.00 0.00 H new ATOM 0 HA SER A 87 57.817 19.094 -3.595 1.00 0.00 H new ATOM 0 HB2 SER A 87 58.665 21.345 -2.412 1.00 0.00 H new ATOM 0 HB3 SER A 87 60.089 21.075 -3.397 1.00 0.00 H new ATOM 0 HG SER A 87 58.470 22.322 -4.519 1.00 0.00 H new ATOM 1275 N ALA A 88 61.129 18.911 -3.749 1.00 0.00 N ATOM 1276 CA ALA A 88 62.232 18.293 -4.479 1.00 0.00 C ATOM 1277 C ALA A 88 63.152 17.542 -3.522 1.00 0.00 C ATOM 1278 O ALA A 88 63.193 16.312 -3.514 1.00 0.00 O ATOM 1279 CB ALA A 88 63.046 19.356 -5.221 1.00 0.00 C ATOM 0 H ALA A 88 61.414 19.553 -3.009 1.00 0.00 H new ATOM 0 HA ALA A 88 61.807 17.593 -5.198 1.00 0.00 H new ATOM 0 HB1 ALA A 88 63.864 18.878 -5.760 1.00 0.00 H new ATOM 0 HB2 ALA A 88 62.402 19.879 -5.928 1.00 0.00 H new ATOM 0 HB3 ALA A 88 63.452 20.070 -4.504 1.00 0.00 H new ATOM 1285 N GLY A 89 63.889 18.298 -2.713 1.00 0.00 N ATOM 1286 CA GLY A 89 64.808 17.697 -1.751 1.00 0.00 C ATOM 1287 C GLY A 89 66.256 17.941 -2.160 1.00 0.00 C ATOM 1288 O GLY A 89 66.897 17.085 -2.770 1.00 0.00 O ATOM 0 H GLY A 89 63.869 19.318 -2.704 1.00 0.00 H new ATOM 0 HA2 GLY A 89 64.630 18.116 -0.761 1.00 0.00 H new ATOM 0 HA3 GLY A 89 64.620 16.625 -1.683 1.00 0.00 H new ATOM 1292 N GLY A 90 66.765 19.121 -1.816 1.00 0.00 N ATOM 1293 CA GLY A 90 68.142 19.474 -2.150 1.00 0.00 C ATOM 1294 C GLY A 90 69.043 19.350 -0.927 1.00 0.00 C ATOM 1295 O GLY A 90 69.141 20.271 -0.115 1.00 0.00 O ATOM 0 H GLY A 90 66.251 19.843 -1.311 1.00 0.00 H new ATOM 0 HA2 GLY A 90 68.507 18.823 -2.944 1.00 0.00 H new ATOM 0 HA3 GLY A 90 68.178 20.494 -2.533 1.00 0.00 H new ATOM 1299 N ALA A 91 69.702 18.202 -0.805 1.00 0.00 N ATOM 1300 CA ALA A 91 70.596 17.964 0.325 1.00 0.00 C ATOM 1301 C ALA A 91 72.020 18.379 -0.026 1.00 0.00 C ATOM 1302 O ALA A 91 72.563 19.328 0.539 1.00 0.00 O ATOM 1303 CB ALA A 91 70.588 16.484 0.713 1.00 0.00 C ATOM 0 H ALA A 91 69.636 17.429 -1.467 1.00 0.00 H new ATOM 0 HA ALA A 91 70.241 18.560 1.166 1.00 0.00 H new ATOM 0 HB1 ALA A 91 71.260 16.325 1.557 1.00 0.00 H new ATOM 0 HB2 ALA A 91 69.577 16.187 0.993 1.00 0.00 H new ATOM 0 HB3 ALA A 91 70.921 15.884 -0.134 1.00 0.00 H new ATOM 1309 N ALA A 92 72.615 17.653 -0.970 1.00 0.00 N ATOM 1310 CA ALA A 92 73.985 17.933 -1.411 1.00 0.00 C ATOM 1311 C ALA A 92 74.985 17.595 -0.310 1.00 0.00 C ATOM 1312 O ALA A 92 75.767 16.652 -0.428 1.00 0.00 O ATOM 1313 CB ALA A 92 74.148 19.407 -1.807 1.00 0.00 C ATOM 0 H ALA A 92 72.173 16.866 -1.446 1.00 0.00 H new ATOM 0 HA ALA A 92 74.182 17.309 -2.283 1.00 0.00 H new ATOM 0 HB1 ALA A 92 75.174 19.586 -2.130 1.00 0.00 H new ATOM 0 HB2 ALA A 92 73.465 19.642 -2.623 1.00 0.00 H new ATOM 0 HB3 ALA A 92 73.922 20.041 -0.950 1.00 0.00 H new ATOM 1319 N ARG A 93 74.950 18.377 0.762 1.00 0.00 N ATOM 1320 CA ARG A 93 75.856 18.157 1.887 1.00 0.00 C ATOM 1321 C ARG A 93 75.433 19.003 3.084 1.00 0.00 C ATOM 1322 O ARG A 93 75.424 18.531 4.222 1.00 0.00 O ATOM 1323 CB ARG A 93 77.291 18.522 1.500 1.00 0.00 C ATOM 1324 CG ARG A 93 77.323 19.940 0.926 1.00 0.00 C ATOM 1325 CD ARG A 93 78.693 20.207 0.300 1.00 0.00 C ATOM 1326 NE ARG A 93 78.717 19.765 -1.096 1.00 0.00 N ATOM 1327 CZ ARG A 93 79.865 19.567 -1.761 1.00 0.00 C ATOM 1328 NH1 ARG A 93 81.028 19.761 -1.185 1.00 0.00 N ATOM 1329 NH2 ARG A 93 79.825 19.172 -3.004 1.00 0.00 N ATOM 0 H ARG A 93 74.311 19.163 0.878 1.00 0.00 H new ATOM 0 HA ARG A 93 75.811 17.101 2.154 1.00 0.00 H new ATOM 0 HB2 ARG A 93 77.941 18.457 2.372 1.00 0.00 H new ATOM 0 HB3 ARG A 93 77.672 17.813 0.765 1.00 0.00 H new ATOM 0 HG2 ARG A 93 76.540 20.058 0.177 1.00 0.00 H new ATOM 0 HG3 ARG A 93 77.123 20.667 1.713 1.00 0.00 H new ATOM 0 HD2 ARG A 93 78.922 21.271 0.354 1.00 0.00 H new ATOM 0 HD3 ARG A 93 79.465 19.685 0.866 1.00 0.00 H new ATOM 0 HE ARG A 93 77.833 19.603 -1.578 1.00 0.00 H new ATOM 0 HH11 ARG A 93 81.071 20.068 -0.213 1.00 0.00 H new ATOM 0 HH12 ARG A 93 81.889 19.605 -1.709 1.00 0.00 H new ATOM 0 HH21 ARG A 93 78.926 19.017 -3.461 1.00 0.00 H new ATOM 0 HH22 ARG A 93 80.692 19.019 -3.519 1.00 0.00 H new ATOM 1343 N ASP A 94 75.081 20.257 2.815 1.00 0.00 N ATOM 1344 CA ASP A 94 74.657 21.163 3.879 1.00 0.00 C ATOM 1345 C ASP A 94 73.715 22.228 3.325 1.00 0.00 C ATOM 1346 O ASP A 94 74.127 23.350 3.028 1.00 0.00 O ATOM 1347 CB ASP A 94 75.869 21.847 4.515 1.00 0.00 C ATOM 1348 CG ASP A 94 76.516 20.904 5.522 1.00 0.00 C ATOM 1349 OD1 ASP A 94 75.881 20.609 6.521 1.00 0.00 O ATOM 1350 OD2 ASP A 94 77.637 20.488 5.281 1.00 0.00 O ATOM 0 H ASP A 94 75.080 20.666 1.881 1.00 0.00 H new ATOM 0 HA ASP A 94 74.136 20.576 4.636 1.00 0.00 H new ATOM 0 HB2 ASP A 94 76.589 22.123 3.745 1.00 0.00 H new ATOM 0 HB3 ASP A 94 75.562 22.769 5.009 1.00 0.00 H new ATOM 1355 N LYS A 95 72.444 21.862 3.189 1.00 0.00 N ATOM 1356 CA LYS A 95 71.445 22.791 2.667 1.00 0.00 C ATOM 1357 C LYS A 95 71.084 23.831 3.724 1.00 0.00 C ATOM 1358 O LYS A 95 71.355 23.584 4.887 1.00 0.00 O ATOM 1359 CB LYS A 95 70.178 22.040 2.253 1.00 0.00 C ATOM 1360 CG LYS A 95 69.667 21.206 3.429 1.00 0.00 C ATOM 1361 CD LYS A 95 68.218 20.789 3.170 1.00 0.00 C ATOM 1362 CE LYS A 95 67.290 21.977 3.430 1.00 0.00 C ATOM 1363 NZ LYS A 95 65.938 21.682 2.875 1.00 0.00 N ATOM 1364 OXT LYS A 95 70.540 24.858 3.354 1.00 0.00 O ATOM 0 H LYS A 95 72.083 20.939 3.430 1.00 0.00 H new ATOM 0 HA LYS A 95 71.871 23.289 1.796 1.00 0.00 H new ATOM 0 HB2 LYS A 95 69.412 22.747 1.936 1.00 0.00 H new ATOM 0 HB3 LYS A 95 70.388 21.394 1.401 1.00 0.00 H new ATOM 0 HG2 LYS A 95 70.292 20.323 3.561 1.00 0.00 H new ATOM 0 HG3 LYS A 95 69.731 21.782 4.352 1.00 0.00 H new ATOM 0 HD2 LYS A 95 68.106 20.445 2.142 1.00 0.00 H new ATOM 0 HD3 LYS A 95 67.948 19.954 3.817 1.00 0.00 H new ATOM 0 HE2 LYS A 95 67.221 22.171 4.500 1.00 0.00 H new ATOM 0 HE3 LYS A 95 67.696 22.877 2.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 65.307 22.489 3.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 66.012 21.517 1.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 65.551 20.833 3.335 1.00 0.00 H new TER 1378 LYS A 95