USER MOD reduce.3.24.130724 H: found=0, std=0, add=684, rem=0, adj=20 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 Set 1.1: A 16 CYS SG : rot 164:sc= -1.34 USER MOD Set 1.2: A 47 THR OG1 : rot 77:sc= 0.693 USER MOD Single : A 1 MET CE :methyl -152:sc= 0 (180deg=-0.0175) USER MOD Single : A 1 MET N :NH3+ -162:sc= 0 (180deg=-0.377) USER MOD Single : A 2 THR OG1 : rot -119:sc= 0.231 USER MOD Single : A 5 THR OG1 : rot -61:sc= 0.045 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.00393 USER MOD Single : A 22 SER OG : rot 126:sc= 0.454 USER MOD Single : A 39 TYR OH : rot 180:sc=-0.00429 USER MOD Single : A 41 SER OG : rot 46:sc= 1.21 USER MOD Single : A 46 ASN : amide:sc= -2.22 K(o=-2.2,f=-0.57) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -0.0745 X(o=-0.075,f=-0.43) 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= -0.0425 USER MOD Single : A 76 MET CE :methyl 172:sc= -0.0276 (180deg=-0.107) USER MOD Single : A 77 THR OG1 : rot 73:sc= 1.09 USER MOD Single : A 78 ASN : amide:sc= -7.43! C(o=-7.4!,f=-10!) USER MOD Single : A 80 SER OG : rot 107:sc= -4.72! USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0.0165 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 60.582 14.140 2.180 1.00 0.00 N ATOM 2 CA MET A 1 61.444 13.815 3.352 1.00 0.00 C ATOM 3 C MET A 1 62.671 13.040 2.879 1.00 0.00 C ATOM 4 O MET A 1 62.720 11.813 2.980 1.00 0.00 O ATOM 5 CB MET A 1 60.655 12.962 4.350 1.00 0.00 C ATOM 6 CG MET A 1 59.327 13.647 4.678 1.00 0.00 C ATOM 7 SD MET A 1 58.771 13.134 6.322 1.00 0.00 S ATOM 8 CE MET A 1 59.751 14.321 7.274 1.00 0.00 C ATOM 0 H1 MET A 1 59.926 14.907 2.433 1.00 0.00 H new ATOM 0 H2 MET A 1 61.178 14.443 1.384 1.00 0.00 H new ATOM 0 H3 MET A 1 60.039 13.297 1.904 1.00 0.00 H new ATOM 0 HA MET A 1 61.760 14.739 3.837 1.00 0.00 H new ATOM 0 HB2 MET A 1 60.471 11.972 3.932 1.00 0.00 H new ATOM 0 HB3 MET A 1 61.237 12.820 5.261 1.00 0.00 H new ATOM 0 HG2 MET A 1 59.447 14.730 4.645 1.00 0.00 H new ATOM 0 HG3 MET A 1 58.577 13.386 3.931 1.00 0.00 H new ATOM 0 HE1 MET A 1 59.967 13.907 8.259 1.00 0.00 H new ATOM 0 HE2 MET A 1 60.686 14.522 6.752 1.00 0.00 H new ATOM 0 HE3 MET A 1 59.191 15.249 7.385 1.00 0.00 H new ATOM 20 N THR A 2 63.658 13.776 2.353 1.00 0.00 N ATOM 21 CA THR A 2 64.906 13.174 1.850 1.00 0.00 C ATOM 22 C THR A 2 64.628 11.901 1.034 1.00 0.00 C ATOM 23 O THR A 2 63.501 11.664 0.605 1.00 0.00 O ATOM 24 CB THR A 2 65.861 12.864 3.019 1.00 0.00 C ATOM 25 OG1 THR A 2 67.106 12.413 2.507 1.00 0.00 O ATOM 26 CG2 THR A 2 65.265 11.786 3.930 1.00 0.00 C ATOM 0 H THR A 2 63.619 14.791 2.263 1.00 0.00 H new ATOM 0 HA THR A 2 65.381 13.897 1.187 1.00 0.00 H new ATOM 0 HB THR A 2 66.007 13.774 3.601 1.00 0.00 H new ATOM 0 HG1 THR A 2 67.280 11.503 2.826 1.00 0.00 H new ATOM 0 HG21 THR A 2 65.954 11.581 4.749 1.00 0.00 H new ATOM 0 HG22 THR A 2 64.315 12.135 4.334 1.00 0.00 H new ATOM 0 HG23 THR A 2 65.102 10.874 3.356 1.00 0.00 H new ATOM 34 N LEU A 3 65.663 11.090 0.825 1.00 0.00 N ATOM 35 CA LEU A 3 65.507 9.852 0.067 1.00 0.00 C ATOM 36 C LEU A 3 66.802 9.045 0.105 1.00 0.00 C ATOM 37 O LEU A 3 67.703 9.342 0.885 1.00 0.00 O ATOM 38 CB LEU A 3 65.111 10.153 -1.380 1.00 0.00 C ATOM 39 CG LEU A 3 66.201 10.777 -2.253 1.00 0.00 C ATOM 40 CD1 LEU A 3 65.902 10.484 -3.726 1.00 0.00 C ATOM 41 CD2 LEU A 3 66.225 12.290 -2.030 1.00 0.00 C ATOM 0 H LEU A 3 66.608 11.265 1.166 1.00 0.00 H new ATOM 0 HA LEU A 3 64.712 9.263 0.525 1.00 0.00 H new ATOM 0 HB2 LEU A 3 64.785 9.224 -1.848 1.00 0.00 H new ATOM 0 HB3 LEU A 3 64.252 10.824 -1.370 1.00 0.00 H new ATOM 0 HG LEU A 3 67.170 10.354 -1.987 1.00 0.00 H new ATOM 0 HD11 LEU A 3 66.678 10.928 -4.350 1.00 0.00 H new ATOM 0 HD12 LEU A 3 65.881 9.406 -3.885 1.00 0.00 H new ATOM 0 HD13 LEU A 3 64.934 10.909 -3.992 1.00 0.00 H new ATOM 0 HD21 LEU A 3 67.001 12.737 -2.651 1.00 0.00 H new ATOM 0 HD22 LEU A 3 65.257 12.713 -2.299 1.00 0.00 H new ATOM 0 HD23 LEU A 3 66.434 12.500 -0.981 1.00 0.00 H new ATOM 53 N LEU A 4 66.884 8.013 -0.732 1.00 0.00 N ATOM 54 CA LEU A 4 68.081 7.167 -0.751 1.00 0.00 C ATOM 55 C LEU A 4 68.723 7.164 -2.134 1.00 0.00 C ATOM 56 O LEU A 4 68.098 7.545 -3.125 1.00 0.00 O ATOM 57 CB LEU A 4 67.718 5.730 -0.362 1.00 0.00 C ATOM 58 CG LEU A 4 68.795 4.966 0.412 1.00 0.00 C ATOM 59 CD1 LEU A 4 68.896 5.521 1.833 1.00 0.00 C ATOM 60 CD2 LEU A 4 68.420 3.483 0.472 1.00 0.00 C ATOM 0 H LEU A 4 66.155 7.744 -1.393 1.00 0.00 H new ATOM 0 HA LEU A 4 68.791 7.574 -0.032 1.00 0.00 H new ATOM 0 HB2 LEU A 4 66.810 5.753 0.240 1.00 0.00 H new ATOM 0 HB3 LEU A 4 67.484 5.174 -1.270 1.00 0.00 H new ATOM 0 HG LEU A 4 69.755 5.082 -0.091 1.00 0.00 H new ATOM 0 HD11 LEU A 4 69.663 4.976 2.383 1.00 0.00 H new ATOM 0 HD12 LEU A 4 69.160 6.578 1.793 1.00 0.00 H new ATOM 0 HD13 LEU A 4 67.937 5.405 2.338 1.00 0.00 H new ATOM 0 HD21 LEU A 4 69.185 2.936 1.023 1.00 0.00 H new ATOM 0 HD22 LEU A 4 67.460 3.371 0.976 1.00 0.00 H new ATOM 0 HD23 LEU A 4 68.347 3.085 -0.540 1.00 0.00 H new ATOM 72 N THR A 5 69.976 6.725 -2.192 1.00 0.00 N ATOM 73 CA THR A 5 70.688 6.673 -3.463 1.00 0.00 C ATOM 74 C THR A 5 71.572 5.435 -3.543 1.00 0.00 C ATOM 75 O THR A 5 71.750 4.705 -2.564 1.00 0.00 O ATOM 76 CB THR A 5 71.560 7.916 -3.636 1.00 0.00 C ATOM 77 OG1 THR A 5 72.221 8.206 -2.412 1.00 0.00 O ATOM 78 CG2 THR A 5 70.681 9.096 -4.037 1.00 0.00 C ATOM 0 H THR A 5 70.513 6.404 -1.386 1.00 0.00 H new ATOM 0 HA THR A 5 69.943 6.632 -4.257 1.00 0.00 H new ATOM 0 HB THR A 5 72.304 7.737 -4.412 1.00 0.00 H new ATOM 0 HG1 THR A 5 71.556 8.393 -1.717 1.00 0.00 H new ATOM 0 HG21 THR A 5 71.300 9.985 -4.161 1.00 0.00 H new ATOM 0 HG22 THR A 5 70.176 8.871 -4.976 1.00 0.00 H new ATOM 0 HG23 THR A 5 69.938 9.277 -3.260 1.00 0.00 H new ATOM 86 N LEU A 6 72.130 5.212 -4.728 1.00 0.00 N ATOM 87 CA LEU A 6 73.009 4.066 -4.953 1.00 0.00 C ATOM 88 C LEU A 6 74.182 4.097 -3.981 1.00 0.00 C ATOM 89 O LEU A 6 74.390 3.163 -3.211 1.00 0.00 O ATOM 90 CB LEU A 6 73.550 4.079 -6.383 1.00 0.00 C ATOM 91 CG LEU A 6 72.485 4.156 -7.479 1.00 0.00 C ATOM 92 CD1 LEU A 6 73.155 4.460 -8.821 1.00 0.00 C ATOM 93 CD2 LEU A 6 71.751 2.816 -7.569 1.00 0.00 C ATOM 0 H LEU A 6 71.991 5.806 -5.546 1.00 0.00 H new ATOM 0 HA LEU A 6 72.426 3.159 -4.793 1.00 0.00 H new ATOM 0 HB2 LEU A 6 74.224 4.929 -6.492 1.00 0.00 H new ATOM 0 HB3 LEU A 6 74.145 3.179 -6.538 1.00 0.00 H new ATOM 0 HG LEU A 6 71.774 4.947 -7.240 1.00 0.00 H new ATOM 0 HD11 LEU A 6 72.397 4.515 -9.602 1.00 0.00 H new ATOM 0 HD12 LEU A 6 73.680 5.413 -8.758 1.00 0.00 H new ATOM 0 HD13 LEU A 6 73.866 3.669 -9.060 1.00 0.00 H new ATOM 0 HD21 LEU A 6 70.992 2.869 -8.349 1.00 0.00 H new ATOM 0 HD22 LEU A 6 72.463 2.026 -7.808 1.00 0.00 H new ATOM 0 HD23 LEU A 6 71.275 2.597 -6.613 1.00 0.00 H new ATOM 105 N SER A 7 74.937 5.191 -4.033 1.00 0.00 N ATOM 106 CA SER A 7 76.105 5.370 -3.164 1.00 0.00 C ATOM 107 C SER A 7 75.763 5.109 -1.697 1.00 0.00 C ATOM 108 O SER A 7 76.567 4.550 -0.947 1.00 0.00 O ATOM 109 CB SER A 7 76.653 6.792 -3.303 1.00 0.00 C ATOM 110 OG SER A 7 78.073 6.748 -3.325 1.00 0.00 O ATOM 0 H SER A 7 74.763 5.970 -4.668 1.00 0.00 H new ATOM 0 HA SER A 7 76.857 4.647 -3.478 1.00 0.00 H new ATOM 0 HB2 SER A 7 76.278 7.251 -4.218 1.00 0.00 H new ATOM 0 HB3 SER A 7 76.310 7.409 -2.473 1.00 0.00 H new ATOM 0 HG SER A 7 78.427 7.657 -3.416 1.00 0.00 H new ATOM 116 N ASP A 8 74.560 5.517 -1.294 1.00 0.00 N ATOM 117 CA ASP A 8 74.126 5.322 0.085 1.00 0.00 C ATOM 118 C ASP A 8 74.154 3.843 0.451 1.00 0.00 C ATOM 119 O ASP A 8 74.752 3.447 1.449 1.00 0.00 O ATOM 120 CB ASP A 8 72.701 5.846 0.280 1.00 0.00 C ATOM 121 CG ASP A 8 72.683 7.373 0.229 1.00 0.00 C ATOM 122 OD1 ASP A 8 73.722 7.976 0.452 1.00 0.00 O ATOM 123 OD2 ASP A 8 71.622 7.919 -0.027 1.00 0.00 O ATOM 0 H ASP A 8 73.878 5.979 -1.895 1.00 0.00 H new ATOM 0 HA ASP A 8 74.811 5.873 0.729 1.00 0.00 H new ATOM 0 HB2 ASP A 8 72.049 5.442 -0.495 1.00 0.00 H new ATOM 0 HB3 ASP A 8 72.309 5.503 1.237 1.00 0.00 H new ATOM 128 N LEU A 9 73.499 3.030 -0.372 1.00 0.00 N ATOM 129 CA LEU A 9 73.450 1.590 -0.122 1.00 0.00 C ATOM 130 C LEU A 9 74.855 0.988 -0.081 1.00 0.00 C ATOM 131 O LEU A 9 75.144 0.117 0.741 1.00 0.00 O ATOM 132 CB LEU A 9 72.635 0.880 -1.202 1.00 0.00 C ATOM 133 CG LEU A 9 72.339 -0.597 -0.922 1.00 0.00 C ATOM 134 CD1 LEU A 9 71.659 -0.737 0.443 1.00 0.00 C ATOM 135 CD2 LEU A 9 71.414 -1.149 -2.010 1.00 0.00 C ATOM 0 H LEU A 9 73.000 3.336 -1.207 1.00 0.00 H new ATOM 0 HA LEU A 9 72.973 1.446 0.847 1.00 0.00 H new ATOM 0 HB2 LEU A 9 71.689 1.407 -1.328 1.00 0.00 H new ATOM 0 HB3 LEU A 9 73.170 0.955 -2.148 1.00 0.00 H new ATOM 0 HG LEU A 9 73.274 -1.157 -0.920 1.00 0.00 H new ATOM 0 HD11 LEU A 9 71.450 -1.789 0.639 1.00 0.00 H new ATOM 0 HD12 LEU A 9 72.317 -0.347 1.219 1.00 0.00 H new ATOM 0 HD13 LEU A 9 70.725 -0.175 0.444 1.00 0.00 H new ATOM 0 HD21 LEU A 9 71.204 -2.200 -1.810 1.00 0.00 H new ATOM 0 HD22 LEU A 9 70.480 -0.587 -2.014 1.00 0.00 H new ATOM 0 HD23 LEU A 9 71.898 -1.054 -2.982 1.00 0.00 H new ATOM 147 N LEU A 10 75.727 1.452 -0.979 1.00 0.00 N ATOM 148 CA LEU A 10 77.106 0.937 -1.035 1.00 0.00 C ATOM 149 C LEU A 10 77.780 0.996 0.336 1.00 0.00 C ATOM 150 O LEU A 10 78.264 -0.010 0.852 1.00 0.00 O ATOM 151 CB LEU A 10 77.959 1.747 -2.019 1.00 0.00 C ATOM 152 CG LEU A 10 77.329 2.020 -3.388 1.00 0.00 C ATOM 153 CD1 LEU A 10 78.385 2.613 -4.324 1.00 0.00 C ATOM 154 CD2 LEU A 10 76.796 0.715 -3.987 1.00 0.00 C ATOM 0 H LEU A 10 75.512 2.172 -1.669 1.00 0.00 H new ATOM 0 HA LEU A 10 77.037 -0.099 -1.366 1.00 0.00 H new ATOM 0 HB2 LEU A 10 78.202 2.703 -1.556 1.00 0.00 H new ATOM 0 HB3 LEU A 10 78.900 1.219 -2.173 1.00 0.00 H new ATOM 0 HG LEU A 10 76.505 2.723 -3.269 1.00 0.00 H new ATOM 0 HD11 LEU A 10 77.939 2.808 -5.299 1.00 0.00 H new ATOM 0 HD12 LEU A 10 78.761 3.546 -3.904 1.00 0.00 H new ATOM 0 HD13 LEU A 10 79.209 1.908 -4.437 1.00 0.00 H new ATOM 0 HD21 LEU A 10 76.349 0.917 -4.961 1.00 0.00 H new ATOM 0 HD22 LEU A 10 77.616 0.007 -4.104 1.00 0.00 H new ATOM 0 HD23 LEU A 10 76.043 0.291 -3.323 1.00 0.00 H new ATOM 166 N THR A 11 77.816 2.194 0.906 1.00 0.00 N ATOM 167 CA THR A 11 78.437 2.413 2.200 1.00 0.00 C ATOM 168 C THR A 11 77.812 1.531 3.280 1.00 0.00 C ATOM 169 O THR A 11 78.513 0.840 4.016 1.00 0.00 O ATOM 170 CB THR A 11 78.260 3.879 2.583 1.00 0.00 C ATOM 171 OG1 THR A 11 78.732 4.703 1.526 1.00 0.00 O ATOM 172 CG2 THR A 11 79.047 4.171 3.842 1.00 0.00 C ATOM 0 H THR A 11 77.418 3.034 0.486 1.00 0.00 H new ATOM 0 HA THR A 11 79.493 2.155 2.126 1.00 0.00 H new ATOM 0 HB THR A 11 77.204 4.084 2.761 1.00 0.00 H new ATOM 0 HG1 THR A 11 78.617 5.645 1.770 1.00 0.00 H new ATOM 0 HG21 THR A 11 78.920 5.219 4.115 1.00 0.00 H new ATOM 0 HG22 THR A 11 78.685 3.538 4.652 1.00 0.00 H new ATOM 0 HG23 THR A 11 80.103 3.967 3.666 1.00 0.00 H new ATOM 180 N LEU A 12 76.489 1.575 3.380 1.00 0.00 N ATOM 181 CA LEU A 12 75.784 0.780 4.393 1.00 0.00 C ATOM 182 C LEU A 12 76.119 -0.698 4.247 1.00 0.00 C ATOM 183 O LEU A 12 76.533 -1.352 5.203 1.00 0.00 O ATOM 184 CB LEU A 12 74.273 0.966 4.275 1.00 0.00 C ATOM 185 CG LEU A 12 73.803 2.419 4.316 1.00 0.00 C ATOM 186 CD1 LEU A 12 72.304 2.482 4.020 1.00 0.00 C ATOM 187 CD2 LEU A 12 74.074 3.001 5.704 1.00 0.00 C ATOM 0 H LEU A 12 75.885 2.142 2.785 1.00 0.00 H new ATOM 0 HA LEU A 12 76.112 1.129 5.372 1.00 0.00 H new ATOM 0 HB2 LEU A 12 73.937 0.516 3.341 1.00 0.00 H new ATOM 0 HB3 LEU A 12 73.789 0.419 5.084 1.00 0.00 H new ATOM 0 HG LEU A 12 74.344 2.997 3.566 1.00 0.00 H new ATOM 0 HD11 LEU A 12 71.971 3.519 4.050 1.00 0.00 H new ATOM 0 HD12 LEU A 12 72.111 2.067 3.031 1.00 0.00 H new ATOM 0 HD13 LEU A 12 71.761 1.905 4.768 1.00 0.00 H new ATOM 0 HD21 LEU A 12 73.739 4.038 5.735 1.00 0.00 H new ATOM 0 HD22 LEU A 12 73.533 2.422 6.453 1.00 0.00 H new ATOM 0 HD23 LEU A 12 75.143 2.958 5.914 1.00 0.00 H new ATOM 199 N LEU A 13 75.954 -1.212 3.035 1.00 0.00 N ATOM 200 CA LEU A 13 76.266 -2.617 2.776 1.00 0.00 C ATOM 201 C LEU A 13 77.757 -2.852 3.011 1.00 0.00 C ATOM 202 O LEU A 13 78.170 -3.895 3.518 1.00 0.00 O ATOM 203 CB LEU A 13 75.887 -3.011 1.341 1.00 0.00 C ATOM 204 CG LEU A 13 74.740 -4.023 1.243 1.00 0.00 C ATOM 205 CD1 LEU A 13 74.478 -4.374 -0.224 1.00 0.00 C ATOM 206 CD2 LEU A 13 75.115 -5.295 2.010 1.00 0.00 C ATOM 0 H LEU A 13 75.613 -0.691 2.227 1.00 0.00 H new ATOM 0 HA LEU A 13 75.684 -3.238 3.457 1.00 0.00 H new ATOM 0 HB2 LEU A 13 75.609 -2.111 0.792 1.00 0.00 H new ATOM 0 HB3 LEU A 13 76.765 -3.427 0.848 1.00 0.00 H new ATOM 0 HG LEU A 13 73.840 -3.586 1.674 1.00 0.00 H new ATOM 0 HD11 LEU A 13 73.662 -5.094 -0.286 1.00 0.00 H new ATOM 0 HD12 LEU A 13 74.208 -3.471 -0.772 1.00 0.00 H new ATOM 0 HD13 LEU A 13 75.378 -4.808 -0.661 1.00 0.00 H new ATOM 0 HD21 LEU A 13 74.300 -6.015 1.941 1.00 0.00 H new ATOM 0 HD22 LEU A 13 76.018 -5.727 1.579 1.00 0.00 H new ATOM 0 HD23 LEU A 13 75.294 -5.049 3.057 1.00 0.00 H new ATOM 218 N ARG A 14 78.552 -1.846 2.652 1.00 0.00 N ATOM 219 CA ARG A 14 79.996 -1.912 2.842 1.00 0.00 C ATOM 220 C ARG A 14 80.313 -2.047 4.332 1.00 0.00 C ATOM 221 O ARG A 14 81.051 -2.941 4.748 1.00 0.00 O ATOM 222 CB ARG A 14 80.656 -0.639 2.292 1.00 0.00 C ATOM 223 CG ARG A 14 82.180 -0.710 2.454 1.00 0.00 C ATOM 224 CD ARG A 14 82.752 0.699 2.644 1.00 0.00 C ATOM 225 NE ARG A 14 83.636 0.743 3.812 1.00 0.00 N ATOM 226 CZ ARG A 14 84.216 1.879 4.225 1.00 0.00 C ATOM 227 NH1 ARG A 14 84.017 3.013 3.594 1.00 0.00 N ATOM 228 NH2 ARG A 14 84.992 1.858 5.274 1.00 0.00 N ATOM 0 H ARG A 14 78.220 -0.979 2.229 1.00 0.00 H new ATOM 0 HA ARG A 14 80.385 -2.778 2.307 1.00 0.00 H new ATOM 0 HB2 ARG A 14 80.402 -0.516 1.239 1.00 0.00 H new ATOM 0 HB3 ARG A 14 80.269 0.234 2.817 1.00 0.00 H new ATOM 0 HG2 ARG A 14 82.434 -1.334 3.311 1.00 0.00 H new ATOM 0 HG3 ARG A 14 82.626 -1.177 1.576 1.00 0.00 H new ATOM 0 HD2 ARG A 14 83.303 0.997 1.752 1.00 0.00 H new ATOM 0 HD3 ARG A 14 81.939 1.414 2.769 1.00 0.00 H new ATOM 0 HE ARG A 14 83.816 -0.119 4.327 1.00 0.00 H new ATOM 0 HH11 ARG A 14 83.412 3.041 2.773 1.00 0.00 H new ATOM 0 HH12 ARG A 14 84.468 3.866 3.924 1.00 0.00 H new ATOM 0 HH21 ARG A 14 85.153 0.982 5.772 1.00 0.00 H new ATOM 0 HH22 ARG A 14 85.438 2.717 5.596 1.00 0.00 H new ATOM 242 N GLU A 15 79.741 -1.143 5.126 1.00 0.00 N ATOM 243 CA GLU A 15 79.955 -1.156 6.574 1.00 0.00 C ATOM 244 C GLU A 15 79.547 -2.504 7.159 1.00 0.00 C ATOM 245 O GLU A 15 80.265 -3.095 7.967 1.00 0.00 O ATOM 246 CB GLU A 15 79.131 -0.046 7.239 1.00 0.00 C ATOM 247 CG GLU A 15 79.419 -0.003 8.748 1.00 0.00 C ATOM 248 CD GLU A 15 80.095 1.317 9.113 1.00 0.00 C ATOM 249 OE1 GLU A 15 80.904 1.783 8.327 1.00 0.00 O ATOM 250 OE2 GLU A 15 79.792 1.841 10.172 1.00 0.00 O ATOM 0 H GLU A 15 79.130 -0.397 4.795 1.00 0.00 H new ATOM 0 HA GLU A 15 81.015 -0.987 6.766 1.00 0.00 H new ATOM 0 HB2 GLU A 15 79.373 0.916 6.788 1.00 0.00 H new ATOM 0 HB3 GLU A 15 78.069 -0.220 7.069 1.00 0.00 H new ATOM 0 HG2 GLU A 15 78.490 -0.112 9.307 1.00 0.00 H new ATOM 0 HG3 GLU A 15 80.060 -0.839 9.028 1.00 0.00 H new ATOM 257 N CYS A 16 78.383 -2.983 6.732 1.00 0.00 N ATOM 258 CA CYS A 16 77.870 -4.271 7.205 1.00 0.00 C ATOM 259 C CYS A 16 78.885 -5.382 6.955 1.00 0.00 C ATOM 260 O CYS A 16 79.244 -6.136 7.859 1.00 0.00 O ATOM 261 CB CYS A 16 76.571 -4.621 6.483 1.00 0.00 C ATOM 262 SG CYS A 16 75.690 -5.897 7.415 1.00 0.00 S ATOM 0 H CYS A 16 77.778 -2.505 6.064 1.00 0.00 H new ATOM 0 HA CYS A 16 77.686 -4.184 8.276 1.00 0.00 H new ATOM 0 HB2 CYS A 16 75.947 -3.733 6.382 1.00 0.00 H new ATOM 0 HB3 CYS A 16 76.786 -4.975 5.475 1.00 0.00 H new ATOM 0 HG CYS A 16 74.455 -5.952 7.014 1.00 0.00 H new ATOM 268 N ALA A 17 79.342 -5.467 5.712 1.00 0.00 N ATOM 269 CA ALA A 17 80.321 -6.484 5.335 1.00 0.00 C ATOM 270 C ALA A 17 81.658 -6.211 6.019 1.00 0.00 C ATOM 271 O ALA A 17 82.351 -7.133 6.450 1.00 0.00 O ATOM 272 CB ALA A 17 80.528 -6.494 3.820 1.00 0.00 C ATOM 0 H ALA A 17 79.055 -4.850 4.952 1.00 0.00 H new ATOM 0 HA ALA A 17 79.940 -7.454 5.653 1.00 0.00 H new ATOM 0 HB1 ALA A 17 81.260 -7.258 3.558 1.00 0.00 H new ATOM 0 HB2 ALA A 17 79.582 -6.713 3.325 1.00 0.00 H new ATOM 0 HB3 ALA A 17 80.889 -5.518 3.496 1.00 0.00 H new ATOM 278 N GLY A 18 82.010 -4.931 6.112 1.00 0.00 N ATOM 279 CA GLY A 18 83.266 -4.541 6.747 1.00 0.00 C ATOM 280 C GLY A 18 84.350 -4.288 5.703 1.00 0.00 C ATOM 281 O GLY A 18 85.534 -4.508 5.951 1.00 0.00 O ATOM 0 H GLY A 18 81.451 -4.154 5.760 1.00 0.00 H new ATOM 0 HA2 GLY A 18 83.113 -3.641 7.343 1.00 0.00 H new ATOM 0 HA3 GLY A 18 83.591 -5.325 7.431 1.00 0.00 H new ATOM 285 N GLU A 19 83.928 -3.824 4.530 1.00 0.00 N ATOM 286 CA GLU A 19 84.867 -3.545 3.451 1.00 0.00 C ATOM 287 C GLU A 19 85.459 -2.148 3.605 1.00 0.00 C ATOM 288 O GLU A 19 85.119 -1.410 4.530 1.00 0.00 O ATOM 289 CB GLU A 19 84.168 -3.643 2.094 1.00 0.00 C ATOM 290 CG GLU A 19 84.239 -5.084 1.584 1.00 0.00 C ATOM 291 CD GLU A 19 83.720 -5.143 0.152 1.00 0.00 C ATOM 292 OE1 GLU A 19 84.000 -4.222 -0.597 1.00 0.00 O ATOM 293 OE2 GLU A 19 83.051 -6.109 -0.176 1.00 0.00 O ATOM 0 H GLU A 19 82.951 -3.635 4.305 1.00 0.00 H new ATOM 0 HA GLU A 19 85.666 -4.285 3.502 1.00 0.00 H new ATOM 0 HB2 GLU A 19 83.128 -3.330 2.186 1.00 0.00 H new ATOM 0 HB3 GLU A 19 84.642 -2.970 1.380 1.00 0.00 H new ATOM 0 HG2 GLU A 19 85.267 -5.445 1.625 1.00 0.00 H new ATOM 0 HG3 GLU A 19 83.646 -5.737 2.224 1.00 0.00 H new ATOM 300 N GLU A 20 86.349 -1.795 2.682 1.00 0.00 N ATOM 301 CA GLU A 20 86.989 -0.483 2.713 1.00 0.00 C ATOM 302 C GLU A 20 86.790 0.232 1.376 1.00 0.00 C ATOM 303 O GLU A 20 87.726 0.792 0.802 1.00 0.00 O ATOM 304 CB GLU A 20 88.486 -0.626 2.996 1.00 0.00 C ATOM 305 CG GLU A 20 89.041 0.709 3.491 1.00 0.00 C ATOM 306 CD GLU A 20 90.507 0.541 3.876 1.00 0.00 C ATOM 307 OE1 GLU A 20 91.299 0.243 2.997 1.00 0.00 O ATOM 308 OE2 GLU A 20 90.815 0.713 5.043 1.00 0.00 O ATOM 0 H GLU A 20 86.642 -2.393 1.909 1.00 0.00 H new ATOM 0 HA GLU A 20 86.530 0.104 3.509 1.00 0.00 H new ATOM 0 HB2 GLU A 20 88.653 -1.401 3.744 1.00 0.00 H new ATOM 0 HB3 GLU A 20 89.010 -0.937 2.092 1.00 0.00 H new ATOM 0 HG2 GLU A 20 88.943 1.466 2.713 1.00 0.00 H new ATOM 0 HG3 GLU A 20 88.467 1.058 4.349 1.00 0.00 H new ATOM 315 N GLU A 21 85.555 0.201 0.887 1.00 0.00 N ATOM 316 CA GLU A 21 85.228 0.841 -0.383 1.00 0.00 C ATOM 317 C GLU A 21 83.736 0.707 -0.672 1.00 0.00 C ATOM 318 O GLU A 21 83.135 -0.337 -0.423 1.00 0.00 O ATOM 319 CB GLU A 21 86.019 0.198 -1.525 1.00 0.00 C ATOM 320 CG GLU A 21 85.774 -1.315 -1.536 1.00 0.00 C ATOM 321 CD GLU A 21 87.061 -2.042 -1.914 1.00 0.00 C ATOM 322 OE1 GLU A 21 87.807 -1.506 -2.717 1.00 0.00 O ATOM 323 OE2 GLU A 21 87.283 -3.123 -1.394 1.00 0.00 O ATOM 0 H GLU A 21 84.768 -0.257 1.347 1.00 0.00 H new ATOM 0 HA GLU A 21 85.492 1.896 -0.310 1.00 0.00 H new ATOM 0 HB2 GLU A 21 85.717 0.632 -2.478 1.00 0.00 H new ATOM 0 HB3 GLU A 21 87.083 0.403 -1.404 1.00 0.00 H new ATOM 0 HG2 GLU A 21 85.433 -1.645 -0.555 1.00 0.00 H new ATOM 0 HG3 GLU A 21 84.984 -1.560 -2.246 1.00 0.00 H new ATOM 330 N SER A 22 83.140 1.777 -1.198 1.00 0.00 N ATOM 331 CA SER A 22 81.706 1.777 -1.512 1.00 0.00 C ATOM 332 C SER A 22 81.311 0.532 -2.321 1.00 0.00 C ATOM 333 O SER A 22 80.848 -0.460 -1.758 1.00 0.00 O ATOM 334 CB SER A 22 81.329 3.045 -2.287 1.00 0.00 C ATOM 335 OG SER A 22 82.096 3.109 -3.483 1.00 0.00 O ATOM 0 H SER A 22 83.621 2.650 -1.415 1.00 0.00 H new ATOM 0 HA SER A 22 81.160 1.758 -0.569 1.00 0.00 H new ATOM 0 HB2 SER A 22 80.265 3.038 -2.523 1.00 0.00 H new ATOM 0 HB3 SER A 22 81.514 3.928 -1.675 1.00 0.00 H new ATOM 0 HG SER A 22 81.496 3.210 -4.251 1.00 0.00 H new ATOM 341 N ILE A 23 81.485 0.591 -3.641 1.00 0.00 N ATOM 342 CA ILE A 23 81.129 -0.529 -4.492 1.00 0.00 C ATOM 343 C ILE A 23 82.288 -0.909 -5.421 1.00 0.00 C ATOM 344 O ILE A 23 82.110 -1.117 -6.621 1.00 0.00 O ATOM 345 CB ILE A 23 79.889 -0.155 -5.299 1.00 0.00 C ATOM 346 CG1 ILE A 23 79.303 -1.407 -5.941 1.00 0.00 C ATOM 347 CG2 ILE A 23 80.241 0.874 -6.379 1.00 0.00 C ATOM 348 CD1 ILE A 23 78.509 -2.189 -4.891 1.00 0.00 C ATOM 0 H ILE A 23 81.867 1.398 -4.135 1.00 0.00 H new ATOM 0 HA ILE A 23 80.915 -1.399 -3.872 1.00 0.00 H new ATOM 0 HB ILE A 23 79.152 0.288 -4.630 1.00 0.00 H new ATOM 0 HG12 ILE A 23 78.656 -1.134 -6.774 1.00 0.00 H new ATOM 0 HG13 ILE A 23 80.101 -2.029 -6.348 1.00 0.00 H new ATOM 0 HG21 ILE A 23 79.345 1.129 -6.945 1.00 0.00 H new ATOM 0 HG22 ILE A 23 80.641 1.772 -5.909 1.00 0.00 H new ATOM 0 HG23 ILE A 23 80.988 0.454 -7.053 1.00 0.00 H new ATOM 0 HD11 ILE A 23 78.088 -3.085 -5.346 1.00 0.00 H new ATOM 0 HD12 ILE A 23 79.170 -2.474 -4.073 1.00 0.00 H new ATOM 0 HD13 ILE A 23 77.703 -1.565 -4.506 1.00 0.00 H new ATOM 360 N ASP A 24 83.478 -0.998 -4.843 1.00 0.00 N ATOM 361 CA ASP A 24 84.680 -1.353 -5.605 1.00 0.00 C ATOM 362 C ASP A 24 84.497 -2.663 -6.384 1.00 0.00 C ATOM 363 O ASP A 24 85.229 -2.931 -7.336 1.00 0.00 O ATOM 364 CB ASP A 24 85.876 -1.506 -4.667 1.00 0.00 C ATOM 365 CG ASP A 24 87.168 -1.458 -5.474 1.00 0.00 C ATOM 366 OD1 ASP A 24 87.409 -0.445 -6.110 1.00 0.00 O ATOM 367 OD2 ASP A 24 87.897 -2.436 -5.447 1.00 0.00 O ATOM 0 H ASP A 24 83.643 -0.831 -3.850 1.00 0.00 H new ATOM 0 HA ASP A 24 84.857 -0.546 -6.315 1.00 0.00 H new ATOM 0 HB2 ASP A 24 85.871 -0.710 -3.922 1.00 0.00 H new ATOM 0 HB3 ASP A 24 85.808 -2.450 -4.126 1.00 0.00 H new ATOM 372 N LEU A 25 83.519 -3.479 -5.965 1.00 0.00 N ATOM 373 CA LEU A 25 83.240 -4.769 -6.615 1.00 0.00 C ATOM 374 C LEU A 25 83.314 -4.694 -8.144 1.00 0.00 C ATOM 375 O LEU A 25 83.632 -5.681 -8.808 1.00 0.00 O ATOM 376 CB LEU A 25 81.849 -5.267 -6.220 1.00 0.00 C ATOM 377 CG LEU A 25 81.639 -5.481 -4.718 1.00 0.00 C ATOM 378 CD1 LEU A 25 80.166 -5.254 -4.370 1.00 0.00 C ATOM 379 CD2 LEU A 25 82.034 -6.912 -4.349 1.00 0.00 C ATOM 0 H LEU A 25 82.906 -3.268 -5.177 1.00 0.00 H new ATOM 0 HA LEU A 25 84.012 -5.459 -6.273 1.00 0.00 H new ATOM 0 HB2 LEU A 25 81.109 -4.551 -6.576 1.00 0.00 H new ATOM 0 HB3 LEU A 25 81.657 -6.208 -6.736 1.00 0.00 H new ATOM 0 HG LEU A 25 82.256 -4.776 -4.161 1.00 0.00 H new ATOM 0 HD11 LEU A 25 80.017 -5.406 -3.301 1.00 0.00 H new ATOM 0 HD12 LEU A 25 79.883 -4.235 -4.634 1.00 0.00 H new ATOM 0 HD13 LEU A 25 79.548 -5.959 -4.927 1.00 0.00 H new ATOM 0 HD21 LEU A 25 81.885 -7.066 -3.280 1.00 0.00 H new ATOM 0 HD22 LEU A 25 81.416 -7.615 -4.907 1.00 0.00 H new ATOM 0 HD23 LEU A 25 83.083 -7.075 -4.597 1.00 0.00 H new ATOM 391 N GLY A 26 83.021 -3.522 -8.696 1.00 0.00 N ATOM 392 CA GLY A 26 83.064 -3.354 -10.147 1.00 0.00 C ATOM 393 C GLY A 26 82.417 -2.042 -10.575 1.00 0.00 C ATOM 394 O GLY A 26 82.776 -1.468 -11.602 1.00 0.00 O ATOM 0 H GLY A 26 82.756 -2.687 -8.174 1.00 0.00 H new ATOM 0 HA2 GLY A 26 84.099 -3.379 -10.487 1.00 0.00 H new ATOM 0 HA3 GLY A 26 82.551 -4.188 -10.627 1.00 0.00 H new ATOM 398 N GLY A 27 81.459 -1.571 -9.782 1.00 0.00 N ATOM 399 CA GLY A 27 80.776 -0.325 -10.103 1.00 0.00 C ATOM 400 C GLY A 27 79.429 -0.595 -10.763 1.00 0.00 C ATOM 401 O GLY A 27 78.399 -0.066 -10.345 1.00 0.00 O ATOM 0 H GLY A 27 81.143 -2.026 -8.926 1.00 0.00 H new ATOM 0 HA2 GLY A 27 80.629 0.258 -9.194 1.00 0.00 H new ATOM 0 HA3 GLY A 27 81.398 0.274 -10.769 1.00 0.00 H new ATOM 405 N ASP A 28 79.448 -1.422 -11.804 1.00 0.00 N ATOM 406 CA ASP A 28 78.225 -1.757 -12.520 1.00 0.00 C ATOM 407 C ASP A 28 77.500 -2.910 -11.828 1.00 0.00 C ATOM 408 O ASP A 28 77.261 -3.966 -12.418 1.00 0.00 O ATOM 409 CB ASP A 28 78.544 -2.147 -13.967 1.00 0.00 C ATOM 410 CG ASP A 28 78.528 -0.901 -14.846 1.00 0.00 C ATOM 411 OD1 ASP A 28 79.276 0.017 -14.553 1.00 0.00 O ATOM 412 OD2 ASP A 28 77.768 -0.883 -15.800 1.00 0.00 O ATOM 0 H ASP A 28 80.290 -1.869 -12.167 1.00 0.00 H new ATOM 0 HA ASP A 28 77.579 -0.879 -12.520 1.00 0.00 H new ATOM 0 HB2 ASP A 28 79.521 -2.628 -14.018 1.00 0.00 H new ATOM 0 HB3 ASP A 28 77.813 -2.870 -14.329 1.00 0.00 H new ATOM 417 N VAL A 29 77.150 -2.696 -10.563 1.00 0.00 N ATOM 418 CA VAL A 29 76.453 -3.721 -9.794 1.00 0.00 C ATOM 419 C VAL A 29 75.225 -3.123 -9.105 1.00 0.00 C ATOM 420 O VAL A 29 74.995 -3.320 -7.911 1.00 0.00 O ATOM 421 CB VAL A 29 77.397 -4.347 -8.758 1.00 0.00 C ATOM 422 CG1 VAL A 29 77.838 -3.295 -7.736 1.00 0.00 C ATOM 423 CG2 VAL A 29 76.692 -5.503 -8.040 1.00 0.00 C ATOM 0 H VAL A 29 77.335 -1.832 -10.053 1.00 0.00 H new ATOM 0 HA VAL A 29 76.122 -4.504 -10.477 1.00 0.00 H new ATOM 0 HB VAL A 29 78.278 -4.728 -9.274 1.00 0.00 H new ATOM 0 HG11 VAL A 29 78.507 -3.753 -7.008 1.00 0.00 H new ATOM 0 HG12 VAL A 29 78.359 -2.486 -8.248 1.00 0.00 H new ATOM 0 HG13 VAL A 29 76.963 -2.896 -7.224 1.00 0.00 H new ATOM 0 HG21 VAL A 29 77.368 -5.942 -7.306 1.00 0.00 H new ATOM 0 HG22 VAL A 29 75.802 -5.129 -7.535 1.00 0.00 H new ATOM 0 HG23 VAL A 29 76.404 -6.262 -8.768 1.00 0.00 H new ATOM 433 N GLU A 30 74.438 -2.392 -9.883 1.00 0.00 N ATOM 434 CA GLU A 30 73.228 -1.771 -9.370 1.00 0.00 C ATOM 435 C GLU A 30 72.001 -2.620 -9.715 1.00 0.00 C ATOM 436 O GLU A 30 70.967 -2.540 -9.053 1.00 0.00 O ATOM 437 CB GLU A 30 73.069 -0.377 -9.970 1.00 0.00 C ATOM 438 CG GLU A 30 73.019 -0.459 -11.501 1.00 0.00 C ATOM 439 CD GLU A 30 74.392 -0.128 -12.080 1.00 0.00 C ATOM 440 OE1 GLU A 30 75.262 -0.980 -12.013 1.00 0.00 O ATOM 441 OE2 GLU A 30 74.551 0.973 -12.582 1.00 0.00 O ATOM 0 H GLU A 30 74.617 -2.216 -10.871 1.00 0.00 H new ATOM 0 HA GLU A 30 73.309 -1.695 -8.286 1.00 0.00 H new ATOM 0 HB2 GLU A 30 72.157 0.086 -9.594 1.00 0.00 H new ATOM 0 HB3 GLU A 30 73.900 0.257 -9.660 1.00 0.00 H new ATOM 0 HG2 GLU A 30 72.714 -1.458 -11.811 1.00 0.00 H new ATOM 0 HG3 GLU A 30 72.274 0.236 -11.888 1.00 0.00 H new ATOM 448 N ASP A 31 72.137 -3.437 -10.758 1.00 0.00 N ATOM 449 CA ASP A 31 71.053 -4.304 -11.190 1.00 0.00 C ATOM 450 C ASP A 31 71.477 -5.773 -11.101 1.00 0.00 C ATOM 451 O ASP A 31 70.945 -6.630 -11.805 1.00 0.00 O ATOM 452 CB ASP A 31 70.651 -3.975 -12.629 1.00 0.00 C ATOM 453 CG ASP A 31 69.745 -2.749 -12.635 1.00 0.00 C ATOM 454 OD1 ASP A 31 68.899 -2.656 -11.761 1.00 0.00 O ATOM 455 OD2 ASP A 31 69.910 -1.919 -13.515 1.00 0.00 O ATOM 0 H ASP A 31 72.987 -3.514 -11.316 1.00 0.00 H new ATOM 0 HA ASP A 31 70.200 -4.138 -10.533 1.00 0.00 H new ATOM 0 HB2 ASP A 31 71.539 -3.787 -13.232 1.00 0.00 H new ATOM 0 HB3 ASP A 31 70.135 -4.824 -13.077 1.00 0.00 H new ATOM 460 N VAL A 32 72.425 -6.055 -10.202 1.00 0.00 N ATOM 461 CA VAL A 32 72.895 -7.421 -9.996 1.00 0.00 C ATOM 462 C VAL A 32 72.377 -7.930 -8.651 1.00 0.00 C ATOM 463 O VAL A 32 72.450 -7.232 -7.639 1.00 0.00 O ATOM 464 CB VAL A 32 74.429 -7.475 -10.014 1.00 0.00 C ATOM 465 CG1 VAL A 32 74.905 -8.922 -9.852 1.00 0.00 C ATOM 466 CG2 VAL A 32 74.940 -6.925 -11.346 1.00 0.00 C ATOM 0 H VAL A 32 72.877 -5.358 -9.611 1.00 0.00 H new ATOM 0 HA VAL A 32 72.520 -8.051 -10.802 1.00 0.00 H new ATOM 0 HB VAL A 32 74.816 -6.875 -9.191 1.00 0.00 H new ATOM 0 HG11 VAL A 32 75.995 -8.950 -9.866 1.00 0.00 H new ATOM 0 HG12 VAL A 32 74.544 -9.320 -8.904 1.00 0.00 H new ATOM 0 HG13 VAL A 32 74.516 -9.527 -10.671 1.00 0.00 H new ATOM 0 HG21 VAL A 32 76.029 -6.962 -11.361 1.00 0.00 H new ATOM 0 HG22 VAL A 32 74.545 -7.527 -12.164 1.00 0.00 H new ATOM 0 HG23 VAL A 32 74.611 -5.893 -11.464 1.00 0.00 H new ATOM 476 N ALA A 33 71.835 -9.146 -8.651 1.00 0.00 N ATOM 477 CA ALA A 33 71.287 -9.729 -7.424 1.00 0.00 C ATOM 478 C ALA A 33 72.343 -9.797 -6.321 1.00 0.00 C ATOM 479 O ALA A 33 73.537 -9.928 -6.589 1.00 0.00 O ATOM 480 CB ALA A 33 70.757 -11.137 -7.686 1.00 0.00 C ATOM 0 H ALA A 33 71.763 -9.742 -9.475 1.00 0.00 H new ATOM 0 HA ALA A 33 70.472 -9.083 -7.097 1.00 0.00 H new ATOM 0 HB1 ALA A 33 70.354 -11.552 -6.762 1.00 0.00 H new ATOM 0 HB2 ALA A 33 69.969 -11.095 -8.438 1.00 0.00 H new ATOM 0 HB3 ALA A 33 71.568 -11.770 -8.045 1.00 0.00 H new ATOM 486 N PHE A 34 71.877 -9.713 -5.073 1.00 0.00 N ATOM 487 CA PHE A 34 72.774 -9.767 -3.916 1.00 0.00 C ATOM 488 C PHE A 34 73.617 -11.042 -3.941 1.00 0.00 C ATOM 489 O PHE A 34 74.788 -11.036 -3.564 1.00 0.00 O ATOM 490 CB PHE A 34 71.969 -9.740 -2.615 1.00 0.00 C ATOM 491 CG PHE A 34 71.283 -8.403 -2.465 1.00 0.00 C ATOM 492 CD1 PHE A 34 72.046 -7.235 -2.326 1.00 0.00 C ATOM 493 CD2 PHE A 34 69.886 -8.329 -2.457 1.00 0.00 C ATOM 494 CE1 PHE A 34 71.410 -5.997 -2.181 1.00 0.00 C ATOM 495 CE2 PHE A 34 69.251 -7.089 -2.313 1.00 0.00 C ATOM 496 CZ PHE A 34 70.013 -5.924 -2.175 1.00 0.00 C ATOM 0 H PHE A 34 70.890 -9.608 -4.838 1.00 0.00 H new ATOM 0 HA PHE A 34 73.429 -8.897 -3.965 1.00 0.00 H new ATOM 0 HB2 PHE A 34 71.229 -10.540 -2.618 1.00 0.00 H new ATOM 0 HB3 PHE A 34 72.628 -9.918 -1.765 1.00 0.00 H new ATOM 0 HD1 PHE A 34 73.125 -7.291 -2.331 1.00 0.00 H new ATOM 0 HD2 PHE A 34 69.297 -9.228 -2.562 1.00 0.00 H new ATOM 0 HE1 PHE A 34 71.998 -5.097 -2.074 1.00 0.00 H new ATOM 0 HE2 PHE A 34 68.173 -7.032 -2.308 1.00 0.00 H new ATOM 0 HZ PHE A 34 69.523 -4.968 -2.064 1.00 0.00 H new ATOM 506 N ASP A 35 73.002 -12.135 -4.384 1.00 0.00 N ATOM 507 CA ASP A 35 73.699 -13.417 -4.451 1.00 0.00 C ATOM 508 C ASP A 35 74.857 -13.348 -5.441 1.00 0.00 C ATOM 509 O ASP A 35 75.945 -13.862 -5.185 1.00 0.00 O ATOM 510 CB ASP A 35 72.740 -14.532 -4.880 1.00 0.00 C ATOM 511 CG ASP A 35 73.433 -15.884 -4.742 1.00 0.00 C ATOM 512 OD1 ASP A 35 74.335 -16.147 -5.521 1.00 0.00 O ATOM 513 OD2 ASP A 35 73.051 -16.636 -3.862 1.00 0.00 O ATOM 0 H ASP A 35 72.032 -12.160 -4.699 1.00 0.00 H new ATOM 0 HA ASP A 35 74.086 -13.637 -3.456 1.00 0.00 H new ATOM 0 HB2 ASP A 35 71.841 -14.509 -4.265 1.00 0.00 H new ATOM 0 HB3 ASP A 35 72.425 -14.377 -5.912 1.00 0.00 H new ATOM 518 N ALA A 36 74.607 -12.709 -6.580 1.00 0.00 N ATOM 519 CA ALA A 36 75.634 -12.577 -7.610 1.00 0.00 C ATOM 520 C ALA A 36 76.835 -11.805 -7.071 1.00 0.00 C ATOM 521 O ALA A 36 77.979 -12.067 -7.446 1.00 0.00 O ATOM 522 CB ALA A 36 75.069 -11.853 -8.835 1.00 0.00 C ATOM 0 H ALA A 36 73.712 -12.278 -6.813 1.00 0.00 H new ATOM 0 HA ALA A 36 75.955 -13.577 -7.901 1.00 0.00 H new ATOM 0 HB1 ALA A 36 75.846 -11.762 -9.594 1.00 0.00 H new ATOM 0 HB2 ALA A 36 74.231 -12.421 -9.239 1.00 0.00 H new ATOM 0 HB3 ALA A 36 74.727 -10.860 -8.545 1.00 0.00 H new ATOM 528 N LEU A 37 76.563 -10.851 -6.186 1.00 0.00 N ATOM 529 CA LEU A 37 77.634 -10.044 -5.598 1.00 0.00 C ATOM 530 C LEU A 37 78.413 -10.867 -4.579 1.00 0.00 C ATOM 531 O LEU A 37 79.629 -10.733 -4.446 1.00 0.00 O ATOM 532 CB LEU A 37 77.077 -8.788 -4.907 1.00 0.00 C ATOM 533 CG LEU A 37 75.739 -8.262 -5.446 1.00 0.00 C ATOM 534 CD1 LEU A 37 75.458 -6.881 -4.853 1.00 0.00 C ATOM 535 CD2 LEU A 37 75.801 -8.157 -6.971 1.00 0.00 C ATOM 0 H LEU A 37 75.625 -10.617 -5.862 1.00 0.00 H new ATOM 0 HA LEU A 37 78.293 -9.733 -6.409 1.00 0.00 H new ATOM 0 HB2 LEU A 37 76.959 -9.004 -3.845 1.00 0.00 H new ATOM 0 HB3 LEU A 37 77.818 -7.993 -4.990 1.00 0.00 H new ATOM 0 HG LEU A 37 74.942 -8.950 -5.164 1.00 0.00 H new ATOM 0 HD11 LEU A 37 74.508 -6.507 -5.235 1.00 0.00 H new ATOM 0 HD12 LEU A 37 75.408 -6.955 -3.767 1.00 0.00 H new ATOM 0 HD13 LEU A 37 76.257 -6.195 -5.134 1.00 0.00 H new ATOM 0 HD21 LEU A 37 74.849 -7.783 -7.349 1.00 0.00 H new ATOM 0 HD22 LEU A 37 76.599 -7.472 -7.256 1.00 0.00 H new ATOM 0 HD23 LEU A 37 75.999 -9.141 -7.396 1.00 0.00 H new ATOM 547 N GLY A 38 77.695 -11.726 -3.862 1.00 0.00 N ATOM 548 CA GLY A 38 78.326 -12.577 -2.857 1.00 0.00 C ATOM 549 C GLY A 38 77.709 -12.384 -1.468 1.00 0.00 C ATOM 550 O GLY A 38 78.222 -12.913 -0.481 1.00 0.00 O ATOM 0 H GLY A 38 76.687 -11.851 -3.956 1.00 0.00 H new ATOM 0 HA2 GLY A 38 78.229 -13.621 -3.154 1.00 0.00 H new ATOM 0 HA3 GLY A 38 79.392 -12.356 -2.813 1.00 0.00 H new ATOM 554 N TYR A 39 76.607 -11.632 -1.384 1.00 0.00 N ATOM 555 CA TYR A 39 75.960 -11.409 -0.096 1.00 0.00 C ATOM 556 C TYR A 39 75.169 -12.647 0.312 1.00 0.00 C ATOM 557 O TYR A 39 74.875 -13.511 -0.514 1.00 0.00 O ATOM 558 CB TYR A 39 75.004 -10.219 -0.175 1.00 0.00 C ATOM 559 CG TYR A 39 75.791 -8.932 -0.214 1.00 0.00 C ATOM 560 CD1 TYR A 39 76.728 -8.650 0.788 1.00 0.00 C ATOM 561 CD2 TYR A 39 75.578 -8.016 -1.251 1.00 0.00 C ATOM 562 CE1 TYR A 39 77.452 -7.453 0.752 1.00 0.00 C ATOM 563 CE2 TYR A 39 76.302 -6.820 -1.287 1.00 0.00 C ATOM 564 CZ TYR A 39 77.238 -6.537 -0.287 1.00 0.00 C ATOM 565 OH TYR A 39 77.952 -5.356 -0.322 1.00 0.00 O ATOM 0 H TYR A 39 76.155 -11.177 -2.177 1.00 0.00 H new ATOM 0 HA TYR A 39 76.735 -11.203 0.642 1.00 0.00 H new ATOM 0 HB2 TYR A 39 74.380 -10.301 -1.065 1.00 0.00 H new ATOM 0 HB3 TYR A 39 74.335 -10.221 0.685 1.00 0.00 H new ATOM 0 HD1 TYR A 39 76.892 -9.356 1.588 1.00 0.00 H new ATOM 0 HD2 TYR A 39 74.855 -8.233 -2.023 1.00 0.00 H new ATOM 0 HE1 TYR A 39 78.175 -7.235 1.524 1.00 0.00 H new ATOM 0 HE2 TYR A 39 76.138 -6.114 -2.088 1.00 0.00 H new ATOM 0 HH TYR A 39 77.684 -4.835 -1.108 1.00 0.00 H new ATOM 575 N ASP A 40 74.822 -12.723 1.593 1.00 0.00 N ATOM 576 CA ASP A 40 74.056 -13.860 2.092 1.00 0.00 C ATOM 577 C ASP A 40 72.615 -13.442 2.339 1.00 0.00 C ATOM 578 O ASP A 40 71.697 -13.849 1.626 1.00 0.00 O ATOM 579 CB ASP A 40 74.659 -14.386 3.396 1.00 0.00 C ATOM 580 CG ASP A 40 75.822 -15.320 3.079 1.00 0.00 C ATOM 581 OD1 ASP A 40 76.648 -14.950 2.261 1.00 0.00 O ATOM 582 OD2 ASP A 40 75.869 -16.392 3.660 1.00 0.00 O ATOM 0 H ASP A 40 75.055 -12.022 2.296 1.00 0.00 H new ATOM 0 HA ASP A 40 74.088 -14.651 1.343 1.00 0.00 H new ATOM 0 HB2 ASP A 40 75.004 -13.555 4.011 1.00 0.00 H new ATOM 0 HB3 ASP A 40 73.900 -14.915 3.972 1.00 0.00 H new ATOM 587 N SER A 41 72.436 -12.615 3.362 1.00 0.00 N ATOM 588 CA SER A 41 71.114 -12.110 3.735 1.00 0.00 C ATOM 589 C SER A 41 71.204 -11.445 5.095 1.00 0.00 C ATOM 590 O SER A 41 70.687 -10.351 5.300 1.00 0.00 O ATOM 591 CB SER A 41 70.074 -13.238 3.802 1.00 0.00 C ATOM 592 OG SER A 41 69.433 -13.360 2.539 1.00 0.00 O ATOM 0 H SER A 41 73.194 -12.276 3.954 1.00 0.00 H new ATOM 0 HA SER A 41 70.797 -11.398 2.973 1.00 0.00 H new ATOM 0 HB2 SER A 41 70.556 -14.178 4.070 1.00 0.00 H new ATOM 0 HB3 SER A 41 69.338 -13.025 4.577 1.00 0.00 H new ATOM 0 HG SER A 41 70.107 -13.350 1.828 1.00 0.00 H new ATOM 598 N LEU A 42 71.887 -12.126 6.016 1.00 0.00 N ATOM 599 CA LEU A 42 72.068 -11.614 7.377 1.00 0.00 C ATOM 600 C LEU A 42 72.625 -10.191 7.353 1.00 0.00 C ATOM 601 O LEU A 42 72.185 -9.323 8.108 1.00 0.00 O ATOM 602 CB LEU A 42 73.028 -12.518 8.159 1.00 0.00 C ATOM 603 CG LEU A 42 72.660 -12.739 9.627 1.00 0.00 C ATOM 604 CD1 LEU A 42 73.580 -13.802 10.230 1.00 0.00 C ATOM 605 CD2 LEU A 42 72.825 -11.427 10.398 1.00 0.00 C ATOM 0 H LEU A 42 72.324 -13.032 5.846 1.00 0.00 H new ATOM 0 HA LEU A 42 71.093 -11.605 7.865 1.00 0.00 H new ATOM 0 HB2 LEU A 42 73.075 -13.487 7.663 1.00 0.00 H new ATOM 0 HB3 LEU A 42 74.028 -12.087 8.112 1.00 0.00 H new ATOM 0 HG LEU A 42 71.625 -13.073 9.694 1.00 0.00 H new ATOM 0 HD11 LEU A 42 73.318 -13.959 11.276 1.00 0.00 H new ATOM 0 HD12 LEU A 42 73.464 -14.737 9.682 1.00 0.00 H new ATOM 0 HD13 LEU A 42 74.615 -13.468 10.162 1.00 0.00 H new ATOM 0 HD21 LEU A 42 72.563 -11.584 11.444 1.00 0.00 H new ATOM 0 HD22 LEU A 42 73.860 -11.093 10.330 1.00 0.00 H new ATOM 0 HD23 LEU A 42 72.170 -10.668 9.970 1.00 0.00 H new ATOM 617 N ALA A 43 73.590 -9.963 6.468 1.00 0.00 N ATOM 618 CA ALA A 43 74.191 -8.640 6.348 1.00 0.00 C ATOM 619 C ALA A 43 73.166 -7.648 5.822 1.00 0.00 C ATOM 620 O ALA A 43 73.058 -6.525 6.313 1.00 0.00 O ATOM 621 CB ALA A 43 75.389 -8.676 5.397 1.00 0.00 C ATOM 0 H ALA A 43 73.968 -10.665 5.832 1.00 0.00 H new ATOM 0 HA ALA A 43 74.530 -8.329 7.336 1.00 0.00 H new ATOM 0 HB1 ALA A 43 75.823 -7.679 5.321 1.00 0.00 H new ATOM 0 HB2 ALA A 43 76.137 -9.370 5.781 1.00 0.00 H new ATOM 0 HB3 ALA A 43 75.061 -9.005 4.411 1.00 0.00 H new ATOM 627 N LEU A 44 72.410 -8.077 4.820 1.00 0.00 N ATOM 628 CA LEU A 44 71.388 -7.219 4.227 1.00 0.00 C ATOM 629 C LEU A 44 70.359 -6.801 5.271 1.00 0.00 C ATOM 630 O LEU A 44 69.963 -5.637 5.332 1.00 0.00 O ATOM 631 CB LEU A 44 70.688 -7.938 3.072 1.00 0.00 C ATOM 632 CG LEU A 44 71.608 -8.369 1.925 1.00 0.00 C ATOM 633 CD1 LEU A 44 70.763 -8.880 0.760 1.00 0.00 C ATOM 634 CD2 LEU A 44 72.444 -7.176 1.453 1.00 0.00 C ATOM 0 H LEU A 44 72.482 -9.005 4.403 1.00 0.00 H new ATOM 0 HA LEU A 44 71.881 -6.326 3.844 1.00 0.00 H new ATOM 0 HB2 LEU A 44 70.185 -8.821 3.465 1.00 0.00 H new ATOM 0 HB3 LEU A 44 69.915 -7.283 2.671 1.00 0.00 H new ATOM 0 HG LEU A 44 72.270 -9.160 2.276 1.00 0.00 H new ATOM 0 HD11 LEU A 44 71.417 -9.187 -0.057 1.00 0.00 H new ATOM 0 HD12 LEU A 44 70.168 -9.732 1.088 1.00 0.00 H new ATOM 0 HD13 LEU A 44 70.100 -8.086 0.415 1.00 0.00 H new ATOM 0 HD21 LEU A 44 73.096 -7.489 0.637 1.00 0.00 H new ATOM 0 HD22 LEU A 44 71.782 -6.383 1.105 1.00 0.00 H new ATOM 0 HD23 LEU A 44 73.050 -6.806 2.280 1.00 0.00 H new ATOM 646 N LEU A 45 69.931 -7.754 6.104 1.00 0.00 N ATOM 647 CA LEU A 45 68.944 -7.434 7.150 1.00 0.00 C ATOM 648 C LEU A 45 69.473 -6.313 8.043 1.00 0.00 C ATOM 649 O LEU A 45 68.762 -5.362 8.364 1.00 0.00 O ATOM 650 CB LEU A 45 68.610 -8.645 8.042 1.00 0.00 C ATOM 651 CG LEU A 45 68.788 -10.031 7.418 1.00 0.00 C ATOM 652 CD1 LEU A 45 68.202 -11.086 8.358 1.00 0.00 C ATOM 653 CD2 LEU A 45 68.064 -10.101 6.068 1.00 0.00 C ATOM 0 H LEU A 45 70.238 -8.726 6.081 1.00 0.00 H new ATOM 0 HA LEU A 45 68.034 -7.127 6.634 1.00 0.00 H new ATOM 0 HB2 LEU A 45 69.233 -8.592 8.935 1.00 0.00 H new ATOM 0 HB3 LEU A 45 67.575 -8.550 8.370 1.00 0.00 H new ATOM 0 HG LEU A 45 69.851 -10.217 7.263 1.00 0.00 H new ATOM 0 HD11 LEU A 45 68.327 -12.075 7.917 1.00 0.00 H new ATOM 0 HD12 LEU A 45 68.720 -11.048 9.316 1.00 0.00 H new ATOM 0 HD13 LEU A 45 67.141 -10.888 8.511 1.00 0.00 H new ATOM 0 HD21 LEU A 45 68.198 -11.092 5.634 1.00 0.00 H new ATOM 0 HD22 LEU A 45 67.001 -9.910 6.215 1.00 0.00 H new ATOM 0 HD23 LEU A 45 68.478 -9.351 5.394 1.00 0.00 H new ATOM 665 N ASN A 46 70.739 -6.442 8.433 1.00 0.00 N ATOM 666 CA ASN A 46 71.369 -5.438 9.285 1.00 0.00 C ATOM 667 C ASN A 46 71.429 -4.097 8.562 1.00 0.00 C ATOM 668 O ASN A 46 71.020 -3.068 9.099 1.00 0.00 O ATOM 669 CB ASN A 46 72.789 -5.864 9.659 1.00 0.00 C ATOM 670 CG ASN A 46 72.743 -7.194 10.401 1.00 0.00 C ATOM 671 OD1 ASN A 46 71.984 -7.354 11.357 1.00 0.00 O ATOM 672 ND2 ASN A 46 73.518 -8.169 10.013 1.00 0.00 N ATOM 0 H ASN A 46 71.343 -7.223 8.176 1.00 0.00 H new ATOM 0 HA ASN A 46 70.771 -5.341 10.191 1.00 0.00 H new ATOM 0 HB2 ASN A 46 73.400 -5.957 8.761 1.00 0.00 H new ATOM 0 HB3 ASN A 46 73.255 -5.103 10.284 1.00 0.00 H new ATOM 0 HD21 ASN A 46 73.495 -9.064 10.502 1.00 0.00 H new ATOM 0 HD22 ASN A 46 74.147 -8.036 9.221 1.00 0.00 H new ATOM 679 N THR A 47 71.945 -4.121 7.333 1.00 0.00 N ATOM 680 CA THR A 47 72.054 -2.897 6.536 1.00 0.00 C ATOM 681 C THR A 47 70.685 -2.248 6.357 1.00 0.00 C ATOM 682 O THR A 47 70.506 -1.056 6.608 1.00 0.00 O ATOM 683 CB THR A 47 72.641 -3.202 5.154 1.00 0.00 C ATOM 684 OG1 THR A 47 73.475 -4.347 5.232 1.00 0.00 O ATOM 685 CG2 THR A 47 73.460 -2.006 4.671 1.00 0.00 C ATOM 0 H THR A 47 72.290 -4.962 6.871 1.00 0.00 H new ATOM 0 HA THR A 47 72.715 -2.213 7.069 1.00 0.00 H new ATOM 0 HB THR A 47 71.829 -3.393 4.452 1.00 0.00 H new ATOM 0 HG1 THR A 47 72.920 -5.153 5.277 1.00 0.00 H new ATOM 0 HG21 THR A 47 73.877 -2.224 3.688 1.00 0.00 H new ATOM 0 HG22 THR A 47 72.818 -1.128 4.606 1.00 0.00 H new ATOM 0 HG23 THR A 47 74.270 -1.812 5.374 1.00 0.00 H new ATOM 693 N VAL A 48 69.722 -3.053 5.925 1.00 0.00 N ATOM 694 CA VAL A 48 68.364 -2.560 5.716 1.00 0.00 C ATOM 695 C VAL A 48 67.775 -2.066 7.036 1.00 0.00 C ATOM 696 O VAL A 48 66.997 -1.113 7.066 1.00 0.00 O ATOM 697 CB VAL A 48 67.468 -3.667 5.147 1.00 0.00 C ATOM 698 CG1 VAL A 48 66.090 -3.094 4.807 1.00 0.00 C ATOM 699 CG2 VAL A 48 68.105 -4.238 3.876 1.00 0.00 C ATOM 0 H VAL A 48 69.853 -4.042 5.714 1.00 0.00 H new ATOM 0 HA VAL A 48 68.408 -1.736 5.004 1.00 0.00 H new ATOM 0 HB VAL A 48 67.359 -4.457 5.890 1.00 0.00 H new ATOM 0 HG11 VAL A 48 65.457 -3.884 4.403 1.00 0.00 H new ATOM 0 HG12 VAL A 48 65.632 -2.688 5.709 1.00 0.00 H new ATOM 0 HG13 VAL A 48 66.198 -2.302 4.066 1.00 0.00 H new ATOM 0 HG21 VAL A 48 67.468 -5.025 3.472 1.00 0.00 H new ATOM 0 HG22 VAL A 48 68.216 -3.445 3.137 1.00 0.00 H new ATOM 0 HG23 VAL A 48 69.085 -4.651 4.114 1.00 0.00 H new ATOM 709 N GLY A 49 68.159 -2.727 8.124 1.00 0.00 N ATOM 710 CA GLY A 49 67.669 -2.353 9.449 1.00 0.00 C ATOM 711 C GLY A 49 68.084 -0.927 9.801 1.00 0.00 C ATOM 712 O GLY A 49 67.294 -0.146 10.334 1.00 0.00 O ATOM 0 H GLY A 49 68.803 -3.518 8.117 1.00 0.00 H new ATOM 0 HA2 GLY A 49 66.583 -2.437 9.476 1.00 0.00 H new ATOM 0 HA3 GLY A 49 68.061 -3.045 10.195 1.00 0.00 H new ATOM 716 N ARG A 50 69.335 -0.597 9.499 1.00 0.00 N ATOM 717 CA ARG A 50 69.847 0.736 9.791 1.00 0.00 C ATOM 718 C ARG A 50 69.125 1.782 8.951 1.00 0.00 C ATOM 719 O ARG A 50 68.883 2.899 9.402 1.00 0.00 O ATOM 720 CB ARG A 50 71.348 0.812 9.504 1.00 0.00 C ATOM 721 CG ARG A 50 71.900 2.141 10.026 1.00 0.00 C ATOM 722 CD ARG A 50 72.321 1.989 11.491 1.00 0.00 C ATOM 723 NE ARG A 50 73.773 1.831 11.598 1.00 0.00 N ATOM 724 CZ ARG A 50 74.618 2.855 11.412 1.00 0.00 C ATOM 725 NH1 ARG A 50 74.176 4.057 11.124 1.00 0.00 N ATOM 726 NH2 ARG A 50 75.903 2.654 11.519 1.00 0.00 N ATOM 0 H ARG A 50 70.006 -1.226 9.057 1.00 0.00 H new ATOM 0 HA ARG A 50 69.672 0.937 10.848 1.00 0.00 H new ATOM 0 HB2 ARG A 50 71.863 -0.021 9.982 1.00 0.00 H new ATOM 0 HB3 ARG A 50 71.529 0.726 8.433 1.00 0.00 H new ATOM 0 HG2 ARG A 50 72.753 2.453 9.423 1.00 0.00 H new ATOM 0 HG3 ARG A 50 71.144 2.920 9.935 1.00 0.00 H new ATOM 0 HD2 ARG A 50 72.002 2.863 12.059 1.00 0.00 H new ATOM 0 HD3 ARG A 50 71.823 1.125 11.930 1.00 0.00 H new ATOM 0 HE ARG A 50 74.154 0.912 11.821 1.00 0.00 H new ATOM 0 HH11 ARG A 50 73.174 4.225 11.038 1.00 0.00 H new ATOM 0 HH12 ARG A 50 74.835 4.823 10.986 1.00 0.00 H new ATOM 0 HH21 ARG A 50 76.257 1.724 11.742 1.00 0.00 H new ATOM 0 HH22 ARG A 50 76.554 3.427 11.379 1.00 0.00 H new ATOM 740 N ILE A 51 68.782 1.408 7.722 1.00 0.00 N ATOM 741 CA ILE A 51 68.085 2.329 6.828 1.00 0.00 C ATOM 742 C ILE A 51 66.668 2.587 7.333 1.00 0.00 C ATOM 743 O ILE A 51 66.237 3.732 7.449 1.00 0.00 O ATOM 744 CB ILE A 51 68.027 1.760 5.406 1.00 0.00 C ATOM 745 CG1 ILE A 51 69.449 1.459 4.924 1.00 0.00 C ATOM 746 CG2 ILE A 51 67.384 2.781 4.461 1.00 0.00 C ATOM 747 CD1 ILE A 51 69.434 0.266 3.963 1.00 0.00 C ATOM 0 H ILE A 51 68.971 0.487 7.326 1.00 0.00 H new ATOM 0 HA ILE A 51 68.637 3.269 6.811 1.00 0.00 H new ATOM 0 HB ILE A 51 67.433 0.846 5.410 1.00 0.00 H new ATOM 0 HG12 ILE A 51 69.866 2.334 4.425 1.00 0.00 H new ATOM 0 HG13 ILE A 51 70.093 1.242 5.776 1.00 0.00 H new ATOM 0 HG21 ILE A 51 67.346 2.370 3.452 1.00 0.00 H new ATOM 0 HG22 ILE A 51 66.372 3.004 4.800 1.00 0.00 H new ATOM 0 HG23 ILE A 51 67.976 3.697 4.458 1.00 0.00 H new ATOM 0 HD11 ILE A 51 70.449 0.058 3.625 1.00 0.00 H new ATOM 0 HD12 ILE A 51 69.036 -0.610 4.476 1.00 0.00 H new ATOM 0 HD13 ILE A 51 68.806 0.499 3.103 1.00 0.00 H new ATOM 759 N GLU A 52 65.944 1.511 7.630 1.00 0.00 N ATOM 760 CA GLU A 52 64.573 1.650 8.119 1.00 0.00 C ATOM 761 C GLU A 52 64.533 2.440 9.426 1.00 0.00 C ATOM 762 O GLU A 52 63.505 3.019 9.777 1.00 0.00 O ATOM 763 CB GLU A 52 63.929 0.279 8.338 1.00 0.00 C ATOM 764 CG GLU A 52 64.777 -0.539 9.312 1.00 0.00 C ATOM 765 CD GLU A 52 64.069 -1.853 9.625 1.00 0.00 C ATOM 766 OE1 GLU A 52 63.235 -1.856 10.517 1.00 0.00 O ATOM 767 OE2 GLU A 52 64.370 -2.837 8.969 1.00 0.00 O ATOM 0 H GLU A 52 66.274 0.550 7.543 1.00 0.00 H new ATOM 0 HA GLU A 52 64.011 2.192 7.359 1.00 0.00 H new ATOM 0 HB2 GLU A 52 62.920 0.399 8.732 1.00 0.00 H new ATOM 0 HB3 GLU A 52 63.840 -0.247 7.388 1.00 0.00 H new ATOM 0 HG2 GLU A 52 65.758 -0.736 8.879 1.00 0.00 H new ATOM 0 HG3 GLU A 52 64.941 0.025 10.230 1.00 0.00 H new ATOM 774 N ARG A 53 65.651 2.459 10.151 1.00 0.00 N ATOM 775 CA ARG A 53 65.700 3.189 11.416 1.00 0.00 C ATOM 776 C ARG A 53 66.263 4.592 11.213 1.00 0.00 C ATOM 777 O ARG A 53 65.779 5.561 11.797 1.00 0.00 O ATOM 778 CB ARG A 53 66.568 2.445 12.433 1.00 0.00 C ATOM 779 CG ARG A 53 66.408 3.093 13.810 1.00 0.00 C ATOM 780 CD ARG A 53 67.534 2.621 14.732 1.00 0.00 C ATOM 781 NE ARG A 53 67.869 3.658 15.711 1.00 0.00 N ATOM 782 CZ ARG A 53 67.043 3.984 16.715 1.00 0.00 C ATOM 783 NH1 ARG A 53 65.887 3.385 16.866 1.00 0.00 N ATOM 784 NH2 ARG A 53 67.397 4.915 17.558 1.00 0.00 N ATOM 0 H ARG A 53 66.518 1.988 9.891 1.00 0.00 H new ATOM 0 HA ARG A 53 64.680 3.264 11.793 1.00 0.00 H new ATOM 0 HB2 ARG A 53 66.277 1.395 12.477 1.00 0.00 H new ATOM 0 HB3 ARG A 53 67.613 2.473 12.125 1.00 0.00 H new ATOM 0 HG2 ARG A 53 66.431 4.179 13.717 1.00 0.00 H new ATOM 0 HG3 ARG A 53 65.440 2.830 14.237 1.00 0.00 H new ATOM 0 HD2 ARG A 53 67.231 1.710 15.249 1.00 0.00 H new ATOM 0 HD3 ARG A 53 68.416 2.373 14.141 1.00 0.00 H new ATOM 0 HE ARG A 53 68.760 4.148 15.626 1.00 0.00 H new ATOM 0 HH11 ARG A 53 65.601 2.656 16.213 1.00 0.00 H new ATOM 0 HH12 ARG A 53 65.273 3.648 17.637 1.00 0.00 H new ATOM 0 HH21 ARG A 53 68.295 5.387 17.449 1.00 0.00 H new ATOM 0 HH22 ARG A 53 66.776 5.171 18.326 1.00 0.00 H new ATOM 798 N ASP A 54 67.295 4.689 10.383 1.00 0.00 N ATOM 799 CA ASP A 54 67.923 5.975 10.112 1.00 0.00 C ATOM 800 C ASP A 54 67.037 6.832 9.212 1.00 0.00 C ATOM 801 O ASP A 54 66.934 8.045 9.393 1.00 0.00 O ATOM 802 CB ASP A 54 69.275 5.771 9.427 1.00 0.00 C ATOM 803 CG ASP A 54 70.316 5.366 10.466 1.00 0.00 C ATOM 804 OD1 ASP A 54 69.984 4.568 11.328 1.00 0.00 O ATOM 805 OD2 ASP A 54 71.429 5.860 10.385 1.00 0.00 O ATOM 0 H ASP A 54 67.711 3.899 9.890 1.00 0.00 H new ATOM 0 HA ASP A 54 68.066 6.484 11.065 1.00 0.00 H new ATOM 0 HB2 ASP A 54 69.193 5.001 8.659 1.00 0.00 H new ATOM 0 HB3 ASP A 54 69.583 6.689 8.926 1.00 0.00 H new ATOM 810 N TYR A 55 66.402 6.188 8.238 1.00 0.00 N ATOM 811 CA TYR A 55 65.529 6.899 7.310 1.00 0.00 C ATOM 812 C TYR A 55 64.070 6.818 7.757 1.00 0.00 C ATOM 813 O TYR A 55 63.252 7.662 7.390 1.00 0.00 O ATOM 814 CB TYR A 55 65.642 6.306 5.904 1.00 0.00 C ATOM 815 CG TYR A 55 66.990 6.646 5.315 1.00 0.00 C ATOM 816 CD1 TYR A 55 68.156 6.107 5.871 1.00 0.00 C ATOM 817 CD2 TYR A 55 67.072 7.502 4.210 1.00 0.00 C ATOM 818 CE1 TYR A 55 69.404 6.422 5.321 1.00 0.00 C ATOM 819 CE2 TYR A 55 68.320 7.818 3.660 1.00 0.00 C ATOM 820 CZ TYR A 55 69.486 7.277 4.216 1.00 0.00 C ATOM 821 OH TYR A 55 70.717 7.589 3.674 1.00 0.00 O ATOM 0 H TYR A 55 66.474 5.184 8.071 1.00 0.00 H new ATOM 0 HA TYR A 55 65.847 7.942 7.299 1.00 0.00 H new ATOM 0 HB2 TYR A 55 65.514 5.224 5.944 1.00 0.00 H new ATOM 0 HB3 TYR A 55 64.848 6.698 5.269 1.00 0.00 H new ATOM 0 HD1 TYR A 55 68.093 5.448 6.724 1.00 0.00 H new ATOM 0 HD2 TYR A 55 66.172 7.919 3.782 1.00 0.00 H new ATOM 0 HE1 TYR A 55 70.304 6.005 5.749 1.00 0.00 H new ATOM 0 HE2 TYR A 55 68.384 8.478 2.808 1.00 0.00 H new ATOM 0 HH TYR A 55 70.595 8.193 2.912 1.00 0.00 H new ATOM 831 N GLY A 56 63.743 5.793 8.543 1.00 0.00 N ATOM 832 CA GLY A 56 62.370 5.625 9.011 1.00 0.00 C ATOM 833 C GLY A 56 61.487 5.109 7.881 1.00 0.00 C ATOM 834 O GLY A 56 60.304 5.437 7.798 1.00 0.00 O ATOM 0 H GLY A 56 64.397 5.079 8.864 1.00 0.00 H new ATOM 0 HA2 GLY A 56 62.346 4.927 9.848 1.00 0.00 H new ATOM 0 HA3 GLY A 56 61.984 6.576 9.378 1.00 0.00 H new ATOM 838 N VAL A 57 62.081 4.298 7.007 1.00 0.00 N ATOM 839 CA VAL A 57 61.344 3.741 5.877 1.00 0.00 C ATOM 840 C VAL A 57 60.751 2.381 6.241 1.00 0.00 C ATOM 841 O VAL A 57 61.390 1.568 6.907 1.00 0.00 O ATOM 842 CB VAL A 57 62.267 3.592 4.658 1.00 0.00 C ATOM 843 CG1 VAL A 57 62.816 4.965 4.267 1.00 0.00 C ATOM 844 CG2 VAL A 57 63.440 2.665 4.994 1.00 0.00 C ATOM 0 H VAL A 57 63.060 4.015 7.059 1.00 0.00 H new ATOM 0 HA VAL A 57 60.533 4.426 5.629 1.00 0.00 H new ATOM 0 HB VAL A 57 61.696 3.167 3.832 1.00 0.00 H new ATOM 0 HG11 VAL A 57 63.471 4.862 3.402 1.00 0.00 H new ATOM 0 HG12 VAL A 57 61.989 5.630 4.018 1.00 0.00 H new ATOM 0 HG13 VAL A 57 63.379 5.383 5.101 1.00 0.00 H new ATOM 0 HG21 VAL A 57 64.087 2.567 4.123 1.00 0.00 H new ATOM 0 HG22 VAL A 57 64.009 3.084 5.824 1.00 0.00 H new ATOM 0 HG23 VAL A 57 63.059 1.683 5.275 1.00 0.00 H new ATOM 854 N GLN A 58 59.516 2.147 5.800 1.00 0.00 N ATOM 855 CA GLN A 58 58.842 0.881 6.089 1.00 0.00 C ATOM 856 C GLN A 58 57.446 0.858 5.468 1.00 0.00 C ATOM 857 O GLN A 58 56.440 1.048 6.155 1.00 0.00 O ATOM 858 CB GLN A 58 58.722 0.666 7.602 1.00 0.00 C ATOM 859 CG GLN A 58 58.776 -0.831 7.911 1.00 0.00 C ATOM 860 CD GLN A 58 58.004 -1.114 9.196 1.00 0.00 C ATOM 861 OE1 GLN A 58 56.861 -0.684 9.348 1.00 0.00 O ATOM 862 NE2 GLN A 58 58.567 -1.820 10.138 1.00 0.00 N ATOM 0 H GLN A 58 58.967 2.807 5.249 1.00 0.00 H new ATOM 0 HA GLN A 58 59.441 0.080 5.657 1.00 0.00 H new ATOM 0 HB2 GLN A 58 59.530 1.184 8.119 1.00 0.00 H new ATOM 0 HB3 GLN A 58 57.787 1.090 7.967 1.00 0.00 H new ATOM 0 HG2 GLN A 58 58.349 -1.399 7.085 1.00 0.00 H new ATOM 0 HG3 GLN A 58 59.812 -1.154 8.018 1.00 0.00 H new ATOM 0 HE21 GLN A 58 59.514 -2.176 10.011 1.00 0.00 H new ATOM 0 HE22 GLN A 58 58.060 -2.016 11.001 1.00 0.00 H new ATOM 871 N LEU A 59 57.393 0.617 4.161 1.00 0.00 N ATOM 872 CA LEU A 59 56.110 0.564 3.459 1.00 0.00 C ATOM 873 C LEU A 59 55.870 -0.834 2.888 1.00 0.00 C ATOM 874 O LEU A 59 55.195 -0.995 1.872 1.00 0.00 O ATOM 875 CB LEU A 59 56.072 1.590 2.321 1.00 0.00 C ATOM 876 CG LEU A 59 56.995 1.294 1.130 1.00 0.00 C ATOM 877 CD1 LEU A 59 56.449 1.987 -0.120 1.00 0.00 C ATOM 878 CD2 LEU A 59 58.408 1.811 1.430 1.00 0.00 C ATOM 0 H LEU A 59 58.210 0.457 3.572 1.00 0.00 H new ATOM 0 HA LEU A 59 55.325 0.800 4.178 1.00 0.00 H new ATOM 0 HB2 LEU A 59 55.048 1.662 1.955 1.00 0.00 H new ATOM 0 HB3 LEU A 59 56.335 2.567 2.727 1.00 0.00 H new ATOM 0 HG LEU A 59 57.035 0.218 0.961 1.00 0.00 H new ATOM 0 HD11 LEU A 59 57.103 1.778 -0.967 1.00 0.00 H new ATOM 0 HD12 LEU A 59 55.447 1.614 -0.334 1.00 0.00 H new ATOM 0 HD13 LEU A 59 56.407 3.063 0.049 1.00 0.00 H new ATOM 0 HD21 LEU A 59 59.060 1.599 0.583 1.00 0.00 H new ATOM 0 HD22 LEU A 59 58.373 2.887 1.601 1.00 0.00 H new ATOM 0 HD23 LEU A 59 58.796 1.315 2.320 1.00 0.00 H new ATOM 890 N GLY A 60 56.433 -1.842 3.551 1.00 0.00 N ATOM 891 CA GLY A 60 56.277 -3.219 3.101 1.00 0.00 C ATOM 892 C GLY A 60 57.300 -4.126 3.775 1.00 0.00 C ATOM 893 O GLY A 60 58.503 -4.007 3.546 1.00 0.00 O ATOM 0 H GLY A 60 56.996 -1.731 4.394 1.00 0.00 H new ATOM 0 HA2 GLY A 60 55.269 -3.568 3.327 1.00 0.00 H new ATOM 0 HA3 GLY A 60 56.397 -3.269 2.019 1.00 0.00 H new ATOM 897 N ASP A 61 56.807 -5.035 4.612 1.00 0.00 N ATOM 898 CA ASP A 61 57.687 -5.959 5.320 1.00 0.00 C ATOM 899 C ASP A 61 58.374 -6.905 4.339 1.00 0.00 C ATOM 900 O ASP A 61 59.525 -7.296 4.532 1.00 0.00 O ATOM 901 CB ASP A 61 56.892 -6.786 6.333 1.00 0.00 C ATOM 902 CG ASP A 61 56.610 -5.940 7.570 1.00 0.00 C ATOM 903 OD1 ASP A 61 55.720 -5.108 7.505 1.00 0.00 O ATOM 904 OD2 ASP A 61 57.288 -6.136 8.565 1.00 0.00 O ATOM 0 H ASP A 61 55.814 -5.151 4.815 1.00 0.00 H new ATOM 0 HA ASP A 61 58.440 -5.369 5.842 1.00 0.00 H new ATOM 0 HB2 ASP A 61 55.956 -7.123 5.888 1.00 0.00 H new ATOM 0 HB3 ASP A 61 57.453 -7.679 6.610 1.00 0.00 H new ATOM 909 N ASP A 62 57.654 -7.268 3.282 1.00 0.00 N ATOM 910 CA ASP A 62 58.202 -8.173 2.279 1.00 0.00 C ATOM 911 C ASP A 62 59.147 -7.452 1.314 1.00 0.00 C ATOM 912 O ASP A 62 59.709 -8.073 0.412 1.00 0.00 O ATOM 913 CB ASP A 62 57.078 -8.826 1.474 1.00 0.00 C ATOM 914 CG ASP A 62 56.178 -7.745 0.886 1.00 0.00 C ATOM 915 OD1 ASP A 62 56.666 -6.967 0.083 1.00 0.00 O ATOM 916 OD2 ASP A 62 55.013 -7.712 1.247 1.00 0.00 O ATOM 0 H ASP A 62 56.701 -6.954 3.099 1.00 0.00 H new ATOM 0 HA ASP A 62 58.768 -8.934 2.816 1.00 0.00 H new ATOM 0 HB2 ASP A 62 57.497 -9.439 0.676 1.00 0.00 H new ATOM 0 HB3 ASP A 62 56.496 -9.490 2.114 1.00 0.00 H new ATOM 921 N ALA A 63 59.339 -6.145 1.510 1.00 0.00 N ATOM 922 CA ALA A 63 60.240 -5.383 0.648 1.00 0.00 C ATOM 923 C ALA A 63 61.639 -5.981 0.695 1.00 0.00 C ATOM 924 O ALA A 63 62.378 -5.959 -0.290 1.00 0.00 O ATOM 925 CB ALA A 63 60.313 -3.930 1.111 1.00 0.00 C ATOM 0 H ALA A 63 58.890 -5.601 2.247 1.00 0.00 H new ATOM 0 HA ALA A 63 59.854 -5.424 -0.370 1.00 0.00 H new ATOM 0 HB1 ALA A 63 60.988 -3.374 0.460 1.00 0.00 H new ATOM 0 HB2 ALA A 63 59.319 -3.484 1.069 1.00 0.00 H new ATOM 0 HB3 ALA A 63 60.684 -3.893 2.135 1.00 0.00 H new ATOM 931 N VAL A 64 61.988 -6.526 1.856 1.00 0.00 N ATOM 932 CA VAL A 64 63.300 -7.141 2.031 1.00 0.00 C ATOM 933 C VAL A 64 63.378 -8.461 1.264 1.00 0.00 C ATOM 934 O VAL A 64 64.458 -8.899 0.869 1.00 0.00 O ATOM 935 CB VAL A 64 63.581 -7.407 3.511 1.00 0.00 C ATOM 936 CG1 VAL A 64 63.746 -6.076 4.246 1.00 0.00 C ATOM 937 CG2 VAL A 64 62.415 -8.190 4.126 1.00 0.00 C ATOM 0 H VAL A 64 61.389 -6.555 2.681 1.00 0.00 H new ATOM 0 HA VAL A 64 64.047 -6.449 1.642 1.00 0.00 H new ATOM 0 HB VAL A 64 64.497 -7.991 3.605 1.00 0.00 H new ATOM 0 HG11 VAL A 64 63.946 -6.265 5.301 1.00 0.00 H new ATOM 0 HG12 VAL A 64 64.578 -5.522 3.812 1.00 0.00 H new ATOM 0 HG13 VAL A 64 62.831 -5.491 4.150 1.00 0.00 H new ATOM 0 HG21 VAL A 64 62.619 -8.378 5.180 1.00 0.00 H new ATOM 0 HG22 VAL A 64 61.497 -7.610 4.031 1.00 0.00 H new ATOM 0 HG23 VAL A 64 62.299 -9.140 3.604 1.00 0.00 H new ATOM 947 N GLU A 65 62.221 -9.092 1.058 1.00 0.00 N ATOM 948 CA GLU A 65 62.177 -10.359 0.338 1.00 0.00 C ATOM 949 C GLU A 65 62.408 -10.135 -1.152 1.00 0.00 C ATOM 950 O GLU A 65 63.348 -10.670 -1.738 1.00 0.00 O ATOM 951 CB GLU A 65 60.822 -11.042 0.537 1.00 0.00 C ATOM 952 CG GLU A 65 60.909 -12.495 0.066 1.00 0.00 C ATOM 953 CD GLU A 65 59.753 -13.292 0.659 1.00 0.00 C ATOM 954 OE1 GLU A 65 58.617 -12.902 0.441 1.00 0.00 O ATOM 955 OE2 GLU A 65 60.020 -14.281 1.322 1.00 0.00 O ATOM 0 H GLU A 65 61.314 -8.750 1.376 1.00 0.00 H new ATOM 0 HA GLU A 65 62.966 -10.998 0.735 1.00 0.00 H new ATOM 0 HB2 GLU A 65 60.535 -11.006 1.588 1.00 0.00 H new ATOM 0 HB3 GLU A 65 60.050 -10.513 -0.022 1.00 0.00 H new ATOM 0 HG2 GLU A 65 60.874 -12.538 -1.023 1.00 0.00 H new ATOM 0 HG3 GLU A 65 61.860 -12.931 0.372 1.00 0.00 H new ATOM 962 N LYS A 66 61.535 -9.335 -1.759 1.00 0.00 N ATOM 963 CA LYS A 66 61.646 -9.040 -3.184 1.00 0.00 C ATOM 964 C LYS A 66 62.971 -8.346 -3.492 1.00 0.00 C ATOM 965 O LYS A 66 63.510 -8.470 -4.591 1.00 0.00 O ATOM 966 CB LYS A 66 60.495 -8.139 -3.637 1.00 0.00 C ATOM 967 CG LYS A 66 59.160 -8.812 -3.313 1.00 0.00 C ATOM 968 CD LYS A 66 58.740 -9.708 -4.481 1.00 0.00 C ATOM 969 CE LYS A 66 57.237 -9.978 -4.402 1.00 0.00 C ATOM 970 NZ LYS A 66 56.860 -10.994 -5.426 1.00 0.00 N ATOM 0 H LYS A 66 60.750 -8.883 -1.291 1.00 0.00 H new ATOM 0 HA LYS A 66 61.602 -9.987 -3.723 1.00 0.00 H new ATOM 0 HB2 LYS A 66 60.558 -7.173 -3.137 1.00 0.00 H new ATOM 0 HB3 LYS A 66 60.568 -7.949 -4.708 1.00 0.00 H new ATOM 0 HG2 LYS A 66 59.251 -9.404 -2.402 1.00 0.00 H new ATOM 0 HG3 LYS A 66 58.396 -8.057 -3.128 1.00 0.00 H new ATOM 0 HD2 LYS A 66 58.985 -9.227 -5.428 1.00 0.00 H new ATOM 0 HD3 LYS A 66 59.291 -10.648 -4.449 1.00 0.00 H new ATOM 0 HE2 LYS A 66 56.973 -10.334 -3.406 1.00 0.00 H new ATOM 0 HE3 LYS A 66 56.682 -9.055 -4.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 55.838 -11.178 -5.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 57.099 -10.637 -6.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 57.380 -11.877 -5.247 1.00 0.00 H new ATOM 984 N ALA A 67 63.491 -7.611 -2.508 1.00 0.00 N ATOM 985 CA ALA A 67 64.755 -6.897 -2.685 1.00 0.00 C ATOM 986 C ALA A 67 65.880 -7.862 -3.053 1.00 0.00 C ATOM 987 O ALA A 67 66.486 -8.493 -2.187 1.00 0.00 O ATOM 988 CB ALA A 67 65.140 -6.158 -1.404 1.00 0.00 C ATOM 0 H ALA A 67 63.062 -7.495 -1.590 1.00 0.00 H new ATOM 0 HA ALA A 67 64.615 -6.180 -3.494 1.00 0.00 H new ATOM 0 HB1 ALA A 67 66.083 -5.633 -1.556 1.00 0.00 H new ATOM 0 HB2 ALA A 67 64.361 -5.439 -1.151 1.00 0.00 H new ATOM 0 HB3 ALA A 67 65.251 -6.874 -0.590 1.00 0.00 H new ATOM 994 N THR A 68 66.155 -7.959 -4.350 1.00 0.00 N ATOM 995 CA THR A 68 67.218 -8.836 -4.834 1.00 0.00 C ATOM 996 C THR A 68 68.424 -8.004 -5.267 1.00 0.00 C ATOM 997 O THR A 68 69.570 -8.440 -5.164 1.00 0.00 O ATOM 998 CB THR A 68 66.731 -9.675 -6.020 1.00 0.00 C ATOM 999 OG1 THR A 68 67.810 -10.452 -6.521 1.00 0.00 O ATOM 1000 CG2 THR A 68 66.209 -8.754 -7.123 1.00 0.00 C ATOM 0 H THR A 68 65.661 -7.446 -5.081 1.00 0.00 H new ATOM 0 HA THR A 68 67.505 -9.504 -4.022 1.00 0.00 H new ATOM 0 HB THR A 68 65.927 -10.334 -5.692 1.00 0.00 H new ATOM 0 HG1 THR A 68 67.501 -10.991 -7.279 1.00 0.00 H new ATOM 0 HG21 THR A 68 65.864 -9.354 -7.965 1.00 0.00 H new ATOM 0 HG22 THR A 68 65.381 -8.158 -6.738 1.00 0.00 H new ATOM 0 HG23 THR A 68 67.010 -8.092 -7.454 1.00 0.00 H new ATOM 1008 N THR A 69 68.148 -6.795 -5.750 1.00 0.00 N ATOM 1009 CA THR A 69 69.204 -5.890 -6.193 1.00 0.00 C ATOM 1010 C THR A 69 69.265 -4.683 -5.254 1.00 0.00 C ATOM 1011 O THR A 69 68.375 -4.500 -4.423 1.00 0.00 O ATOM 1012 CB THR A 69 68.931 -5.401 -7.628 1.00 0.00 C ATOM 1013 OG1 THR A 69 67.599 -5.729 -8.003 1.00 0.00 O ATOM 1014 CG2 THR A 69 69.907 -6.064 -8.600 1.00 0.00 C ATOM 0 H THR A 69 67.204 -6.420 -5.844 1.00 0.00 H new ATOM 0 HA THR A 69 70.153 -6.426 -6.177 1.00 0.00 H new ATOM 0 HB THR A 69 69.064 -4.320 -7.663 1.00 0.00 H new ATOM 0 HG1 THR A 69 67.429 -5.415 -8.916 1.00 0.00 H new ATOM 0 HG21 THR A 69 69.707 -5.713 -9.612 1.00 0.00 H new ATOM 0 HG22 THR A 69 70.929 -5.807 -8.322 1.00 0.00 H new ATOM 0 HG23 THR A 69 69.782 -7.146 -8.560 1.00 0.00 H new ATOM 1022 N PRO A 70 70.293 -3.829 -5.374 1.00 0.00 N ATOM 1023 CA PRO A 70 70.399 -2.644 -4.508 1.00 0.00 C ATOM 1024 C PRO A 70 69.329 -1.622 -4.855 1.00 0.00 C ATOM 1025 O PRO A 70 68.741 -0.992 -3.976 1.00 0.00 O ATOM 1026 CB PRO A 70 71.802 -2.130 -4.808 1.00 0.00 C ATOM 1027 CG PRO A 70 72.177 -2.670 -6.177 1.00 0.00 C ATOM 1028 CD PRO A 70 71.384 -3.963 -6.368 1.00 0.00 C ATOM 0 HA PRO A 70 70.248 -2.857 -3.450 1.00 0.00 H new ATOM 0 HB2 PRO A 70 71.825 -1.040 -4.801 1.00 0.00 H new ATOM 0 HB3 PRO A 70 72.509 -2.469 -4.051 1.00 0.00 H new ATOM 0 HG2 PRO A 70 71.936 -1.949 -6.958 1.00 0.00 H new ATOM 0 HG3 PRO A 70 73.249 -2.860 -6.239 1.00 0.00 H new ATOM 0 HD2 PRO A 70 70.997 -4.054 -7.383 1.00 0.00 H new ATOM 0 HD3 PRO A 70 71.997 -4.845 -6.180 1.00 0.00 H new ATOM 1036 N ARG A 71 69.055 -1.493 -6.150 1.00 0.00 N ATOM 1037 CA ARG A 71 68.019 -0.573 -6.611 1.00 0.00 C ATOM 1038 C ARG A 71 66.674 -0.914 -5.962 1.00 0.00 C ATOM 1039 O ARG A 71 65.803 -0.057 -5.823 1.00 0.00 O ATOM 1040 CB ARG A 71 67.867 -0.653 -8.130 1.00 0.00 C ATOM 1041 CG ARG A 71 69.144 -0.147 -8.797 1.00 0.00 C ATOM 1042 CD ARG A 71 69.002 1.342 -9.112 1.00 0.00 C ATOM 1043 NE ARG A 71 70.001 1.753 -10.096 1.00 0.00 N ATOM 1044 CZ ARG A 71 70.009 2.980 -10.638 1.00 0.00 C ATOM 1045 NH1 ARG A 71 69.111 3.875 -10.306 1.00 0.00 N ATOM 1046 NH2 ARG A 71 70.926 3.287 -11.514 1.00 0.00 N ATOM 0 H ARG A 71 69.530 -2.007 -6.892 1.00 0.00 H new ATOM 0 HA ARG A 71 68.318 0.436 -6.327 1.00 0.00 H new ATOM 0 HB2 ARG A 71 67.669 -1.681 -8.433 1.00 0.00 H new ATOM 0 HB3 ARG A 71 67.014 -0.056 -8.453 1.00 0.00 H new ATOM 0 HG2 ARG A 71 69.999 -0.310 -8.140 1.00 0.00 H new ATOM 0 HG3 ARG A 71 69.334 -0.706 -9.713 1.00 0.00 H new ATOM 0 HD2 ARG A 71 68.001 1.545 -9.494 1.00 0.00 H new ATOM 0 HD3 ARG A 71 69.120 1.926 -8.199 1.00 0.00 H new ATOM 0 HE ARG A 71 70.717 1.084 -10.380 1.00 0.00 H new ATOM 0 HH11 ARG A 71 68.389 3.644 -9.624 1.00 0.00 H new ATOM 0 HH12 ARG A 71 69.134 4.803 -10.730 1.00 0.00 H new ATOM 0 HH21 ARG A 71 71.628 2.597 -11.781 1.00 0.00 H new ATOM 0 HH22 ARG A 71 70.941 4.217 -11.932 1.00 0.00 H new ATOM 1060 N ALA A 72 66.519 -2.180 -5.558 1.00 0.00 N ATOM 1061 CA ALA A 72 65.280 -2.614 -4.920 1.00 0.00 C ATOM 1062 C ALA A 72 65.136 -1.948 -3.559 1.00 0.00 C ATOM 1063 O ALA A 72 64.179 -1.217 -3.304 1.00 0.00 O ATOM 1064 CB ALA A 72 65.275 -4.131 -4.740 1.00 0.00 C ATOM 0 H ALA A 72 67.226 -2.908 -5.661 1.00 0.00 H new ATOM 0 HA ALA A 72 64.445 -2.327 -5.559 1.00 0.00 H new ATOM 0 HB1 ALA A 72 64.344 -4.438 -4.263 1.00 0.00 H new ATOM 0 HB2 ALA A 72 65.360 -4.613 -5.714 1.00 0.00 H new ATOM 0 HB3 ALA A 72 66.118 -4.426 -4.115 1.00 0.00 H new ATOM 1070 N LEU A 73 66.110 -2.205 -2.690 1.00 0.00 N ATOM 1071 CA LEU A 73 66.104 -1.621 -1.345 1.00 0.00 C ATOM 1072 C LEU A 73 66.041 -0.100 -1.428 1.00 0.00 C ATOM 1073 O LEU A 73 65.304 0.550 -0.688 1.00 0.00 O ATOM 1074 CB LEU A 73 67.365 -2.015 -0.575 1.00 0.00 C ATOM 1075 CG LEU A 73 67.661 -3.515 -0.533 1.00 0.00 C ATOM 1076 CD1 LEU A 73 69.050 -3.745 0.063 1.00 0.00 C ATOM 1077 CD2 LEU A 73 66.613 -4.214 0.336 1.00 0.00 C ATOM 0 H LEU A 73 66.909 -2.808 -2.887 1.00 0.00 H new ATOM 0 HA LEU A 73 65.226 -2.002 -0.823 1.00 0.00 H new ATOM 0 HB2 LEU A 73 68.218 -1.505 -1.022 1.00 0.00 H new ATOM 0 HB3 LEU A 73 67.275 -1.650 0.448 1.00 0.00 H new ATOM 0 HG LEU A 73 67.628 -3.921 -1.544 1.00 0.00 H new ATOM 0 HD11 LEU A 73 69.261 -4.814 0.093 1.00 0.00 H new ATOM 0 HD12 LEU A 73 69.798 -3.245 -0.553 1.00 0.00 H new ATOM 0 HD13 LEU A 73 69.083 -3.340 1.075 1.00 0.00 H new ATOM 0 HD21 LEU A 73 66.821 -5.283 0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 73 66.648 -3.807 1.347 1.00 0.00 H new ATOM 0 HD23 LEU A 73 65.622 -4.050 -0.087 1.00 0.00 H new ATOM 1089 N ILE A 74 66.815 0.459 -2.352 1.00 0.00 N ATOM 1090 CA ILE A 74 66.826 1.906 -2.536 1.00 0.00 C ATOM 1091 C ILE A 74 65.455 2.359 -3.037 1.00 0.00 C ATOM 1092 O ILE A 74 64.952 3.412 -2.649 1.00 0.00 O ATOM 1093 CB ILE A 74 67.910 2.320 -3.548 1.00 0.00 C ATOM 1094 CG1 ILE A 74 69.284 1.871 -3.041 1.00 0.00 C ATOM 1095 CG2 ILE A 74 67.920 3.843 -3.720 1.00 0.00 C ATOM 1096 CD1 ILE A 74 70.339 2.121 -4.123 1.00 0.00 C ATOM 0 H ILE A 74 67.434 -0.058 -2.976 1.00 0.00 H new ATOM 0 HA ILE A 74 67.049 2.381 -1.580 1.00 0.00 H new ATOM 0 HB ILE A 74 67.692 1.848 -4.506 1.00 0.00 H new ATOM 0 HG12 ILE A 74 69.544 2.416 -2.133 1.00 0.00 H new ATOM 0 HG13 ILE A 74 69.259 0.813 -2.781 1.00 0.00 H new ATOM 0 HG21 ILE A 74 68.691 4.123 -4.438 1.00 0.00 H new ATOM 0 HG22 ILE A 74 66.947 4.174 -4.084 1.00 0.00 H new ATOM 0 HG23 ILE A 74 68.129 4.316 -2.761 1.00 0.00 H new ATOM 0 HD11 ILE A 74 71.316 1.801 -3.760 1.00 0.00 H new ATOM 0 HD12 ILE A 74 70.082 1.556 -5.019 1.00 0.00 H new ATOM 0 HD13 ILE A 74 70.371 3.184 -4.361 1.00 0.00 H new ATOM 1108 N GLU A 75 64.859 1.550 -3.907 1.00 0.00 N ATOM 1109 CA GLU A 75 63.550 1.876 -4.464 1.00 0.00 C ATOM 1110 C GLU A 75 62.478 1.908 -3.381 1.00 0.00 C ATOM 1111 O GLU A 75 61.710 2.865 -3.283 1.00 0.00 O ATOM 1112 CB GLU A 75 63.155 0.856 -5.535 1.00 0.00 C ATOM 1113 CG GLU A 75 63.628 1.347 -6.905 1.00 0.00 C ATOM 1114 CD GLU A 75 63.384 0.261 -7.948 1.00 0.00 C ATOM 1115 OE1 GLU A 75 63.908 -0.827 -7.774 1.00 0.00 O ATOM 1116 OE2 GLU A 75 62.679 0.534 -8.905 1.00 0.00 O ATOM 0 H GLU A 75 65.257 0.672 -4.240 1.00 0.00 H new ATOM 0 HA GLU A 75 63.624 2.867 -4.912 1.00 0.00 H new ATOM 0 HB2 GLU A 75 63.600 -0.114 -5.311 1.00 0.00 H new ATOM 0 HB3 GLU A 75 62.074 0.718 -5.540 1.00 0.00 H new ATOM 0 HG2 GLU A 75 63.095 2.257 -7.181 1.00 0.00 H new ATOM 0 HG3 GLU A 75 64.688 1.598 -6.867 1.00 0.00 H new ATOM 1123 N MET A 76 62.424 0.855 -2.572 1.00 0.00 N ATOM 1124 CA MET A 76 61.429 0.788 -1.508 1.00 0.00 C ATOM 1125 C MET A 76 61.634 1.931 -0.520 1.00 0.00 C ATOM 1126 O MET A 76 60.679 2.467 0.044 1.00 0.00 O ATOM 1127 CB MET A 76 61.521 -0.548 -0.767 1.00 0.00 C ATOM 1128 CG MET A 76 62.941 -0.755 -0.239 1.00 0.00 C ATOM 1129 SD MET A 76 62.991 -2.246 0.786 1.00 0.00 S ATOM 1130 CE MET A 76 64.128 -1.617 2.045 1.00 0.00 C ATOM 0 H MET A 76 63.046 0.049 -2.630 1.00 0.00 H new ATOM 0 HA MET A 76 60.442 0.875 -1.961 1.00 0.00 H new ATOM 0 HB2 MET A 76 60.811 -0.565 0.060 1.00 0.00 H new ATOM 0 HB3 MET A 76 61.250 -1.364 -1.437 1.00 0.00 H new ATOM 0 HG2 MET A 76 63.640 -0.848 -1.070 1.00 0.00 H new ATOM 0 HG3 MET A 76 63.254 0.111 0.344 1.00 0.00 H new ATOM 0 HE1 MET A 76 64.193 -2.331 2.866 1.00 0.00 H new ATOM 0 HE2 MET A 76 65.116 -1.477 1.606 1.00 0.00 H new ATOM 0 HE3 MET A 76 63.761 -0.663 2.423 1.00 0.00 H new ATOM 1140 N THR A 77 62.894 2.305 -0.323 1.00 0.00 N ATOM 1141 CA THR A 77 63.218 3.393 0.591 1.00 0.00 C ATOM 1142 C THR A 77 62.730 4.723 0.024 1.00 0.00 C ATOM 1143 O THR A 77 62.012 5.469 0.687 1.00 0.00 O ATOM 1144 CB THR A 77 64.731 3.470 0.816 1.00 0.00 C ATOM 1145 OG1 THR A 77 65.218 2.188 1.187 1.00 0.00 O ATOM 1146 CG2 THR A 77 65.032 4.474 1.930 1.00 0.00 C ATOM 0 H THR A 77 63.699 1.876 -0.779 1.00 0.00 H new ATOM 0 HA THR A 77 62.721 3.197 1.541 1.00 0.00 H new ATOM 0 HB THR A 77 65.220 3.793 -0.103 1.00 0.00 H new ATOM 0 HG1 THR A 77 65.222 1.600 0.403 1.00 0.00 H new ATOM 0 HG21 THR A 77 66.109 4.528 2.090 1.00 0.00 H new ATOM 0 HG22 THR A 77 64.657 5.457 1.645 1.00 0.00 H new ATOM 0 HG23 THR A 77 64.544 4.153 2.851 1.00 0.00 H new ATOM 1154 N ASN A 78 63.122 5.004 -1.217 1.00 0.00 N ATOM 1155 CA ASN A 78 62.718 6.247 -1.876 1.00 0.00 C ATOM 1156 C ASN A 78 61.202 6.321 -1.984 1.00 0.00 C ATOM 1157 O ASN A 78 60.603 7.388 -1.870 1.00 0.00 O ATOM 1158 CB ASN A 78 63.310 6.323 -3.283 1.00 0.00 C ATOM 1159 CG ASN A 78 64.775 6.732 -3.203 1.00 0.00 C ATOM 1160 OD1 ASN A 78 65.132 7.864 -3.520 1.00 0.00 O ATOM 1161 ND2 ASN A 78 65.656 5.871 -2.792 1.00 0.00 N ATOM 0 H ASN A 78 63.713 4.395 -1.783 1.00 0.00 H new ATOM 0 HA ASN A 78 63.087 7.079 -1.276 1.00 0.00 H new ATOM 0 HB2 ASN A 78 63.219 5.357 -3.779 1.00 0.00 H new ATOM 0 HB3 ASN A 78 62.754 7.043 -3.883 1.00 0.00 H new ATOM 0 HD21 ASN A 78 66.639 6.136 -2.734 1.00 0.00 H new ATOM 0 HD22 ASN A 78 65.365 4.930 -2.528 1.00 0.00 H new ATOM 1168 N ALA A 79 60.598 5.161 -2.200 1.00 0.00 N ATOM 1169 CA ALA A 79 59.149 5.067 -2.321 1.00 0.00 C ATOM 1170 C ALA A 79 58.491 5.485 -1.018 1.00 0.00 C ATOM 1171 O ALA A 79 57.410 6.072 -1.004 1.00 0.00 O ATOM 1172 CB ALA A 79 58.736 3.632 -2.643 1.00 0.00 C ATOM 0 H ALA A 79 61.088 4.272 -2.295 1.00 0.00 H new ATOM 0 HA ALA A 79 58.828 5.728 -3.126 1.00 0.00 H new ATOM 0 HB1 ALA A 79 57.651 3.577 -2.731 1.00 0.00 H new ATOM 0 HB2 ALA A 79 59.192 3.325 -3.584 1.00 0.00 H new ATOM 0 HB3 ALA A 79 59.070 2.969 -1.844 1.00 0.00 H new ATOM 1178 N SER A 80 59.163 5.170 0.082 1.00 0.00 N ATOM 1179 CA SER A 80 58.649 5.511 1.395 1.00 0.00 C ATOM 1180 C SER A 80 58.809 7.006 1.646 1.00 0.00 C ATOM 1181 O SER A 80 57.890 7.673 2.119 1.00 0.00 O ATOM 1182 CB SER A 80 59.376 4.702 2.483 1.00 0.00 C ATOM 1183 OG SER A 80 60.439 5.466 3.043 1.00 0.00 O ATOM 0 H SER A 80 60.059 4.682 0.088 1.00 0.00 H new ATOM 0 HA SER A 80 57.589 5.261 1.433 1.00 0.00 H new ATOM 0 HB2 SER A 80 58.672 4.418 3.265 1.00 0.00 H new ATOM 0 HB3 SER A 80 59.768 3.779 2.057 1.00 0.00 H new ATOM 0 HG SER A 80 60.191 5.760 3.944 1.00 0.00 H new ATOM 1189 N LEU A 81 59.989 7.525 1.318 1.00 0.00 N ATOM 1190 CA LEU A 81 60.250 8.943 1.511 1.00 0.00 C ATOM 1191 C LEU A 81 59.354 9.771 0.600 1.00 0.00 C ATOM 1192 O LEU A 81 58.689 10.707 1.046 1.00 0.00 O ATOM 1193 CB LEU A 81 61.716 9.280 1.209 1.00 0.00 C ATOM 1194 CG LEU A 81 62.754 8.922 2.292 1.00 0.00 C ATOM 1195 CD1 LEU A 81 62.192 9.158 3.698 1.00 0.00 C ATOM 1196 CD2 LEU A 81 63.161 7.455 2.153 1.00 0.00 C ATOM 0 H LEU A 81 60.766 6.994 0.924 1.00 0.00 H new ATOM 0 HA LEU A 81 60.039 9.180 2.554 1.00 0.00 H new ATOM 0 HB2 LEU A 81 61.998 8.770 0.288 1.00 0.00 H new ATOM 0 HB3 LEU A 81 61.784 10.350 1.015 1.00 0.00 H new ATOM 0 HG LEU A 81 63.622 9.566 2.152 1.00 0.00 H new ATOM 0 HD11 LEU A 81 62.947 8.897 4.440 1.00 0.00 H new ATOM 0 HD12 LEU A 81 61.921 10.208 3.810 1.00 0.00 H new ATOM 0 HD13 LEU A 81 61.308 8.537 3.845 1.00 0.00 H new ATOM 0 HD21 LEU A 81 63.894 7.207 2.920 1.00 0.00 H new ATOM 0 HD22 LEU A 81 62.282 6.821 2.272 1.00 0.00 H new ATOM 0 HD23 LEU A 81 63.597 7.290 1.168 1.00 0.00 H new ATOM 1208 N THR A 82 59.342 9.423 -0.686 1.00 0.00 N ATOM 1209 CA THR A 82 58.517 10.154 -1.645 1.00 0.00 C ATOM 1210 C THR A 82 57.037 10.039 -1.275 1.00 0.00 C ATOM 1211 O THR A 82 56.249 10.953 -1.514 1.00 0.00 O ATOM 1212 CB THR A 82 58.730 9.625 -3.070 1.00 0.00 C ATOM 1213 OG1 THR A 82 57.946 10.387 -3.977 1.00 0.00 O ATOM 1214 CG2 THR A 82 58.321 8.153 -3.156 1.00 0.00 C ATOM 0 H THR A 82 59.883 8.654 -1.082 1.00 0.00 H new ATOM 0 HA THR A 82 58.817 11.201 -1.611 1.00 0.00 H new ATOM 0 HB THR A 82 59.785 9.714 -3.327 1.00 0.00 H new ATOM 0 HG1 THR A 82 58.082 10.052 -4.888 1.00 0.00 H new ATOM 0 HG21 THR A 82 58.477 7.791 -4.172 1.00 0.00 H new ATOM 0 HG22 THR A 82 58.926 7.566 -2.465 1.00 0.00 H new ATOM 0 HG23 THR A 82 57.268 8.052 -2.893 1.00 0.00 H new ATOM 1222 N GLY A 83 56.673 8.900 -0.687 1.00 0.00 N ATOM 1223 CA GLY A 83 55.287 8.673 -0.286 1.00 0.00 C ATOM 1224 C GLY A 83 54.878 9.644 0.815 1.00 0.00 C ATOM 1225 O GLY A 83 53.800 10.237 0.773 1.00 0.00 O ATOM 0 H GLY A 83 57.309 8.130 -0.480 1.00 0.00 H new ATOM 0 HA2 GLY A 83 54.630 8.794 -1.147 1.00 0.00 H new ATOM 0 HA3 GLY A 83 55.168 7.648 0.064 1.00 0.00 H new ATOM 1229 N ALA A 84 55.755 9.801 1.804 1.00 0.00 N ATOM 1230 CA ALA A 84 55.485 10.705 2.920 1.00 0.00 C ATOM 1231 C ALA A 84 54.229 10.274 3.670 1.00 0.00 C ATOM 1232 O ALA A 84 53.498 11.102 4.214 1.00 0.00 O ATOM 1233 CB ALA A 84 55.298 12.139 2.417 1.00 0.00 C ATOM 0 H ALA A 84 56.652 9.318 1.856 1.00 0.00 H new ATOM 0 HA ALA A 84 56.340 10.665 3.595 1.00 0.00 H new ATOM 0 HB1 ALA A 84 55.098 12.798 3.262 1.00 0.00 H new ATOM 0 HB2 ALA A 84 56.204 12.467 1.908 1.00 0.00 H new ATOM 0 HB3 ALA A 84 54.459 12.174 1.723 1.00 0.00 H new ATOM 1239 N SER A 85 53.986 8.966 3.696 1.00 0.00 N ATOM 1240 CA SER A 85 52.815 8.432 4.386 1.00 0.00 C ATOM 1241 C SER A 85 53.110 7.026 4.928 1.00 0.00 C ATOM 1242 O SER A 85 53.737 6.219 4.240 1.00 0.00 O ATOM 1243 CB SER A 85 51.622 8.357 3.434 1.00 0.00 C ATOM 1244 OG SER A 85 51.911 7.434 2.391 1.00 0.00 O ATOM 0 H SER A 85 54.577 8.263 3.252 1.00 0.00 H new ATOM 0 HA SER A 85 52.577 9.100 5.214 1.00 0.00 H new ATOM 0 HB2 SER A 85 50.729 8.044 3.975 1.00 0.00 H new ATOM 0 HB3 SER A 85 51.413 9.342 3.016 1.00 0.00 H new ATOM 0 HG SER A 85 51.147 7.382 1.779 1.00 0.00 H new ATOM 1250 N PRO A 86 52.671 6.704 6.159 1.00 0.00 N ATOM 1251 CA PRO A 86 52.915 5.374 6.747 1.00 0.00 C ATOM 1252 C PRO A 86 51.884 4.338 6.303 1.00 0.00 C ATOM 1253 O PRO A 86 50.891 4.666 5.654 1.00 0.00 O ATOM 1254 CB PRO A 86 52.790 5.651 8.239 1.00 0.00 C ATOM 1255 CG PRO A 86 51.924 6.897 8.394 1.00 0.00 C ATOM 1256 CD PRO A 86 51.914 7.622 7.044 1.00 0.00 C ATOM 0 HA PRO A 86 53.874 4.952 6.445 1.00 0.00 H new ATOM 0 HB2 PRO A 86 52.338 4.802 8.752 1.00 0.00 H new ATOM 0 HB3 PRO A 86 53.772 5.807 8.685 1.00 0.00 H new ATOM 0 HG2 PRO A 86 50.911 6.625 8.691 1.00 0.00 H new ATOM 0 HG3 PRO A 86 52.322 7.546 9.175 1.00 0.00 H new ATOM 0 HD2 PRO A 86 50.899 7.784 6.682 1.00 0.00 H new ATOM 0 HD3 PRO A 86 52.389 8.601 7.109 1.00 0.00 H new ATOM 1264 N SER A 87 52.132 3.083 6.667 1.00 0.00 N ATOM 1265 CA SER A 87 51.219 2.001 6.307 1.00 0.00 C ATOM 1266 C SER A 87 50.211 1.765 7.426 1.00 0.00 C ATOM 1267 O SER A 87 49.008 1.660 7.188 1.00 0.00 O ATOM 1268 CB SER A 87 51.993 0.708 6.052 1.00 0.00 C ATOM 1269 OG SER A 87 52.969 0.536 7.070 1.00 0.00 O ATOM 0 H SER A 87 52.948 2.791 7.205 1.00 0.00 H new ATOM 0 HA SER A 87 50.693 2.292 5.397 1.00 0.00 H new ATOM 0 HB2 SER A 87 51.310 -0.142 6.040 1.00 0.00 H new ATOM 0 HB3 SER A 87 52.473 0.745 5.074 1.00 0.00 H new ATOM 0 HG SER A 87 53.466 -0.293 6.910 1.00 0.00 H new ATOM 1275 N ALA A 88 50.719 1.685 8.654 1.00 0.00 N ATOM 1276 CA ALA A 88 49.859 1.462 9.816 1.00 0.00 C ATOM 1277 C ALA A 88 49.110 0.139 9.684 1.00 0.00 C ATOM 1278 O ALA A 88 48.125 0.037 8.953 1.00 0.00 O ATOM 1279 CB ALA A 88 48.842 2.598 9.957 1.00 0.00 C ATOM 0 H ALA A 88 51.712 1.770 8.870 1.00 0.00 H new ATOM 0 HA ALA A 88 50.495 1.431 10.701 1.00 0.00 H new ATOM 0 HB1 ALA A 88 48.211 2.415 10.827 1.00 0.00 H new ATOM 0 HB2 ALA A 88 49.368 3.544 10.083 1.00 0.00 H new ATOM 0 HB3 ALA A 88 48.222 2.644 9.062 1.00 0.00 H new ATOM 1285 N GLY A 89 49.591 -0.872 10.401 1.00 0.00 N ATOM 1286 CA GLY A 89 48.962 -2.189 10.360 1.00 0.00 C ATOM 1287 C GLY A 89 48.929 -2.816 11.750 1.00 0.00 C ATOM 1288 O GLY A 89 49.015 -4.035 11.898 1.00 0.00 O ATOM 0 H GLY A 89 50.406 -0.807 11.011 1.00 0.00 H new ATOM 0 HA2 GLY A 89 47.947 -2.101 9.972 1.00 0.00 H new ATOM 0 HA3 GLY A 89 49.510 -2.838 9.676 1.00 0.00 H new ATOM 1292 N GLY A 90 48.806 -1.967 12.765 1.00 0.00 N ATOM 1293 CA GLY A 90 48.764 -2.446 14.145 1.00 0.00 C ATOM 1294 C GLY A 90 47.705 -1.696 14.946 1.00 0.00 C ATOM 1295 O GLY A 90 47.500 -0.495 14.760 1.00 0.00 O ATOM 0 H GLY A 90 48.734 -0.955 12.662 1.00 0.00 H new ATOM 0 HA2 GLY A 90 48.547 -3.514 14.158 1.00 0.00 H new ATOM 0 HA3 GLY A 90 49.741 -2.313 14.611 1.00 0.00 H new ATOM 1299 N ALA A 91 47.036 -2.417 15.840 1.00 0.00 N ATOM 1300 CA ALA A 91 45.997 -1.813 16.670 1.00 0.00 C ATOM 1301 C ALA A 91 46.596 -1.277 17.966 1.00 0.00 C ATOM 1302 O ALA A 91 46.139 -0.273 18.511 1.00 0.00 O ATOM 1303 CB ALA A 91 44.916 -2.840 17.007 1.00 0.00 C ATOM 0 H ALA A 91 47.192 -3.411 16.008 1.00 0.00 H new ATOM 0 HA ALA A 91 45.553 -0.992 16.108 1.00 0.00 H new ATOM 0 HB1 ALA A 91 44.150 -2.372 17.626 1.00 0.00 H new ATOM 0 HB2 ALA A 91 44.464 -3.208 16.086 1.00 0.00 H new ATOM 0 HB3 ALA A 91 45.362 -3.673 17.550 1.00 0.00 H new ATOM 1309 N ALA A 92 47.628 -1.961 18.453 1.00 0.00 N ATOM 1310 CA ALA A 92 48.288 -1.549 19.689 1.00 0.00 C ATOM 1311 C ALA A 92 49.626 -2.265 19.843 1.00 0.00 C ATOM 1312 O ALA A 92 49.921 -3.219 19.125 1.00 0.00 O ATOM 1313 CB ALA A 92 47.408 -1.870 20.899 1.00 0.00 C ATOM 0 H ALA A 92 48.022 -2.794 18.016 1.00 0.00 H new ATOM 0 HA ALA A 92 48.456 -0.473 19.638 1.00 0.00 H new ATOM 0 HB1 ALA A 92 47.915 -1.556 21.811 1.00 0.00 H new ATOM 0 HB2 ALA A 92 46.460 -1.340 20.810 1.00 0.00 H new ATOM 0 HB3 ALA A 92 47.221 -2.943 20.938 1.00 0.00 H new ATOM 1319 N ARG A 93 50.431 -1.790 20.788 1.00 0.00 N ATOM 1320 CA ARG A 93 51.740 -2.391 21.032 1.00 0.00 C ATOM 1321 C ARG A 93 52.386 -1.774 22.269 1.00 0.00 C ATOM 1322 O ARG A 93 52.977 -2.473 23.092 1.00 0.00 O ATOM 1323 CB ARG A 93 52.660 -2.176 19.828 1.00 0.00 C ATOM 1324 CG ARG A 93 52.724 -0.686 19.492 1.00 0.00 C ATOM 1325 CD ARG A 93 53.312 -0.504 18.092 1.00 0.00 C ATOM 1326 NE ARG A 93 54.772 -0.406 18.153 1.00 0.00 N ATOM 1327 CZ ARG A 93 55.544 -0.559 17.067 1.00 0.00 C ATOM 1328 NH1 ARG A 93 55.020 -0.806 15.890 1.00 0.00 N ATOM 1329 NH2 ARG A 93 56.840 -0.462 17.183 1.00 0.00 N ATOM 0 H ARG A 93 50.205 -1.000 21.392 1.00 0.00 H new ATOM 0 HA ARG A 93 51.596 -3.460 21.192 1.00 0.00 H new ATOM 0 HB2 ARG A 93 53.659 -2.553 20.049 1.00 0.00 H new ATOM 0 HB3 ARG A 93 52.290 -2.737 18.970 1.00 0.00 H new ATOM 0 HG2 ARG A 93 51.727 -0.249 19.539 1.00 0.00 H new ATOM 0 HG3 ARG A 93 53.337 -0.163 20.226 1.00 0.00 H new ATOM 0 HD2 ARG A 93 53.025 -1.344 17.459 1.00 0.00 H new ATOM 0 HD3 ARG A 93 52.901 0.395 17.633 1.00 0.00 H new ATOM 0 HE ARG A 93 55.216 -0.215 19.051 1.00 0.00 H new ATOM 0 HH11 ARG A 93 54.008 -0.885 15.789 1.00 0.00 H new ATOM 0 HH12 ARG A 93 55.624 -0.919 15.076 1.00 0.00 H new ATOM 0 HH21 ARG A 93 57.258 -0.271 18.094 1.00 0.00 H new ATOM 0 HH22 ARG A 93 57.435 -0.577 16.363 1.00 0.00 H new ATOM 1343 N ASP A 94 52.267 -0.455 22.388 1.00 0.00 N ATOM 1344 CA ASP A 94 52.845 0.252 23.528 1.00 0.00 C ATOM 1345 C ASP A 94 52.031 -0.018 24.790 1.00 0.00 C ATOM 1346 O ASP A 94 52.583 -0.248 25.865 1.00 0.00 O ATOM 1347 CB ASP A 94 52.874 1.760 23.266 1.00 0.00 C ATOM 1348 CG ASP A 94 51.476 2.239 22.888 1.00 0.00 C ATOM 1349 OD1 ASP A 94 50.987 1.816 21.853 1.00 0.00 O ATOM 1350 OD2 ASP A 94 50.917 3.021 23.637 1.00 0.00 O ATOM 0 H ASP A 94 51.781 0.141 21.718 1.00 0.00 H new ATOM 0 HA ASP A 94 53.863 -0.111 23.667 1.00 0.00 H new ATOM 0 HB2 ASP A 94 53.223 2.287 24.154 1.00 0.00 H new ATOM 0 HB3 ASP A 94 53.577 1.987 22.464 1.00 0.00 H new ATOM 1355 N LYS A 95 50.709 0.013 24.645 1.00 0.00 N ATOM 1356 CA LYS A 95 49.822 -0.229 25.780 1.00 0.00 C ATOM 1357 C LYS A 95 48.364 -0.212 25.329 1.00 0.00 C ATOM 1358 O LYS A 95 47.511 -0.537 26.137 1.00 0.00 O ATOM 1359 CB LYS A 95 50.023 0.839 26.858 1.00 0.00 C ATOM 1360 CG LYS A 95 49.851 2.229 26.239 1.00 0.00 C ATOM 1361 CD LYS A 95 49.191 3.163 27.255 1.00 0.00 C ATOM 1362 CE LYS A 95 50.269 3.838 28.105 1.00 0.00 C ATOM 1363 NZ LYS A 95 49.738 5.116 28.660 1.00 0.00 N ATOM 1364 OXT LYS A 95 48.124 0.125 24.182 1.00 0.00 O ATOM 0 H LYS A 95 50.232 0.201 23.763 1.00 0.00 H new ATOM 0 HA LYS A 95 50.065 -1.208 26.192 1.00 0.00 H new ATOM 0 HB2 LYS A 95 49.303 0.697 27.664 1.00 0.00 H new ATOM 0 HB3 LYS A 95 51.016 0.745 27.297 1.00 0.00 H new ATOM 0 HG2 LYS A 95 50.820 2.627 25.939 1.00 0.00 H new ATOM 0 HG3 LYS A 95 49.240 2.164 25.338 1.00 0.00 H new ATOM 0 HD2 LYS A 95 48.596 3.916 26.739 1.00 0.00 H new ATOM 0 HD3 LYS A 95 48.510 2.600 27.893 1.00 0.00 H new ATOM 0 HE2 LYS A 95 50.575 3.177 28.916 1.00 0.00 H new ATOM 0 HE3 LYS A 95 51.155 4.032 27.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 50.471 5.575 29.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 49.467 5.747 27.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 48.905 4.918 29.251 1.00 0.00 H new TER 1378 LYS A 95