USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 653 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 -155:sc= -0.0603 (180deg=-0.642) USER MOD Single : A 1 MET N :NH3+ -167:sc=-0.00327 (180deg=-0.227) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ -166:sc= -0.0058 (180deg=-0.177) USER MOD Single : A 5 GLN : amide:sc= -0.454 K(o=-0.45,f=-1.5) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -1.19! C(o=-1.2!,f=-1.7!) USER MOD Single : A 12 LYS NZ :NH3+ -173:sc= 0.729 (180deg=0.634) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 HIS : no HD1:sc= -5.04! C(o=-5!,f=-8.1!) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 MET CE :methyl 156:sc=-0.00308 (180deg=-0.408) USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 38 ASN : amide:sc= -3.2! C(o=-3.2!,f=-11!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -0.666 X(o=-0.67,f=-0.61) USER MOD Single : A 48 SER OG : rot 180:sc= 0.199 USER MOD Single : A 54 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -151:sc= -0.033 (180deg=-0.756) USER MOD Single : A 62 GLN : amide:sc= -0.0226 K(o=-0.023,f=-1.4!) USER MOD Single : A 68 THR OG1 : rot 160:sc= -5.42! USER MOD Single : A 71 GLN : amide:sc= -1.97 K(o=-2,f=-3.9!) USER MOD Single : A 84 ASN : amide:sc= -2.37! X(o=-2.4!,f=-2) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 47.173 -12.050 16.014 1.00 0.00 N ATOM 2 CA MET A 1 48.050 -12.913 15.172 1.00 0.00 C ATOM 3 C MET A 1 49.480 -12.388 15.229 1.00 0.00 C ATOM 4 O MET A 1 49.766 -11.285 14.759 1.00 0.00 O ATOM 5 CB MET A 1 47.544 -12.896 13.728 1.00 0.00 C ATOM 6 CG MET A 1 46.172 -13.568 13.660 1.00 0.00 C ATOM 7 SD MET A 1 45.685 -13.771 11.928 1.00 0.00 S ATOM 8 CE MET A 1 45.383 -12.023 11.572 1.00 0.00 C ATOM 0 H1 MET A 1 46.257 -12.521 16.157 1.00 0.00 H new ATOM 0 H2 MET A 1 47.627 -11.888 16.936 1.00 0.00 H new ATOM 0 H3 MET A 1 47.023 -11.138 15.537 1.00 0.00 H new ATOM 0 HA MET A 1 48.029 -13.937 15.546 1.00 0.00 H new ATOM 0 HB2 MET A 1 47.476 -11.870 13.367 1.00 0.00 H new ATOM 0 HB3 MET A 1 48.248 -13.416 13.079 1.00 0.00 H new ATOM 0 HG2 MET A 1 46.205 -14.538 14.156 1.00 0.00 H new ATOM 0 HG3 MET A 1 45.433 -12.965 14.188 1.00 0.00 H new ATOM 0 HE1 MET A 1 44.675 -11.937 10.748 1.00 0.00 H new ATOM 0 HE2 MET A 1 44.971 -11.537 12.457 1.00 0.00 H new ATOM 0 HE3 MET A 1 46.321 -11.540 11.297 1.00 0.00 H new ATOM 20 N THR A 2 50.375 -13.182 15.807 1.00 0.00 N ATOM 21 CA THR A 2 51.775 -12.786 15.918 1.00 0.00 C ATOM 22 C THR A 2 52.659 -13.689 15.064 1.00 0.00 C ATOM 23 O THR A 2 52.464 -14.904 15.023 1.00 0.00 O ATOM 24 CB THR A 2 52.225 -12.862 17.379 1.00 0.00 C ATOM 25 OG1 THR A 2 51.810 -14.103 17.936 1.00 0.00 O ATOM 26 CG2 THR A 2 51.600 -11.711 18.168 1.00 0.00 C ATOM 0 H THR A 2 50.159 -14.097 16.203 1.00 0.00 H new ATOM 0 HA THR A 2 51.871 -11.761 15.560 1.00 0.00 H new ATOM 0 HB THR A 2 53.311 -12.785 17.430 1.00 0.00 H new ATOM 0 HG1 THR A 2 52.099 -14.155 18.871 1.00 0.00 H new ATOM 0 HG21 THR A 2 51.921 -11.766 19.208 1.00 0.00 H new ATOM 0 HG22 THR A 2 51.919 -10.761 17.740 1.00 0.00 H new ATOM 0 HG23 THR A 2 50.514 -11.784 18.119 1.00 0.00 H new ATOM 34 N VAL A 3 53.629 -13.087 14.385 1.00 0.00 N ATOM 35 CA VAL A 3 54.538 -13.847 13.535 1.00 0.00 C ATOM 36 C VAL A 3 55.975 -13.376 13.734 1.00 0.00 C ATOM 37 O VAL A 3 56.286 -12.201 13.539 1.00 0.00 O ATOM 38 CB VAL A 3 54.143 -13.679 12.066 1.00 0.00 C ATOM 39 CG1 VAL A 3 55.171 -14.381 11.178 1.00 0.00 C ATOM 40 CG2 VAL A 3 52.764 -14.298 11.837 1.00 0.00 C ATOM 0 H VAL A 3 53.806 -12.083 14.406 1.00 0.00 H new ATOM 0 HA VAL A 3 54.470 -14.899 13.811 1.00 0.00 H new ATOM 0 HB VAL A 3 54.112 -12.618 11.816 1.00 0.00 H new ATOM 0 HG11 VAL A 3 54.890 -14.262 10.132 1.00 0.00 H new ATOM 0 HG12 VAL A 3 56.155 -13.941 11.342 1.00 0.00 H new ATOM 0 HG13 VAL A 3 55.202 -15.442 11.426 1.00 0.00 H new ATOM 0 HG21 VAL A 3 52.481 -14.179 10.791 1.00 0.00 H new ATOM 0 HG22 VAL A 3 52.795 -15.359 12.086 1.00 0.00 H new ATOM 0 HG23 VAL A 3 52.031 -13.798 12.470 1.00 0.00 H new ATOM 50 N LYS A 4 56.847 -14.299 14.126 1.00 0.00 N ATOM 51 CA LYS A 4 58.249 -13.965 14.349 1.00 0.00 C ATOM 52 C LYS A 4 59.151 -14.800 13.445 1.00 0.00 C ATOM 53 O LYS A 4 58.730 -15.825 12.908 1.00 0.00 O ATOM 54 CB LYS A 4 58.620 -14.215 15.812 1.00 0.00 C ATOM 55 CG LYS A 4 57.746 -15.338 16.376 1.00 0.00 C ATOM 56 CD LYS A 4 58.136 -15.606 17.831 1.00 0.00 C ATOM 57 CE LYS A 4 57.285 -16.748 18.387 1.00 0.00 C ATOM 58 NZ LYS A 4 55.884 -16.276 18.577 1.00 0.00 N ATOM 0 H LYS A 4 56.610 -15.277 14.295 1.00 0.00 H new ATOM 0 HA LYS A 4 58.392 -12.911 14.112 1.00 0.00 H new ATOM 0 HB2 LYS A 4 59.673 -14.485 15.890 1.00 0.00 H new ATOM 0 HB3 LYS A 4 58.481 -13.304 16.394 1.00 0.00 H new ATOM 0 HG2 LYS A 4 56.694 -15.060 16.316 1.00 0.00 H new ATOM 0 HG3 LYS A 4 57.871 -16.243 15.782 1.00 0.00 H new ATOM 0 HD2 LYS A 4 59.193 -15.863 17.893 1.00 0.00 H new ATOM 0 HD3 LYS A 4 57.991 -14.706 18.429 1.00 0.00 H new ATOM 0 HE2 LYS A 4 57.305 -17.597 17.703 1.00 0.00 H new ATOM 0 HE3 LYS A 4 57.696 -17.093 19.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 55.365 -16.958 19.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 55.891 -15.348 19.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 55.417 -16.193 17.651 1.00 0.00 H new ATOM 72 N GLN A 5 60.392 -14.353 13.282 1.00 0.00 N ATOM 73 CA GLN A 5 61.346 -15.065 12.440 1.00 0.00 C ATOM 74 C GLN A 5 62.776 -14.718 12.842 1.00 0.00 C ATOM 75 O GLN A 5 63.138 -13.545 12.931 1.00 0.00 O ATOM 76 CB GLN A 5 61.124 -14.699 10.972 1.00 0.00 C ATOM 77 CG GLN A 5 59.955 -15.513 10.414 1.00 0.00 C ATOM 78 CD GLN A 5 59.749 -15.187 8.939 1.00 0.00 C ATOM 79 OE1 GLN A 5 59.232 -14.122 8.604 1.00 0.00 O ATOM 80 NE2 GLN A 5 60.126 -16.046 8.031 1.00 0.00 N ATOM 0 H GLN A 5 60.759 -13.507 13.718 1.00 0.00 H new ATOM 0 HA GLN A 5 61.191 -16.136 12.573 1.00 0.00 H new ATOM 0 HB2 GLN A 5 60.916 -13.633 10.879 1.00 0.00 H new ATOM 0 HB3 GLN A 5 62.028 -14.898 10.396 1.00 0.00 H new ATOM 0 HG2 GLN A 5 60.152 -16.578 10.535 1.00 0.00 H new ATOM 0 HG3 GLN A 5 59.047 -15.291 10.974 1.00 0.00 H new ATOM 0 HE21 GLN A 5 60.554 -16.928 8.310 1.00 0.00 H new ATOM 0 HE22 GLN A 5 59.992 -15.835 7.042 1.00 0.00 H new ATOM 89 N THR A 6 63.583 -15.745 13.086 1.00 0.00 N ATOM 90 CA THR A 6 64.972 -15.535 13.480 1.00 0.00 C ATOM 91 C THR A 6 65.838 -15.249 12.257 1.00 0.00 C ATOM 92 O THR A 6 65.828 -16.006 11.287 1.00 0.00 O ATOM 93 CB THR A 6 65.503 -16.772 14.207 1.00 0.00 C ATOM 94 OG1 THR A 6 64.486 -17.763 14.254 1.00 0.00 O ATOM 95 CG2 THR A 6 65.916 -16.393 15.629 1.00 0.00 C ATOM 0 H THR A 6 63.303 -16.723 13.019 1.00 0.00 H new ATOM 0 HA THR A 6 65.014 -14.676 14.150 1.00 0.00 H new ATOM 0 HB THR A 6 66.369 -17.164 13.674 1.00 0.00 H new ATOM 0 HG1 THR A 6 64.824 -18.557 14.718 1.00 0.00 H new ATOM 0 HG21 THR A 6 66.294 -17.275 16.145 1.00 0.00 H new ATOM 0 HG22 THR A 6 66.696 -15.633 15.591 1.00 0.00 H new ATOM 0 HG23 THR A 6 65.053 -16.000 16.166 1.00 0.00 H new ATOM 103 N VAL A 7 66.588 -14.153 12.313 1.00 0.00 N ATOM 104 CA VAL A 7 67.458 -13.777 11.204 1.00 0.00 C ATOM 105 C VAL A 7 68.855 -13.438 11.711 1.00 0.00 C ATOM 106 O VAL A 7 69.010 -12.699 12.684 1.00 0.00 O ATOM 107 CB VAL A 7 66.873 -12.571 10.468 1.00 0.00 C ATOM 108 CG1 VAL A 7 67.800 -12.177 9.316 1.00 0.00 C ATOM 109 CG2 VAL A 7 65.495 -12.935 9.911 1.00 0.00 C ATOM 0 H VAL A 7 66.611 -13.514 13.108 1.00 0.00 H new ATOM 0 HA VAL A 7 67.528 -14.622 10.518 1.00 0.00 H new ATOM 0 HB VAL A 7 66.777 -11.734 11.160 1.00 0.00 H new ATOM 0 HG11 VAL A 7 67.383 -11.317 8.791 1.00 0.00 H new ATOM 0 HG12 VAL A 7 68.783 -11.919 9.711 1.00 0.00 H new ATOM 0 HG13 VAL A 7 67.896 -13.013 8.624 1.00 0.00 H new ATOM 0 HG21 VAL A 7 65.076 -12.076 9.386 1.00 0.00 H new ATOM 0 HG22 VAL A 7 65.592 -13.772 9.219 1.00 0.00 H new ATOM 0 HG23 VAL A 7 64.834 -13.217 10.731 1.00 0.00 H new ATOM 119 N GLU A 8 69.869 -13.981 11.046 1.00 0.00 N ATOM 120 CA GLU A 8 71.250 -13.729 11.440 1.00 0.00 C ATOM 121 C GLU A 8 71.676 -12.323 11.031 1.00 0.00 C ATOM 122 O GLU A 8 71.359 -11.861 9.935 1.00 0.00 O ATOM 123 CB GLU A 8 72.176 -14.755 10.782 1.00 0.00 C ATOM 124 CG GLU A 8 71.744 -16.166 11.187 1.00 0.00 C ATOM 125 CD GLU A 8 72.655 -17.198 10.531 1.00 0.00 C ATOM 126 OE1 GLU A 8 73.564 -16.794 9.824 1.00 0.00 O ATOM 127 OE2 GLU A 8 72.431 -18.378 10.744 1.00 0.00 O ATOM 0 H GLU A 8 69.762 -14.594 10.238 1.00 0.00 H new ATOM 0 HA GLU A 8 71.320 -13.817 12.524 1.00 0.00 H new ATOM 0 HB2 GLU A 8 72.141 -14.650 9.698 1.00 0.00 H new ATOM 0 HB3 GLU A 8 73.208 -14.578 11.086 1.00 0.00 H new ATOM 0 HG2 GLU A 8 71.784 -16.270 12.271 1.00 0.00 H new ATOM 0 HG3 GLU A 8 70.710 -16.339 10.888 1.00 0.00 H new ATOM 134 N ILE A 9 72.395 -11.646 11.921 1.00 0.00 N ATOM 135 CA ILE A 9 72.859 -10.291 11.642 1.00 0.00 C ATOM 136 C ILE A 9 74.189 -10.323 10.897 1.00 0.00 C ATOM 137 O ILE A 9 75.179 -10.856 11.397 1.00 0.00 O ATOM 138 CB ILE A 9 73.024 -9.516 12.950 1.00 0.00 C ATOM 139 CG1 ILE A 9 71.652 -9.316 13.600 1.00 0.00 C ATOM 140 CG2 ILE A 9 73.652 -8.151 12.660 1.00 0.00 C ATOM 141 CD1 ILE A 9 70.655 -8.823 12.550 1.00 0.00 C ATOM 0 H ILE A 9 72.667 -12.009 12.834 1.00 0.00 H new ATOM 0 HA ILE A 9 72.117 -9.795 11.017 1.00 0.00 H new ATOM 0 HB ILE A 9 73.670 -10.077 13.625 1.00 0.00 H new ATOM 0 HG12 ILE A 9 71.304 -10.253 14.035 1.00 0.00 H new ATOM 0 HG13 ILE A 9 71.725 -8.595 14.414 1.00 0.00 H new ATOM 0 HG21 ILE A 9 73.769 -7.599 13.593 1.00 0.00 H new ATOM 0 HG22 ILE A 9 74.628 -8.291 12.196 1.00 0.00 H new ATOM 0 HG23 ILE A 9 73.006 -7.589 11.985 1.00 0.00 H new ATOM 0 HD11 ILE A 9 69.679 -8.681 13.014 1.00 0.00 H new ATOM 0 HD12 ILE A 9 71.001 -7.876 12.136 1.00 0.00 H new ATOM 0 HD13 ILE A 9 70.574 -9.560 11.751 1.00 0.00 H new ATOM 153 N THR A 10 74.203 -9.748 9.698 1.00 0.00 N ATOM 154 CA THR A 10 75.418 -9.716 8.892 1.00 0.00 C ATOM 155 C THR A 10 75.589 -8.350 8.238 1.00 0.00 C ATOM 156 O THR A 10 75.000 -8.074 7.192 1.00 0.00 O ATOM 157 CB THR A 10 75.357 -10.799 7.812 1.00 0.00 C ATOM 158 OG1 THR A 10 75.406 -12.080 8.425 1.00 0.00 O ATOM 159 CG2 THR A 10 76.545 -10.640 6.861 1.00 0.00 C ATOM 0 H THR A 10 73.394 -9.302 9.266 1.00 0.00 H new ATOM 0 HA THR A 10 76.271 -9.903 9.544 1.00 0.00 H new ATOM 0 HB THR A 10 74.429 -10.701 7.250 1.00 0.00 H new ATOM 0 HG1 THR A 10 75.365 -12.775 7.735 1.00 0.00 H new ATOM 0 HG21 THR A 10 76.501 -11.411 6.092 1.00 0.00 H new ATOM 0 HG22 THR A 10 76.506 -9.657 6.392 1.00 0.00 H new ATOM 0 HG23 THR A 10 77.475 -10.738 7.421 1.00 0.00 H new ATOM 167 N ASN A 11 76.398 -7.498 8.859 1.00 0.00 N ATOM 168 CA ASN A 11 76.638 -6.161 8.327 1.00 0.00 C ATOM 169 C ASN A 11 75.554 -5.196 8.796 1.00 0.00 C ATOM 170 O ASN A 11 75.263 -4.203 8.132 1.00 0.00 O ATOM 171 CB ASN A 11 76.659 -6.203 6.797 1.00 0.00 C ATOM 172 CG ASN A 11 76.957 -4.816 6.242 1.00 0.00 C ATOM 173 OD1 ASN A 11 77.805 -4.101 6.776 1.00 0.00 O ATOM 174 ND2 ASN A 11 76.307 -4.389 5.193 1.00 0.00 N ATOM 0 H ASN A 11 76.895 -7.707 9.725 1.00 0.00 H new ATOM 0 HA ASN A 11 77.603 -5.812 8.694 1.00 0.00 H new ATOM 0 HB2 ASN A 11 77.414 -6.911 6.455 1.00 0.00 H new ATOM 0 HB3 ASN A 11 75.698 -6.555 6.421 1.00 0.00 H new ATOM 0 HD21 ASN A 11 76.502 -3.462 4.815 1.00 0.00 H new ATOM 0 HD22 ASN A 11 75.605 -4.983 4.752 1.00 0.00 H new ATOM 181 N LYS A 12 74.960 -5.498 9.947 1.00 0.00 N ATOM 182 CA LYS A 12 73.908 -4.650 10.496 1.00 0.00 C ATOM 183 C LYS A 12 72.549 -5.051 9.933 1.00 0.00 C ATOM 184 O LYS A 12 72.384 -6.152 9.408 1.00 0.00 O ATOM 185 CB LYS A 12 74.190 -3.184 10.161 1.00 0.00 C ATOM 186 CG LYS A 12 75.577 -2.799 10.678 1.00 0.00 C ATOM 187 CD LYS A 12 75.752 -1.281 10.591 1.00 0.00 C ATOM 188 CE LYS A 12 77.226 -0.925 10.789 1.00 0.00 C ATOM 189 NZ LYS A 12 77.630 -1.241 12.188 1.00 0.00 N ATOM 0 H LYS A 12 75.187 -6.316 10.513 1.00 0.00 H new ATOM 0 HA LYS A 12 73.892 -4.778 11.578 1.00 0.00 H new ATOM 0 HB2 LYS A 12 74.136 -3.030 9.083 1.00 0.00 H new ATOM 0 HB3 LYS A 12 73.432 -2.545 10.613 1.00 0.00 H new ATOM 0 HG2 LYS A 12 75.697 -3.131 11.709 1.00 0.00 H new ATOM 0 HG3 LYS A 12 76.347 -3.299 10.090 1.00 0.00 H new ATOM 0 HD2 LYS A 12 75.407 -0.919 9.622 1.00 0.00 H new ATOM 0 HD3 LYS A 12 75.143 -0.790 11.350 1.00 0.00 H new ATOM 0 HE2 LYS A 12 77.844 -1.484 10.086 1.00 0.00 H new ATOM 0 HE3 LYS A 12 77.386 0.133 10.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 78.594 -0.891 12.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 76.973 -0.782 12.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 77.605 -2.271 12.332 1.00 0.00 H new ATOM 203 N LEU A 13 71.577 -4.151 10.046 1.00 0.00 N ATOM 204 CA LEU A 13 70.235 -4.424 9.543 1.00 0.00 C ATOM 205 C LEU A 13 70.170 -4.189 8.038 1.00 0.00 C ATOM 206 O LEU A 13 69.086 -4.072 7.465 1.00 0.00 O ATOM 207 CB LEU A 13 69.221 -3.521 10.247 1.00 0.00 C ATOM 208 CG LEU A 13 69.358 -3.682 11.762 1.00 0.00 C ATOM 209 CD1 LEU A 13 68.334 -2.788 12.466 1.00 0.00 C ATOM 210 CD2 LEU A 13 69.106 -5.142 12.144 1.00 0.00 C ATOM 0 H LEU A 13 71.692 -3.234 10.478 1.00 0.00 H new ATOM 0 HA LEU A 13 69.995 -5.468 9.747 1.00 0.00 H new ATOM 0 HB2 LEU A 13 69.387 -2.481 9.965 1.00 0.00 H new ATOM 0 HB3 LEU A 13 68.209 -3.779 9.933 1.00 0.00 H new ATOM 0 HG LEU A 13 70.364 -3.393 12.068 1.00 0.00 H new ATOM 0 HD11 LEU A 13 68.432 -2.903 13.545 1.00 0.00 H new ATOM 0 HD12 LEU A 13 68.512 -1.747 12.194 1.00 0.00 H new ATOM 0 HD13 LEU A 13 67.328 -3.076 12.160 1.00 0.00 H new ATOM 0 HD21 LEU A 13 69.203 -5.258 13.223 1.00 0.00 H new ATOM 0 HD22 LEU A 13 68.100 -5.430 11.837 1.00 0.00 H new ATOM 0 HD23 LEU A 13 69.834 -5.780 11.644 1.00 0.00 H new ATOM 222 N GLY A 14 71.335 -4.121 7.403 1.00 0.00 N ATOM 223 CA GLY A 14 71.399 -3.901 5.963 1.00 0.00 C ATOM 224 C GLY A 14 72.421 -2.821 5.622 1.00 0.00 C ATOM 225 O GLY A 14 73.594 -2.930 5.980 1.00 0.00 O ATOM 0 H GLY A 14 72.242 -4.214 7.859 1.00 0.00 H new ATOM 0 HA2 GLY A 14 71.665 -4.831 5.461 1.00 0.00 H new ATOM 0 HA3 GLY A 14 70.417 -3.608 5.592 1.00 0.00 H new ATOM 229 N MET A 15 71.968 -1.783 4.928 1.00 0.00 N ATOM 230 CA MET A 15 72.853 -0.689 4.544 1.00 0.00 C ATOM 231 C MET A 15 72.798 0.433 5.576 1.00 0.00 C ATOM 232 O MET A 15 71.746 1.030 5.803 1.00 0.00 O ATOM 233 CB MET A 15 72.447 -0.145 3.174 1.00 0.00 C ATOM 234 CG MET A 15 72.734 -1.197 2.101 1.00 0.00 C ATOM 235 SD MET A 15 72.226 -0.563 0.484 1.00 0.00 S ATOM 236 CE MET A 15 72.747 -1.994 -0.494 1.00 0.00 C ATOM 0 H MET A 15 71.001 -1.676 4.622 1.00 0.00 H new ATOM 0 HA MET A 15 73.872 -1.072 4.495 1.00 0.00 H new ATOM 0 HB2 MET A 15 71.388 0.112 3.172 1.00 0.00 H new ATOM 0 HB3 MET A 15 72.997 0.771 2.957 1.00 0.00 H new ATOM 0 HG2 MET A 15 73.796 -1.441 2.091 1.00 0.00 H new ATOM 0 HG3 MET A 15 72.198 -2.118 2.327 1.00 0.00 H new ATOM 0 HE1 MET A 15 72.524 -1.816 -1.546 1.00 0.00 H new ATOM 0 HE2 MET A 15 73.819 -2.148 -0.371 1.00 0.00 H new ATOM 0 HE3 MET A 15 72.212 -2.881 -0.154 1.00 0.00 H new ATOM 246 N HIS A 16 73.937 0.714 6.200 1.00 0.00 N ATOM 247 CA HIS A 16 74.007 1.767 7.206 1.00 0.00 C ATOM 248 C HIS A 16 72.942 1.555 8.276 1.00 0.00 C ATOM 249 O HIS A 16 73.227 1.039 9.357 1.00 0.00 O ATOM 250 CB HIS A 16 73.807 3.133 6.548 1.00 0.00 C ATOM 251 CG HIS A 16 73.584 4.174 7.610 1.00 0.00 C ATOM 252 ND1 HIS A 16 72.321 4.483 8.090 1.00 0.00 N ATOM 253 CD2 HIS A 16 74.454 4.986 8.295 1.00 0.00 C ATOM 254 CE1 HIS A 16 72.464 5.442 9.022 1.00 0.00 C ATOM 255 NE2 HIS A 16 73.744 5.787 9.186 1.00 0.00 N ATOM 0 H HIS A 16 74.819 0.231 6.028 1.00 0.00 H new ATOM 0 HA HIS A 16 74.990 1.731 7.675 1.00 0.00 H new ATOM 0 HB2 HIS A 16 74.680 3.391 5.949 1.00 0.00 H new ATOM 0 HB3 HIS A 16 72.954 3.101 5.871 1.00 0.00 H new ATOM 0 HD2 HIS A 16 75.526 5.001 8.163 1.00 0.00 H new ATOM 0 HE1 HIS A 16 71.644 5.880 9.571 1.00 0.00 H new ATOM 0 HE2 HIS A 16 74.120 6.486 9.826 1.00 0.00 H new ATOM 263 N ALA A 17 71.712 1.955 7.969 1.00 0.00 N ATOM 264 CA ALA A 17 70.612 1.804 8.913 1.00 0.00 C ATOM 265 C ALA A 17 69.281 2.130 8.240 1.00 0.00 C ATOM 266 O ALA A 17 68.232 2.130 8.886 1.00 0.00 O ATOM 267 CB ALA A 17 70.820 2.731 10.111 1.00 0.00 C ATOM 0 H ALA A 17 71.454 2.383 7.080 1.00 0.00 H new ATOM 0 HA ALA A 17 70.591 0.769 9.255 1.00 0.00 H new ATOM 0 HB1 ALA A 17 69.993 2.612 10.811 1.00 0.00 H new ATOM 0 HB2 ALA A 17 71.756 2.478 10.608 1.00 0.00 H new ATOM 0 HB3 ALA A 17 70.859 3.765 9.768 1.00 0.00 H new ATOM 273 N ARG A 18 69.332 2.406 6.942 1.00 0.00 N ATOM 274 CA ARG A 18 68.124 2.731 6.192 1.00 0.00 C ATOM 275 C ARG A 18 66.975 1.818 6.607 1.00 0.00 C ATOM 276 O ARG A 18 65.859 2.276 6.849 1.00 0.00 O ATOM 277 CB ARG A 18 68.383 2.582 4.693 1.00 0.00 C ATOM 278 CG ARG A 18 68.356 3.961 4.030 1.00 0.00 C ATOM 279 CD ARG A 18 68.867 3.848 2.593 1.00 0.00 C ATOM 280 NE ARG A 18 70.251 3.386 2.584 1.00 0.00 N ATOM 281 CZ ARG A 18 70.888 3.149 1.442 1.00 0.00 C ATOM 282 NH1 ARG A 18 72.127 2.736 1.461 1.00 0.00 N ATOM 283 NH2 ARG A 18 70.277 3.328 0.304 1.00 0.00 N ATOM 0 H ARG A 18 70.190 2.412 6.390 1.00 0.00 H new ATOM 0 HA ARG A 18 67.850 3.763 6.410 1.00 0.00 H new ATOM 0 HB2 ARG A 18 69.349 2.105 4.526 1.00 0.00 H new ATOM 0 HB3 ARG A 18 67.627 1.937 4.245 1.00 0.00 H new ATOM 0 HG2 ARG A 18 67.341 4.359 4.036 1.00 0.00 H new ATOM 0 HG3 ARG A 18 68.975 4.659 4.593 1.00 0.00 H new ATOM 0 HD2 ARG A 18 68.241 3.155 2.030 1.00 0.00 H new ATOM 0 HD3 ARG A 18 68.796 4.816 2.097 1.00 0.00 H new ATOM 0 HE ARG A 18 70.738 3.243 3.469 1.00 0.00 H new ATOM 0 HH11 ARG A 18 72.604 2.596 2.351 1.00 0.00 H new ATOM 0 HH12 ARG A 18 72.617 2.554 0.585 1.00 0.00 H new ATOM 0 HH21 ARG A 18 69.309 3.650 0.290 1.00 0.00 H new ATOM 0 HH22 ARG A 18 70.767 3.146 -0.572 1.00 0.00 H new ATOM 297 N PRO A 19 67.234 0.541 6.690 1.00 0.00 N ATOM 298 CA PRO A 19 66.208 -0.467 7.084 1.00 0.00 C ATOM 299 C PRO A 19 65.439 -0.044 8.333 1.00 0.00 C ATOM 300 O PRO A 19 64.212 -0.128 8.377 1.00 0.00 O ATOM 301 CB PRO A 19 67.025 -1.733 7.347 1.00 0.00 C ATOM 302 CG PRO A 19 68.269 -1.581 6.535 1.00 0.00 C ATOM 303 CD PRO A 19 68.539 -0.080 6.418 1.00 0.00 C ATOM 0 HA PRO A 19 65.447 -0.600 6.315 1.00 0.00 H new ATOM 0 HB2 PRO A 19 67.258 -1.836 8.407 1.00 0.00 H new ATOM 0 HB3 PRO A 19 66.472 -2.625 7.054 1.00 0.00 H new ATOM 0 HG2 PRO A 19 69.107 -2.089 7.013 1.00 0.00 H new ATOM 0 HG3 PRO A 19 68.145 -2.030 5.549 1.00 0.00 H new ATOM 0 HD2 PRO A 19 69.293 0.246 7.134 1.00 0.00 H new ATOM 0 HD3 PRO A 19 68.907 0.183 5.426 1.00 0.00 H new ATOM 311 N ALA A 20 66.170 0.411 9.346 1.00 0.00 N ATOM 312 CA ALA A 20 65.546 0.846 10.590 1.00 0.00 C ATOM 313 C ALA A 20 64.601 2.015 10.334 1.00 0.00 C ATOM 314 O ALA A 20 63.454 2.008 10.780 1.00 0.00 O ATOM 315 CB ALA A 20 66.621 1.266 11.595 1.00 0.00 C ATOM 0 H ALA A 20 67.187 0.488 9.330 1.00 0.00 H new ATOM 0 HA ALA A 20 64.973 0.013 10.998 1.00 0.00 H new ATOM 0 HB1 ALA A 20 66.146 1.590 12.521 1.00 0.00 H new ATOM 0 HB2 ALA A 20 67.278 0.421 11.800 1.00 0.00 H new ATOM 0 HB3 ALA A 20 67.205 2.087 11.181 1.00 0.00 H new ATOM 321 N MET A 21 65.091 3.018 9.613 1.00 0.00 N ATOM 322 CA MET A 21 64.281 4.189 9.302 1.00 0.00 C ATOM 323 C MET A 21 63.092 3.799 8.428 1.00 0.00 C ATOM 324 O MET A 21 61.974 4.265 8.642 1.00 0.00 O ATOM 325 CB MET A 21 65.129 5.234 8.575 1.00 0.00 C ATOM 326 CG MET A 21 66.035 5.946 9.581 1.00 0.00 C ATOM 327 SD MET A 21 66.970 7.247 8.737 1.00 0.00 S ATOM 328 CE MET A 21 67.898 7.830 10.178 1.00 0.00 C ATOM 0 H MET A 21 66.038 3.044 9.236 1.00 0.00 H new ATOM 0 HA MET A 21 63.910 4.610 10.237 1.00 0.00 H new ATOM 0 HB2 MET A 21 65.731 4.756 7.802 1.00 0.00 H new ATOM 0 HB3 MET A 21 64.484 5.957 8.075 1.00 0.00 H new ATOM 0 HG2 MET A 21 65.437 6.376 10.384 1.00 0.00 H new ATOM 0 HG3 MET A 21 66.718 5.232 10.040 1.00 0.00 H new ATOM 0 HE1 MET A 21 68.553 8.649 9.882 1.00 0.00 H new ATOM 0 HE2 MET A 21 67.203 8.179 10.942 1.00 0.00 H new ATOM 0 HE3 MET A 21 68.498 7.013 10.579 1.00 0.00 H new ATOM 338 N LYS A 22 63.344 2.942 7.445 1.00 0.00 N ATOM 339 CA LYS A 22 62.288 2.495 6.546 1.00 0.00 C ATOM 340 C LYS A 22 61.224 1.719 7.316 1.00 0.00 C ATOM 341 O LYS A 22 60.033 1.826 7.027 1.00 0.00 O ATOM 342 CB LYS A 22 62.876 1.607 5.447 1.00 0.00 C ATOM 343 CG LYS A 22 63.519 2.483 4.372 1.00 0.00 C ATOM 344 CD LYS A 22 63.984 1.606 3.208 1.00 0.00 C ATOM 345 CE LYS A 22 64.764 2.459 2.206 1.00 0.00 C ATOM 346 NZ LYS A 22 65.272 1.592 1.106 1.00 0.00 N ATOM 0 H LYS A 22 64.264 2.546 7.251 1.00 0.00 H new ATOM 0 HA LYS A 22 61.826 3.372 6.093 1.00 0.00 H new ATOM 0 HB2 LYS A 22 63.618 0.929 5.870 1.00 0.00 H new ATOM 0 HB3 LYS A 22 62.094 0.989 5.007 1.00 0.00 H new ATOM 0 HG2 LYS A 22 62.804 3.226 4.018 1.00 0.00 H new ATOM 0 HG3 LYS A 22 64.365 3.028 4.791 1.00 0.00 H new ATOM 0 HD2 LYS A 22 64.612 0.795 3.578 1.00 0.00 H new ATOM 0 HD3 LYS A 22 63.125 1.146 2.719 1.00 0.00 H new ATOM 0 HE2 LYS A 22 64.122 3.241 1.800 1.00 0.00 H new ATOM 0 HE3 LYS A 22 65.596 2.956 2.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 65.802 2.171 0.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 65.898 0.861 1.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 64.470 1.137 0.624 1.00 0.00 H new ATOM 360 N LEU A 23 61.664 0.938 8.298 1.00 0.00 N ATOM 361 CA LEU A 23 60.739 0.149 9.104 1.00 0.00 C ATOM 362 C LEU A 23 59.659 1.044 9.704 1.00 0.00 C ATOM 363 O LEU A 23 58.477 0.700 9.688 1.00 0.00 O ATOM 364 CB LEU A 23 61.499 -0.559 10.227 1.00 0.00 C ATOM 365 CG LEU A 23 61.568 -2.058 9.930 1.00 0.00 C ATOM 366 CD1 LEU A 23 62.502 -2.736 10.934 1.00 0.00 C ATOM 367 CD2 LEU A 23 60.168 -2.664 10.048 1.00 0.00 C ATOM 0 H LEU A 23 62.646 0.835 8.553 1.00 0.00 H new ATOM 0 HA LEU A 23 60.266 -0.594 8.462 1.00 0.00 H new ATOM 0 HB2 LEU A 23 62.505 -0.148 10.315 1.00 0.00 H new ATOM 0 HB3 LEU A 23 61.001 -0.389 11.181 1.00 0.00 H new ATOM 0 HG LEU A 23 61.949 -2.211 8.920 1.00 0.00 H new ATOM 0 HD11 LEU A 23 62.551 -3.804 10.722 1.00 0.00 H new ATOM 0 HD12 LEU A 23 63.499 -2.304 10.852 1.00 0.00 H new ATOM 0 HD13 LEU A 23 62.122 -2.584 11.944 1.00 0.00 H new ATOM 0 HD21 LEU A 23 60.215 -3.732 9.837 1.00 0.00 H new ATOM 0 HD22 LEU A 23 59.789 -2.510 11.058 1.00 0.00 H new ATOM 0 HD23 LEU A 23 59.501 -2.182 9.333 1.00 0.00 H new ATOM 379 N PHE A 24 60.072 2.192 10.228 1.00 0.00 N ATOM 380 CA PHE A 24 59.129 3.129 10.827 1.00 0.00 C ATOM 381 C PHE A 24 58.038 3.499 9.828 1.00 0.00 C ATOM 382 O PHE A 24 56.866 3.611 10.186 1.00 0.00 O ATOM 383 CB PHE A 24 59.862 4.394 11.276 1.00 0.00 C ATOM 384 CG PHE A 24 60.270 4.253 12.724 1.00 0.00 C ATOM 385 CD1 PHE A 24 61.234 3.308 13.090 1.00 0.00 C ATOM 386 CD2 PHE A 24 59.683 5.069 13.698 1.00 0.00 C ATOM 387 CE1 PHE A 24 61.612 3.177 14.432 1.00 0.00 C ATOM 388 CE2 PHE A 24 60.061 4.940 15.040 1.00 0.00 C ATOM 389 CZ PHE A 24 61.025 3.993 15.406 1.00 0.00 C ATOM 0 H PHE A 24 61.046 2.495 10.251 1.00 0.00 H new ATOM 0 HA PHE A 24 58.669 2.651 11.692 1.00 0.00 H new ATOM 0 HB2 PHE A 24 60.742 4.558 10.654 1.00 0.00 H new ATOM 0 HB3 PHE A 24 59.217 5.264 11.152 1.00 0.00 H new ATOM 0 HD1 PHE A 24 61.687 2.679 12.338 1.00 0.00 H new ATOM 0 HD2 PHE A 24 58.938 5.798 13.414 1.00 0.00 H new ATOM 0 HE1 PHE A 24 62.356 2.447 14.715 1.00 0.00 H new ATOM 0 HE2 PHE A 24 59.609 5.570 15.792 1.00 0.00 H new ATOM 0 HZ PHE A 24 61.316 3.892 16.441 1.00 0.00 H new ATOM 399 N GLU A 25 58.432 3.684 8.572 1.00 0.00 N ATOM 400 CA GLU A 25 57.479 4.038 7.527 1.00 0.00 C ATOM 401 C GLU A 25 56.599 2.842 7.181 1.00 0.00 C ATOM 402 O GLU A 25 55.414 2.995 6.885 1.00 0.00 O ATOM 403 CB GLU A 25 58.225 4.504 6.275 1.00 0.00 C ATOM 404 CG GLU A 25 58.930 5.832 6.566 1.00 0.00 C ATOM 405 CD GLU A 25 57.900 6.938 6.760 1.00 0.00 C ATOM 406 OE1 GLU A 25 56.760 6.732 6.379 1.00 0.00 O ATOM 407 OE2 GLU A 25 58.265 7.975 7.290 1.00 0.00 O ATOM 0 H GLU A 25 59.397 3.595 8.255 1.00 0.00 H new ATOM 0 HA GLU A 25 56.848 4.847 7.895 1.00 0.00 H new ATOM 0 HB2 GLU A 25 58.953 3.752 5.972 1.00 0.00 H new ATOM 0 HB3 GLU A 25 57.527 4.624 5.446 1.00 0.00 H new ATOM 0 HG2 GLU A 25 59.547 5.737 7.460 1.00 0.00 H new ATOM 0 HG3 GLU A 25 59.598 6.086 5.743 1.00 0.00 H new ATOM 414 N LEU A 26 57.188 1.651 7.221 1.00 0.00 N ATOM 415 CA LEU A 26 56.447 0.434 6.911 1.00 0.00 C ATOM 416 C LEU A 26 55.329 0.215 7.925 1.00 0.00 C ATOM 417 O LEU A 26 54.207 -0.135 7.562 1.00 0.00 O ATOM 418 CB LEU A 26 57.390 -0.770 6.920 1.00 0.00 C ATOM 419 CG LEU A 26 58.383 -0.651 5.763 1.00 0.00 C ATOM 420 CD1 LEU A 26 59.279 -1.890 5.727 1.00 0.00 C ATOM 421 CD2 LEU A 26 57.615 -0.540 4.443 1.00 0.00 C ATOM 0 H LEU A 26 58.168 1.503 7.463 1.00 0.00 H new ATOM 0 HA LEU A 26 56.007 0.542 5.919 1.00 0.00 H new ATOM 0 HB2 LEU A 26 57.925 -0.819 7.868 1.00 0.00 H new ATOM 0 HB3 LEU A 26 56.818 -1.693 6.829 1.00 0.00 H new ATOM 0 HG LEU A 26 58.999 0.237 5.904 1.00 0.00 H new ATOM 0 HD11 LEU A 26 59.986 -1.804 4.902 1.00 0.00 H new ATOM 0 HD12 LEU A 26 59.826 -1.971 6.667 1.00 0.00 H new ATOM 0 HD13 LEU A 26 58.665 -2.779 5.587 1.00 0.00 H new ATOM 0 HD21 LEU A 26 58.321 -0.455 3.617 1.00 0.00 H new ATOM 0 HD22 LEU A 26 57.000 -1.429 4.304 1.00 0.00 H new ATOM 0 HD23 LEU A 26 56.977 0.343 4.467 1.00 0.00 H new ATOM 433 N MET A 27 55.645 0.426 9.200 1.00 0.00 N ATOM 434 CA MET A 27 54.659 0.251 10.259 1.00 0.00 C ATOM 435 C MET A 27 53.447 1.141 10.013 1.00 0.00 C ATOM 436 O MET A 27 52.314 0.760 10.306 1.00 0.00 O ATOM 437 CB MET A 27 55.281 0.595 11.614 1.00 0.00 C ATOM 438 CG MET A 27 56.348 -0.444 11.966 1.00 0.00 C ATOM 439 SD MET A 27 57.425 0.212 13.263 1.00 0.00 S ATOM 440 CE MET A 27 56.226 0.136 14.616 1.00 0.00 C ATOM 0 H MET A 27 56.568 0.716 9.522 1.00 0.00 H new ATOM 0 HA MET A 27 54.337 -0.790 10.262 1.00 0.00 H new ATOM 0 HB2 MET A 27 55.725 1.590 11.580 1.00 0.00 H new ATOM 0 HB3 MET A 27 54.511 0.616 12.385 1.00 0.00 H new ATOM 0 HG2 MET A 27 55.875 -1.366 12.303 1.00 0.00 H new ATOM 0 HG3 MET A 27 56.935 -0.692 11.082 1.00 0.00 H new ATOM 0 HE1 MET A 27 56.754 0.081 15.568 1.00 0.00 H new ATOM 0 HE2 MET A 27 55.601 1.029 14.599 1.00 0.00 H new ATOM 0 HE3 MET A 27 55.599 -0.748 14.498 1.00 0.00 H new ATOM 450 N GLN A 28 53.693 2.331 9.473 1.00 0.00 N ATOM 451 CA GLN A 28 52.613 3.269 9.190 1.00 0.00 C ATOM 452 C GLN A 28 51.817 2.815 7.971 1.00 0.00 C ATOM 453 O GLN A 28 50.587 2.883 7.959 1.00 0.00 O ATOM 454 CB GLN A 28 53.187 4.665 8.938 1.00 0.00 C ATOM 455 CG GLN A 28 53.932 5.144 10.185 1.00 0.00 C ATOM 456 CD GLN A 28 54.616 6.477 9.903 1.00 0.00 C ATOM 457 OE1 GLN A 28 54.576 6.971 8.777 1.00 0.00 O ATOM 458 NE2 GLN A 28 55.245 7.094 10.867 1.00 0.00 N ATOM 0 H GLN A 28 54.624 2.666 9.224 1.00 0.00 H new ATOM 0 HA GLN A 28 51.948 3.301 10.053 1.00 0.00 H new ATOM 0 HB2 GLN A 28 53.863 4.643 8.084 1.00 0.00 H new ATOM 0 HB3 GLN A 28 52.385 5.360 8.691 1.00 0.00 H new ATOM 0 HG2 GLN A 28 53.235 5.252 11.016 1.00 0.00 H new ATOM 0 HG3 GLN A 28 54.672 4.402 10.484 1.00 0.00 H new ATOM 0 HE21 GLN A 28 55.277 6.683 11.800 1.00 0.00 H new ATOM 0 HE22 GLN A 28 55.704 7.987 10.687 1.00 0.00 H new ATOM 467 N GLY A 29 52.525 2.354 6.946 1.00 0.00 N ATOM 468 CA GLY A 29 51.874 1.890 5.727 1.00 0.00 C ATOM 469 C GLY A 29 51.178 0.553 5.956 1.00 0.00 C ATOM 470 O GLY A 29 50.115 0.290 5.393 1.00 0.00 O ATOM 0 H GLY A 29 53.543 2.292 6.934 1.00 0.00 H new ATOM 0 HA2 GLY A 29 51.147 2.631 5.394 1.00 0.00 H new ATOM 0 HA3 GLY A 29 52.613 1.788 4.932 1.00 0.00 H new ATOM 474 N PHE A 30 51.784 -0.288 6.788 1.00 0.00 N ATOM 475 CA PHE A 30 51.213 -1.596 7.086 1.00 0.00 C ATOM 476 C PHE A 30 50.477 -1.567 8.423 1.00 0.00 C ATOM 477 O PHE A 30 50.782 -0.751 9.292 1.00 0.00 O ATOM 478 CB PHE A 30 52.320 -2.651 7.136 1.00 0.00 C ATOM 479 CG PHE A 30 53.162 -2.554 5.886 1.00 0.00 C ATOM 480 CD1 PHE A 30 54.458 -3.085 5.872 1.00 0.00 C ATOM 481 CD2 PHE A 30 52.649 -1.934 4.741 1.00 0.00 C ATOM 482 CE1 PHE A 30 55.239 -2.996 4.715 1.00 0.00 C ATOM 483 CE2 PHE A 30 53.429 -1.845 3.583 1.00 0.00 C ATOM 484 CZ PHE A 30 54.725 -2.375 3.569 1.00 0.00 C ATOM 0 H PHE A 30 52.664 -0.089 7.264 1.00 0.00 H new ATOM 0 HA PHE A 30 50.504 -1.850 6.298 1.00 0.00 H new ATOM 0 HB2 PHE A 30 52.941 -2.501 8.019 1.00 0.00 H new ATOM 0 HB3 PHE A 30 51.885 -3.647 7.218 1.00 0.00 H new ATOM 0 HD1 PHE A 30 54.855 -3.564 6.755 1.00 0.00 H new ATOM 0 HD2 PHE A 30 51.650 -1.524 4.751 1.00 0.00 H new ATOM 0 HE1 PHE A 30 56.238 -3.406 4.705 1.00 0.00 H new ATOM 0 HE2 PHE A 30 53.031 -1.367 2.700 1.00 0.00 H new ATOM 0 HZ PHE A 30 55.328 -2.305 2.676 1.00 0.00 H new ATOM 494 N ASP A 31 49.506 -2.461 8.578 1.00 0.00 N ATOM 495 CA ASP A 31 48.731 -2.526 9.812 1.00 0.00 C ATOM 496 C ASP A 31 49.237 -3.656 10.704 1.00 0.00 C ATOM 497 O ASP A 31 48.801 -4.801 10.578 1.00 0.00 O ATOM 498 CB ASP A 31 47.252 -2.750 9.490 1.00 0.00 C ATOM 499 CG ASP A 31 46.619 -1.446 9.017 1.00 0.00 C ATOM 500 OD1 ASP A 31 47.297 -0.433 9.056 1.00 0.00 O ATOM 501 OD2 ASP A 31 45.465 -1.480 8.622 1.00 0.00 O ATOM 0 H ASP A 31 49.238 -3.146 7.871 1.00 0.00 H new ATOM 0 HA ASP A 31 48.847 -1.580 10.342 1.00 0.00 H new ATOM 0 HB2 ASP A 31 47.151 -3.514 8.719 1.00 0.00 H new ATOM 0 HB3 ASP A 31 46.730 -3.118 10.374 1.00 0.00 H new ATOM 506 N ALA A 32 50.158 -3.326 11.603 1.00 0.00 N ATOM 507 CA ALA A 32 50.716 -4.322 12.511 1.00 0.00 C ATOM 508 C ALA A 32 51.886 -3.737 13.294 1.00 0.00 C ATOM 509 O ALA A 32 52.572 -2.832 12.820 1.00 0.00 O ATOM 510 CB ALA A 32 51.187 -5.544 11.721 1.00 0.00 C ATOM 0 H ALA A 32 50.532 -2.384 11.722 1.00 0.00 H new ATOM 0 HA ALA A 32 49.938 -4.622 13.213 1.00 0.00 H new ATOM 0 HB1 ALA A 32 51.602 -6.283 12.407 1.00 0.00 H new ATOM 0 HB2 ALA A 32 50.343 -5.979 11.187 1.00 0.00 H new ATOM 0 HB3 ALA A 32 51.952 -5.242 11.006 1.00 0.00 H new ATOM 516 N GLU A 33 52.108 -4.260 14.496 1.00 0.00 N ATOM 517 CA GLU A 33 53.200 -3.782 15.337 1.00 0.00 C ATOM 518 C GLU A 33 54.429 -4.672 15.178 1.00 0.00 C ATOM 519 O GLU A 33 54.328 -5.898 15.207 1.00 0.00 O ATOM 520 CB GLU A 33 52.762 -3.771 16.802 1.00 0.00 C ATOM 521 CG GLU A 33 53.841 -3.097 17.653 1.00 0.00 C ATOM 522 CD GLU A 33 53.350 -2.937 19.087 1.00 0.00 C ATOM 523 OE1 GLU A 33 52.146 -2.907 19.280 1.00 0.00 O ATOM 524 OE2 GLU A 33 54.186 -2.846 19.971 1.00 0.00 O ATOM 0 H GLU A 33 51.551 -5.009 14.907 1.00 0.00 H new ATOM 0 HA GLU A 33 53.457 -2.769 15.026 1.00 0.00 H new ATOM 0 HB2 GLU A 33 51.817 -3.238 16.906 1.00 0.00 H new ATOM 0 HB3 GLU A 33 52.594 -4.790 17.150 1.00 0.00 H new ATOM 0 HG2 GLU A 33 54.753 -3.693 17.637 1.00 0.00 H new ATOM 0 HG3 GLU A 33 54.090 -2.122 17.234 1.00 0.00 H new ATOM 531 N VAL A 34 55.589 -4.045 15.009 1.00 0.00 N ATOM 532 CA VAL A 34 56.832 -4.790 14.848 1.00 0.00 C ATOM 533 C VAL A 34 57.703 -4.655 16.092 1.00 0.00 C ATOM 534 O VAL A 34 57.729 -3.604 16.733 1.00 0.00 O ATOM 535 CB VAL A 34 57.596 -4.272 13.628 1.00 0.00 C ATOM 536 CG1 VAL A 34 58.896 -5.062 13.467 1.00 0.00 C ATOM 537 CG2 VAL A 34 56.736 -4.446 12.376 1.00 0.00 C ATOM 0 H VAL A 34 55.694 -3.031 14.980 1.00 0.00 H new ATOM 0 HA VAL A 34 56.587 -5.842 14.703 1.00 0.00 H new ATOM 0 HB VAL A 34 57.827 -3.216 13.766 1.00 0.00 H new ATOM 0 HG11 VAL A 34 59.441 -4.693 12.598 1.00 0.00 H new ATOM 0 HG12 VAL A 34 59.510 -4.938 14.359 1.00 0.00 H new ATOM 0 HG13 VAL A 34 58.665 -6.118 13.329 1.00 0.00 H new ATOM 0 HG21 VAL A 34 57.280 -4.077 11.507 1.00 0.00 H new ATOM 0 HG22 VAL A 34 56.504 -5.502 12.238 1.00 0.00 H new ATOM 0 HG23 VAL A 34 55.810 -3.883 12.490 1.00 0.00 H new ATOM 547 N LEU A 35 58.415 -5.725 16.429 1.00 0.00 N ATOM 548 CA LEU A 35 59.285 -5.714 17.600 1.00 0.00 C ATOM 549 C LEU A 35 60.525 -6.567 17.356 1.00 0.00 C ATOM 550 O LEU A 35 60.426 -7.710 16.911 1.00 0.00 O ATOM 551 CB LEU A 35 58.528 -6.249 18.817 1.00 0.00 C ATOM 552 CG LEU A 35 59.517 -6.530 19.950 1.00 0.00 C ATOM 553 CD1 LEU A 35 58.911 -6.080 21.281 1.00 0.00 C ATOM 554 CD2 LEU A 35 59.812 -8.031 20.007 1.00 0.00 C ATOM 0 H LEU A 35 58.408 -6.605 15.913 1.00 0.00 H new ATOM 0 HA LEU A 35 59.597 -4.686 17.787 1.00 0.00 H new ATOM 0 HB2 LEU A 35 57.782 -5.524 19.142 1.00 0.00 H new ATOM 0 HB3 LEU A 35 57.992 -7.161 18.553 1.00 0.00 H new ATOM 0 HG LEU A 35 60.442 -5.983 19.769 1.00 0.00 H new ATOM 0 HD11 LEU A 35 59.616 -6.280 22.088 1.00 0.00 H new ATOM 0 HD12 LEU A 35 58.699 -5.012 21.241 1.00 0.00 H new ATOM 0 HD13 LEU A 35 57.986 -6.627 21.463 1.00 0.00 H new ATOM 0 HD21 LEU A 35 60.517 -8.233 20.814 1.00 0.00 H new ATOM 0 HD22 LEU A 35 58.886 -8.577 20.188 1.00 0.00 H new ATOM 0 HD23 LEU A 35 60.244 -8.353 19.059 1.00 0.00 H new ATOM 566 N LEU A 36 61.692 -6.002 17.648 1.00 0.00 N ATOM 567 CA LEU A 36 62.947 -6.720 17.456 1.00 0.00 C ATOM 568 C LEU A 36 63.635 -6.961 18.796 1.00 0.00 C ATOM 569 O LEU A 36 63.429 -6.216 19.753 1.00 0.00 O ATOM 570 CB LEU A 36 63.872 -5.918 16.540 1.00 0.00 C ATOM 571 CG LEU A 36 63.140 -5.585 15.240 1.00 0.00 C ATOM 572 CD1 LEU A 36 62.917 -4.074 15.153 1.00 0.00 C ATOM 573 CD2 LEU A 36 63.984 -6.044 14.049 1.00 0.00 C ATOM 0 H LEU A 36 61.795 -5.056 18.016 1.00 0.00 H new ATOM 0 HA LEU A 36 62.728 -7.683 16.995 1.00 0.00 H new ATOM 0 HB2 LEU A 36 64.187 -5.001 17.037 1.00 0.00 H new ATOM 0 HB3 LEU A 36 64.774 -6.491 16.325 1.00 0.00 H new ATOM 0 HG LEU A 36 62.177 -6.096 15.223 1.00 0.00 H new ATOM 0 HD11 LEU A 36 62.395 -3.836 14.226 1.00 0.00 H new ATOM 0 HD12 LEU A 36 62.317 -3.745 16.002 1.00 0.00 H new ATOM 0 HD13 LEU A 36 63.879 -3.563 15.169 1.00 0.00 H new ATOM 0 HD21 LEU A 36 63.463 -5.807 13.121 1.00 0.00 H new ATOM 0 HD22 LEU A 36 64.946 -5.532 14.066 1.00 0.00 H new ATOM 0 HD23 LEU A 36 64.145 -7.120 14.110 1.00 0.00 H new ATOM 585 N ARG A 37 64.455 -8.006 18.855 1.00 0.00 N ATOM 586 CA ARG A 37 65.168 -8.335 20.082 1.00 0.00 C ATOM 587 C ARG A 37 66.403 -9.177 19.775 1.00 0.00 C ATOM 588 O ARG A 37 66.396 -9.992 18.852 1.00 0.00 O ATOM 589 CB ARG A 37 64.247 -9.103 21.032 1.00 0.00 C ATOM 590 CG ARG A 37 63.881 -10.453 20.410 1.00 0.00 C ATOM 591 CD ARG A 37 63.199 -11.332 21.459 1.00 0.00 C ATOM 592 NE ARG A 37 62.024 -10.655 21.996 1.00 0.00 N ATOM 593 CZ ARG A 37 60.840 -10.761 21.403 1.00 0.00 C ATOM 594 NH1 ARG A 37 59.802 -10.146 21.903 1.00 0.00 N ATOM 595 NH2 ARG A 37 60.713 -11.479 20.321 1.00 0.00 N ATOM 0 H ARG A 37 64.641 -8.634 18.073 1.00 0.00 H new ATOM 0 HA ARG A 37 65.485 -7.406 20.556 1.00 0.00 H new ATOM 0 HB2 ARG A 37 64.742 -9.255 21.991 1.00 0.00 H new ATOM 0 HB3 ARG A 37 63.344 -8.524 21.227 1.00 0.00 H new ATOM 0 HG2 ARG A 37 63.217 -10.305 19.558 1.00 0.00 H new ATOM 0 HG3 ARG A 37 64.777 -10.947 20.034 1.00 0.00 H new ATOM 0 HD2 ARG A 37 62.908 -12.283 21.013 1.00 0.00 H new ATOM 0 HD3 ARG A 37 63.898 -11.558 22.265 1.00 0.00 H new ATOM 0 HE ARG A 37 62.113 -10.091 22.841 1.00 0.00 H new ATOM 0 HH11 ARG A 37 59.900 -9.584 22.749 1.00 0.00 H new ATOM 0 HH12 ARG A 37 58.893 -10.227 21.448 1.00 0.00 H new ATOM 0 HH21 ARG A 37 61.523 -11.960 19.930 1.00 0.00 H new ATOM 0 HH22 ARG A 37 59.803 -11.560 19.866 1.00 0.00 H new ATOM 609 N ASN A 38 67.460 -8.975 20.555 1.00 0.00 N ATOM 610 CA ASN A 38 68.697 -9.722 20.356 1.00 0.00 C ATOM 611 C ASN A 38 68.707 -10.981 21.218 1.00 0.00 C ATOM 612 O ASN A 38 67.999 -11.064 22.220 1.00 0.00 O ATOM 613 CB ASN A 38 69.899 -8.846 20.715 1.00 0.00 C ATOM 614 CG ASN A 38 69.909 -7.593 19.846 1.00 0.00 C ATOM 615 OD1 ASN A 38 69.411 -7.613 18.721 1.00 0.00 O ATOM 616 ND2 ASN A 38 70.448 -6.496 20.304 1.00 0.00 N ATOM 0 H ASN A 38 67.486 -8.306 21.325 1.00 0.00 H new ATOM 0 HA ASN A 38 68.760 -10.013 19.307 1.00 0.00 H new ATOM 0 HB2 ASN A 38 69.855 -8.568 21.768 1.00 0.00 H new ATOM 0 HB3 ASN A 38 70.823 -9.406 20.571 1.00 0.00 H new ATOM 0 HD21 ASN A 38 70.457 -5.653 19.729 1.00 0.00 H new ATOM 0 HD22 ASN A 38 70.860 -6.481 21.237 1.00 0.00 H new ATOM 623 N ASP A 39 69.514 -11.959 20.819 1.00 0.00 N ATOM 624 CA ASP A 39 69.608 -13.209 21.562 1.00 0.00 C ATOM 625 C ASP A 39 70.084 -12.951 22.988 1.00 0.00 C ATOM 626 O ASP A 39 69.826 -13.746 23.892 1.00 0.00 O ATOM 627 CB ASP A 39 70.580 -14.161 20.863 1.00 0.00 C ATOM 628 CG ASP A 39 71.956 -13.512 20.750 1.00 0.00 C ATOM 629 OD1 ASP A 39 72.084 -12.370 21.160 1.00 0.00 O ATOM 630 OD2 ASP A 39 72.859 -14.166 20.257 1.00 0.00 O ATOM 0 H ASP A 39 70.108 -11.910 19.991 1.00 0.00 H new ATOM 0 HA ASP A 39 68.618 -13.663 21.598 1.00 0.00 H new ATOM 0 HB2 ASP A 39 70.654 -15.094 21.422 1.00 0.00 H new ATOM 0 HB3 ASP A 39 70.205 -14.413 19.871 1.00 0.00 H new ATOM 635 N GLU A 40 70.778 -11.835 23.182 1.00 0.00 N ATOM 636 CA GLU A 40 71.285 -11.482 24.503 1.00 0.00 C ATOM 637 C GLU A 40 70.134 -11.165 25.452 1.00 0.00 C ATOM 638 O GLU A 40 70.293 -11.204 26.672 1.00 0.00 O ATOM 639 CB GLU A 40 72.213 -10.270 24.400 1.00 0.00 C ATOM 640 CG GLU A 40 73.467 -10.652 23.611 1.00 0.00 C ATOM 641 CD GLU A 40 74.316 -9.413 23.349 1.00 0.00 C ATOM 642 OE1 GLU A 40 73.799 -8.319 23.514 1.00 0.00 O ATOM 643 OE2 GLU A 40 75.469 -9.574 22.987 1.00 0.00 O ATOM 0 H GLU A 40 71.001 -11.164 22.447 1.00 0.00 H new ATOM 0 HA GLU A 40 71.841 -12.333 24.897 1.00 0.00 H new ATOM 0 HB2 GLU A 40 71.698 -9.445 23.907 1.00 0.00 H new ATOM 0 HB3 GLU A 40 72.489 -9.924 25.396 1.00 0.00 H new ATOM 0 HG2 GLU A 40 74.046 -11.389 24.167 1.00 0.00 H new ATOM 0 HG3 GLU A 40 73.185 -11.116 22.666 1.00 0.00 H new ATOM 650 N GLY A 41 68.974 -10.850 24.883 1.00 0.00 N ATOM 651 CA GLY A 41 67.803 -10.528 25.689 1.00 0.00 C ATOM 652 C GLY A 41 67.470 -9.043 25.597 1.00 0.00 C ATOM 653 O GLY A 41 66.593 -8.549 26.306 1.00 0.00 O ATOM 0 H GLY A 41 68.821 -10.811 23.875 1.00 0.00 H new ATOM 0 HA2 GLY A 41 66.951 -11.117 25.351 1.00 0.00 H new ATOM 0 HA3 GLY A 41 67.986 -10.800 26.729 1.00 0.00 H new ATOM 657 N THR A 42 68.174 -8.337 24.718 1.00 0.00 N ATOM 658 CA THR A 42 67.945 -6.907 24.542 1.00 0.00 C ATOM 659 C THR A 42 66.785 -6.666 23.581 1.00 0.00 C ATOM 660 O THR A 42 66.885 -6.956 22.388 1.00 0.00 O ATOM 661 CB THR A 42 69.209 -6.238 24.000 1.00 0.00 C ATOM 662 OG1 THR A 42 70.210 -6.232 25.009 1.00 0.00 O ATOM 663 CG2 THR A 42 68.891 -4.800 23.586 1.00 0.00 C ATOM 0 H THR A 42 68.902 -8.728 24.121 1.00 0.00 H new ATOM 0 HA THR A 42 67.695 -6.475 25.511 1.00 0.00 H new ATOM 0 HB THR A 42 69.570 -6.792 23.133 1.00 0.00 H new ATOM 0 HG1 THR A 42 71.021 -5.805 24.662 1.00 0.00 H new ATOM 0 HG21 THR A 42 69.793 -4.325 23.200 1.00 0.00 H new ATOM 0 HG22 THR A 42 68.124 -4.805 22.812 1.00 0.00 H new ATOM 0 HG23 THR A 42 68.530 -4.244 24.451 1.00 0.00 H new ATOM 671 N GLU A 43 65.688 -6.133 24.107 1.00 0.00 N ATOM 672 CA GLU A 43 64.515 -5.856 23.285 1.00 0.00 C ATOM 673 C GLU A 43 64.656 -4.506 22.589 1.00 0.00 C ATOM 674 O GLU A 43 64.555 -3.456 23.223 1.00 0.00 O ATOM 675 CB GLU A 43 63.256 -5.857 24.154 1.00 0.00 C ATOM 676 CG GLU A 43 62.987 -7.273 24.663 1.00 0.00 C ATOM 677 CD GLU A 43 61.748 -7.281 25.552 1.00 0.00 C ATOM 678 OE1 GLU A 43 61.251 -6.208 25.853 1.00 0.00 O ATOM 679 OE2 GLU A 43 61.313 -8.361 25.919 1.00 0.00 O ATOM 0 H GLU A 43 65.586 -5.885 25.091 1.00 0.00 H new ATOM 0 HA GLU A 43 64.433 -6.635 22.527 1.00 0.00 H new ATOM 0 HB2 GLU A 43 63.381 -5.175 24.995 1.00 0.00 H new ATOM 0 HB3 GLU A 43 62.403 -5.499 23.577 1.00 0.00 H new ATOM 0 HG2 GLU A 43 62.845 -7.950 23.821 1.00 0.00 H new ATOM 0 HG3 GLU A 43 63.849 -7.637 25.223 1.00 0.00 H new ATOM 686 N ALA A 44 64.889 -4.542 21.281 1.00 0.00 N ATOM 687 CA ALA A 44 65.041 -3.315 20.508 1.00 0.00 C ATOM 688 C ALA A 44 63.716 -2.917 19.868 1.00 0.00 C ATOM 689 O ALA A 44 63.536 -3.047 18.658 1.00 0.00 O ATOM 690 CB ALA A 44 66.097 -3.512 19.419 1.00 0.00 C ATOM 0 H ALA A 44 64.976 -5.401 20.737 1.00 0.00 H new ATOM 0 HA ALA A 44 65.358 -2.520 21.183 1.00 0.00 H new ATOM 0 HB1 ALA A 44 66.205 -2.591 18.846 1.00 0.00 H new ATOM 0 HB2 ALA A 44 67.052 -3.767 19.880 1.00 0.00 H new ATOM 0 HB3 ALA A 44 65.788 -4.319 18.754 1.00 0.00 H new ATOM 696 N GLU A 45 62.791 -2.429 20.688 1.00 0.00 N ATOM 697 CA GLU A 45 61.485 -2.013 20.191 1.00 0.00 C ATOM 698 C GLU A 45 61.617 -1.356 18.821 1.00 0.00 C ATOM 699 O GLU A 45 62.317 -0.355 18.667 1.00 0.00 O ATOM 700 CB GLU A 45 60.837 -1.029 21.164 1.00 0.00 C ATOM 701 CG GLU A 45 60.336 -1.783 22.384 1.00 0.00 C ATOM 702 CD GLU A 45 59.883 -0.802 23.459 1.00 0.00 C ATOM 703 OE1 GLU A 45 60.212 0.367 23.343 1.00 0.00 O ATOM 704 OE2 GLU A 45 59.213 -1.233 24.383 1.00 0.00 O ATOM 0 H GLU A 45 62.920 -2.312 21.693 1.00 0.00 H new ATOM 0 HA GLU A 45 60.858 -2.900 20.102 1.00 0.00 H new ATOM 0 HB2 GLU A 45 61.558 -0.268 21.463 1.00 0.00 H new ATOM 0 HB3 GLU A 45 60.010 -0.511 20.678 1.00 0.00 H new ATOM 0 HG2 GLU A 45 59.508 -2.434 22.104 1.00 0.00 H new ATOM 0 HG3 GLU A 45 61.127 -2.423 22.775 1.00 0.00 H new ATOM 711 N ALA A 46 60.940 -1.926 17.829 1.00 0.00 N ATOM 712 CA ALA A 46 60.990 -1.387 16.475 1.00 0.00 C ATOM 713 C ALA A 46 60.466 0.045 16.450 1.00 0.00 C ATOM 714 O ALA A 46 60.443 0.690 15.400 1.00 0.00 O ATOM 715 CB ALA A 46 60.152 -2.256 15.535 1.00 0.00 C ATOM 0 H ALA A 46 60.355 -2.755 17.936 1.00 0.00 H new ATOM 0 HA ALA A 46 62.028 -1.389 16.141 1.00 0.00 H new ATOM 0 HB1 ALA A 46 60.195 -1.846 14.526 1.00 0.00 H new ATOM 0 HB2 ALA A 46 60.546 -3.272 15.531 1.00 0.00 H new ATOM 0 HB3 ALA A 46 59.117 -2.269 15.878 1.00 0.00 H new ATOM 721 N ASN A 47 60.046 0.537 17.610 1.00 0.00 N ATOM 722 CA ASN A 47 59.524 1.896 17.709 1.00 0.00 C ATOM 723 C ASN A 47 60.335 2.710 18.711 1.00 0.00 C ATOM 724 O ASN A 47 59.774 3.406 19.558 1.00 0.00 O ATOM 725 CB ASN A 47 58.058 1.861 18.143 1.00 0.00 C ATOM 726 CG ASN A 47 57.473 3.269 18.119 1.00 0.00 C ATOM 727 OD1 ASN A 47 57.453 3.917 17.073 1.00 0.00 O ATOM 728 ND2 ASN A 47 56.994 3.786 19.219 1.00 0.00 N ATOM 0 H ASN A 47 60.056 0.020 18.489 1.00 0.00 H new ATOM 0 HA ASN A 47 59.601 2.368 16.729 1.00 0.00 H new ATOM 0 HB2 ASN A 47 57.489 1.211 17.479 1.00 0.00 H new ATOM 0 HB3 ASN A 47 57.977 1.442 19.146 1.00 0.00 H new ATOM 0 HD21 ASN A 47 56.603 4.728 19.212 1.00 0.00 H new ATOM 0 HD22 ASN A 47 57.011 3.248 20.085 1.00 0.00 H new ATOM 735 N SER A 48 61.657 2.617 18.610 1.00 0.00 N ATOM 736 CA SER A 48 62.536 3.350 19.514 1.00 0.00 C ATOM 737 C SER A 48 63.906 3.557 18.878 1.00 0.00 C ATOM 738 O SER A 48 64.547 2.603 18.439 1.00 0.00 O ATOM 739 CB SER A 48 62.690 2.583 20.827 1.00 0.00 C ATOM 740 OG SER A 48 63.955 2.887 21.402 1.00 0.00 O ATOM 0 H SER A 48 62.140 2.046 17.917 1.00 0.00 H new ATOM 0 HA SER A 48 62.091 4.325 19.714 1.00 0.00 H new ATOM 0 HB2 SER A 48 61.890 2.854 21.516 1.00 0.00 H new ATOM 0 HB3 SER A 48 62.607 1.511 20.647 1.00 0.00 H new ATOM 0 HG SER A 48 64.057 2.398 22.245 1.00 0.00 H new ATOM 746 N VAL A 49 64.349 4.809 18.833 1.00 0.00 N ATOM 747 CA VAL A 49 65.646 5.129 18.249 1.00 0.00 C ATOM 748 C VAL A 49 66.773 4.535 19.086 1.00 0.00 C ATOM 749 O VAL A 49 67.784 4.080 18.551 1.00 0.00 O ATOM 750 CB VAL A 49 65.819 6.646 18.161 1.00 0.00 C ATOM 751 CG1 VAL A 49 64.749 7.230 17.235 1.00 0.00 C ATOM 752 CG2 VAL A 49 65.671 7.257 19.556 1.00 0.00 C ATOM 0 H VAL A 49 63.833 5.613 19.191 1.00 0.00 H new ATOM 0 HA VAL A 49 65.688 4.700 17.248 1.00 0.00 H new ATOM 0 HB VAL A 49 66.808 6.876 17.765 1.00 0.00 H new ATOM 0 HG11 VAL A 49 64.873 8.311 17.173 1.00 0.00 H new ATOM 0 HG12 VAL A 49 64.851 6.795 16.241 1.00 0.00 H new ATOM 0 HG13 VAL A 49 63.760 7.000 17.631 1.00 0.00 H new ATOM 0 HG21 VAL A 49 65.794 8.338 19.495 1.00 0.00 H new ATOM 0 HG22 VAL A 49 64.682 7.026 19.951 1.00 0.00 H new ATOM 0 HG23 VAL A 49 66.432 6.842 20.217 1.00 0.00 H new ATOM 762 N ILE A 50 66.593 4.542 20.402 1.00 0.00 N ATOM 763 CA ILE A 50 67.603 4.001 21.305 1.00 0.00 C ATOM 764 C ILE A 50 67.825 2.517 21.032 1.00 0.00 C ATOM 765 O ILE A 50 68.943 2.015 21.149 1.00 0.00 O ATOM 766 CB ILE A 50 67.163 4.195 22.756 1.00 0.00 C ATOM 767 CG1 ILE A 50 67.174 5.686 23.097 1.00 0.00 C ATOM 768 CG2 ILE A 50 68.126 3.454 23.686 1.00 0.00 C ATOM 769 CD1 ILE A 50 66.392 5.921 24.390 1.00 0.00 C ATOM 0 H ILE A 50 65.764 4.913 20.865 1.00 0.00 H new ATOM 0 HA ILE A 50 68.539 4.534 21.135 1.00 0.00 H new ATOM 0 HB ILE A 50 66.156 3.799 22.885 1.00 0.00 H new ATOM 0 HG12 ILE A 50 68.200 6.036 23.212 1.00 0.00 H new ATOM 0 HG13 ILE A 50 66.731 6.259 22.283 1.00 0.00 H new ATOM 0 HG21 ILE A 50 67.812 3.593 24.720 1.00 0.00 H new ATOM 0 HG22 ILE A 50 68.120 2.391 23.444 1.00 0.00 H new ATOM 0 HG23 ILE A 50 69.133 3.850 23.557 1.00 0.00 H new ATOM 0 HD11 ILE A 50 66.400 6.984 24.632 1.00 0.00 H new ATOM 0 HD12 ILE A 50 65.363 5.587 24.259 1.00 0.00 H new ATOM 0 HD13 ILE A 50 66.855 5.360 25.202 1.00 0.00 H new ATOM 781 N ALA A 51 66.753 1.820 20.667 1.00 0.00 N ATOM 782 CA ALA A 51 66.844 0.394 20.380 1.00 0.00 C ATOM 783 C ALA A 51 67.684 0.151 19.129 1.00 0.00 C ATOM 784 O ALA A 51 68.473 -0.792 19.074 1.00 0.00 O ATOM 785 CB ALA A 51 65.445 -0.188 20.176 1.00 0.00 C ATOM 0 H ALA A 51 65.819 2.216 20.564 1.00 0.00 H new ATOM 0 HA ALA A 51 67.323 -0.097 21.227 1.00 0.00 H new ATOM 0 HB1 ALA A 51 65.522 -1.254 19.962 1.00 0.00 H new ATOM 0 HB2 ALA A 51 64.854 -0.041 21.080 1.00 0.00 H new ATOM 0 HB3 ALA A 51 64.960 0.316 19.340 1.00 0.00 H new ATOM 791 N LEU A 52 67.509 1.008 18.130 1.00 0.00 N ATOM 792 CA LEU A 52 68.256 0.878 16.884 1.00 0.00 C ATOM 793 C LEU A 52 69.756 0.960 17.148 1.00 0.00 C ATOM 794 O LEU A 52 70.543 0.222 16.555 1.00 0.00 O ATOM 795 CB LEU A 52 67.847 1.985 15.910 1.00 0.00 C ATOM 796 CG LEU A 52 68.600 1.809 14.591 1.00 0.00 C ATOM 797 CD1 LEU A 52 68.307 0.423 14.016 1.00 0.00 C ATOM 798 CD2 LEU A 52 68.142 2.879 13.598 1.00 0.00 C ATOM 0 H LEU A 52 66.861 1.795 18.157 1.00 0.00 H new ATOM 0 HA LEU A 52 68.027 -0.093 16.446 1.00 0.00 H new ATOM 0 HB2 LEU A 52 66.772 1.950 15.734 1.00 0.00 H new ATOM 0 HB3 LEU A 52 68.068 2.962 16.340 1.00 0.00 H new ATOM 0 HG LEU A 52 69.671 1.909 14.768 1.00 0.00 H new ATOM 0 HD11 LEU A 52 68.844 0.298 13.076 1.00 0.00 H new ATOM 0 HD12 LEU A 52 68.631 -0.340 14.723 1.00 0.00 H new ATOM 0 HD13 LEU A 52 67.236 0.322 13.838 1.00 0.00 H new ATOM 0 HD21 LEU A 52 68.678 2.755 12.657 1.00 0.00 H new ATOM 0 HD22 LEU A 52 67.071 2.777 13.422 1.00 0.00 H new ATOM 0 HD23 LEU A 52 68.350 3.868 14.007 1.00 0.00 H new ATOM 810 N LEU A 53 70.147 1.863 18.043 1.00 0.00 N ATOM 811 CA LEU A 53 71.556 2.033 18.378 1.00 0.00 C ATOM 812 C LEU A 53 72.106 0.771 19.035 1.00 0.00 C ATOM 813 O LEU A 53 73.251 0.386 18.801 1.00 0.00 O ATOM 814 CB LEU A 53 71.727 3.220 19.327 1.00 0.00 C ATOM 815 CG LEU A 53 72.331 4.400 18.564 1.00 0.00 C ATOM 816 CD1 LEU A 53 72.341 5.638 19.461 1.00 0.00 C ATOM 817 CD2 LEU A 53 73.765 4.059 18.152 1.00 0.00 C ATOM 0 H LEU A 53 69.513 2.484 18.546 1.00 0.00 H new ATOM 0 HA LEU A 53 72.109 2.221 17.458 1.00 0.00 H new ATOM 0 HB2 LEU A 53 70.763 3.502 19.751 1.00 0.00 H new ATOM 0 HB3 LEU A 53 72.373 2.943 20.160 1.00 0.00 H new ATOM 0 HG LEU A 53 71.733 4.601 17.675 1.00 0.00 H new ATOM 0 HD11 LEU A 53 72.772 6.478 18.916 1.00 0.00 H new ATOM 0 HD12 LEU A 53 71.320 5.882 19.756 1.00 0.00 H new ATOM 0 HD13 LEU A 53 72.938 5.438 20.351 1.00 0.00 H new ATOM 0 HD21 LEU A 53 74.197 4.899 17.608 1.00 0.00 H new ATOM 0 HD22 LEU A 53 74.361 3.858 19.042 1.00 0.00 H new ATOM 0 HD23 LEU A 53 73.760 3.177 17.512 1.00 0.00 H new ATOM 829 N MET A 54 71.282 0.132 19.860 1.00 0.00 N ATOM 830 CA MET A 54 71.698 -1.086 20.547 1.00 0.00 C ATOM 831 C MET A 54 71.918 -2.217 19.546 1.00 0.00 C ATOM 832 O MET A 54 72.840 -3.019 19.694 1.00 0.00 O ATOM 833 CB MET A 54 70.634 -1.502 21.563 1.00 0.00 C ATOM 834 CG MET A 54 70.528 -0.437 22.657 1.00 0.00 C ATOM 835 SD MET A 54 71.974 -0.542 23.742 1.00 0.00 S ATOM 836 CE MET A 54 71.529 0.820 24.847 1.00 0.00 C ATOM 0 H MET A 54 70.330 0.434 20.068 1.00 0.00 H new ATOM 0 HA MET A 54 72.636 -0.886 21.065 1.00 0.00 H new ATOM 0 HB2 MET A 54 69.671 -1.626 21.067 1.00 0.00 H new ATOM 0 HB3 MET A 54 70.893 -2.465 22.002 1.00 0.00 H new ATOM 0 HG2 MET A 54 70.467 0.555 22.209 1.00 0.00 H new ATOM 0 HG3 MET A 54 69.615 -0.583 23.234 1.00 0.00 H new ATOM 0 HE1 MET A 54 72.299 0.936 25.610 1.00 0.00 H new ATOM 0 HE2 MET A 54 71.446 1.743 24.272 1.00 0.00 H new ATOM 0 HE3 MET A 54 70.574 0.603 25.325 1.00 0.00 H new ATOM 846 N LEU A 55 71.066 -2.274 18.528 1.00 0.00 N ATOM 847 CA LEU A 55 71.177 -3.311 17.508 1.00 0.00 C ATOM 848 C LEU A 55 72.493 -3.174 16.748 1.00 0.00 C ATOM 849 O LEU A 55 72.993 -4.142 16.175 1.00 0.00 O ATOM 850 CB LEU A 55 70.006 -3.209 16.529 1.00 0.00 C ATOM 851 CG LEU A 55 68.700 -3.516 17.262 1.00 0.00 C ATOM 852 CD1 LEU A 55 67.518 -3.281 16.319 1.00 0.00 C ATOM 853 CD2 LEU A 55 68.704 -4.977 17.719 1.00 0.00 C ATOM 0 H LEU A 55 70.296 -1.620 18.387 1.00 0.00 H new ATOM 0 HA LEU A 55 71.154 -4.283 18.000 1.00 0.00 H new ATOM 0 HB2 LEU A 55 69.966 -2.209 16.096 1.00 0.00 H new ATOM 0 HB3 LEU A 55 70.146 -3.908 15.704 1.00 0.00 H new ATOM 0 HG LEU A 55 68.608 -2.863 18.130 1.00 0.00 H new ATOM 0 HD11 LEU A 55 66.587 -3.500 16.841 1.00 0.00 H new ATOM 0 HD12 LEU A 55 67.515 -2.241 15.992 1.00 0.00 H new ATOM 0 HD13 LEU A 55 67.609 -3.934 15.451 1.00 0.00 H new ATOM 0 HD21 LEU A 55 67.773 -5.197 18.242 1.00 0.00 H new ATOM 0 HD22 LEU A 55 68.796 -5.630 16.851 1.00 0.00 H new ATOM 0 HD23 LEU A 55 69.546 -5.146 18.390 1.00 0.00 H new ATOM 865 N ASP A 56 73.047 -1.967 16.748 1.00 0.00 N ATOM 866 CA ASP A 56 74.305 -1.716 16.053 1.00 0.00 C ATOM 867 C ASP A 56 75.387 -2.674 16.540 1.00 0.00 C ATOM 868 O ASP A 56 76.208 -3.148 15.755 1.00 0.00 O ATOM 869 CB ASP A 56 74.754 -0.272 16.292 1.00 0.00 C ATOM 870 CG ASP A 56 75.978 0.041 15.439 1.00 0.00 C ATOM 871 OD1 ASP A 56 75.862 -0.020 14.226 1.00 0.00 O ATOM 872 OD2 ASP A 56 77.014 0.337 16.012 1.00 0.00 O ATOM 0 H ASP A 56 72.650 -1.153 17.217 1.00 0.00 H new ATOM 0 HA ASP A 56 74.148 -1.876 14.986 1.00 0.00 H new ATOM 0 HB2 ASP A 56 73.944 0.415 16.046 1.00 0.00 H new ATOM 0 HB3 ASP A 56 74.988 -0.125 17.346 1.00 0.00 H new ATOM 877 N SER A 57 75.381 -2.954 17.839 1.00 0.00 N ATOM 878 CA SER A 57 76.367 -3.858 18.420 1.00 0.00 C ATOM 879 C SER A 57 76.001 -5.310 18.129 1.00 0.00 C ATOM 880 O SER A 57 76.702 -6.233 18.546 1.00 0.00 O ATOM 881 CB SER A 57 76.447 -3.643 19.931 1.00 0.00 C ATOM 882 OG SER A 57 76.952 -2.341 20.194 1.00 0.00 O ATOM 0 H SER A 57 74.710 -2.571 18.505 1.00 0.00 H new ATOM 0 HA SER A 57 77.337 -3.643 17.971 1.00 0.00 H new ATOM 0 HB2 SER A 57 75.460 -3.760 20.379 1.00 0.00 H new ATOM 0 HB3 SER A 57 77.094 -4.395 20.383 1.00 0.00 H new ATOM 0 HG SER A 57 77.003 -2.199 21.162 1.00 0.00 H new ATOM 888 N ALA A 58 74.898 -5.505 17.413 1.00 0.00 N ATOM 889 CA ALA A 58 74.448 -6.850 17.072 1.00 0.00 C ATOM 890 C ALA A 58 75.091 -7.316 15.770 1.00 0.00 C ATOM 891 O ALA A 58 74.498 -8.088 15.016 1.00 0.00 O ATOM 892 CB ALA A 58 72.925 -6.869 16.928 1.00 0.00 C ATOM 0 H ALA A 58 74.303 -4.755 17.060 1.00 0.00 H new ATOM 0 HA ALA A 58 74.746 -7.527 17.873 1.00 0.00 H new ATOM 0 HB1 ALA A 58 72.596 -7.877 16.673 1.00 0.00 H new ATOM 0 HB2 ALA A 58 72.467 -6.565 17.869 1.00 0.00 H new ATOM 0 HB3 ALA A 58 72.626 -6.179 16.139 1.00 0.00 H new ATOM 898 N LYS A 59 76.306 -6.844 15.514 1.00 0.00 N ATOM 899 CA LYS A 59 77.020 -7.220 14.299 1.00 0.00 C ATOM 900 C LYS A 59 77.558 -8.643 14.413 1.00 0.00 C ATOM 901 O LYS A 59 78.634 -8.867 14.968 1.00 0.00 O ATOM 902 CB LYS A 59 78.178 -6.252 14.052 1.00 0.00 C ATOM 903 CG LYS A 59 78.829 -5.883 15.387 1.00 0.00 C ATOM 904 CD LYS A 59 80.154 -5.164 15.129 1.00 0.00 C ATOM 905 CE LYS A 59 80.846 -4.873 16.461 1.00 0.00 C ATOM 906 NZ LYS A 59 80.002 -3.944 17.265 1.00 0.00 N ATOM 0 H LYS A 59 76.814 -6.205 16.126 1.00 0.00 H new ATOM 0 HA LYS A 59 76.324 -7.173 13.462 1.00 0.00 H new ATOM 0 HB2 LYS A 59 78.914 -6.710 13.391 1.00 0.00 H new ATOM 0 HB3 LYS A 59 77.815 -5.354 13.552 1.00 0.00 H new ATOM 0 HG2 LYS A 59 78.162 -5.242 15.964 1.00 0.00 H new ATOM 0 HG3 LYS A 59 79.000 -6.781 15.980 1.00 0.00 H new ATOM 0 HD2 LYS A 59 80.797 -5.780 14.500 1.00 0.00 H new ATOM 0 HD3 LYS A 59 79.976 -4.234 14.589 1.00 0.00 H new ATOM 0 HE2 LYS A 59 81.008 -5.801 17.009 1.00 0.00 H new ATOM 0 HE3 LYS A 59 81.827 -4.431 16.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 80.610 -3.371 17.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 79.470 -3.318 16.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 79.336 -4.494 17.845 1.00 0.00 H new ATOM 920 N GLY A 60 76.804 -9.600 13.884 1.00 0.00 N ATOM 921 CA GLY A 60 77.215 -10.999 13.932 1.00 0.00 C ATOM 922 C GLY A 60 76.410 -11.768 14.973 1.00 0.00 C ATOM 923 O GLY A 60 76.682 -12.938 15.244 1.00 0.00 O ATOM 0 H GLY A 60 75.911 -9.435 13.420 1.00 0.00 H new ATOM 0 HA2 GLY A 60 77.079 -11.456 12.952 1.00 0.00 H new ATOM 0 HA3 GLY A 60 78.277 -11.062 14.169 1.00 0.00 H new ATOM 927 N ARG A 61 75.416 -11.104 15.554 1.00 0.00 N ATOM 928 CA ARG A 61 74.576 -11.736 16.565 1.00 0.00 C ATOM 929 C ARG A 61 73.216 -12.103 15.979 1.00 0.00 C ATOM 930 O ARG A 61 72.813 -11.573 14.943 1.00 0.00 O ATOM 931 CB ARG A 61 74.383 -10.789 17.751 1.00 0.00 C ATOM 932 CG ARG A 61 75.743 -10.460 18.369 1.00 0.00 C ATOM 933 CD ARG A 61 75.538 -9.817 19.741 1.00 0.00 C ATOM 934 NE ARG A 61 75.018 -10.797 20.686 1.00 0.00 N ATOM 935 CZ ARG A 61 75.821 -11.683 21.268 1.00 0.00 C ATOM 936 NH1 ARG A 61 75.332 -12.551 22.112 1.00 0.00 N ATOM 937 NH2 ARG A 61 77.098 -11.684 20.997 1.00 0.00 N ATOM 0 H ARG A 61 75.174 -10.136 15.344 1.00 0.00 H new ATOM 0 HA ARG A 61 75.071 -12.646 16.904 1.00 0.00 H new ATOM 0 HB2 ARG A 61 73.890 -9.874 17.423 1.00 0.00 H new ATOM 0 HB3 ARG A 61 73.735 -11.250 18.496 1.00 0.00 H new ATOM 0 HG2 ARG A 61 76.339 -11.367 18.466 1.00 0.00 H new ATOM 0 HG3 ARG A 61 76.296 -9.783 17.718 1.00 0.00 H new ATOM 0 HD2 ARG A 61 76.483 -9.415 20.107 1.00 0.00 H new ATOM 0 HD3 ARG A 61 74.846 -8.979 19.658 1.00 0.00 H new ATOM 0 HE ARG A 61 74.022 -10.803 20.905 1.00 0.00 H new ATOM 0 HH11 ARG A 61 74.334 -12.549 22.325 1.00 0.00 H new ATOM 0 HH12 ARG A 61 75.948 -13.231 22.559 1.00 0.00 H new ATOM 0 HH21 ARG A 61 77.480 -11.005 20.339 1.00 0.00 H new ATOM 0 HH22 ARG A 61 77.714 -12.364 21.444 1.00 0.00 H new ATOM 951 N GLN A 62 72.514 -13.012 16.649 1.00 0.00 N ATOM 952 CA GLN A 62 71.200 -13.441 16.185 1.00 0.00 C ATOM 953 C GLN A 62 70.101 -12.642 16.876 1.00 0.00 C ATOM 954 O GLN A 62 70.217 -12.298 18.053 1.00 0.00 O ATOM 955 CB GLN A 62 71.007 -14.932 16.470 1.00 0.00 C ATOM 956 CG GLN A 62 71.932 -15.749 15.567 1.00 0.00 C ATOM 957 CD GLN A 62 71.873 -17.222 15.956 1.00 0.00 C ATOM 958 OE1 GLN A 62 71.650 -17.549 17.122 1.00 0.00 O ATOM 959 NE2 GLN A 62 72.059 -18.137 15.044 1.00 0.00 N ATOM 0 H GLN A 62 72.830 -13.462 17.508 1.00 0.00 H new ATOM 0 HA GLN A 62 71.139 -13.266 15.111 1.00 0.00 H new ATOM 0 HB2 GLN A 62 71.224 -15.144 17.517 1.00 0.00 H new ATOM 0 HB3 GLN A 62 69.969 -15.215 16.296 1.00 0.00 H new ATOM 0 HG2 GLN A 62 71.637 -15.628 14.525 1.00 0.00 H new ATOM 0 HG3 GLN A 62 72.955 -15.382 15.653 1.00 0.00 H new ATOM 0 HE21 GLN A 62 72.244 -17.865 14.079 1.00 0.00 H new ATOM 0 HE22 GLN A 62 72.020 -19.124 15.297 1.00 0.00 H new ATOM 968 N ILE A 63 69.035 -12.350 16.139 1.00 0.00 N ATOM 969 CA ILE A 63 67.920 -11.589 16.693 1.00 0.00 C ATOM 970 C ILE A 63 66.593 -12.269 16.366 1.00 0.00 C ATOM 971 O ILE A 63 66.530 -13.149 15.507 1.00 0.00 O ATOM 972 CB ILE A 63 67.921 -10.170 16.125 1.00 0.00 C ATOM 973 CG1 ILE A 63 67.699 -10.228 14.612 1.00 0.00 C ATOM 974 CG2 ILE A 63 69.266 -9.504 16.417 1.00 0.00 C ATOM 975 CD1 ILE A 63 67.463 -8.814 14.076 1.00 0.00 C ATOM 0 H ILE A 63 68.919 -12.626 15.164 1.00 0.00 H new ATOM 0 HA ILE A 63 68.037 -11.546 17.776 1.00 0.00 H new ATOM 0 HB ILE A 63 67.122 -9.592 16.589 1.00 0.00 H new ATOM 0 HG12 ILE A 63 68.566 -10.674 14.123 1.00 0.00 H new ATOM 0 HG13 ILE A 63 66.843 -10.863 14.383 1.00 0.00 H new ATOM 0 HG21 ILE A 63 69.267 -8.492 16.012 1.00 0.00 H new ATOM 0 HG22 ILE A 63 69.426 -9.464 17.494 1.00 0.00 H new ATOM 0 HG23 ILE A 63 70.066 -10.081 15.953 1.00 0.00 H new ATOM 0 HD11 ILE A 63 67.305 -8.855 12.998 1.00 0.00 H new ATOM 0 HD12 ILE A 63 66.583 -8.385 14.556 1.00 0.00 H new ATOM 0 HD13 ILE A 63 68.333 -8.193 14.292 1.00 0.00 H new ATOM 987 N GLU A 64 65.537 -11.856 17.059 1.00 0.00 N ATOM 988 CA GLU A 64 64.216 -12.432 16.834 1.00 0.00 C ATOM 989 C GLU A 64 63.201 -11.338 16.519 1.00 0.00 C ATOM 990 O GLU A 64 62.734 -10.635 17.414 1.00 0.00 O ATOM 991 CB GLU A 64 63.767 -13.206 18.075 1.00 0.00 C ATOM 992 CG GLU A 64 64.901 -14.118 18.547 1.00 0.00 C ATOM 993 CD GLU A 64 65.689 -13.436 19.661 1.00 0.00 C ATOM 994 OE1 GLU A 64 66.435 -12.519 19.356 1.00 0.00 O ATOM 995 OE2 GLU A 64 65.533 -13.839 20.801 1.00 0.00 O ATOM 0 H GLU A 64 65.569 -11.131 17.775 1.00 0.00 H new ATOM 0 HA GLU A 64 64.276 -13.111 15.984 1.00 0.00 H new ATOM 0 HB2 GLU A 64 63.490 -12.512 18.869 1.00 0.00 H new ATOM 0 HB3 GLU A 64 62.881 -13.798 17.846 1.00 0.00 H new ATOM 0 HG2 GLU A 64 64.493 -15.064 18.905 1.00 0.00 H new ATOM 0 HG3 GLU A 64 65.562 -14.351 17.713 1.00 0.00 H new ATOM 1002 N VAL A 65 62.864 -11.202 15.240 1.00 0.00 N ATOM 1003 CA VAL A 65 61.902 -10.190 14.818 1.00 0.00 C ATOM 1004 C VAL A 65 60.476 -10.697 15.003 1.00 0.00 C ATOM 1005 O VAL A 65 60.147 -11.816 14.606 1.00 0.00 O ATOM 1006 CB VAL A 65 62.131 -9.833 13.348 1.00 0.00 C ATOM 1007 CG1 VAL A 65 61.368 -8.551 13.009 1.00 0.00 C ATOM 1008 CG2 VAL A 65 63.627 -9.613 13.106 1.00 0.00 C ATOM 0 H VAL A 65 63.239 -11.775 14.484 1.00 0.00 H new ATOM 0 HA VAL A 65 62.043 -9.302 15.434 1.00 0.00 H new ATOM 0 HB VAL A 65 61.774 -10.646 12.716 1.00 0.00 H new ATOM 0 HG11 VAL A 65 61.531 -8.297 11.962 1.00 0.00 H new ATOM 0 HG12 VAL A 65 60.303 -8.704 13.184 1.00 0.00 H new ATOM 0 HG13 VAL A 65 61.725 -7.737 13.640 1.00 0.00 H new ATOM 0 HG21 VAL A 65 63.793 -9.359 12.059 1.00 0.00 H new ATOM 0 HG22 VAL A 65 63.982 -8.799 13.738 1.00 0.00 H new ATOM 0 HG23 VAL A 65 64.173 -10.525 13.348 1.00 0.00 H new ATOM 1018 N GLU A 66 59.633 -9.869 15.610 1.00 0.00 N ATOM 1019 CA GLU A 66 58.242 -10.245 15.842 1.00 0.00 C ATOM 1020 C GLU A 66 57.300 -9.169 15.311 1.00 0.00 C ATOM 1021 O GLU A 66 57.562 -7.975 15.453 1.00 0.00 O ATOM 1022 CB GLU A 66 58.000 -10.443 17.340 1.00 0.00 C ATOM 1023 CG GLU A 66 56.518 -10.736 17.583 1.00 0.00 C ATOM 1024 CD GLU A 66 56.306 -11.191 19.023 1.00 0.00 C ATOM 1025 OE1 GLU A 66 57.277 -11.229 19.761 1.00 0.00 O ATOM 1026 OE2 GLU A 66 55.176 -11.495 19.367 1.00 0.00 O ATOM 0 H GLU A 66 59.885 -8.940 15.948 1.00 0.00 H new ATOM 0 HA GLU A 66 58.043 -11.178 15.314 1.00 0.00 H new ATOM 0 HB2 GLU A 66 58.610 -11.266 17.712 1.00 0.00 H new ATOM 0 HB3 GLU A 66 58.300 -9.550 17.889 1.00 0.00 H new ATOM 0 HG2 GLU A 66 55.925 -9.843 17.384 1.00 0.00 H new ATOM 0 HG3 GLU A 66 56.174 -11.508 16.895 1.00 0.00 H new ATOM 1033 N ALA A 67 56.203 -9.603 14.698 1.00 0.00 N ATOM 1034 CA ALA A 67 55.227 -8.668 14.148 1.00 0.00 C ATOM 1035 C ALA A 67 53.807 -9.148 14.429 1.00 0.00 C ATOM 1036 O ALA A 67 53.520 -10.343 14.352 1.00 0.00 O ATOM 1037 CB ALA A 67 55.432 -8.528 12.639 1.00 0.00 C ATOM 0 H ALA A 67 55.969 -10.587 14.570 1.00 0.00 H new ATOM 0 HA ALA A 67 55.371 -7.699 14.625 1.00 0.00 H new ATOM 0 HB1 ALA A 67 54.700 -7.829 12.236 1.00 0.00 H new ATOM 0 HB2 ALA A 67 56.437 -8.155 12.441 1.00 0.00 H new ATOM 0 HB3 ALA A 67 55.305 -9.500 12.163 1.00 0.00 H new ATOM 1043 N THR A 68 52.925 -8.210 14.755 1.00 0.00 N ATOM 1044 CA THR A 68 51.537 -8.550 15.045 1.00 0.00 C ATOM 1045 C THR A 68 50.589 -7.665 14.242 1.00 0.00 C ATOM 1046 O THR A 68 50.829 -6.469 14.080 1.00 0.00 O ATOM 1047 CB THR A 68 51.257 -8.374 16.539 1.00 0.00 C ATOM 1048 OG1 THR A 68 52.189 -9.144 17.287 1.00 0.00 O ATOM 1049 CG2 THR A 68 49.835 -8.844 16.853 1.00 0.00 C ATOM 0 H THR A 68 53.144 -7.216 14.825 1.00 0.00 H new ATOM 0 HA THR A 68 51.372 -9.590 14.764 1.00 0.00 H new ATOM 0 HB THR A 68 51.356 -7.322 16.806 1.00 0.00 H new ATOM 0 HG1 THR A 68 52.234 -8.802 18.204 1.00 0.00 H new ATOM 0 HG21 THR A 68 49.637 -8.718 17.917 1.00 0.00 H new ATOM 0 HG22 THR A 68 49.121 -8.253 16.279 1.00 0.00 H new ATOM 0 HG23 THR A 68 49.732 -9.896 16.587 1.00 0.00 H new ATOM 1057 N GLY A 69 49.513 -8.262 13.739 1.00 0.00 N ATOM 1058 CA GLY A 69 48.536 -7.519 12.953 1.00 0.00 C ATOM 1059 C GLY A 69 48.180 -8.269 11.675 1.00 0.00 C ATOM 1060 O GLY A 69 48.682 -9.364 11.424 1.00 0.00 O ATOM 0 H GLY A 69 49.297 -9.251 13.861 1.00 0.00 H new ATOM 0 HA2 GLY A 69 47.636 -7.355 13.546 1.00 0.00 H new ATOM 0 HA3 GLY A 69 48.936 -6.536 12.703 1.00 0.00 H new ATOM 1064 N PRO A 70 47.327 -7.697 10.870 1.00 0.00 N ATOM 1065 CA PRO A 70 46.887 -8.315 9.587 1.00 0.00 C ATOM 1066 C PRO A 70 47.984 -8.275 8.524 1.00 0.00 C ATOM 1067 O PRO A 70 48.012 -9.105 7.616 1.00 0.00 O ATOM 1068 CB PRO A 70 45.687 -7.465 9.165 1.00 0.00 C ATOM 1069 CG PRO A 70 45.890 -6.138 9.820 1.00 0.00 C ATOM 1070 CD PRO A 70 46.686 -6.393 11.100 1.00 0.00 C ATOM 0 HA PRO A 70 46.645 -9.371 9.704 1.00 0.00 H new ATOM 0 HB2 PRO A 70 45.639 -7.365 8.081 1.00 0.00 H new ATOM 0 HB3 PRO A 70 44.750 -7.922 9.485 1.00 0.00 H new ATOM 0 HG2 PRO A 70 46.429 -5.459 9.159 1.00 0.00 H new ATOM 0 HG3 PRO A 70 44.933 -5.669 10.047 1.00 0.00 H new ATOM 0 HD2 PRO A 70 47.425 -5.610 11.272 1.00 0.00 H new ATOM 0 HD3 PRO A 70 46.037 -6.417 11.975 1.00 0.00 H new ATOM 1078 N GLN A 71 48.884 -7.305 8.648 1.00 0.00 N ATOM 1079 CA GLN A 71 49.978 -7.166 7.693 1.00 0.00 C ATOM 1080 C GLN A 71 51.315 -7.468 8.364 1.00 0.00 C ATOM 1081 O GLN A 71 52.375 -7.141 7.830 1.00 0.00 O ATOM 1082 CB GLN A 71 49.999 -5.745 7.125 1.00 0.00 C ATOM 1083 CG GLN A 71 48.726 -5.502 6.311 1.00 0.00 C ATOM 1084 CD GLN A 71 48.755 -4.104 5.705 1.00 0.00 C ATOM 1085 OE1 GLN A 71 49.805 -3.641 5.259 1.00 0.00 O ATOM 1086 NE2 GLN A 71 47.657 -3.399 5.660 1.00 0.00 N ATOM 0 H GLN A 71 48.879 -6.609 9.394 1.00 0.00 H new ATOM 0 HA GLN A 71 49.821 -7.878 6.883 1.00 0.00 H new ATOM 0 HB2 GLN A 71 50.070 -5.019 7.935 1.00 0.00 H new ATOM 0 HB3 GLN A 71 50.878 -5.606 6.495 1.00 0.00 H new ATOM 0 HG2 GLN A 71 48.641 -6.248 5.521 1.00 0.00 H new ATOM 0 HG3 GLN A 71 47.849 -5.613 6.949 1.00 0.00 H new ATOM 0 HE21 GLN A 71 46.788 -3.784 6.030 1.00 0.00 H new ATOM 0 HE22 GLN A 71 47.668 -2.463 5.255 1.00 0.00 H new ATOM 1095 N GLU A 72 51.256 -8.092 9.536 1.00 0.00 N ATOM 1096 CA GLU A 72 52.468 -8.432 10.270 1.00 0.00 C ATOM 1097 C GLU A 72 53.444 -9.188 9.374 1.00 0.00 C ATOM 1098 O GLU A 72 54.647 -8.928 9.393 1.00 0.00 O ATOM 1099 CB GLU A 72 52.118 -9.292 11.486 1.00 0.00 C ATOM 1100 CG GLU A 72 51.516 -10.619 11.018 1.00 0.00 C ATOM 1101 CD GLU A 72 50.876 -11.346 12.196 1.00 0.00 C ATOM 1102 OE1 GLU A 72 51.613 -11.804 13.055 1.00 0.00 O ATOM 1103 OE2 GLU A 72 49.659 -11.434 12.223 1.00 0.00 O ATOM 0 H GLU A 72 50.388 -8.370 9.995 1.00 0.00 H new ATOM 0 HA GLU A 72 52.940 -7.507 10.602 1.00 0.00 H new ATOM 0 HB2 GLU A 72 53.011 -9.476 12.083 1.00 0.00 H new ATOM 0 HB3 GLU A 72 51.410 -8.765 12.126 1.00 0.00 H new ATOM 0 HG2 GLU A 72 50.770 -10.437 10.244 1.00 0.00 H new ATOM 0 HG3 GLU A 72 52.291 -11.243 10.573 1.00 0.00 H new ATOM 1110 N GLU A 73 52.917 -10.123 8.591 1.00 0.00 N ATOM 1111 CA GLU A 73 53.752 -10.911 7.692 1.00 0.00 C ATOM 1112 C GLU A 73 54.502 -10.002 6.723 1.00 0.00 C ATOM 1113 O GLU A 73 55.709 -10.147 6.528 1.00 0.00 O ATOM 1114 CB GLU A 73 52.887 -11.896 6.903 1.00 0.00 C ATOM 1115 CG GLU A 73 52.249 -12.900 7.866 1.00 0.00 C ATOM 1116 CD GLU A 73 51.606 -14.038 7.080 1.00 0.00 C ATOM 1117 OE1 GLU A 73 51.623 -13.975 5.863 1.00 0.00 O ATOM 1118 OE2 GLU A 73 51.104 -14.956 7.709 1.00 0.00 O ATOM 0 H GLU A 73 51.924 -10.353 8.560 1.00 0.00 H new ATOM 0 HA GLU A 73 54.476 -11.463 8.291 1.00 0.00 H new ATOM 0 HB2 GLU A 73 52.113 -11.359 6.355 1.00 0.00 H new ATOM 0 HB3 GLU A 73 53.495 -12.420 6.165 1.00 0.00 H new ATOM 0 HG2 GLU A 73 53.004 -13.297 8.544 1.00 0.00 H new ATOM 0 HG3 GLU A 73 51.499 -12.402 8.480 1.00 0.00 H new ATOM 1125 N GLU A 74 53.779 -9.064 6.120 1.00 0.00 N ATOM 1126 CA GLU A 74 54.387 -8.136 5.173 1.00 0.00 C ATOM 1127 C GLU A 74 55.545 -7.389 5.825 1.00 0.00 C ATOM 1128 O GLU A 74 56.650 -7.344 5.283 1.00 0.00 O ATOM 1129 CB GLU A 74 53.342 -7.133 4.681 1.00 0.00 C ATOM 1130 CG GLU A 74 53.930 -6.299 3.542 1.00 0.00 C ATOM 1131 CD GLU A 74 52.822 -5.530 2.831 1.00 0.00 C ATOM 1132 OE1 GLU A 74 51.673 -5.711 3.199 1.00 0.00 O ATOM 1133 OE2 GLU A 74 53.138 -4.772 1.929 1.00 0.00 O ATOM 0 H GLU A 74 52.779 -8.927 6.268 1.00 0.00 H new ATOM 0 HA GLU A 74 54.768 -8.707 4.326 1.00 0.00 H new ATOM 0 HB2 GLU A 74 52.451 -7.659 4.338 1.00 0.00 H new ATOM 0 HB3 GLU A 74 53.033 -6.483 5.500 1.00 0.00 H new ATOM 0 HG2 GLU A 74 54.672 -5.604 3.935 1.00 0.00 H new ATOM 0 HG3 GLU A 74 54.445 -6.948 2.834 1.00 0.00 H new ATOM 1140 N ALA A 75 55.285 -6.803 6.990 1.00 0.00 N ATOM 1141 CA ALA A 75 56.316 -6.060 7.706 1.00 0.00 C ATOM 1142 C ALA A 75 57.583 -6.898 7.843 1.00 0.00 C ATOM 1143 O ALA A 75 58.686 -6.423 7.573 1.00 0.00 O ATOM 1144 CB ALA A 75 55.807 -5.669 9.094 1.00 0.00 C ATOM 0 H ALA A 75 54.377 -6.828 7.455 1.00 0.00 H new ATOM 0 HA ALA A 75 56.550 -5.160 7.138 1.00 0.00 H new ATOM 0 HB1 ALA A 75 56.582 -5.114 9.623 1.00 0.00 H new ATOM 0 HB2 ALA A 75 54.919 -5.045 8.993 1.00 0.00 H new ATOM 0 HB3 ALA A 75 55.557 -6.568 9.656 1.00 0.00 H new ATOM 1150 N LEU A 76 57.417 -8.148 8.266 1.00 0.00 N ATOM 1151 CA LEU A 76 58.554 -9.043 8.435 1.00 0.00 C ATOM 1152 C LEU A 76 59.206 -9.342 7.089 1.00 0.00 C ATOM 1153 O LEU A 76 60.431 -9.381 6.977 1.00 0.00 O ATOM 1154 CB LEU A 76 58.096 -10.351 9.085 1.00 0.00 C ATOM 1155 CG LEU A 76 57.698 -10.088 10.538 1.00 0.00 C ATOM 1156 CD1 LEU A 76 57.064 -11.347 11.131 1.00 0.00 C ATOM 1157 CD2 LEU A 76 58.943 -9.716 11.347 1.00 0.00 C ATOM 0 H LEU A 76 56.513 -8.560 8.496 1.00 0.00 H new ATOM 0 HA LEU A 76 59.285 -8.554 9.078 1.00 0.00 H new ATOM 0 HB2 LEU A 76 57.251 -10.766 8.535 1.00 0.00 H new ATOM 0 HB3 LEU A 76 58.897 -11.089 9.044 1.00 0.00 H new ATOM 0 HG LEU A 76 56.980 -9.269 10.575 1.00 0.00 H new ATOM 0 HD11 LEU A 76 56.781 -11.159 12.167 1.00 0.00 H new ATOM 0 HD12 LEU A 76 56.178 -11.614 10.555 1.00 0.00 H new ATOM 0 HD13 LEU A 76 57.781 -12.167 11.095 1.00 0.00 H new ATOM 0 HD21 LEU A 76 58.661 -9.528 12.383 1.00 0.00 H new ATOM 0 HD22 LEU A 76 59.660 -10.536 11.309 1.00 0.00 H new ATOM 0 HD23 LEU A 76 59.396 -8.818 10.926 1.00 0.00 H new ATOM 1169 N ALA A 77 58.378 -9.552 6.070 1.00 0.00 N ATOM 1170 CA ALA A 77 58.886 -9.846 4.736 1.00 0.00 C ATOM 1171 C ALA A 77 59.760 -8.702 4.231 1.00 0.00 C ATOM 1172 O ALA A 77 60.826 -8.929 3.659 1.00 0.00 O ATOM 1173 CB ALA A 77 57.720 -10.065 3.770 1.00 0.00 C ATOM 0 H ALA A 77 57.361 -9.524 6.142 1.00 0.00 H new ATOM 0 HA ALA A 77 59.489 -10.752 4.789 1.00 0.00 H new ATOM 0 HB1 ALA A 77 58.108 -10.284 2.775 1.00 0.00 H new ATOM 0 HB2 ALA A 77 57.114 -10.902 4.116 1.00 0.00 H new ATOM 0 HB3 ALA A 77 57.107 -9.165 3.730 1.00 0.00 H new ATOM 1179 N ALA A 78 59.300 -7.475 4.449 1.00 0.00 N ATOM 1180 CA ALA A 78 60.050 -6.302 4.013 1.00 0.00 C ATOM 1181 C ALA A 78 61.388 -6.221 4.740 1.00 0.00 C ATOM 1182 O ALA A 78 62.419 -5.935 4.133 1.00 0.00 O ATOM 1183 CB ALA A 78 59.240 -5.033 4.287 1.00 0.00 C ATOM 0 H ALA A 78 58.420 -7.267 4.920 1.00 0.00 H new ATOM 0 HA ALA A 78 60.236 -6.390 2.943 1.00 0.00 H new ATOM 0 HB1 ALA A 78 59.807 -4.162 3.959 1.00 0.00 H new ATOM 0 HB2 ALA A 78 58.297 -5.079 3.742 1.00 0.00 H new ATOM 0 HB3 ALA A 78 59.039 -4.953 5.355 1.00 0.00 H new ATOM 1189 N VAL A 79 61.363 -6.475 6.045 1.00 0.00 N ATOM 1190 CA VAL A 79 62.581 -6.429 6.845 1.00 0.00 C ATOM 1191 C VAL A 79 63.511 -7.578 6.470 1.00 0.00 C ATOM 1192 O VAL A 79 64.715 -7.387 6.304 1.00 0.00 O ATOM 1193 CB VAL A 79 62.233 -6.516 8.331 1.00 0.00 C ATOM 1194 CG1 VAL A 79 63.517 -6.474 9.161 1.00 0.00 C ATOM 1195 CG2 VAL A 79 61.341 -5.332 8.714 1.00 0.00 C ATOM 0 H VAL A 79 60.520 -6.713 6.567 1.00 0.00 H new ATOM 0 HA VAL A 79 63.089 -5.485 6.646 1.00 0.00 H new ATOM 0 HB VAL A 79 61.706 -7.450 8.526 1.00 0.00 H new ATOM 0 HG11 VAL A 79 63.268 -6.536 10.220 1.00 0.00 H new ATOM 0 HG12 VAL A 79 64.154 -7.315 8.888 1.00 0.00 H new ATOM 0 HG13 VAL A 79 64.045 -5.541 8.967 1.00 0.00 H new ATOM 0 HG21 VAL A 79 61.092 -5.392 9.773 1.00 0.00 H new ATOM 0 HG22 VAL A 79 61.870 -4.399 8.518 1.00 0.00 H new ATOM 0 HG23 VAL A 79 60.425 -5.360 8.124 1.00 0.00 H new ATOM 1205 N ILE A 80 62.942 -8.773 6.338 1.00 0.00 N ATOM 1206 CA ILE A 80 63.730 -9.948 5.981 1.00 0.00 C ATOM 1207 C ILE A 80 64.306 -9.797 4.576 1.00 0.00 C ATOM 1208 O ILE A 80 65.456 -10.158 4.323 1.00 0.00 O ATOM 1209 CB ILE A 80 62.858 -11.201 6.045 1.00 0.00 C ATOM 1210 CG1 ILE A 80 62.638 -11.592 7.508 1.00 0.00 C ATOM 1211 CG2 ILE A 80 63.556 -12.348 5.312 1.00 0.00 C ATOM 1212 CD1 ILE A 80 61.583 -12.698 7.589 1.00 0.00 C ATOM 0 H ILE A 80 61.947 -8.952 6.472 1.00 0.00 H new ATOM 0 HA ILE A 80 64.551 -10.042 6.691 1.00 0.00 H new ATOM 0 HB ILE A 80 61.897 -10.999 5.572 1.00 0.00 H new ATOM 0 HG12 ILE A 80 63.574 -11.935 7.948 1.00 0.00 H new ATOM 0 HG13 ILE A 80 62.315 -10.724 8.083 1.00 0.00 H new ATOM 0 HG21 ILE A 80 62.933 -13.242 5.358 1.00 0.00 H new ATOM 0 HG22 ILE A 80 63.716 -12.070 4.270 1.00 0.00 H new ATOM 0 HG23 ILE A 80 64.517 -12.551 5.785 1.00 0.00 H new ATOM 0 HD11 ILE A 80 61.427 -12.976 8.631 1.00 0.00 H new ATOM 0 HD12 ILE A 80 60.646 -12.338 7.165 1.00 0.00 H new ATOM 0 HD13 ILE A 80 61.924 -13.568 7.029 1.00 0.00 H new ATOM 1224 N ALA A 81 63.499 -9.261 3.666 1.00 0.00 N ATOM 1225 CA ALA A 81 63.939 -9.066 2.290 1.00 0.00 C ATOM 1226 C ALA A 81 65.111 -8.091 2.236 1.00 0.00 C ATOM 1227 O ALA A 81 66.011 -8.232 1.410 1.00 0.00 O ATOM 1228 CB ALA A 81 62.784 -8.528 1.443 1.00 0.00 C ATOM 0 H ALA A 81 62.544 -8.956 3.855 1.00 0.00 H new ATOM 0 HA ALA A 81 64.263 -10.028 1.892 1.00 0.00 H new ATOM 0 HB1 ALA A 81 63.121 -8.385 0.416 1.00 0.00 H new ATOM 0 HB2 ALA A 81 61.959 -9.240 1.458 1.00 0.00 H new ATOM 0 HB3 ALA A 81 62.447 -7.575 1.850 1.00 0.00 H new ATOM 1234 N LEU A 82 65.090 -7.102 3.123 1.00 0.00 N ATOM 1235 CA LEU A 82 66.156 -6.108 3.170 1.00 0.00 C ATOM 1236 C LEU A 82 67.428 -6.716 3.752 1.00 0.00 C ATOM 1237 O LEU A 82 68.534 -6.407 3.310 1.00 0.00 O ATOM 1238 CB LEU A 82 65.721 -4.914 4.023 1.00 0.00 C ATOM 1239 CG LEU A 82 65.004 -3.891 3.142 1.00 0.00 C ATOM 1240 CD1 LEU A 82 64.105 -3.010 4.012 1.00 0.00 C ATOM 1241 CD2 LEU A 82 66.039 -3.015 2.433 1.00 0.00 C ATOM 0 H LEU A 82 64.352 -6.968 3.814 1.00 0.00 H new ATOM 0 HA LEU A 82 66.359 -5.771 2.153 1.00 0.00 H new ATOM 0 HB2 LEU A 82 65.060 -5.247 4.823 1.00 0.00 H new ATOM 0 HB3 LEU A 82 66.590 -4.456 4.497 1.00 0.00 H new ATOM 0 HG LEU A 82 64.397 -4.412 2.401 1.00 0.00 H new ATOM 0 HD11 LEU A 82 63.593 -2.280 3.384 1.00 0.00 H new ATOM 0 HD12 LEU A 82 63.368 -3.632 4.520 1.00 0.00 H new ATOM 0 HD13 LEU A 82 64.712 -2.489 4.752 1.00 0.00 H new ATOM 0 HD21 LEU A 82 65.529 -2.285 1.804 1.00 0.00 H new ATOM 0 HD22 LEU A 82 66.645 -2.495 3.175 1.00 0.00 H new ATOM 0 HD23 LEU A 82 66.682 -3.640 1.814 1.00 0.00 H new ATOM 1253 N PHE A 83 67.261 -7.582 4.747 1.00 0.00 N ATOM 1254 CA PHE A 83 68.404 -8.228 5.382 1.00 0.00 C ATOM 1255 C PHE A 83 69.045 -9.235 4.432 1.00 0.00 C ATOM 1256 O PHE A 83 70.262 -9.422 4.440 1.00 0.00 O ATOM 1257 CB PHE A 83 67.955 -8.943 6.659 1.00 0.00 C ATOM 1258 CG PHE A 83 67.472 -7.924 7.663 1.00 0.00 C ATOM 1259 CD1 PHE A 83 67.388 -6.574 7.306 1.00 0.00 C ATOM 1260 CD2 PHE A 83 67.106 -8.332 8.953 1.00 0.00 C ATOM 1261 CE1 PHE A 83 66.941 -5.629 8.237 1.00 0.00 C ATOM 1262 CE2 PHE A 83 66.659 -7.387 9.884 1.00 0.00 C ATOM 1263 CZ PHE A 83 66.576 -6.037 9.527 1.00 0.00 C ATOM 0 H PHE A 83 66.354 -7.851 5.128 1.00 0.00 H new ATOM 0 HA PHE A 83 69.139 -7.463 5.632 1.00 0.00 H new ATOM 0 HB2 PHE A 83 67.158 -9.651 6.431 1.00 0.00 H new ATOM 0 HB3 PHE A 83 68.782 -9.517 7.077 1.00 0.00 H new ATOM 0 HD1 PHE A 83 67.668 -6.261 6.311 1.00 0.00 H new ATOM 0 HD2 PHE A 83 67.169 -9.374 9.228 1.00 0.00 H new ATOM 0 HE1 PHE A 83 66.878 -4.587 7.961 1.00 0.00 H new ATOM 0 HE2 PHE A 83 66.378 -7.700 10.879 1.00 0.00 H new ATOM 0 HZ PHE A 83 66.230 -5.309 10.246 1.00 0.00 H new ATOM 1273 N ASN A 84 68.219 -9.879 3.614 1.00 0.00 N ATOM 1274 CA ASN A 84 68.717 -10.863 2.662 1.00 0.00 C ATOM 1275 C ASN A 84 69.475 -10.178 1.530 1.00 0.00 C ATOM 1276 O ASN A 84 70.181 -10.829 0.759 1.00 0.00 O ATOM 1277 CB ASN A 84 67.551 -11.667 2.084 1.00 0.00 C ATOM 1278 CG ASN A 84 66.798 -12.375 3.205 1.00 0.00 C ATOM 1279 OD1 ASN A 84 65.681 -12.849 3.001 1.00 0.00 O ATOM 1280 ND2 ASN A 84 67.348 -12.475 4.384 1.00 0.00 N ATOM 0 H ASN A 84 67.209 -9.738 3.591 1.00 0.00 H new ATOM 0 HA ASN A 84 69.398 -11.535 3.185 1.00 0.00 H new ATOM 0 HB2 ASN A 84 66.875 -11.005 1.543 1.00 0.00 H new ATOM 0 HB3 ASN A 84 67.923 -12.398 1.367 1.00 0.00 H new ATOM 0 HD21 ASN A 84 66.852 -12.947 5.140 1.00 0.00 H new ATOM 0 HD22 ASN A 84 68.274 -12.081 4.550 1.00 0.00 H new ATOM 1287 N SER A 85 69.325 -8.861 1.436 1.00 0.00 N ATOM 1288 CA SER A 85 69.999 -8.097 0.394 1.00 0.00 C ATOM 1289 C SER A 85 71.312 -7.523 0.916 1.00 0.00 C ATOM 1290 O SER A 85 72.210 -7.323 0.114 1.00 0.00 O ATOM 1291 CB SER A 85 69.098 -6.959 -0.086 1.00 0.00 C ATOM 1292 OG SER A 85 69.554 -6.500 -1.352 1.00 0.00 O ATOM 1293 OXT SER A 85 71.402 -7.290 2.111 1.00 0.00 O ATOM 0 H SER A 85 68.746 -8.304 2.065 1.00 0.00 H new ATOM 0 HA SER A 85 70.213 -8.766 -0.440 1.00 0.00 H new ATOM 0 HB2 SER A 85 68.067 -7.304 -0.161 1.00 0.00 H new ATOM 0 HB3 SER A 85 69.109 -6.142 0.635 1.00 0.00 H new ATOM 0 HG SER A 85 68.977 -5.771 -1.663 1.00 0.00 H new TER 1299 SER A 85