USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=11 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 Set 1.1: A 27 MET CE :methyl 167:sc= -1.24 (180deg=-0.192) USER MOD Set 1.2: A 47 ASN : amide:sc= -3.65! C(o=-4.9!,f=-6.5!) USER MOD Single : A 1 MET CE :methyl -122:sc=-0.00895 (180deg=-0.22) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -0.89 K(o=-0.89,f=-2.3!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0681 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.0838 K(o=-0.084,f=-2.1!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 HIS : no HD1:sc= -0.352 K(o=-0.35,f=-1.9) 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 28 GLN : amide:sc= -0.0541 K(o=-0.054,f=-1.8!) USER MOD Single : A 38 ASN : amide:sc= -2.86! C(o=-2.9!,f=-10!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl -143:sc= -0.182 (180deg=-0.32) USER MOD Single : A 57 SER OG : rot -68:sc= 1.28 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= -0.0203 K(o=-0.02,f=-1.4!) USER MOD Single : A 68 THR OG1 : rot 176:sc= -4.77! USER MOD Single : A 71 GLN : amide:sc= -0.0619 K(o=-0.062,f=-0.86) USER MOD Single : A 84 ASN : amide:sc= -0.376 K(o=-0.38,f=-1.7!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 47.470 -13.332 16.637 1.00 0.00 N ATOM 2 CA MET A 1 48.269 -14.191 15.718 1.00 0.00 C ATOM 3 C MET A 1 49.549 -13.460 15.327 1.00 0.00 C ATOM 4 O MET A 1 49.609 -12.808 14.283 1.00 0.00 O ATOM 5 CB MET A 1 47.443 -14.503 14.468 1.00 0.00 C ATOM 6 CG MET A 1 48.154 -15.574 13.640 1.00 0.00 C ATOM 7 SD MET A 1 47.108 -16.049 12.242 1.00 0.00 S ATOM 8 CE MET A 1 47.476 -14.624 11.189 1.00 0.00 C ATOM 0 H1 MET A 1 46.596 -13.829 16.905 1.00 0.00 H new ATOM 0 H2 MET A 1 48.027 -13.126 17.491 1.00 0.00 H new ATOM 0 H3 MET A 1 47.228 -12.441 16.157 1.00 0.00 H new ATOM 0 HA MET A 1 48.528 -15.124 16.218 1.00 0.00 H new ATOM 0 HB2 MET A 1 46.449 -14.849 14.753 1.00 0.00 H new ATOM 0 HB3 MET A 1 47.308 -13.599 13.874 1.00 0.00 H new ATOM 0 HG2 MET A 1 49.111 -15.195 13.280 1.00 0.00 H new ATOM 0 HG3 MET A 1 48.369 -16.445 14.260 1.00 0.00 H new ATOM 0 HE1 MET A 1 46.550 -14.102 10.946 1.00 0.00 H new ATOM 0 HE2 MET A 1 48.147 -13.946 11.716 1.00 0.00 H new ATOM 0 HE3 MET A 1 47.952 -14.964 10.270 1.00 0.00 H new ATOM 20 N THR A 2 50.570 -13.569 16.172 1.00 0.00 N ATOM 21 CA THR A 2 51.844 -12.913 15.903 1.00 0.00 C ATOM 22 C THR A 2 52.713 -13.780 14.999 1.00 0.00 C ATOM 23 O THR A 2 52.560 -15.001 14.957 1.00 0.00 O ATOM 24 CB THR A 2 52.580 -12.646 17.219 1.00 0.00 C ATOM 25 OG1 THR A 2 52.822 -13.878 17.883 1.00 0.00 O ATOM 26 CG2 THR A 2 51.725 -11.743 18.110 1.00 0.00 C ATOM 0 H THR A 2 50.540 -14.101 17.042 1.00 0.00 H new ATOM 0 HA THR A 2 51.646 -11.968 15.398 1.00 0.00 H new ATOM 0 HB THR A 2 53.529 -12.153 17.011 1.00 0.00 H new ATOM 0 HG1 THR A 2 53.295 -13.709 18.725 1.00 0.00 H new ATOM 0 HG21 THR A 2 52.250 -11.554 19.046 1.00 0.00 H new ATOM 0 HG22 THR A 2 51.541 -10.798 17.600 1.00 0.00 H new ATOM 0 HG23 THR A 2 50.774 -12.233 18.320 1.00 0.00 H new ATOM 34 N VAL A 3 53.627 -13.141 14.276 1.00 0.00 N ATOM 35 CA VAL A 3 54.517 -13.864 13.375 1.00 0.00 C ATOM 36 C VAL A 3 55.948 -13.358 13.516 1.00 0.00 C ATOM 37 O VAL A 3 56.238 -12.197 13.226 1.00 0.00 O ATOM 38 CB VAL A 3 54.051 -13.685 11.928 1.00 0.00 C ATOM 39 CG1 VAL A 3 55.045 -14.363 10.984 1.00 0.00 C ATOM 40 CG2 VAL A 3 52.670 -14.321 11.757 1.00 0.00 C ATOM 0 H VAL A 3 53.770 -12.131 14.296 1.00 0.00 H new ATOM 0 HA VAL A 3 54.490 -14.921 13.638 1.00 0.00 H new ATOM 0 HB VAL A 3 53.995 -12.622 11.692 1.00 0.00 H new ATOM 0 HG11 VAL A 3 54.713 -14.236 9.954 1.00 0.00 H new ATOM 0 HG12 VAL A 3 56.029 -13.911 11.107 1.00 0.00 H new ATOM 0 HG13 VAL A 3 55.102 -15.426 11.218 1.00 0.00 H new ATOM 0 HG21 VAL A 3 52.336 -14.195 10.727 1.00 0.00 H new ATOM 0 HG22 VAL A 3 52.727 -15.384 11.992 1.00 0.00 H new ATOM 0 HG23 VAL A 3 51.961 -13.838 12.430 1.00 0.00 H new ATOM 50 N LYS A 4 56.840 -14.235 13.966 1.00 0.00 N ATOM 51 CA LYS A 4 58.239 -13.864 14.144 1.00 0.00 C ATOM 52 C LYS A 4 59.144 -14.768 13.313 1.00 0.00 C ATOM 53 O LYS A 4 58.716 -15.815 12.825 1.00 0.00 O ATOM 54 CB LYS A 4 58.624 -13.973 15.620 1.00 0.00 C ATOM 55 CG LYS A 4 58.223 -15.350 16.154 1.00 0.00 C ATOM 56 CD LYS A 4 58.352 -15.365 17.678 1.00 0.00 C ATOM 57 CE LYS A 4 57.994 -16.756 18.207 1.00 0.00 C ATOM 58 NZ LYS A 4 58.176 -16.786 19.686 1.00 0.00 N ATOM 0 H LYS A 4 56.621 -15.200 14.212 1.00 0.00 H new ATOM 0 HA LYS A 4 58.367 -12.835 13.810 1.00 0.00 H new ATOM 0 HB2 LYS A 4 59.697 -13.824 15.738 1.00 0.00 H new ATOM 0 HB3 LYS A 4 58.128 -13.190 16.194 1.00 0.00 H new ATOM 0 HG2 LYS A 4 57.198 -15.580 15.863 1.00 0.00 H new ATOM 0 HG3 LYS A 4 58.859 -16.120 15.717 1.00 0.00 H new ATOM 0 HD2 LYS A 4 59.369 -15.104 17.970 1.00 0.00 H new ATOM 0 HD3 LYS A 4 57.692 -14.616 18.117 1.00 0.00 H new ATOM 0 HE2 LYS A 4 56.963 -17.000 17.952 1.00 0.00 H new ATOM 0 HE3 LYS A 4 58.626 -17.510 17.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 57.933 -17.731 20.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 59.167 -16.571 19.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 57.555 -16.077 20.127 1.00 0.00 H new ATOM 72 N GLN A 5 60.398 -14.357 13.155 1.00 0.00 N ATOM 73 CA GLN A 5 61.358 -15.136 12.382 1.00 0.00 C ATOM 74 C GLN A 5 62.784 -14.794 12.799 1.00 0.00 C ATOM 75 O GLN A 5 63.156 -13.622 12.874 1.00 0.00 O ATOM 76 CB GLN A 5 61.178 -14.853 10.889 1.00 0.00 C ATOM 77 CG GLN A 5 59.991 -15.656 10.356 1.00 0.00 C ATOM 78 CD GLN A 5 59.821 -15.407 8.860 1.00 0.00 C ATOM 79 OE1 GLN A 5 59.365 -14.337 8.457 1.00 0.00 O ATOM 80 NE2 GLN A 5 60.164 -16.335 8.011 1.00 0.00 N ATOM 0 H GLN A 5 60.772 -13.494 13.550 1.00 0.00 H new ATOM 0 HA GLN A 5 61.179 -16.194 12.575 1.00 0.00 H new ATOM 0 HB2 GLN A 5 61.012 -13.788 10.728 1.00 0.00 H new ATOM 0 HB3 GLN A 5 62.084 -15.120 10.346 1.00 0.00 H new ATOM 0 HG2 GLN A 5 60.148 -16.719 10.540 1.00 0.00 H new ATOM 0 HG3 GLN A 5 59.082 -15.372 10.886 1.00 0.00 H new ATOM 0 HE21 GLN A 5 60.542 -17.220 8.348 1.00 0.00 H new ATOM 0 HE22 GLN A 5 60.055 -16.176 7.009 1.00 0.00 H new ATOM 89 N THR A 6 63.579 -15.824 13.072 1.00 0.00 N ATOM 90 CA THR A 6 64.964 -15.620 13.482 1.00 0.00 C ATOM 91 C THR A 6 65.846 -15.331 12.271 1.00 0.00 C ATOM 92 O THR A 6 65.825 -16.069 11.285 1.00 0.00 O ATOM 93 CB THR A 6 65.483 -16.862 14.208 1.00 0.00 C ATOM 94 OG1 THR A 6 64.401 -17.749 14.456 1.00 0.00 O ATOM 95 CG2 THR A 6 66.122 -16.451 15.536 1.00 0.00 C ATOM 0 H THR A 6 63.291 -16.801 13.017 1.00 0.00 H new ATOM 0 HA THR A 6 65.000 -14.764 14.156 1.00 0.00 H new ATOM 0 HB THR A 6 66.229 -17.360 13.588 1.00 0.00 H new ATOM 0 HG1 THR A 6 64.732 -18.547 14.920 1.00 0.00 H new ATOM 0 HG21 THR A 6 66.491 -17.337 16.052 1.00 0.00 H new ATOM 0 HG22 THR A 6 66.952 -15.770 15.345 1.00 0.00 H new ATOM 0 HG23 THR A 6 65.379 -15.952 16.158 1.00 0.00 H new ATOM 103 N VAL A 7 66.620 -14.253 12.353 1.00 0.00 N ATOM 104 CA VAL A 7 67.507 -13.877 11.259 1.00 0.00 C ATOM 105 C VAL A 7 68.907 -13.575 11.783 1.00 0.00 C ATOM 106 O VAL A 7 69.076 -12.774 12.703 1.00 0.00 O ATOM 107 CB VAL A 7 66.954 -12.645 10.539 1.00 0.00 C ATOM 108 CG1 VAL A 7 67.887 -12.264 9.388 1.00 0.00 C ATOM 109 CG2 VAL A 7 65.565 -12.963 9.982 1.00 0.00 C ATOM 0 H VAL A 7 66.651 -13.629 13.159 1.00 0.00 H new ATOM 0 HA VAL A 7 67.565 -14.712 10.560 1.00 0.00 H new ATOM 0 HB VAL A 7 66.885 -11.814 11.241 1.00 0.00 H new ATOM 0 HG11 VAL A 7 67.493 -11.387 8.875 1.00 0.00 H new ATOM 0 HG12 VAL A 7 68.878 -12.039 9.782 1.00 0.00 H new ATOM 0 HG13 VAL A 7 67.956 -13.094 8.685 1.00 0.00 H new ATOM 0 HG21 VAL A 7 65.169 -12.087 9.469 1.00 0.00 H new ATOM 0 HG22 VAL A 7 65.636 -13.794 9.280 1.00 0.00 H new ATOM 0 HG23 VAL A 7 64.899 -13.236 10.800 1.00 0.00 H new ATOM 119 N GLU A 8 69.907 -14.221 11.193 1.00 0.00 N ATOM 120 CA GLU A 8 71.289 -14.013 11.610 1.00 0.00 C ATOM 121 C GLU A 8 71.807 -12.673 11.098 1.00 0.00 C ATOM 122 O GLU A 8 71.606 -12.321 9.936 1.00 0.00 O ATOM 123 CB GLU A 8 72.172 -15.143 11.076 1.00 0.00 C ATOM 124 CG GLU A 8 71.531 -16.492 11.406 1.00 0.00 C ATOM 125 CD GLU A 8 72.467 -17.626 11.003 1.00 0.00 C ATOM 126 OE1 GLU A 8 73.188 -17.456 10.034 1.00 0.00 O ATOM 127 OE2 GLU A 8 72.449 -18.648 11.669 1.00 0.00 O ATOM 0 H GLU A 8 69.788 -14.888 10.430 1.00 0.00 H new ATOM 0 HA GLU A 8 71.324 -14.010 12.699 1.00 0.00 H new ATOM 0 HB2 GLU A 8 72.297 -15.042 9.998 1.00 0.00 H new ATOM 0 HB3 GLU A 8 73.166 -15.083 11.520 1.00 0.00 H new ATOM 0 HG2 GLU A 8 71.314 -16.550 12.473 1.00 0.00 H new ATOM 0 HG3 GLU A 8 70.580 -16.590 10.882 1.00 0.00 H new ATOM 134 N ILE A 9 72.476 -11.930 11.974 1.00 0.00 N ATOM 135 CA ILE A 9 73.019 -10.629 11.599 1.00 0.00 C ATOM 136 C ILE A 9 74.501 -10.745 11.254 1.00 0.00 C ATOM 137 O ILE A 9 75.336 -10.962 12.131 1.00 0.00 O ATOM 138 CB ILE A 9 72.837 -9.636 12.748 1.00 0.00 C ATOM 139 CG1 ILE A 9 71.361 -9.587 13.149 1.00 0.00 C ATOM 140 CG2 ILE A 9 73.288 -8.245 12.298 1.00 0.00 C ATOM 141 CD1 ILE A 9 70.491 -9.542 11.891 1.00 0.00 C ATOM 0 H ILE A 9 72.654 -12.203 12.940 1.00 0.00 H new ATOM 0 HA ILE A 9 72.481 -10.271 10.721 1.00 0.00 H new ATOM 0 HB ILE A 9 73.437 -9.954 13.601 1.00 0.00 H new ATOM 0 HG12 ILE A 9 71.107 -10.461 13.749 1.00 0.00 H new ATOM 0 HG13 ILE A 9 71.170 -8.710 13.767 1.00 0.00 H new ATOM 0 HG21 ILE A 9 73.158 -7.538 13.117 1.00 0.00 H new ATOM 0 HG22 ILE A 9 74.339 -8.278 12.011 1.00 0.00 H new ATOM 0 HG23 ILE A 9 72.689 -7.926 11.445 1.00 0.00 H new ATOM 0 HD11 ILE A 9 69.440 -9.507 12.177 1.00 0.00 H new ATOM 0 HD12 ILE A 9 70.739 -8.654 11.309 1.00 0.00 H new ATOM 0 HD13 ILE A 9 70.674 -10.433 11.290 1.00 0.00 H new ATOM 153 N THR A 10 74.818 -10.598 9.973 1.00 0.00 N ATOM 154 CA THR A 10 76.203 -10.688 9.523 1.00 0.00 C ATOM 155 C THR A 10 76.533 -9.539 8.575 1.00 0.00 C ATOM 156 O THR A 10 77.158 -9.741 7.533 1.00 0.00 O ATOM 157 CB THR A 10 76.437 -12.023 8.812 1.00 0.00 C ATOM 158 OG1 THR A 10 76.416 -13.075 9.767 1.00 0.00 O ATOM 159 CG2 THR A 10 77.794 -11.996 8.107 1.00 0.00 C ATOM 0 H THR A 10 74.141 -10.417 9.232 1.00 0.00 H new ATOM 0 HA THR A 10 76.854 -10.624 10.395 1.00 0.00 H new ATOM 0 HB THR A 10 75.651 -12.186 8.074 1.00 0.00 H new ATOM 0 HG1 THR A 10 76.564 -13.931 9.314 1.00 0.00 H new ATOM 0 HG21 THR A 10 77.960 -12.947 7.601 1.00 0.00 H new ATOM 0 HG22 THR A 10 77.808 -11.188 7.375 1.00 0.00 H new ATOM 0 HG23 THR A 10 78.583 -11.834 8.842 1.00 0.00 H new ATOM 167 N ASN A 11 76.108 -8.335 8.942 1.00 0.00 N ATOM 168 CA ASN A 11 76.364 -7.161 8.115 1.00 0.00 C ATOM 169 C ASN A 11 75.243 -6.970 7.097 1.00 0.00 C ATOM 170 O ASN A 11 75.441 -6.358 6.047 1.00 0.00 O ATOM 171 CB ASN A 11 77.698 -7.318 7.383 1.00 0.00 C ATOM 172 CG ASN A 11 78.853 -7.140 8.363 1.00 0.00 C ATOM 173 OD1 ASN A 11 78.684 -6.528 9.418 1.00 0.00 O ATOM 174 ND2 ASN A 11 80.023 -7.640 8.075 1.00 0.00 N ATOM 0 H ASN A 11 75.589 -8.147 9.800 1.00 0.00 H new ATOM 0 HA ASN A 11 76.406 -6.285 8.763 1.00 0.00 H new ATOM 0 HB2 ASN A 11 77.753 -8.302 6.917 1.00 0.00 H new ATOM 0 HB3 ASN A 11 77.772 -6.582 6.583 1.00 0.00 H new ATOM 0 HD21 ASN A 11 80.801 -7.524 8.725 1.00 0.00 H new ATOM 0 HD22 ASN A 11 80.160 -8.146 7.200 1.00 0.00 H new ATOM 181 N LYS A 12 74.066 -7.498 7.416 1.00 0.00 N ATOM 182 CA LYS A 12 72.919 -7.380 6.522 1.00 0.00 C ATOM 183 C LYS A 12 71.751 -6.707 7.235 1.00 0.00 C ATOM 184 O LYS A 12 70.622 -6.721 6.745 1.00 0.00 O ATOM 185 CB LYS A 12 72.492 -8.766 6.035 1.00 0.00 C ATOM 186 CG LYS A 12 72.261 -9.681 7.238 1.00 0.00 C ATOM 187 CD LYS A 12 72.636 -11.117 6.867 1.00 0.00 C ATOM 188 CE LYS A 12 71.591 -11.684 5.903 1.00 0.00 C ATOM 189 NZ LYS A 12 71.726 -13.167 5.841 1.00 0.00 N ATOM 0 H LYS A 12 73.881 -8.008 8.280 1.00 0.00 H new ATOM 0 HA LYS A 12 73.209 -6.768 5.668 1.00 0.00 H new ATOM 0 HB2 LYS A 12 71.580 -8.690 5.442 1.00 0.00 H new ATOM 0 HB3 LYS A 12 73.260 -9.188 5.386 1.00 0.00 H new ATOM 0 HG2 LYS A 12 72.860 -9.345 8.084 1.00 0.00 H new ATOM 0 HG3 LYS A 12 71.217 -9.635 7.548 1.00 0.00 H new ATOM 0 HD2 LYS A 12 73.623 -11.139 6.404 1.00 0.00 H new ATOM 0 HD3 LYS A 12 72.691 -11.733 7.764 1.00 0.00 H new ATOM 0 HE2 LYS A 12 70.589 -11.413 6.235 1.00 0.00 H new ATOM 0 HE3 LYS A 12 71.725 -11.254 4.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 71.016 -13.553 5.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 72.678 -13.415 5.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 71.578 -13.569 6.789 1.00 0.00 H new ATOM 203 N LEU A 13 72.031 -6.118 8.392 1.00 0.00 N ATOM 204 CA LEU A 13 70.994 -5.441 9.164 1.00 0.00 C ATOM 205 C LEU A 13 70.668 -4.085 8.550 1.00 0.00 C ATOM 206 O LEU A 13 69.625 -3.497 8.837 1.00 0.00 O ATOM 207 CB LEU A 13 71.460 -5.251 10.609 1.00 0.00 C ATOM 208 CG LEU A 13 70.246 -5.029 11.513 1.00 0.00 C ATOM 209 CD1 LEU A 13 69.758 -6.374 12.053 1.00 0.00 C ATOM 210 CD2 LEU A 13 70.641 -4.123 12.681 1.00 0.00 C ATOM 0 H LEU A 13 72.959 -6.095 8.814 1.00 0.00 H new ATOM 0 HA LEU A 13 70.096 -6.058 9.150 1.00 0.00 H new ATOM 0 HB2 LEU A 13 72.018 -6.127 10.940 1.00 0.00 H new ATOM 0 HB3 LEU A 13 72.136 -4.399 10.675 1.00 0.00 H new ATOM 0 HG LEU A 13 69.447 -4.558 10.940 1.00 0.00 H new ATOM 0 HD11 LEU A 13 68.893 -6.215 12.697 1.00 0.00 H new ATOM 0 HD12 LEU A 13 69.477 -7.020 11.221 1.00 0.00 H new ATOM 0 HD13 LEU A 13 70.555 -6.847 12.626 1.00 0.00 H new ATOM 0 HD21 LEU A 13 69.777 -3.964 13.326 1.00 0.00 H new ATOM 0 HD22 LEU A 13 71.439 -4.595 13.254 1.00 0.00 H new ATOM 0 HD23 LEU A 13 70.988 -3.164 12.296 1.00 0.00 H new ATOM 222 N GLY A 14 71.566 -3.592 7.704 1.00 0.00 N ATOM 223 CA GLY A 14 71.363 -2.303 7.054 1.00 0.00 C ATOM 224 C GLY A 14 72.693 -1.598 6.811 1.00 0.00 C ATOM 225 O GLY A 14 73.503 -1.448 7.726 1.00 0.00 O ATOM 0 H GLY A 14 72.436 -4.062 7.454 1.00 0.00 H new ATOM 0 HA2 GLY A 14 70.845 -2.447 6.106 1.00 0.00 H new ATOM 0 HA3 GLY A 14 70.723 -1.676 7.674 1.00 0.00 H new ATOM 229 N MET A 15 72.913 -1.170 5.573 1.00 0.00 N ATOM 230 CA MET A 15 74.150 -0.482 5.221 1.00 0.00 C ATOM 231 C MET A 15 74.348 0.748 6.101 1.00 0.00 C ATOM 232 O MET A 15 75.434 0.973 6.634 1.00 0.00 O ATOM 233 CB MET A 15 74.114 -0.060 3.751 1.00 0.00 C ATOM 234 CG MET A 15 74.236 -1.298 2.860 1.00 0.00 C ATOM 235 SD MET A 15 75.880 -2.028 3.065 1.00 0.00 S ATOM 236 CE MET A 15 75.635 -3.448 1.969 1.00 0.00 C ATOM 0 H MET A 15 72.256 -1.286 4.801 1.00 0.00 H new ATOM 0 HA MET A 15 74.982 -1.167 5.381 1.00 0.00 H new ATOM 0 HB2 MET A 15 73.184 0.466 3.535 1.00 0.00 H new ATOM 0 HB3 MET A 15 74.928 0.634 3.541 1.00 0.00 H new ATOM 0 HG2 MET A 15 73.468 -2.025 3.122 1.00 0.00 H new ATOM 0 HG3 MET A 15 74.074 -1.026 1.817 1.00 0.00 H new ATOM 0 HE1 MET A 15 76.544 -4.050 1.944 1.00 0.00 H new ATOM 0 HE2 MET A 15 74.808 -4.055 2.339 1.00 0.00 H new ATOM 0 HE3 MET A 15 75.405 -3.096 0.963 1.00 0.00 H new ATOM 246 N HIS A 16 73.291 1.541 6.248 1.00 0.00 N ATOM 247 CA HIS A 16 73.360 2.746 7.065 1.00 0.00 C ATOM 248 C HIS A 16 72.131 2.856 7.962 1.00 0.00 C ATOM 249 O HIS A 16 71.635 3.952 8.219 1.00 0.00 O ATOM 250 CB HIS A 16 73.451 3.981 6.168 1.00 0.00 C ATOM 251 CG HIS A 16 74.720 3.925 5.364 1.00 0.00 C ATOM 252 ND1 HIS A 16 74.827 3.179 4.201 1.00 0.00 N ATOM 253 CD2 HIS A 16 75.946 4.518 5.541 1.00 0.00 C ATOM 254 CE1 HIS A 16 76.076 3.339 3.728 1.00 0.00 C ATOM 255 NE2 HIS A 16 76.800 4.146 4.508 1.00 0.00 N ATOM 0 H HIS A 16 72.383 1.372 5.815 1.00 0.00 H new ATOM 0 HA HIS A 16 74.250 2.687 7.692 1.00 0.00 H new ATOM 0 HB2 HIS A 16 72.588 4.025 5.503 1.00 0.00 H new ATOM 0 HB3 HIS A 16 73.432 4.886 6.775 1.00 0.00 H new ATOM 0 HD2 HIS A 16 76.207 5.174 6.358 1.00 0.00 H new ATOM 0 HE1 HIS A 16 76.448 2.872 2.828 1.00 0.00 H new ATOM 0 HE2 HIS A 16 77.771 4.429 4.375 1.00 0.00 H new ATOM 263 N ALA A 17 71.645 1.712 8.434 1.00 0.00 N ATOM 264 CA ALA A 17 70.473 1.692 9.301 1.00 0.00 C ATOM 265 C ALA A 17 69.213 2.015 8.505 1.00 0.00 C ATOM 266 O ALA A 17 68.119 2.102 9.063 1.00 0.00 O ATOM 267 CB ALA A 17 70.641 2.710 10.431 1.00 0.00 C ATOM 0 H ALA A 17 72.041 0.794 8.233 1.00 0.00 H new ATOM 0 HA ALA A 17 70.375 0.693 9.725 1.00 0.00 H new ATOM 0 HB1 ALA A 17 69.761 2.688 11.074 1.00 0.00 H new ATOM 0 HB2 ALA A 17 71.525 2.460 11.017 1.00 0.00 H new ATOM 0 HB3 ALA A 17 70.757 3.708 10.008 1.00 0.00 H new ATOM 273 N ARG A 18 69.374 2.194 7.197 1.00 0.00 N ATOM 274 CA ARG A 18 68.243 2.507 6.334 1.00 0.00 C ATOM 275 C ARG A 18 67.024 1.678 6.726 1.00 0.00 C ATOM 276 O ARG A 18 65.935 2.215 6.936 1.00 0.00 O ATOM 277 CB ARG A 18 68.605 2.227 4.875 1.00 0.00 C ATOM 278 CG ARG A 18 68.503 3.521 4.064 1.00 0.00 C ATOM 279 CD ARG A 18 69.465 4.561 4.640 1.00 0.00 C ATOM 280 NE ARG A 18 70.455 4.941 3.639 1.00 0.00 N ATOM 281 CZ ARG A 18 71.464 5.751 3.943 1.00 0.00 C ATOM 282 NH1 ARG A 18 72.338 6.076 3.029 1.00 0.00 N ATOM 283 NH2 ARG A 18 71.581 6.221 5.154 1.00 0.00 N ATOM 0 H ARG A 18 70.271 2.128 6.715 1.00 0.00 H new ATOM 0 HA ARG A 18 68.003 3.564 6.452 1.00 0.00 H new ATOM 0 HB2 ARG A 18 69.616 1.825 4.811 1.00 0.00 H new ATOM 0 HB3 ARG A 18 67.935 1.473 4.462 1.00 0.00 H new ATOM 0 HG2 ARG A 18 68.743 3.327 3.019 1.00 0.00 H new ATOM 0 HG3 ARG A 18 67.482 3.900 4.091 1.00 0.00 H new ATOM 0 HD2 ARG A 18 68.909 5.441 4.964 1.00 0.00 H new ATOM 0 HD3 ARG A 18 69.964 4.157 5.521 1.00 0.00 H new ATOM 0 HE ARG A 18 70.372 4.579 2.689 1.00 0.00 H new ATOM 0 HH11 ARG A 18 72.246 5.708 2.082 1.00 0.00 H new ATOM 0 HH12 ARG A 18 73.112 6.698 3.262 1.00 0.00 H new ATOM 0 HH21 ARG A 18 70.898 5.967 5.868 1.00 0.00 H new ATOM 0 HH22 ARG A 18 72.355 6.843 5.387 1.00 0.00 H new ATOM 297 N PRO A 19 67.192 0.389 6.826 1.00 0.00 N ATOM 298 CA PRO A 19 66.090 -0.543 7.201 1.00 0.00 C ATOM 299 C PRO A 19 65.306 -0.046 8.413 1.00 0.00 C ATOM 300 O PRO A 19 64.076 0.001 8.392 1.00 0.00 O ATOM 301 CB PRO A 19 66.815 -1.852 7.518 1.00 0.00 C ATOM 302 CG PRO A 19 68.088 -1.800 6.739 1.00 0.00 C ATOM 303 CD PRO A 19 68.458 -0.323 6.592 1.00 0.00 C ATOM 0 HA PRO A 19 65.350 -0.643 6.407 1.00 0.00 H new ATOM 0 HB2 PRO A 19 67.012 -1.943 8.586 1.00 0.00 H new ATOM 0 HB3 PRO A 19 66.213 -2.714 7.230 1.00 0.00 H new ATOM 0 HG2 PRO A 19 68.878 -2.347 7.253 1.00 0.00 H new ATOM 0 HG3 PRO A 19 67.962 -2.266 5.762 1.00 0.00 H new ATOM 0 HD2 PRO A 19 69.220 -0.029 7.314 1.00 0.00 H new ATOM 0 HD3 PRO A 19 68.858 -0.109 5.601 1.00 0.00 H new ATOM 311 N ALA A 20 66.026 0.326 9.466 1.00 0.00 N ATOM 312 CA ALA A 20 65.387 0.819 10.681 1.00 0.00 C ATOM 313 C ALA A 20 64.505 2.023 10.368 1.00 0.00 C ATOM 314 O ALA A 20 63.329 2.055 10.733 1.00 0.00 O ATOM 315 CB ALA A 20 66.450 1.214 11.707 1.00 0.00 C ATOM 0 H ALA A 20 67.045 0.296 9.503 1.00 0.00 H new ATOM 0 HA ALA A 20 64.765 0.024 11.093 1.00 0.00 H new ATOM 0 HB1 ALA A 20 65.964 1.581 12.611 1.00 0.00 H new ATOM 0 HB2 ALA A 20 67.061 0.345 11.951 1.00 0.00 H new ATOM 0 HB3 ALA A 20 67.083 1.998 11.292 1.00 0.00 H new ATOM 321 N MET A 21 65.080 3.012 9.691 1.00 0.00 N ATOM 322 CA MET A 21 64.336 4.214 9.333 1.00 0.00 C ATOM 323 C MET A 21 63.165 3.865 8.420 1.00 0.00 C ATOM 324 O MET A 21 62.057 4.375 8.593 1.00 0.00 O ATOM 325 CB MET A 21 65.258 5.209 8.627 1.00 0.00 C ATOM 326 CG MET A 21 66.191 5.855 9.652 1.00 0.00 C ATOM 327 SD MET A 21 67.260 7.056 8.820 1.00 0.00 S ATOM 328 CE MET A 21 68.282 7.481 10.251 1.00 0.00 C ATOM 0 H MET A 21 66.052 3.005 9.381 1.00 0.00 H new ATOM 0 HA MET A 21 63.949 4.665 10.247 1.00 0.00 H new ATOM 0 HB2 MET A 21 65.841 4.700 7.859 1.00 0.00 H new ATOM 0 HB3 MET A 21 64.667 5.974 8.124 1.00 0.00 H new ATOM 0 HG2 MET A 21 65.608 6.348 10.430 1.00 0.00 H new ATOM 0 HG3 MET A 21 66.796 5.092 10.142 1.00 0.00 H new ATOM 0 HE1 MET A 21 69.025 8.223 9.960 1.00 0.00 H new ATOM 0 HE2 MET A 21 67.651 7.890 11.040 1.00 0.00 H new ATOM 0 HE3 MET A 21 68.786 6.586 10.617 1.00 0.00 H new ATOM 338 N LYS A 22 63.417 2.992 7.450 1.00 0.00 N ATOM 339 CA LYS A 22 62.376 2.582 6.516 1.00 0.00 C ATOM 340 C LYS A 22 61.266 1.835 7.249 1.00 0.00 C ATOM 341 O LYS A 22 60.087 1.982 6.925 1.00 0.00 O ATOM 342 CB LYS A 22 62.971 1.682 5.431 1.00 0.00 C ATOM 343 CG LYS A 22 63.671 2.545 4.380 1.00 0.00 C ATOM 344 CD LYS A 22 64.073 1.673 3.188 1.00 0.00 C ATOM 345 CE LYS A 22 64.890 2.505 2.199 1.00 0.00 C ATOM 346 NZ LYS A 22 65.366 1.632 1.089 1.00 0.00 N ATOM 0 H LYS A 22 64.326 2.558 7.291 1.00 0.00 H new ATOM 0 HA LYS A 22 61.955 3.475 6.054 1.00 0.00 H new ATOM 0 HB2 LYS A 22 63.680 0.982 5.873 1.00 0.00 H new ATOM 0 HB3 LYS A 22 62.185 1.088 4.965 1.00 0.00 H new ATOM 0 HG2 LYS A 22 63.008 3.345 4.051 1.00 0.00 H new ATOM 0 HG3 LYS A 22 64.553 3.018 4.812 1.00 0.00 H new ATOM 0 HD2 LYS A 22 64.657 0.818 3.530 1.00 0.00 H new ATOM 0 HD3 LYS A 22 63.184 1.276 2.698 1.00 0.00 H new ATOM 0 HE2 LYS A 22 64.282 3.317 1.802 1.00 0.00 H new ATOM 0 HE3 LYS A 22 65.740 2.962 2.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 65.922 2.198 0.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 65.961 0.872 1.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 64.548 1.216 0.599 1.00 0.00 H new ATOM 360 N LEU A 23 61.651 1.033 8.236 1.00 0.00 N ATOM 361 CA LEU A 23 60.680 0.269 9.009 1.00 0.00 C ATOM 362 C LEU A 23 59.605 1.191 9.576 1.00 0.00 C ATOM 363 O LEU A 23 58.416 0.876 9.532 1.00 0.00 O ATOM 364 CB LEU A 23 61.382 -0.466 10.153 1.00 0.00 C ATOM 365 CG LEU A 23 61.486 -1.954 9.816 1.00 0.00 C ATOM 366 CD1 LEU A 23 62.526 -2.612 10.724 1.00 0.00 C ATOM 367 CD2 LEU A 23 60.126 -2.621 10.032 1.00 0.00 C ATOM 0 H LEU A 23 62.622 0.896 8.518 1.00 0.00 H new ATOM 0 HA LEU A 23 60.208 -0.458 8.348 1.00 0.00 H new ATOM 0 HB2 LEU A 23 62.376 -0.048 10.312 1.00 0.00 H new ATOM 0 HB3 LEU A 23 60.827 -0.330 11.081 1.00 0.00 H new ATOM 0 HG LEU A 23 61.788 -2.070 8.775 1.00 0.00 H new ATOM 0 HD11 LEU A 23 62.600 -3.673 10.484 1.00 0.00 H new ATOM 0 HD12 LEU A 23 63.495 -2.137 10.571 1.00 0.00 H new ATOM 0 HD13 LEU A 23 62.225 -2.496 11.765 1.00 0.00 H new ATOM 0 HD21 LEU A 23 60.199 -3.682 9.792 1.00 0.00 H new ATOM 0 HD22 LEU A 23 59.825 -2.504 11.073 1.00 0.00 H new ATOM 0 HD23 LEU A 23 59.384 -2.153 9.385 1.00 0.00 H new ATOM 379 N PHE A 24 60.033 2.331 10.108 1.00 0.00 N ATOM 380 CA PHE A 24 59.098 3.292 10.680 1.00 0.00 C ATOM 381 C PHE A 24 58.040 3.683 9.653 1.00 0.00 C ATOM 382 O PHE A 24 56.860 3.811 9.980 1.00 0.00 O ATOM 383 CB PHE A 24 59.849 4.542 11.143 1.00 0.00 C ATOM 384 CG PHE A 24 60.234 4.390 12.594 1.00 0.00 C ATOM 385 CD1 PHE A 24 60.920 3.247 13.021 1.00 0.00 C ATOM 386 CD2 PHE A 24 59.905 5.394 13.514 1.00 0.00 C ATOM 387 CE1 PHE A 24 61.276 3.107 14.368 1.00 0.00 C ATOM 388 CE2 PHE A 24 60.261 5.253 14.860 1.00 0.00 C ATOM 389 CZ PHE A 24 60.947 4.110 15.287 1.00 0.00 C ATOM 0 H PHE A 24 61.013 2.610 10.155 1.00 0.00 H new ATOM 0 HA PHE A 24 58.606 2.828 11.535 1.00 0.00 H new ATOM 0 HB2 PHE A 24 60.740 4.690 10.533 1.00 0.00 H new ATOM 0 HB3 PHE A 24 59.223 5.425 11.013 1.00 0.00 H new ATOM 0 HD1 PHE A 24 61.175 2.473 12.312 1.00 0.00 H new ATOM 0 HD2 PHE A 24 59.377 6.277 13.185 1.00 0.00 H new ATOM 0 HE1 PHE A 24 61.805 2.225 14.698 1.00 0.00 H new ATOM 0 HE2 PHE A 24 60.006 6.026 15.570 1.00 0.00 H new ATOM 0 HZ PHE A 24 61.222 4.002 16.326 1.00 0.00 H new ATOM 399 N GLU A 25 58.472 3.868 8.410 1.00 0.00 N ATOM 400 CA GLU A 25 57.554 4.241 7.341 1.00 0.00 C ATOM 401 C GLU A 25 56.658 3.064 6.971 1.00 0.00 C ATOM 402 O GLU A 25 55.486 3.242 6.641 1.00 0.00 O ATOM 403 CB GLU A 25 58.341 4.692 6.110 1.00 0.00 C ATOM 404 CG GLU A 25 57.382 5.297 5.082 1.00 0.00 C ATOM 405 CD GLU A 25 56.856 6.636 5.586 1.00 0.00 C ATOM 406 OE1 GLU A 25 57.441 7.169 6.514 1.00 0.00 O ATOM 407 OE2 GLU A 25 55.874 7.110 5.035 1.00 0.00 O ATOM 0 H GLU A 25 59.445 3.767 8.120 1.00 0.00 H new ATOM 0 HA GLU A 25 56.930 5.062 7.693 1.00 0.00 H new ATOM 0 HB2 GLU A 25 59.094 5.426 6.396 1.00 0.00 H new ATOM 0 HB3 GLU A 25 58.871 3.845 5.674 1.00 0.00 H new ATOM 0 HG2 GLU A 25 57.895 5.433 4.130 1.00 0.00 H new ATOM 0 HG3 GLU A 25 56.551 4.615 4.902 1.00 0.00 H new ATOM 414 N LEU A 26 57.219 1.860 7.032 1.00 0.00 N ATOM 415 CA LEU A 26 56.460 0.658 6.703 1.00 0.00 C ATOM 416 C LEU A 26 55.363 0.420 7.735 1.00 0.00 C ATOM 417 O LEU A 26 54.235 0.070 7.385 1.00 0.00 O ATOM 418 CB LEU A 26 57.394 -0.553 6.661 1.00 0.00 C ATOM 419 CG LEU A 26 58.372 -0.403 5.494 1.00 0.00 C ATOM 420 CD1 LEU A 26 59.293 -1.624 5.439 1.00 0.00 C ATOM 421 CD2 LEU A 26 57.588 -0.297 4.184 1.00 0.00 C ATOM 0 H LEU A 26 58.188 1.691 7.304 1.00 0.00 H new ATOM 0 HA LEU A 26 56.000 0.797 5.725 1.00 0.00 H new ATOM 0 HB2 LEU A 26 57.942 -0.636 7.600 1.00 0.00 H new ATOM 0 HB3 LEU A 26 56.814 -1.469 6.548 1.00 0.00 H new ATOM 0 HG LEU A 26 58.971 0.497 5.635 1.00 0.00 H new ATOM 0 HD11 LEU A 26 59.990 -1.517 4.608 1.00 0.00 H new ATOM 0 HD12 LEU A 26 59.851 -1.701 6.372 1.00 0.00 H new ATOM 0 HD13 LEU A 26 58.695 -2.525 5.298 1.00 0.00 H new ATOM 0 HD21 LEU A 26 58.283 -0.190 3.351 1.00 0.00 H new ATOM 0 HD22 LEU A 26 56.990 -1.198 4.044 1.00 0.00 H new ATOM 0 HD23 LEU A 26 56.931 0.572 4.222 1.00 0.00 H new ATOM 433 N MET A 27 55.699 0.615 9.005 1.00 0.00 N ATOM 434 CA MET A 27 54.732 0.419 10.079 1.00 0.00 C ATOM 435 C MET A 27 53.501 1.293 9.856 1.00 0.00 C ATOM 436 O MET A 27 52.378 0.884 10.145 1.00 0.00 O ATOM 437 CB MET A 27 55.369 0.767 11.425 1.00 0.00 C ATOM 438 CG MET A 27 56.422 -0.285 11.781 1.00 0.00 C ATOM 439 SD MET A 27 57.756 0.492 12.725 1.00 0.00 S ATOM 440 CE MET A 27 56.793 0.873 14.209 1.00 0.00 C ATOM 0 H MET A 27 56.626 0.906 9.315 1.00 0.00 H new ATOM 0 HA MET A 27 54.426 -0.627 10.082 1.00 0.00 H new ATOM 0 HB2 MET A 27 55.828 1.754 11.377 1.00 0.00 H new ATOM 0 HB3 MET A 27 54.605 0.808 12.201 1.00 0.00 H new ATOM 0 HG2 MET A 27 55.968 -1.086 12.364 1.00 0.00 H new ATOM 0 HG3 MET A 27 56.820 -0.738 10.873 1.00 0.00 H new ATOM 0 HE1 MET A 27 57.467 1.151 15.019 1.00 0.00 H new ATOM 0 HE2 MET A 27 56.116 1.701 14.001 1.00 0.00 H new ATOM 0 HE3 MET A 27 56.215 -0.003 14.502 1.00 0.00 H new ATOM 450 N GLN A 28 53.723 2.496 9.337 1.00 0.00 N ATOM 451 CA GLN A 28 52.625 3.419 9.078 1.00 0.00 C ATOM 452 C GLN A 28 51.801 2.948 7.883 1.00 0.00 C ATOM 453 O GLN A 28 50.583 3.119 7.849 1.00 0.00 O ATOM 454 CB GLN A 28 53.173 4.820 8.801 1.00 0.00 C ATOM 455 CG GLN A 28 53.846 5.363 10.064 1.00 0.00 C ATOM 456 CD GLN A 28 54.629 6.629 9.734 1.00 0.00 C ATOM 457 OE1 GLN A 28 55.022 6.836 8.586 1.00 0.00 O ATOM 458 NE2 GLN A 28 54.879 7.494 10.678 1.00 0.00 N ATOM 0 H GLN A 28 54.646 2.852 9.089 1.00 0.00 H new ATOM 0 HA GLN A 28 51.984 3.448 9.959 1.00 0.00 H new ATOM 0 HB2 GLN A 28 53.889 4.786 7.980 1.00 0.00 H new ATOM 0 HB3 GLN A 28 52.365 5.484 8.492 1.00 0.00 H new ATOM 0 HG2 GLN A 28 53.094 5.578 10.823 1.00 0.00 H new ATOM 0 HG3 GLN A 28 54.515 4.610 10.482 1.00 0.00 H new ATOM 0 HE21 GLN A 28 54.552 7.320 11.629 1.00 0.00 H new ATOM 0 HE22 GLN A 28 55.401 8.344 10.466 1.00 0.00 H new ATOM 467 N GLY A 29 52.476 2.353 6.905 1.00 0.00 N ATOM 468 CA GLY A 29 51.797 1.859 5.712 1.00 0.00 C ATOM 469 C GLY A 29 51.135 0.513 5.983 1.00 0.00 C ATOM 470 O GLY A 29 50.056 0.226 5.463 1.00 0.00 O ATOM 0 H GLY A 29 53.485 2.202 6.914 1.00 0.00 H new ATOM 0 HA2 GLY A 29 51.046 2.581 5.391 1.00 0.00 H new ATOM 0 HA3 GLY A 29 52.513 1.759 4.896 1.00 0.00 H new ATOM 474 N PHE A 30 51.787 -0.308 6.799 1.00 0.00 N ATOM 475 CA PHE A 30 51.250 -1.623 7.133 1.00 0.00 C ATOM 476 C PHE A 30 50.521 -1.580 8.472 1.00 0.00 C ATOM 477 O PHE A 30 50.828 -0.752 9.330 1.00 0.00 O ATOM 478 CB PHE A 30 52.384 -2.648 7.199 1.00 0.00 C ATOM 479 CG PHE A 30 53.229 -2.545 5.953 1.00 0.00 C ATOM 480 CD1 PHE A 30 54.550 -3.010 5.961 1.00 0.00 C ATOM 481 CD2 PHE A 30 52.692 -1.985 4.787 1.00 0.00 C ATOM 482 CE1 PHE A 30 55.333 -2.915 4.805 1.00 0.00 C ATOM 483 CE2 PHE A 30 53.476 -1.890 3.631 1.00 0.00 C ATOM 484 CZ PHE A 30 54.796 -2.355 3.639 1.00 0.00 C ATOM 0 H PHE A 30 52.681 -0.089 7.239 1.00 0.00 H new ATOM 0 HA PHE A 30 50.542 -1.914 6.357 1.00 0.00 H new ATOM 0 HB2 PHE A 30 52.997 -2.471 8.083 1.00 0.00 H new ATOM 0 HB3 PHE A 30 51.974 -3.654 7.291 1.00 0.00 H new ATOM 0 HD1 PHE A 30 54.965 -3.442 6.860 1.00 0.00 H new ATOM 0 HD2 PHE A 30 51.673 -1.627 4.780 1.00 0.00 H new ATOM 0 HE1 PHE A 30 56.352 -3.274 4.812 1.00 0.00 H new ATOM 0 HE2 PHE A 30 53.062 -1.457 2.732 1.00 0.00 H new ATOM 0 HZ PHE A 30 55.400 -2.282 2.747 1.00 0.00 H new ATOM 494 N ASP A 31 49.555 -2.476 8.643 1.00 0.00 N ATOM 495 CA ASP A 31 48.788 -2.530 9.883 1.00 0.00 C ATOM 496 C ASP A 31 49.303 -3.649 10.783 1.00 0.00 C ATOM 497 O ASP A 31 48.893 -4.802 10.653 1.00 0.00 O ATOM 498 CB ASP A 31 47.309 -2.762 9.572 1.00 0.00 C ATOM 499 CG ASP A 31 46.690 -1.491 9.001 1.00 0.00 C ATOM 500 OD1 ASP A 31 47.332 -0.457 9.078 1.00 0.00 O ATOM 501 OD2 ASP A 31 45.583 -1.571 8.494 1.00 0.00 O ATOM 0 H ASP A 31 49.286 -3.170 7.945 1.00 0.00 H new ATOM 0 HA ASP A 31 48.905 -1.579 10.403 1.00 0.00 H new ATOM 0 HB2 ASP A 31 47.203 -3.580 8.859 1.00 0.00 H new ATOM 0 HB3 ASP A 31 46.781 -3.058 10.478 1.00 0.00 H new ATOM 506 N ALA A 32 50.203 -3.299 11.697 1.00 0.00 N ATOM 507 CA ALA A 32 50.766 -4.283 12.616 1.00 0.00 C ATOM 508 C ALA A 32 51.956 -3.695 13.367 1.00 0.00 C ATOM 509 O ALA A 32 52.644 -2.808 12.862 1.00 0.00 O ATOM 510 CB ALA A 32 51.212 -5.524 11.841 1.00 0.00 C ATOM 0 H ALA A 32 50.556 -2.350 11.821 1.00 0.00 H new ATOM 0 HA ALA A 32 49.998 -4.561 13.337 1.00 0.00 H new ATOM 0 HB1 ALA A 32 51.631 -6.254 12.533 1.00 0.00 H new ATOM 0 HB2 ALA A 32 50.355 -5.960 11.328 1.00 0.00 H new ATOM 0 HB3 ALA A 32 51.968 -5.243 11.108 1.00 0.00 H new ATOM 516 N GLU A 33 52.192 -4.193 14.576 1.00 0.00 N ATOM 517 CA GLU A 33 53.301 -3.710 15.388 1.00 0.00 C ATOM 518 C GLU A 33 54.517 -4.619 15.232 1.00 0.00 C ATOM 519 O GLU A 33 54.402 -5.843 15.302 1.00 0.00 O ATOM 520 CB GLU A 33 52.888 -3.657 16.860 1.00 0.00 C ATOM 521 CG GLU A 33 53.991 -2.983 17.677 1.00 0.00 C ATOM 522 CD GLU A 33 53.513 -2.749 19.107 1.00 0.00 C ATOM 523 OE1 GLU A 33 52.343 -2.981 19.363 1.00 0.00 O ATOM 524 OE2 GLU A 33 54.323 -2.342 19.922 1.00 0.00 O ATOM 0 H GLU A 33 51.634 -4.926 15.013 1.00 0.00 H new ATOM 0 HA GLU A 33 53.564 -2.708 15.048 1.00 0.00 H new ATOM 0 HB2 GLU A 33 51.954 -3.106 16.967 1.00 0.00 H new ATOM 0 HB3 GLU A 33 52.708 -4.665 17.234 1.00 0.00 H new ATOM 0 HG2 GLU A 33 54.885 -3.607 17.681 1.00 0.00 H new ATOM 0 HG3 GLU A 33 54.267 -2.034 17.217 1.00 0.00 H new ATOM 531 N VAL A 34 55.680 -4.012 15.020 1.00 0.00 N ATOM 532 CA VAL A 34 56.911 -4.777 14.855 1.00 0.00 C ATOM 533 C VAL A 34 57.761 -4.704 16.119 1.00 0.00 C ATOM 534 O VAL A 34 57.817 -3.668 16.782 1.00 0.00 O ATOM 535 CB VAL A 34 57.709 -4.233 13.669 1.00 0.00 C ATOM 536 CG1 VAL A 34 59.003 -5.033 13.515 1.00 0.00 C ATOM 537 CG2 VAL A 34 56.875 -4.361 12.393 1.00 0.00 C ATOM 0 H VAL A 34 55.796 -3.000 14.959 1.00 0.00 H new ATOM 0 HA VAL A 34 56.647 -5.818 14.668 1.00 0.00 H new ATOM 0 HB VAL A 34 57.949 -3.184 13.843 1.00 0.00 H new ATOM 0 HG11 VAL A 34 59.572 -4.646 12.670 1.00 0.00 H new ATOM 0 HG12 VAL A 34 59.597 -4.943 14.424 1.00 0.00 H new ATOM 0 HG13 VAL A 34 58.764 -6.082 13.341 1.00 0.00 H new ATOM 0 HG21 VAL A 34 57.443 -3.974 11.547 1.00 0.00 H new ATOM 0 HG22 VAL A 34 56.635 -5.410 12.219 1.00 0.00 H new ATOM 0 HG23 VAL A 34 55.952 -3.791 12.503 1.00 0.00 H new ATOM 547 N LEU A 35 58.420 -5.810 16.449 1.00 0.00 N ATOM 548 CA LEU A 35 59.264 -5.860 17.637 1.00 0.00 C ATOM 549 C LEU A 35 60.567 -6.593 17.338 1.00 0.00 C ATOM 550 O LEU A 35 60.562 -7.667 16.736 1.00 0.00 O ATOM 551 CB LEU A 35 58.526 -6.570 18.774 1.00 0.00 C ATOM 552 CG LEU A 35 59.507 -6.879 19.905 1.00 0.00 C ATOM 553 CD1 LEU A 35 58.832 -6.620 21.252 1.00 0.00 C ATOM 554 CD2 LEU A 35 59.933 -8.347 19.822 1.00 0.00 C ATOM 0 H LEU A 35 58.387 -6.678 15.915 1.00 0.00 H new ATOM 0 HA LEU A 35 59.496 -4.838 17.938 1.00 0.00 H new ATOM 0 HB2 LEU A 35 57.715 -5.942 19.143 1.00 0.00 H new ATOM 0 HB3 LEU A 35 58.074 -7.492 18.408 1.00 0.00 H new ATOM 0 HG LEU A 35 60.384 -6.239 19.810 1.00 0.00 H new ATOM 0 HD11 LEU A 35 59.532 -6.840 22.058 1.00 0.00 H new ATOM 0 HD12 LEU A 35 58.528 -5.575 21.311 1.00 0.00 H new ATOM 0 HD13 LEU A 35 57.955 -7.260 21.348 1.00 0.00 H new ATOM 0 HD21 LEU A 35 60.633 -8.569 20.628 1.00 0.00 H new ATOM 0 HD22 LEU A 35 59.055 -8.986 19.917 1.00 0.00 H new ATOM 0 HD23 LEU A 35 60.415 -8.532 18.862 1.00 0.00 H new ATOM 566 N LEU A 36 61.682 -6.006 17.762 1.00 0.00 N ATOM 567 CA LEU A 36 62.987 -6.613 17.535 1.00 0.00 C ATOM 568 C LEU A 36 63.677 -6.914 18.862 1.00 0.00 C ATOM 569 O LEU A 36 63.479 -6.207 19.850 1.00 0.00 O ATOM 570 CB LEU A 36 63.864 -5.672 16.705 1.00 0.00 C ATOM 571 CG LEU A 36 63.542 -5.852 15.220 1.00 0.00 C ATOM 572 CD1 LEU A 36 63.733 -4.521 14.491 1.00 0.00 C ATOM 573 CD2 LEU A 36 64.481 -6.901 14.620 1.00 0.00 C ATOM 0 H LEU A 36 61.708 -5.117 18.261 1.00 0.00 H new ATOM 0 HA LEU A 36 62.842 -7.548 16.993 1.00 0.00 H new ATOM 0 HB2 LEU A 36 63.690 -4.638 17.003 1.00 0.00 H new ATOM 0 HB3 LEU A 36 64.918 -5.884 16.888 1.00 0.00 H new ATOM 0 HG LEU A 36 62.509 -6.181 15.109 1.00 0.00 H new ATOM 0 HD11 LEU A 36 63.504 -4.649 13.433 1.00 0.00 H new ATOM 0 HD12 LEU A 36 63.066 -3.773 14.919 1.00 0.00 H new ATOM 0 HD13 LEU A 36 64.766 -4.191 14.601 1.00 0.00 H new ATOM 0 HD21 LEU A 36 64.253 -7.031 13.562 1.00 0.00 H new ATOM 0 HD22 LEU A 36 65.514 -6.571 14.731 1.00 0.00 H new ATOM 0 HD23 LEU A 36 64.346 -7.850 15.139 1.00 0.00 H new ATOM 585 N ARG A 37 64.485 -7.969 18.877 1.00 0.00 N ATOM 586 CA ARG A 37 65.198 -8.354 20.089 1.00 0.00 C ATOM 587 C ARG A 37 66.421 -9.199 19.746 1.00 0.00 C ATOM 588 O ARG A 37 66.381 -10.024 18.833 1.00 0.00 O ATOM 589 CB ARG A 37 64.270 -9.147 21.012 1.00 0.00 C ATOM 590 CG ARG A 37 63.820 -10.427 20.307 1.00 0.00 C ATOM 591 CD ARG A 37 63.116 -11.342 21.309 1.00 0.00 C ATOM 592 NE ARG A 37 62.190 -12.232 20.618 1.00 0.00 N ATOM 593 CZ ARG A 37 61.542 -13.192 21.270 1.00 0.00 C ATOM 594 NH1 ARG A 37 60.718 -13.975 20.628 1.00 0.00 N ATOM 595 NH2 ARG A 37 61.731 -13.352 22.551 1.00 0.00 N ATOM 0 H ARG A 37 64.661 -8.568 18.071 1.00 0.00 H new ATOM 0 HA ARG A 37 65.528 -7.448 20.597 1.00 0.00 H new ATOM 0 HB2 ARG A 37 64.786 -9.393 21.940 1.00 0.00 H new ATOM 0 HB3 ARG A 37 63.403 -8.543 21.280 1.00 0.00 H new ATOM 0 HG2 ARG A 37 63.147 -10.184 19.485 1.00 0.00 H new ATOM 0 HG3 ARG A 37 64.680 -10.938 19.874 1.00 0.00 H new ATOM 0 HD2 ARG A 37 63.854 -11.928 21.857 1.00 0.00 H new ATOM 0 HD3 ARG A 37 62.576 -10.743 22.042 1.00 0.00 H new ATOM 0 HE ARG A 37 62.037 -12.116 19.616 1.00 0.00 H new ATOM 0 HH11 ARG A 37 60.572 -13.850 19.626 1.00 0.00 H new ATOM 0 HH12 ARG A 37 60.221 -14.712 21.128 1.00 0.00 H new ATOM 0 HH21 ARG A 37 62.376 -12.740 23.052 1.00 0.00 H new ATOM 0 HH22 ARG A 37 61.234 -14.089 23.052 1.00 0.00 H new ATOM 609 N ASN A 38 67.506 -8.989 20.484 1.00 0.00 N ATOM 610 CA ASN A 38 68.735 -9.737 20.248 1.00 0.00 C ATOM 611 C ASN A 38 68.741 -11.029 21.061 1.00 0.00 C ATOM 612 O ASN A 38 67.993 -11.168 22.027 1.00 0.00 O ATOM 613 CB ASN A 38 69.948 -8.886 20.631 1.00 0.00 C ATOM 614 CG ASN A 38 69.969 -7.606 19.802 1.00 0.00 C ATOM 615 OD1 ASN A 38 69.652 -7.631 18.612 1.00 0.00 O ATOM 616 ND2 ASN A 38 70.325 -6.483 20.362 1.00 0.00 N ATOM 0 H ASN A 38 67.560 -8.312 21.245 1.00 0.00 H new ATOM 0 HA ASN A 38 68.787 -9.987 19.188 1.00 0.00 H new ATOM 0 HB2 ASN A 38 69.910 -8.641 21.692 1.00 0.00 H new ATOM 0 HB3 ASN A 38 70.866 -9.451 20.466 1.00 0.00 H new ATOM 0 HD21 ASN A 38 70.341 -5.623 19.814 1.00 0.00 H new ATOM 0 HD22 ASN A 38 70.587 -6.465 21.348 1.00 0.00 H new ATOM 623 N ASP A 39 69.591 -11.969 20.661 1.00 0.00 N ATOM 624 CA ASP A 39 69.685 -13.246 21.359 1.00 0.00 C ATOM 625 C ASP A 39 70.096 -13.032 22.813 1.00 0.00 C ATOM 626 O ASP A 39 69.749 -13.822 23.690 1.00 0.00 O ATOM 627 CB ASP A 39 70.709 -14.146 20.666 1.00 0.00 C ATOM 628 CG ASP A 39 70.660 -15.548 21.264 1.00 0.00 C ATOM 629 OD1 ASP A 39 69.624 -16.183 21.152 1.00 0.00 O ATOM 630 OD2 ASP A 39 71.660 -15.966 21.826 1.00 0.00 O ATOM 0 H ASP A 39 70.220 -11.872 19.864 1.00 0.00 H new ATOM 0 HA ASP A 39 68.706 -13.725 21.335 1.00 0.00 H new ATOM 0 HB2 ASP A 39 70.502 -14.190 19.597 1.00 0.00 H new ATOM 0 HB3 ASP A 39 71.709 -13.728 20.780 1.00 0.00 H new ATOM 635 N GLU A 40 70.837 -11.956 23.061 1.00 0.00 N ATOM 636 CA GLU A 40 71.289 -11.647 24.412 1.00 0.00 C ATOM 637 C GLU A 40 70.099 -11.401 25.333 1.00 0.00 C ATOM 638 O GLU A 40 70.227 -11.452 26.556 1.00 0.00 O ATOM 639 CB GLU A 40 72.187 -10.408 24.391 1.00 0.00 C ATOM 640 CG GLU A 40 73.481 -10.726 23.640 1.00 0.00 C ATOM 641 CD GLU A 40 74.263 -9.442 23.383 1.00 0.00 C ATOM 642 OE1 GLU A 40 73.666 -8.382 23.461 1.00 0.00 O ATOM 643 OE2 GLU A 40 75.449 -9.539 23.114 1.00 0.00 O ATOM 0 H GLU A 40 71.135 -11.289 22.350 1.00 0.00 H new ATOM 0 HA GLU A 40 71.854 -12.499 24.790 1.00 0.00 H new ATOM 0 HB2 GLU A 40 71.669 -9.579 23.909 1.00 0.00 H new ATOM 0 HB3 GLU A 40 72.414 -10.093 25.410 1.00 0.00 H new ATOM 0 HG2 GLU A 40 74.087 -11.421 24.221 1.00 0.00 H new ATOM 0 HG3 GLU A 40 73.251 -11.217 22.694 1.00 0.00 H new ATOM 650 N GLY A 41 68.941 -11.135 24.736 1.00 0.00 N ATOM 651 CA GLY A 41 67.733 -10.883 25.513 1.00 0.00 C ATOM 652 C GLY A 41 67.395 -9.396 25.527 1.00 0.00 C ATOM 653 O GLY A 41 66.494 -8.961 26.245 1.00 0.00 O ATOM 0 H GLY A 41 68.814 -11.089 23.725 1.00 0.00 H new ATOM 0 HA2 GLY A 41 66.900 -11.445 25.091 1.00 0.00 H new ATOM 0 HA3 GLY A 41 67.872 -11.238 26.534 1.00 0.00 H new ATOM 657 N THR A 42 68.123 -8.621 24.730 1.00 0.00 N ATOM 658 CA THR A 42 67.890 -7.183 24.660 1.00 0.00 C ATOM 659 C THR A 42 66.729 -6.874 23.721 1.00 0.00 C ATOM 660 O THR A 42 66.831 -7.061 22.508 1.00 0.00 O ATOM 661 CB THR A 42 69.153 -6.474 24.163 1.00 0.00 C ATOM 662 OG1 THR A 42 70.054 -6.301 25.247 1.00 0.00 O ATOM 663 CG2 THR A 42 68.780 -5.109 23.585 1.00 0.00 C ATOM 0 H THR A 42 68.873 -8.961 24.128 1.00 0.00 H new ATOM 0 HA THR A 42 67.640 -6.825 25.659 1.00 0.00 H new ATOM 0 HB THR A 42 69.627 -7.076 23.388 1.00 0.00 H new ATOM 0 HG1 THR A 42 70.864 -5.849 24.930 1.00 0.00 H new ATOM 0 HG21 THR A 42 69.680 -4.605 23.232 1.00 0.00 H new ATOM 0 HG22 THR A 42 68.089 -5.243 22.753 1.00 0.00 H new ATOM 0 HG23 THR A 42 68.305 -4.504 24.358 1.00 0.00 H new ATOM 671 N GLU A 43 65.626 -6.398 24.289 1.00 0.00 N ATOM 672 CA GLU A 43 64.451 -6.067 23.493 1.00 0.00 C ATOM 673 C GLU A 43 64.603 -4.686 22.861 1.00 0.00 C ATOM 674 O GLU A 43 64.498 -3.666 23.542 1.00 0.00 O ATOM 675 CB GLU A 43 63.199 -6.091 24.373 1.00 0.00 C ATOM 676 CG GLU A 43 62.857 -7.538 24.734 1.00 0.00 C ATOM 677 CD GLU A 43 61.738 -7.566 25.770 1.00 0.00 C ATOM 678 OE1 GLU A 43 61.489 -6.535 26.371 1.00 0.00 O ATOM 679 OE2 GLU A 43 61.147 -8.618 25.945 1.00 0.00 O ATOM 0 H GLU A 43 65.522 -6.234 25.290 1.00 0.00 H new ATOM 0 HA GLU A 43 64.353 -6.809 22.701 1.00 0.00 H new ATOM 0 HB2 GLU A 43 63.367 -5.509 25.279 1.00 0.00 H new ATOM 0 HB3 GLU A 43 62.363 -5.629 23.848 1.00 0.00 H new ATOM 0 HG2 GLU A 43 62.550 -8.082 23.840 1.00 0.00 H new ATOM 0 HG3 GLU A 43 63.740 -8.042 25.127 1.00 0.00 H new ATOM 686 N ALA A 44 64.851 -4.663 21.556 1.00 0.00 N ATOM 687 CA ALA A 44 65.017 -3.402 20.842 1.00 0.00 C ATOM 688 C ALA A 44 63.713 -2.997 20.163 1.00 0.00 C ATOM 689 O ALA A 44 63.513 -3.256 18.976 1.00 0.00 O ATOM 690 CB ALA A 44 66.121 -3.537 19.793 1.00 0.00 C ATOM 0 H ALA A 44 64.941 -5.496 20.975 1.00 0.00 H new ATOM 0 HA ALA A 44 65.294 -2.631 21.562 1.00 0.00 H new ATOM 0 HB1 ALA A 44 66.238 -2.591 19.264 1.00 0.00 H new ATOM 0 HB2 ALA A 44 67.059 -3.798 20.283 1.00 0.00 H new ATOM 0 HB3 ALA A 44 65.854 -4.319 19.082 1.00 0.00 H new ATOM 696 N GLU A 45 62.829 -2.359 20.923 1.00 0.00 N ATOM 697 CA GLU A 45 61.547 -1.922 20.383 1.00 0.00 C ATOM 698 C GLU A 45 61.717 -1.390 18.963 1.00 0.00 C ATOM 699 O GLU A 45 62.471 -0.445 18.730 1.00 0.00 O ATOM 700 CB GLU A 45 60.948 -0.832 21.272 1.00 0.00 C ATOM 701 CG GLU A 45 60.450 -1.454 22.573 1.00 0.00 C ATOM 702 CD GLU A 45 60.040 -0.359 23.552 1.00 0.00 C ATOM 703 OE1 GLU A 45 59.383 -0.680 24.528 1.00 0.00 O ATOM 704 OE2 GLU A 45 60.388 0.785 23.311 1.00 0.00 O ATOM 0 H GLU A 45 62.975 -2.134 21.907 1.00 0.00 H new ATOM 0 HA GLU A 45 60.874 -2.779 20.359 1.00 0.00 H new ATOM 0 HB2 GLU A 45 61.697 -0.069 21.484 1.00 0.00 H new ATOM 0 HB3 GLU A 45 60.126 -0.337 20.755 1.00 0.00 H new ATOM 0 HG2 GLU A 45 59.602 -2.109 22.371 1.00 0.00 H new ATOM 0 HG3 GLU A 45 61.233 -2.072 23.013 1.00 0.00 H new ATOM 711 N ALA A 46 61.012 -2.004 18.018 1.00 0.00 N ATOM 712 CA ALA A 46 61.093 -1.583 16.624 1.00 0.00 C ATOM 713 C ALA A 46 60.458 -0.208 16.442 1.00 0.00 C ATOM 714 O ALA A 46 60.283 0.261 15.317 1.00 0.00 O ATOM 715 CB ALA A 46 60.380 -2.599 15.731 1.00 0.00 C ATOM 0 H ALA A 46 60.383 -2.788 18.190 1.00 0.00 H new ATOM 0 HA ALA A 46 62.144 -1.525 16.341 1.00 0.00 H new ATOM 0 HB1 ALA A 46 60.445 -2.278 14.691 1.00 0.00 H new ATOM 0 HB2 ALA A 46 60.854 -3.575 15.840 1.00 0.00 H new ATOM 0 HB3 ALA A 46 59.333 -2.670 16.025 1.00 0.00 H new ATOM 721 N ASN A 47 60.117 0.432 17.555 1.00 0.00 N ATOM 722 CA ASN A 47 59.502 1.754 17.506 1.00 0.00 C ATOM 723 C ASN A 47 60.254 2.728 18.407 1.00 0.00 C ATOM 724 O ASN A 47 59.657 3.625 19.003 1.00 0.00 O ATOM 725 CB ASN A 47 58.041 1.667 17.951 1.00 0.00 C ATOM 726 CG ASN A 47 57.501 0.263 17.699 1.00 0.00 C ATOM 727 OD1 ASN A 47 58.117 -0.722 18.107 1.00 0.00 O ATOM 728 ND2 ASN A 47 56.381 0.112 17.048 1.00 0.00 N ATOM 0 H ASN A 47 60.254 0.061 18.495 1.00 0.00 H new ATOM 0 HA ASN A 47 59.547 2.118 16.480 1.00 0.00 H new ATOM 0 HB2 ASN A 47 57.960 1.912 19.010 1.00 0.00 H new ATOM 0 HB3 ASN A 47 57.443 2.398 17.408 1.00 0.00 H new ATOM 0 HD21 ASN A 47 56.013 -0.824 16.876 1.00 0.00 H new ATOM 0 HD22 ASN A 47 55.873 0.930 16.711 1.00 0.00 H new ATOM 735 N SER A 48 61.566 2.546 18.502 1.00 0.00 N ATOM 736 CA SER A 48 62.390 3.415 19.334 1.00 0.00 C ATOM 737 C SER A 48 63.798 3.532 18.759 1.00 0.00 C ATOM 738 O SER A 48 64.443 2.527 18.461 1.00 0.00 O ATOM 739 CB SER A 48 62.464 2.860 20.756 1.00 0.00 C ATOM 740 OG SER A 48 63.448 3.576 21.490 1.00 0.00 O ATOM 0 H SER A 48 62.079 1.810 18.017 1.00 0.00 H new ATOM 0 HA SER A 48 61.934 4.405 19.353 1.00 0.00 H new ATOM 0 HB2 SER A 48 61.494 2.949 21.244 1.00 0.00 H new ATOM 0 HB3 SER A 48 62.712 1.799 20.732 1.00 0.00 H new ATOM 0 HG SER A 48 63.496 3.223 22.403 1.00 0.00 H new ATOM 746 N VAL A 49 64.267 4.766 18.604 1.00 0.00 N ATOM 747 CA VAL A 49 65.601 5.003 18.063 1.00 0.00 C ATOM 748 C VAL A 49 66.667 4.479 19.018 1.00 0.00 C ATOM 749 O VAL A 49 67.732 4.031 18.592 1.00 0.00 O ATOM 750 CB VAL A 49 65.812 6.499 17.830 1.00 0.00 C ATOM 751 CG1 VAL A 49 64.913 6.971 16.687 1.00 0.00 C ATOM 752 CG2 VAL A 49 65.456 7.268 19.106 1.00 0.00 C ATOM 0 H VAL A 49 63.748 5.611 18.843 1.00 0.00 H new ATOM 0 HA VAL A 49 65.687 4.473 17.115 1.00 0.00 H new ATOM 0 HB VAL A 49 66.855 6.682 17.571 1.00 0.00 H new ATOM 0 HG11 VAL A 49 65.064 8.038 16.522 1.00 0.00 H new ATOM 0 HG12 VAL A 49 65.163 6.424 15.778 1.00 0.00 H new ATOM 0 HG13 VAL A 49 63.870 6.788 16.945 1.00 0.00 H new ATOM 0 HG21 VAL A 49 65.606 8.335 18.942 1.00 0.00 H new ATOM 0 HG22 VAL A 49 64.413 7.083 19.363 1.00 0.00 H new ATOM 0 HG23 VAL A 49 66.095 6.933 19.923 1.00 0.00 H new ATOM 762 N ILE A 50 66.375 4.538 20.313 1.00 0.00 N ATOM 763 CA ILE A 50 67.316 4.066 21.322 1.00 0.00 C ATOM 764 C ILE A 50 67.612 2.583 21.127 1.00 0.00 C ATOM 765 O ILE A 50 68.746 2.138 21.300 1.00 0.00 O ATOM 766 CB ILE A 50 66.742 4.295 22.721 1.00 0.00 C ATOM 767 CG1 ILE A 50 66.661 5.798 22.998 1.00 0.00 C ATOM 768 CG2 ILE A 50 67.650 3.636 23.760 1.00 0.00 C ATOM 769 CD1 ILE A 50 65.765 6.046 24.213 1.00 0.00 C ATOM 0 H ILE A 50 65.500 4.906 20.687 1.00 0.00 H new ATOM 0 HA ILE A 50 68.245 4.627 21.215 1.00 0.00 H new ATOM 0 HB ILE A 50 65.745 3.858 22.780 1.00 0.00 H new ATOM 0 HG12 ILE A 50 67.658 6.199 23.180 1.00 0.00 H new ATOM 0 HG13 ILE A 50 66.263 6.318 22.127 1.00 0.00 H new ATOM 0 HG21 ILE A 50 67.241 3.799 24.757 1.00 0.00 H new ATOM 0 HG22 ILE A 50 67.711 2.566 23.564 1.00 0.00 H new ATOM 0 HG23 ILE A 50 68.647 4.073 23.701 1.00 0.00 H new ATOM 0 HD11 ILE A 50 65.707 7.116 24.410 1.00 0.00 H new ATOM 0 HD12 ILE A 50 64.766 5.660 24.013 1.00 0.00 H new ATOM 0 HD13 ILE A 50 66.183 5.539 25.083 1.00 0.00 H new ATOM 781 N ALA A 51 66.583 1.822 20.767 1.00 0.00 N ATOM 782 CA ALA A 51 66.743 0.389 20.552 1.00 0.00 C ATOM 783 C ALA A 51 67.605 0.125 19.321 1.00 0.00 C ATOM 784 O ALA A 51 68.421 -0.796 19.310 1.00 0.00 O ATOM 785 CB ALA A 51 65.374 -0.268 20.369 1.00 0.00 C ATOM 0 H ALA A 51 65.636 2.171 20.619 1.00 0.00 H new ATOM 0 HA ALA A 51 67.236 -0.038 21.425 1.00 0.00 H new ATOM 0 HB1 ALA A 51 65.503 -1.338 20.209 1.00 0.00 H new ATOM 0 HB2 ALA A 51 64.770 -0.105 21.261 1.00 0.00 H new ATOM 0 HB3 ALA A 51 64.873 0.170 19.506 1.00 0.00 H new ATOM 791 N LEU A 52 67.417 0.940 18.288 1.00 0.00 N ATOM 792 CA LEU A 52 68.184 0.784 17.058 1.00 0.00 C ATOM 793 C LEU A 52 69.678 0.897 17.339 1.00 0.00 C ATOM 794 O LEU A 52 70.482 0.147 16.785 1.00 0.00 O ATOM 795 CB LEU A 52 67.770 1.855 16.046 1.00 0.00 C ATOM 796 CG LEU A 52 68.530 1.641 14.736 1.00 0.00 C ATOM 797 CD1 LEU A 52 68.200 0.258 14.174 1.00 0.00 C ATOM 798 CD2 LEU A 52 68.114 2.713 13.725 1.00 0.00 C ATOM 0 H LEU A 52 66.746 1.708 18.278 1.00 0.00 H new ATOM 0 HA LEU A 52 67.978 -0.204 16.647 1.00 0.00 H new ATOM 0 HB2 LEU A 52 66.696 1.806 15.868 1.00 0.00 H new ATOM 0 HB3 LEU A 52 67.982 2.847 16.444 1.00 0.00 H new ATOM 0 HG LEU A 52 69.602 1.711 14.923 1.00 0.00 H new ATOM 0 HD11 LEU A 52 68.742 0.106 13.240 1.00 0.00 H new ATOM 0 HD12 LEU A 52 68.494 -0.507 14.893 1.00 0.00 H new ATOM 0 HD13 LEU A 52 67.128 0.187 13.987 1.00 0.00 H new ATOM 0 HD21 LEU A 52 68.655 2.562 12.791 1.00 0.00 H new ATOM 0 HD22 LEU A 52 67.042 2.642 13.539 1.00 0.00 H new ATOM 0 HD23 LEU A 52 68.348 3.700 14.124 1.00 0.00 H new ATOM 810 N LEU A 53 70.043 1.838 18.203 1.00 0.00 N ATOM 811 CA LEU A 53 71.444 2.041 18.551 1.00 0.00 C ATOM 812 C LEU A 53 72.031 0.776 19.169 1.00 0.00 C ATOM 813 O LEU A 53 73.185 0.427 18.915 1.00 0.00 O ATOM 814 CB LEU A 53 71.576 3.202 19.538 1.00 0.00 C ATOM 815 CG LEU A 53 73.052 3.425 19.871 1.00 0.00 C ATOM 816 CD1 LEU A 53 73.809 3.810 18.600 1.00 0.00 C ATOM 817 CD2 LEU A 53 73.176 4.551 20.899 1.00 0.00 C ATOM 0 H LEU A 53 69.393 2.468 18.672 1.00 0.00 H new ATOM 0 HA LEU A 53 71.994 2.276 17.640 1.00 0.00 H new ATOM 0 HB2 LEU A 53 71.148 4.108 19.109 1.00 0.00 H new ATOM 0 HB3 LEU A 53 71.016 2.985 20.448 1.00 0.00 H new ATOM 0 HG LEU A 53 73.475 2.508 20.282 1.00 0.00 H new ATOM 0 HD11 LEU A 53 74.861 3.969 18.837 1.00 0.00 H new ATOM 0 HD12 LEU A 53 73.719 3.009 17.866 1.00 0.00 H new ATOM 0 HD13 LEU A 53 73.387 4.727 18.189 1.00 0.00 H new ATOM 0 HD21 LEU A 53 74.227 4.712 21.138 1.00 0.00 H new ATOM 0 HD22 LEU A 53 72.753 5.468 20.487 1.00 0.00 H new ATOM 0 HD23 LEU A 53 72.636 4.277 21.805 1.00 0.00 H new ATOM 829 N MET A 54 71.230 0.094 19.981 1.00 0.00 N ATOM 830 CA MET A 54 71.682 -1.133 20.629 1.00 0.00 C ATOM 831 C MET A 54 71.837 -2.254 19.608 1.00 0.00 C ATOM 832 O MET A 54 72.740 -3.083 19.715 1.00 0.00 O ATOM 833 CB MET A 54 70.679 -1.554 21.705 1.00 0.00 C ATOM 834 CG MET A 54 70.664 -0.513 22.826 1.00 0.00 C ATOM 835 SD MET A 54 69.403 -0.959 24.046 1.00 0.00 S ATOM 836 CE MET A 54 70.386 -2.179 24.953 1.00 0.00 C ATOM 0 H MET A 54 70.273 0.366 20.205 1.00 0.00 H new ATOM 0 HA MET A 54 72.651 -0.942 21.090 1.00 0.00 H new ATOM 0 HB2 MET A 54 69.684 -1.651 21.271 1.00 0.00 H new ATOM 0 HB3 MET A 54 70.948 -2.531 22.106 1.00 0.00 H new ATOM 0 HG2 MET A 54 71.643 -0.461 23.302 1.00 0.00 H new ATOM 0 HG3 MET A 54 70.456 0.475 22.416 1.00 0.00 H new ATOM 0 HE1 MET A 54 69.745 -3.004 25.265 1.00 0.00 H new ATOM 0 HE2 MET A 54 71.179 -2.559 24.309 1.00 0.00 H new ATOM 0 HE3 MET A 54 70.827 -1.710 25.833 1.00 0.00 H new ATOM 846 N LEU A 55 70.950 -2.274 18.618 1.00 0.00 N ATOM 847 CA LEU A 55 70.999 -3.299 17.583 1.00 0.00 C ATOM 848 C LEU A 55 72.278 -3.172 16.762 1.00 0.00 C ATOM 849 O LEU A 55 72.769 -4.153 16.204 1.00 0.00 O ATOM 850 CB LEU A 55 69.784 -3.169 16.662 1.00 0.00 C ATOM 851 CG LEU A 55 68.511 -3.489 17.447 1.00 0.00 C ATOM 852 CD1 LEU A 55 67.287 -3.190 16.580 1.00 0.00 C ATOM 853 CD2 LEU A 55 68.511 -4.969 17.836 1.00 0.00 C ATOM 0 H LEU A 55 70.194 -1.597 18.511 1.00 0.00 H new ATOM 0 HA LEU A 55 70.987 -4.276 18.065 1.00 0.00 H new ATOM 0 HB2 LEU A 55 69.729 -2.159 16.256 1.00 0.00 H new ATOM 0 HB3 LEU A 55 69.882 -3.848 15.815 1.00 0.00 H new ATOM 0 HG LEU A 55 68.476 -2.876 18.347 1.00 0.00 H new ATOM 0 HD11 LEU A 55 66.380 -3.418 17.140 1.00 0.00 H new ATOM 0 HD12 LEU A 55 67.286 -2.136 16.302 1.00 0.00 H new ATOM 0 HD13 LEU A 55 67.321 -3.802 15.679 1.00 0.00 H new ATOM 0 HD21 LEU A 55 67.604 -5.198 18.396 1.00 0.00 H new ATOM 0 HD22 LEU A 55 68.546 -5.582 16.935 1.00 0.00 H new ATOM 0 HD23 LEU A 55 69.383 -5.183 18.455 1.00 0.00 H new ATOM 865 N ASP A 56 72.813 -1.958 16.693 1.00 0.00 N ATOM 866 CA ASP A 56 74.036 -1.713 15.938 1.00 0.00 C ATOM 867 C ASP A 56 75.143 -2.661 16.389 1.00 0.00 C ATOM 868 O ASP A 56 75.944 -3.125 15.578 1.00 0.00 O ATOM 869 CB ASP A 56 74.490 -0.266 16.132 1.00 0.00 C ATOM 870 CG ASP A 56 73.562 0.678 15.374 1.00 0.00 C ATOM 871 OD1 ASP A 56 72.763 0.190 14.591 1.00 0.00 O ATOM 872 OD2 ASP A 56 73.665 1.874 15.586 1.00 0.00 O ATOM 0 H ASP A 56 72.422 -1.133 17.148 1.00 0.00 H new ATOM 0 HA ASP A 56 73.830 -1.889 14.882 1.00 0.00 H new ATOM 0 HB2 ASP A 56 74.490 -0.015 17.193 1.00 0.00 H new ATOM 0 HB3 ASP A 56 75.513 -0.146 15.776 1.00 0.00 H new ATOM 877 N SER A 57 75.179 -2.944 17.687 1.00 0.00 N ATOM 878 CA SER A 57 76.192 -3.838 18.236 1.00 0.00 C ATOM 879 C SER A 57 75.838 -5.293 17.942 1.00 0.00 C ATOM 880 O SER A 57 76.553 -6.209 18.348 1.00 0.00 O ATOM 881 CB SER A 57 76.306 -3.634 19.746 1.00 0.00 C ATOM 882 OG SER A 57 75.100 -4.056 20.369 1.00 0.00 O ATOM 0 H SER A 57 74.524 -2.571 18.374 1.00 0.00 H new ATOM 0 HA SER A 57 77.148 -3.606 17.766 1.00 0.00 H new ATOM 0 HB2 SER A 57 77.150 -4.202 20.139 1.00 0.00 H new ATOM 0 HB3 SER A 57 76.496 -2.584 19.969 1.00 0.00 H new ATOM 0 HG SER A 57 74.374 -3.445 20.124 1.00 0.00 H new ATOM 888 N ALA A 58 74.732 -5.496 17.234 1.00 0.00 N ATOM 889 CA ALA A 58 74.293 -6.845 16.892 1.00 0.00 C ATOM 890 C ALA A 58 75.030 -7.351 15.656 1.00 0.00 C ATOM 891 O ALA A 58 74.545 -8.236 14.951 1.00 0.00 O ATOM 892 CB ALA A 58 72.787 -6.852 16.628 1.00 0.00 C ATOM 0 H ALA A 58 74.127 -4.751 16.888 1.00 0.00 H new ATOM 0 HA ALA A 58 74.518 -7.504 17.731 1.00 0.00 H new ATOM 0 HB1 ALA A 58 72.467 -7.862 16.373 1.00 0.00 H new ATOM 0 HB2 ALA A 58 72.259 -6.519 17.522 1.00 0.00 H new ATOM 0 HB3 ALA A 58 72.560 -6.180 15.800 1.00 0.00 H new ATOM 898 N LYS A 59 76.205 -6.784 15.400 1.00 0.00 N ATOM 899 CA LYS A 59 77.001 -7.186 14.246 1.00 0.00 C ATOM 900 C LYS A 59 77.594 -8.575 14.463 1.00 0.00 C ATOM 901 O LYS A 59 78.634 -8.722 15.105 1.00 0.00 O ATOM 902 CB LYS A 59 78.128 -6.178 14.011 1.00 0.00 C ATOM 903 CG LYS A 59 77.576 -4.959 13.269 1.00 0.00 C ATOM 904 CD LYS A 59 78.702 -3.953 13.031 1.00 0.00 C ATOM 905 CE LYS A 59 78.148 -2.728 12.301 1.00 0.00 C ATOM 906 NZ LYS A 59 79.246 -1.745 12.074 1.00 0.00 N ATOM 0 H LYS A 59 76.624 -6.050 15.971 1.00 0.00 H new ATOM 0 HA LYS A 59 76.351 -7.213 13.371 1.00 0.00 H new ATOM 0 HB2 LYS A 59 78.561 -5.872 14.963 1.00 0.00 H new ATOM 0 HB3 LYS A 59 78.927 -6.639 13.431 1.00 0.00 H new ATOM 0 HG2 LYS A 59 77.141 -5.265 12.318 1.00 0.00 H new ATOM 0 HG3 LYS A 59 76.778 -4.497 13.850 1.00 0.00 H new ATOM 0 HD2 LYS A 59 79.143 -3.654 13.982 1.00 0.00 H new ATOM 0 HD3 LYS A 59 79.496 -4.412 12.442 1.00 0.00 H new ATOM 0 HE2 LYS A 59 77.710 -3.026 11.348 1.00 0.00 H new ATOM 0 HE3 LYS A 59 77.352 -2.271 12.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 78.869 -0.912 11.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 79.644 -1.452 12.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 79.991 -2.184 11.497 1.00 0.00 H new ATOM 920 N GLY A 60 76.927 -9.589 13.924 1.00 0.00 N ATOM 921 CA GLY A 60 77.398 -10.962 14.064 1.00 0.00 C ATOM 922 C GLY A 60 76.573 -11.717 15.100 1.00 0.00 C ATOM 923 O GLY A 60 76.879 -12.860 15.439 1.00 0.00 O ATOM 0 H GLY A 60 76.064 -9.488 13.389 1.00 0.00 H new ATOM 0 HA2 GLY A 60 77.336 -11.472 13.102 1.00 0.00 H new ATOM 0 HA3 GLY A 60 78.448 -10.962 14.358 1.00 0.00 H new ATOM 927 N ARG A 61 75.525 -11.070 15.601 1.00 0.00 N ATOM 928 CA ARG A 61 74.663 -11.690 16.599 1.00 0.00 C ATOM 929 C ARG A 61 73.311 -12.048 15.991 1.00 0.00 C ATOM 930 O ARG A 61 72.923 -11.508 14.954 1.00 0.00 O ATOM 931 CB ARG A 61 74.456 -10.737 17.777 1.00 0.00 C ATOM 932 CG ARG A 61 75.815 -10.354 18.369 1.00 0.00 C ATOM 933 CD ARG A 61 75.794 -10.580 19.882 1.00 0.00 C ATOM 934 NE ARG A 61 75.685 -12.003 20.179 1.00 0.00 N ATOM 935 CZ ARG A 61 75.707 -12.448 21.430 1.00 0.00 C ATOM 936 NH1 ARG A 61 75.607 -13.727 21.670 1.00 0.00 N ATOM 937 NH2 ARG A 61 75.828 -11.606 22.420 1.00 0.00 N ATOM 0 H ARG A 61 75.254 -10.123 15.334 1.00 0.00 H new ATOM 0 HA ARG A 61 75.145 -12.602 16.950 1.00 0.00 H new ATOM 0 HB2 ARG A 61 73.926 -9.843 17.447 1.00 0.00 H new ATOM 0 HB3 ARG A 61 73.837 -11.212 18.538 1.00 0.00 H new ATOM 0 HG2 ARG A 61 76.604 -10.951 17.912 1.00 0.00 H new ATOM 0 HG3 ARG A 61 76.038 -9.310 18.150 1.00 0.00 H new ATOM 0 HD2 ARG A 61 76.702 -10.177 20.330 1.00 0.00 H new ATOM 0 HD3 ARG A 61 74.955 -10.044 20.325 1.00 0.00 H new ATOM 0 HE ARG A 61 75.590 -12.669 19.412 1.00 0.00 H new ATOM 0 HH11 ARG A 61 75.512 -14.385 20.897 1.00 0.00 H new ATOM 0 HH12 ARG A 61 75.624 -14.068 22.631 1.00 0.00 H new ATOM 0 HH21 ARG A 61 75.906 -10.606 22.233 1.00 0.00 H new ATOM 0 HH22 ARG A 61 75.845 -11.948 23.381 1.00 0.00 H new ATOM 951 N GLN A 62 72.598 -12.961 16.641 1.00 0.00 N ATOM 952 CA GLN A 62 71.289 -13.384 16.154 1.00 0.00 C ATOM 953 C GLN A 62 70.182 -12.576 16.824 1.00 0.00 C ATOM 954 O GLN A 62 70.290 -12.208 17.993 1.00 0.00 O ATOM 955 CB GLN A 62 71.081 -14.873 16.440 1.00 0.00 C ATOM 956 CG GLN A 62 72.033 -15.698 15.571 1.00 0.00 C ATOM 957 CD GLN A 62 71.953 -17.169 15.962 1.00 0.00 C ATOM 958 OE1 GLN A 62 71.661 -17.491 17.113 1.00 0.00 O ATOM 959 NE2 GLN A 62 72.200 -18.086 15.066 1.00 0.00 N ATOM 0 H GLN A 62 72.901 -13.420 17.500 1.00 0.00 H new ATOM 0 HA GLN A 62 71.249 -13.212 15.078 1.00 0.00 H new ATOM 0 HB2 GLN A 62 71.262 -15.080 17.495 1.00 0.00 H new ATOM 0 HB3 GLN A 62 70.048 -15.153 16.233 1.00 0.00 H new ATOM 0 HG2 GLN A 62 71.774 -15.578 14.519 1.00 0.00 H new ATOM 0 HG3 GLN A 62 73.054 -15.336 15.691 1.00 0.00 H new ATOM 0 HE21 GLN A 62 72.442 -17.816 14.113 1.00 0.00 H new ATOM 0 HE22 GLN A 62 72.151 -19.073 15.319 1.00 0.00 H new ATOM 968 N ILE A 63 69.119 -12.304 16.074 1.00 0.00 N ATOM 969 CA ILE A 63 67.997 -11.538 16.606 1.00 0.00 C ATOM 970 C ILE A 63 66.675 -12.215 16.261 1.00 0.00 C ATOM 971 O ILE A 63 66.614 -13.069 15.377 1.00 0.00 O ATOM 972 CB ILE A 63 68.013 -10.122 16.030 1.00 0.00 C ATOM 973 CG1 ILE A 63 67.738 -10.181 14.526 1.00 0.00 C ATOM 974 CG2 ILE A 63 69.384 -9.486 16.272 1.00 0.00 C ATOM 975 CD1 ILE A 63 67.750 -8.764 13.949 1.00 0.00 C ATOM 0 H ILE A 63 69.011 -12.600 15.104 1.00 0.00 H new ATOM 0 HA ILE A 63 68.095 -11.490 17.691 1.00 0.00 H new ATOM 0 HB ILE A 63 67.244 -9.523 16.518 1.00 0.00 H new ATOM 0 HG12 ILE A 63 68.492 -10.793 14.031 1.00 0.00 H new ATOM 0 HG13 ILE A 63 66.773 -10.653 14.340 1.00 0.00 H new ATOM 0 HG21 ILE A 63 69.394 -8.477 15.861 1.00 0.00 H new ATOM 0 HG22 ILE A 63 69.582 -9.444 17.343 1.00 0.00 H new ATOM 0 HG23 ILE A 63 70.154 -10.084 15.784 1.00 0.00 H new ATOM 0 HD11 ILE A 63 67.554 -8.806 12.878 1.00 0.00 H new ATOM 0 HD12 ILE A 63 66.979 -8.166 14.436 1.00 0.00 H new ATOM 0 HD13 ILE A 63 68.725 -8.309 14.122 1.00 0.00 H new ATOM 987 N GLU A 64 65.616 -11.826 16.965 1.00 0.00 N ATOM 988 CA GLU A 64 64.297 -12.402 16.725 1.00 0.00 C ATOM 989 C GLU A 64 63.298 -11.313 16.349 1.00 0.00 C ATOM 990 O GLU A 64 62.873 -10.527 17.196 1.00 0.00 O ATOM 991 CB GLU A 64 63.811 -13.134 17.977 1.00 0.00 C ATOM 992 CG GLU A 64 64.985 -13.863 18.633 1.00 0.00 C ATOM 993 CD GLU A 64 64.485 -14.728 19.783 1.00 0.00 C ATOM 994 OE1 GLU A 64 63.908 -15.768 19.510 1.00 0.00 O ATOM 995 OE2 GLU A 64 64.685 -14.339 20.923 1.00 0.00 O ATOM 0 H GLU A 64 65.644 -11.120 17.701 1.00 0.00 H new ATOM 0 HA GLU A 64 64.374 -13.109 15.899 1.00 0.00 H new ATOM 0 HB2 GLU A 64 63.373 -12.424 18.679 1.00 0.00 H new ATOM 0 HB3 GLU A 64 63.029 -13.846 17.714 1.00 0.00 H new ATOM 0 HG2 GLU A 64 65.496 -14.483 17.896 1.00 0.00 H new ATOM 0 HG3 GLU A 64 65.713 -13.140 19.001 1.00 0.00 H new ATOM 1002 N VAL A 65 62.925 -11.273 15.074 1.00 0.00 N ATOM 1003 CA VAL A 65 61.974 -10.276 14.596 1.00 0.00 C ATOM 1004 C VAL A 65 60.543 -10.765 14.792 1.00 0.00 C ATOM 1005 O VAL A 65 60.177 -11.845 14.330 1.00 0.00 O ATOM 1006 CB VAL A 65 62.220 -9.989 13.114 1.00 0.00 C ATOM 1007 CG1 VAL A 65 61.494 -8.702 12.716 1.00 0.00 C ATOM 1008 CG2 VAL A 65 63.721 -9.823 12.869 1.00 0.00 C ATOM 0 H VAL A 65 63.264 -11.915 14.357 1.00 0.00 H new ATOM 0 HA VAL A 65 62.115 -9.361 15.171 1.00 0.00 H new ATOM 0 HB VAL A 65 61.843 -10.819 12.516 1.00 0.00 H new ATOM 0 HG11 VAL A 65 61.669 -8.497 11.660 1.00 0.00 H new ATOM 0 HG12 VAL A 65 60.424 -8.819 12.890 1.00 0.00 H new ATOM 0 HG13 VAL A 65 61.871 -7.872 13.314 1.00 0.00 H new ATOM 0 HG21 VAL A 65 63.897 -9.618 11.813 1.00 0.00 H new ATOM 0 HG22 VAL A 65 64.098 -8.993 13.467 1.00 0.00 H new ATOM 0 HG23 VAL A 65 64.239 -10.739 13.152 1.00 0.00 H new ATOM 1018 N GLU A 66 59.738 -9.961 15.479 1.00 0.00 N ATOM 1019 CA GLU A 66 58.347 -10.322 15.730 1.00 0.00 C ATOM 1020 C GLU A 66 57.413 -9.206 15.274 1.00 0.00 C ATOM 1021 O GLU A 66 57.729 -8.024 15.410 1.00 0.00 O ATOM 1022 CB GLU A 66 58.138 -10.588 17.222 1.00 0.00 C ATOM 1023 CG GLU A 66 56.650 -10.816 17.496 1.00 0.00 C ATOM 1024 CD GLU A 66 56.459 -11.376 18.902 1.00 0.00 C ATOM 1025 OE1 GLU A 66 57.452 -11.551 19.588 1.00 0.00 O ATOM 1026 OE2 GLU A 66 55.323 -11.621 19.271 1.00 0.00 O ATOM 0 H GLU A 66 60.022 -9.062 15.869 1.00 0.00 H new ATOM 0 HA GLU A 66 58.118 -11.225 15.165 1.00 0.00 H new ATOM 0 HB2 GLU A 66 58.713 -11.461 17.531 1.00 0.00 H new ATOM 0 HB3 GLU A 66 58.501 -9.743 17.807 1.00 0.00 H new ATOM 0 HG2 GLU A 66 56.105 -9.878 17.392 1.00 0.00 H new ATOM 0 HG3 GLU A 66 56.238 -11.508 16.761 1.00 0.00 H new ATOM 1033 N ALA A 67 56.262 -9.589 14.732 1.00 0.00 N ATOM 1034 CA ALA A 67 55.289 -8.611 14.259 1.00 0.00 C ATOM 1035 C ALA A 67 53.868 -9.097 14.526 1.00 0.00 C ATOM 1036 O ALA A 67 53.589 -10.295 14.465 1.00 0.00 O ATOM 1037 CB ALA A 67 55.475 -8.372 12.760 1.00 0.00 C ATOM 0 H ALA A 67 55.981 -10.562 14.610 1.00 0.00 H new ATOM 0 HA ALA A 67 55.449 -7.677 14.798 1.00 0.00 H new ATOM 0 HB1 ALA A 67 54.744 -7.640 12.415 1.00 0.00 H new ATOM 0 HB2 ALA A 67 56.481 -7.996 12.574 1.00 0.00 H new ATOM 0 HB3 ALA A 67 55.332 -9.309 12.222 1.00 0.00 H new ATOM 1043 N THR A 68 52.972 -8.160 14.821 1.00 0.00 N ATOM 1044 CA THR A 68 51.582 -8.505 15.096 1.00 0.00 C ATOM 1045 C THR A 68 50.640 -7.552 14.369 1.00 0.00 C ATOM 1046 O THR A 68 50.803 -6.333 14.432 1.00 0.00 O ATOM 1047 CB THR A 68 51.315 -8.441 16.601 1.00 0.00 C ATOM 1048 OG1 THR A 68 52.278 -9.231 17.286 1.00 0.00 O ATOM 1049 CG2 THR A 68 49.913 -8.973 16.897 1.00 0.00 C ATOM 0 H THR A 68 53.182 -7.163 14.875 1.00 0.00 H new ATOM 0 HA THR A 68 51.402 -9.519 14.739 1.00 0.00 H new ATOM 0 HB THR A 68 51.386 -7.407 16.938 1.00 0.00 H new ATOM 0 HG1 THR A 68 52.149 -9.139 18.253 1.00 0.00 H new ATOM 0 HG21 THR A 68 49.725 -8.926 17.970 1.00 0.00 H new ATOM 0 HG22 THR A 68 49.175 -8.366 16.373 1.00 0.00 H new ATOM 0 HG23 THR A 68 49.837 -10.007 16.560 1.00 0.00 H new ATOM 1057 N GLY A 69 49.653 -8.115 13.679 1.00 0.00 N ATOM 1058 CA GLY A 69 48.689 -7.305 12.944 1.00 0.00 C ATOM 1059 C GLY A 69 48.335 -7.955 11.611 1.00 0.00 C ATOM 1060 O GLY A 69 49.017 -8.874 11.156 1.00 0.00 O ATOM 0 H GLY A 69 49.500 -9.121 13.614 1.00 0.00 H new ATOM 0 HA2 GLY A 69 47.786 -7.176 13.541 1.00 0.00 H new ATOM 0 HA3 GLY A 69 49.101 -6.311 12.770 1.00 0.00 H new ATOM 1064 N PRO A 70 47.285 -7.495 10.988 1.00 0.00 N ATOM 1065 CA PRO A 70 46.822 -8.035 9.677 1.00 0.00 C ATOM 1066 C PRO A 70 47.964 -8.169 8.673 1.00 0.00 C ATOM 1067 O PRO A 70 48.069 -9.172 7.968 1.00 0.00 O ATOM 1068 CB PRO A 70 45.795 -7.006 9.203 1.00 0.00 C ATOM 1069 CG PRO A 70 45.290 -6.345 10.443 1.00 0.00 C ATOM 1070 CD PRO A 70 46.424 -6.404 11.468 1.00 0.00 C ATOM 0 HA PRO A 70 46.411 -9.040 9.771 1.00 0.00 H new ATOM 0 HB2 PRO A 70 46.249 -6.280 8.529 1.00 0.00 H new ATOM 0 HB3 PRO A 70 44.983 -7.485 8.655 1.00 0.00 H new ATOM 0 HG2 PRO A 70 45.004 -5.313 10.242 1.00 0.00 H new ATOM 0 HG3 PRO A 70 44.402 -6.854 10.819 1.00 0.00 H new ATOM 0 HD2 PRO A 70 46.967 -5.460 11.517 1.00 0.00 H new ATOM 0 HD3 PRO A 70 46.046 -6.606 12.470 1.00 0.00 H new ATOM 1078 N GLN A 71 48.818 -7.151 8.617 1.00 0.00 N ATOM 1079 CA GLN A 71 49.949 -7.165 7.696 1.00 0.00 C ATOM 1080 C GLN A 71 51.250 -7.413 8.451 1.00 0.00 C ATOM 1081 O GLN A 71 52.318 -6.963 8.032 1.00 0.00 O ATOM 1082 CB GLN A 71 50.033 -5.831 6.952 1.00 0.00 C ATOM 1083 CG GLN A 71 48.842 -5.702 6.000 1.00 0.00 C ATOM 1084 CD GLN A 71 48.872 -4.341 5.312 1.00 0.00 C ATOM 1085 OE1 GLN A 71 49.938 -3.863 4.926 1.00 0.00 O ATOM 1086 NE2 GLN A 71 47.758 -3.686 5.133 1.00 0.00 N ATOM 0 H GLN A 71 48.749 -6.312 9.194 1.00 0.00 H new ATOM 0 HA GLN A 71 49.800 -7.971 6.978 1.00 0.00 H new ATOM 0 HB2 GLN A 71 50.035 -5.005 7.663 1.00 0.00 H new ATOM 0 HB3 GLN A 71 50.967 -5.772 6.393 1.00 0.00 H new ATOM 0 HG2 GLN A 71 48.873 -6.497 5.255 1.00 0.00 H new ATOM 0 HG3 GLN A 71 47.910 -5.820 6.552 1.00 0.00 H new ATOM 0 HE21 GLN A 71 46.875 -4.084 5.454 1.00 0.00 H new ATOM 0 HE22 GLN A 71 47.770 -2.776 4.672 1.00 0.00 H new ATOM 1095 N GLU A 72 51.155 -8.131 9.565 1.00 0.00 N ATOM 1096 CA GLU A 72 52.334 -8.431 10.372 1.00 0.00 C ATOM 1097 C GLU A 72 53.377 -9.170 9.540 1.00 0.00 C ATOM 1098 O GLU A 72 54.577 -8.940 9.686 1.00 0.00 O ATOM 1099 CB GLU A 72 51.937 -9.288 11.576 1.00 0.00 C ATOM 1100 CG GLU A 72 51.411 -10.641 11.090 1.00 0.00 C ATOM 1101 CD GLU A 72 50.796 -11.410 12.254 1.00 0.00 C ATOM 1102 OE1 GLU A 72 51.543 -12.052 12.974 1.00 0.00 O ATOM 1103 OE2 GLU A 72 49.588 -11.346 12.408 1.00 0.00 O ATOM 0 H GLU A 72 50.282 -8.514 9.928 1.00 0.00 H new ATOM 0 HA GLU A 72 52.763 -7.492 10.721 1.00 0.00 H new ATOM 0 HB2 GLU A 72 52.796 -9.434 12.231 1.00 0.00 H new ATOM 0 HB3 GLU A 72 51.172 -8.778 12.162 1.00 0.00 H new ATOM 0 HG2 GLU A 72 50.666 -10.491 10.308 1.00 0.00 H new ATOM 0 HG3 GLU A 72 52.223 -11.219 10.650 1.00 0.00 H new ATOM 1110 N GLU A 73 52.911 -10.059 8.668 1.00 0.00 N ATOM 1111 CA GLU A 73 53.815 -10.827 7.819 1.00 0.00 C ATOM 1112 C GLU A 73 54.558 -9.905 6.856 1.00 0.00 C ATOM 1113 O GLU A 73 55.772 -10.015 6.689 1.00 0.00 O ATOM 1114 CB GLU A 73 53.025 -11.868 7.024 1.00 0.00 C ATOM 1115 CG GLU A 73 51.680 -11.277 6.601 1.00 0.00 C ATOM 1116 CD GLU A 73 51.027 -12.166 5.548 1.00 0.00 C ATOM 1117 OE1 GLU A 73 51.569 -12.256 4.458 1.00 0.00 O ATOM 1118 OE2 GLU A 73 49.996 -12.746 5.846 1.00 0.00 O ATOM 0 H GLU A 73 51.921 -10.264 8.531 1.00 0.00 H new ATOM 0 HA GLU A 73 54.542 -11.331 8.456 1.00 0.00 H new ATOM 0 HB2 GLU A 73 53.591 -12.176 6.145 1.00 0.00 H new ATOM 0 HB3 GLU A 73 52.867 -12.760 7.630 1.00 0.00 H new ATOM 0 HG2 GLU A 73 51.025 -11.185 7.468 1.00 0.00 H new ATOM 0 HG3 GLU A 73 51.824 -10.273 6.202 1.00 0.00 H new ATOM 1125 N GLU A 74 53.819 -8.998 6.223 1.00 0.00 N ATOM 1126 CA GLU A 74 54.420 -8.063 5.280 1.00 0.00 C ATOM 1127 C GLU A 74 55.587 -7.323 5.925 1.00 0.00 C ATOM 1128 O GLU A 74 56.689 -7.287 5.379 1.00 0.00 O ATOM 1129 CB GLU A 74 53.372 -7.053 4.806 1.00 0.00 C ATOM 1130 CG GLU A 74 53.950 -6.214 3.665 1.00 0.00 C ATOM 1131 CD GLU A 74 52.830 -5.469 2.946 1.00 0.00 C ATOM 1132 OE1 GLU A 74 51.683 -5.669 3.310 1.00 0.00 O ATOM 1133 OE2 GLU A 74 53.136 -4.709 2.042 1.00 0.00 O ATOM 0 H GLU A 74 52.812 -8.892 6.345 1.00 0.00 H new ATOM 0 HA GLU A 74 54.793 -8.629 4.426 1.00 0.00 H new ATOM 0 HB2 GLU A 74 52.475 -7.574 4.470 1.00 0.00 H new ATOM 0 HB3 GLU A 74 53.075 -6.407 5.632 1.00 0.00 H new ATOM 0 HG2 GLU A 74 54.677 -5.503 4.058 1.00 0.00 H new ATOM 0 HG3 GLU A 74 54.480 -6.857 2.962 1.00 0.00 H new ATOM 1140 N ALA A 75 55.336 -6.735 7.091 1.00 0.00 N ATOM 1141 CA ALA A 75 56.375 -5.999 7.802 1.00 0.00 C ATOM 1142 C ALA A 75 57.639 -6.843 7.928 1.00 0.00 C ATOM 1143 O ALA A 75 58.742 -6.372 7.653 1.00 0.00 O ATOM 1144 CB ALA A 75 55.878 -5.609 9.195 1.00 0.00 C ATOM 0 H ALA A 75 54.430 -6.753 7.560 1.00 0.00 H new ATOM 0 HA ALA A 75 56.609 -5.098 7.235 1.00 0.00 H new ATOM 0 HB1 ALA A 75 56.660 -5.060 9.720 1.00 0.00 H new ATOM 0 HB2 ALA A 75 54.992 -4.980 9.103 1.00 0.00 H new ATOM 0 HB3 ALA A 75 55.627 -6.509 9.757 1.00 0.00 H new ATOM 1150 N LEU A 76 57.471 -8.093 8.346 1.00 0.00 N ATOM 1151 CA LEU A 76 58.605 -8.995 8.505 1.00 0.00 C ATOM 1152 C LEU A 76 59.243 -9.297 7.152 1.00 0.00 C ATOM 1153 O LEU A 76 60.467 -9.343 7.029 1.00 0.00 O ATOM 1154 CB LEU A 76 58.149 -10.301 9.160 1.00 0.00 C ATOM 1155 CG LEU A 76 58.674 -10.363 10.595 1.00 0.00 C ATOM 1156 CD1 LEU A 76 58.238 -9.108 11.354 1.00 0.00 C ATOM 1157 CD2 LEU A 76 58.107 -11.601 11.290 1.00 0.00 C ATOM 0 H LEU A 76 56.566 -8.502 8.579 1.00 0.00 H new ATOM 0 HA LEU A 76 59.344 -8.509 9.143 1.00 0.00 H new ATOM 0 HB2 LEU A 76 57.061 -10.361 9.157 1.00 0.00 H new ATOM 0 HB3 LEU A 76 58.517 -11.154 8.590 1.00 0.00 H new ATOM 0 HG LEU A 76 59.763 -10.419 10.582 1.00 0.00 H new ATOM 0 HD11 LEU A 76 58.612 -9.153 12.377 1.00 0.00 H new ATOM 0 HD12 LEU A 76 58.641 -8.225 10.858 1.00 0.00 H new ATOM 0 HD13 LEU A 76 57.150 -9.051 11.368 1.00 0.00 H new ATOM 0 HD21 LEU A 76 58.480 -11.647 12.313 1.00 0.00 H new ATOM 0 HD22 LEU A 76 57.019 -11.545 11.303 1.00 0.00 H new ATOM 0 HD23 LEU A 76 58.417 -12.496 10.750 1.00 0.00 H new ATOM 1169 N ALA A 77 58.405 -9.503 6.141 1.00 0.00 N ATOM 1170 CA ALA A 77 58.898 -9.799 4.802 1.00 0.00 C ATOM 1171 C ALA A 77 59.775 -8.662 4.290 1.00 0.00 C ATOM 1172 O ALA A 77 60.834 -8.895 3.708 1.00 0.00 O ATOM 1173 CB ALA A 77 57.722 -10.010 3.846 1.00 0.00 C ATOM 0 H ALA A 77 57.389 -9.471 6.223 1.00 0.00 H new ATOM 0 HA ALA A 77 59.495 -10.710 4.849 1.00 0.00 H new ATOM 0 HB1 ALA A 77 58.100 -10.231 2.848 1.00 0.00 H new ATOM 0 HB2 ALA A 77 57.113 -10.844 4.196 1.00 0.00 H new ATOM 0 HB3 ALA A 77 57.114 -9.106 3.812 1.00 0.00 H new ATOM 1179 N ALA A 78 59.327 -7.430 4.512 1.00 0.00 N ATOM 1180 CA ALA A 78 60.079 -6.263 4.068 1.00 0.00 C ATOM 1181 C ALA A 78 61.430 -6.197 4.776 1.00 0.00 C ATOM 1182 O ALA A 78 62.455 -5.927 4.151 1.00 0.00 O ATOM 1183 CB ALA A 78 59.286 -4.988 4.360 1.00 0.00 C ATOM 0 H ALA A 78 58.454 -7.215 4.993 1.00 0.00 H new ATOM 0 HA ALA A 78 60.246 -6.348 2.994 1.00 0.00 H new ATOM 0 HB1 ALA A 78 59.855 -4.121 4.025 1.00 0.00 H new ATOM 0 HB2 ALA A 78 58.333 -5.023 3.831 1.00 0.00 H new ATOM 0 HB3 ALA A 78 59.104 -4.910 5.432 1.00 0.00 H new ATOM 1189 N VAL A 79 61.421 -6.446 6.080 1.00 0.00 N ATOM 1190 CA VAL A 79 62.651 -6.413 6.863 1.00 0.00 C ATOM 1191 C VAL A 79 63.546 -7.595 6.502 1.00 0.00 C ATOM 1192 O VAL A 79 64.747 -7.434 6.289 1.00 0.00 O ATOM 1193 CB VAL A 79 62.323 -6.455 8.355 1.00 0.00 C ATOM 1194 CG1 VAL A 79 63.622 -6.487 9.164 1.00 0.00 C ATOM 1195 CG2 VAL A 79 61.519 -5.209 8.735 1.00 0.00 C ATOM 0 H VAL A 79 60.582 -6.671 6.615 1.00 0.00 H new ATOM 0 HA VAL A 79 63.180 -5.488 6.635 1.00 0.00 H new ATOM 0 HB VAL A 79 61.737 -7.348 8.572 1.00 0.00 H new ATOM 0 HG11 VAL A 79 63.387 -6.517 10.228 1.00 0.00 H new ATOM 0 HG12 VAL A 79 64.197 -7.373 8.894 1.00 0.00 H new ATOM 0 HG13 VAL A 79 64.208 -5.594 8.947 1.00 0.00 H new ATOM 0 HG21 VAL A 79 61.284 -5.238 9.799 1.00 0.00 H new ATOM 0 HG22 VAL A 79 62.106 -4.317 8.517 1.00 0.00 H new ATOM 0 HG23 VAL A 79 60.593 -5.184 8.160 1.00 0.00 H new ATOM 1205 N ILE A 80 62.951 -8.781 6.437 1.00 0.00 N ATOM 1206 CA ILE A 80 63.704 -9.984 6.101 1.00 0.00 C ATOM 1207 C ILE A 80 64.266 -9.884 4.686 1.00 0.00 C ATOM 1208 O ILE A 80 65.397 -10.298 4.426 1.00 0.00 O ATOM 1209 CB ILE A 80 62.801 -11.213 6.208 1.00 0.00 C ATOM 1210 CG1 ILE A 80 62.604 -11.573 7.682 1.00 0.00 C ATOM 1211 CG2 ILE A 80 63.453 -12.391 5.480 1.00 0.00 C ATOM 1212 CD1 ILE A 80 61.528 -12.653 7.805 1.00 0.00 C ATOM 0 H ILE A 80 61.958 -8.935 6.611 1.00 0.00 H new ATOM 0 HA ILE A 80 64.532 -10.081 6.804 1.00 0.00 H new ATOM 0 HB ILE A 80 61.835 -10.994 5.753 1.00 0.00 H new ATOM 0 HG12 ILE A 80 63.542 -11.929 8.109 1.00 0.00 H new ATOM 0 HG13 ILE A 80 62.312 -10.688 8.247 1.00 0.00 H new ATOM 0 HG21 ILE A 80 62.809 -13.267 5.556 1.00 0.00 H new ATOM 0 HG22 ILE A 80 63.596 -12.136 4.430 1.00 0.00 H new ATOM 0 HG23 ILE A 80 64.419 -12.610 5.935 1.00 0.00 H new ATOM 0 HD11 ILE A 80 61.388 -12.909 8.855 1.00 0.00 H new ATOM 0 HD12 ILE A 80 60.590 -12.280 7.394 1.00 0.00 H new ATOM 0 HD13 ILE A 80 61.838 -13.540 7.253 1.00 0.00 H new ATOM 1224 N ALA A 81 63.471 -9.331 3.776 1.00 0.00 N ATOM 1225 CA ALA A 81 63.901 -9.180 2.391 1.00 0.00 C ATOM 1226 C ALA A 81 65.117 -8.264 2.306 1.00 0.00 C ATOM 1227 O ALA A 81 65.978 -8.439 1.444 1.00 0.00 O ATOM 1228 CB ALA A 81 62.762 -8.600 1.552 1.00 0.00 C ATOM 0 H ALA A 81 62.532 -8.982 3.970 1.00 0.00 H new ATOM 0 HA ALA A 81 64.173 -10.162 2.004 1.00 0.00 H new ATOM 0 HB1 ALA A 81 63.091 -8.490 0.519 1.00 0.00 H new ATOM 0 HB2 ALA A 81 61.904 -9.271 1.590 1.00 0.00 H new ATOM 0 HB3 ALA A 81 62.478 -7.625 1.948 1.00 0.00 H new ATOM 1234 N LEU A 82 65.181 -7.289 3.206 1.00 0.00 N ATOM 1235 CA LEU A 82 66.298 -6.352 3.224 1.00 0.00 C ATOM 1236 C LEU A 82 67.595 -7.073 3.574 1.00 0.00 C ATOM 1237 O LEU A 82 68.615 -6.895 2.909 1.00 0.00 O ATOM 1238 CB LEU A 82 66.035 -5.245 4.248 1.00 0.00 C ATOM 1239 CG LEU A 82 66.179 -3.881 3.574 1.00 0.00 C ATOM 1240 CD1 LEU A 82 67.575 -3.757 2.962 1.00 0.00 C ATOM 1241 CD2 LEU A 82 65.127 -3.745 2.471 1.00 0.00 C ATOM 0 H LEU A 82 64.478 -7.127 3.927 1.00 0.00 H new ATOM 0 HA LEU A 82 66.396 -5.912 2.231 1.00 0.00 H new ATOM 0 HB2 LEU A 82 65.034 -5.352 4.666 1.00 0.00 H new ATOM 0 HB3 LEU A 82 66.737 -5.328 5.078 1.00 0.00 H new ATOM 0 HG LEU A 82 66.036 -3.094 4.315 1.00 0.00 H new ATOM 0 HD11 LEU A 82 67.677 -2.784 2.482 1.00 0.00 H new ATOM 0 HD12 LEU A 82 68.326 -3.855 3.746 1.00 0.00 H new ATOM 0 HD13 LEU A 82 67.719 -4.544 2.222 1.00 0.00 H new ATOM 0 HD21 LEU A 82 65.228 -2.772 1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 82 65.271 -4.533 1.732 1.00 0.00 H new ATOM 0 HD23 LEU A 82 64.131 -3.833 2.905 1.00 0.00 H new ATOM 1253 N PHE A 83 67.548 -7.890 4.621 1.00 0.00 N ATOM 1254 CA PHE A 83 68.725 -8.636 5.050 1.00 0.00 C ATOM 1255 C PHE A 83 68.993 -9.802 4.103 1.00 0.00 C ATOM 1256 O PHE A 83 70.125 -10.269 3.984 1.00 0.00 O ATOM 1257 CB PHE A 83 68.518 -9.167 6.470 1.00 0.00 C ATOM 1258 CG PHE A 83 67.952 -8.071 7.340 1.00 0.00 C ATOM 1259 CD1 PHE A 83 67.309 -8.393 8.542 1.00 0.00 C ATOM 1260 CD2 PHE A 83 68.069 -6.733 6.945 1.00 0.00 C ATOM 1261 CE1 PHE A 83 66.783 -7.375 9.348 1.00 0.00 C ATOM 1262 CE2 PHE A 83 67.544 -5.716 7.752 1.00 0.00 C ATOM 1263 CZ PHE A 83 66.900 -6.037 8.953 1.00 0.00 C ATOM 0 H PHE A 83 66.713 -8.052 5.185 1.00 0.00 H new ATOM 0 HA PHE A 83 69.584 -7.965 5.035 1.00 0.00 H new ATOM 0 HB2 PHE A 83 67.840 -10.021 6.455 1.00 0.00 H new ATOM 0 HB3 PHE A 83 69.465 -9.519 6.880 1.00 0.00 H new ATOM 0 HD1 PHE A 83 67.219 -9.425 8.847 1.00 0.00 H new ATOM 0 HD2 PHE A 83 68.564 -6.485 6.018 1.00 0.00 H new ATOM 0 HE1 PHE A 83 66.287 -7.623 10.275 1.00 0.00 H new ATOM 0 HE2 PHE A 83 67.636 -4.684 7.448 1.00 0.00 H new ATOM 0 HZ PHE A 83 66.494 -5.253 9.574 1.00 0.00 H new ATOM 1273 N ASN A 84 67.943 -10.265 3.433 1.00 0.00 N ATOM 1274 CA ASN A 84 68.075 -11.377 2.498 1.00 0.00 C ATOM 1275 C ASN A 84 68.213 -10.862 1.070 1.00 0.00 C ATOM 1276 O ASN A 84 68.385 -11.640 0.131 1.00 0.00 O ATOM 1277 CB ASN A 84 66.853 -12.291 2.598 1.00 0.00 C ATOM 1278 CG ASN A 84 67.072 -13.548 1.762 1.00 0.00 C ATOM 1279 OD1 ASN A 84 68.206 -13.999 1.605 1.00 0.00 O ATOM 1280 ND2 ASN A 84 66.047 -14.143 1.216 1.00 0.00 N ATOM 0 H ASN A 84 66.998 -9.891 3.519 1.00 0.00 H new ATOM 0 HA ASN A 84 68.971 -11.941 2.757 1.00 0.00 H new ATOM 0 HB2 ASN A 84 66.676 -12.563 3.639 1.00 0.00 H new ATOM 0 HB3 ASN A 84 65.965 -11.763 2.251 1.00 0.00 H new ATOM 0 HD21 ASN A 84 66.184 -14.985 0.657 1.00 0.00 H new ATOM 0 HD22 ASN A 84 65.108 -13.766 1.348 1.00 0.00 H new ATOM 1287 N SER A 85 68.135 -9.544 0.910 1.00 0.00 N ATOM 1288 CA SER A 85 68.251 -8.935 -0.409 1.00 0.00 C ATOM 1289 C SER A 85 67.104 -9.381 -1.309 1.00 0.00 C ATOM 1290 O SER A 85 67.258 -10.389 -1.977 1.00 0.00 O ATOM 1291 CB SER A 85 69.583 -9.326 -1.048 1.00 0.00 C ATOM 1292 OG SER A 85 70.651 -8.819 -0.256 1.00 0.00 O ATOM 1293 OXT SER A 85 66.086 -8.707 -1.315 1.00 0.00 O ATOM 0 H SER A 85 67.993 -8.882 1.673 1.00 0.00 H new ATOM 0 HA SER A 85 68.206 -7.852 -0.293 1.00 0.00 H new ATOM 0 HB2 SER A 85 69.657 -10.411 -1.127 1.00 0.00 H new ATOM 0 HB3 SER A 85 69.645 -8.927 -2.061 1.00 0.00 H new ATOM 0 HG SER A 85 71.507 -9.070 -0.662 1.00 0.00 H new TER 1299 SER A 85