USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=17 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 -156:sc= -0.122 (180deg=-0.893) USER MOD Single : A 1 MET N :NH3+ -165:sc= 1.19 (180deg=1.02) USER MOD Single : A 2 THR OG1 : rot 85:sc= -0.397! USER MOD Single : A 4 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0249) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 6 THR OG1 : rot 82:sc= 0.145 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.0673 X(o=-0.067,f=0) USER MOD Single : A 12 LYS NZ :NH3+ 161:sc= -0.0846 (180deg=-0.549) USER MOD Single : A 15 MET CE :methyl -153:sc= -0.171 (180deg=-1.17) USER MOD Single : A 16 HIS : no HD1:sc= -2.21! C(o=-2.2!,f=-2.9!) USER MOD Single : A 21 MET CE :methyl -136:sc= 0 (180deg=-0.15) USER MOD Single : A 22 LYS NZ :NH3+ 163:sc= -0.0379 (180deg=-0.354) USER MOD Single : A 27 MET CE :methyl 146:sc=-0.00356 (180deg=-1.02) USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-1!) USER MOD Single : A 38 ASN : amide:sc= -6.97! C(o=-7!,f=-13!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -3.94! K(o=-3.9!,f=-1.2) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl 159:sc= 0 (180deg=-0.869) USER MOD Single : A 57 SER OG : rot -83:sc= 1.04 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 68 THR OG1 : rot 180:sc= -1.2 USER MOD Single : A 71 GLN : amide:sc= -6.72! C(o=-6.7!,f=-4.1!) USER MOD Single : A 84 ASN : amide:sc= -0.0238 K(o=-0.024,f=-1.5!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 48.350 -13.925 13.101 1.00 0.00 N ATOM 2 CA MET A 1 48.314 -13.868 14.590 1.00 0.00 C ATOM 3 C MET A 1 49.739 -13.905 15.131 1.00 0.00 C ATOM 4 O MET A 1 50.211 -14.943 15.596 1.00 0.00 O ATOM 5 CB MET A 1 47.522 -15.063 15.124 1.00 0.00 C ATOM 6 CG MET A 1 46.026 -14.819 14.916 1.00 0.00 C ATOM 7 SD MET A 1 45.079 -16.097 15.779 1.00 0.00 S ATOM 8 CE MET A 1 45.589 -17.492 14.748 1.00 0.00 C ATOM 0 H1 MET A 1 47.423 -13.648 12.720 1.00 0.00 H new ATOM 0 H2 MET A 1 49.079 -13.273 12.746 1.00 0.00 H new ATOM 0 H3 MET A 1 48.574 -14.894 12.796 1.00 0.00 H new ATOM 0 HA MET A 1 47.832 -12.945 14.913 1.00 0.00 H new ATOM 0 HB2 MET A 1 47.827 -15.974 14.610 1.00 0.00 H new ATOM 0 HB3 MET A 1 47.734 -15.209 16.183 1.00 0.00 H new ATOM 0 HG2 MET A 1 45.752 -13.833 15.291 1.00 0.00 H new ATOM 0 HG3 MET A 1 45.789 -14.832 13.852 1.00 0.00 H new ATOM 0 HE1 MET A 1 44.838 -18.280 14.805 1.00 0.00 H new ATOM 0 HE2 MET A 1 45.691 -17.162 13.714 1.00 0.00 H new ATOM 0 HE3 MET A 1 46.546 -17.876 15.102 1.00 0.00 H new ATOM 20 N THR A 2 50.421 -12.766 15.065 1.00 0.00 N ATOM 21 CA THR A 2 51.793 -12.680 15.552 1.00 0.00 C ATOM 22 C THR A 2 52.704 -13.605 14.749 1.00 0.00 C ATOM 23 O THR A 2 52.490 -14.816 14.705 1.00 0.00 O ATOM 24 CB THR A 2 51.848 -13.063 17.032 1.00 0.00 C ATOM 25 OG1 THR A 2 50.545 -13.413 17.477 1.00 0.00 O ATOM 26 CG2 THR A 2 52.369 -11.880 17.849 1.00 0.00 C ATOM 0 H THR A 2 50.050 -11.896 14.682 1.00 0.00 H new ATOM 0 HA THR A 2 52.139 -11.653 15.431 1.00 0.00 H new ATOM 0 HB THR A 2 52.517 -13.913 17.163 1.00 0.00 H new ATOM 0 HG1 THR A 2 50.372 -14.356 17.273 1.00 0.00 H new ATOM 0 HG21 THR A 2 52.407 -12.155 18.903 1.00 0.00 H new ATOM 0 HG22 THR A 2 53.369 -11.614 17.507 1.00 0.00 H new ATOM 0 HG23 THR A 2 51.702 -11.027 17.720 1.00 0.00 H new ATOM 34 N VAL A 3 53.719 -13.025 14.117 1.00 0.00 N ATOM 35 CA VAL A 3 54.655 -13.808 13.319 1.00 0.00 C ATOM 36 C VAL A 3 56.085 -13.332 13.548 1.00 0.00 C ATOM 37 O VAL A 3 56.400 -12.159 13.346 1.00 0.00 O ATOM 38 CB VAL A 3 54.305 -13.683 11.835 1.00 0.00 C ATOM 39 CG1 VAL A 3 54.509 -12.236 11.382 1.00 0.00 C ATOM 40 CG2 VAL A 3 55.216 -14.604 11.019 1.00 0.00 C ATOM 0 H VAL A 3 53.914 -12.024 14.141 1.00 0.00 H new ATOM 0 HA VAL A 3 54.580 -14.852 13.624 1.00 0.00 H new ATOM 0 HB VAL A 3 53.264 -13.968 11.682 1.00 0.00 H new ATOM 0 HG11 VAL A 3 54.260 -12.147 10.325 1.00 0.00 H new ATOM 0 HG12 VAL A 3 53.863 -11.578 11.964 1.00 0.00 H new ATOM 0 HG13 VAL A 3 55.550 -11.950 11.535 1.00 0.00 H new ATOM 0 HG21 VAL A 3 54.968 -14.517 9.961 1.00 0.00 H new ATOM 0 HG22 VAL A 3 56.256 -14.317 11.173 1.00 0.00 H new ATOM 0 HG23 VAL A 3 55.073 -15.635 11.341 1.00 0.00 H new ATOM 50 N LYS A 4 56.948 -14.250 13.973 1.00 0.00 N ATOM 51 CA LYS A 4 58.344 -13.913 14.227 1.00 0.00 C ATOM 52 C LYS A 4 59.268 -14.801 13.398 1.00 0.00 C ATOM 53 O LYS A 4 58.830 -15.791 12.812 1.00 0.00 O ATOM 54 CB LYS A 4 58.662 -14.088 15.712 1.00 0.00 C ATOM 55 CG LYS A 4 57.771 -15.183 16.301 1.00 0.00 C ATOM 56 CD LYS A 4 58.394 -15.705 17.598 1.00 0.00 C ATOM 57 CE LYS A 4 57.558 -16.871 18.132 1.00 0.00 C ATOM 58 NZ LYS A 4 56.302 -16.346 18.739 1.00 0.00 N ATOM 0 H LYS A 4 56.707 -15.226 14.148 1.00 0.00 H new ATOM 0 HA LYS A 4 58.505 -12.873 13.942 1.00 0.00 H new ATOM 0 HB2 LYS A 4 59.712 -14.351 15.841 1.00 0.00 H new ATOM 0 HB3 LYS A 4 58.501 -13.149 16.242 1.00 0.00 H new ATOM 0 HG2 LYS A 4 56.774 -14.789 16.497 1.00 0.00 H new ATOM 0 HG3 LYS A 4 57.657 -15.998 15.586 1.00 0.00 H new ATOM 0 HD2 LYS A 4 59.418 -16.031 17.417 1.00 0.00 H new ATOM 0 HD3 LYS A 4 58.440 -14.907 18.339 1.00 0.00 H new ATOM 0 HE2 LYS A 4 57.322 -17.563 17.324 1.00 0.00 H new ATOM 0 HE3 LYS A 4 58.127 -17.430 18.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 55.791 -17.122 19.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 56.535 -15.614 19.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 55.702 -15.935 17.995 1.00 0.00 H new ATOM 72 N GLN A 5 60.546 -14.440 13.355 1.00 0.00 N ATOM 73 CA GLN A 5 61.521 -15.211 12.594 1.00 0.00 C ATOM 74 C GLN A 5 62.941 -14.814 12.983 1.00 0.00 C ATOM 75 O GLN A 5 63.258 -13.629 13.087 1.00 0.00 O ATOM 76 CB GLN A 5 61.317 -14.981 11.096 1.00 0.00 C ATOM 77 CG GLN A 5 60.675 -16.220 10.471 1.00 0.00 C ATOM 78 CD GLN A 5 60.545 -16.036 8.963 1.00 0.00 C ATOM 79 OE1 GLN A 5 59.681 -15.293 8.500 1.00 0.00 O ATOM 80 NE2 GLN A 5 61.358 -16.673 8.165 1.00 0.00 N ATOM 0 H GLN A 5 60.928 -13.625 13.834 1.00 0.00 H new ATOM 0 HA GLN A 5 61.376 -16.267 12.821 1.00 0.00 H new ATOM 0 HB2 GLN A 5 60.683 -14.109 10.934 1.00 0.00 H new ATOM 0 HB3 GLN A 5 62.273 -14.773 10.616 1.00 0.00 H new ATOM 0 HG2 GLN A 5 61.279 -17.101 10.687 1.00 0.00 H new ATOM 0 HG3 GLN A 5 59.692 -16.392 10.911 1.00 0.00 H new ATOM 0 HE21 GLN A 5 62.074 -17.289 8.551 1.00 0.00 H new ATOM 0 HE22 GLN A 5 61.278 -16.555 7.155 1.00 0.00 H new ATOM 89 N THR A 6 63.792 -15.813 13.198 1.00 0.00 N ATOM 90 CA THR A 6 65.176 -15.556 13.575 1.00 0.00 C ATOM 91 C THR A 6 65.994 -15.130 12.359 1.00 0.00 C ATOM 92 O THR A 6 66.004 -15.814 11.336 1.00 0.00 O ATOM 93 CB THR A 6 65.792 -16.814 14.191 1.00 0.00 C ATOM 94 OG1 THR A 6 64.801 -17.829 14.280 1.00 0.00 O ATOM 95 CG2 THR A 6 66.323 -16.493 15.589 1.00 0.00 C ATOM 0 H THR A 6 63.549 -16.800 13.118 1.00 0.00 H new ATOM 0 HA THR A 6 65.189 -14.749 14.308 1.00 0.00 H new ATOM 0 HB THR A 6 66.614 -17.161 13.564 1.00 0.00 H new ATOM 0 HG1 THR A 6 64.714 -18.278 13.413 1.00 0.00 H new ATOM 0 HG21 THR A 6 66.761 -17.390 16.026 1.00 0.00 H new ATOM 0 HG22 THR A 6 67.083 -15.714 15.520 1.00 0.00 H new ATOM 0 HG23 THR A 6 65.504 -16.146 16.218 1.00 0.00 H new ATOM 103 N VAL A 7 66.679 -13.997 12.480 1.00 0.00 N ATOM 104 CA VAL A 7 67.496 -13.490 11.385 1.00 0.00 C ATOM 105 C VAL A 7 68.939 -13.297 11.841 1.00 0.00 C ATOM 106 O VAL A 7 69.195 -12.682 12.877 1.00 0.00 O ATOM 107 CB VAL A 7 66.933 -12.159 10.885 1.00 0.00 C ATOM 108 CG1 VAL A 7 67.865 -11.578 9.819 1.00 0.00 C ATOM 109 CG2 VAL A 7 65.547 -12.389 10.279 1.00 0.00 C ATOM 0 H VAL A 7 66.685 -13.417 13.319 1.00 0.00 H new ATOM 0 HA VAL A 7 67.477 -14.218 10.574 1.00 0.00 H new ATOM 0 HB VAL A 7 66.855 -11.461 11.719 1.00 0.00 H new ATOM 0 HG11 VAL A 7 67.464 -10.629 9.463 1.00 0.00 H new ATOM 0 HG12 VAL A 7 68.853 -11.415 10.249 1.00 0.00 H new ATOM 0 HG13 VAL A 7 67.943 -12.275 8.985 1.00 0.00 H new ATOM 0 HG21 VAL A 7 65.144 -11.441 9.922 1.00 0.00 H new ATOM 0 HG22 VAL A 7 65.626 -13.087 9.445 1.00 0.00 H new ATOM 0 HG23 VAL A 7 64.882 -12.803 11.037 1.00 0.00 H new ATOM 119 N GLU A 8 69.878 -13.825 11.063 1.00 0.00 N ATOM 120 CA GLU A 8 71.292 -13.706 11.399 1.00 0.00 C ATOM 121 C GLU A 8 71.865 -12.402 10.851 1.00 0.00 C ATOM 122 O GLU A 8 71.807 -12.144 9.649 1.00 0.00 O ATOM 123 CB GLU A 8 72.067 -14.890 10.822 1.00 0.00 C ATOM 124 CG GLU A 8 71.340 -16.192 11.164 1.00 0.00 C ATOM 125 CD GLU A 8 72.190 -17.388 10.751 1.00 0.00 C ATOM 126 OE1 GLU A 8 72.824 -17.309 9.712 1.00 0.00 O ATOM 127 OE2 GLU A 8 72.194 -18.367 11.480 1.00 0.00 O ATOM 0 H GLU A 8 69.687 -14.336 10.201 1.00 0.00 H new ATOM 0 HA GLU A 8 71.390 -13.704 12.485 1.00 0.00 H new ATOM 0 HB2 GLU A 8 72.159 -14.786 9.741 1.00 0.00 H new ATOM 0 HB3 GLU A 8 73.078 -14.909 11.228 1.00 0.00 H new ATOM 0 HG2 GLU A 8 71.135 -16.233 12.234 1.00 0.00 H new ATOM 0 HG3 GLU A 8 70.378 -16.226 10.653 1.00 0.00 H new ATOM 134 N ILE A 9 72.419 -11.586 11.741 1.00 0.00 N ATOM 135 CA ILE A 9 73.002 -10.312 11.336 1.00 0.00 C ATOM 136 C ILE A 9 74.413 -10.516 10.796 1.00 0.00 C ATOM 137 O ILE A 9 75.317 -10.918 11.530 1.00 0.00 O ATOM 138 CB ILE A 9 73.045 -9.355 12.529 1.00 0.00 C ATOM 139 CG1 ILE A 9 71.620 -8.919 12.882 1.00 0.00 C ATOM 140 CG2 ILE A 9 73.879 -8.125 12.168 1.00 0.00 C ATOM 141 CD1 ILE A 9 71.654 -8.029 14.127 1.00 0.00 C ATOM 0 H ILE A 9 72.477 -11.782 12.740 1.00 0.00 H new ATOM 0 HA ILE A 9 72.382 -9.884 10.548 1.00 0.00 H new ATOM 0 HB ILE A 9 73.495 -9.860 13.384 1.00 0.00 H new ATOM 0 HG12 ILE A 9 71.176 -8.378 12.047 1.00 0.00 H new ATOM 0 HG13 ILE A 9 70.995 -9.793 13.063 1.00 0.00 H new ATOM 0 HG21 ILE A 9 73.909 -7.444 13.018 1.00 0.00 H new ATOM 0 HG22 ILE A 9 74.893 -8.434 11.915 1.00 0.00 H new ATOM 0 HG23 ILE A 9 73.430 -7.619 11.313 1.00 0.00 H new ATOM 0 HD11 ILE A 9 70.640 -7.718 14.380 1.00 0.00 H new ATOM 0 HD12 ILE A 9 72.081 -8.586 14.961 1.00 0.00 H new ATOM 0 HD13 ILE A 9 72.265 -7.148 13.928 1.00 0.00 H new ATOM 153 N THR A 10 74.596 -10.237 9.510 1.00 0.00 N ATOM 154 CA THR A 10 75.904 -10.393 8.884 1.00 0.00 C ATOM 155 C THR A 10 76.759 -9.152 9.117 1.00 0.00 C ATOM 156 O THR A 10 77.177 -8.487 8.169 1.00 0.00 O ATOM 157 CB THR A 10 75.740 -10.627 7.381 1.00 0.00 C ATOM 158 OG1 THR A 10 75.279 -11.953 7.159 1.00 0.00 O ATOM 159 CG2 THR A 10 77.085 -10.428 6.681 1.00 0.00 C ATOM 0 H THR A 10 73.862 -9.904 8.885 1.00 0.00 H new ATOM 0 HA THR A 10 76.401 -11.253 9.333 1.00 0.00 H new ATOM 0 HB THR A 10 75.017 -9.918 6.979 1.00 0.00 H new ATOM 0 HG1 THR A 10 75.171 -12.105 6.197 1.00 0.00 H new ATOM 0 HG21 THR A 10 76.966 -10.595 5.610 1.00 0.00 H new ATOM 0 HG22 THR A 10 77.438 -9.411 6.853 1.00 0.00 H new ATOM 0 HG23 THR A 10 77.811 -11.136 7.080 1.00 0.00 H new ATOM 167 N ASN A 11 77.016 -8.846 10.384 1.00 0.00 N ATOM 168 CA ASN A 11 77.823 -7.681 10.730 1.00 0.00 C ATOM 169 C ASN A 11 77.164 -6.405 10.218 1.00 0.00 C ATOM 170 O ASN A 11 77.831 -5.390 10.013 1.00 0.00 O ATOM 171 CB ASN A 11 79.221 -7.816 10.126 1.00 0.00 C ATOM 172 CG ASN A 11 79.908 -9.062 10.674 1.00 0.00 C ATOM 173 OD1 ASN A 11 80.380 -9.900 9.906 1.00 0.00 O ATOM 174 ND2 ASN A 11 79.994 -9.234 11.964 1.00 0.00 N ATOM 0 H ASN A 11 76.680 -9.384 11.183 1.00 0.00 H new ATOM 0 HA ASN A 11 77.903 -7.625 11.816 1.00 0.00 H new ATOM 0 HB2 ASN A 11 79.152 -7.876 9.040 1.00 0.00 H new ATOM 0 HB3 ASN A 11 79.814 -6.932 10.359 1.00 0.00 H new ATOM 0 HD21 ASN A 11 80.453 -10.064 12.338 1.00 0.00 H new ATOM 0 HD22 ASN A 11 79.602 -8.538 12.599 1.00 0.00 H new ATOM 181 N LYS A 12 75.852 -6.462 10.014 1.00 0.00 N ATOM 182 CA LYS A 12 75.113 -5.305 9.525 1.00 0.00 C ATOM 183 C LYS A 12 73.626 -5.623 9.422 1.00 0.00 C ATOM 184 O LYS A 12 73.232 -6.597 8.780 1.00 0.00 O ATOM 185 CB LYS A 12 75.644 -4.889 8.151 1.00 0.00 C ATOM 186 CG LYS A 12 76.193 -3.463 8.225 1.00 0.00 C ATOM 187 CD LYS A 12 76.758 -3.061 6.862 1.00 0.00 C ATOM 188 CE LYS A 12 77.283 -1.626 6.928 1.00 0.00 C ATOM 189 NZ LYS A 12 78.395 -1.551 7.918 1.00 0.00 N ATOM 0 H LYS A 12 75.282 -7.292 10.179 1.00 0.00 H new ATOM 0 HA LYS A 12 75.249 -4.486 10.231 1.00 0.00 H new ATOM 0 HB2 LYS A 12 76.427 -5.575 7.829 1.00 0.00 H new ATOM 0 HB3 LYS A 12 74.847 -4.945 7.409 1.00 0.00 H new ATOM 0 HG2 LYS A 12 75.403 -2.773 8.521 1.00 0.00 H new ATOM 0 HG3 LYS A 12 76.971 -3.401 8.986 1.00 0.00 H new ATOM 0 HD2 LYS A 12 77.561 -3.740 6.575 1.00 0.00 H new ATOM 0 HD3 LYS A 12 75.985 -3.141 6.098 1.00 0.00 H new ATOM 0 HE2 LYS A 12 77.634 -1.310 5.946 1.00 0.00 H new ATOM 0 HE3 LYS A 12 76.480 -0.946 7.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 78.958 -0.694 7.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 78.002 -1.517 8.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 79.002 -2.390 7.822 1.00 0.00 H new ATOM 203 N LEU A 13 72.803 -4.795 10.057 1.00 0.00 N ATOM 204 CA LEU A 13 71.358 -4.999 10.031 1.00 0.00 C ATOM 205 C LEU A 13 70.820 -4.824 8.615 1.00 0.00 C ATOM 206 O LEU A 13 69.643 -5.074 8.352 1.00 0.00 O ATOM 207 CB LEU A 13 70.673 -4.002 10.967 1.00 0.00 C ATOM 208 CG LEU A 13 71.076 -4.297 12.412 1.00 0.00 C ATOM 209 CD1 LEU A 13 70.963 -3.020 13.246 1.00 0.00 C ATOM 210 CD2 LEU A 13 70.146 -5.366 12.992 1.00 0.00 C ATOM 0 H LEU A 13 73.108 -3.982 10.592 1.00 0.00 H new ATOM 0 HA LEU A 13 71.146 -6.014 10.366 1.00 0.00 H new ATOM 0 HB2 LEU A 13 70.956 -2.984 10.700 1.00 0.00 H new ATOM 0 HB3 LEU A 13 69.591 -4.071 10.859 1.00 0.00 H new ATOM 0 HG LEU A 13 72.105 -4.656 12.435 1.00 0.00 H new ATOM 0 HD11 LEU A 13 71.250 -3.231 14.276 1.00 0.00 H new ATOM 0 HD12 LEU A 13 71.623 -2.257 12.834 1.00 0.00 H new ATOM 0 HD13 LEU A 13 69.934 -2.660 13.223 1.00 0.00 H new ATOM 0 HD21 LEU A 13 70.432 -5.577 14.022 1.00 0.00 H new ATOM 0 HD22 LEU A 13 69.118 -5.006 12.968 1.00 0.00 H new ATOM 0 HD23 LEU A 13 70.225 -6.277 12.399 1.00 0.00 H new ATOM 222 N GLY A 14 71.688 -4.391 7.705 1.00 0.00 N ATOM 223 CA GLY A 14 71.288 -4.186 6.318 1.00 0.00 C ATOM 224 C GLY A 14 72.325 -3.357 5.570 1.00 0.00 C ATOM 225 O GLY A 14 73.529 -3.557 5.732 1.00 0.00 O ATOM 0 H GLY A 14 72.666 -4.177 7.902 1.00 0.00 H new ATOM 0 HA2 GLY A 14 71.163 -5.150 5.825 1.00 0.00 H new ATOM 0 HA3 GLY A 14 70.322 -3.683 6.285 1.00 0.00 H new ATOM 229 N MET A 15 71.851 -2.424 4.750 1.00 0.00 N ATOM 230 CA MET A 15 72.749 -1.570 3.981 1.00 0.00 C ATOM 231 C MET A 15 73.289 -0.440 4.852 1.00 0.00 C ATOM 232 O MET A 15 74.442 -0.035 4.715 1.00 0.00 O ATOM 233 CB MET A 15 72.006 -0.979 2.780 1.00 0.00 C ATOM 234 CG MET A 15 71.468 -2.113 1.906 1.00 0.00 C ATOM 235 SD MET A 15 72.839 -3.163 1.366 1.00 0.00 S ATOM 236 CE MET A 15 73.659 -1.940 0.314 1.00 0.00 C ATOM 0 H MET A 15 70.859 -2.241 4.602 1.00 0.00 H new ATOM 0 HA MET A 15 73.585 -2.175 3.630 1.00 0.00 H new ATOM 0 HB2 MET A 15 71.186 -0.348 3.121 1.00 0.00 H new ATOM 0 HB3 MET A 15 72.676 -0.345 2.200 1.00 0.00 H new ATOM 0 HG2 MET A 15 70.742 -2.704 2.465 1.00 0.00 H new ATOM 0 HG3 MET A 15 70.947 -1.703 1.041 1.00 0.00 H new ATOM 0 HE1 MET A 15 74.217 -2.451 -0.470 1.00 0.00 H new ATOM 0 HE2 MET A 15 72.911 -1.289 -0.138 1.00 0.00 H new ATOM 0 HE3 MET A 15 74.343 -1.343 0.916 1.00 0.00 H new ATOM 246 N HIS A 16 72.446 0.064 5.748 1.00 0.00 N ATOM 247 CA HIS A 16 72.850 1.148 6.636 1.00 0.00 C ATOM 248 C HIS A 16 71.627 1.885 7.173 1.00 0.00 C ATOM 249 O HIS A 16 71.227 2.917 6.634 1.00 0.00 O ATOM 250 CB HIS A 16 73.752 2.129 5.887 1.00 0.00 C ATOM 251 CG HIS A 16 75.176 1.942 6.331 1.00 0.00 C ATOM 252 ND1 HIS A 16 76.213 1.757 5.431 1.00 0.00 N ATOM 253 CD2 HIS A 16 75.752 1.907 7.578 1.00 0.00 C ATOM 254 CE1 HIS A 16 77.348 1.621 6.141 1.00 0.00 C ATOM 255 NE2 HIS A 16 77.123 1.705 7.455 1.00 0.00 N ATOM 0 H HIS A 16 71.487 -0.258 5.878 1.00 0.00 H new ATOM 0 HA HIS A 16 73.399 0.720 7.475 1.00 0.00 H new ATOM 0 HB2 HIS A 16 73.671 1.966 4.812 1.00 0.00 H new ATOM 0 HB3 HIS A 16 73.432 3.153 6.079 1.00 0.00 H new ATOM 0 HD2 HIS A 16 75.221 2.019 8.512 1.00 0.00 H new ATOM 0 HE1 HIS A 16 78.322 1.463 5.702 1.00 0.00 H new ATOM 0 HE2 HIS A 16 77.809 1.636 8.207 1.00 0.00 H new ATOM 263 N ALA A 17 71.037 1.347 8.236 1.00 0.00 N ATOM 264 CA ALA A 17 69.859 1.963 8.836 1.00 0.00 C ATOM 265 C ALA A 17 68.757 2.135 7.795 1.00 0.00 C ATOM 266 O ALA A 17 67.672 2.630 8.102 1.00 0.00 O ATOM 267 CB ALA A 17 70.224 3.326 9.424 1.00 0.00 C ATOM 0 H ALA A 17 71.352 0.493 8.696 1.00 0.00 H new ATOM 0 HA ALA A 17 69.496 1.311 9.630 1.00 0.00 H new ATOM 0 HB1 ALA A 17 69.338 3.779 9.870 1.00 0.00 H new ATOM 0 HB2 ALA A 17 70.991 3.199 10.188 1.00 0.00 H new ATOM 0 HB3 ALA A 17 70.604 3.973 8.634 1.00 0.00 H new ATOM 273 N ARG A 18 69.042 1.722 6.565 1.00 0.00 N ATOM 274 CA ARG A 18 68.066 1.835 5.487 1.00 0.00 C ATOM 275 C ARG A 18 66.723 1.255 5.917 1.00 0.00 C ATOM 276 O ARG A 18 65.696 1.932 5.863 1.00 0.00 O ATOM 277 CB ARG A 18 68.570 1.094 4.246 1.00 0.00 C ATOM 278 CG ARG A 18 68.876 2.103 3.138 1.00 0.00 C ATOM 279 CD ARG A 18 67.568 2.564 2.493 1.00 0.00 C ATOM 280 NE ARG A 18 67.845 3.474 1.387 1.00 0.00 N ATOM 281 CZ ARG A 18 66.859 4.009 0.674 1.00 0.00 C ATOM 282 NH1 ARG A 18 67.133 4.821 -0.311 1.00 0.00 N ATOM 283 NH2 ARG A 18 65.618 3.723 0.957 1.00 0.00 N ATOM 0 H ARG A 18 69.933 1.309 6.291 1.00 0.00 H new ATOM 0 HA ARG A 18 67.934 2.891 5.251 1.00 0.00 H new ATOM 0 HB2 ARG A 18 69.466 0.523 4.489 1.00 0.00 H new ATOM 0 HB3 ARG A 18 67.819 0.381 3.906 1.00 0.00 H new ATOM 0 HG2 ARG A 18 69.413 2.958 3.548 1.00 0.00 H new ATOM 0 HG3 ARG A 18 69.524 1.650 2.388 1.00 0.00 H new ATOM 0 HD2 ARG A 18 67.008 1.701 2.132 1.00 0.00 H new ATOM 0 HD3 ARG A 18 66.944 3.061 3.235 1.00 0.00 H new ATOM 0 HE ARG A 18 68.812 3.704 1.157 1.00 0.00 H new ATOM 0 HH11 ARG A 18 68.103 5.044 -0.533 1.00 0.00 H new ATOM 0 HH12 ARG A 18 66.377 5.232 -0.859 1.00 0.00 H new ATOM 0 HH21 ARG A 18 65.404 3.088 1.726 1.00 0.00 H new ATOM 0 HH22 ARG A 18 64.862 4.134 0.409 1.00 0.00 H new ATOM 297 N PRO A 19 66.719 0.020 6.340 1.00 0.00 N ATOM 298 CA PRO A 19 65.480 -0.674 6.793 1.00 0.00 C ATOM 299 C PRO A 19 64.993 -0.156 8.144 1.00 0.00 C ATOM 300 O PRO A 19 63.821 0.188 8.301 1.00 0.00 O ATOM 301 CB PRO A 19 65.901 -2.141 6.891 1.00 0.00 C ATOM 302 CG PRO A 19 67.378 -2.120 7.103 1.00 0.00 C ATOM 303 CD PRO A 19 67.902 -0.848 6.433 1.00 0.00 C ATOM 0 HA PRO A 19 64.646 -0.511 6.110 1.00 0.00 H new ATOM 0 HB2 PRO A 19 65.393 -2.640 7.716 1.00 0.00 H new ATOM 0 HB3 PRO A 19 65.643 -2.685 5.982 1.00 0.00 H new ATOM 0 HG2 PRO A 19 67.616 -2.123 8.167 1.00 0.00 H new ATOM 0 HG3 PRO A 19 67.844 -3.005 6.670 1.00 0.00 H new ATOM 0 HD2 PRO A 19 68.692 -0.383 7.022 1.00 0.00 H new ATOM 0 HD3 PRO A 19 68.320 -1.059 5.449 1.00 0.00 H new ATOM 311 N ALA A 20 65.900 -0.102 9.114 1.00 0.00 N ATOM 312 CA ALA A 20 65.551 0.377 10.446 1.00 0.00 C ATOM 313 C ALA A 20 64.783 1.692 10.356 1.00 0.00 C ATOM 314 O ALA A 20 63.694 1.826 10.914 1.00 0.00 O ATOM 315 CB ALA A 20 66.818 0.579 11.278 1.00 0.00 C ATOM 0 H ALA A 20 66.875 -0.382 9.004 1.00 0.00 H new ATOM 0 HA ALA A 20 64.918 -0.369 10.926 1.00 0.00 H new ATOM 0 HB1 ALA A 20 66.548 0.937 12.271 1.00 0.00 H new ATOM 0 HB2 ALA A 20 67.350 -0.368 11.366 1.00 0.00 H new ATOM 0 HB3 ALA A 20 67.460 1.312 10.790 1.00 0.00 H new ATOM 321 N MET A 21 65.359 2.659 9.649 1.00 0.00 N ATOM 322 CA MET A 21 64.719 3.960 9.492 1.00 0.00 C ATOM 323 C MET A 21 63.402 3.819 8.734 1.00 0.00 C ATOM 324 O MET A 21 62.366 4.317 9.173 1.00 0.00 O ATOM 325 CB MET A 21 65.647 4.911 8.735 1.00 0.00 C ATOM 326 CG MET A 21 66.692 5.479 9.696 1.00 0.00 C ATOM 327 SD MET A 21 67.351 7.026 9.025 1.00 0.00 S ATOM 328 CE MET A 21 68.327 6.295 7.688 1.00 0.00 C ATOM 0 H MET A 21 66.260 2.568 9.179 1.00 0.00 H new ATOM 0 HA MET A 21 64.514 4.366 10.483 1.00 0.00 H new ATOM 0 HB2 MET A 21 66.138 4.383 7.918 1.00 0.00 H new ATOM 0 HB3 MET A 21 65.070 5.721 8.289 1.00 0.00 H new ATOM 0 HG2 MET A 21 66.244 5.656 10.674 1.00 0.00 H new ATOM 0 HG3 MET A 21 67.498 4.760 9.840 1.00 0.00 H new ATOM 0 HE1 MET A 21 69.306 6.772 7.649 1.00 0.00 H new ATOM 0 HE2 MET A 21 68.451 5.227 7.870 1.00 0.00 H new ATOM 0 HE3 MET A 21 67.813 6.444 6.739 1.00 0.00 H new ATOM 338 N LYS A 22 63.453 3.138 7.595 1.00 0.00 N ATOM 339 CA LYS A 22 62.259 2.936 6.783 1.00 0.00 C ATOM 340 C LYS A 22 61.189 2.198 7.581 1.00 0.00 C ATOM 341 O LYS A 22 59.994 2.429 7.396 1.00 0.00 O ATOM 342 CB LYS A 22 62.608 2.132 5.529 1.00 0.00 C ATOM 343 CG LYS A 22 61.383 2.054 4.615 1.00 0.00 C ATOM 344 CD LYS A 22 61.820 1.629 3.211 1.00 0.00 C ATOM 345 CE LYS A 22 60.587 1.464 2.320 1.00 0.00 C ATOM 346 NZ LYS A 22 59.915 2.783 2.152 1.00 0.00 N ATOM 0 H LYS A 22 64.302 2.719 7.215 1.00 0.00 H new ATOM 0 HA LYS A 22 61.872 3.912 6.491 1.00 0.00 H new ATOM 0 HB2 LYS A 22 63.439 2.602 5.002 1.00 0.00 H new ATOM 0 HB3 LYS A 22 62.933 1.129 5.806 1.00 0.00 H new ATOM 0 HG2 LYS A 22 60.663 1.340 5.015 1.00 0.00 H new ATOM 0 HG3 LYS A 22 60.884 3.022 4.575 1.00 0.00 H new ATOM 0 HD2 LYS A 22 62.491 2.375 2.786 1.00 0.00 H new ATOM 0 HD3 LYS A 22 62.375 0.692 3.259 1.00 0.00 H new ATOM 0 HE2 LYS A 22 60.878 1.066 1.348 1.00 0.00 H new ATOM 0 HE3 LYS A 22 59.897 0.747 2.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 59.267 2.742 1.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 59.377 3.011 3.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 60.631 3.519 1.987 1.00 0.00 H new ATOM 360 N LEU A 23 61.626 1.311 8.468 1.00 0.00 N ATOM 361 CA LEU A 23 60.696 0.544 9.289 1.00 0.00 C ATOM 362 C LEU A 23 59.662 1.467 9.928 1.00 0.00 C ATOM 363 O LEU A 23 58.459 1.230 9.828 1.00 0.00 O ATOM 364 CB LEU A 23 61.458 -0.206 10.382 1.00 0.00 C ATOM 365 CG LEU A 23 61.519 -1.694 10.033 1.00 0.00 C ATOM 366 CD1 LEU A 23 62.531 -2.392 10.944 1.00 0.00 C ATOM 367 CD2 LEU A 23 60.137 -2.321 10.234 1.00 0.00 C ATOM 0 H LEU A 23 62.611 1.106 8.636 1.00 0.00 H new ATOM 0 HA LEU A 23 60.182 -0.174 8.649 1.00 0.00 H new ATOM 0 HB2 LEU A 23 62.466 0.197 10.479 1.00 0.00 H new ATOM 0 HB3 LEU A 23 60.965 -0.067 11.344 1.00 0.00 H new ATOM 0 HG LEU A 23 61.825 -1.811 8.993 1.00 0.00 H new ATOM 0 HD11 LEU A 23 62.574 -3.452 10.695 1.00 0.00 H new ATOM 0 HD12 LEU A 23 63.516 -1.946 10.803 1.00 0.00 H new ATOM 0 HD13 LEU A 23 62.225 -2.276 11.984 1.00 0.00 H new ATOM 0 HD21 LEU A 23 60.179 -3.381 9.986 1.00 0.00 H new ATOM 0 HD22 LEU A 23 59.832 -2.204 11.274 1.00 0.00 H new ATOM 0 HD23 LEU A 23 59.415 -1.825 9.586 1.00 0.00 H new ATOM 379 N PHE A 24 60.141 2.519 10.583 1.00 0.00 N ATOM 380 CA PHE A 24 59.248 3.472 11.233 1.00 0.00 C ATOM 381 C PHE A 24 58.185 3.959 10.253 1.00 0.00 C ATOM 382 O PHE A 24 57.012 4.086 10.607 1.00 0.00 O ATOM 383 CB PHE A 24 60.048 4.666 11.758 1.00 0.00 C ATOM 384 CG PHE A 24 60.529 4.372 13.159 1.00 0.00 C ATOM 385 CD1 PHE A 24 61.548 3.436 13.367 1.00 0.00 C ATOM 386 CD2 PHE A 24 59.954 5.036 14.249 1.00 0.00 C ATOM 387 CE1 PHE A 24 61.994 3.163 14.666 1.00 0.00 C ATOM 388 CE2 PHE A 24 60.400 4.763 15.548 1.00 0.00 C ATOM 389 CZ PHE A 24 61.420 3.827 15.756 1.00 0.00 C ATOM 0 H PHE A 24 61.134 2.733 10.678 1.00 0.00 H new ATOM 0 HA PHE A 24 58.757 2.972 12.068 1.00 0.00 H new ATOM 0 HB2 PHE A 24 60.897 4.864 11.104 1.00 0.00 H new ATOM 0 HB3 PHE A 24 59.428 5.562 11.755 1.00 0.00 H new ATOM 0 HD1 PHE A 24 61.991 2.924 12.525 1.00 0.00 H new ATOM 0 HD2 PHE A 24 59.167 5.758 14.088 1.00 0.00 H new ATOM 0 HE1 PHE A 24 62.780 2.440 14.827 1.00 0.00 H new ATOM 0 HE2 PHE A 24 59.957 5.275 16.390 1.00 0.00 H new ATOM 0 HZ PHE A 24 61.764 3.617 16.758 1.00 0.00 H new ATOM 399 N GLU A 25 58.603 4.229 9.022 1.00 0.00 N ATOM 400 CA GLU A 25 57.678 4.699 7.998 1.00 0.00 C ATOM 401 C GLU A 25 56.823 3.546 7.482 1.00 0.00 C ATOM 402 O GLU A 25 55.647 3.725 7.163 1.00 0.00 O ATOM 403 CB GLU A 25 58.455 5.320 6.835 1.00 0.00 C ATOM 404 CG GLU A 25 59.033 6.668 7.270 1.00 0.00 C ATOM 405 CD GLU A 25 59.902 7.245 6.158 1.00 0.00 C ATOM 406 OE1 GLU A 25 60.180 6.523 5.215 1.00 0.00 O ATOM 407 OE2 GLU A 25 60.276 8.402 6.265 1.00 0.00 O ATOM 0 H GLU A 25 59.569 4.132 8.710 1.00 0.00 H new ATOM 0 HA GLU A 25 57.027 5.452 8.441 1.00 0.00 H new ATOM 0 HB2 GLU A 25 59.258 4.652 6.522 1.00 0.00 H new ATOM 0 HB3 GLU A 25 57.798 5.454 5.975 1.00 0.00 H new ATOM 0 HG2 GLU A 25 58.225 7.360 7.508 1.00 0.00 H new ATOM 0 HG3 GLU A 25 59.624 6.544 8.178 1.00 0.00 H new ATOM 414 N LEU A 26 57.421 2.362 7.406 1.00 0.00 N ATOM 415 CA LEU A 26 56.705 1.184 6.931 1.00 0.00 C ATOM 416 C LEU A 26 55.559 0.839 7.875 1.00 0.00 C ATOM 417 O LEU A 26 54.456 0.515 7.436 1.00 0.00 O ATOM 418 CB LEU A 26 57.664 -0.005 6.831 1.00 0.00 C ATOM 419 CG LEU A 26 56.955 -1.178 6.154 1.00 0.00 C ATOM 420 CD1 LEU A 26 56.623 -0.808 4.708 1.00 0.00 C ATOM 421 CD2 LEU A 26 57.872 -2.404 6.169 1.00 0.00 C ATOM 0 H LEU A 26 58.393 2.193 7.665 1.00 0.00 H new ATOM 0 HA LEU A 26 56.295 1.403 5.945 1.00 0.00 H new ATOM 0 HB2 LEU A 26 58.550 0.276 6.261 1.00 0.00 H new ATOM 0 HB3 LEU A 26 58.003 -0.296 7.825 1.00 0.00 H new ATOM 0 HG LEU A 26 56.034 -1.405 6.691 1.00 0.00 H new ATOM 0 HD11 LEU A 26 56.117 -1.644 4.225 1.00 0.00 H new ATOM 0 HD12 LEU A 26 55.971 0.066 4.696 1.00 0.00 H new ATOM 0 HD13 LEU A 26 57.543 -0.581 4.170 1.00 0.00 H new ATOM 0 HD21 LEU A 26 57.368 -3.241 5.687 1.00 0.00 H new ATOM 0 HD22 LEU A 26 58.793 -2.176 5.632 1.00 0.00 H new ATOM 0 HD23 LEU A 26 58.109 -2.668 7.200 1.00 0.00 H new ATOM 433 N MET A 27 55.828 0.912 9.174 1.00 0.00 N ATOM 434 CA MET A 27 54.810 0.606 10.173 1.00 0.00 C ATOM 435 C MET A 27 53.597 1.512 9.995 1.00 0.00 C ATOM 436 O MET A 27 52.464 1.106 10.253 1.00 0.00 O ATOM 437 CB MET A 27 55.386 0.791 11.579 1.00 0.00 C ATOM 438 CG MET A 27 56.400 -0.318 11.866 1.00 0.00 C ATOM 439 SD MET A 27 57.419 0.151 13.287 1.00 0.00 S ATOM 440 CE MET A 27 56.138 -0.029 14.553 1.00 0.00 C ATOM 0 H MET A 27 56.735 1.178 9.558 1.00 0.00 H new ATOM 0 HA MET A 27 54.498 -0.430 10.042 1.00 0.00 H new ATOM 0 HB2 MET A 27 55.865 1.767 11.662 1.00 0.00 H new ATOM 0 HB3 MET A 27 54.585 0.766 12.318 1.00 0.00 H new ATOM 0 HG2 MET A 27 55.882 -1.255 12.069 1.00 0.00 H new ATOM 0 HG3 MET A 27 57.030 -0.485 10.992 1.00 0.00 H new ATOM 0 HE1 MET A 27 56.590 -0.382 15.480 1.00 0.00 H new ATOM 0 HE2 MET A 27 55.660 0.935 14.726 1.00 0.00 H new ATOM 0 HE3 MET A 27 55.392 -0.749 14.216 1.00 0.00 H new ATOM 450 N GLN A 28 53.842 2.739 9.548 1.00 0.00 N ATOM 451 CA GLN A 28 52.761 3.694 9.338 1.00 0.00 C ATOM 452 C GLN A 28 51.849 3.228 8.207 1.00 0.00 C ATOM 453 O GLN A 28 50.625 3.305 8.313 1.00 0.00 O ATOM 454 CB GLN A 28 53.338 5.069 8.995 1.00 0.00 C ATOM 455 CG GLN A 28 52.229 6.121 9.061 1.00 0.00 C ATOM 456 CD GLN A 28 52.824 7.516 8.910 1.00 0.00 C ATOM 457 OE1 GLN A 28 53.964 7.661 8.470 1.00 0.00 O ATOM 458 NE2 GLN A 28 52.116 8.558 9.250 1.00 0.00 N ATOM 0 H GLN A 28 54.772 3.093 9.326 1.00 0.00 H new ATOM 0 HA GLN A 28 52.178 3.763 10.257 1.00 0.00 H new ATOM 0 HB2 GLN A 28 54.137 5.324 9.692 1.00 0.00 H new ATOM 0 HB3 GLN A 28 53.778 5.052 7.998 1.00 0.00 H new ATOM 0 HG2 GLN A 28 51.498 5.941 8.272 1.00 0.00 H new ATOM 0 HG3 GLN A 28 51.699 6.044 10.010 1.00 0.00 H new ATOM 0 HE21 GLN A 28 51.171 8.436 9.615 1.00 0.00 H new ATOM 0 HE22 GLN A 28 52.507 9.495 9.151 1.00 0.00 H new ATOM 467 N GLY A 29 52.454 2.741 7.130 1.00 0.00 N ATOM 468 CA GLY A 29 51.687 2.262 5.986 1.00 0.00 C ATOM 469 C GLY A 29 51.168 0.850 6.233 1.00 0.00 C ATOM 470 O GLY A 29 50.093 0.481 5.758 1.00 0.00 O ATOM 0 H GLY A 29 53.466 2.667 7.025 1.00 0.00 H new ATOM 0 HA2 GLY A 29 50.850 2.934 5.797 1.00 0.00 H new ATOM 0 HA3 GLY A 29 52.312 2.273 5.093 1.00 0.00 H new ATOM 474 N PHE A 30 51.937 0.066 6.980 1.00 0.00 N ATOM 475 CA PHE A 30 51.546 -1.306 7.286 1.00 0.00 C ATOM 476 C PHE A 30 50.803 -1.366 8.617 1.00 0.00 C ATOM 477 O PHE A 30 51.241 -0.784 9.609 1.00 0.00 O ATOM 478 CB PHE A 30 52.783 -2.202 7.351 1.00 0.00 C ATOM 479 CG PHE A 30 53.323 -2.421 5.958 1.00 0.00 C ATOM 480 CD1 PHE A 30 52.857 -1.637 4.895 1.00 0.00 C ATOM 481 CD2 PHE A 30 54.290 -3.407 5.730 1.00 0.00 C ATOM 482 CE1 PHE A 30 53.358 -1.841 3.603 1.00 0.00 C ATOM 483 CE2 PHE A 30 54.790 -3.610 4.438 1.00 0.00 C ATOM 484 CZ PHE A 30 54.325 -2.828 3.375 1.00 0.00 C ATOM 0 H PHE A 30 52.829 0.354 7.383 1.00 0.00 H new ATOM 0 HA PHE A 30 50.884 -1.659 6.495 1.00 0.00 H new ATOM 0 HB2 PHE A 30 53.545 -1.742 7.979 1.00 0.00 H new ATOM 0 HB3 PHE A 30 52.528 -3.158 7.808 1.00 0.00 H new ATOM 0 HD1 PHE A 30 52.112 -0.876 5.071 1.00 0.00 H new ATOM 0 HD2 PHE A 30 54.650 -4.011 6.550 1.00 0.00 H new ATOM 0 HE1 PHE A 30 52.999 -1.237 2.783 1.00 0.00 H new ATOM 0 HE2 PHE A 30 55.536 -4.371 4.262 1.00 0.00 H new ATOM 0 HZ PHE A 30 54.712 -2.986 2.379 1.00 0.00 H new ATOM 494 N ASP A 31 49.677 -2.071 8.631 1.00 0.00 N ATOM 495 CA ASP A 31 48.884 -2.200 9.847 1.00 0.00 C ATOM 496 C ASP A 31 49.408 -3.343 10.710 1.00 0.00 C ATOM 497 O ASP A 31 48.989 -4.491 10.557 1.00 0.00 O ATOM 498 CB ASP A 31 47.418 -2.456 9.490 1.00 0.00 C ATOM 499 CG ASP A 31 46.761 -1.163 9.021 1.00 0.00 C ATOM 500 OD1 ASP A 31 47.406 -0.131 9.103 1.00 0.00 O ATOM 501 OD2 ASP A 31 45.623 -1.224 8.585 1.00 0.00 O ATOM 0 H ASP A 31 49.295 -2.558 7.820 1.00 0.00 H new ATOM 0 HA ASP A 31 48.963 -1.270 10.410 1.00 0.00 H new ATOM 0 HB2 ASP A 31 47.353 -3.211 8.707 1.00 0.00 H new ATOM 0 HB3 ASP A 31 46.887 -2.849 10.357 1.00 0.00 H new ATOM 506 N ALA A 32 50.324 -3.022 11.616 1.00 0.00 N ATOM 507 CA ALA A 32 50.899 -4.031 12.498 1.00 0.00 C ATOM 508 C ALA A 32 52.076 -3.453 13.277 1.00 0.00 C ATOM 509 O ALA A 32 52.700 -2.483 12.848 1.00 0.00 O ATOM 510 CB ALA A 32 51.368 -5.235 11.680 1.00 0.00 C ATOM 0 H ALA A 32 50.683 -2.078 11.759 1.00 0.00 H new ATOM 0 HA ALA A 32 50.132 -4.349 13.204 1.00 0.00 H new ATOM 0 HB1 ALA A 32 51.796 -5.983 12.347 1.00 0.00 H new ATOM 0 HB2 ALA A 32 50.520 -5.666 11.148 1.00 0.00 H new ATOM 0 HB3 ALA A 32 52.123 -4.915 10.962 1.00 0.00 H new ATOM 516 N GLU A 33 52.376 -4.057 14.423 1.00 0.00 N ATOM 517 CA GLU A 33 53.482 -3.594 15.253 1.00 0.00 C ATOM 518 C GLU A 33 54.691 -4.510 15.092 1.00 0.00 C ATOM 519 O GLU A 33 54.571 -5.733 15.163 1.00 0.00 O ATOM 520 CB GLU A 33 53.055 -3.563 16.721 1.00 0.00 C ATOM 521 CG GLU A 33 54.169 -2.942 17.565 1.00 0.00 C ATOM 522 CD GLU A 33 53.709 -2.797 19.011 1.00 0.00 C ATOM 523 OE1 GLU A 33 52.570 -3.138 19.287 1.00 0.00 O ATOM 524 OE2 GLU A 33 54.502 -2.348 19.823 1.00 0.00 O ATOM 0 H GLU A 33 51.873 -4.862 14.796 1.00 0.00 H new ATOM 0 HA GLU A 33 53.756 -2.589 14.934 1.00 0.00 H new ATOM 0 HB2 GLU A 33 52.137 -2.986 16.831 1.00 0.00 H new ATOM 0 HB3 GLU A 33 52.841 -4.573 17.070 1.00 0.00 H new ATOM 0 HG2 GLU A 33 55.062 -3.566 17.520 1.00 0.00 H new ATOM 0 HG3 GLU A 33 54.441 -1.967 17.162 1.00 0.00 H new ATOM 531 N VAL A 34 55.858 -3.909 14.877 1.00 0.00 N ATOM 532 CA VAL A 34 57.084 -4.680 14.707 1.00 0.00 C ATOM 533 C VAL A 34 57.976 -4.546 15.938 1.00 0.00 C ATOM 534 O VAL A 34 58.141 -3.454 16.480 1.00 0.00 O ATOM 535 CB VAL A 34 57.841 -4.194 13.471 1.00 0.00 C ATOM 536 CG1 VAL A 34 59.178 -4.930 13.368 1.00 0.00 C ATOM 537 CG2 VAL A 34 57.006 -4.478 12.219 1.00 0.00 C ATOM 0 H VAL A 34 55.980 -2.898 14.817 1.00 0.00 H new ATOM 0 HA VAL A 34 56.816 -5.729 14.578 1.00 0.00 H new ATOM 0 HB VAL A 34 58.022 -3.122 13.554 1.00 0.00 H new ATOM 0 HG11 VAL A 34 59.717 -4.583 12.487 1.00 0.00 H new ATOM 0 HG12 VAL A 34 59.773 -4.730 14.259 1.00 0.00 H new ATOM 0 HG13 VAL A 34 58.998 -6.002 13.285 1.00 0.00 H new ATOM 0 HG21 VAL A 34 57.544 -4.132 11.337 1.00 0.00 H new ATOM 0 HG22 VAL A 34 56.826 -5.550 12.137 1.00 0.00 H new ATOM 0 HG23 VAL A 34 56.053 -3.954 12.291 1.00 0.00 H new ATOM 547 N LEU A 35 58.549 -5.664 16.371 1.00 0.00 N ATOM 548 CA LEU A 35 59.424 -5.658 17.539 1.00 0.00 C ATOM 549 C LEU A 35 60.689 -6.465 17.264 1.00 0.00 C ATOM 550 O LEU A 35 60.623 -7.589 16.766 1.00 0.00 O ATOM 551 CB LEU A 35 58.691 -6.250 18.744 1.00 0.00 C ATOM 552 CG LEU A 35 59.696 -6.546 19.858 1.00 0.00 C ATOM 553 CD1 LEU A 35 59.090 -6.160 21.209 1.00 0.00 C ATOM 554 CD2 LEU A 35 60.029 -8.040 19.859 1.00 0.00 C ATOM 0 H LEU A 35 58.425 -6.578 15.936 1.00 0.00 H new ATOM 0 HA LEU A 35 59.704 -4.627 17.755 1.00 0.00 H new ATOM 0 HB2 LEU A 35 57.932 -5.553 19.100 1.00 0.00 H new ATOM 0 HB3 LEU A 35 58.173 -7.164 18.455 1.00 0.00 H new ATOM 0 HG LEU A 35 60.605 -5.969 19.689 1.00 0.00 H new ATOM 0 HD11 LEU A 35 59.807 -6.371 22.003 1.00 0.00 H new ATOM 0 HD12 LEU A 35 58.850 -5.097 21.210 1.00 0.00 H new ATOM 0 HD13 LEU A 35 58.181 -6.737 21.378 1.00 0.00 H new ATOM 0 HD21 LEU A 35 60.745 -8.253 20.653 1.00 0.00 H new ATOM 0 HD22 LEU A 35 59.119 -8.616 20.028 1.00 0.00 H new ATOM 0 HD23 LEU A 35 60.460 -8.317 18.897 1.00 0.00 H new ATOM 566 N LEU A 36 61.839 -5.884 17.590 1.00 0.00 N ATOM 567 CA LEU A 36 63.113 -6.559 17.373 1.00 0.00 C ATOM 568 C LEU A 36 63.700 -7.038 18.697 1.00 0.00 C ATOM 569 O LEU A 36 63.492 -6.417 19.740 1.00 0.00 O ATOM 570 CB LEU A 36 64.098 -5.610 16.689 1.00 0.00 C ATOM 571 CG LEU A 36 63.537 -5.183 15.332 1.00 0.00 C ATOM 572 CD1 LEU A 36 64.011 -3.765 15.006 1.00 0.00 C ATOM 573 CD2 LEU A 36 64.033 -6.147 14.252 1.00 0.00 C ATOM 0 H LEU A 36 61.915 -4.954 18.002 1.00 0.00 H new ATOM 0 HA LEU A 36 62.939 -7.424 16.733 1.00 0.00 H new ATOM 0 HB2 LEU A 36 64.270 -4.734 17.315 1.00 0.00 H new ATOM 0 HB3 LEU A 36 65.062 -6.102 16.557 1.00 0.00 H new ATOM 0 HG LEU A 36 62.448 -5.202 15.366 1.00 0.00 H new ATOM 0 HD11 LEU A 36 63.611 -3.461 14.039 1.00 0.00 H new ATOM 0 HD12 LEU A 36 63.660 -3.078 15.776 1.00 0.00 H new ATOM 0 HD13 LEU A 36 65.100 -3.745 14.971 1.00 0.00 H new ATOM 0 HD21 LEU A 36 63.634 -5.845 13.284 1.00 0.00 H new ATOM 0 HD22 LEU A 36 65.122 -6.127 14.218 1.00 0.00 H new ATOM 0 HD23 LEU A 36 63.696 -7.157 14.484 1.00 0.00 H new ATOM 585 N ARG A 37 64.435 -8.144 18.648 1.00 0.00 N ATOM 586 CA ARG A 37 65.048 -8.696 19.851 1.00 0.00 C ATOM 587 C ARG A 37 66.375 -9.368 19.514 1.00 0.00 C ATOM 588 O ARG A 37 66.473 -10.123 18.547 1.00 0.00 O ATOM 589 CB ARG A 37 64.107 -9.716 20.495 1.00 0.00 C ATOM 590 CG ARG A 37 64.925 -10.731 21.296 1.00 0.00 C ATOM 591 CD ARG A 37 64.003 -11.492 22.249 1.00 0.00 C ATOM 592 NE ARG A 37 63.548 -10.613 23.321 1.00 0.00 N ATOM 593 CZ ARG A 37 62.745 -11.058 24.281 1.00 0.00 C ATOM 594 NH1 ARG A 37 62.352 -10.252 25.229 1.00 0.00 N ATOM 595 NH2 ARG A 37 62.349 -12.302 24.276 1.00 0.00 N ATOM 0 H ARG A 37 64.620 -8.672 17.795 1.00 0.00 H new ATOM 0 HA ARG A 37 65.233 -7.880 20.550 1.00 0.00 H new ATOM 0 HB2 ARG A 37 63.396 -9.209 21.148 1.00 0.00 H new ATOM 0 HB3 ARG A 37 63.526 -10.226 19.727 1.00 0.00 H new ATOM 0 HG2 ARG A 37 65.422 -11.427 20.621 1.00 0.00 H new ATOM 0 HG3 ARG A 37 65.706 -10.221 21.859 1.00 0.00 H new ATOM 0 HD2 ARG A 37 63.146 -11.883 21.702 1.00 0.00 H new ATOM 0 HD3 ARG A 37 64.530 -12.348 22.670 1.00 0.00 H new ATOM 0 HE ARG A 37 63.852 -9.639 23.333 1.00 0.00 H new ATOM 0 HH11 ARG A 37 62.661 -9.280 25.233 1.00 0.00 H new ATOM 0 HH12 ARG A 37 61.735 -10.594 25.966 1.00 0.00 H new ATOM 0 HH21 ARG A 37 62.656 -12.932 23.535 1.00 0.00 H new ATOM 0 HH22 ARG A 37 61.732 -12.644 25.013 1.00 0.00 H new ATOM 609 N ASN A 38 67.396 -9.086 20.318 1.00 0.00 N ATOM 610 CA ASN A 38 68.714 -9.670 20.096 1.00 0.00 C ATOM 611 C ASN A 38 68.862 -10.974 20.873 1.00 0.00 C ATOM 612 O ASN A 38 68.155 -11.207 21.853 1.00 0.00 O ATOM 613 CB ASN A 38 69.801 -8.685 20.535 1.00 0.00 C ATOM 614 CG ASN A 38 69.824 -7.483 19.598 1.00 0.00 C ATOM 615 OD1 ASN A 38 69.229 -7.522 18.522 1.00 0.00 O ATOM 616 ND2 ASN A 38 70.479 -6.410 19.947 1.00 0.00 N ATOM 0 H ASN A 38 67.337 -8.462 21.123 1.00 0.00 H new ATOM 0 HA ASN A 38 68.822 -9.882 19.032 1.00 0.00 H new ATOM 0 HB2 ASN A 38 69.614 -8.356 21.557 1.00 0.00 H new ATOM 0 HB3 ASN A 38 70.773 -9.178 20.531 1.00 0.00 H new ATOM 0 HD21 ASN A 38 70.499 -5.600 19.327 1.00 0.00 H new ATOM 0 HD22 ASN A 38 70.971 -6.381 20.840 1.00 0.00 H new ATOM 623 N ASP A 39 69.785 -11.820 20.428 1.00 0.00 N ATOM 624 CA ASP A 39 70.018 -13.098 21.089 1.00 0.00 C ATOM 625 C ASP A 39 70.277 -12.893 22.578 1.00 0.00 C ATOM 626 O ASP A 39 69.985 -13.766 23.396 1.00 0.00 O ATOM 627 CB ASP A 39 71.217 -13.805 20.453 1.00 0.00 C ATOM 628 CG ASP A 39 71.329 -15.228 20.990 1.00 0.00 C ATOM 629 OD1 ASP A 39 70.670 -15.522 21.974 1.00 0.00 O ATOM 630 OD2 ASP A 39 72.072 -16.002 20.411 1.00 0.00 O ATOM 0 H ASP A 39 70.380 -11.645 19.618 1.00 0.00 H new ATOM 0 HA ASP A 39 69.127 -13.715 20.969 1.00 0.00 H new ATOM 0 HB2 ASP A 39 71.105 -13.824 19.369 1.00 0.00 H new ATOM 0 HB3 ASP A 39 72.132 -13.253 20.669 1.00 0.00 H new ATOM 635 N GLU A 40 70.827 -11.733 22.923 1.00 0.00 N ATOM 636 CA GLU A 40 71.121 -11.423 24.318 1.00 0.00 C ATOM 637 C GLU A 40 69.831 -11.259 25.114 1.00 0.00 C ATOM 638 O GLU A 40 69.851 -11.207 26.344 1.00 0.00 O ATOM 639 CB GLU A 40 71.945 -10.137 24.405 1.00 0.00 C ATOM 640 CG GLU A 40 73.313 -10.364 23.760 1.00 0.00 C ATOM 641 CD GLU A 40 74.095 -9.055 23.723 1.00 0.00 C ATOM 642 OE1 GLU A 40 73.492 -8.021 23.958 1.00 0.00 O ATOM 643 OE2 GLU A 40 75.286 -9.106 23.461 1.00 0.00 O ATOM 0 H GLU A 40 71.076 -10.997 22.262 1.00 0.00 H new ATOM 0 HA GLU A 40 71.692 -12.249 24.741 1.00 0.00 H new ATOM 0 HB2 GLU A 40 71.424 -9.323 23.901 1.00 0.00 H new ATOM 0 HB3 GLU A 40 72.067 -9.840 25.447 1.00 0.00 H new ATOM 0 HG2 GLU A 40 73.869 -11.114 24.322 1.00 0.00 H new ATOM 0 HG3 GLU A 40 73.188 -10.751 22.749 1.00 0.00 H new ATOM 650 N GLY A 41 68.710 -11.177 24.405 1.00 0.00 N ATOM 651 CA GLY A 41 67.415 -11.018 25.058 1.00 0.00 C ATOM 652 C GLY A 41 67.066 -9.544 25.225 1.00 0.00 C ATOM 653 O GLY A 41 66.164 -9.192 25.985 1.00 0.00 O ATOM 0 H GLY A 41 68.671 -11.218 23.387 1.00 0.00 H new ATOM 0 HA2 GLY A 41 66.643 -11.514 24.469 1.00 0.00 H new ATOM 0 HA3 GLY A 41 67.433 -11.504 26.033 1.00 0.00 H new ATOM 657 N THR A 42 67.787 -8.685 24.512 1.00 0.00 N ATOM 658 CA THR A 42 67.545 -7.249 24.591 1.00 0.00 C ATOM 659 C THR A 42 66.412 -6.846 23.653 1.00 0.00 C ATOM 660 O THR A 42 66.537 -6.951 22.432 1.00 0.00 O ATOM 661 CB THR A 42 68.816 -6.484 24.219 1.00 0.00 C ATOM 662 OG1 THR A 42 69.658 -6.384 25.360 1.00 0.00 O ATOM 663 CG2 THR A 42 68.446 -5.082 23.732 1.00 0.00 C ATOM 0 H THR A 42 68.538 -8.955 23.877 1.00 0.00 H new ATOM 0 HA THR A 42 67.260 -7.002 25.614 1.00 0.00 H new ATOM 0 HB THR A 42 69.341 -7.015 23.425 1.00 0.00 H new ATOM 0 HG1 THR A 42 70.474 -5.895 25.123 1.00 0.00 H new ATOM 0 HG21 THR A 42 69.353 -4.538 23.467 1.00 0.00 H new ATOM 0 HG22 THR A 42 67.801 -5.159 22.857 1.00 0.00 H new ATOM 0 HG23 THR A 42 67.921 -4.548 24.524 1.00 0.00 H new ATOM 671 N GLU A 43 65.309 -6.384 24.231 1.00 0.00 N ATOM 672 CA GLU A 43 64.159 -5.968 23.435 1.00 0.00 C ATOM 673 C GLU A 43 64.429 -4.625 22.764 1.00 0.00 C ATOM 674 O GLU A 43 64.402 -3.579 23.413 1.00 0.00 O ATOM 675 CB GLU A 43 62.920 -5.855 24.326 1.00 0.00 C ATOM 676 CG GLU A 43 62.554 -7.236 24.870 1.00 0.00 C ATOM 677 CD GLU A 43 61.355 -7.129 25.805 1.00 0.00 C ATOM 678 OE1 GLU A 43 60.923 -6.015 26.056 1.00 0.00 O ATOM 679 OE2 GLU A 43 60.884 -8.160 26.256 1.00 0.00 O ATOM 0 H GLU A 43 65.186 -6.288 25.239 1.00 0.00 H new ATOM 0 HA GLU A 43 63.985 -6.718 22.664 1.00 0.00 H new ATOM 0 HB2 GLU A 43 63.113 -5.168 25.150 1.00 0.00 H new ATOM 0 HB3 GLU A 43 62.086 -5.444 23.757 1.00 0.00 H new ATOM 0 HG2 GLU A 43 62.323 -7.911 24.046 1.00 0.00 H new ATOM 0 HG3 GLU A 43 63.404 -7.663 25.403 1.00 0.00 H new ATOM 686 N ALA A 44 64.691 -4.661 21.461 1.00 0.00 N ATOM 687 CA ALA A 44 64.966 -3.441 20.713 1.00 0.00 C ATOM 688 C ALA A 44 63.699 -2.935 20.030 1.00 0.00 C ATOM 689 O ALA A 44 63.591 -2.961 18.804 1.00 0.00 O ATOM 690 CB ALA A 44 66.044 -3.705 19.660 1.00 0.00 C ATOM 0 H ALA A 44 64.718 -5.516 20.905 1.00 0.00 H new ATOM 0 HA ALA A 44 65.318 -2.681 21.411 1.00 0.00 H new ATOM 0 HB1 ALA A 44 66.243 -2.788 19.106 1.00 0.00 H new ATOM 0 HB2 ALA A 44 66.958 -4.038 20.151 1.00 0.00 H new ATOM 0 HB3 ALA A 44 65.699 -4.477 18.972 1.00 0.00 H new ATOM 696 N GLU A 45 62.744 -2.476 20.832 1.00 0.00 N ATOM 697 CA GLU A 45 61.489 -1.966 20.294 1.00 0.00 C ATOM 698 C GLU A 45 61.740 -1.139 19.036 1.00 0.00 C ATOM 699 O GLU A 45 62.463 -0.143 19.070 1.00 0.00 O ATOM 700 CB GLU A 45 60.782 -1.125 21.345 1.00 0.00 C ATOM 701 CG GLU A 45 60.531 -1.987 22.576 1.00 0.00 C ATOM 702 CD GLU A 45 59.805 -1.177 23.645 1.00 0.00 C ATOM 703 OE1 GLU A 45 59.469 -1.751 24.668 1.00 0.00 O ATOM 704 OE2 GLU A 45 59.595 0.004 23.425 1.00 0.00 O ATOM 0 H GLU A 45 62.814 -2.447 21.849 1.00 0.00 H new ATOM 0 HA GLU A 45 60.854 -2.810 20.026 1.00 0.00 H new ATOM 0 HB2 GLU A 45 61.390 -0.260 21.608 1.00 0.00 H new ATOM 0 HB3 GLU A 45 59.839 -0.744 20.952 1.00 0.00 H new ATOM 0 HG2 GLU A 45 59.937 -2.859 22.304 1.00 0.00 H new ATOM 0 HG3 GLU A 45 61.478 -2.357 22.970 1.00 0.00 H new ATOM 711 N ALA A 46 61.139 -1.560 17.928 1.00 0.00 N ATOM 712 CA ALA A 46 61.306 -0.851 16.665 1.00 0.00 C ATOM 713 C ALA A 46 60.604 0.503 16.714 1.00 0.00 C ATOM 714 O ALA A 46 60.415 1.153 15.686 1.00 0.00 O ATOM 715 CB ALA A 46 60.731 -1.684 15.518 1.00 0.00 C ATOM 0 H ALA A 46 60.537 -2.382 17.879 1.00 0.00 H new ATOM 0 HA ALA A 46 62.371 -0.690 16.499 1.00 0.00 H new ATOM 0 HB1 ALA A 46 60.860 -1.147 14.578 1.00 0.00 H new ATOM 0 HB2 ALA A 46 61.253 -2.639 15.465 1.00 0.00 H new ATOM 0 HB3 ALA A 46 59.670 -1.860 15.693 1.00 0.00 H new ATOM 721 N ASN A 47 60.220 0.921 17.915 1.00 0.00 N ATOM 722 CA ASN A 47 59.540 2.200 18.087 1.00 0.00 C ATOM 723 C ASN A 47 60.369 3.136 18.960 1.00 0.00 C ATOM 724 O ASN A 47 59.851 4.105 19.513 1.00 0.00 O ATOM 725 CB ASN A 47 58.169 1.980 18.729 1.00 0.00 C ATOM 726 CG ASN A 47 58.256 2.210 20.235 1.00 0.00 C ATOM 727 OD1 ASN A 47 57.622 3.125 20.761 1.00 0.00 O ATOM 728 ND2 ASN A 47 59.009 1.430 20.962 1.00 0.00 N ATOM 0 H ASN A 47 60.366 0.398 18.778 1.00 0.00 H new ATOM 0 HA ASN A 47 59.412 2.657 17.106 1.00 0.00 H new ATOM 0 HB2 ASN A 47 57.439 2.661 18.290 1.00 0.00 H new ATOM 0 HB3 ASN A 47 57.822 0.967 18.527 1.00 0.00 H new ATOM 0 HD21 ASN A 47 59.074 1.578 21.969 1.00 0.00 H new ATOM 0 HD22 ASN A 47 59.533 0.673 20.523 1.00 0.00 H new ATOM 735 N SER A 48 61.659 2.838 19.079 1.00 0.00 N ATOM 736 CA SER A 48 62.551 3.660 19.888 1.00 0.00 C ATOM 737 C SER A 48 63.932 3.745 19.246 1.00 0.00 C ATOM 738 O SER A 48 64.523 2.728 18.883 1.00 0.00 O ATOM 739 CB SER A 48 62.676 3.069 21.292 1.00 0.00 C ATOM 740 OG SER A 48 63.762 3.688 21.967 1.00 0.00 O ATOM 0 H SER A 48 62.107 2.040 18.629 1.00 0.00 H new ATOM 0 HA SER A 48 62.130 4.663 19.952 1.00 0.00 H new ATOM 0 HB2 SER A 48 61.751 3.224 21.848 1.00 0.00 H new ATOM 0 HB3 SER A 48 62.836 1.992 21.233 1.00 0.00 H new ATOM 0 HG SER A 48 63.844 3.312 22.868 1.00 0.00 H new ATOM 746 N VAL A 49 64.440 4.965 19.109 1.00 0.00 N ATOM 747 CA VAL A 49 65.754 5.172 18.509 1.00 0.00 C ATOM 748 C VAL A 49 66.842 4.539 19.369 1.00 0.00 C ATOM 749 O VAL A 49 67.864 4.083 18.859 1.00 0.00 O ATOM 750 CB VAL A 49 66.028 6.669 18.356 1.00 0.00 C ATOM 751 CG1 VAL A 49 65.152 7.238 17.238 1.00 0.00 C ATOM 752 CG2 VAL A 49 65.703 7.383 19.670 1.00 0.00 C ATOM 0 H VAL A 49 63.967 5.820 19.402 1.00 0.00 H new ATOM 0 HA VAL A 49 65.763 4.699 17.527 1.00 0.00 H new ATOM 0 HB VAL A 49 67.078 6.822 18.108 1.00 0.00 H new ATOM 0 HG11 VAL A 49 65.348 8.305 17.130 1.00 0.00 H new ATOM 0 HG12 VAL A 49 65.382 6.730 16.301 1.00 0.00 H new ATOM 0 HG13 VAL A 49 64.102 7.085 17.485 1.00 0.00 H new ATOM 0 HG21 VAL A 49 65.898 8.450 19.562 1.00 0.00 H new ATOM 0 HG22 VAL A 49 64.653 7.229 19.918 1.00 0.00 H new ATOM 0 HG23 VAL A 49 66.327 6.979 20.468 1.00 0.00 H new ATOM 762 N ILE A 50 66.613 4.514 20.679 1.00 0.00 N ATOM 763 CA ILE A 50 67.582 3.934 21.602 1.00 0.00 C ATOM 764 C ILE A 50 67.787 2.452 21.305 1.00 0.00 C ATOM 765 O ILE A 50 68.907 1.946 21.364 1.00 0.00 O ATOM 766 CB ILE A 50 67.097 4.105 23.042 1.00 0.00 C ATOM 767 CG1 ILE A 50 67.105 5.591 23.409 1.00 0.00 C ATOM 768 CG2 ILE A 50 68.025 3.341 23.988 1.00 0.00 C ATOM 769 CD1 ILE A 50 66.274 5.809 24.675 1.00 0.00 C ATOM 0 H ILE A 50 65.772 4.885 21.122 1.00 0.00 H new ATOM 0 HA ILE A 50 68.532 4.452 21.474 1.00 0.00 H new ATOM 0 HB ILE A 50 66.084 3.713 23.133 1.00 0.00 H new ATOM 0 HG12 ILE A 50 68.128 5.931 23.570 1.00 0.00 H new ATOM 0 HG13 ILE A 50 66.698 6.181 22.588 1.00 0.00 H new ATOM 0 HG21 ILE A 50 67.679 3.463 25.014 1.00 0.00 H new ATOM 0 HG22 ILE A 50 68.020 2.283 23.727 1.00 0.00 H new ATOM 0 HG23 ILE A 50 69.038 3.732 23.898 1.00 0.00 H new ATOM 0 HD11 ILE A 50 66.280 6.867 24.936 1.00 0.00 H new ATOM 0 HD12 ILE A 50 65.249 5.485 24.498 1.00 0.00 H new ATOM 0 HD13 ILE A 50 66.701 5.231 25.494 1.00 0.00 H new ATOM 781 N ALA A 51 66.697 1.762 20.983 1.00 0.00 N ATOM 782 CA ALA A 51 66.769 0.338 20.679 1.00 0.00 C ATOM 783 C ALA A 51 67.550 0.104 19.389 1.00 0.00 C ATOM 784 O ALA A 51 68.355 -0.823 19.298 1.00 0.00 O ATOM 785 CB ALA A 51 65.359 -0.238 20.535 1.00 0.00 C ATOM 0 H ALA A 51 65.761 2.162 20.926 1.00 0.00 H new ATOM 0 HA ALA A 51 67.284 -0.163 21.499 1.00 0.00 H new ATOM 0 HB1 ALA A 51 65.422 -1.302 20.308 1.00 0.00 H new ATOM 0 HB2 ALA A 51 64.812 -0.098 21.467 1.00 0.00 H new ATOM 0 HB3 ALA A 51 64.837 0.275 19.727 1.00 0.00 H new ATOM 791 N LEU A 52 67.307 0.952 18.394 1.00 0.00 N ATOM 792 CA LEU A 52 67.994 0.829 17.114 1.00 0.00 C ATOM 793 C LEU A 52 69.505 0.926 17.304 1.00 0.00 C ATOM 794 O LEU A 52 70.271 0.241 16.627 1.00 0.00 O ATOM 795 CB LEU A 52 67.526 1.930 16.162 1.00 0.00 C ATOM 796 CG LEU A 52 66.086 1.654 15.728 1.00 0.00 C ATOM 797 CD1 LEU A 52 65.580 2.810 14.866 1.00 0.00 C ATOM 798 CD2 LEU A 52 66.039 0.356 14.919 1.00 0.00 C ATOM 0 H LEU A 52 66.645 1.726 18.449 1.00 0.00 H new ATOM 0 HA LEU A 52 67.755 -0.145 16.688 1.00 0.00 H new ATOM 0 HB2 LEU A 52 67.589 2.901 16.654 1.00 0.00 H new ATOM 0 HB3 LEU A 52 68.178 1.972 15.289 1.00 0.00 H new ATOM 0 HG LEU A 52 65.453 1.557 16.610 1.00 0.00 H new ATOM 0 HD11 LEU A 52 64.554 2.612 14.558 1.00 0.00 H new ATOM 0 HD12 LEU A 52 65.614 3.735 15.442 1.00 0.00 H new ATOM 0 HD13 LEU A 52 66.211 2.909 13.983 1.00 0.00 H new ATOM 0 HD21 LEU A 52 65.013 0.158 14.609 1.00 0.00 H new ATOM 0 HD22 LEU A 52 66.672 0.454 14.037 1.00 0.00 H new ATOM 0 HD23 LEU A 52 66.398 -0.469 15.534 1.00 0.00 H new ATOM 810 N LEU A 53 69.925 1.782 18.231 1.00 0.00 N ATOM 811 CA LEU A 53 71.347 1.961 18.500 1.00 0.00 C ATOM 812 C LEU A 53 71.938 0.698 19.119 1.00 0.00 C ATOM 813 O LEU A 53 73.082 0.335 18.842 1.00 0.00 O ATOM 814 CB LEU A 53 71.554 3.141 19.451 1.00 0.00 C ATOM 815 CG LEU A 53 72.059 4.350 18.662 1.00 0.00 C ATOM 816 CD1 LEU A 53 73.465 4.063 18.134 1.00 0.00 C ATOM 817 CD2 LEU A 53 71.117 4.619 17.486 1.00 0.00 C ATOM 0 H LEU A 53 69.307 2.357 18.803 1.00 0.00 H new ATOM 0 HA LEU A 53 71.854 2.162 17.556 1.00 0.00 H new ATOM 0 HB2 LEU A 53 70.618 3.386 19.953 1.00 0.00 H new ATOM 0 HB3 LEU A 53 72.271 2.875 20.227 1.00 0.00 H new ATOM 0 HG LEU A 53 72.087 5.224 19.313 1.00 0.00 H new ATOM 0 HD11 LEU A 53 73.825 4.924 17.572 1.00 0.00 H new ATOM 0 HD12 LEU A 53 74.136 3.870 18.971 1.00 0.00 H new ATOM 0 HD13 LEU A 53 73.438 3.190 17.482 1.00 0.00 H new ATOM 0 HD21 LEU A 53 71.475 5.480 16.922 1.00 0.00 H new ATOM 0 HD22 LEU A 53 71.089 3.745 16.835 1.00 0.00 H new ATOM 0 HD23 LEU A 53 70.115 4.823 17.862 1.00 0.00 H new ATOM 829 N MET A 54 71.150 0.031 19.956 1.00 0.00 N ATOM 830 CA MET A 54 71.607 -1.192 20.608 1.00 0.00 C ATOM 831 C MET A 54 71.789 -2.307 19.585 1.00 0.00 C ATOM 832 O MET A 54 72.737 -3.090 19.667 1.00 0.00 O ATOM 833 CB MET A 54 70.593 -1.629 21.667 1.00 0.00 C ATOM 834 CG MET A 54 70.550 -0.592 22.791 1.00 0.00 C ATOM 835 SD MET A 54 69.228 -1.017 23.953 1.00 0.00 S ATOM 836 CE MET A 54 69.587 0.262 25.183 1.00 0.00 C ATOM 0 H MET A 54 70.200 0.313 20.198 1.00 0.00 H new ATOM 0 HA MET A 54 72.566 -0.991 21.085 1.00 0.00 H new ATOM 0 HB2 MET A 54 69.605 -1.736 21.218 1.00 0.00 H new ATOM 0 HB3 MET A 54 70.868 -2.605 22.068 1.00 0.00 H new ATOM 0 HG2 MET A 54 71.508 -0.562 23.309 1.00 0.00 H new ATOM 0 HG3 MET A 54 70.380 0.402 22.377 1.00 0.00 H new ATOM 0 HE1 MET A 54 68.702 0.438 25.794 1.00 0.00 H new ATOM 0 HE2 MET A 54 70.408 -0.066 25.820 1.00 0.00 H new ATOM 0 HE3 MET A 54 69.867 1.186 24.676 1.00 0.00 H new ATOM 846 N LEU A 55 70.876 -2.375 18.620 1.00 0.00 N ATOM 847 CA LEU A 55 70.948 -3.400 17.585 1.00 0.00 C ATOM 848 C LEU A 55 72.239 -3.263 16.785 1.00 0.00 C ATOM 849 O LEU A 55 72.842 -4.260 16.387 1.00 0.00 O ATOM 850 CB LEU A 55 69.747 -3.275 16.645 1.00 0.00 C ATOM 851 CG LEU A 55 68.461 -3.574 17.416 1.00 0.00 C ATOM 852 CD1 LEU A 55 67.252 -3.278 16.528 1.00 0.00 C ATOM 853 CD2 LEU A 55 68.444 -5.050 17.824 1.00 0.00 C ATOM 0 H LEU A 55 70.084 -1.738 18.534 1.00 0.00 H new ATOM 0 HA LEU A 55 70.934 -4.378 18.065 1.00 0.00 H new ATOM 0 HB2 LEU A 55 69.705 -2.271 16.223 1.00 0.00 H new ATOM 0 HB3 LEU A 55 69.852 -3.968 15.810 1.00 0.00 H new ATOM 0 HG LEU A 55 68.418 -2.948 18.307 1.00 0.00 H new ATOM 0 HD11 LEU A 55 66.336 -3.491 17.078 1.00 0.00 H new ATOM 0 HD12 LEU A 55 67.264 -2.228 16.236 1.00 0.00 H new ATOM 0 HD13 LEU A 55 67.294 -3.903 15.636 1.00 0.00 H new ATOM 0 HD21 LEU A 55 67.528 -5.265 18.374 1.00 0.00 H new ATOM 0 HD22 LEU A 55 68.487 -5.675 16.932 1.00 0.00 H new ATOM 0 HD23 LEU A 55 69.305 -5.262 18.457 1.00 0.00 H new ATOM 865 N ASP A 56 72.657 -2.024 16.553 1.00 0.00 N ATOM 866 CA ASP A 56 73.880 -1.769 15.799 1.00 0.00 C ATOM 867 C ASP A 56 75.025 -2.624 16.331 1.00 0.00 C ATOM 868 O ASP A 56 75.887 -3.067 15.571 1.00 0.00 O ATOM 869 CB ASP A 56 74.256 -0.290 15.898 1.00 0.00 C ATOM 870 CG ASP A 56 75.458 0.004 15.007 1.00 0.00 C ATOM 871 OD1 ASP A 56 76.036 -0.941 14.496 1.00 0.00 O ATOM 872 OD2 ASP A 56 75.784 1.169 14.850 1.00 0.00 O ATOM 0 H ASP A 56 72.172 -1.186 16.873 1.00 0.00 H new ATOM 0 HA ASP A 56 73.702 -2.029 14.755 1.00 0.00 H new ATOM 0 HB2 ASP A 56 73.411 0.329 15.598 1.00 0.00 H new ATOM 0 HB3 ASP A 56 74.488 -0.034 16.932 1.00 0.00 H new ATOM 877 N SER A 57 75.028 -2.852 17.640 1.00 0.00 N ATOM 878 CA SER A 57 76.074 -3.656 18.263 1.00 0.00 C ATOM 879 C SER A 57 75.832 -5.140 18.007 1.00 0.00 C ATOM 880 O SER A 57 76.674 -5.980 18.326 1.00 0.00 O ATOM 881 CB SER A 57 76.106 -3.395 19.768 1.00 0.00 C ATOM 882 OG SER A 57 74.914 -3.897 20.358 1.00 0.00 O ATOM 0 H SER A 57 74.324 -2.495 18.286 1.00 0.00 H new ATOM 0 HA SER A 57 77.032 -3.375 17.826 1.00 0.00 H new ATOM 0 HB2 SER A 57 76.977 -3.876 20.214 1.00 0.00 H new ATOM 0 HB3 SER A 57 76.199 -2.326 19.961 1.00 0.00 H new ATOM 0 HG SER A 57 74.198 -3.235 20.263 1.00 0.00 H new ATOM 888 N ALA A 58 74.678 -5.456 17.429 1.00 0.00 N ATOM 889 CA ALA A 58 74.335 -6.842 17.135 1.00 0.00 C ATOM 890 C ALA A 58 75.034 -7.308 15.861 1.00 0.00 C ATOM 891 O ALA A 58 74.532 -8.177 15.149 1.00 0.00 O ATOM 892 CB ALA A 58 72.821 -6.982 16.969 1.00 0.00 C ATOM 0 H ALA A 58 73.969 -4.776 17.156 1.00 0.00 H new ATOM 0 HA ALA A 58 74.668 -7.463 17.967 1.00 0.00 H new ATOM 0 HB1 ALA A 58 72.574 -8.021 16.750 1.00 0.00 H new ATOM 0 HB2 ALA A 58 72.324 -6.677 17.890 1.00 0.00 H new ATOM 0 HB3 ALA A 58 72.485 -6.348 16.149 1.00 0.00 H new ATOM 898 N LYS A 59 76.195 -6.723 15.582 1.00 0.00 N ATOM 899 CA LYS A 59 76.954 -7.087 14.391 1.00 0.00 C ATOM 900 C LYS A 59 77.542 -8.486 14.536 1.00 0.00 C ATOM 901 O LYS A 59 78.590 -8.668 15.157 1.00 0.00 O ATOM 902 CB LYS A 59 78.081 -6.078 14.162 1.00 0.00 C ATOM 903 CG LYS A 59 78.679 -5.667 15.509 1.00 0.00 C ATOM 904 CD LYS A 59 79.979 -4.894 15.277 1.00 0.00 C ATOM 905 CE LYS A 59 80.583 -4.494 16.624 1.00 0.00 C ATOM 906 NZ LYS A 59 81.871 -3.779 16.399 1.00 0.00 N ATOM 0 H LYS A 59 76.627 -6.001 16.159 1.00 0.00 H new ATOM 0 HA LYS A 59 76.278 -7.077 13.536 1.00 0.00 H new ATOM 0 HB2 LYS A 59 78.852 -6.516 13.528 1.00 0.00 H new ATOM 0 HB3 LYS A 59 77.698 -5.201 13.639 1.00 0.00 H new ATOM 0 HG2 LYS A 59 77.970 -5.049 16.060 1.00 0.00 H new ATOM 0 HG3 LYS A 59 78.873 -6.550 16.117 1.00 0.00 H new ATOM 0 HD2 LYS A 59 80.685 -5.508 14.718 1.00 0.00 H new ATOM 0 HD3 LYS A 59 79.784 -4.006 14.676 1.00 0.00 H new ATOM 0 HE2 LYS A 59 79.890 -3.854 17.169 1.00 0.00 H new ATOM 0 HE3 LYS A 59 80.749 -5.380 17.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 82.282 -3.507 17.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 82.532 -4.404 15.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 81.700 -2.926 15.829 1.00 0.00 H new ATOM 920 N GLY A 60 76.864 -9.471 13.957 1.00 0.00 N ATOM 921 CA GLY A 60 77.330 -10.851 14.029 1.00 0.00 C ATOM 922 C GLY A 60 76.490 -11.659 15.012 1.00 0.00 C ATOM 923 O GLY A 60 76.737 -12.847 15.224 1.00 0.00 O ATOM 0 H GLY A 60 75.996 -9.341 13.436 1.00 0.00 H new ATOM 0 HA2 GLY A 60 77.280 -11.308 13.041 1.00 0.00 H new ATOM 0 HA3 GLY A 60 78.376 -10.870 14.336 1.00 0.00 H new ATOM 927 N ARG A 61 75.498 -11.008 15.610 1.00 0.00 N ATOM 928 CA ARG A 61 74.627 -11.677 16.569 1.00 0.00 C ATOM 929 C ARG A 61 73.276 -11.994 15.936 1.00 0.00 C ATOM 930 O ARG A 61 72.901 -11.406 14.922 1.00 0.00 O ATOM 931 CB ARG A 61 74.422 -10.787 17.797 1.00 0.00 C ATOM 932 CG ARG A 61 75.773 -10.512 18.460 1.00 0.00 C ATOM 933 CD ARG A 61 75.550 -9.845 19.818 1.00 0.00 C ATOM 934 NE ARG A 61 74.929 -10.785 20.745 1.00 0.00 N ATOM 935 CZ ARG A 61 75.651 -11.705 21.377 1.00 0.00 C ATOM 936 NH1 ARG A 61 75.072 -12.534 22.202 1.00 0.00 N ATOM 937 NH2 ARG A 61 76.937 -11.778 21.174 1.00 0.00 N ATOM 0 H ARG A 61 75.278 -10.025 15.449 1.00 0.00 H new ATOM 0 HA ARG A 61 75.101 -12.611 16.872 1.00 0.00 H new ATOM 0 HB2 ARG A 61 73.951 -9.849 17.504 1.00 0.00 H new ATOM 0 HB3 ARG A 61 73.750 -11.274 18.504 1.00 0.00 H new ATOM 0 HG2 ARG A 61 76.324 -11.444 18.587 1.00 0.00 H new ATOM 0 HG3 ARG A 61 76.379 -9.868 17.822 1.00 0.00 H new ATOM 0 HD2 ARG A 61 76.501 -9.499 20.222 1.00 0.00 H new ATOM 0 HD3 ARG A 61 74.916 -8.966 19.700 1.00 0.00 H new ATOM 0 HE ARG A 61 73.924 -10.735 20.911 1.00 0.00 H new ATOM 0 HH11 ARG A 61 74.066 -12.476 22.361 1.00 0.00 H new ATOM 0 HH12 ARG A 61 75.625 -13.240 22.687 1.00 0.00 H new ATOM 0 HH21 ARG A 61 77.389 -11.129 20.530 1.00 0.00 H new ATOM 0 HH22 ARG A 61 77.491 -12.484 21.659 1.00 0.00 H new ATOM 951 N GLN A 62 72.549 -12.928 16.542 1.00 0.00 N ATOM 952 CA GLN A 62 71.241 -13.316 16.027 1.00 0.00 C ATOM 953 C GLN A 62 70.137 -12.504 16.698 1.00 0.00 C ATOM 954 O GLN A 62 70.249 -12.135 17.868 1.00 0.00 O ATOM 955 CB GLN A 62 71.003 -14.807 16.276 1.00 0.00 C ATOM 956 CG GLN A 62 71.943 -15.629 15.393 1.00 0.00 C ATOM 957 CD GLN A 62 71.789 -17.113 15.707 1.00 0.00 C ATOM 958 OE1 GLN A 62 71.706 -17.496 16.874 1.00 0.00 O ATOM 959 NE2 GLN A 62 71.746 -17.977 14.729 1.00 0.00 N ATOM 0 H GLN A 62 72.840 -13.426 17.383 1.00 0.00 H new ATOM 0 HA GLN A 62 71.221 -13.118 14.955 1.00 0.00 H new ATOM 0 HB2 GLN A 62 71.175 -15.043 17.326 1.00 0.00 H new ATOM 0 HB3 GLN A 62 69.966 -15.062 16.057 1.00 0.00 H new ATOM 0 HG2 GLN A 62 71.720 -15.446 14.342 1.00 0.00 H new ATOM 0 HG3 GLN A 62 72.975 -15.319 15.559 1.00 0.00 H new ATOM 0 HE21 GLN A 62 71.815 -17.657 13.763 1.00 0.00 H new ATOM 0 HE22 GLN A 62 71.643 -18.971 14.931 1.00 0.00 H new ATOM 968 N ILE A 63 69.073 -12.231 15.951 1.00 0.00 N ATOM 969 CA ILE A 63 67.955 -11.463 16.484 1.00 0.00 C ATOM 970 C ILE A 63 66.631 -12.143 16.151 1.00 0.00 C ATOM 971 O ILE A 63 66.555 -12.959 15.232 1.00 0.00 O ATOM 972 CB ILE A 63 67.966 -10.049 15.899 1.00 0.00 C ATOM 973 CG1 ILE A 63 67.627 -10.113 14.407 1.00 0.00 C ATOM 974 CG2 ILE A 63 69.353 -9.431 16.079 1.00 0.00 C ATOM 975 CD1 ILE A 63 67.714 -8.711 13.803 1.00 0.00 C ATOM 0 H ILE A 63 68.962 -12.528 14.982 1.00 0.00 H new ATOM 0 HA ILE A 63 68.060 -11.408 17.568 1.00 0.00 H new ATOM 0 HB ILE A 63 67.227 -9.437 16.416 1.00 0.00 H new ATOM 0 HG12 ILE A 63 68.317 -10.784 13.895 1.00 0.00 H new ATOM 0 HG13 ILE A 63 66.625 -10.519 14.268 1.00 0.00 H new ATOM 0 HG21 ILE A 63 69.360 -8.424 15.662 1.00 0.00 H new ATOM 0 HG22 ILE A 63 69.596 -9.386 17.141 1.00 0.00 H new ATOM 0 HG23 ILE A 63 70.093 -10.042 15.563 1.00 0.00 H new ATOM 0 HD11 ILE A 63 67.473 -8.757 12.741 1.00 0.00 H new ATOM 0 HD12 ILE A 63 67.007 -8.053 14.308 1.00 0.00 H new ATOM 0 HD13 ILE A 63 68.725 -8.323 13.929 1.00 0.00 H new ATOM 987 N GLU A 64 65.589 -11.803 16.904 1.00 0.00 N ATOM 988 CA GLU A 64 64.273 -12.389 16.678 1.00 0.00 C ATOM 989 C GLU A 64 63.255 -11.305 16.337 1.00 0.00 C ATOM 990 O GLU A 64 62.710 -10.650 17.224 1.00 0.00 O ATOM 991 CB GLU A 64 63.817 -13.144 17.928 1.00 0.00 C ATOM 992 CG GLU A 64 65.020 -13.830 18.577 1.00 0.00 C ATOM 993 CD GLU A 64 64.567 -14.647 19.783 1.00 0.00 C ATOM 994 OE1 GLU A 64 63.930 -14.077 20.654 1.00 0.00 O ATOM 995 OE2 GLU A 64 64.862 -15.830 19.818 1.00 0.00 O ATOM 0 H GLU A 64 65.630 -11.130 17.670 1.00 0.00 H new ATOM 0 HA GLU A 64 64.343 -13.082 15.840 1.00 0.00 H new ATOM 0 HB2 GLU A 64 63.354 -12.454 18.634 1.00 0.00 H new ATOM 0 HB3 GLU A 64 63.062 -13.884 17.663 1.00 0.00 H new ATOM 0 HG2 GLU A 64 65.514 -14.478 17.853 1.00 0.00 H new ATOM 0 HG3 GLU A 64 65.751 -13.083 18.887 1.00 0.00 H new ATOM 1002 N VAL A 65 63.005 -11.122 15.045 1.00 0.00 N ATOM 1003 CA VAL A 65 62.050 -10.115 14.596 1.00 0.00 C ATOM 1004 C VAL A 65 60.621 -10.623 14.755 1.00 0.00 C ATOM 1005 O VAL A 65 60.285 -11.714 14.295 1.00 0.00 O ATOM 1006 CB VAL A 65 62.309 -9.765 13.130 1.00 0.00 C ATOM 1007 CG1 VAL A 65 61.487 -8.534 12.746 1.00 0.00 C ATOM 1008 CG2 VAL A 65 63.798 -9.465 12.936 1.00 0.00 C ATOM 0 H VAL A 65 63.447 -11.653 14.295 1.00 0.00 H new ATOM 0 HA VAL A 65 62.177 -9.223 15.209 1.00 0.00 H new ATOM 0 HB VAL A 65 62.020 -10.605 12.498 1.00 0.00 H new ATOM 0 HG11 VAL A 65 61.672 -8.285 11.701 1.00 0.00 H new ATOM 0 HG12 VAL A 65 60.427 -8.746 12.887 1.00 0.00 H new ATOM 0 HG13 VAL A 65 61.776 -7.693 13.376 1.00 0.00 H new ATOM 0 HG21 VAL A 65 63.986 -9.215 11.892 1.00 0.00 H new ATOM 0 HG22 VAL A 65 64.085 -8.624 13.568 1.00 0.00 H new ATOM 0 HG23 VAL A 65 64.385 -10.342 13.210 1.00 0.00 H new ATOM 1018 N GLU A 66 59.783 -9.824 15.408 1.00 0.00 N ATOM 1019 CA GLU A 66 58.392 -10.204 15.622 1.00 0.00 C ATOM 1020 C GLU A 66 57.456 -9.102 15.132 1.00 0.00 C ATOM 1021 O GLU A 66 57.730 -7.916 15.313 1.00 0.00 O ATOM 1022 CB GLU A 66 58.143 -10.462 17.109 1.00 0.00 C ATOM 1023 CG GLU A 66 56.663 -10.776 17.332 1.00 0.00 C ATOM 1024 CD GLU A 66 56.441 -11.253 18.763 1.00 0.00 C ATOM 1025 OE1 GLU A 66 57.408 -11.304 19.506 1.00 0.00 O ATOM 1026 OE2 GLU A 66 55.309 -11.560 19.096 1.00 0.00 O ATOM 0 H GLU A 66 60.041 -8.916 15.795 1.00 0.00 H new ATOM 0 HA GLU A 66 58.192 -11.115 15.058 1.00 0.00 H new ATOM 0 HB2 GLU A 66 58.758 -11.294 17.452 1.00 0.00 H new ATOM 0 HB3 GLU A 66 58.433 -9.589 17.694 1.00 0.00 H new ATOM 0 HG2 GLU A 66 56.061 -9.888 17.138 1.00 0.00 H new ATOM 0 HG3 GLU A 66 56.335 -11.542 16.630 1.00 0.00 H new ATOM 1033 N ALA A 67 56.351 -9.504 14.511 1.00 0.00 N ATOM 1034 CA ALA A 67 55.383 -8.543 13.998 1.00 0.00 C ATOM 1035 C ALA A 67 53.959 -9.008 14.290 1.00 0.00 C ATOM 1036 O ALA A 67 53.637 -10.186 14.134 1.00 0.00 O ATOM 1037 CB ALA A 67 55.566 -8.369 12.490 1.00 0.00 C ATOM 0 H ALA A 67 56.106 -10.481 14.352 1.00 0.00 H new ATOM 0 HA ALA A 67 55.551 -7.588 14.496 1.00 0.00 H new ATOM 0 HB1 ALA A 67 54.838 -7.649 12.116 1.00 0.00 H new ATOM 0 HB2 ALA A 67 56.573 -8.006 12.285 1.00 0.00 H new ATOM 0 HB3 ALA A 67 55.417 -9.327 11.992 1.00 0.00 H new ATOM 1043 N THR A 68 53.111 -8.076 14.713 1.00 0.00 N ATOM 1044 CA THR A 68 51.725 -8.402 15.023 1.00 0.00 C ATOM 1045 C THR A 68 50.775 -7.507 14.234 1.00 0.00 C ATOM 1046 O THR A 68 51.042 -6.322 14.038 1.00 0.00 O ATOM 1047 CB THR A 68 51.468 -8.226 16.522 1.00 0.00 C ATOM 1048 OG1 THR A 68 52.417 -8.988 17.255 1.00 0.00 O ATOM 1049 CG2 THR A 68 50.055 -8.704 16.859 1.00 0.00 C ATOM 0 H THR A 68 53.358 -7.096 14.848 1.00 0.00 H new ATOM 0 HA THR A 68 51.545 -9.440 14.744 1.00 0.00 H new ATOM 0 HB THR A 68 51.564 -7.173 16.787 1.00 0.00 H new ATOM 0 HG1 THR A 68 52.256 -8.876 18.215 1.00 0.00 H new ATOM 0 HG21 THR A 68 49.873 -8.578 17.926 1.00 0.00 H new ATOM 0 HG22 THR A 68 49.329 -8.118 16.296 1.00 0.00 H new ATOM 0 HG23 THR A 68 49.955 -9.757 16.595 1.00 0.00 H new ATOM 1057 N GLY A 69 49.665 -8.084 13.783 1.00 0.00 N ATOM 1058 CA GLY A 69 48.682 -7.328 13.014 1.00 0.00 C ATOM 1059 C GLY A 69 48.348 -8.039 11.707 1.00 0.00 C ATOM 1060 O GLY A 69 48.844 -9.133 11.437 1.00 0.00 O ATOM 0 H GLY A 69 49.425 -9.064 13.935 1.00 0.00 H new ATOM 0 HA2 GLY A 69 47.775 -7.198 13.604 1.00 0.00 H new ATOM 0 HA3 GLY A 69 49.069 -6.331 12.802 1.00 0.00 H new ATOM 1064 N PRO A 70 47.520 -7.435 10.900 1.00 0.00 N ATOM 1065 CA PRO A 70 47.104 -8.011 9.589 1.00 0.00 C ATOM 1066 C PRO A 70 48.232 -7.972 8.561 1.00 0.00 C ATOM 1067 O PRO A 70 48.319 -8.834 7.687 1.00 0.00 O ATOM 1068 CB PRO A 70 45.937 -7.123 9.154 1.00 0.00 C ATOM 1069 CG PRO A 70 46.144 -5.820 9.854 1.00 0.00 C ATOM 1070 CD PRO A 70 46.888 -6.131 11.153 1.00 0.00 C ATOM 0 HA PRO A 70 46.834 -9.064 9.672 1.00 0.00 H new ATOM 0 HB2 PRO A 70 45.927 -6.990 8.072 1.00 0.00 H new ATOM 0 HB3 PRO A 70 44.981 -7.569 9.429 1.00 0.00 H new ATOM 0 HG2 PRO A 70 46.720 -5.135 9.233 1.00 0.00 H new ATOM 0 HG3 PRO A 70 45.189 -5.336 10.061 1.00 0.00 H new ATOM 0 HD2 PRO A 70 47.630 -5.366 11.381 1.00 0.00 H new ATOM 0 HD3 PRO A 70 46.206 -6.176 12.002 1.00 0.00 H new ATOM 1078 N GLN A 71 49.094 -6.966 8.674 1.00 0.00 N ATOM 1079 CA GLN A 71 50.213 -6.825 7.750 1.00 0.00 C ATOM 1080 C GLN A 71 51.510 -7.295 8.402 1.00 0.00 C ATOM 1081 O GLN A 71 52.596 -7.095 7.860 1.00 0.00 O ATOM 1082 CB GLN A 71 50.356 -5.363 7.323 1.00 0.00 C ATOM 1083 CG GLN A 71 49.148 -4.958 6.475 1.00 0.00 C ATOM 1084 CD GLN A 71 49.345 -3.549 5.929 1.00 0.00 C ATOM 1085 OE1 GLN A 71 50.313 -3.287 5.215 1.00 0.00 O ATOM 1086 NE2 GLN A 71 48.477 -2.619 6.222 1.00 0.00 N ATOM 0 H GLN A 71 49.040 -6.242 9.390 1.00 0.00 H new ATOM 0 HA GLN A 71 50.016 -7.442 6.874 1.00 0.00 H new ATOM 0 HB2 GLN A 71 50.428 -4.722 8.202 1.00 0.00 H new ATOM 0 HB3 GLN A 71 51.275 -5.228 6.753 1.00 0.00 H new ATOM 0 HG2 GLN A 71 49.018 -5.661 5.652 1.00 0.00 H new ATOM 0 HG3 GLN A 71 48.240 -5.000 7.077 1.00 0.00 H new ATOM 0 HE21 GLN A 71 47.675 -2.838 6.814 1.00 0.00 H new ATOM 0 HE22 GLN A 71 48.600 -1.674 5.859 1.00 0.00 H new ATOM 1095 N GLU A 72 51.386 -7.921 9.568 1.00 0.00 N ATOM 1096 CA GLU A 72 52.555 -8.416 10.286 1.00 0.00 C ATOM 1097 C GLU A 72 53.486 -9.166 9.339 1.00 0.00 C ATOM 1098 O GLU A 72 54.701 -8.963 9.357 1.00 0.00 O ATOM 1099 CB GLU A 72 52.118 -9.346 11.418 1.00 0.00 C ATOM 1100 CG GLU A 72 51.457 -10.594 10.828 1.00 0.00 C ATOM 1101 CD GLU A 72 50.774 -11.393 11.932 1.00 0.00 C ATOM 1102 OE1 GLU A 72 50.884 -10.994 13.079 1.00 0.00 O ATOM 1103 OE2 GLU A 72 50.152 -12.393 11.614 1.00 0.00 O ATOM 0 H GLU A 72 50.495 -8.097 10.033 1.00 0.00 H new ATOM 0 HA GLU A 72 53.090 -7.563 10.704 1.00 0.00 H new ATOM 0 HB2 GLU A 72 52.979 -9.629 12.023 1.00 0.00 H new ATOM 0 HB3 GLU A 72 51.421 -8.830 12.078 1.00 0.00 H new ATOM 0 HG2 GLU A 72 50.727 -10.306 10.071 1.00 0.00 H new ATOM 0 HG3 GLU A 72 52.205 -11.211 10.331 1.00 0.00 H new ATOM 1110 N GLU A 73 52.909 -10.032 8.513 1.00 0.00 N ATOM 1111 CA GLU A 73 53.699 -10.807 7.562 1.00 0.00 C ATOM 1112 C GLU A 73 54.445 -9.881 6.607 1.00 0.00 C ATOM 1113 O GLU A 73 55.627 -10.083 6.329 1.00 0.00 O ATOM 1114 CB GLU A 73 52.787 -11.742 6.764 1.00 0.00 C ATOM 1115 CG GLU A 73 51.445 -11.053 6.513 1.00 0.00 C ATOM 1116 CD GLU A 73 50.687 -11.777 5.404 1.00 0.00 C ATOM 1117 OE1 GLU A 73 51.166 -11.767 4.283 1.00 0.00 O ATOM 1118 OE2 GLU A 73 49.639 -12.330 5.694 1.00 0.00 O ATOM 0 H GLU A 73 51.906 -10.214 8.482 1.00 0.00 H new ATOM 0 HA GLU A 73 54.426 -11.399 8.118 1.00 0.00 H new ATOM 0 HB2 GLU A 73 53.257 -12.004 5.816 1.00 0.00 H new ATOM 0 HB3 GLU A 73 52.634 -12.672 7.311 1.00 0.00 H new ATOM 0 HG2 GLU A 73 50.852 -11.049 7.428 1.00 0.00 H new ATOM 0 HG3 GLU A 73 51.608 -10.012 6.234 1.00 0.00 H new ATOM 1125 N GLU A 74 53.746 -8.867 6.107 1.00 0.00 N ATOM 1126 CA GLU A 74 54.353 -7.916 5.184 1.00 0.00 C ATOM 1127 C GLU A 74 55.513 -7.186 5.853 1.00 0.00 C ATOM 1128 O GLU A 74 56.611 -7.108 5.302 1.00 0.00 O ATOM 1129 CB GLU A 74 53.308 -6.901 4.718 1.00 0.00 C ATOM 1130 CG GLU A 74 52.210 -7.620 3.933 1.00 0.00 C ATOM 1131 CD GLU A 74 51.273 -6.602 3.293 1.00 0.00 C ATOM 1132 OE1 GLU A 74 51.507 -5.418 3.472 1.00 0.00 O ATOM 1133 OE2 GLU A 74 50.337 -7.020 2.634 1.00 0.00 O ATOM 0 H GLU A 74 52.766 -8.684 6.324 1.00 0.00 H new ATOM 0 HA GLU A 74 54.733 -8.466 4.323 1.00 0.00 H new ATOM 0 HB2 GLU A 74 52.878 -6.386 5.577 1.00 0.00 H new ATOM 0 HB3 GLU A 74 53.777 -6.141 4.094 1.00 0.00 H new ATOM 0 HG2 GLU A 74 52.655 -8.250 3.163 1.00 0.00 H new ATOM 0 HG3 GLU A 74 51.648 -8.277 4.597 1.00 0.00 H new ATOM 1140 N ALA A 75 55.261 -6.654 7.045 1.00 0.00 N ATOM 1141 CA ALA A 75 56.293 -5.933 7.781 1.00 0.00 C ATOM 1142 C ALA A 75 57.501 -6.831 8.023 1.00 0.00 C ATOM 1143 O ALA A 75 58.642 -6.428 7.795 1.00 0.00 O ATOM 1144 CB ALA A 75 55.737 -5.449 9.121 1.00 0.00 C ATOM 0 H ALA A 75 54.359 -6.708 7.518 1.00 0.00 H new ATOM 0 HA ALA A 75 56.605 -5.074 7.187 1.00 0.00 H new ATOM 0 HB1 ALA A 75 56.514 -4.912 9.665 1.00 0.00 H new ATOM 0 HB2 ALA A 75 54.891 -4.784 8.945 1.00 0.00 H new ATOM 0 HB3 ALA A 75 55.409 -6.306 9.710 1.00 0.00 H new ATOM 1150 N LEU A 76 57.243 -8.049 8.486 1.00 0.00 N ATOM 1151 CA LEU A 76 58.318 -8.997 8.754 1.00 0.00 C ATOM 1152 C LEU A 76 59.042 -9.363 7.463 1.00 0.00 C ATOM 1153 O LEU A 76 60.272 -9.380 7.414 1.00 0.00 O ATOM 1154 CB LEU A 76 57.750 -10.262 9.399 1.00 0.00 C ATOM 1155 CG LEU A 76 58.839 -10.950 10.223 1.00 0.00 C ATOM 1156 CD1 LEU A 76 58.857 -10.367 11.637 1.00 0.00 C ATOM 1157 CD2 LEU A 76 58.551 -12.452 10.296 1.00 0.00 C ATOM 0 H LEU A 76 56.306 -8.401 8.682 1.00 0.00 H new ATOM 0 HA LEU A 76 59.028 -8.530 9.436 1.00 0.00 H new ATOM 0 HB2 LEU A 76 56.903 -10.009 10.036 1.00 0.00 H new ATOM 0 HB3 LEU A 76 57.379 -10.939 8.630 1.00 0.00 H new ATOM 0 HG LEU A 76 59.808 -10.787 9.751 1.00 0.00 H new ATOM 0 HD11 LEU A 76 59.634 -10.858 12.223 1.00 0.00 H new ATOM 0 HD12 LEU A 76 59.062 -9.298 11.587 1.00 0.00 H new ATOM 0 HD13 LEU A 76 57.888 -10.529 12.110 1.00 0.00 H new ATOM 0 HD21 LEU A 76 59.327 -12.943 10.883 1.00 0.00 H new ATOM 0 HD22 LEU A 76 57.582 -12.614 10.768 1.00 0.00 H new ATOM 0 HD23 LEU A 76 58.539 -12.870 9.289 1.00 0.00 H new ATOM 1169 N ALA A 77 58.272 -9.654 6.421 1.00 0.00 N ATOM 1170 CA ALA A 77 58.851 -10.017 5.133 1.00 0.00 C ATOM 1171 C ALA A 77 59.670 -8.861 4.571 1.00 0.00 C ATOM 1172 O ALA A 77 60.763 -9.061 4.041 1.00 0.00 O ATOM 1173 CB ALA A 77 57.741 -10.386 4.146 1.00 0.00 C ATOM 0 H ALA A 77 57.252 -9.646 6.442 1.00 0.00 H new ATOM 0 HA ALA A 77 59.506 -10.876 5.279 1.00 0.00 H new ATOM 0 HB1 ALA A 77 58.182 -10.656 3.186 1.00 0.00 H new ATOM 0 HB2 ALA A 77 57.174 -11.232 4.535 1.00 0.00 H new ATOM 0 HB3 ALA A 77 57.075 -9.534 4.012 1.00 0.00 H new ATOM 1179 N ALA A 78 59.136 -7.650 4.692 1.00 0.00 N ATOM 1180 CA ALA A 78 59.827 -6.467 4.194 1.00 0.00 C ATOM 1181 C ALA A 78 61.152 -6.275 4.926 1.00 0.00 C ATOM 1182 O ALA A 78 62.182 -6.010 4.307 1.00 0.00 O ATOM 1183 CB ALA A 78 58.951 -5.228 4.389 1.00 0.00 C ATOM 0 H ALA A 78 58.233 -7.463 5.128 1.00 0.00 H new ATOM 0 HA ALA A 78 60.027 -6.606 3.131 1.00 0.00 H new ATOM 0 HB1 ALA A 78 59.475 -4.349 4.014 1.00 0.00 H new ATOM 0 HB2 ALA A 78 58.016 -5.354 3.842 1.00 0.00 H new ATOM 0 HB3 ALA A 78 58.736 -5.097 5.450 1.00 0.00 H new ATOM 1189 N VAL A 79 61.117 -6.414 6.247 1.00 0.00 N ATOM 1190 CA VAL A 79 62.321 -6.258 7.054 1.00 0.00 C ATOM 1191 C VAL A 79 63.299 -7.394 6.780 1.00 0.00 C ATOM 1192 O VAL A 79 64.498 -7.168 6.611 1.00 0.00 O ATOM 1193 CB VAL A 79 61.956 -6.241 8.540 1.00 0.00 C ATOM 1194 CG1 VAL A 79 63.230 -6.112 9.377 1.00 0.00 C ATOM 1195 CG2 VAL A 79 61.036 -5.053 8.825 1.00 0.00 C ATOM 0 H VAL A 79 60.274 -6.633 6.778 1.00 0.00 H new ATOM 0 HA VAL A 79 62.795 -5.314 6.787 1.00 0.00 H new ATOM 0 HB VAL A 79 61.444 -7.168 8.799 1.00 0.00 H new ATOM 0 HG11 VAL A 79 62.970 -6.100 10.436 1.00 0.00 H new ATOM 0 HG12 VAL A 79 63.886 -6.959 9.174 1.00 0.00 H new ATOM 0 HG13 VAL A 79 63.743 -5.186 9.119 1.00 0.00 H new ATOM 0 HG21 VAL A 79 60.776 -5.040 9.883 1.00 0.00 H new ATOM 0 HG22 VAL A 79 61.548 -4.126 8.566 1.00 0.00 H new ATOM 0 HG23 VAL A 79 60.128 -5.145 8.229 1.00 0.00 H new ATOM 1205 N ILE A 80 62.780 -8.617 6.736 1.00 0.00 N ATOM 1206 CA ILE A 80 63.617 -9.783 6.479 1.00 0.00 C ATOM 1207 C ILE A 80 64.251 -9.689 5.095 1.00 0.00 C ATOM 1208 O ILE A 80 65.439 -9.964 4.926 1.00 0.00 O ATOM 1209 CB ILE A 80 62.779 -11.058 6.574 1.00 0.00 C ATOM 1210 CG1 ILE A 80 62.461 -11.349 8.043 1.00 0.00 C ATOM 1211 CG2 ILE A 80 63.565 -12.231 5.982 1.00 0.00 C ATOM 1212 CD1 ILE A 80 61.448 -12.493 8.130 1.00 0.00 C ATOM 0 H ILE A 80 61.791 -8.825 6.874 1.00 0.00 H new ATOM 0 HA ILE A 80 64.408 -9.813 7.228 1.00 0.00 H new ATOM 0 HB ILE A 80 61.851 -10.925 6.019 1.00 0.00 H new ATOM 0 HG12 ILE A 80 63.373 -11.615 8.577 1.00 0.00 H new ATOM 0 HG13 ILE A 80 62.059 -10.456 8.523 1.00 0.00 H new ATOM 0 HG21 ILE A 80 62.968 -13.140 6.050 1.00 0.00 H new ATOM 0 HG22 ILE A 80 63.795 -12.025 4.937 1.00 0.00 H new ATOM 0 HG23 ILE A 80 64.493 -12.364 6.538 1.00 0.00 H new ATOM 0 HD11 ILE A 80 61.222 -12.700 9.176 1.00 0.00 H new ATOM 0 HD12 ILE A 80 60.533 -12.209 7.610 1.00 0.00 H new ATOM 0 HD13 ILE A 80 61.867 -13.386 7.666 1.00 0.00 H new ATOM 1224 N ALA A 81 63.452 -9.297 4.109 1.00 0.00 N ATOM 1225 CA ALA A 81 63.947 -9.167 2.743 1.00 0.00 C ATOM 1226 C ALA A 81 65.066 -8.134 2.677 1.00 0.00 C ATOM 1227 O ALA A 81 66.005 -8.271 1.892 1.00 0.00 O ATOM 1228 CB ALA A 81 62.808 -8.750 1.811 1.00 0.00 C ATOM 0 H ALA A 81 62.466 -9.065 4.228 1.00 0.00 H new ATOM 0 HA ALA A 81 64.339 -10.133 2.425 1.00 0.00 H new ATOM 0 HB1 ALA A 81 63.187 -8.655 0.793 1.00 0.00 H new ATOM 0 HB2 ALA A 81 62.022 -9.505 1.837 1.00 0.00 H new ATOM 0 HB3 ALA A 81 62.403 -7.792 2.138 1.00 0.00 H new ATOM 1234 N LEU A 82 64.959 -7.101 3.507 1.00 0.00 N ATOM 1235 CA LEU A 82 65.968 -6.050 3.536 1.00 0.00 C ATOM 1236 C LEU A 82 67.236 -6.544 4.225 1.00 0.00 C ATOM 1237 O LEU A 82 68.347 -6.256 3.781 1.00 0.00 O ATOM 1238 CB LEU A 82 65.426 -4.827 4.279 1.00 0.00 C ATOM 1239 CG LEU A 82 65.027 -3.751 3.267 1.00 0.00 C ATOM 1240 CD1 LEU A 82 66.282 -3.177 2.607 1.00 0.00 C ATOM 1241 CD2 LEU A 82 64.126 -4.369 2.195 1.00 0.00 C ATOM 0 H LEU A 82 64.189 -6.970 4.164 1.00 0.00 H new ATOM 0 HA LEU A 82 66.209 -5.775 2.509 1.00 0.00 H new ATOM 0 HB2 LEU A 82 64.565 -5.109 4.885 1.00 0.00 H new ATOM 0 HB3 LEU A 82 66.182 -4.438 4.961 1.00 0.00 H new ATOM 0 HG LEU A 82 64.490 -2.953 3.780 1.00 0.00 H new ATOM 0 HD11 LEU A 82 65.996 -2.411 1.886 1.00 0.00 H new ATOM 0 HD12 LEU A 82 66.925 -2.737 3.369 1.00 0.00 H new ATOM 0 HD13 LEU A 82 66.821 -3.974 2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 82 63.841 -3.603 1.473 1.00 0.00 H new ATOM 0 HD22 LEU A 82 64.664 -5.167 1.684 1.00 0.00 H new ATOM 0 HD23 LEU A 82 63.230 -4.777 2.663 1.00 0.00 H new ATOM 1253 N PHE A 83 67.060 -7.291 5.310 1.00 0.00 N ATOM 1254 CA PHE A 83 68.198 -7.823 6.051 1.00 0.00 C ATOM 1255 C PHE A 83 68.937 -8.866 5.221 1.00 0.00 C ATOM 1256 O PHE A 83 70.157 -9.001 5.316 1.00 0.00 O ATOM 1257 CB PHE A 83 67.719 -8.454 7.360 1.00 0.00 C ATOM 1258 CG PHE A 83 67.518 -7.375 8.397 1.00 0.00 C ATOM 1259 CD1 PHE A 83 66.901 -6.170 8.041 1.00 0.00 C ATOM 1260 CD2 PHE A 83 67.947 -7.581 9.713 1.00 0.00 C ATOM 1261 CE1 PHE A 83 66.714 -5.169 9.003 1.00 0.00 C ATOM 1262 CE2 PHE A 83 67.761 -6.581 10.675 1.00 0.00 C ATOM 1263 CZ PHE A 83 67.144 -5.375 10.320 1.00 0.00 C ATOM 0 H PHE A 83 66.148 -7.540 5.693 1.00 0.00 H new ATOM 0 HA PHE A 83 68.880 -7.002 6.272 1.00 0.00 H new ATOM 0 HB2 PHE A 83 66.786 -8.993 7.196 1.00 0.00 H new ATOM 0 HB3 PHE A 83 68.450 -9.181 7.714 1.00 0.00 H new ATOM 0 HD1 PHE A 83 66.569 -6.012 7.025 1.00 0.00 H new ATOM 0 HD2 PHE A 83 68.422 -8.512 9.987 1.00 0.00 H new ATOM 0 HE1 PHE A 83 66.238 -4.239 8.729 1.00 0.00 H new ATOM 0 HE2 PHE A 83 68.093 -6.740 11.690 1.00 0.00 H new ATOM 0 HZ PHE A 83 67.000 -4.604 11.062 1.00 0.00 H new ATOM 1273 N ASN A 84 68.189 -9.605 4.407 1.00 0.00 N ATOM 1274 CA ASN A 84 68.783 -10.636 3.564 1.00 0.00 C ATOM 1275 C ASN A 84 69.100 -10.078 2.179 1.00 0.00 C ATOM 1276 O ASN A 84 69.685 -10.766 1.342 1.00 0.00 O ATOM 1277 CB ASN A 84 67.824 -11.820 3.433 1.00 0.00 C ATOM 1278 CG ASN A 84 67.628 -12.485 4.790 1.00 0.00 C ATOM 1279 OD1 ASN A 84 68.472 -12.353 5.675 1.00 0.00 O ATOM 1280 ND2 ASN A 84 66.555 -13.197 5.009 1.00 0.00 N ATOM 0 H ASN A 84 67.178 -9.510 4.314 1.00 0.00 H new ATOM 0 HA ASN A 84 69.710 -10.971 4.029 1.00 0.00 H new ATOM 0 HB2 ASN A 84 66.864 -11.480 3.044 1.00 0.00 H new ATOM 0 HB3 ASN A 84 68.220 -12.542 2.719 1.00 0.00 H new ATOM 0 HD21 ASN A 84 66.416 -13.645 5.915 1.00 0.00 H new ATOM 0 HD22 ASN A 84 65.856 -13.305 4.274 1.00 0.00 H new ATOM 1287 N SER A 85 68.711 -8.830 1.947 1.00 0.00 N ATOM 1288 CA SER A 85 68.959 -8.191 0.659 1.00 0.00 C ATOM 1289 C SER A 85 70.156 -8.832 -0.035 1.00 0.00 C ATOM 1290 O SER A 85 70.099 -8.992 -1.243 1.00 0.00 O ATOM 1291 CB SER A 85 69.222 -6.698 0.860 1.00 0.00 C ATOM 1292 OG SER A 85 69.790 -6.159 -0.326 1.00 0.00 O ATOM 1293 OXT SER A 85 71.113 -9.153 0.651 1.00 0.00 O ATOM 0 H SER A 85 68.227 -8.244 2.627 1.00 0.00 H new ATOM 0 HA SER A 85 68.077 -8.323 0.032 1.00 0.00 H new ATOM 0 HB2 SER A 85 68.292 -6.182 1.099 1.00 0.00 H new ATOM 0 HB3 SER A 85 69.897 -6.546 1.702 1.00 0.00 H new ATOM 0 HG SER A 85 69.959 -5.202 -0.202 1.00 0.00 H new TER 1299 SER A 85