USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1018 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 47 ASN : amide:sc= -0.489 K(o=-1.3,f=-2) USER MOD Set 1.2: A 75 GLN : amide:sc= -0.86 K(o=-1.3,f=-1.9) USER MOD Set 2.1: A 14 ASN : amide:sc= -3.1! C(o=-2.6!,f=-8.6!) USER MOD Set 2.2: A 42 SER OG : rot -135:sc= 1.37 USER MOD Set 2.3: A 71 HIS : no HD1:sc= -0.88 K(o=-2.6,f=-5.5!) USER MOD Set 3.1: A 49 HIS : no HD1:sc= -0.585 X(o=-0.36,f=-0.57) USER MOD Set 3.2: A 52 SER OG : rot 173:sc= 0.223 USER MOD Set 4.1: A 45 THR OG1 : rot 160:sc= 0.00706 USER MOD Set 4.2: A 93 HIS : no HE2:sc= -5.48! C(o=-5.5!,f=-7.4!) USER MOD Set 5.1: A 11 CYS SG : rot 138:sc= 0.994 USER MOD Set 5.2: A 16 CYS SG : rot 106:sc= 0.872 USER MOD Set 5.3: A 18 SER OG : rot 107:sc= 1.18 USER MOD Set 6.1: A 6 HIS : no HE2:sc= -0.287 X(o=-6.4,f=-6.8!) USER MOD Set 6.2: A 8 THR OG1 : rot -120:sc= -1.4! USER MOD Set 6.3: A 41 THR OG1 : rot 180:sc= -0.0224 USER MOD Set 6.4: A 80 HIS : no HD1:sc= -4.67! C(o=-6.4!,f=-5.5!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.0899 USER MOD Single : A 20 MET CE :methyl -108:sc= -2.5 (180deg=-3.73) USER MOD Single : A 23 LYS NZ :NH3+ -176:sc= 1.19 (180deg=1.07) USER MOD Single : A 24 MET CE :methyl -139:sc= -2.23 (180deg=-4.94!) USER MOD Single : A 27 GLN : amide:sc= -0.0828 X(o=-0.083,f=-0.15) USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-0.98) USER MOD Single : A 31 HIS : no HD1:sc= -0.0211 X(o=-0.021,f=0.00075) USER MOD Single : A 53 CYS SG : rot 44:sc= 0.237 USER MOD Single : A 65 HIS : no HD1:sc= -0.705 K(o=-0.71,f=0.2) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0.0556 K(o=0.056,f=-1.6) USER MOD Single : A 99 GLN : amide:sc= -0.502 K(o=-0.5,f=-1.5) USER MOD Single : A 109 MET CE :methyl -129:sc= -4.55! (180deg=-8.09!) USER MOD Single : A 112 SER OG : rot -29:sc= 0.583 USER MOD Single : A 144 SER OG : rot -100:sc= 1.25 USER MOD Single : A 150 HIS : no HE2:sc= 0.358 K(o=0.36,f=-2.2!) USER MOD ----------------------------------------------------------------- ATOM 50 N PRO A 4 -6.336 21.085 -17.608 1.00 1.00 N ATOM 51 CA PRO A 4 -6.151 21.746 -16.319 1.00 1.00 C ATOM 52 C PRO A 4 -4.909 22.624 -16.269 1.00 1.00 C ATOM 53 O PRO A 4 -4.025 22.528 -17.119 1.00 1.00 O ATOM 54 CB PRO A 4 -5.997 20.582 -15.343 1.00 1.00 C ATOM 55 CG PRO A 4 -5.496 19.451 -16.171 1.00 1.00 C ATOM 56 CD PRO A 4 -6.072 19.640 -17.537 1.00 1.00 C ATOM 0 HA PRO A 4 -6.981 22.416 -16.098 1.00 1.00 H new ATOM 0 HB2 PRO A 4 -5.297 20.827 -14.544 1.00 1.00 H new ATOM 0 HB3 PRO A 4 -6.947 20.335 -14.870 1.00 1.00 H new ATOM 0 HG2 PRO A 4 -4.407 19.448 -16.206 1.00 1.00 H new ATOM 0 HG3 PRO A 4 -5.804 18.494 -15.749 1.00 1.00 H new ATOM 0 HD2 PRO A 4 -5.375 19.322 -18.313 1.00 1.00 H new ATOM 0 HD3 PRO A 4 -6.985 19.059 -17.670 1.00 1.00 H new ATOM 64 N LEU A 5 -4.826 23.433 -15.222 1.00 1.00 N ATOM 65 CA LEU A 5 -3.691 24.324 -15.035 1.00 1.00 C ATOM 66 C LEU A 5 -2.451 23.543 -14.604 1.00 1.00 C ATOM 67 O LEU A 5 -2.485 22.319 -14.495 1.00 1.00 O ATOM 68 CB LEU A 5 -4.010 25.378 -13.987 1.00 1.00 C ATOM 69 CG LEU A 5 -3.379 26.739 -14.252 1.00 1.00 C ATOM 70 CD1 LEU A 5 -4.309 27.591 -15.094 1.00 1.00 C ATOM 71 CD2 LEU A 5 -3.017 27.432 -12.952 1.00 1.00 C ATOM 0 H LEU A 5 -5.533 23.490 -14.489 1.00 1.00 H new ATOM 0 HA LEU A 5 -3.489 24.811 -15.989 1.00 1.00 H new ATOM 0 HB2 LEU A 5 -5.092 25.498 -13.927 1.00 1.00 H new ATOM 0 HB3 LEU A 5 -3.675 25.019 -13.014 1.00 1.00 H new ATOM 0 HG LEU A 5 -2.454 26.592 -14.810 1.00 1.00 H new ATOM 0 HD11 LEU A 5 -3.848 28.561 -15.277 1.00 1.00 H new ATOM 0 HD12 LEU A 5 -4.497 27.093 -16.045 1.00 1.00 H new ATOM 0 HD13 LEU A 5 -5.252 27.732 -14.566 1.00 1.00 H new ATOM 0 HD21 LEU A 5 -2.568 28.401 -13.169 1.00 1.00 H new ATOM 0 HD22 LEU A 5 -3.916 27.574 -12.353 1.00 1.00 H new ATOM 0 HD23 LEU A 5 -2.306 26.819 -12.399 1.00 1.00 H new ATOM 83 N HIS A 6 -1.384 24.261 -14.277 1.00 1.00 N ATOM 84 CA HIS A 6 -0.149 23.619 -13.847 1.00 1.00 C ATOM 85 C HIS A 6 0.711 24.577 -13.039 1.00 1.00 C ATOM 86 O HIS A 6 1.429 25.390 -13.606 1.00 1.00 O ATOM 87 CB HIS A 6 0.652 23.114 -15.051 1.00 1.00 C ATOM 88 CG HIS A 6 1.293 21.774 -14.830 1.00 1.00 C ATOM 89 ND1 HIS A 6 1.882 21.034 -15.838 1.00 1.00 N ATOM 90 CD2 HIS A 6 1.428 21.038 -13.703 1.00 1.00 C ATOM 91 CE1 HIS A 6 2.348 19.904 -15.337 1.00 1.00 C ATOM 92 NE2 HIS A 6 2.084 19.880 -14.044 1.00 1.00 N ATOM 0 H HIS A 6 -1.348 25.280 -14.301 1.00 1.00 H new ATOM 0 HA HIS A 6 -0.424 22.772 -13.219 1.00 1.00 H new ATOM 0 HB2 HIS A 6 -0.009 23.053 -15.916 1.00 1.00 H new ATOM 0 HB3 HIS A 6 1.426 23.842 -15.292 1.00 1.00 H new ATOM 0 HD1 HIS A 6 1.947 21.316 -16.816 1.00 1.00 H new ATOM 0 HD2 HIS A 6 1.083 21.311 -12.716 1.00 1.00 H new ATOM 0 HE1 HIS A 6 2.859 19.131 -15.892 1.00 1.00 H new ATOM 101 N VAL A 7 0.572 24.535 -11.724 1.00 1.00 N ATOM 102 CA VAL A 7 1.403 25.352 -10.851 1.00 1.00 C ATOM 103 C VAL A 7 2.596 24.538 -10.402 1.00 1.00 C ATOM 104 O VAL A 7 2.435 23.555 -9.690 1.00 1.00 O ATOM 105 CB VAL A 7 0.664 25.833 -9.591 1.00 1.00 C ATOM 106 CG1 VAL A 7 1.341 27.056 -9.018 1.00 1.00 C ATOM 107 CG2 VAL A 7 -0.804 26.101 -9.862 1.00 1.00 C ATOM 0 H VAL A 7 -0.105 23.947 -11.238 1.00 1.00 H new ATOM 0 HA VAL A 7 1.696 26.230 -11.427 1.00 1.00 H new ATOM 0 HB VAL A 7 0.711 25.031 -8.854 1.00 1.00 H new ATOM 0 HG11 VAL A 7 0.806 27.384 -8.127 1.00 1.00 H new ATOM 0 HG12 VAL A 7 2.370 26.812 -8.754 1.00 1.00 H new ATOM 0 HG13 VAL A 7 1.336 27.855 -9.759 1.00 1.00 H new ATOM 0 HG21 VAL A 7 -1.288 26.439 -8.945 1.00 1.00 H new ATOM 0 HG22 VAL A 7 -0.898 26.872 -10.627 1.00 1.00 H new ATOM 0 HG23 VAL A 7 -1.283 25.185 -10.209 1.00 1.00 H new ATOM 117 N THR A 8 3.766 24.873 -10.895 1.00 1.00 N ATOM 118 CA THR A 8 4.973 24.177 -10.497 1.00 1.00 C ATOM 119 C THR A 8 5.880 25.107 -9.687 1.00 1.00 C ATOM 120 O THR A 8 6.370 26.110 -10.191 1.00 1.00 O ATOM 121 CB THR A 8 5.729 23.592 -11.723 1.00 1.00 C ATOM 122 OG1 THR A 8 6.835 22.799 -11.285 1.00 1.00 O ATOM 123 CG2 THR A 8 6.231 24.672 -12.663 1.00 1.00 C ATOM 0 H THR A 8 3.910 25.622 -11.572 1.00 1.00 H new ATOM 0 HA THR A 8 4.683 23.337 -9.866 1.00 1.00 H new ATOM 0 HB THR A 8 5.016 22.977 -12.271 1.00 1.00 H new ATOM 0 HG1 THR A 8 7.667 23.172 -11.644 1.00 1.00 H new ATOM 0 HG21 THR A 8 6.752 24.211 -13.502 1.00 1.00 H new ATOM 0 HG22 THR A 8 5.386 25.252 -13.035 1.00 1.00 H new ATOM 0 HG23 THR A 8 6.916 25.330 -12.128 1.00 1.00 H new ATOM 131 N PHE A 9 6.056 24.810 -8.409 1.00 1.00 N ATOM 132 CA PHE A 9 6.907 25.642 -7.561 1.00 1.00 C ATOM 133 C PHE A 9 8.360 25.255 -7.756 1.00 1.00 C ATOM 134 O PHE A 9 8.664 24.087 -7.975 1.00 1.00 O ATOM 135 CB PHE A 9 6.547 25.502 -6.084 1.00 1.00 C ATOM 136 CG PHE A 9 5.114 25.154 -5.842 1.00 1.00 C ATOM 137 CD1 PHE A 9 4.111 26.094 -5.995 1.00 1.00 C ATOM 138 CD2 PHE A 9 4.776 23.875 -5.460 1.00 1.00 C ATOM 139 CE1 PHE A 9 2.799 25.761 -5.767 1.00 1.00 C ATOM 140 CE2 PHE A 9 3.467 23.536 -5.231 1.00 1.00 C ATOM 141 CZ PHE A 9 2.478 24.480 -5.383 1.00 1.00 C ATOM 0 H PHE A 9 5.630 24.012 -7.938 1.00 1.00 H new ATOM 0 HA PHE A 9 6.748 26.680 -7.854 1.00 1.00 H new ATOM 0 HB2 PHE A 9 7.178 24.734 -5.637 1.00 1.00 H new ATOM 0 HB3 PHE A 9 6.775 26.438 -5.574 1.00 1.00 H new ATOM 0 HD1 PHE A 9 4.363 27.100 -6.297 1.00 1.00 H new ATOM 0 HD2 PHE A 9 5.550 23.131 -5.339 1.00 1.00 H new ATOM 0 HE1 PHE A 9 2.022 26.502 -5.889 1.00 1.00 H new ATOM 0 HE2 PHE A 9 3.213 22.530 -4.932 1.00 1.00 H new ATOM 0 HZ PHE A 9 1.447 24.215 -5.200 1.00 1.00 H new ATOM 151 N VAL A 10 9.254 26.222 -7.649 1.00 1.00 N ATOM 152 CA VAL A 10 10.666 25.984 -7.880 1.00 1.00 C ATOM 153 C VAL A 10 11.521 26.585 -6.782 1.00 1.00 C ATOM 154 O VAL A 10 11.546 27.804 -6.582 1.00 1.00 O ATOM 155 CB VAL A 10 11.107 26.588 -9.227 1.00 1.00 C ATOM 156 CG1 VAL A 10 12.554 26.261 -9.517 1.00 1.00 C ATOM 157 CG2 VAL A 10 10.213 26.120 -10.360 1.00 1.00 C ATOM 0 H VAL A 10 9.024 27.185 -7.402 1.00 1.00 H new ATOM 0 HA VAL A 10 10.806 24.903 -7.891 1.00 1.00 H new ATOM 0 HB VAL A 10 11.010 27.671 -9.151 1.00 1.00 H new ATOM 0 HG11 VAL A 10 12.841 26.698 -10.473 1.00 1.00 H new ATOM 0 HG12 VAL A 10 13.185 26.669 -8.727 1.00 1.00 H new ATOM 0 HG13 VAL A 10 12.681 25.179 -9.560 1.00 1.00 H new ATOM 0 HG21 VAL A 10 10.550 26.564 -11.297 1.00 1.00 H new ATOM 0 HG22 VAL A 10 10.260 25.034 -10.435 1.00 1.00 H new ATOM 0 HG23 VAL A 10 9.186 26.426 -10.163 1.00 1.00 H new ATOM 167 N CYS A 11 12.241 25.725 -6.087 1.00 1.00 N ATOM 168 CA CYS A 11 13.126 26.156 -5.027 1.00 1.00 C ATOM 169 C CYS A 11 14.407 25.333 -5.048 1.00 1.00 C ATOM 170 O CYS A 11 14.569 24.446 -5.888 1.00 1.00 O ATOM 171 CB CYS A 11 12.430 26.028 -3.674 1.00 1.00 C ATOM 172 SG CYS A 11 11.950 24.342 -3.239 1.00 1.00 S ATOM 0 H CYS A 11 12.228 24.717 -6.241 1.00 1.00 H new ATOM 0 HA CYS A 11 13.383 27.203 -5.185 1.00 1.00 H new ATOM 0 HB2 CYS A 11 13.093 26.415 -2.900 1.00 1.00 H new ATOM 0 HB3 CYS A 11 11.540 26.657 -3.676 1.00 1.00 H new ATOM 0 HG CYS A 11 12.209 24.127 -1.983 1.00 1.00 H new ATOM 178 N THR A 12 15.322 25.635 -4.146 1.00 1.00 N ATOM 179 CA THR A 12 16.565 24.902 -4.067 1.00 1.00 C ATOM 180 C THR A 12 16.412 23.662 -3.197 1.00 1.00 C ATOM 181 O THR A 12 16.573 23.719 -1.982 1.00 1.00 O ATOM 182 CB THR A 12 17.691 25.788 -3.527 1.00 1.00 C ATOM 183 OG1 THR A 12 17.143 26.788 -2.652 1.00 1.00 O ATOM 184 CG2 THR A 12 18.433 26.441 -4.674 1.00 1.00 C ATOM 0 H THR A 12 15.225 26.383 -3.459 1.00 1.00 H new ATOM 0 HA THR A 12 16.827 24.587 -5.077 1.00 1.00 H new ATOM 0 HB THR A 12 18.394 25.173 -2.965 1.00 1.00 H new ATOM 0 HG1 THR A 12 17.866 27.352 -2.307 1.00 1.00 H new ATOM 0 HG21 THR A 12 19.232 27.069 -4.280 1.00 1.00 H new ATOM 0 HG22 THR A 12 18.860 25.671 -5.316 1.00 1.00 H new ATOM 0 HG23 THR A 12 17.742 27.054 -5.253 1.00 1.00 H new ATOM 192 N GLY A 13 15.974 22.576 -3.817 1.00 1.00 N ATOM 193 CA GLY A 13 15.810 21.332 -3.098 1.00 1.00 C ATOM 194 C GLY A 13 14.508 20.650 -3.435 1.00 1.00 C ATOM 195 O GLY A 13 14.451 19.425 -3.519 1.00 1.00 O ATOM 0 H GLY A 13 15.729 22.535 -4.806 1.00 1.00 H new ATOM 0 HA2 GLY A 13 16.640 20.665 -3.334 1.00 1.00 H new ATOM 0 HA3 GLY A 13 15.851 21.525 -2.026 1.00 1.00 H new ATOM 199 N ASN A 14 13.463 21.458 -3.614 1.00 1.00 N ATOM 200 CA ASN A 14 12.123 20.963 -3.949 1.00 1.00 C ATOM 201 C ASN A 14 11.554 20.103 -2.817 1.00 1.00 C ATOM 202 O ASN A 14 10.562 19.392 -2.983 1.00 1.00 O ATOM 203 CB ASN A 14 12.147 20.158 -5.258 1.00 1.00 C ATOM 204 CG ASN A 14 10.753 19.793 -5.735 1.00 1.00 C ATOM 205 OD1 ASN A 14 10.532 18.729 -6.300 1.00 1.00 O ATOM 206 ND2 ASN A 14 9.804 20.685 -5.524 1.00 1.00 N ATOM 0 H ASN A 14 13.519 22.473 -3.532 1.00 1.00 H new ATOM 0 HA ASN A 14 11.477 21.830 -4.083 1.00 1.00 H new ATOM 0 HB2 ASN A 14 12.652 20.739 -6.030 1.00 1.00 H new ATOM 0 HB3 ASN A 14 12.729 19.248 -5.112 1.00 1.00 H new ATOM 0 HD21 ASN A 14 8.851 20.499 -5.835 1.00 1.00 H new ATOM 0 HD22 ASN A 14 10.024 21.561 -5.050 1.00 1.00 H new ATOM 213 N ILE A 15 12.135 20.220 -1.640 1.00 1.00 N ATOM 214 CA ILE A 15 11.707 19.411 -0.517 1.00 1.00 C ATOM 215 C ILE A 15 11.325 20.266 0.678 1.00 1.00 C ATOM 216 O ILE A 15 11.017 19.748 1.740 1.00 1.00 O ATOM 217 CB ILE A 15 12.807 18.418 -0.103 1.00 1.00 C ATOM 218 CG1 ILE A 15 14.140 19.149 0.110 1.00 1.00 C ATOM 219 CG2 ILE A 15 12.953 17.331 -1.155 1.00 1.00 C ATOM 220 CD1 ILE A 15 15.099 18.411 1.013 1.00 1.00 C ATOM 0 H ILE A 15 12.900 20.863 -1.437 1.00 1.00 H new ATOM 0 HA ILE A 15 10.826 18.858 -0.843 1.00 1.00 H new ATOM 0 HB ILE A 15 12.521 17.952 0.840 1.00 1.00 H new ATOM 0 HG12 ILE A 15 14.616 19.308 -0.858 1.00 1.00 H new ATOM 0 HG13 ILE A 15 13.941 20.134 0.533 1.00 1.00 H new ATOM 0 HG21 ILE A 15 13.734 16.634 -0.852 1.00 1.00 H new ATOM 0 HG22 ILE A 15 12.009 16.796 -1.259 1.00 1.00 H new ATOM 0 HG23 ILE A 15 13.221 17.783 -2.110 1.00 1.00 H new ATOM 0 HD11 ILE A 15 16.018 18.988 1.117 1.00 1.00 H new ATOM 0 HD12 ILE A 15 14.643 18.275 1.994 1.00 1.00 H new ATOM 0 HD13 ILE A 15 15.329 17.437 0.581 1.00 1.00 H new ATOM 232 N CYS A 16 11.216 21.565 0.463 1.00 1.00 N ATOM 233 CA CYS A 16 10.903 22.473 1.552 1.00 1.00 C ATOM 234 C CYS A 16 9.708 23.372 1.227 1.00 1.00 C ATOM 235 O CYS A 16 8.561 22.984 1.439 1.00 1.00 O ATOM 236 CB CYS A 16 12.133 23.313 1.880 1.00 1.00 C ATOM 237 SG CYS A 16 12.905 24.090 0.432 1.00 1.00 S ATOM 0 H CYS A 16 11.338 22.011 -0.446 1.00 1.00 H new ATOM 0 HA CYS A 16 10.623 21.877 2.420 1.00 1.00 H new ATOM 0 HB2 CYS A 16 11.850 24.091 2.589 1.00 1.00 H new ATOM 0 HB3 CYS A 16 12.870 22.681 2.376 1.00 1.00 H new ATOM 0 HG CYS A 16 12.637 25.362 0.427 1.00 1.00 H new ATOM 243 N ARG A 17 9.974 24.509 0.587 1.00 1.00 N ATOM 244 CA ARG A 17 8.926 25.486 0.287 1.00 1.00 C ATOM 245 C ARG A 17 7.936 24.973 -0.760 1.00 1.00 C ATOM 246 O ARG A 17 6.722 25.122 -0.596 1.00 1.00 O ATOM 247 CB ARG A 17 9.533 26.820 -0.169 1.00 1.00 C ATOM 248 CG ARG A 17 9.767 27.811 0.967 1.00 1.00 C ATOM 249 CD ARG A 17 11.009 27.490 1.794 1.00 1.00 C ATOM 250 NE ARG A 17 12.233 28.077 1.228 1.00 1.00 N ATOM 251 CZ ARG A 17 12.662 29.324 1.490 1.00 1.00 C ATOM 252 NH1 ARG A 17 11.956 30.128 2.281 1.00 1.00 N ATOM 253 NH2 ARG A 17 13.806 29.763 0.971 1.00 1.00 N ATOM 0 H ARG A 17 10.904 24.777 0.266 1.00 1.00 H new ATOM 0 HA ARG A 17 8.373 25.645 1.213 1.00 1.00 H new ATOM 0 HB2 ARG A 17 10.482 26.625 -0.669 1.00 1.00 H new ATOM 0 HB3 ARG A 17 8.872 27.276 -0.906 1.00 1.00 H new ATOM 0 HG2 ARG A 17 9.863 28.814 0.552 1.00 1.00 H new ATOM 0 HG3 ARG A 17 8.895 27.819 1.620 1.00 1.00 H new ATOM 0 HD2 ARG A 17 10.870 27.859 2.810 1.00 1.00 H new ATOM 0 HD3 ARG A 17 11.127 26.408 1.861 1.00 1.00 H new ATOM 0 HE ARG A 17 12.791 27.502 0.597 1.00 1.00 H new ATOM 0 HH11 ARG A 17 11.083 29.800 2.693 1.00 1.00 H new ATOM 0 HH12 ARG A 17 12.288 31.073 2.475 1.00 1.00 H new ATOM 0 HH21 ARG A 17 14.361 29.153 0.372 1.00 1.00 H new ATOM 0 HH22 ARG A 17 14.127 30.710 1.173 1.00 1.00 H new ATOM 267 N SER A 18 8.456 24.365 -1.821 1.00 1.00 N ATOM 268 CA SER A 18 7.615 23.839 -2.897 1.00 1.00 C ATOM 269 C SER A 18 6.583 22.819 -2.388 1.00 1.00 C ATOM 270 O SER A 18 5.385 23.044 -2.529 1.00 1.00 O ATOM 271 CB SER A 18 8.480 23.217 -3.993 1.00 1.00 C ATOM 272 OG SER A 18 9.386 24.166 -4.529 1.00 1.00 O ATOM 0 H SER A 18 9.456 24.223 -1.961 1.00 1.00 H new ATOM 0 HA SER A 18 7.059 24.681 -3.310 1.00 1.00 H new ATOM 0 HB2 SER A 18 9.034 22.370 -3.587 1.00 1.00 H new ATOM 0 HB3 SER A 18 7.842 22.829 -4.788 1.00 1.00 H new ATOM 0 HG SER A 18 10.292 23.968 -4.213 1.00 1.00 H new ATOM 278 N PRO A 19 7.010 21.711 -1.738 1.00 1.00 N ATOM 279 CA PRO A 19 6.074 20.685 -1.272 1.00 1.00 C ATOM 280 C PRO A 19 5.140 21.211 -0.195 1.00 1.00 C ATOM 281 O PRO A 19 4.032 20.725 -0.058 1.00 1.00 O ATOM 282 CB PRO A 19 6.978 19.585 -0.722 1.00 1.00 C ATOM 283 CG PRO A 19 8.233 20.277 -0.350 1.00 1.00 C ATOM 284 CD PRO A 19 8.393 21.417 -1.310 1.00 1.00 C ATOM 0 HA PRO A 19 5.418 20.338 -2.071 1.00 1.00 H new ATOM 0 HB2 PRO A 19 6.526 19.096 0.141 1.00 1.00 H new ATOM 0 HB3 PRO A 19 7.159 18.812 -1.469 1.00 1.00 H new ATOM 0 HG2 PRO A 19 8.186 20.639 0.677 1.00 1.00 H new ATOM 0 HG3 PRO A 19 9.083 19.597 -0.410 1.00 1.00 H new ATOM 0 HD2 PRO A 19 8.857 22.280 -0.833 1.00 1.00 H new ATOM 0 HD3 PRO A 19 9.024 21.143 -2.155 1.00 1.00 H new ATOM 292 N MET A 20 5.565 22.247 0.515 1.00 1.00 N ATOM 293 CA MET A 20 4.727 22.850 1.544 1.00 1.00 C ATOM 294 C MET A 20 3.439 23.409 0.936 1.00 1.00 C ATOM 295 O MET A 20 2.347 22.979 1.291 1.00 1.00 O ATOM 296 CB MET A 20 5.490 23.959 2.257 1.00 1.00 C ATOM 297 CG MET A 20 6.367 23.473 3.394 1.00 1.00 C ATOM 298 SD MET A 20 5.433 23.113 4.891 1.00 1.00 S ATOM 299 CE MET A 20 4.808 24.742 5.284 1.00 1.00 C ATOM 0 H MET A 20 6.479 22.686 0.399 1.00 1.00 H new ATOM 0 HA MET A 20 4.461 22.078 2.266 1.00 1.00 H new ATOM 0 HB2 MET A 20 6.112 24.483 1.531 1.00 1.00 H new ATOM 0 HB3 MET A 20 4.776 24.684 2.647 1.00 1.00 H new ATOM 0 HG2 MET A 20 6.899 22.575 3.078 1.00 1.00 H new ATOM 0 HG3 MET A 20 7.121 24.229 3.614 1.00 1.00 H new ATOM 0 HE1 MET A 20 5.330 25.131 6.158 1.00 1.00 H new ATOM 0 HE2 MET A 20 4.972 25.409 4.437 1.00 1.00 H new ATOM 0 HE3 MET A 20 3.741 24.681 5.496 1.00 1.00 H new ATOM 309 N ALA A 21 3.577 24.268 -0.072 1.00 1.00 N ATOM 310 CA ALA A 21 2.402 24.866 -0.708 1.00 1.00 C ATOM 311 C ALA A 21 1.689 23.839 -1.550 1.00 1.00 C ATOM 312 O ALA A 21 0.465 23.828 -1.613 1.00 1.00 O ATOM 313 CB ALA A 21 2.775 26.061 -1.564 1.00 1.00 C ATOM 0 H ALA A 21 4.473 24.562 -0.461 1.00 1.00 H new ATOM 0 HA ALA A 21 1.739 25.214 0.085 1.00 1.00 H new ATOM 0 HB1 ALA A 21 1.876 26.477 -2.019 1.00 1.00 H new ATOM 0 HB2 ALA A 21 3.252 26.819 -0.943 1.00 1.00 H new ATOM 0 HB3 ALA A 21 3.466 25.747 -2.347 1.00 1.00 H new ATOM 319 N GLU A 22 2.475 22.926 -2.101 1.00 1.00 N ATOM 320 CA GLU A 22 1.970 21.876 -2.962 1.00 1.00 C ATOM 321 C GLU A 22 0.807 21.163 -2.286 1.00 1.00 C ATOM 322 O GLU A 22 -0.312 21.214 -2.758 1.00 1.00 O ATOM 323 CB GLU A 22 3.102 20.886 -3.244 1.00 1.00 C ATOM 324 CG GLU A 22 2.980 20.144 -4.558 1.00 1.00 C ATOM 325 CD GLU A 22 3.970 19.013 -4.640 1.00 1.00 C ATOM 326 OE1 GLU A 22 5.179 19.284 -4.691 1.00 1.00 O ATOM 327 OE2 GLU A 22 3.546 17.846 -4.604 1.00 1.00 O ATOM 0 H GLU A 22 3.485 22.896 -1.961 1.00 1.00 H new ATOM 0 HA GLU A 22 1.614 22.304 -3.899 1.00 1.00 H new ATOM 0 HB2 GLU A 22 4.049 21.425 -3.233 1.00 1.00 H new ATOM 0 HB3 GLU A 22 3.140 20.158 -2.433 1.00 1.00 H new ATOM 0 HG2 GLU A 22 1.968 19.753 -4.665 1.00 1.00 H new ATOM 0 HG3 GLU A 22 3.144 20.835 -5.385 1.00 1.00 H new ATOM 334 N LYS A 23 1.032 20.731 -1.061 1.00 1.00 N ATOM 335 CA LYS A 23 0.019 19.978 -0.342 1.00 1.00 C ATOM 336 C LYS A 23 -1.025 20.923 0.227 1.00 1.00 C ATOM 337 O LYS A 23 -2.187 20.572 0.319 1.00 1.00 O ATOM 338 CB LYS A 23 0.627 19.159 0.804 1.00 1.00 C ATOM 339 CG LYS A 23 2.092 18.804 0.617 1.00 1.00 C ATOM 340 CD LYS A 23 2.296 17.407 0.060 1.00 1.00 C ATOM 341 CE LYS A 23 3.078 17.427 -1.244 1.00 1.00 C ATOM 342 NZ LYS A 23 2.185 17.327 -2.431 1.00 1.00 N ATOM 0 H LYS A 23 1.898 20.885 -0.545 1.00 1.00 H new ATOM 0 HA LYS A 23 -0.441 19.291 -1.052 1.00 1.00 H new ATOM 0 HB2 LYS A 23 0.518 19.720 1.732 1.00 1.00 H new ATOM 0 HB3 LYS A 23 0.055 18.238 0.919 1.00 1.00 H new ATOM 0 HG2 LYS A 23 2.553 19.528 -0.055 1.00 1.00 H new ATOM 0 HG3 LYS A 23 2.605 18.886 1.575 1.00 1.00 H new ATOM 0 HD2 LYS A 23 2.826 16.798 0.792 1.00 1.00 H new ATOM 0 HD3 LYS A 23 1.327 16.936 -0.105 1.00 1.00 H new ATOM 0 HE2 LYS A 23 3.659 18.347 -1.304 1.00 1.00 H new ATOM 0 HE3 LYS A 23 3.788 16.600 -1.254 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 2.761 17.276 -3.295 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 1.600 16.471 -2.354 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 1.570 18.164 -2.474 1.00 1.00 H new ATOM 356 N MET A 24 -0.606 22.140 0.553 1.00 1.00 N ATOM 357 CA MET A 24 -1.484 23.116 1.179 1.00 1.00 C ATOM 358 C MET A 24 -2.671 23.509 0.309 1.00 1.00 C ATOM 359 O MET A 24 -3.797 23.043 0.514 1.00 1.00 O ATOM 360 CB MET A 24 -0.688 24.353 1.562 1.00 1.00 C ATOM 361 CG MET A 24 0.142 24.139 2.811 1.00 1.00 C ATOM 362 SD MET A 24 -0.488 25.039 4.231 1.00 1.00 S ATOM 363 CE MET A 24 0.041 26.693 3.818 1.00 1.00 C ATOM 0 H MET A 24 0.344 22.474 0.392 1.00 1.00 H new ATOM 0 HA MET A 24 -1.897 22.640 2.069 1.00 1.00 H new ATOM 0 HB2 MET A 24 -0.033 24.631 0.736 1.00 1.00 H new ATOM 0 HB3 MET A 24 -1.371 25.187 1.721 1.00 1.00 H new ATOM 0 HG2 MET A 24 0.170 23.075 3.045 1.00 1.00 H new ATOM 0 HG3 MET A 24 1.169 24.450 2.617 1.00 1.00 H new ATOM 0 HE1 MET A 24 0.412 27.191 4.714 1.00 1.00 H new ATOM 0 HE2 MET A 24 0.836 26.646 3.073 1.00 1.00 H new ATOM 0 HE3 MET A 24 -0.802 27.254 3.414 1.00 1.00 H new ATOM 373 N PHE A 25 -2.425 24.330 -0.695 1.00 1.00 N ATOM 374 CA PHE A 25 -3.517 24.842 -1.496 1.00 1.00 C ATOM 375 C PHE A 25 -3.994 23.818 -2.506 1.00 1.00 C ATOM 376 O PHE A 25 -5.159 23.848 -2.901 1.00 1.00 O ATOM 377 CB PHE A 25 -3.145 26.161 -2.179 1.00 1.00 C ATOM 378 CG PHE A 25 -2.314 26.035 -3.413 1.00 1.00 C ATOM 379 CD1 PHE A 25 -1.135 25.336 -3.389 1.00 1.00 C ATOM 380 CD2 PHE A 25 -2.714 26.639 -4.590 1.00 1.00 C ATOM 381 CE1 PHE A 25 -0.357 25.232 -4.510 1.00 1.00 C ATOM 382 CE2 PHE A 25 -1.938 26.537 -5.726 1.00 1.00 C ATOM 383 CZ PHE A 25 -0.754 25.831 -5.682 1.00 1.00 C ATOM 0 H PHE A 25 -1.497 24.651 -0.971 1.00 1.00 H new ATOM 0 HA PHE A 25 -4.345 25.046 -0.817 1.00 1.00 H new ATOM 0 HB2 PHE A 25 -4.064 26.690 -2.433 1.00 1.00 H new ATOM 0 HB3 PHE A 25 -2.608 26.782 -1.462 1.00 1.00 H new ATOM 0 HD1 PHE A 25 -0.816 24.861 -2.473 1.00 1.00 H new ATOM 0 HD2 PHE A 25 -3.640 27.194 -4.621 1.00 1.00 H new ATOM 0 HE1 PHE A 25 0.570 24.679 -4.474 1.00 1.00 H new ATOM 0 HE2 PHE A 25 -2.256 27.007 -6.645 1.00 1.00 H new ATOM 0 HZ PHE A 25 -0.140 25.749 -6.567 1.00 1.00 H new ATOM 393 N ALA A 26 -3.117 22.915 -2.945 1.00 1.00 N ATOM 394 CA ALA A 26 -3.566 21.894 -3.883 1.00 1.00 C ATOM 395 C ALA A 26 -4.595 20.988 -3.223 1.00 1.00 C ATOM 396 O ALA A 26 -5.562 20.562 -3.865 1.00 1.00 O ATOM 397 CB ALA A 26 -2.420 21.091 -4.448 1.00 1.00 C ATOM 0 H ALA A 26 -2.133 22.870 -2.679 1.00 1.00 H new ATOM 0 HA ALA A 26 -4.034 22.405 -4.724 1.00 1.00 H new ATOM 0 HB1 ALA A 26 -2.806 20.344 -5.141 1.00 1.00 H new ATOM 0 HB2 ALA A 26 -1.735 21.755 -4.975 1.00 1.00 H new ATOM 0 HB3 ALA A 26 -1.890 20.593 -3.636 1.00 1.00 H new ATOM 403 N GLN A 27 -4.393 20.697 -1.932 1.00 1.00 N ATOM 404 CA GLN A 27 -5.341 19.887 -1.187 1.00 1.00 C ATOM 405 C GLN A 27 -6.671 20.626 -1.121 1.00 1.00 C ATOM 406 O GLN A 27 -7.734 20.026 -1.277 1.00 1.00 O ATOM 407 CB GLN A 27 -4.805 19.553 0.202 1.00 1.00 C ATOM 408 CG GLN A 27 -5.203 20.514 1.304 1.00 1.00 C ATOM 409 CD GLN A 27 -6.296 19.948 2.174 1.00 1.00 C ATOM 410 OE1 GLN A 27 -7.474 20.264 2.017 1.00 1.00 O ATOM 411 NE2 GLN A 27 -5.905 19.038 3.036 1.00 1.00 N ATOM 0 H GLN A 27 -3.586 21.011 -1.393 1.00 1.00 H new ATOM 0 HA GLN A 27 -5.492 18.935 -1.696 1.00 1.00 H new ATOM 0 HB2 GLN A 27 -5.147 18.554 0.474 1.00 1.00 H new ATOM 0 HB3 GLN A 27 -3.717 19.515 0.153 1.00 1.00 H new ATOM 0 HG2 GLN A 27 -4.332 20.743 1.918 1.00 1.00 H new ATOM 0 HG3 GLN A 27 -5.539 21.453 0.864 1.00 1.00 H new ATOM 0 HE21 GLN A 27 -4.914 18.814 3.126 1.00 1.00 H new ATOM 0 HE22 GLN A 27 -6.592 18.556 3.615 1.00 1.00 H new ATOM 420 N GLN A 28 -6.598 21.946 -0.937 1.00 1.00 N ATOM 421 CA GLN A 28 -7.789 22.787 -0.934 1.00 1.00 C ATOM 422 C GLN A 28 -8.523 22.675 -2.269 1.00 1.00 C ATOM 423 O GLN A 28 -9.745 22.522 -2.311 1.00 1.00 O ATOM 424 CB GLN A 28 -7.423 24.247 -0.668 1.00 1.00 C ATOM 425 CG GLN A 28 -6.764 24.488 0.680 1.00 1.00 C ATOM 426 CD GLN A 28 -6.483 25.956 0.918 1.00 1.00 C ATOM 427 OE1 GLN A 28 -7.173 26.828 0.385 1.00 1.00 O ATOM 428 NE2 GLN A 28 -5.480 26.243 1.731 1.00 1.00 N ATOM 0 H GLN A 28 -5.725 22.452 -0.788 1.00 1.00 H new ATOM 0 HA GLN A 28 -8.444 22.440 -0.135 1.00 1.00 H new ATOM 0 HB2 GLN A 28 -6.752 24.591 -1.455 1.00 1.00 H new ATOM 0 HB3 GLN A 28 -8.326 24.854 -0.732 1.00 1.00 H new ATOM 0 HG2 GLN A 28 -7.410 24.109 1.472 1.00 1.00 H new ATOM 0 HG3 GLN A 28 -5.831 23.927 0.733 1.00 1.00 H new ATOM 0 HE21 GLN A 28 -4.933 25.492 2.152 1.00 1.00 H new ATOM 0 HE22 GLN A 28 -5.253 27.216 1.937 1.00 1.00 H new ATOM 437 N LEU A 29 -7.756 22.735 -3.359 1.00 1.00 N ATOM 438 CA LEU A 29 -8.305 22.648 -4.710 1.00 1.00 C ATOM 439 C LEU A 29 -9.148 21.390 -4.879 1.00 1.00 C ATOM 440 O LEU A 29 -10.333 21.459 -5.196 1.00 1.00 O ATOM 441 CB LEU A 29 -7.177 22.649 -5.745 1.00 1.00 C ATOM 442 CG LEU A 29 -6.271 23.882 -5.732 1.00 1.00 C ATOM 443 CD1 LEU A 29 -5.165 23.740 -6.763 1.00 1.00 C ATOM 444 CD2 LEU A 29 -7.074 25.148 -5.991 1.00 1.00 C ATOM 0 H LEU A 29 -6.742 22.845 -3.329 1.00 1.00 H new ATOM 0 HA LEU A 29 -8.941 23.519 -4.867 1.00 1.00 H new ATOM 0 HB2 LEU A 29 -6.560 21.765 -5.585 1.00 1.00 H new ATOM 0 HB3 LEU A 29 -7.618 22.554 -6.737 1.00 1.00 H new ATOM 0 HG LEU A 29 -5.819 23.959 -4.743 1.00 1.00 H new ATOM 0 HD11 LEU A 29 -4.530 24.626 -6.740 1.00 1.00 H new ATOM 0 HD12 LEU A 29 -4.566 22.858 -6.535 1.00 1.00 H new ATOM 0 HD13 LEU A 29 -5.604 23.634 -7.755 1.00 1.00 H new ATOM 0 HD21 LEU A 29 -6.408 26.011 -5.977 1.00 1.00 H new ATOM 0 HD22 LEU A 29 -7.558 25.079 -6.965 1.00 1.00 H new ATOM 0 HD23 LEU A 29 -7.833 25.263 -5.217 1.00 1.00 H new ATOM 456 N ARG A 30 -8.521 20.243 -4.715 1.00 1.00 N ATOM 457 CA ARG A 30 -9.223 18.970 -4.838 1.00 1.00 C ATOM 458 C ARG A 30 -10.385 18.872 -3.844 1.00 1.00 C ATOM 459 O ARG A 30 -11.458 18.389 -4.190 1.00 1.00 O ATOM 460 CB ARG A 30 -8.244 17.810 -4.665 1.00 1.00 C ATOM 461 CG ARG A 30 -7.356 17.941 -3.443 1.00 1.00 C ATOM 462 CD ARG A 30 -5.956 17.433 -3.722 1.00 1.00 C ATOM 463 NE ARG A 30 -5.937 15.986 -3.946 1.00 1.00 N ATOM 464 CZ ARG A 30 -5.208 15.374 -4.881 1.00 1.00 C ATOM 465 NH1 ARG A 30 -4.425 16.077 -5.693 1.00 1.00 N ATOM 466 NH2 ARG A 30 -5.269 14.053 -5.000 1.00 1.00 N ATOM 0 H ARG A 30 -7.528 20.160 -4.496 1.00 1.00 H new ATOM 0 HA ARG A 30 -9.653 18.912 -5.838 1.00 1.00 H new ATOM 0 HB2 ARG A 30 -8.806 16.879 -4.597 1.00 1.00 H new ATOM 0 HB3 ARG A 30 -7.617 17.740 -5.554 1.00 1.00 H new ATOM 0 HG2 ARG A 30 -7.311 18.985 -3.134 1.00 1.00 H new ATOM 0 HG3 ARG A 30 -7.790 17.381 -2.614 1.00 1.00 H new ATOM 0 HD2 ARG A 30 -5.553 17.942 -4.598 1.00 1.00 H new ATOM 0 HD3 ARG A 30 -5.306 17.679 -2.882 1.00 1.00 H new ATOM 0 HE ARG A 30 -6.522 15.405 -3.345 1.00 1.00 H new ATOM 0 HH11 ARG A 30 -4.378 17.092 -5.604 1.00 1.00 H new ATOM 0 HH12 ARG A 30 -3.871 15.601 -6.405 1.00 1.00 H new ATOM 0 HH21 ARG A 30 -5.871 13.512 -4.379 1.00 1.00 H new ATOM 0 HH22 ARG A 30 -4.714 13.579 -5.713 1.00 1.00 H new ATOM 480 N HIS A 31 -10.173 19.362 -2.621 1.00 1.00 N ATOM 481 CA HIS A 31 -11.218 19.351 -1.589 1.00 1.00 C ATOM 482 C HIS A 31 -12.436 20.187 -1.991 1.00 1.00 C ATOM 483 O HIS A 31 -13.537 19.975 -1.480 1.00 1.00 O ATOM 484 CB HIS A 31 -10.671 19.835 -0.244 1.00 1.00 C ATOM 485 CG HIS A 31 -10.189 18.727 0.643 1.00 1.00 C ATOM 486 ND1 HIS A 31 -10.887 18.294 1.750 1.00 1.00 N ATOM 487 CD2 HIS A 31 -9.069 17.968 0.592 1.00 1.00 C ATOM 488 CE1 HIS A 31 -10.218 17.322 2.340 1.00 1.00 C ATOM 489 NE2 HIS A 31 -9.111 17.104 1.657 1.00 1.00 N ATOM 0 H HIS A 31 -9.289 19.771 -2.319 1.00 1.00 H new ATOM 0 HA HIS A 31 -11.543 18.316 -1.486 1.00 1.00 H new ATOM 0 HB2 HIS A 31 -9.849 20.528 -0.424 1.00 1.00 H new ATOM 0 HB3 HIS A 31 -11.450 20.392 0.276 1.00 1.00 H new ATOM 0 HD2 HIS A 31 -8.287 18.031 -0.150 1.00 1.00 H new ATOM 0 HE1 HIS A 31 -10.525 16.794 3.231 1.00 1.00 H new ATOM 0 HE2 HIS A 31 -8.402 16.407 1.884 1.00 1.00 H new ATOM 498 N ARG A 32 -12.244 21.134 -2.903 1.00 1.00 N ATOM 499 CA ARG A 32 -13.377 21.936 -3.350 1.00 1.00 C ATOM 500 C ARG A 32 -13.893 21.417 -4.683 1.00 1.00 C ATOM 501 O ARG A 32 -15.012 21.717 -5.099 1.00 1.00 O ATOM 502 CB ARG A 32 -13.040 23.423 -3.401 1.00 1.00 C ATOM 503 CG ARG A 32 -11.857 23.796 -4.268 1.00 1.00 C ATOM 504 CD ARG A 32 -11.189 25.058 -3.747 1.00 1.00 C ATOM 505 NE ARG A 32 -12.148 26.136 -3.511 1.00 1.00 N ATOM 506 CZ ARG A 32 -12.542 26.542 -2.302 1.00 1.00 C ATOM 507 NH1 ARG A 32 -12.086 25.942 -1.204 1.00 1.00 N ATOM 508 NH2 ARG A 32 -13.413 27.532 -2.198 1.00 1.00 N ATOM 0 H ARG A 32 -11.348 21.360 -3.335 1.00 1.00 H new ATOM 0 HA ARG A 32 -14.177 21.835 -2.617 1.00 1.00 H new ATOM 0 HB2 ARG A 32 -13.916 23.964 -3.760 1.00 1.00 H new ATOM 0 HB3 ARG A 32 -12.847 23.768 -2.385 1.00 1.00 H new ATOM 0 HG2 ARG A 32 -11.138 22.977 -4.283 1.00 1.00 H new ATOM 0 HG3 ARG A 32 -12.186 23.950 -5.296 1.00 1.00 H new ATOM 0 HD2 ARG A 32 -10.664 24.832 -2.819 1.00 1.00 H new ATOM 0 HD3 ARG A 32 -10.439 25.392 -4.464 1.00 1.00 H new ATOM 0 HE ARG A 32 -12.542 26.609 -4.324 1.00 1.00 H new ATOM 0 HH11 ARG A 32 -11.430 25.165 -1.283 1.00 1.00 H new ATOM 0 HH12 ARG A 32 -12.393 26.259 -0.285 1.00 1.00 H new ATOM 0 HH21 ARG A 32 -13.779 27.980 -3.038 1.00 1.00 H new ATOM 0 HH22 ARG A 32 -13.719 27.848 -1.278 1.00 1.00 H new ATOM 522 N GLY A 33 -13.053 20.641 -5.343 1.00 1.00 N ATOM 523 CA GLY A 33 -13.432 20.031 -6.599 1.00 1.00 C ATOM 524 C GLY A 33 -12.762 20.693 -7.775 1.00 1.00 C ATOM 525 O GLY A 33 -13.348 20.804 -8.850 1.00 1.00 O ATOM 0 H GLY A 33 -12.108 20.420 -5.030 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -13.170 18.973 -6.581 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -14.514 20.090 -6.718 1.00 1.00 H new ATOM 529 N LEU A 34 -11.520 21.122 -7.587 1.00 1.00 N ATOM 530 CA LEU A 34 -10.780 21.804 -8.635 1.00 1.00 C ATOM 531 C LEU A 34 -9.433 21.125 -8.861 1.00 1.00 C ATOM 532 O LEU A 34 -8.659 21.537 -9.720 1.00 1.00 O ATOM 533 CB LEU A 34 -10.562 23.263 -8.236 1.00 1.00 C ATOM 534 CG LEU A 34 -11.827 24.014 -7.820 1.00 1.00 C ATOM 535 CD1 LEU A 34 -11.472 25.394 -7.300 1.00 1.00 C ATOM 536 CD2 LEU A 34 -12.804 24.100 -8.982 1.00 1.00 C ATOM 0 H LEU A 34 -11.005 21.008 -6.714 1.00 1.00 H new ATOM 0 HA LEU A 34 -11.353 21.759 -9.561 1.00 1.00 H new ATOM 0 HB2 LEU A 34 -9.850 23.296 -7.411 1.00 1.00 H new ATOM 0 HB3 LEU A 34 -10.104 23.789 -9.074 1.00 1.00 H new ATOM 0 HG LEU A 34 -12.313 23.463 -7.015 1.00 1.00 H new ATOM 0 HD11 LEU A 34 -12.382 25.918 -7.007 1.00 1.00 H new ATOM 0 HD12 LEU A 34 -10.814 25.299 -6.436 1.00 1.00 H new ATOM 0 HD13 LEU A 34 -10.964 25.958 -8.082 1.00 1.00 H new ATOM 0 HD21 LEU A 34 -13.698 24.638 -8.667 1.00 1.00 H new ATOM 0 HD22 LEU A 34 -12.336 24.629 -9.812 1.00 1.00 H new ATOM 0 HD23 LEU A 34 -13.079 23.095 -9.301 1.00 1.00 H new ATOM 548 N GLY A 35 -9.164 20.085 -8.075 1.00 1.00 N ATOM 549 CA GLY A 35 -7.911 19.344 -8.191 1.00 1.00 C ATOM 550 C GLY A 35 -7.674 18.801 -9.586 1.00 1.00 C ATOM 551 O GLY A 35 -6.535 18.594 -9.997 1.00 1.00 O ATOM 0 H GLY A 35 -9.795 19.737 -7.353 1.00 1.00 H new ATOM 0 HA2 GLY A 35 -7.082 19.996 -7.915 1.00 1.00 H new ATOM 0 HA3 GLY A 35 -7.917 18.517 -7.481 1.00 1.00 H new ATOM 555 N ASP A 36 -8.754 18.540 -10.303 1.00 1.00 N ATOM 556 CA ASP A 36 -8.663 18.067 -11.672 1.00 1.00 C ATOM 557 C ASP A 36 -8.638 19.235 -12.638 1.00 1.00 C ATOM 558 O ASP A 36 -8.172 19.104 -13.769 1.00 1.00 O ATOM 559 CB ASP A 36 -9.834 17.149 -12.013 1.00 1.00 C ATOM 560 CG ASP A 36 -9.638 15.742 -11.498 1.00 1.00 C ATOM 561 OD1 ASP A 36 -8.949 14.951 -12.179 1.00 1.00 O ATOM 562 OD2 ASP A 36 -10.164 15.416 -10.414 1.00 1.00 O ATOM 0 H ASP A 36 -9.707 18.649 -9.957 1.00 1.00 H new ATOM 0 HA ASP A 36 -7.735 17.502 -11.766 1.00 1.00 H new ATOM 0 HB2 ASP A 36 -10.750 17.562 -11.591 1.00 1.00 H new ATOM 0 HB3 ASP A 36 -9.966 17.121 -13.095 1.00 1.00 H new ATOM 567 N ALA A 37 -9.149 20.376 -12.187 1.00 1.00 N ATOM 568 CA ALA A 37 -9.209 21.577 -13.013 1.00 1.00 C ATOM 569 C ALA A 37 -7.863 22.298 -13.051 1.00 1.00 C ATOM 570 O ALA A 37 -7.558 23.021 -13.996 1.00 1.00 O ATOM 571 CB ALA A 37 -10.293 22.520 -12.510 1.00 1.00 C ATOM 0 H ALA A 37 -9.530 20.494 -11.248 1.00 1.00 H new ATOM 0 HA ALA A 37 -9.454 21.265 -14.028 1.00 1.00 H new ATOM 0 HB1 ALA A 37 -10.322 23.410 -13.139 1.00 1.00 H new ATOM 0 HB2 ALA A 37 -11.259 22.017 -12.548 1.00 1.00 H new ATOM 0 HB3 ALA A 37 -10.075 22.810 -11.482 1.00 1.00 H new ATOM 577 N VAL A 38 -7.071 22.114 -12.008 1.00 1.00 N ATOM 578 CA VAL A 38 -5.760 22.741 -11.920 1.00 1.00 C ATOM 579 C VAL A 38 -4.775 21.804 -11.243 1.00 1.00 C ATOM 580 O VAL A 38 -5.017 21.305 -10.144 1.00 1.00 O ATOM 581 CB VAL A 38 -5.824 24.097 -11.169 1.00 1.00 C ATOM 582 CG1 VAL A 38 -6.761 24.016 -9.984 1.00 1.00 C ATOM 583 CG2 VAL A 38 -4.442 24.548 -10.710 1.00 1.00 C ATOM 0 H VAL A 38 -7.314 21.533 -11.206 1.00 1.00 H new ATOM 0 HA VAL A 38 -5.418 22.944 -12.935 1.00 1.00 H new ATOM 0 HB VAL A 38 -6.208 24.836 -11.872 1.00 1.00 H new ATOM 0 HG11 VAL A 38 -6.788 24.979 -9.475 1.00 1.00 H new ATOM 0 HG12 VAL A 38 -7.763 23.760 -10.329 1.00 1.00 H new ATOM 0 HG13 VAL A 38 -6.408 23.250 -9.293 1.00 1.00 H new ATOM 0 HG21 VAL A 38 -4.525 25.501 -10.188 1.00 1.00 H new ATOM 0 HG22 VAL A 38 -4.020 23.801 -10.037 1.00 1.00 H new ATOM 0 HG23 VAL A 38 -3.791 24.665 -11.576 1.00 1.00 H new ATOM 593 N ARG A 39 -3.685 21.532 -11.939 1.00 1.00 N ATOM 594 CA ARG A 39 -2.670 20.626 -11.450 1.00 1.00 C ATOM 595 C ARG A 39 -1.631 21.402 -10.650 1.00 1.00 C ATOM 596 O ARG A 39 -1.306 22.543 -10.993 1.00 1.00 O ATOM 597 CB ARG A 39 -2.005 19.914 -12.630 1.00 1.00 C ATOM 598 CG ARG A 39 -3.006 19.302 -13.606 1.00 1.00 C ATOM 599 CD ARG A 39 -3.908 18.292 -12.918 1.00 1.00 C ATOM 600 NE ARG A 39 -4.596 17.429 -13.874 1.00 1.00 N ATOM 601 CZ ARG A 39 -4.120 16.257 -14.294 1.00 1.00 C ATOM 602 NH1 ARG A 39 -2.977 15.785 -13.804 1.00 1.00 N ATOM 603 NH2 ARG A 39 -4.805 15.552 -15.183 1.00 1.00 N ATOM 0 H ARG A 39 -3.482 21.933 -12.855 1.00 1.00 H new ATOM 0 HA ARG A 39 -3.130 19.881 -10.801 1.00 1.00 H new ATOM 0 HB2 ARG A 39 -1.374 20.624 -13.165 1.00 1.00 H new ATOM 0 HB3 ARG A 39 -1.351 19.129 -12.250 1.00 1.00 H new ATOM 0 HG2 ARG A 39 -3.613 20.091 -14.049 1.00 1.00 H new ATOM 0 HG3 ARG A 39 -2.470 18.817 -14.422 1.00 1.00 H new ATOM 0 HD2 ARG A 39 -3.314 17.680 -12.239 1.00 1.00 H new ATOM 0 HD3 ARG A 39 -4.644 18.819 -12.311 1.00 1.00 H new ATOM 0 HE ARG A 39 -5.494 17.742 -14.242 1.00 1.00 H new ATOM 0 HH11 ARG A 39 -2.462 16.320 -13.105 1.00 1.00 H new ATOM 0 HH12 ARG A 39 -2.615 14.888 -14.127 1.00 1.00 H new ATOM 0 HH21 ARG A 39 -5.691 15.907 -15.542 1.00 1.00 H new ATOM 0 HH22 ARG A 39 -4.446 14.654 -15.508 1.00 1.00 H new ATOM 617 N VAL A 40 -1.064 20.766 -9.635 1.00 1.00 N ATOM 618 CA VAL A 40 -0.072 21.413 -8.784 1.00 1.00 C ATOM 619 C VAL A 40 1.138 20.506 -8.586 1.00 1.00 C ATOM 620 O VAL A 40 1.030 19.388 -8.078 1.00 1.00 O ATOM 621 CB VAL A 40 -0.666 21.830 -7.418 1.00 1.00 C ATOM 622 CG1 VAL A 40 0.406 22.322 -6.476 1.00 1.00 C ATOM 623 CG2 VAL A 40 -1.730 22.898 -7.619 1.00 1.00 C ATOM 0 H VAL A 40 -1.273 19.801 -9.379 1.00 1.00 H new ATOM 0 HA VAL A 40 0.248 22.323 -9.292 1.00 1.00 H new ATOM 0 HB VAL A 40 -1.123 20.951 -6.965 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -0.047 22.606 -5.526 1.00 1.00 H new ATOM 0 HG12 VAL A 40 1.134 21.529 -6.308 1.00 1.00 H new ATOM 0 HG13 VAL A 40 0.906 23.187 -6.913 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -2.143 23.186 -6.652 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -1.284 23.770 -8.098 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -2.526 22.504 -8.251 1.00 1.00 H new ATOM 633 N THR A 41 2.271 20.992 -9.062 1.00 1.00 N ATOM 634 CA THR A 41 3.524 20.255 -9.029 1.00 1.00 C ATOM 635 C THR A 41 4.644 21.136 -8.497 1.00 1.00 C ATOM 636 O THR A 41 4.409 22.281 -8.116 1.00 1.00 O ATOM 637 CB THR A 41 3.896 19.754 -10.445 1.00 1.00 C ATOM 638 OG1 THR A 41 3.988 20.861 -11.354 1.00 1.00 O ATOM 639 CG2 THR A 41 2.862 18.773 -10.967 1.00 1.00 C ATOM 0 H THR A 41 2.349 21.917 -9.486 1.00 1.00 H new ATOM 0 HA THR A 41 3.395 19.398 -8.368 1.00 1.00 H new ATOM 0 HB THR A 41 4.860 19.250 -10.375 1.00 1.00 H new ATOM 0 HG1 THR A 41 4.225 20.533 -12.246 1.00 1.00 H new ATOM 0 HG21 THR A 41 3.149 18.438 -11.964 1.00 1.00 H new ATOM 0 HG22 THR A 41 2.805 17.915 -10.298 1.00 1.00 H new ATOM 0 HG23 THR A 41 1.889 19.261 -11.015 1.00 1.00 H new ATOM 647 N SER A 42 5.866 20.634 -8.523 1.00 1.00 N ATOM 648 CA SER A 42 6.994 21.404 -8.044 1.00 1.00 C ATOM 649 C SER A 42 8.303 20.837 -8.592 1.00 1.00 C ATOM 650 O SER A 42 8.309 19.776 -9.229 1.00 1.00 O ATOM 651 CB SER A 42 6.998 21.407 -6.516 1.00 1.00 C ATOM 652 OG SER A 42 7.171 20.101 -6.005 1.00 1.00 O ATOM 0 H SER A 42 6.099 19.703 -8.869 1.00 1.00 H new ATOM 0 HA SER A 42 6.903 22.431 -8.398 1.00 1.00 H new ATOM 0 HB2 SER A 42 7.798 22.052 -6.153 1.00 1.00 H new ATOM 0 HB3 SER A 42 6.061 21.824 -6.148 1.00 1.00 H new ATOM 0 HG SER A 42 6.536 19.949 -5.274 1.00 1.00 H new ATOM 658 N ALA A 43 9.392 21.581 -8.417 1.00 1.00 N ATOM 659 CA ALA A 43 10.697 21.157 -8.897 1.00 1.00 C ATOM 660 C ALA A 43 11.814 21.962 -8.246 1.00 1.00 C ATOM 661 O ALA A 43 11.568 22.964 -7.566 1.00 1.00 O ATOM 662 CB ALA A 43 10.778 21.326 -10.403 1.00 1.00 C ATOM 0 H ALA A 43 9.392 22.484 -7.943 1.00 1.00 H new ATOM 0 HA ALA A 43 10.822 20.107 -8.632 1.00 1.00 H new ATOM 0 HB1 ALA A 43 11.759 21.006 -10.753 1.00 1.00 H new ATOM 0 HB2 ALA A 43 10.007 20.720 -10.879 1.00 1.00 H new ATOM 0 HB3 ALA A 43 10.625 22.374 -10.660 1.00 1.00 H new ATOM 668 N GLY A 44 13.037 21.480 -8.420 1.00 1.00 N ATOM 669 CA GLY A 44 14.203 22.168 -7.917 1.00 1.00 C ATOM 670 C GLY A 44 15.212 22.407 -9.022 1.00 1.00 C ATOM 671 O GLY A 44 15.499 21.502 -9.806 1.00 1.00 O ATOM 0 H GLY A 44 13.241 20.609 -8.910 1.00 1.00 H new ATOM 0 HA2 GLY A 44 13.906 23.121 -7.478 1.00 1.00 H new ATOM 0 HA3 GLY A 44 14.662 21.580 -7.122 1.00 1.00 H new ATOM 675 N THR A 45 15.772 23.609 -9.074 1.00 1.00 N ATOM 676 CA THR A 45 16.711 23.976 -10.133 1.00 1.00 C ATOM 677 C THR A 45 18.053 23.253 -9.996 1.00 1.00 C ATOM 678 O THR A 45 18.737 23.008 -10.990 1.00 1.00 O ATOM 679 CB THR A 45 16.954 25.498 -10.138 1.00 1.00 C ATOM 680 OG1 THR A 45 17.269 25.942 -8.811 1.00 1.00 O ATOM 681 CG2 THR A 45 15.730 26.241 -10.641 1.00 1.00 C ATOM 0 H THR A 45 15.594 24.349 -8.395 1.00 1.00 H new ATOM 0 HA THR A 45 16.255 23.669 -11.074 1.00 1.00 H new ATOM 0 HB THR A 45 17.788 25.709 -10.807 1.00 1.00 H new ATOM 0 HG1 THR A 45 17.726 26.808 -8.856 1.00 1.00 H new ATOM 0 HG21 THR A 45 15.927 27.313 -10.635 1.00 1.00 H new ATOM 0 HG22 THR A 45 15.502 25.920 -11.657 1.00 1.00 H new ATOM 0 HG23 THR A 45 14.881 26.024 -9.993 1.00 1.00 H new ATOM 689 N GLY A 46 18.399 22.875 -8.770 1.00 1.00 N ATOM 690 CA GLY A 46 19.679 22.231 -8.525 1.00 1.00 C ATOM 691 C GLY A 46 19.543 20.754 -8.212 1.00 1.00 C ATOM 692 O GLY A 46 20.507 20.127 -7.778 1.00 1.00 O ATOM 0 H GLY A 46 17.818 23.002 -7.942 1.00 1.00 H new ATOM 0 HA2 GLY A 46 20.316 22.355 -9.400 1.00 1.00 H new ATOM 0 HA3 GLY A 46 20.178 22.729 -7.694 1.00 1.00 H new ATOM 696 N ASN A 47 18.329 20.227 -8.401 1.00 1.00 N ATOM 697 CA ASN A 47 18.012 18.802 -8.180 1.00 1.00 C ATOM 698 C ASN A 47 18.634 18.232 -6.896 1.00 1.00 C ATOM 699 O ASN A 47 19.005 17.062 -6.855 1.00 1.00 O ATOM 700 CB ASN A 47 18.408 17.945 -9.402 1.00 1.00 C ATOM 701 CG ASN A 47 19.895 17.944 -9.729 1.00 1.00 C ATOM 702 OD1 ASN A 47 20.378 18.790 -10.481 1.00 1.00 O ATOM 703 ND2 ASN A 47 20.627 16.993 -9.173 1.00 1.00 N ATOM 0 H ASN A 47 17.529 20.777 -8.714 1.00 1.00 H new ATOM 0 HA ASN A 47 16.931 18.754 -8.050 1.00 1.00 H new ATOM 0 HB2 ASN A 47 18.089 16.918 -9.226 1.00 1.00 H new ATOM 0 HB3 ASN A 47 17.860 18.304 -10.273 1.00 1.00 H new ATOM 0 HD21 ASN A 47 21.628 16.943 -9.362 1.00 1.00 H new ATOM 0 HD22 ASN A 47 20.190 16.309 -8.555 1.00 1.00 H new ATOM 710 N TRP A 48 18.640 19.041 -5.830 1.00 1.00 N ATOM 711 CA TRP A 48 19.189 18.643 -4.525 1.00 1.00 C ATOM 712 C TRP A 48 18.723 17.258 -4.095 1.00 1.00 C ATOM 713 O TRP A 48 19.487 16.292 -4.110 1.00 1.00 O ATOM 714 CB TRP A 48 18.775 19.660 -3.450 1.00 1.00 C ATOM 715 CG TRP A 48 19.857 20.621 -3.069 1.00 1.00 C ATOM 716 CD1 TRP A 48 20.644 20.558 -1.955 1.00 1.00 C ATOM 717 CD2 TRP A 48 20.272 21.786 -3.789 1.00 1.00 C ATOM 718 NE1 TRP A 48 21.524 21.613 -1.938 1.00 1.00 N ATOM 719 CE2 TRP A 48 21.317 22.380 -3.054 1.00 1.00 C ATOM 720 CE3 TRP A 48 19.865 22.387 -4.982 1.00 1.00 C ATOM 721 CZ2 TRP A 48 21.961 23.541 -3.477 1.00 1.00 C ATOM 722 CZ3 TRP A 48 20.504 23.540 -5.403 1.00 1.00 C ATOM 723 CH2 TRP A 48 21.540 24.108 -4.649 1.00 1.00 C ATOM 0 H TRP A 48 18.265 19.989 -5.846 1.00 1.00 H new ATOM 0 HA TRP A 48 20.273 18.616 -4.633 1.00 1.00 H new ATOM 0 HB2 TRP A 48 17.914 20.223 -3.810 1.00 1.00 H new ATOM 0 HB3 TRP A 48 18.453 19.120 -2.559 1.00 1.00 H new ATOM 0 HD1 TRP A 48 20.584 19.791 -1.197 1.00 1.00 H new ATOM 0 HE1 TRP A 48 22.218 21.795 -1.213 1.00 1.00 H new ATOM 0 HE3 TRP A 48 19.064 21.959 -5.567 1.00 1.00 H new ATOM 0 HZ2 TRP A 48 22.763 23.978 -2.901 1.00 1.00 H new ATOM 0 HZ3 TRP A 48 20.200 24.009 -6.327 1.00 1.00 H new ATOM 0 HH2 TRP A 48 22.016 25.012 -5.000 1.00 1.00 H new ATOM 734 N HIS A 49 17.483 17.192 -3.665 1.00 1.00 N ATOM 735 CA HIS A 49 16.905 15.946 -3.203 1.00 1.00 C ATOM 736 C HIS A 49 15.921 15.395 -4.214 1.00 1.00 C ATOM 737 O HIS A 49 14.874 14.885 -3.844 1.00 1.00 O ATOM 738 CB HIS A 49 16.225 16.144 -1.845 1.00 1.00 C ATOM 739 CG HIS A 49 17.162 16.057 -0.681 1.00 1.00 C ATOM 740 ND1 HIS A 49 17.046 15.098 0.303 1.00 1.00 N ATOM 741 CD2 HIS A 49 18.232 16.815 -0.341 1.00 1.00 C ATOM 742 CE1 HIS A 49 18.004 15.271 1.195 1.00 1.00 C ATOM 743 NE2 HIS A 49 18.736 16.304 0.826 1.00 1.00 N ATOM 0 H HIS A 49 16.850 17.991 -3.625 1.00 1.00 H new ATOM 0 HA HIS A 49 17.711 15.221 -3.087 1.00 1.00 H new ATOM 0 HB2 HIS A 49 15.735 17.118 -1.833 1.00 1.00 H new ATOM 0 HB3 HIS A 49 15.444 15.393 -1.727 1.00 1.00 H new ATOM 0 HD2 HIS A 49 18.616 17.664 -0.888 1.00 1.00 H new ATOM 0 HE1 HIS A 49 18.161 14.669 2.077 1.00 1.00 H new ATOM 0 HE2 HIS A 49 19.547 16.665 1.329 1.00 1.00 H new ATOM 752 N VAL A 50 16.266 15.475 -5.489 1.00 1.00 N ATOM 753 CA VAL A 50 15.390 14.946 -6.526 1.00 1.00 C ATOM 754 C VAL A 50 15.191 13.432 -6.335 1.00 1.00 C ATOM 755 O VAL A 50 16.156 12.682 -6.190 1.00 1.00 O ATOM 756 CB VAL A 50 15.929 15.259 -7.944 1.00 1.00 C ATOM 757 CG1 VAL A 50 17.268 14.583 -8.203 1.00 1.00 C ATOM 758 CG2 VAL A 50 14.909 14.871 -9.002 1.00 1.00 C ATOM 0 H VAL A 50 17.132 15.894 -5.829 1.00 1.00 H new ATOM 0 HA VAL A 50 14.423 15.440 -6.432 1.00 1.00 H new ATOM 0 HB VAL A 50 16.095 16.335 -8.003 1.00 1.00 H new ATOM 0 HG11 VAL A 50 17.611 14.828 -9.208 1.00 1.00 H new ATOM 0 HG12 VAL A 50 17.999 14.933 -7.475 1.00 1.00 H new ATOM 0 HG13 VAL A 50 17.154 13.503 -8.112 1.00 1.00 H new ATOM 0 HG21 VAL A 50 15.306 15.099 -9.991 1.00 1.00 H new ATOM 0 HG22 VAL A 50 14.700 13.804 -8.932 1.00 1.00 H new ATOM 0 HG23 VAL A 50 13.988 15.432 -8.843 1.00 1.00 H new ATOM 768 N GLY A 51 13.931 13.008 -6.245 1.00 1.00 N ATOM 769 CA GLY A 51 13.630 11.605 -6.000 1.00 1.00 C ATOM 770 C GLY A 51 13.379 11.333 -4.533 1.00 1.00 C ATOM 771 O GLY A 51 12.942 10.246 -4.151 1.00 1.00 O ATOM 0 H GLY A 51 13.113 13.611 -6.337 1.00 1.00 H new ATOM 0 HA2 GLY A 51 12.753 11.315 -6.579 1.00 1.00 H new ATOM 0 HA3 GLY A 51 14.460 10.989 -6.347 1.00 1.00 H new ATOM 775 N SER A 52 13.720 12.312 -3.708 1.00 1.00 N ATOM 776 CA SER A 52 13.509 12.222 -2.275 1.00 1.00 C ATOM 777 C SER A 52 12.061 12.565 -1.936 1.00 1.00 C ATOM 778 O SER A 52 11.196 12.631 -2.815 1.00 1.00 O ATOM 779 CB SER A 52 14.453 13.166 -1.531 1.00 1.00 C ATOM 780 OG SER A 52 14.675 12.745 -0.195 1.00 1.00 O ATOM 0 H SER A 52 14.148 13.186 -4.013 1.00 1.00 H new ATOM 0 HA SER A 52 13.719 11.200 -1.960 1.00 1.00 H new ATOM 0 HB2 SER A 52 15.405 13.218 -2.059 1.00 1.00 H new ATOM 0 HB3 SER A 52 14.034 14.172 -1.530 1.00 1.00 H new ATOM 0 HG SER A 52 15.371 13.302 0.212 1.00 1.00 H new ATOM 786 N CYS A 53 11.839 12.912 -0.684 1.00 1.00 N ATOM 787 CA CYS A 53 10.518 13.240 -0.196 1.00 1.00 C ATOM 788 C CYS A 53 10.571 14.566 0.548 1.00 1.00 C ATOM 789 O CYS A 53 11.649 15.136 0.720 1.00 1.00 O ATOM 790 CB CYS A 53 10.034 12.119 0.723 1.00 1.00 C ATOM 791 SG CYS A 53 8.296 12.234 1.229 1.00 1.00 S ATOM 0 H CYS A 53 12.572 12.974 0.023 1.00 1.00 H new ATOM 0 HA CYS A 53 9.820 13.338 -1.028 1.00 1.00 H new ATOM 0 HB2 CYS A 53 10.187 11.165 0.218 1.00 1.00 H new ATOM 0 HB3 CYS A 53 10.657 12.109 1.618 1.00 1.00 H new ATOM 0 HG CYS A 53 7.565 12.552 0.202 1.00 1.00 H new ATOM 797 N ALA A 54 9.407 15.092 0.906 1.00 1.00 N ATOM 798 CA ALA A 54 9.321 16.364 1.618 1.00 1.00 C ATOM 799 C ALA A 54 10.154 16.345 2.900 1.00 1.00 C ATOM 800 O ALA A 54 10.199 15.337 3.607 1.00 1.00 O ATOM 801 CB ALA A 54 7.868 16.699 1.926 1.00 1.00 C ATOM 0 H ALA A 54 8.505 14.657 0.715 1.00 1.00 H new ATOM 0 HA ALA A 54 9.731 17.140 0.971 1.00 1.00 H new ATOM 0 HB1 ALA A 54 7.818 17.650 2.457 1.00 1.00 H new ATOM 0 HB2 ALA A 54 7.307 16.774 0.995 1.00 1.00 H new ATOM 0 HB3 ALA A 54 7.437 15.914 2.547 1.00 1.00 H new ATOM 807 N ASP A 55 10.808 17.469 3.177 1.00 1.00 N ATOM 808 CA ASP A 55 11.685 17.609 4.335 1.00 1.00 C ATOM 809 C ASP A 55 10.933 17.368 5.638 1.00 1.00 C ATOM 810 O ASP A 55 9.770 17.756 5.779 1.00 1.00 O ATOM 811 CB ASP A 55 12.301 19.011 4.353 1.00 1.00 C ATOM 812 CG ASP A 55 13.358 19.181 5.424 1.00 1.00 C ATOM 813 OD1 ASP A 55 12.988 19.309 6.605 1.00 1.00 O ATOM 814 OD2 ASP A 55 14.558 19.193 5.086 1.00 1.00 O ATOM 0 H ASP A 55 10.745 18.310 2.604 1.00 1.00 H new ATOM 0 HA ASP A 55 12.471 16.858 4.252 1.00 1.00 H new ATOM 0 HB2 ASP A 55 12.743 19.220 3.379 1.00 1.00 H new ATOM 0 HB3 ASP A 55 11.512 19.746 4.510 1.00 1.00 H new ATOM 819 N GLU A 56 11.604 16.703 6.574 1.00 1.00 N ATOM 820 CA GLU A 56 11.047 16.392 7.884 1.00 1.00 C ATOM 821 C GLU A 56 10.464 17.613 8.602 1.00 1.00 C ATOM 822 O GLU A 56 9.510 17.463 9.371 1.00 1.00 O ATOM 823 CB GLU A 56 12.112 15.716 8.750 1.00 1.00 C ATOM 824 CG GLU A 56 13.415 16.495 8.859 1.00 1.00 C ATOM 825 CD GLU A 56 14.509 15.695 9.537 1.00 1.00 C ATOM 826 OE1 GLU A 56 14.419 15.478 10.765 1.00 1.00 O ATOM 827 OE2 GLU A 56 15.464 15.273 8.848 1.00 1.00 O ATOM 0 H GLU A 56 12.557 16.363 6.442 1.00 1.00 H new ATOM 0 HA GLU A 56 10.212 15.711 7.722 1.00 1.00 H new ATOM 0 HB2 GLU A 56 11.708 15.564 9.751 1.00 1.00 H new ATOM 0 HB3 GLU A 56 12.325 14.729 8.339 1.00 1.00 H new ATOM 0 HG2 GLU A 56 13.746 16.786 7.862 1.00 1.00 H new ATOM 0 HG3 GLU A 56 13.240 17.414 9.418 1.00 1.00 H new ATOM 834 N ARG A 57 10.985 18.816 8.341 1.00 1.00 N ATOM 835 CA ARG A 57 10.457 20.023 8.978 1.00 1.00 C ATOM 836 C ARG A 57 9.064 20.304 8.453 1.00 1.00 C ATOM 837 O ARG A 57 8.108 20.403 9.218 1.00 1.00 O ATOM 838 CB ARG A 57 11.338 21.241 8.660 1.00 1.00 C ATOM 839 CG ARG A 57 12.815 21.048 8.937 1.00 1.00 C ATOM 840 CD ARG A 57 13.666 21.936 8.032 1.00 1.00 C ATOM 841 NE ARG A 57 13.709 23.335 8.451 1.00 1.00 N ATOM 842 CZ ARG A 57 14.652 24.188 8.048 1.00 1.00 C ATOM 843 NH1 ARG A 57 15.634 23.770 7.255 1.00 1.00 N ATOM 844 NH2 ARG A 57 14.621 25.456 8.436 1.00 1.00 N ATOM 0 H ARG A 57 11.762 18.978 7.701 1.00 1.00 H new ATOM 0 HA ARG A 57 10.441 19.856 10.055 1.00 1.00 H new ATOM 0 HB2 ARG A 57 11.211 21.499 7.609 1.00 1.00 H new ATOM 0 HB3 ARG A 57 10.982 22.091 9.242 1.00 1.00 H new ATOM 0 HG2 ARG A 57 13.025 21.280 9.981 1.00 1.00 H new ATOM 0 HG3 ARG A 57 13.083 20.003 8.782 1.00 1.00 H new ATOM 0 HD2 ARG A 57 14.682 21.543 8.005 1.00 1.00 H new ATOM 0 HD3 ARG A 57 13.276 21.883 7.015 1.00 1.00 H new ATOM 0 HE ARG A 57 12.983 23.676 9.082 1.00 1.00 H new ATOM 0 HH11 ARG A 57 15.667 22.796 6.954 1.00 1.00 H new ATOM 0 HH12 ARG A 57 16.354 24.423 6.948 1.00 1.00 H new ATOM 0 HH21 ARG A 57 13.873 25.784 9.046 1.00 1.00 H new ATOM 0 HH22 ARG A 57 15.345 26.103 8.124 1.00 1.00 H new ATOM 858 N ALA A 58 8.950 20.309 7.130 1.00 1.00 N ATOM 859 CA ALA A 58 7.694 20.630 6.468 1.00 1.00 C ATOM 860 C ALA A 58 6.664 19.541 6.720 1.00 1.00 C ATOM 861 O ALA A 58 5.471 19.815 6.843 1.00 1.00 O ATOM 862 CB ALA A 58 7.936 20.807 4.979 1.00 1.00 C ATOM 0 H ALA A 58 9.717 20.093 6.493 1.00 1.00 H new ATOM 0 HA ALA A 58 7.303 21.562 6.877 1.00 1.00 H new ATOM 0 HB1 ALA A 58 6.995 21.047 4.484 1.00 1.00 H new ATOM 0 HB2 ALA A 58 8.647 21.617 4.820 1.00 1.00 H new ATOM 0 HB3 ALA A 58 8.339 19.883 4.564 1.00 1.00 H new ATOM 868 N ALA A 59 7.138 18.309 6.845 1.00 1.00 N ATOM 869 CA ALA A 59 6.259 17.184 7.125 1.00 1.00 C ATOM 870 C ALA A 59 5.569 17.380 8.465 1.00 1.00 C ATOM 871 O ALA A 59 4.356 17.209 8.580 1.00 1.00 O ATOM 872 CB ALA A 59 7.039 15.883 7.110 1.00 1.00 C ATOM 0 H ALA A 59 8.124 18.064 6.757 1.00 1.00 H new ATOM 0 HA ALA A 59 5.498 17.133 6.347 1.00 1.00 H new ATOM 0 HB1 ALA A 59 6.365 15.052 7.321 1.00 1.00 H new ATOM 0 HB2 ALA A 59 7.492 15.742 6.129 1.00 1.00 H new ATOM 0 HB3 ALA A 59 7.820 15.919 7.869 1.00 1.00 H new ATOM 878 N GLY A 60 6.347 17.758 9.473 1.00 1.00 N ATOM 879 CA GLY A 60 5.786 18.019 10.780 1.00 1.00 C ATOM 880 C GLY A 60 4.810 19.174 10.753 1.00 1.00 C ATOM 881 O GLY A 60 3.771 19.134 11.407 1.00 1.00 O ATOM 0 H GLY A 60 7.356 17.888 9.406 1.00 1.00 H new ATOM 0 HA2 GLY A 60 5.280 17.124 11.143 1.00 1.00 H new ATOM 0 HA3 GLY A 60 6.590 18.239 11.483 1.00 1.00 H new ATOM 885 N VAL A 61 5.137 20.183 9.959 1.00 1.00 N ATOM 886 CA VAL A 61 4.294 21.360 9.808 1.00 1.00 C ATOM 887 C VAL A 61 2.940 20.998 9.200 1.00 1.00 C ATOM 888 O VAL A 61 1.885 21.229 9.802 1.00 1.00 O ATOM 889 CB VAL A 61 4.983 22.414 8.909 1.00 1.00 C ATOM 890 CG1 VAL A 61 4.130 23.648 8.755 1.00 1.00 C ATOM 891 CG2 VAL A 61 6.349 22.783 9.448 1.00 1.00 C ATOM 0 H VAL A 61 5.992 20.209 9.403 1.00 1.00 H new ATOM 0 HA VAL A 61 4.137 21.774 10.804 1.00 1.00 H new ATOM 0 HB VAL A 61 5.111 21.965 7.924 1.00 1.00 H new ATOM 0 HG11 VAL A 61 4.643 24.368 8.118 1.00 1.00 H new ATOM 0 HG12 VAL A 61 3.177 23.377 8.301 1.00 1.00 H new ATOM 0 HG13 VAL A 61 3.953 24.092 9.734 1.00 1.00 H new ATOM 0 HG21 VAL A 61 6.809 23.525 8.796 1.00 1.00 H new ATOM 0 HG22 VAL A 61 6.245 23.196 10.451 1.00 1.00 H new ATOM 0 HG23 VAL A 61 6.978 21.893 9.486 1.00 1.00 H new ATOM 901 N LEU A 62 2.980 20.424 8.010 1.00 1.00 N ATOM 902 CA LEU A 62 1.775 20.078 7.282 1.00 1.00 C ATOM 903 C LEU A 62 0.894 19.128 8.086 1.00 1.00 C ATOM 904 O LEU A 62 -0.262 19.445 8.372 1.00 1.00 O ATOM 905 CB LEU A 62 2.153 19.465 5.935 1.00 1.00 C ATOM 906 CG LEU A 62 2.933 20.403 5.010 1.00 1.00 C ATOM 907 CD1 LEU A 62 3.400 19.666 3.771 1.00 1.00 C ATOM 908 CD2 LEU A 62 2.076 21.598 4.627 1.00 1.00 C ATOM 0 H LEU A 62 3.845 20.186 7.524 1.00 1.00 H new ATOM 0 HA LEU A 62 1.196 20.986 7.111 1.00 1.00 H new ATOM 0 HB2 LEU A 62 2.749 18.570 6.111 1.00 1.00 H new ATOM 0 HB3 LEU A 62 1.243 19.147 5.426 1.00 1.00 H new ATOM 0 HG LEU A 62 3.812 20.762 5.545 1.00 1.00 H new ATOM 0 HD11 LEU A 62 3.952 20.350 3.127 1.00 1.00 H new ATOM 0 HD12 LEU A 62 4.048 18.839 4.062 1.00 1.00 H new ATOM 0 HD13 LEU A 62 2.536 19.277 3.232 1.00 1.00 H new ATOM 0 HD21 LEU A 62 2.643 22.257 3.969 1.00 1.00 H new ATOM 0 HD22 LEU A 62 1.180 21.253 4.110 1.00 1.00 H new ATOM 0 HD23 LEU A 62 1.789 22.143 5.526 1.00 1.00 H new ATOM 920 N ARG A 63 1.476 18.024 8.541 1.00 1.00 N ATOM 921 CA ARG A 63 0.732 17.025 9.308 1.00 1.00 C ATOM 922 C ARG A 63 0.138 17.637 10.579 1.00 1.00 C ATOM 923 O ARG A 63 -0.925 17.221 11.036 1.00 1.00 O ATOM 924 CB ARG A 63 1.625 15.836 9.682 1.00 1.00 C ATOM 925 CG ARG A 63 2.553 16.112 10.855 1.00 1.00 C ATOM 926 CD ARG A 63 3.402 14.901 11.192 1.00 1.00 C ATOM 927 NE ARG A 63 2.644 13.890 11.930 1.00 1.00 N ATOM 928 CZ ARG A 63 2.846 12.575 11.828 1.00 1.00 C ATOM 929 NH1 ARG A 63 3.705 12.086 10.940 1.00 1.00 N ATOM 930 NH2 ARG A 63 2.157 11.744 12.600 1.00 1.00 N ATOM 0 H ARG A 63 2.459 17.796 8.394 1.00 1.00 H new ATOM 0 HA ARG A 63 -0.080 16.670 8.673 1.00 1.00 H new ATOM 0 HB2 ARG A 63 0.994 14.981 9.923 1.00 1.00 H new ATOM 0 HB3 ARG A 63 2.223 15.556 8.815 1.00 1.00 H new ATOM 0 HG2 ARG A 63 3.200 16.956 10.617 1.00 1.00 H new ATOM 0 HG3 ARG A 63 1.964 16.398 11.726 1.00 1.00 H new ATOM 0 HD2 ARG A 63 3.791 14.463 10.273 1.00 1.00 H new ATOM 0 HD3 ARG A 63 4.262 15.214 11.784 1.00 1.00 H new ATOM 0 HE ARG A 63 1.913 14.212 12.564 1.00 1.00 H new ATOM 0 HH11 ARG A 63 4.219 12.718 10.326 1.00 1.00 H new ATOM 0 HH12 ARG A 63 3.850 11.079 10.872 1.00 1.00 H new ATOM 0 HH21 ARG A 63 1.478 12.112 13.266 1.00 1.00 H new ATOM 0 HH22 ARG A 63 2.307 10.738 12.527 1.00 1.00 H new ATOM 944 N ALA A 64 0.809 18.655 11.120 1.00 1.00 N ATOM 945 CA ALA A 64 0.348 19.306 12.340 1.00 1.00 C ATOM 946 C ALA A 64 -0.934 20.081 12.093 1.00 1.00 C ATOM 947 O ALA A 64 -1.792 20.188 12.966 1.00 1.00 O ATOM 948 CB ALA A 64 1.416 20.239 12.899 1.00 1.00 C ATOM 0 H ALA A 64 1.669 19.043 10.732 1.00 1.00 H new ATOM 0 HA ALA A 64 0.148 18.524 13.072 1.00 1.00 H new ATOM 0 HB1 ALA A 64 1.046 20.712 13.809 1.00 1.00 H new ATOM 0 HB2 ALA A 64 2.316 19.667 13.127 1.00 1.00 H new ATOM 0 HB3 ALA A 64 1.651 21.006 12.161 1.00 1.00 H new ATOM 954 N HIS A 65 -1.061 20.628 10.895 1.00 1.00 N ATOM 955 CA HIS A 65 -2.234 21.417 10.550 1.00 1.00 C ATOM 956 C HIS A 65 -3.246 20.587 9.756 1.00 1.00 C ATOM 957 O HIS A 65 -4.256 21.106 9.275 1.00 1.00 O ATOM 958 CB HIS A 65 -1.813 22.677 9.790 1.00 1.00 C ATOM 959 CG HIS A 65 -0.944 23.585 10.612 1.00 1.00 C ATOM 960 ND1 HIS A 65 -1.450 24.460 11.546 1.00 1.00 N ATOM 961 CD2 HIS A 65 0.406 23.719 10.666 1.00 1.00 C ATOM 962 CE1 HIS A 65 -0.455 25.090 12.143 1.00 1.00 C ATOM 963 NE2 HIS A 65 0.682 24.660 11.631 1.00 1.00 N ATOM 0 H HIS A 65 -0.371 20.542 10.149 1.00 1.00 H new ATOM 0 HA HIS A 65 -2.731 21.726 11.470 1.00 1.00 H new ATOM 0 HB2 HIS A 65 -1.278 22.389 8.885 1.00 1.00 H new ATOM 0 HB3 HIS A 65 -2.703 23.221 9.474 1.00 1.00 H new ATOM 0 HD2 HIS A 65 1.128 23.187 10.064 1.00 1.00 H new ATOM 0 HE1 HIS A 65 -0.555 25.833 12.920 1.00 1.00 H new ATOM 0 HE2 HIS A 65 1.613 24.974 11.905 1.00 1.00 H new ATOM 972 N GLY A 66 -2.960 19.292 9.634 1.00 1.00 N ATOM 973 CA GLY A 66 -3.873 18.374 8.972 1.00 1.00 C ATOM 974 C GLY A 66 -3.643 18.287 7.478 1.00 1.00 C ATOM 975 O GLY A 66 -4.475 17.755 6.743 1.00 1.00 O ATOM 0 H GLY A 66 -2.105 18.860 9.985 1.00 1.00 H new ATOM 0 HA2 GLY A 66 -3.763 17.382 9.410 1.00 1.00 H new ATOM 0 HA3 GLY A 66 -4.899 18.692 9.158 1.00 1.00 H new ATOM 979 N TYR A 67 -2.513 18.803 7.035 1.00 1.00 N ATOM 980 CA TYR A 67 -2.163 18.788 5.628 1.00 1.00 C ATOM 981 C TYR A 67 -1.376 17.526 5.285 1.00 1.00 C ATOM 982 O TYR A 67 -0.719 16.948 6.152 1.00 1.00 O ATOM 983 CB TYR A 67 -1.347 20.032 5.268 1.00 1.00 C ATOM 984 CG TYR A 67 -2.164 21.308 5.206 1.00 1.00 C ATOM 985 CD1 TYR A 67 -2.952 21.595 4.098 1.00 1.00 C ATOM 986 CD2 TYR A 67 -2.146 22.221 6.254 1.00 1.00 C ATOM 987 CE1 TYR A 67 -3.701 22.759 4.036 1.00 1.00 C ATOM 988 CE2 TYR A 67 -2.890 23.385 6.198 1.00 1.00 C ATOM 989 CZ TYR A 67 -3.665 23.650 5.088 1.00 1.00 C ATOM 990 OH TYR A 67 -4.402 24.810 5.032 1.00 1.00 O ATOM 0 H TYR A 67 -1.815 19.242 7.636 1.00 1.00 H new ATOM 0 HA TYR A 67 -3.084 18.792 5.045 1.00 1.00 H new ATOM 0 HB2 TYR A 67 -0.551 20.157 6.002 1.00 1.00 H new ATOM 0 HB3 TYR A 67 -0.867 19.872 4.302 1.00 1.00 H new ATOM 0 HD1 TYR A 67 -2.981 20.900 3.272 1.00 1.00 H new ATOM 0 HD2 TYR A 67 -1.541 22.018 7.126 1.00 1.00 H new ATOM 0 HE1 TYR A 67 -4.310 22.967 3.169 1.00 1.00 H new ATOM 0 HE2 TYR A 67 -2.865 24.084 7.021 1.00 1.00 H new ATOM 0 HH TYR A 67 -4.265 25.325 5.854 1.00 1.00 H new ATOM 1000 N PRO A 68 -1.470 17.056 4.034 1.00 1.00 N ATOM 1001 CA PRO A 68 -0.710 15.895 3.572 1.00 1.00 C ATOM 1002 C PRO A 68 0.766 16.219 3.458 1.00 1.00 C ATOM 1003 O PRO A 68 1.141 17.383 3.362 1.00 1.00 O ATOM 1004 CB PRO A 68 -1.300 15.603 2.194 1.00 1.00 C ATOM 1005 CG PRO A 68 -1.861 16.903 1.740 1.00 1.00 C ATOM 1006 CD PRO A 68 -2.326 17.613 2.978 1.00 1.00 C ATOM 0 HA PRO A 68 -0.780 15.050 4.257 1.00 1.00 H new ATOM 0 HB2 PRO A 68 -0.537 15.239 1.506 1.00 1.00 H new ATOM 0 HB3 PRO A 68 -2.072 14.836 2.248 1.00 1.00 H new ATOM 0 HG2 PRO A 68 -1.108 17.490 1.214 1.00 1.00 H new ATOM 0 HG3 PRO A 68 -2.687 16.749 1.046 1.00 1.00 H new ATOM 0 HD2 PRO A 68 -2.205 18.693 2.891 1.00 1.00 H new ATOM 0 HD3 PRO A 68 -3.381 17.425 3.176 1.00 1.00 H new ATOM 1014 N THR A 69 1.601 15.198 3.451 1.00 1.00 N ATOM 1015 CA THR A 69 3.033 15.421 3.403 1.00 1.00 C ATOM 1016 C THR A 69 3.713 14.512 2.377 1.00 1.00 C ATOM 1017 O THR A 69 4.933 14.548 2.216 1.00 1.00 O ATOM 1018 CB THR A 69 3.663 15.201 4.799 1.00 1.00 C ATOM 1019 OG1 THR A 69 3.519 13.829 5.198 1.00 1.00 O ATOM 1020 CG2 THR A 69 3.005 16.089 5.841 1.00 1.00 C ATOM 0 H THR A 69 1.318 14.218 3.478 1.00 1.00 H new ATOM 0 HA THR A 69 3.191 16.455 3.095 1.00 1.00 H new ATOM 0 HB THR A 69 4.720 15.458 4.730 1.00 1.00 H new ATOM 0 HG1 THR A 69 3.923 13.701 6.082 1.00 1.00 H new ATOM 0 HG21 THR A 69 3.467 15.914 6.813 1.00 1.00 H new ATOM 0 HG22 THR A 69 3.133 17.135 5.561 1.00 1.00 H new ATOM 0 HG23 THR A 69 1.942 15.857 5.898 1.00 1.00 H new ATOM 1028 N ASP A 70 2.911 13.742 1.645 1.00 1.00 N ATOM 1029 CA ASP A 70 3.443 12.824 0.637 1.00 1.00 C ATOM 1030 C ASP A 70 3.906 13.605 -0.591 1.00 1.00 C ATOM 1031 O ASP A 70 3.148 14.407 -1.144 1.00 1.00 O ATOM 1032 CB ASP A 70 2.384 11.789 0.240 1.00 1.00 C ATOM 1033 CG ASP A 70 2.953 10.671 -0.612 1.00 1.00 C ATOM 1034 OD1 ASP A 70 3.530 9.726 -0.039 1.00 1.00 O ATOM 1035 OD2 ASP A 70 2.817 10.726 -1.855 1.00 1.00 O ATOM 0 H ASP A 70 1.895 13.734 1.729 1.00 1.00 H new ATOM 0 HA ASP A 70 4.297 12.297 1.063 1.00 1.00 H new ATOM 0 HB2 ASP A 70 1.940 11.365 1.141 1.00 1.00 H new ATOM 0 HB3 ASP A 70 1.583 12.286 -0.307 1.00 1.00 H new ATOM 1040 N HIS A 71 5.150 13.387 -1.001 1.00 1.00 N ATOM 1041 CA HIS A 71 5.739 14.127 -2.114 1.00 1.00 C ATOM 1042 C HIS A 71 7.026 13.460 -2.587 1.00 1.00 C ATOM 1043 O HIS A 71 7.764 12.896 -1.789 1.00 1.00 O ATOM 1044 CB HIS A 71 6.001 15.576 -1.662 1.00 1.00 C ATOM 1045 CG HIS A 71 6.985 16.354 -2.483 1.00 1.00 C ATOM 1046 ND1 HIS A 71 6.644 17.109 -3.585 1.00 1.00 N ATOM 1047 CD2 HIS A 71 8.315 16.534 -2.310 1.00 1.00 C ATOM 1048 CE1 HIS A 71 7.721 17.716 -4.045 1.00 1.00 C ATOM 1049 NE2 HIS A 71 8.749 17.388 -3.288 1.00 1.00 N ATOM 0 H HIS A 71 5.774 12.700 -0.578 1.00 1.00 H new ATOM 0 HA HIS A 71 5.048 14.131 -2.957 1.00 1.00 H new ATOM 0 HB2 HIS A 71 5.052 16.113 -1.663 1.00 1.00 H new ATOM 0 HB3 HIS A 71 6.354 15.556 -0.631 1.00 1.00 H new ATOM 0 HD2 HIS A 71 8.924 16.085 -1.539 1.00 1.00 H new ATOM 0 HE1 HIS A 71 7.755 18.374 -4.901 1.00 1.00 H new ATOM 0 HE2 HIS A 71 9.707 17.716 -3.410 1.00 1.00 H new ATOM 1058 N ARG A 72 7.320 13.612 -3.870 1.00 1.00 N ATOM 1059 CA ARG A 72 8.534 13.073 -4.457 1.00 1.00 C ATOM 1060 C ARG A 72 9.197 14.182 -5.262 1.00 1.00 C ATOM 1061 O ARG A 72 8.656 14.658 -6.263 1.00 1.00 O ATOM 1062 CB ARG A 72 8.205 11.854 -5.330 1.00 1.00 C ATOM 1063 CG ARG A 72 9.414 11.094 -5.881 1.00 1.00 C ATOM 1064 CD ARG A 72 9.990 11.760 -7.118 1.00 1.00 C ATOM 1065 NE ARG A 72 10.673 10.803 -7.994 1.00 1.00 N ATOM 1066 CZ ARG A 72 11.531 11.144 -8.956 1.00 1.00 C ATOM 1067 NH1 ARG A 72 11.900 12.410 -9.115 1.00 1.00 N ATOM 1068 NH2 ARG A 72 12.031 10.210 -9.750 1.00 1.00 N ATOM 0 H ARG A 72 6.724 14.111 -4.530 1.00 1.00 H new ATOM 0 HA ARG A 72 9.221 12.732 -3.682 1.00 1.00 H new ATOM 0 HB2 ARG A 72 7.599 11.163 -4.745 1.00 1.00 H new ATOM 0 HB3 ARG A 72 7.592 12.184 -6.169 1.00 1.00 H new ATOM 0 HG2 ARG A 72 10.184 11.031 -5.112 1.00 1.00 H new ATOM 0 HG3 ARG A 72 9.120 10.072 -6.123 1.00 1.00 H new ATOM 0 HD2 ARG A 72 9.189 12.249 -7.672 1.00 1.00 H new ATOM 0 HD3 ARG A 72 10.691 12.539 -6.817 1.00 1.00 H new ATOM 0 HE ARG A 72 10.479 9.811 -7.859 1.00 1.00 H new ATOM 0 HH11 ARG A 72 11.526 13.131 -8.498 1.00 1.00 H new ATOM 0 HH12 ARG A 72 12.557 12.661 -9.854 1.00 1.00 H new ATOM 0 HH21 ARG A 72 11.759 9.235 -9.624 1.00 1.00 H new ATOM 0 HH22 ARG A 72 12.688 10.466 -10.487 1.00 1.00 H new ATOM 1082 N ALA A 73 10.326 14.643 -4.750 1.00 1.00 N ATOM 1083 CA ALA A 73 11.037 15.777 -5.330 1.00 1.00 C ATOM 1084 C ALA A 73 11.430 15.535 -6.786 1.00 1.00 C ATOM 1085 O ALA A 73 11.804 14.425 -7.164 1.00 1.00 O ATOM 1086 CB ALA A 73 12.256 16.119 -4.491 1.00 1.00 C ATOM 0 H ALA A 73 10.776 14.246 -3.925 1.00 1.00 H new ATOM 0 HA ALA A 73 10.353 16.626 -5.326 1.00 1.00 H new ATOM 0 HB1 ALA A 73 12.777 16.967 -4.935 1.00 1.00 H new ATOM 0 HB2 ALA A 73 11.941 16.376 -3.480 1.00 1.00 H new ATOM 0 HB3 ALA A 73 12.926 15.260 -4.455 1.00 1.00 H new ATOM 1092 N ALA A 74 11.295 16.570 -7.598 1.00 1.00 N ATOM 1093 CA ALA A 74 11.664 16.513 -9.004 1.00 1.00 C ATOM 1094 C ALA A 74 12.537 17.709 -9.376 1.00 1.00 C ATOM 1095 O ALA A 74 12.648 18.670 -8.615 1.00 1.00 O ATOM 1096 CB ALA A 74 10.413 16.487 -9.868 1.00 1.00 C ATOM 0 H ALA A 74 10.927 17.474 -7.302 1.00 1.00 H new ATOM 0 HA ALA A 74 12.235 15.601 -9.179 1.00 1.00 H new ATOM 0 HB1 ALA A 74 10.698 16.444 -10.919 1.00 1.00 H new ATOM 0 HB2 ALA A 74 9.816 15.610 -9.618 1.00 1.00 H new ATOM 0 HB3 ALA A 74 9.827 17.388 -9.687 1.00 1.00 H new ATOM 1102 N GLN A 75 13.182 17.634 -10.528 1.00 1.00 N ATOM 1103 CA GLN A 75 14.035 18.717 -10.988 1.00 1.00 C ATOM 1104 C GLN A 75 13.284 19.529 -12.041 1.00 1.00 C ATOM 1105 O GLN A 75 12.277 19.062 -12.582 1.00 1.00 O ATOM 1106 CB GLN A 75 15.349 18.146 -11.538 1.00 1.00 C ATOM 1107 CG GLN A 75 16.186 19.148 -12.326 1.00 1.00 C ATOM 1108 CD GLN A 75 17.503 18.566 -12.811 1.00 1.00 C ATOM 1109 OE1 GLN A 75 17.599 17.372 -13.090 1.00 1.00 O ATOM 1110 NE2 GLN A 75 18.526 19.400 -12.912 1.00 1.00 N ATOM 0 H GLN A 75 13.131 16.836 -11.161 1.00 1.00 H new ATOM 0 HA GLN A 75 14.287 19.380 -10.160 1.00 1.00 H new ATOM 0 HB2 GLN A 75 15.944 17.768 -10.707 1.00 1.00 H new ATOM 0 HB3 GLN A 75 15.121 17.295 -12.180 1.00 1.00 H new ATOM 0 HG2 GLN A 75 15.612 19.499 -13.184 1.00 1.00 H new ATOM 0 HG3 GLN A 75 16.387 20.017 -11.700 1.00 1.00 H new ATOM 0 HE21 GLN A 75 18.407 20.384 -12.671 1.00 1.00 H new ATOM 0 HE22 GLN A 75 19.433 19.059 -13.231 1.00 1.00 H new ATOM 1119 N VAL A 76 13.708 20.768 -12.266 1.00 1.00 N ATOM 1120 CA VAL A 76 13.077 21.619 -13.260 1.00 1.00 C ATOM 1121 C VAL A 76 13.314 21.073 -14.661 1.00 1.00 C ATOM 1122 O VAL A 76 14.443 21.058 -15.151 1.00 1.00 O ATOM 1123 CB VAL A 76 13.610 23.059 -13.176 1.00 1.00 C ATOM 1124 CG1 VAL A 76 13.017 23.932 -14.260 1.00 1.00 C ATOM 1125 CG2 VAL A 76 13.337 23.647 -11.805 1.00 1.00 C ATOM 0 H VAL A 76 14.487 21.203 -11.771 1.00 1.00 H new ATOM 0 HA VAL A 76 12.007 21.628 -13.053 1.00 1.00 H new ATOM 0 HB VAL A 76 14.688 23.026 -13.332 1.00 1.00 H new ATOM 0 HG11 VAL A 76 13.415 24.943 -14.171 1.00 1.00 H new ATOM 0 HG12 VAL A 76 13.276 23.525 -15.237 1.00 1.00 H new ATOM 0 HG13 VAL A 76 11.933 23.958 -14.153 1.00 1.00 H new ATOM 0 HG21 VAL A 76 13.721 24.666 -11.763 1.00 1.00 H new ATOM 0 HG22 VAL A 76 12.263 23.656 -11.620 1.00 1.00 H new ATOM 0 HG23 VAL A 76 13.831 23.042 -11.045 1.00 1.00 H new ATOM 1135 N GLY A 77 12.249 20.582 -15.273 1.00 1.00 N ATOM 1136 CA GLY A 77 12.344 20.033 -16.607 1.00 1.00 C ATOM 1137 C GLY A 77 11.334 20.640 -17.550 1.00 1.00 C ATOM 1138 O GLY A 77 10.618 21.575 -17.186 1.00 1.00 O ATOM 0 H GLY A 77 11.314 20.554 -14.866 1.00 1.00 H new ATOM 0 HA2 GLY A 77 13.348 20.202 -16.996 1.00 1.00 H new ATOM 0 HA3 GLY A 77 12.196 18.954 -16.565 1.00 1.00 H new ATOM 1142 N THR A 78 11.217 20.035 -18.721 1.00 1.00 N ATOM 1143 CA THR A 78 10.317 20.487 -19.771 1.00 1.00 C ATOM 1144 C THR A 78 8.878 20.620 -19.291 1.00 1.00 C ATOM 1145 O THR A 78 8.249 21.663 -19.470 1.00 1.00 O ATOM 1146 CB THR A 78 10.343 19.489 -20.930 1.00 1.00 C ATOM 1147 OG1 THR A 78 11.664 19.404 -21.482 1.00 1.00 O ATOM 1148 CG2 THR A 78 9.339 19.869 -22.004 1.00 1.00 C ATOM 0 H THR A 78 11.752 19.204 -18.973 1.00 1.00 H new ATOM 0 HA THR A 78 10.665 21.471 -20.085 1.00 1.00 H new ATOM 0 HB THR A 78 10.061 18.510 -20.542 1.00 1.00 H new ATOM 0 HG1 THR A 78 11.669 18.761 -22.222 1.00 1.00 H new ATOM 0 HG21 THR A 78 9.380 19.141 -22.815 1.00 1.00 H new ATOM 0 HG22 THR A 78 8.336 19.880 -21.577 1.00 1.00 H new ATOM 0 HG23 THR A 78 9.579 20.859 -22.392 1.00 1.00 H new ATOM 1156 N GLU A 79 8.368 19.560 -18.683 1.00 1.00 N ATOM 1157 CA GLU A 79 6.995 19.523 -18.204 1.00 1.00 C ATOM 1158 C GLU A 79 6.745 20.653 -17.207 1.00 1.00 C ATOM 1159 O GLU A 79 5.633 21.162 -17.085 1.00 1.00 O ATOM 1160 CB GLU A 79 6.723 18.191 -17.517 1.00 1.00 C ATOM 1161 CG GLU A 79 7.566 18.024 -16.274 1.00 1.00 C ATOM 1162 CD GLU A 79 8.898 17.361 -16.522 1.00 1.00 C ATOM 1163 OE1 GLU A 79 9.870 18.089 -16.800 1.00 1.00 O ATOM 1164 OE2 GLU A 79 8.980 16.127 -16.398 1.00 1.00 O ATOM 0 H GLU A 79 8.893 18.703 -18.508 1.00 1.00 H new ATOM 0 HA GLU A 79 6.330 19.644 -19.059 1.00 1.00 H new ATOM 0 HB2 GLU A 79 5.667 18.126 -17.253 1.00 1.00 H new ATOM 0 HB3 GLU A 79 6.929 17.375 -18.210 1.00 1.00 H new ATOM 0 HG2 GLU A 79 7.737 19.004 -15.829 1.00 1.00 H new ATOM 0 HG3 GLU A 79 7.009 17.435 -15.545 1.00 1.00 H new ATOM 1171 N HIS A 80 7.799 21.034 -16.499 1.00 1.00 N ATOM 1172 CA HIS A 80 7.704 22.096 -15.508 1.00 1.00 C ATOM 1173 C HIS A 80 7.664 23.453 -16.200 1.00 1.00 C ATOM 1174 O HIS A 80 6.869 24.313 -15.844 1.00 1.00 O ATOM 1175 CB HIS A 80 8.871 22.015 -14.515 1.00 1.00 C ATOM 1176 CG HIS A 80 8.861 20.753 -13.702 1.00 1.00 C ATOM 1177 ND1 HIS A 80 9.436 19.574 -14.129 1.00 1.00 N ATOM 1178 CD2 HIS A 80 8.346 20.491 -12.479 1.00 1.00 C ATOM 1179 CE1 HIS A 80 9.276 18.647 -13.203 1.00 1.00 C ATOM 1180 NE2 HIS A 80 8.617 19.178 -12.190 1.00 1.00 N ATOM 0 H HIS A 80 8.728 20.624 -16.592 1.00 1.00 H new ATOM 0 HA HIS A 80 6.780 21.971 -14.944 1.00 1.00 H new ATOM 0 HB2 HIS A 80 9.812 22.081 -15.062 1.00 1.00 H new ATOM 0 HB3 HIS A 80 8.831 22.873 -13.844 1.00 1.00 H new ATOM 0 HD2 HIS A 80 7.818 21.188 -11.846 1.00 1.00 H new ATOM 0 HE1 HIS A 80 9.625 17.627 -13.264 1.00 1.00 H new ATOM 0 HE2 HIS A 80 8.353 18.692 -11.333 1.00 1.00 H new ATOM 1189 N LEU A 81 8.506 23.623 -17.210 1.00 1.00 N ATOM 1190 CA LEU A 81 8.541 24.858 -17.998 1.00 1.00 C ATOM 1191 C LEU A 81 7.260 25.013 -18.815 1.00 1.00 C ATOM 1192 O LEU A 81 6.954 26.092 -19.318 1.00 1.00 O ATOM 1193 CB LEU A 81 9.738 24.833 -18.946 1.00 1.00 C ATOM 1194 CG LEU A 81 11.072 24.461 -18.301 1.00 1.00 C ATOM 1195 CD1 LEU A 81 12.102 24.124 -19.371 1.00 1.00 C ATOM 1196 CD2 LEU A 81 11.567 25.595 -17.415 1.00 1.00 C ATOM 0 H LEU A 81 9.181 22.918 -17.508 1.00 1.00 H new ATOM 0 HA LEU A 81 8.629 25.700 -17.311 1.00 1.00 H new ATOM 0 HB2 LEU A 81 9.531 24.125 -19.748 1.00 1.00 H new ATOM 0 HB3 LEU A 81 9.837 25.816 -19.406 1.00 1.00 H new ATOM 0 HG LEU A 81 10.924 23.579 -17.678 1.00 1.00 H new ATOM 0 HD11 LEU A 81 13.047 23.861 -18.896 1.00 1.00 H new ATOM 0 HD12 LEU A 81 11.747 23.282 -19.965 1.00 1.00 H new ATOM 0 HD13 LEU A 81 12.250 24.988 -20.019 1.00 1.00 H new ATOM 0 HD21 LEU A 81 12.518 25.315 -16.963 1.00 1.00 H new ATOM 0 HD22 LEU A 81 11.702 26.494 -18.016 1.00 1.00 H new ATOM 0 HD23 LEU A 81 10.836 25.790 -16.631 1.00 1.00 H new ATOM 1208 N ALA A 82 6.540 23.912 -19.004 1.00 1.00 N ATOM 1209 CA ALA A 82 5.308 23.931 -19.778 1.00 1.00 C ATOM 1210 C ALA A 82 4.127 24.299 -18.891 1.00 1.00 C ATOM 1211 O ALA A 82 3.003 24.465 -19.369 1.00 1.00 O ATOM 1212 CB ALA A 82 5.073 22.577 -20.427 1.00 1.00 C ATOM 0 H ALA A 82 6.790 22.996 -18.631 1.00 1.00 H new ATOM 0 HA ALA A 82 5.403 24.684 -20.560 1.00 1.00 H new ATOM 0 HB1 ALA A 82 4.148 22.605 -21.003 1.00 1.00 H new ATOM 0 HB2 ALA A 82 5.906 22.342 -21.089 1.00 1.00 H new ATOM 0 HB3 ALA A 82 4.996 21.812 -19.655 1.00 1.00 H new ATOM 1218 N ALA A 83 4.385 24.369 -17.591 1.00 1.00 N ATOM 1219 CA ALA A 83 3.358 24.715 -16.622 1.00 1.00 C ATOM 1220 C ALA A 83 2.797 26.101 -16.891 1.00 1.00 C ATOM 1221 O ALA A 83 3.483 26.968 -17.436 1.00 1.00 O ATOM 1222 CB ALA A 83 3.915 24.641 -15.214 1.00 1.00 C ATOM 0 H ALA A 83 5.303 24.189 -17.184 1.00 1.00 H new ATOM 0 HA ALA A 83 2.546 23.994 -16.720 1.00 1.00 H new ATOM 0 HB1 ALA A 83 3.134 24.903 -14.500 1.00 1.00 H new ATOM 0 HB2 ALA A 83 4.265 23.628 -15.014 1.00 1.00 H new ATOM 0 HB3 ALA A 83 4.747 25.339 -15.115 1.00 1.00 H new ATOM 1228 N ASP A 84 1.550 26.311 -16.491 1.00 1.00 N ATOM 1229 CA ASP A 84 0.901 27.595 -16.692 1.00 1.00 C ATOM 1230 C ASP A 84 1.361 28.574 -15.630 1.00 1.00 C ATOM 1231 O ASP A 84 1.281 29.784 -15.810 1.00 1.00 O ATOM 1232 CB ASP A 84 -0.623 27.462 -16.643 1.00 1.00 C ATOM 1233 CG ASP A 84 -1.322 28.682 -17.224 1.00 1.00 C ATOM 1234 OD1 ASP A 84 -1.062 29.006 -18.404 1.00 1.00 O ATOM 1235 OD2 ASP A 84 -2.141 29.301 -16.515 1.00 1.00 O ATOM 0 H ASP A 84 0.971 25.610 -16.027 1.00 1.00 H new ATOM 0 HA ASP A 84 1.179 27.963 -17.679 1.00 1.00 H new ATOM 0 HB2 ASP A 84 -0.927 26.573 -17.196 1.00 1.00 H new ATOM 0 HB3 ASP A 84 -0.941 27.320 -15.610 1.00 1.00 H new ATOM 1240 N LEU A 85 1.973 28.038 -14.585 1.00 1.00 N ATOM 1241 CA LEU A 85 2.407 28.855 -13.473 1.00 1.00 C ATOM 1242 C LEU A 85 3.577 28.196 -12.777 1.00 1.00 C ATOM 1243 O LEU A 85 3.479 27.076 -12.289 1.00 1.00 O ATOM 1244 CB LEU A 85 1.268 29.038 -12.468 1.00 1.00 C ATOM 1245 CG LEU A 85 1.370 30.264 -11.547 1.00 1.00 C ATOM 1246 CD1 LEU A 85 0.408 30.119 -10.402 1.00 1.00 C ATOM 1247 CD2 LEU A 85 2.763 30.452 -10.991 1.00 1.00 C ATOM 0 H LEU A 85 2.178 27.043 -14.488 1.00 1.00 H new ATOM 0 HA LEU A 85 2.707 29.830 -13.858 1.00 1.00 H new ATOM 0 HB2 LEU A 85 0.330 29.100 -13.020 1.00 1.00 H new ATOM 0 HB3 LEU A 85 1.213 28.145 -11.846 1.00 1.00 H new ATOM 0 HG LEU A 85 1.126 31.139 -12.150 1.00 1.00 H new ATOM 0 HD11 LEU A 85 0.483 30.990 -9.751 1.00 1.00 H new ATOM 0 HD12 LEU A 85 -0.608 30.041 -10.788 1.00 1.00 H new ATOM 0 HD13 LEU A 85 0.650 29.220 -9.835 1.00 1.00 H new ATOM 0 HD21 LEU A 85 2.782 31.331 -10.347 1.00 1.00 H new ATOM 0 HD22 LEU A 85 3.046 29.572 -10.413 1.00 1.00 H new ATOM 0 HD23 LEU A 85 3.467 30.588 -11.812 1.00 1.00 H new ATOM 1259 N LEU A 86 4.700 28.874 -12.799 1.00 1.00 N ATOM 1260 CA LEU A 86 5.866 28.391 -12.133 1.00 1.00 C ATOM 1261 C LEU A 86 6.158 29.250 -10.916 1.00 1.00 C ATOM 1262 O LEU A 86 6.656 30.362 -11.030 1.00 1.00 O ATOM 1263 CB LEU A 86 7.018 28.348 -13.115 1.00 1.00 C ATOM 1264 CG LEU A 86 6.791 27.389 -14.286 1.00 1.00 C ATOM 1265 CD1 LEU A 86 5.761 27.916 -15.269 1.00 1.00 C ATOM 1266 CD2 LEU A 86 8.095 27.138 -14.976 1.00 1.00 C ATOM 0 H LEU A 86 4.822 29.767 -13.277 1.00 1.00 H new ATOM 0 HA LEU A 86 5.708 27.376 -11.770 1.00 1.00 H new ATOM 0 HB2 LEU A 86 7.189 29.351 -13.506 1.00 1.00 H new ATOM 0 HB3 LEU A 86 7.924 28.054 -12.586 1.00 1.00 H new ATOM 0 HG LEU A 86 6.395 26.455 -13.888 1.00 1.00 H new ATOM 0 HD11 LEU A 86 5.635 27.201 -16.082 1.00 1.00 H new ATOM 0 HD12 LEU A 86 4.809 28.056 -14.758 1.00 1.00 H new ATOM 0 HD13 LEU A 86 6.099 28.870 -15.674 1.00 1.00 H new ATOM 0 HD21 LEU A 86 7.939 26.455 -15.811 1.00 1.00 H new ATOM 0 HD22 LEU A 86 8.497 28.080 -15.348 1.00 1.00 H new ATOM 0 HD23 LEU A 86 8.800 26.695 -14.272 1.00 1.00 H new ATOM 1278 N VAL A 87 5.874 28.689 -9.756 1.00 1.00 N ATOM 1279 CA VAL A 87 6.011 29.412 -8.503 1.00 1.00 C ATOM 1280 C VAL A 87 7.441 29.333 -7.967 1.00 1.00 C ATOM 1281 O VAL A 87 7.824 28.383 -7.291 1.00 1.00 O ATOM 1282 CB VAL A 87 5.023 28.897 -7.439 1.00 1.00 C ATOM 1283 CG1 VAL A 87 5.315 29.507 -6.083 1.00 1.00 C ATOM 1284 CG2 VAL A 87 3.598 29.208 -7.843 1.00 1.00 C ATOM 0 H VAL A 87 5.545 27.729 -9.654 1.00 1.00 H new ATOM 0 HA VAL A 87 5.775 30.455 -8.714 1.00 1.00 H new ATOM 0 HB VAL A 87 5.146 27.816 -7.367 1.00 1.00 H new ATOM 0 HG11 VAL A 87 4.602 29.126 -5.351 1.00 1.00 H new ATOM 0 HG12 VAL A 87 6.327 29.243 -5.776 1.00 1.00 H new ATOM 0 HG13 VAL A 87 5.226 30.592 -6.145 1.00 1.00 H new ATOM 0 HG21 VAL A 87 2.914 28.837 -7.080 1.00 1.00 H new ATOM 0 HG22 VAL A 87 3.476 30.286 -7.946 1.00 1.00 H new ATOM 0 HG23 VAL A 87 3.376 28.725 -8.795 1.00 1.00 H new ATOM 1294 N ALA A 88 8.235 30.310 -8.340 1.00 1.00 N ATOM 1295 CA ALA A 88 9.617 30.384 -7.894 1.00 1.00 C ATOM 1296 C ALA A 88 9.703 30.956 -6.482 1.00 1.00 C ATOM 1297 O ALA A 88 8.843 31.736 -6.057 1.00 1.00 O ATOM 1298 CB ALA A 88 10.451 31.191 -8.869 1.00 1.00 C ATOM 0 H ALA A 88 7.950 31.072 -8.955 1.00 1.00 H new ATOM 0 HA ALA A 88 10.023 29.373 -7.865 1.00 1.00 H new ATOM 0 HB1 ALA A 88 11.482 31.234 -8.517 1.00 1.00 H new ATOM 0 HB2 ALA A 88 10.422 30.718 -9.851 1.00 1.00 H new ATOM 0 HB3 ALA A 88 10.050 32.202 -8.941 1.00 1.00 H new ATOM 1304 N LEU A 89 10.721 30.529 -5.746 1.00 1.00 N ATOM 1305 CA LEU A 89 10.934 31.000 -4.391 1.00 1.00 C ATOM 1306 C LEU A 89 11.941 32.144 -4.371 1.00 1.00 C ATOM 1307 O LEU A 89 12.132 32.794 -3.350 1.00 1.00 O ATOM 1308 CB LEU A 89 11.389 29.851 -3.478 1.00 1.00 C ATOM 1309 CG LEU A 89 10.255 29.018 -2.863 1.00 1.00 C ATOM 1310 CD1 LEU A 89 9.283 29.916 -2.114 1.00 1.00 C ATOM 1311 CD2 LEU A 89 9.527 28.212 -3.928 1.00 1.00 C ATOM 0 H LEU A 89 11.413 29.854 -6.070 1.00 1.00 H new ATOM 0 HA LEU A 89 9.986 31.377 -4.008 1.00 1.00 H new ATOM 0 HB2 LEU A 89 12.037 29.187 -4.051 1.00 1.00 H new ATOM 0 HB3 LEU A 89 11.992 30.266 -2.671 1.00 1.00 H new ATOM 0 HG LEU A 89 10.696 28.316 -2.155 1.00 1.00 H new ATOM 0 HD11 LEU A 89 8.485 29.310 -1.684 1.00 1.00 H new ATOM 0 HD12 LEU A 89 9.811 30.439 -1.317 1.00 1.00 H new ATOM 0 HD13 LEU A 89 8.855 30.644 -2.803 1.00 1.00 H new ATOM 0 HD21 LEU A 89 8.729 27.632 -3.464 1.00 1.00 H new ATOM 0 HD22 LEU A 89 9.100 28.889 -4.668 1.00 1.00 H new ATOM 0 HD23 LEU A 89 10.229 27.537 -4.417 1.00 1.00 H new ATOM 1323 N ASP A 90 12.604 32.373 -5.499 1.00 1.00 N ATOM 1324 CA ASP A 90 13.517 33.502 -5.615 1.00 1.00 C ATOM 1325 C ASP A 90 13.716 33.923 -7.064 1.00 1.00 C ATOM 1326 O ASP A 90 13.334 33.214 -7.999 1.00 1.00 O ATOM 1327 CB ASP A 90 14.881 33.228 -4.956 1.00 1.00 C ATOM 1328 CG ASP A 90 15.633 32.055 -5.551 1.00 1.00 C ATOM 1329 OD1 ASP A 90 15.640 31.901 -6.790 1.00 1.00 O ATOM 1330 OD2 ASP A 90 16.215 31.277 -4.773 1.00 1.00 O ATOM 0 H ASP A 90 12.527 31.798 -6.338 1.00 1.00 H new ATOM 0 HA ASP A 90 13.044 34.323 -5.076 1.00 1.00 H new ATOM 0 HB2 ASP A 90 15.499 34.122 -5.040 1.00 1.00 H new ATOM 0 HB3 ASP A 90 14.728 33.045 -3.892 1.00 1.00 H new ATOM 1335 N ARG A 91 14.328 35.090 -7.211 1.00 1.00 N ATOM 1336 CA ARG A 91 14.638 35.690 -8.509 1.00 1.00 C ATOM 1337 C ARG A 91 15.499 34.781 -9.387 1.00 1.00 C ATOM 1338 O ARG A 91 15.463 34.876 -10.615 1.00 1.00 O ATOM 1339 CB ARG A 91 15.379 37.010 -8.294 1.00 1.00 C ATOM 1340 CG ARG A 91 16.365 36.954 -7.135 1.00 1.00 C ATOM 1341 CD ARG A 91 17.415 38.043 -7.231 1.00 1.00 C ATOM 1342 NE ARG A 91 18.490 37.679 -8.155 1.00 1.00 N ATOM 1343 CZ ARG A 91 19.072 38.533 -8.992 1.00 1.00 C ATOM 1344 NH1 ARG A 91 18.627 39.779 -9.086 1.00 1.00 N ATOM 1345 NH2 ARG A 91 20.093 38.137 -9.741 1.00 1.00 N ATOM 0 H ARG A 91 14.630 35.659 -6.420 1.00 1.00 H new ATOM 0 HA ARG A 91 13.690 35.850 -9.023 1.00 1.00 H new ATOM 0 HB2 ARG A 91 15.913 37.274 -9.207 1.00 1.00 H new ATOM 0 HB3 ARG A 91 14.653 37.802 -8.109 1.00 1.00 H new ATOM 0 HG2 ARG A 91 15.824 37.053 -6.194 1.00 1.00 H new ATOM 0 HG3 ARG A 91 16.853 35.980 -7.121 1.00 1.00 H new ATOM 0 HD2 ARG A 91 16.948 38.970 -7.563 1.00 1.00 H new ATOM 0 HD3 ARG A 91 17.834 38.233 -6.243 1.00 1.00 H new ATOM 0 HE ARG A 91 18.812 36.711 -8.157 1.00 1.00 H new ATOM 0 HH11 ARG A 91 17.838 40.083 -8.516 1.00 1.00 H new ATOM 0 HH12 ARG A 91 19.074 40.433 -9.728 1.00 1.00 H new ATOM 0 HH21 ARG A 91 20.432 37.177 -9.675 1.00 1.00 H new ATOM 0 HH22 ARG A 91 20.539 38.792 -10.383 1.00 1.00 H new ATOM 1359 N ASN A 92 16.246 33.885 -8.758 1.00 1.00 N ATOM 1360 CA ASN A 92 17.162 33.021 -9.487 1.00 1.00 C ATOM 1361 C ASN A 92 16.406 31.910 -10.187 1.00 1.00 C ATOM 1362 O ASN A 92 16.529 31.729 -11.398 1.00 1.00 O ATOM 1363 CB ASN A 92 18.198 32.425 -8.539 1.00 1.00 C ATOM 1364 CG ASN A 92 19.116 33.473 -7.946 1.00 1.00 C ATOM 1365 OD1 ASN A 92 19.341 34.534 -8.537 1.00 1.00 O ATOM 1366 ND2 ASN A 92 19.653 33.189 -6.773 1.00 1.00 N ATOM 0 H ASN A 92 16.236 33.738 -7.749 1.00 1.00 H new ATOM 0 HA ASN A 92 17.673 33.624 -10.238 1.00 1.00 H new ATOM 0 HB2 ASN A 92 17.687 31.897 -7.734 1.00 1.00 H new ATOM 0 HB3 ASN A 92 18.794 31.687 -9.076 1.00 1.00 H new ATOM 0 HD21 ASN A 92 20.279 33.857 -6.323 1.00 1.00 H new ATOM 0 HD22 ASN A 92 19.442 32.301 -6.317 1.00 1.00 H new ATOM 1373 N HIS A 93 15.607 31.180 -9.419 1.00 1.00 N ATOM 1374 CA HIS A 93 14.825 30.072 -9.958 1.00 1.00 C ATOM 1375 C HIS A 93 13.894 30.570 -11.058 1.00 1.00 C ATOM 1376 O HIS A 93 13.787 29.944 -12.113 1.00 1.00 O ATOM 1377 CB HIS A 93 14.011 29.371 -8.857 1.00 1.00 C ATOM 1378 CG HIS A 93 14.820 29.014 -7.650 1.00 1.00 C ATOM 1379 ND1 HIS A 93 14.305 29.038 -6.378 1.00 1.00 N ATOM 1380 CD2 HIS A 93 16.118 28.659 -7.521 1.00 1.00 C ATOM 1381 CE1 HIS A 93 15.252 28.723 -5.520 1.00 1.00 C ATOM 1382 NE2 HIS A 93 16.370 28.489 -6.186 1.00 1.00 N ATOM 0 H HIS A 93 15.483 31.335 -8.419 1.00 1.00 H new ATOM 0 HA HIS A 93 15.521 29.346 -10.377 1.00 1.00 H new ATOM 0 HB2 HIS A 93 13.190 30.021 -8.555 1.00 1.00 H new ATOM 0 HB3 HIS A 93 13.566 28.464 -9.267 1.00 1.00 H new ATOM 0 HD1 HIS A 93 13.340 29.264 -6.136 1.00 1.00 H new ATOM 0 HD2 HIS A 93 16.828 28.532 -8.325 1.00 1.00 H new ATOM 0 HE1 HIS A 93 15.135 28.665 -4.448 1.00 1.00 H new ATOM 1391 N ALA A 94 13.258 31.722 -10.824 1.00 1.00 N ATOM 1392 CA ALA A 94 12.360 32.317 -11.811 1.00 1.00 C ATOM 1393 C ALA A 94 13.112 32.628 -13.102 1.00 1.00 C ATOM 1394 O ALA A 94 12.620 32.366 -14.203 1.00 1.00 O ATOM 1395 CB ALA A 94 11.705 33.574 -11.250 1.00 1.00 C ATOM 0 H ALA A 94 13.350 32.258 -9.961 1.00 1.00 H new ATOM 0 HA ALA A 94 11.574 31.597 -12.040 1.00 1.00 H new ATOM 0 HB1 ALA A 94 11.040 34.003 -11.999 1.00 1.00 H new ATOM 0 HB2 ALA A 94 11.131 33.319 -10.359 1.00 1.00 H new ATOM 0 HB3 ALA A 94 12.475 34.300 -10.990 1.00 1.00 H new ATOM 1401 N ARG A 95 14.311 33.186 -12.947 1.00 1.00 N ATOM 1402 CA ARG A 95 15.179 33.507 -14.073 1.00 1.00 C ATOM 1403 C ARG A 95 15.483 32.267 -14.897 1.00 1.00 C ATOM 1404 O ARG A 95 15.400 32.293 -16.122 1.00 1.00 O ATOM 1405 CB ARG A 95 16.492 34.123 -13.569 1.00 1.00 C ATOM 1406 CG ARG A 95 17.712 33.701 -14.375 1.00 1.00 C ATOM 1407 CD ARG A 95 18.986 34.341 -13.856 1.00 1.00 C ATOM 1408 NE ARG A 95 19.037 35.772 -14.141 1.00 1.00 N ATOM 1409 CZ ARG A 95 19.899 36.322 -14.992 1.00 1.00 C ATOM 1410 NH1 ARG A 95 20.754 35.557 -15.663 1.00 1.00 N ATOM 1411 NH2 ARG A 95 19.899 37.636 -15.171 1.00 1.00 N ATOM 0 H ARG A 95 14.706 33.427 -12.038 1.00 1.00 H new ATOM 0 HA ARG A 95 14.658 34.226 -14.705 1.00 1.00 H new ATOM 0 HB2 ARG A 95 16.408 35.209 -13.595 1.00 1.00 H new ATOM 0 HB3 ARG A 95 16.640 33.840 -12.527 1.00 1.00 H new ATOM 0 HG2 ARG A 95 17.811 32.616 -14.341 1.00 1.00 H new ATOM 0 HG3 ARG A 95 17.568 33.975 -15.420 1.00 1.00 H new ATOM 0 HD2 ARG A 95 19.058 34.183 -12.780 1.00 1.00 H new ATOM 0 HD3 ARG A 95 19.848 33.851 -14.308 1.00 1.00 H new ATOM 0 HE ARG A 95 18.376 36.383 -13.662 1.00 1.00 H new ATOM 0 HH11 ARG A 95 20.750 34.546 -15.526 1.00 1.00 H new ATOM 0 HH12 ARG A 95 21.414 35.981 -16.315 1.00 1.00 H new ATOM 0 HH21 ARG A 95 19.240 38.221 -14.657 1.00 1.00 H new ATOM 0 HH22 ARG A 95 20.558 38.062 -15.822 1.00 1.00 H new ATOM 1425 N LEU A 96 15.775 31.173 -14.210 1.00 1.00 N ATOM 1426 CA LEU A 96 16.167 29.946 -14.877 1.00 1.00 C ATOM 1427 C LEU A 96 15.013 29.396 -15.690 1.00 1.00 C ATOM 1428 O LEU A 96 15.135 29.207 -16.886 1.00 1.00 O ATOM 1429 CB LEU A 96 16.643 28.914 -13.857 1.00 1.00 C ATOM 1430 CG LEU A 96 17.741 29.414 -12.921 1.00 1.00 C ATOM 1431 CD1 LEU A 96 18.199 28.310 -11.985 1.00 1.00 C ATOM 1432 CD2 LEU A 96 18.918 29.964 -13.712 1.00 1.00 C ATOM 0 H LEU A 96 15.747 31.112 -13.192 1.00 1.00 H new ATOM 0 HA LEU A 96 16.992 30.167 -15.554 1.00 1.00 H new ATOM 0 HB2 LEU A 96 15.791 28.592 -13.259 1.00 1.00 H new ATOM 0 HB3 LEU A 96 17.008 28.036 -14.390 1.00 1.00 H new ATOM 0 HG LEU A 96 17.325 30.222 -12.319 1.00 1.00 H new ATOM 0 HD11 LEU A 96 18.981 28.691 -11.328 1.00 1.00 H new ATOM 0 HD12 LEU A 96 17.356 27.969 -11.385 1.00 1.00 H new ATOM 0 HD13 LEU A 96 18.589 27.477 -12.569 1.00 1.00 H new ATOM 0 HD21 LEU A 96 19.687 30.314 -13.024 1.00 1.00 H new ATOM 0 HD22 LEU A 96 19.329 29.179 -14.346 1.00 1.00 H new ATOM 0 HD23 LEU A 96 18.582 30.794 -14.334 1.00 1.00 H new ATOM 1444 N LEU A 97 13.863 29.281 -15.058 1.00 1.00 N ATOM 1445 CA LEU A 97 12.681 28.730 -15.710 1.00 1.00 C ATOM 1446 C LEU A 97 12.405 29.436 -17.042 1.00 1.00 C ATOM 1447 O LEU A 97 12.298 28.795 -18.086 1.00 1.00 O ATOM 1448 CB LEU A 97 11.467 28.892 -14.794 1.00 1.00 C ATOM 1449 CG LEU A 97 11.606 28.272 -13.406 1.00 1.00 C ATOM 1450 CD1 LEU A 97 10.522 28.795 -12.481 1.00 1.00 C ATOM 1451 CD2 LEU A 97 11.543 26.760 -13.491 1.00 1.00 C ATOM 0 H LEU A 97 13.716 29.562 -14.088 1.00 1.00 H new ATOM 0 HA LEU A 97 12.863 27.674 -15.908 1.00 1.00 H new ATOM 0 HB2 LEU A 97 11.260 29.956 -14.679 1.00 1.00 H new ATOM 0 HB3 LEU A 97 10.601 28.450 -15.286 1.00 1.00 H new ATOM 0 HG LEU A 97 12.576 28.555 -12.998 1.00 1.00 H new ATOM 0 HD11 LEU A 97 10.635 28.343 -11.496 1.00 1.00 H new ATOM 0 HD12 LEU A 97 10.608 29.878 -12.396 1.00 1.00 H new ATOM 0 HD13 LEU A 97 9.543 28.540 -12.887 1.00 1.00 H new ATOM 0 HD21 LEU A 97 11.644 26.335 -12.492 1.00 1.00 H new ATOM 0 HD22 LEU A 97 10.587 26.459 -13.919 1.00 1.00 H new ATOM 0 HD23 LEU A 97 12.353 26.397 -14.123 1.00 1.00 H new ATOM 1463 N ARG A 98 12.264 30.754 -16.990 1.00 1.00 N ATOM 1464 CA ARG A 98 11.975 31.544 -18.186 1.00 1.00 C ATOM 1465 C ARG A 98 13.084 31.454 -19.228 1.00 1.00 C ATOM 1466 O ARG A 98 12.808 31.310 -20.418 1.00 1.00 O ATOM 1467 CB ARG A 98 11.676 33.005 -17.828 1.00 1.00 C ATOM 1468 CG ARG A 98 12.856 33.776 -17.260 1.00 1.00 C ATOM 1469 CD ARG A 98 12.382 34.968 -16.451 1.00 1.00 C ATOM 1470 NE ARG A 98 13.369 36.048 -16.395 1.00 1.00 N ATOM 1471 CZ ARG A 98 13.550 36.946 -17.366 1.00 1.00 C ATOM 1472 NH1 ARG A 98 12.861 36.863 -18.499 1.00 1.00 N ATOM 1473 NH2 ARG A 98 14.427 37.929 -17.204 1.00 1.00 N ATOM 0 H ARG A 98 12.345 31.302 -16.133 1.00 1.00 H new ATOM 0 HA ARG A 98 11.081 31.112 -18.636 1.00 1.00 H new ATOM 0 HB2 ARG A 98 11.321 33.518 -18.722 1.00 1.00 H new ATOM 0 HB3 ARG A 98 10.862 33.028 -17.103 1.00 1.00 H new ATOM 0 HG2 ARG A 98 13.456 33.119 -16.630 1.00 1.00 H new ATOM 0 HG3 ARG A 98 13.500 34.115 -18.072 1.00 1.00 H new ATOM 0 HD2 ARG A 98 11.457 35.350 -16.884 1.00 1.00 H new ATOM 0 HD3 ARG A 98 12.149 34.643 -15.437 1.00 1.00 H new ATOM 0 HE ARG A 98 13.954 36.119 -15.563 1.00 1.00 H new ATOM 0 HH11 ARG A 98 12.187 36.109 -18.632 1.00 1.00 H new ATOM 0 HH12 ARG A 98 13.006 37.554 -19.236 1.00 1.00 H new ATOM 0 HH21 ARG A 98 14.962 37.998 -16.338 1.00 1.00 H new ATOM 0 HH22 ARG A 98 14.566 38.616 -17.945 1.00 1.00 H new ATOM 1487 N GLN A 99 14.334 31.530 -18.796 1.00 1.00 N ATOM 1488 CA GLN A 99 15.446 31.436 -19.728 1.00 1.00 C ATOM 1489 C GLN A 99 15.515 30.025 -20.323 1.00 1.00 C ATOM 1490 O GLN A 99 15.921 29.842 -21.471 1.00 1.00 O ATOM 1491 CB GLN A 99 16.757 31.855 -19.041 1.00 1.00 C ATOM 1492 CG GLN A 99 17.396 30.801 -18.149 1.00 1.00 C ATOM 1493 CD GLN A 99 18.579 30.117 -18.805 1.00 1.00 C ATOM 1494 OE1 GLN A 99 18.634 29.970 -20.023 1.00 1.00 O ATOM 1495 NE2 GLN A 99 19.543 29.704 -17.998 1.00 1.00 N ATOM 0 H GLN A 99 14.601 31.655 -17.820 1.00 1.00 H new ATOM 0 HA GLN A 99 15.289 32.127 -20.556 1.00 1.00 H new ATOM 0 HB2 GLN A 99 17.475 32.139 -19.810 1.00 1.00 H new ATOM 0 HB3 GLN A 99 16.564 32.745 -18.441 1.00 1.00 H new ATOM 0 HG2 GLN A 99 17.721 31.267 -17.219 1.00 1.00 H new ATOM 0 HG3 GLN A 99 16.649 30.052 -17.886 1.00 1.00 H new ATOM 0 HE21 GLN A 99 19.460 29.845 -16.991 1.00 1.00 H new ATOM 0 HE22 GLN A 99 20.369 29.245 -18.383 1.00 1.00 H new ATOM 1504 N LEU A 100 15.013 29.046 -19.570 1.00 1.00 N ATOM 1505 CA LEU A 100 14.970 27.668 -20.004 1.00 1.00 C ATOM 1506 C LEU A 100 13.852 27.426 -21.012 1.00 1.00 C ATOM 1507 O LEU A 100 13.897 26.463 -21.775 1.00 1.00 O ATOM 1508 CB LEU A 100 14.769 26.760 -18.792 1.00 1.00 C ATOM 1509 CG LEU A 100 16.041 26.117 -18.250 1.00 1.00 C ATOM 1510 CD1 LEU A 100 16.958 27.120 -17.575 1.00 1.00 C ATOM 1511 CD2 LEU A 100 15.707 24.965 -17.313 1.00 1.00 C ATOM 0 H LEU A 100 14.625 29.197 -18.639 1.00 1.00 H new ATOM 0 HA LEU A 100 15.917 27.441 -20.494 1.00 1.00 H new ATOM 0 HB2 LEU A 100 14.305 27.341 -17.995 1.00 1.00 H new ATOM 0 HB3 LEU A 100 14.067 25.971 -19.061 1.00 1.00 H new ATOM 0 HG LEU A 100 16.587 25.721 -19.106 1.00 1.00 H new ATOM 0 HD11 LEU A 100 17.848 26.609 -17.207 1.00 1.00 H new ATOM 0 HD12 LEU A 100 17.250 27.887 -18.293 1.00 1.00 H new ATOM 0 HD13 LEU A 100 16.436 27.586 -16.739 1.00 1.00 H new ATOM 0 HD21 LEU A 100 16.630 24.521 -16.939 1.00 1.00 H new ATOM 0 HD22 LEU A 100 15.117 25.337 -16.475 1.00 1.00 H new ATOM 0 HD23 LEU A 100 15.135 24.211 -17.853 1.00 1.00 H new ATOM 1523 N GLY A 101 12.863 28.313 -21.037 1.00 1.00 N ATOM 1524 CA GLY A 101 11.749 28.112 -21.939 1.00 1.00 C ATOM 1525 C GLY A 101 10.457 28.749 -21.471 1.00 1.00 C ATOM 1526 O GLY A 101 9.565 28.998 -22.285 1.00 1.00 O ATOM 0 H GLY A 101 12.814 29.152 -20.459 1.00 1.00 H new ATOM 0 HA2 GLY A 101 12.009 28.517 -22.917 1.00 1.00 H new ATOM 0 HA3 GLY A 101 11.588 27.042 -22.069 1.00 1.00 H new ATOM 1530 N VAL A 102 10.328 29.000 -20.169 1.00 1.00 N ATOM 1531 CA VAL A 102 9.105 29.585 -19.646 1.00 1.00 C ATOM 1532 C VAL A 102 9.055 31.095 -19.962 1.00 1.00 C ATOM 1533 O VAL A 102 9.827 31.585 -20.785 1.00 1.00 O ATOM 1534 CB VAL A 102 8.918 29.247 -18.119 1.00 1.00 C ATOM 1535 CG1 VAL A 102 9.164 30.388 -17.166 1.00 1.00 C ATOM 1536 CG2 VAL A 102 7.550 28.656 -17.906 1.00 1.00 C ATOM 0 H VAL A 102 11.046 28.809 -19.470 1.00 1.00 H new ATOM 0 HA VAL A 102 8.248 29.137 -20.148 1.00 1.00 H new ATOM 0 HB VAL A 102 9.698 28.526 -17.876 1.00 1.00 H new ATOM 0 HG11 VAL A 102 9.008 30.047 -16.142 1.00 1.00 H new ATOM 0 HG12 VAL A 102 10.189 30.742 -17.279 1.00 1.00 H new ATOM 0 HG13 VAL A 102 8.473 31.202 -17.387 1.00 1.00 H new ATOM 0 HG21 VAL A 102 7.416 28.420 -16.850 1.00 1.00 H new ATOM 0 HG22 VAL A 102 6.791 29.374 -18.217 1.00 1.00 H new ATOM 0 HG23 VAL A 102 7.451 27.745 -18.496 1.00 1.00 H new ATOM 1546 N GLU A 103 8.196 31.829 -19.284 1.00 1.00 N ATOM 1547 CA GLU A 103 8.047 33.253 -19.492 1.00 1.00 C ATOM 1548 C GLU A 103 7.406 33.825 -18.251 1.00 1.00 C ATOM 1549 O GLU A 103 6.843 33.076 -17.451 1.00 1.00 O ATOM 1550 CB GLU A 103 7.166 33.532 -20.716 1.00 1.00 C ATOM 1551 CG GLU A 103 5.762 32.979 -20.583 1.00 1.00 C ATOM 1552 CD GLU A 103 4.954 33.084 -21.863 1.00 1.00 C ATOM 1553 OE1 GLU A 103 4.372 34.154 -22.117 1.00 1.00 O ATOM 1554 OE2 GLU A 103 4.877 32.081 -22.603 1.00 1.00 O ATOM 0 H GLU A 103 7.577 31.450 -18.567 1.00 1.00 H new ATOM 0 HA GLU A 103 9.019 33.712 -19.674 1.00 1.00 H new ATOM 0 HB2 GLU A 103 7.111 34.609 -20.878 1.00 1.00 H new ATOM 0 HB3 GLU A 103 7.637 33.101 -21.600 1.00 1.00 H new ATOM 0 HG2 GLU A 103 5.818 31.933 -20.281 1.00 1.00 H new ATOM 0 HG3 GLU A 103 5.242 33.513 -19.788 1.00 1.00 H new ATOM 1561 N ALA A 104 7.497 35.132 -18.076 1.00 1.00 N ATOM 1562 CA ALA A 104 7.001 35.766 -16.861 1.00 1.00 C ATOM 1563 C ALA A 104 5.501 35.567 -16.703 1.00 1.00 C ATOM 1564 O ALA A 104 4.973 35.661 -15.597 1.00 1.00 O ATOM 1565 CB ALA A 104 7.345 37.248 -16.837 1.00 1.00 C ATOM 0 H ALA A 104 7.907 35.774 -18.754 1.00 1.00 H new ATOM 0 HA ALA A 104 7.496 35.284 -16.018 1.00 1.00 H new ATOM 0 HB1 ALA A 104 6.963 37.695 -15.919 1.00 1.00 H new ATOM 0 HB2 ALA A 104 8.427 37.371 -16.877 1.00 1.00 H new ATOM 0 HB3 ALA A 104 6.892 37.741 -17.697 1.00 1.00 H new ATOM 1571 N ALA A 105 4.816 35.350 -17.820 1.00 1.00 N ATOM 1572 CA ALA A 105 3.393 35.056 -17.797 1.00 1.00 C ATOM 1573 C ALA A 105 3.126 33.839 -16.926 1.00 1.00 C ATOM 1574 O ALA A 105 2.159 33.793 -16.168 1.00 1.00 O ATOM 1575 CB ALA A 105 2.890 34.799 -19.205 1.00 1.00 C ATOM 0 H ALA A 105 5.227 35.373 -18.753 1.00 1.00 H new ATOM 0 HA ALA A 105 2.865 35.915 -17.382 1.00 1.00 H new ATOM 0 HB1 ALA A 105 1.823 34.580 -19.176 1.00 1.00 H new ATOM 0 HB2 ALA A 105 3.062 35.682 -19.820 1.00 1.00 H new ATOM 0 HB3 ALA A 105 3.423 33.950 -19.633 1.00 1.00 H new ATOM 1581 N ARG A 106 4.040 32.878 -17.017 1.00 1.00 N ATOM 1582 CA ARG A 106 3.910 31.610 -16.312 1.00 1.00 C ATOM 1583 C ARG A 106 4.706 31.619 -15.018 1.00 1.00 C ATOM 1584 O ARG A 106 4.211 31.216 -13.974 1.00 1.00 O ATOM 1585 CB ARG A 106 4.411 30.459 -17.185 1.00 1.00 C ATOM 1586 CG ARG A 106 4.306 30.725 -18.675 1.00 1.00 C ATOM 1587 CD ARG A 106 4.853 29.560 -19.473 1.00 1.00 C ATOM 1588 NE ARG A 106 4.936 29.851 -20.898 1.00 1.00 N ATOM 1589 CZ ARG A 106 5.549 29.072 -21.786 1.00 1.00 C ATOM 1590 NH1 ARG A 106 6.060 27.897 -21.425 1.00 1.00 N ATOM 1591 NH2 ARG A 106 5.651 29.478 -23.042 1.00 1.00 N ATOM 0 H ARG A 106 4.887 32.957 -17.579 1.00 1.00 H new ATOM 0 HA ARG A 106 2.853 31.471 -16.084 1.00 1.00 H new ATOM 0 HB2 ARG A 106 5.452 30.253 -16.935 1.00 1.00 H new ATOM 0 HB3 ARG A 106 3.842 29.560 -16.946 1.00 1.00 H new ATOM 0 HG2 ARG A 106 3.264 30.898 -18.945 1.00 1.00 H new ATOM 0 HG3 ARG A 106 4.855 31.632 -18.926 1.00 1.00 H new ATOM 0 HD2 ARG A 106 5.844 29.301 -19.100 1.00 1.00 H new ATOM 0 HD3 ARG A 106 4.217 28.688 -19.320 1.00 1.00 H new ATOM 0 HE ARG A 106 4.496 30.707 -21.237 1.00 1.00 H new ATOM 0 HH11 ARG A 106 5.984 27.584 -20.457 1.00 1.00 H new ATOM 0 HH12 ARG A 106 6.527 27.310 -22.116 1.00 1.00 H new ATOM 0 HH21 ARG A 106 5.262 30.379 -23.320 1.00 1.00 H new ATOM 0 HH22 ARG A 106 6.119 28.890 -23.732 1.00 1.00 H new ATOM 1605 N VAL A 107 5.926 32.136 -15.074 1.00 1.00 N ATOM 1606 CA VAL A 107 6.812 32.088 -13.929 1.00 1.00 C ATOM 1607 C VAL A 107 6.445 33.194 -12.928 1.00 1.00 C ATOM 1608 O VAL A 107 6.455 34.383 -13.261 1.00 1.00 O ATOM 1609 CB VAL A 107 8.291 32.229 -14.356 1.00 1.00 C ATOM 1610 CG1 VAL A 107 8.582 33.603 -14.906 1.00 1.00 C ATOM 1611 CG2 VAL A 107 9.216 31.903 -13.201 1.00 1.00 C ATOM 0 H VAL A 107 6.319 32.591 -15.898 1.00 1.00 H new ATOM 0 HA VAL A 107 6.690 31.116 -13.451 1.00 1.00 H new ATOM 0 HB VAL A 107 8.473 31.511 -15.156 1.00 1.00 H new ATOM 0 HG11 VAL A 107 9.631 33.664 -15.195 1.00 1.00 H new ATOM 0 HG12 VAL A 107 7.954 33.787 -15.778 1.00 1.00 H new ATOM 0 HG13 VAL A 107 8.372 34.352 -14.143 1.00 1.00 H new ATOM 0 HG21 VAL A 107 10.252 32.009 -13.523 1.00 1.00 H new ATOM 0 HG22 VAL A 107 9.022 32.587 -12.375 1.00 1.00 H new ATOM 0 HG23 VAL A 107 9.041 30.879 -12.873 1.00 1.00 H new ATOM 1621 N ARG A 108 6.071 32.812 -11.718 1.00 1.00 N ATOM 1622 CA ARG A 108 5.678 33.785 -10.715 1.00 1.00 C ATOM 1623 C ARG A 108 6.265 33.439 -9.360 1.00 1.00 C ATOM 1624 O ARG A 108 6.477 32.279 -9.035 1.00 1.00 O ATOM 1625 CB ARG A 108 4.157 33.866 -10.586 1.00 1.00 C ATOM 1626 CG ARG A 108 3.429 34.174 -11.882 1.00 1.00 C ATOM 1627 CD ARG A 108 3.885 35.495 -12.478 1.00 1.00 C ATOM 1628 NE ARG A 108 3.801 36.606 -11.535 1.00 1.00 N ATOM 1629 CZ ARG A 108 4.753 37.527 -11.408 1.00 1.00 C ATOM 1630 NH1 ARG A 108 5.868 37.436 -12.127 1.00 1.00 N ATOM 1631 NH2 ARG A 108 4.597 38.527 -10.554 1.00 1.00 N ATOM 0 H ARG A 108 6.032 31.841 -11.409 1.00 1.00 H new ATOM 0 HA ARG A 108 6.063 34.751 -11.043 1.00 1.00 H new ATOM 0 HB2 ARG A 108 3.788 32.919 -10.193 1.00 1.00 H new ATOM 0 HB3 ARG A 108 3.908 34.634 -9.853 1.00 1.00 H new ATOM 0 HG2 ARG A 108 3.604 33.371 -12.598 1.00 1.00 H new ATOM 0 HG3 ARG A 108 2.355 34.208 -11.698 1.00 1.00 H new ATOM 0 HD2 ARG A 108 4.914 35.396 -12.823 1.00 1.00 H new ATOM 0 HD3 ARG A 108 3.276 35.722 -13.353 1.00 1.00 H new ATOM 0 HE ARG A 108 2.972 36.680 -10.945 1.00 1.00 H new ATOM 0 HH11 ARG A 108 5.994 36.660 -12.777 1.00 1.00 H new ATOM 0 HH12 ARG A 108 6.597 38.142 -12.029 1.00 1.00 H new ATOM 0 HH21 ARG A 108 3.747 38.591 -9.994 1.00 1.00 H new ATOM 0 HH22 ARG A 108 5.327 39.233 -10.457 1.00 1.00 H new ATOM 1645 N MET A 109 6.520 34.467 -8.582 1.00 1.00 N ATOM 1646 CA MET A 109 7.072 34.308 -7.242 1.00 1.00 C ATOM 1647 C MET A 109 5.979 33.934 -6.251 1.00 1.00 C ATOM 1648 O MET A 109 4.908 34.538 -6.263 1.00 1.00 O ATOM 1649 CB MET A 109 7.752 35.598 -6.798 1.00 1.00 C ATOM 1650 CG MET A 109 8.963 35.967 -7.634 1.00 1.00 C ATOM 1651 SD MET A 109 10.321 34.817 -7.391 1.00 1.00 S ATOM 1652 CE MET A 109 10.495 34.925 -5.615 1.00 1.00 C ATOM 0 H MET A 109 6.354 35.436 -8.853 1.00 1.00 H new ATOM 0 HA MET A 109 7.808 33.505 -7.268 1.00 1.00 H new ATOM 0 HB2 MET A 109 7.029 36.413 -6.841 1.00 1.00 H new ATOM 0 HB3 MET A 109 8.057 35.498 -5.756 1.00 1.00 H new ATOM 0 HG2 MET A 109 8.685 35.983 -8.688 1.00 1.00 H new ATOM 0 HG3 MET A 109 9.290 36.974 -7.375 1.00 1.00 H new ATOM 0 HE1 MET A 109 11.538 35.118 -5.363 1.00 1.00 H new ATOM 0 HE2 MET A 109 9.874 35.737 -5.237 1.00 1.00 H new ATOM 0 HE3 MET A 109 10.180 33.986 -5.161 1.00 1.00 H new ATOM 1662 N LEU A 110 6.270 32.989 -5.359 1.00 1.00 N ATOM 1663 CA LEU A 110 5.305 32.547 -4.346 1.00 1.00 C ATOM 1664 C LEU A 110 4.861 33.712 -3.465 1.00 1.00 C ATOM 1665 O LEU A 110 3.671 33.973 -3.319 1.00 1.00 O ATOM 1666 CB LEU A 110 5.936 31.436 -3.482 1.00 1.00 C ATOM 1667 CG LEU A 110 5.013 30.721 -2.471 1.00 1.00 C ATOM 1668 CD1 LEU A 110 4.888 31.506 -1.172 1.00 1.00 C ATOM 1669 CD2 LEU A 110 3.638 30.467 -3.075 1.00 1.00 C ATOM 0 H LEU A 110 7.170 32.511 -5.315 1.00 1.00 H new ATOM 0 HA LEU A 110 4.423 32.156 -4.854 1.00 1.00 H new ATOM 0 HB2 LEU A 110 6.353 30.683 -4.151 1.00 1.00 H new ATOM 0 HB3 LEU A 110 6.770 31.869 -2.931 1.00 1.00 H new ATOM 0 HG LEU A 110 5.471 29.760 -2.236 1.00 1.00 H new ATOM 0 HD11 LEU A 110 4.231 30.972 -0.486 1.00 1.00 H new ATOM 0 HD12 LEU A 110 5.873 31.618 -0.718 1.00 1.00 H new ATOM 0 HD13 LEU A 110 4.471 32.491 -1.381 1.00 1.00 H new ATOM 0 HD21 LEU A 110 3.007 29.963 -2.343 1.00 1.00 H new ATOM 0 HD22 LEU A 110 3.182 31.417 -3.354 1.00 1.00 H new ATOM 0 HD23 LEU A 110 3.740 29.839 -3.960 1.00 1.00 H new ATOM 1681 N ARG A 111 5.832 34.462 -2.962 1.00 1.00 N ATOM 1682 CA ARG A 111 5.557 35.575 -2.064 1.00 1.00 C ATOM 1683 C ARG A 111 4.872 36.706 -2.823 1.00 1.00 C ATOM 1684 O ARG A 111 4.257 37.585 -2.230 1.00 1.00 O ATOM 1685 CB ARG A 111 6.860 36.082 -1.440 1.00 1.00 C ATOM 1686 CG ARG A 111 6.651 37.023 -0.266 1.00 1.00 C ATOM 1687 CD ARG A 111 7.920 37.797 0.058 1.00 1.00 C ATOM 1688 NE ARG A 111 8.208 37.807 1.490 1.00 1.00 N ATOM 1689 CZ ARG A 111 8.433 38.905 2.207 1.00 1.00 C ATOM 1690 NH1 ARG A 111 8.385 40.110 1.642 1.00 1.00 N ATOM 1691 NH2 ARG A 111 8.708 38.795 3.499 1.00 1.00 N ATOM 0 H ARG A 111 6.822 34.319 -3.162 1.00 1.00 H new ATOM 0 HA ARG A 111 4.894 35.229 -1.271 1.00 1.00 H new ATOM 0 HB2 ARG A 111 7.450 35.227 -1.108 1.00 1.00 H new ATOM 0 HB3 ARG A 111 7.443 36.594 -2.205 1.00 1.00 H new ATOM 0 HG2 ARG A 111 5.846 37.721 -0.496 1.00 1.00 H new ATOM 0 HG3 ARG A 111 6.338 36.452 0.608 1.00 1.00 H new ATOM 0 HD2 ARG A 111 8.760 37.355 -0.477 1.00 1.00 H new ATOM 0 HD3 ARG A 111 7.819 38.822 -0.298 1.00 1.00 H new ATOM 0 HE ARG A 111 8.239 36.910 1.974 1.00 1.00 H new ATOM 0 HH11 ARG A 111 8.174 40.199 0.648 1.00 1.00 H new ATOM 0 HH12 ARG A 111 8.559 40.944 2.203 1.00 1.00 H new ATOM 0 HH21 ARG A 111 8.746 37.874 3.936 1.00 1.00 H new ATOM 0 HH22 ARG A 111 8.882 39.631 4.056 1.00 1.00 H new ATOM 1705 N SER A 112 4.956 36.657 -4.147 1.00 1.00 N ATOM 1706 CA SER A 112 4.364 37.687 -4.978 1.00 1.00 C ATOM 1707 C SER A 112 2.854 37.495 -5.111 1.00 1.00 C ATOM 1708 O SER A 112 2.173 38.339 -5.700 1.00 1.00 O ATOM 1709 CB SER A 112 5.032 37.718 -6.356 1.00 1.00 C ATOM 1710 OG SER A 112 4.500 38.751 -7.167 1.00 1.00 O ATOM 0 H SER A 112 5.428 35.915 -4.663 1.00 1.00 H new ATOM 0 HA SER A 112 4.533 38.647 -4.491 1.00 1.00 H new ATOM 0 HB2 SER A 112 6.106 37.863 -6.238 1.00 1.00 H new ATOM 0 HB3 SER A 112 4.893 36.757 -6.851 1.00 1.00 H new ATOM 0 HG SER A 112 3.567 38.916 -6.917 1.00 1.00 H new ATOM 1716 N PHE A 113 2.322 36.376 -4.614 1.00 1.00 N ATOM 1717 CA PHE A 113 0.883 36.161 -4.621 1.00 1.00 C ATOM 1718 C PHE A 113 0.275 36.680 -3.318 1.00 1.00 C ATOM 1719 O PHE A 113 -0.922 36.954 -3.247 1.00 1.00 O ATOM 1720 CB PHE A 113 0.565 34.667 -4.762 1.00 1.00 C ATOM 1721 CG PHE A 113 0.951 34.054 -6.079 1.00 1.00 C ATOM 1722 CD1 PHE A 113 0.152 34.230 -7.192 1.00 1.00 C ATOM 1723 CD2 PHE A 113 2.098 33.287 -6.197 1.00 1.00 C ATOM 1724 CE1 PHE A 113 0.489 33.658 -8.401 1.00 1.00 C ATOM 1725 CE2 PHE A 113 2.439 32.710 -7.403 1.00 1.00 C ATOM 1726 CZ PHE A 113 1.633 32.896 -8.507 1.00 1.00 C ATOM 0 H PHE A 113 2.864 35.614 -4.206 1.00 1.00 H new ATOM 0 HA PHE A 113 0.458 36.700 -5.468 1.00 1.00 H new ATOM 0 HB2 PHE A 113 1.074 34.126 -3.964 1.00 1.00 H new ATOM 0 HB3 PHE A 113 -0.505 34.524 -4.612 1.00 1.00 H new ATOM 0 HD1 PHE A 113 -0.748 34.823 -7.115 1.00 1.00 H new ATOM 0 HD2 PHE A 113 2.732 33.139 -5.336 1.00 1.00 H new ATOM 0 HE1 PHE A 113 -0.143 33.807 -9.264 1.00 1.00 H new ATOM 0 HE2 PHE A 113 3.336 32.113 -7.483 1.00 1.00 H new ATOM 0 HZ PHE A 113 1.898 32.446 -9.452 1.00 1.00 H new ATOM 1736 N ASP A 114 1.115 36.792 -2.292 1.00 1.00 N ATOM 1737 CA ASP A 114 0.687 37.264 -0.978 1.00 1.00 C ATOM 1738 C ASP A 114 0.209 38.710 -1.058 1.00 1.00 C ATOM 1739 O ASP A 114 0.939 39.585 -1.518 1.00 1.00 O ATOM 1740 CB ASP A 114 1.849 37.146 0.020 1.00 1.00 C ATOM 1741 CG ASP A 114 1.586 37.854 1.338 1.00 1.00 C ATOM 1742 OD1 ASP A 114 0.450 37.787 1.846 1.00 1.00 O ATOM 1743 OD2 ASP A 114 2.519 38.496 1.860 1.00 1.00 O ATOM 0 H ASP A 114 2.107 36.559 -2.347 1.00 1.00 H new ATOM 0 HA ASP A 114 -0.143 36.646 -0.637 1.00 1.00 H new ATOM 0 HB2 ASP A 114 2.045 36.092 0.215 1.00 1.00 H new ATOM 0 HB3 ASP A 114 2.750 37.559 -0.433 1.00 1.00 H new ATOM 2056 N GLU A 136 6.974 27.065 10.809 1.00 1.00 N ATOM 2057 CA GLU A 136 5.629 27.614 10.800 1.00 1.00 C ATOM 2058 C GLU A 136 5.603 28.983 10.128 1.00 1.00 C ATOM 2059 O GLU A 136 4.574 29.398 9.594 1.00 1.00 O ATOM 2060 CB GLU A 136 5.095 27.699 12.230 1.00 1.00 C ATOM 2061 CG GLU A 136 5.193 26.380 12.977 1.00 1.00 C ATOM 2062 CD GLU A 136 4.476 26.396 14.311 1.00 1.00 C ATOM 2063 OE1 GLU A 136 5.038 26.936 15.286 1.00 1.00 O ATOM 2064 OE2 GLU A 136 3.353 25.852 14.389 1.00 1.00 O ATOM 0 HA GLU A 136 4.984 26.951 10.223 1.00 1.00 H new ATOM 0 HB2 GLU A 136 5.651 28.462 12.775 1.00 1.00 H new ATOM 0 HB3 GLU A 136 4.054 28.020 12.205 1.00 1.00 H new ATOM 0 HG2 GLU A 136 4.776 25.587 12.357 1.00 1.00 H new ATOM 0 HG3 GLU A 136 6.244 26.139 13.139 1.00 1.00 H new ATOM 2071 N GLU A 137 6.737 29.675 10.153 1.00 1.00 N ATOM 2072 CA GLU A 137 6.850 30.973 9.501 1.00 1.00 C ATOM 2073 C GLU A 137 6.649 30.815 8.003 1.00 1.00 C ATOM 2074 O GLU A 137 5.806 31.481 7.410 1.00 1.00 O ATOM 2075 CB GLU A 137 8.209 31.624 9.782 1.00 1.00 C ATOM 2076 CG GLU A 137 8.386 32.984 9.118 1.00 1.00 C ATOM 2077 CD GLU A 137 7.442 34.039 9.666 1.00 1.00 C ATOM 2078 OE1 GLU A 137 6.264 34.072 9.255 1.00 1.00 O ATOM 2079 OE2 GLU A 137 7.879 34.851 10.509 1.00 1.00 O ATOM 0 H GLU A 137 7.589 29.359 10.617 1.00 1.00 H new ATOM 0 HA GLU A 137 6.076 31.625 9.907 1.00 1.00 H new ATOM 0 HB2 GLU A 137 8.332 31.737 10.859 1.00 1.00 H new ATOM 0 HB3 GLU A 137 8.999 30.956 9.439 1.00 1.00 H new ATOM 0 HG2 GLU A 137 9.414 33.318 9.255 1.00 1.00 H new ATOM 0 HG3 GLU A 137 8.224 32.882 8.045 1.00 1.00 H new ATOM 2086 N VAL A 138 7.385 29.881 7.413 1.00 1.00 N ATOM 2087 CA VAL A 138 7.272 29.599 5.988 1.00 1.00 C ATOM 2088 C VAL A 138 5.859 29.133 5.660 1.00 1.00 C ATOM 2089 O VAL A 138 5.292 29.485 4.628 1.00 1.00 O ATOM 2090 CB VAL A 138 8.274 28.522 5.576 1.00 1.00 C ATOM 2091 CG1 VAL A 138 8.104 28.147 4.117 1.00 1.00 C ATOM 2092 CG2 VAL A 138 9.695 28.969 5.870 1.00 1.00 C ATOM 0 H VAL A 138 8.069 29.304 7.902 1.00 1.00 H new ATOM 0 HA VAL A 138 7.489 30.514 5.436 1.00 1.00 H new ATOM 0 HB VAL A 138 8.075 27.629 6.169 1.00 1.00 H new ATOM 0 HG11 VAL A 138 8.830 27.379 3.852 1.00 1.00 H new ATOM 0 HG12 VAL A 138 7.096 27.765 3.955 1.00 1.00 H new ATOM 0 HG13 VAL A 138 8.263 29.027 3.494 1.00 1.00 H new ATOM 0 HG21 VAL A 138 10.392 28.187 5.569 1.00 1.00 H new ATOM 0 HG22 VAL A 138 9.912 29.882 5.315 1.00 1.00 H new ATOM 0 HG23 VAL A 138 9.803 29.160 6.938 1.00 1.00 H new ATOM 2102 N PHE A 139 5.324 28.313 6.548 1.00 1.00 N ATOM 2103 CA PHE A 139 3.949 27.845 6.439 1.00 1.00 C ATOM 2104 C PHE A 139 3.015 29.041 6.304 1.00 1.00 C ATOM 2105 O PHE A 139 2.141 29.069 5.435 1.00 1.00 O ATOM 2106 CB PHE A 139 3.577 26.984 7.655 1.00 1.00 C ATOM 2107 CG PHE A 139 2.101 26.697 7.784 1.00 1.00 C ATOM 2108 CD1 PHE A 139 1.253 27.588 8.434 1.00 1.00 C ATOM 2109 CD2 PHE A 139 1.558 25.539 7.254 1.00 1.00 C ATOM 2110 CE1 PHE A 139 -0.097 27.329 8.546 1.00 1.00 C ATOM 2111 CE2 PHE A 139 0.207 25.276 7.366 1.00 1.00 C ATOM 2112 CZ PHE A 139 -0.620 26.172 8.011 1.00 1.00 C ATOM 0 H PHE A 139 5.825 27.954 7.361 1.00 1.00 H new ATOM 0 HA PHE A 139 3.848 27.222 5.550 1.00 1.00 H new ATOM 0 HB2 PHE A 139 4.115 26.038 7.594 1.00 1.00 H new ATOM 0 HB3 PHE A 139 3.918 27.487 8.560 1.00 1.00 H new ATOM 0 HD1 PHE A 139 1.658 28.496 8.857 1.00 1.00 H new ATOM 0 HD2 PHE A 139 2.199 24.833 6.747 1.00 1.00 H new ATOM 0 HE1 PHE A 139 -0.743 28.031 9.052 1.00 1.00 H new ATOM 0 HE2 PHE A 139 -0.202 24.368 6.948 1.00 1.00 H new ATOM 0 HZ PHE A 139 -1.677 25.967 8.097 1.00 1.00 H new ATOM 2122 N ALA A 140 3.253 30.047 7.139 1.00 1.00 N ATOM 2123 CA ALA A 140 2.486 31.278 7.104 1.00 1.00 C ATOM 2124 C ALA A 140 2.702 32.005 5.783 1.00 1.00 C ATOM 2125 O ALA A 140 1.768 32.580 5.229 1.00 1.00 O ATOM 2126 CB ALA A 140 2.894 32.175 8.255 1.00 1.00 C ATOM 0 H ALA A 140 3.980 30.028 7.854 1.00 1.00 H new ATOM 0 HA ALA A 140 1.429 31.030 7.198 1.00 1.00 H new ATOM 0 HB1 ALA A 140 2.313 33.097 8.221 1.00 1.00 H new ATOM 0 HB2 ALA A 140 2.708 31.663 9.199 1.00 1.00 H new ATOM 0 HB3 ALA A 140 3.955 32.411 8.174 1.00 1.00 H new ATOM 2132 N VAL A 141 3.951 32.000 5.307 1.00 1.00 N ATOM 2133 CA VAL A 141 4.299 32.620 4.027 1.00 1.00 C ATOM 2134 C VAL A 141 3.435 32.041 2.920 1.00 1.00 C ATOM 2135 O VAL A 141 2.747 32.759 2.197 1.00 1.00 O ATOM 2136 CB VAL A 141 5.780 32.366 3.635 1.00 1.00 C ATOM 2137 CG1 VAL A 141 6.196 33.233 2.449 1.00 1.00 C ATOM 2138 CG2 VAL A 141 6.729 32.546 4.813 1.00 1.00 C ATOM 0 H VAL A 141 4.740 31.572 5.792 1.00 1.00 H new ATOM 0 HA VAL A 141 4.136 33.691 4.145 1.00 1.00 H new ATOM 0 HB VAL A 141 5.852 31.322 3.329 1.00 1.00 H new ATOM 0 HG11 VAL A 141 7.238 33.032 2.199 1.00 1.00 H new ATOM 0 HG12 VAL A 141 5.566 33.002 1.590 1.00 1.00 H new ATOM 0 HG13 VAL A 141 6.082 34.285 2.710 1.00 1.00 H new ATOM 0 HG21 VAL A 141 7.752 32.357 4.488 1.00 1.00 H new ATOM 0 HG22 VAL A 141 6.650 33.565 5.191 1.00 1.00 H new ATOM 0 HG23 VAL A 141 6.464 31.844 5.604 1.00 1.00 H new ATOM 2148 N ILE A 142 3.443 30.724 2.839 1.00 1.00 N ATOM 2149 CA ILE A 142 2.695 30.011 1.827 1.00 1.00 C ATOM 2150 C ILE A 142 1.200 30.216 1.982 1.00 1.00 C ATOM 2151 O ILE A 142 0.524 30.562 1.022 1.00 1.00 O ATOM 2152 CB ILE A 142 3.021 28.516 1.877 1.00 1.00 C ATOM 2153 CG1 ILE A 142 4.451 28.291 1.390 1.00 1.00 C ATOM 2154 CG2 ILE A 142 2.021 27.721 1.047 1.00 1.00 C ATOM 2155 CD1 ILE A 142 5.226 27.304 2.228 1.00 1.00 C ATOM 0 H ILE A 142 3.968 30.121 3.473 1.00 1.00 H new ATOM 0 HA ILE A 142 2.991 30.415 0.859 1.00 1.00 H new ATOM 0 HB ILE A 142 2.944 28.163 2.906 1.00 1.00 H new ATOM 0 HG12 ILE A 142 4.424 27.937 0.359 1.00 1.00 H new ATOM 0 HG13 ILE A 142 4.979 29.245 1.386 1.00 1.00 H new ATOM 0 HG21 ILE A 142 2.270 26.661 1.095 1.00 1.00 H new ATOM 0 HG22 ILE A 142 1.016 27.876 1.441 1.00 1.00 H new ATOM 0 HG23 ILE A 142 2.060 28.056 0.011 1.00 1.00 H new ATOM 0 HD11 ILE A 142 6.232 27.194 1.823 1.00 1.00 H new ATOM 0 HD12 ILE A 142 5.285 27.666 3.255 1.00 1.00 H new ATOM 0 HD13 ILE A 142 4.721 26.338 2.212 1.00 1.00 H new ATOM 2167 N GLU A 143 0.684 29.984 3.183 1.00 1.00 N ATOM 2168 CA GLU A 143 -0.748 30.140 3.423 1.00 1.00 C ATOM 2169 C GLU A 143 -1.193 31.562 3.084 1.00 1.00 C ATOM 2170 O GLU A 143 -2.327 31.780 2.674 1.00 1.00 O ATOM 2171 CB GLU A 143 -1.129 29.777 4.864 1.00 1.00 C ATOM 2172 CG GLU A 143 -0.883 30.872 5.881 1.00 1.00 C ATOM 2173 CD GLU A 143 -1.552 30.573 7.202 1.00 1.00 C ATOM 2174 OE1 GLU A 143 -2.526 29.790 7.211 1.00 1.00 O ATOM 2175 OE2 GLU A 143 -1.120 31.131 8.230 1.00 1.00 O ATOM 0 H GLU A 143 1.225 29.691 3.996 1.00 1.00 H new ATOM 0 HA GLU A 143 -1.271 29.444 2.767 1.00 1.00 H new ATOM 0 HB2 GLU A 143 -2.185 29.508 4.889 1.00 1.00 H new ATOM 0 HB3 GLU A 143 -0.567 28.891 5.161 1.00 1.00 H new ATOM 0 HG2 GLU A 143 0.190 30.990 6.035 1.00 1.00 H new ATOM 0 HG3 GLU A 143 -1.255 31.820 5.492 1.00 1.00 H new ATOM 2182 N SER A 144 -0.283 32.521 3.252 1.00 1.00 N ATOM 2183 CA SER A 144 -0.563 33.914 2.939 1.00 1.00 C ATOM 2184 C SER A 144 -0.560 34.120 1.427 1.00 1.00 C ATOM 2185 O SER A 144 -1.158 35.060 0.911 1.00 1.00 O ATOM 2186 CB SER A 144 0.466 34.836 3.600 1.00 1.00 C ATOM 2187 OG SER A 144 -0.059 36.139 3.794 1.00 1.00 O ATOM 0 H SER A 144 0.659 32.353 3.606 1.00 1.00 H new ATOM 0 HA SER A 144 -1.549 34.165 3.331 1.00 1.00 H new ATOM 0 HB2 SER A 144 0.769 34.417 4.560 1.00 1.00 H new ATOM 0 HB3 SER A 144 1.360 34.891 2.979 1.00 1.00 H new ATOM 0 HG SER A 144 0.264 36.731 3.083 1.00 1.00 H new ATOM 2193 N ALA A 145 0.185 33.273 0.731 1.00 1.00 N ATOM 2194 CA ALA A 145 0.262 33.336 -0.719 1.00 1.00 C ATOM 2195 C ALA A 145 -0.859 32.561 -1.360 1.00 1.00 C ATOM 2196 O ALA A 145 -1.241 32.855 -2.485 1.00 1.00 O ATOM 2197 CB ALA A 145 1.587 32.803 -1.242 1.00 1.00 C ATOM 0 H ALA A 145 0.746 32.532 1.150 1.00 1.00 H new ATOM 0 HA ALA A 145 0.176 34.390 -0.984 1.00 1.00 H new ATOM 0 HB1 ALA A 145 1.602 32.869 -2.330 1.00 1.00 H new ATOM 0 HB2 ALA A 145 2.405 33.395 -0.832 1.00 1.00 H new ATOM 0 HB3 ALA A 145 1.705 31.762 -0.940 1.00 1.00 H new ATOM 2203 N LEU A 146 -1.391 31.563 -0.666 1.00 1.00 N ATOM 2204 CA LEU A 146 -2.447 30.737 -1.225 1.00 1.00 C ATOM 2205 C LEU A 146 -3.672 31.563 -1.684 1.00 1.00 C ATOM 2206 O LEU A 146 -4.268 31.226 -2.699 1.00 1.00 O ATOM 2207 CB LEU A 146 -2.866 29.646 -0.236 1.00 1.00 C ATOM 2208 CG LEU A 146 -1.732 28.725 0.236 1.00 1.00 C ATOM 2209 CD1 LEU A 146 -2.285 27.474 0.900 1.00 1.00 C ATOM 2210 CD2 LEU A 146 -0.815 28.354 -0.923 1.00 1.00 C ATOM 0 H LEU A 146 -1.108 31.309 0.281 1.00 1.00 H new ATOM 0 HA LEU A 146 -2.036 30.263 -2.117 1.00 1.00 H new ATOM 0 HB2 LEU A 146 -3.314 30.121 0.637 1.00 1.00 H new ATOM 0 HB3 LEU A 146 -3.640 29.035 -0.700 1.00 1.00 H new ATOM 0 HG LEU A 146 -1.146 29.271 0.975 1.00 1.00 H new ATOM 0 HD11 LEU A 146 -1.460 26.840 1.225 1.00 1.00 H new ATOM 0 HD12 LEU A 146 -2.887 27.756 1.763 1.00 1.00 H new ATOM 0 HD13 LEU A 146 -2.904 26.928 0.189 1.00 1.00 H new ATOM 0 HD21 LEU A 146 -0.020 27.701 -0.563 1.00 1.00 H new ATOM 0 HD22 LEU A 146 -1.390 27.836 -1.691 1.00 1.00 H new ATOM 0 HD23 LEU A 146 -0.378 29.259 -1.345 1.00 1.00 H new ATOM 2222 N PRO A 147 -4.067 32.659 -0.975 1.00 1.00 N ATOM 2223 CA PRO A 147 -5.191 33.518 -1.399 1.00 1.00 C ATOM 2224 C PRO A 147 -4.859 34.283 -2.679 1.00 1.00 C ATOM 2225 O PRO A 147 -5.743 34.777 -3.378 1.00 1.00 O ATOM 2226 CB PRO A 147 -5.363 34.500 -0.238 1.00 1.00 C ATOM 2227 CG PRO A 147 -4.034 34.535 0.417 1.00 1.00 C ATOM 2228 CD PRO A 147 -3.480 33.150 0.284 1.00 1.00 C ATOM 0 HA PRO A 147 -6.088 32.937 -1.614 1.00 1.00 H new ATOM 0 HB2 PRO A 147 -5.657 35.488 -0.593 1.00 1.00 H new ATOM 0 HB3 PRO A 147 -6.137 34.167 0.453 1.00 1.00 H new ATOM 0 HG2 PRO A 147 -3.381 35.265 -0.061 1.00 1.00 H new ATOM 0 HG3 PRO A 147 -4.121 34.823 1.465 1.00 1.00 H new ATOM 0 HD2 PRO A 147 -2.391 33.157 0.242 1.00 1.00 H new ATOM 0 HD3 PRO A 147 -3.763 32.523 1.129 1.00 1.00 H new ATOM 2236 N GLY A 148 -3.575 34.285 -3.002 1.00 1.00 N ATOM 2237 CA GLY A 148 -3.101 34.959 -4.189 1.00 1.00 C ATOM 2238 C GLY A 148 -2.806 33.959 -5.278 1.00 1.00 C ATOM 2239 O GLY A 148 -3.066 34.202 -6.456 1.00 1.00 O ATOM 0 H GLY A 148 -2.847 33.826 -2.455 1.00 1.00 H new ATOM 0 HA2 GLY A 148 -3.850 35.672 -4.534 1.00 1.00 H new ATOM 0 HA3 GLY A 148 -2.202 35.529 -3.957 1.00 1.00 H new ATOM 2243 N LEU A 149 -2.347 32.786 -4.858 1.00 1.00 N ATOM 2244 CA LEU A 149 -2.037 31.706 -5.771 1.00 1.00 C ATOM 2245 C LEU A 149 -3.349 31.118 -6.286 1.00 1.00 C ATOM 2246 O LEU A 149 -3.501 30.847 -7.474 1.00 1.00 O ATOM 2247 CB LEU A 149 -1.185 30.640 -5.051 1.00 1.00 C ATOM 2248 CG LEU A 149 0.070 30.204 -5.797 1.00 1.00 C ATOM 2249 CD1 LEU A 149 0.635 28.931 -5.200 1.00 1.00 C ATOM 2250 CD2 LEU A 149 -0.235 30.002 -7.257 1.00 1.00 C ATOM 0 H LEU A 149 -2.181 32.563 -3.877 1.00 1.00 H new ATOM 0 HA LEU A 149 -1.457 32.073 -6.617 1.00 1.00 H new ATOM 0 HB2 LEU A 149 -0.893 31.029 -4.076 1.00 1.00 H new ATOM 0 HB3 LEU A 149 -1.805 29.762 -4.871 1.00 1.00 H new ATOM 0 HG LEU A 149 0.817 30.991 -5.698 1.00 1.00 H new ATOM 0 HD11 LEU A 149 1.530 28.638 -5.748 1.00 1.00 H new ATOM 0 HD12 LEU A 149 0.889 29.101 -4.154 1.00 1.00 H new ATOM 0 HD13 LEU A 149 -0.108 28.136 -5.268 1.00 1.00 H new ATOM 0 HD21 LEU A 149 0.670 29.691 -7.778 1.00 1.00 H new ATOM 0 HD22 LEU A 149 -0.999 29.232 -7.366 1.00 1.00 H new ATOM 0 HD23 LEU A 149 -0.597 30.936 -7.686 1.00 1.00 H new ATOM 2262 N HIS A 150 -4.303 30.972 -5.365 1.00 1.00 N ATOM 2263 CA HIS A 150 -5.655 30.522 -5.690 1.00 1.00 C ATOM 2264 C HIS A 150 -6.253 31.385 -6.770 1.00 1.00 C ATOM 2265 O HIS A 150 -6.619 30.908 -7.831 1.00 1.00 O ATOM 2266 CB HIS A 150 -6.566 30.658 -4.484 1.00 1.00 C ATOM 2267 CG HIS A 150 -7.196 29.390 -4.064 1.00 1.00 C ATOM 2268 ND1 HIS A 150 -8.292 28.833 -4.680 1.00 1.00 N ATOM 2269 CD2 HIS A 150 -6.873 28.584 -3.050 1.00 1.00 C ATOM 2270 CE1 HIS A 150 -8.620 27.723 -4.046 1.00 1.00 C ATOM 2271 NE2 HIS A 150 -7.771 27.544 -3.042 1.00 1.00 N ATOM 0 H HIS A 150 -4.159 31.163 -4.373 1.00 1.00 H new ATOM 0 HA HIS A 150 -5.578 29.483 -6.011 1.00 1.00 H new ATOM 0 HB2 HIS A 150 -5.991 31.060 -3.650 1.00 1.00 H new ATOM 0 HB3 HIS A 150 -7.348 31.383 -4.711 1.00 1.00 H new ATOM 0 HD1 HIS A 150 -8.773 29.215 -5.494 1.00 1.00 H new ATOM 0 HD2 HIS A 150 -6.054 28.724 -2.360 1.00 1.00 H new ATOM 0 HE1 HIS A 150 -9.441 27.070 -4.301 1.00 1.00 H new ATOM 2280 N ASP A 151 -6.277 32.677 -6.496 1.00 1.00 N ATOM 2281 CA ASP A 151 -6.917 33.641 -7.379 1.00 1.00 C ATOM 2282 C ASP A 151 -6.329 33.566 -8.773 1.00 1.00 C ATOM 2283 O ASP A 151 -7.052 33.562 -9.767 1.00 1.00 O ATOM 2284 CB ASP A 151 -6.721 35.045 -6.812 1.00 1.00 C ATOM 2285 CG ASP A 151 -7.629 36.074 -7.449 1.00 1.00 C ATOM 2286 OD1 ASP A 151 -8.770 36.233 -6.964 1.00 1.00 O ATOM 2287 OD2 ASP A 151 -7.202 36.737 -8.415 1.00 1.00 O ATOM 0 H ASP A 151 -5.857 33.087 -5.662 1.00 1.00 H new ATOM 0 HA ASP A 151 -7.980 33.410 -7.443 1.00 1.00 H new ATOM 0 HB2 ASP A 151 -6.902 35.025 -5.737 1.00 1.00 H new ATOM 0 HB3 ASP A 151 -5.683 35.347 -6.955 1.00 1.00 H new ATOM 2292 N TRP A 152 -5.014 33.459 -8.823 1.00 1.00 N ATOM 2293 CA TRP A 152 -4.303 33.378 -10.076 1.00 1.00 C ATOM 2294 C TRP A 152 -4.709 32.124 -10.832 1.00 1.00 C ATOM 2295 O TRP A 152 -5.189 32.206 -11.958 1.00 1.00 O ATOM 2296 CB TRP A 152 -2.799 33.386 -9.813 1.00 1.00 C ATOM 2297 CG TRP A 152 -1.969 33.590 -11.043 1.00 1.00 C ATOM 2298 CD1 TRP A 152 -1.348 34.743 -11.429 1.00 1.00 C ATOM 2299 CD2 TRP A 152 -1.669 32.617 -12.051 1.00 1.00 C ATOM 2300 NE1 TRP A 152 -0.677 34.542 -12.610 1.00 1.00 N ATOM 2301 CE2 TRP A 152 -0.864 33.247 -13.012 1.00 1.00 C ATOM 2302 CE3 TRP A 152 -2.008 31.273 -12.236 1.00 1.00 C ATOM 2303 CZ2 TRP A 152 -0.390 32.580 -14.134 1.00 1.00 C ATOM 2304 CZ3 TRP A 152 -1.537 30.614 -13.353 1.00 1.00 C ATOM 2305 CH2 TRP A 152 -0.737 31.270 -14.288 1.00 1.00 C ATOM 0 H TRP A 152 -4.415 33.426 -7.998 1.00 1.00 H new ATOM 0 HA TRP A 152 -4.558 34.242 -10.690 1.00 1.00 H new ATOM 0 HB2 TRP A 152 -2.570 34.175 -9.097 1.00 1.00 H new ATOM 0 HB3 TRP A 152 -2.516 32.441 -9.348 1.00 1.00 H new ATOM 0 HD1 TRP A 152 -1.380 35.676 -10.886 1.00 1.00 H new ATOM 0 HE1 TRP A 152 -0.128 35.244 -13.107 1.00 1.00 H new ATOM 0 HE3 TRP A 152 -2.628 30.759 -11.516 1.00 1.00 H new ATOM 0 HZ2 TRP A 152 0.232 33.082 -14.860 1.00 1.00 H new ATOM 0 HZ3 TRP A 152 -1.791 29.576 -13.505 1.00 1.00 H new ATOM 0 HH2 TRP A 152 -0.384 30.729 -15.153 1.00 1.00 H new ATOM 2316 N VAL A 153 -4.558 30.966 -10.198 1.00 1.00 N ATOM 2317 CA VAL A 153 -4.892 29.707 -10.850 1.00 1.00 C ATOM 2318 C VAL A 153 -6.371 29.683 -11.241 1.00 1.00 C ATOM 2319 O VAL A 153 -6.709 29.274 -12.349 1.00 1.00 O ATOM 2320 CB VAL A 153 -4.526 28.471 -9.978 1.00 1.00 C ATOM 2321 CG1 VAL A 153 -3.084 28.570 -9.514 1.00 1.00 C ATOM 2322 CG2 VAL A 153 -5.447 28.305 -8.777 1.00 1.00 C ATOM 0 H VAL A 153 -4.210 30.874 -9.244 1.00 1.00 H new ATOM 0 HA VAL A 153 -4.288 29.642 -11.755 1.00 1.00 H new ATOM 0 HB VAL A 153 -4.655 27.589 -10.606 1.00 1.00 H new ATOM 0 HG11 VAL A 153 -2.837 27.701 -8.905 1.00 1.00 H new ATOM 0 HG12 VAL A 153 -2.424 28.604 -10.381 1.00 1.00 H new ATOM 0 HG13 VAL A 153 -2.953 29.476 -8.923 1.00 1.00 H new ATOM 0 HG21 VAL A 153 -5.145 27.428 -8.205 1.00 1.00 H new ATOM 0 HG22 VAL A 153 -5.383 29.190 -8.144 1.00 1.00 H new ATOM 0 HG23 VAL A 153 -6.474 28.178 -9.121 1.00 1.00 H new ATOM 2332 N ASP A 154 -7.227 30.202 -10.355 1.00 1.00 N ATOM 2333 CA ASP A 154 -8.665 30.264 -10.601 1.00 1.00 C ATOM 2334 C ASP A 154 -8.974 31.101 -11.843 1.00 1.00 C ATOM 2335 O ASP A 154 -9.670 30.651 -12.752 1.00 1.00 O ATOM 2336 CB ASP A 154 -9.412 30.840 -9.383 1.00 1.00 C ATOM 2337 CG ASP A 154 -9.805 29.786 -8.353 1.00 1.00 C ATOM 2338 OD1 ASP A 154 -10.894 29.190 -8.506 1.00 1.00 O ATOM 2339 OD2 ASP A 154 -9.050 29.568 -7.374 1.00 1.00 O ATOM 0 H ASP A 154 -6.942 30.587 -9.455 1.00 1.00 H new ATOM 0 HA ASP A 154 -9.011 29.244 -10.771 1.00 1.00 H new ATOM 0 HB2 ASP A 154 -8.783 31.589 -8.902 1.00 1.00 H new ATOM 0 HB3 ASP A 154 -10.310 31.352 -9.727 1.00 1.00 H new ATOM 2344 N GLU A 155 -8.427 32.312 -11.875 1.00 1.00 N ATOM 2345 CA GLU A 155 -8.668 33.233 -12.981 1.00 1.00 C ATOM 2346 C GLU A 155 -8.118 32.660 -14.288 1.00 1.00 C ATOM 2347 O GLU A 155 -8.753 32.759 -15.338 1.00 1.00 O ATOM 2348 CB GLU A 155 -8.037 34.610 -12.706 1.00 1.00 C ATOM 2349 CG GLU A 155 -6.607 34.743 -13.204 1.00 1.00 C ATOM 2350 CD GLU A 155 -6.027 36.130 -13.020 1.00 1.00 C ATOM 2351 OE1 GLU A 155 -6.738 36.995 -12.467 1.00 1.00 O ATOM 2352 OE2 GLU A 155 -4.859 36.352 -13.391 1.00 1.00 O ATOM 0 H GLU A 155 -7.813 32.679 -11.147 1.00 1.00 H new ATOM 0 HA GLU A 155 -9.746 33.361 -13.076 1.00 1.00 H new ATOM 0 HB2 GLU A 155 -8.648 35.380 -13.177 1.00 1.00 H new ATOM 0 HB3 GLU A 155 -8.057 34.800 -11.633 1.00 1.00 H new ATOM 0 HG2 GLU A 155 -5.980 34.023 -12.678 1.00 1.00 H new ATOM 0 HG3 GLU A 155 -6.574 34.482 -14.262 1.00 1.00 H new ATOM 2359 N ARG A 156 -6.970 31.997 -14.192 1.00 1.00 N ATOM 2360 CA ARG A 156 -6.293 31.457 -15.360 1.00 1.00 C ATOM 2361 C ARG A 156 -7.024 30.243 -15.903 1.00 1.00 C ATOM 2362 O ARG A 156 -7.277 30.142 -17.106 1.00 1.00 O ATOM 2363 CB ARG A 156 -4.852 31.109 -15.015 1.00 1.00 C ATOM 2364 CG ARG A 156 -4.000 32.327 -14.705 1.00 1.00 C ATOM 2365 CD ARG A 156 -4.303 33.464 -15.650 1.00 1.00 C ATOM 2366 NE ARG A 156 -3.721 34.727 -15.189 1.00 1.00 N ATOM 2367 CZ ARG A 156 -2.602 35.271 -15.651 1.00 1.00 C ATOM 2368 NH1 ARG A 156 -1.851 34.623 -16.538 1.00 1.00 N ATOM 2369 NH2 ARG A 156 -2.228 36.462 -15.200 1.00 1.00 N ATOM 0 H ARG A 156 -6.489 31.821 -13.310 1.00 1.00 H new ATOM 0 HA ARG A 156 -6.292 32.219 -16.139 1.00 1.00 H new ATOM 0 HB2 ARG A 156 -4.843 30.439 -14.155 1.00 1.00 H new ATOM 0 HB3 ARG A 156 -4.407 30.565 -15.848 1.00 1.00 H new ATOM 0 HG2 ARG A 156 -4.179 32.647 -13.679 1.00 1.00 H new ATOM 0 HG3 ARG A 156 -2.945 32.063 -14.777 1.00 1.00 H new ATOM 0 HD2 ARG A 156 -3.916 33.226 -16.641 1.00 1.00 H new ATOM 0 HD3 ARG A 156 -5.383 33.576 -15.749 1.00 1.00 H new ATOM 0 HE ARG A 156 -4.216 35.230 -14.453 1.00 1.00 H new ATOM 0 HH11 ARG A 156 -2.134 33.700 -16.868 1.00 1.00 H new ATOM 0 HH12 ARG A 156 -0.993 35.049 -16.887 1.00 1.00 H new ATOM 0 HH21 ARG A 156 -2.798 36.947 -14.507 1.00 1.00 H new ATOM 0 HH22 ARG A 156 -1.370 36.892 -15.546 1.00 1.00 H new ATOM 2383 N LEU A 157 -7.391 29.344 -15.002 1.00 1.00 N ATOM 2384 CA LEU A 157 -8.108 28.132 -15.384 1.00 1.00 C ATOM 2385 C LEU A 157 -9.465 28.501 -15.966 1.00 1.00 C ATOM 2386 O LEU A 157 -10.022 27.769 -16.778 1.00 1.00 O ATOM 2387 CB LEU A 157 -8.242 27.146 -14.198 1.00 1.00 C ATOM 2388 CG LEU A 157 -9.145 27.555 -13.021 1.00 1.00 C ATOM 2389 CD1 LEU A 157 -10.618 27.301 -13.324 1.00 1.00 C ATOM 2390 CD2 LEU A 157 -8.732 26.795 -11.770 1.00 1.00 C ATOM 0 H LEU A 157 -7.206 29.429 -14.003 1.00 1.00 H new ATOM 0 HA LEU A 157 -7.530 27.614 -16.150 1.00 1.00 H new ATOM 0 HB2 LEU A 157 -8.612 26.199 -14.590 1.00 1.00 H new ATOM 0 HB3 LEU A 157 -7.243 26.959 -13.804 1.00 1.00 H new ATOM 0 HG LEU A 157 -9.022 28.626 -12.859 1.00 1.00 H new ATOM 0 HD11 LEU A 157 -11.223 27.603 -12.469 1.00 1.00 H new ATOM 0 HD12 LEU A 157 -10.914 27.879 -14.200 1.00 1.00 H new ATOM 0 HD13 LEU A 157 -10.771 26.240 -13.520 1.00 1.00 H new ATOM 0 HD21 LEU A 157 -9.373 27.087 -10.938 1.00 1.00 H new ATOM 0 HD22 LEU A 157 -8.831 25.724 -11.946 1.00 1.00 H new ATOM 0 HD23 LEU A 157 -7.695 27.029 -11.528 1.00 1.00 H new