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 45 THR OG1 : rot 160:sc= 0.00624 USER MOD Set 1.2: A 93 HIS : no HE2:sc= -2.89! C(o=-2.9!,f=-4.6!) USER MOD Set 2.1: A 47 ASN : amide:sc= -0.492 X(o=-1.5,f=-1.6) USER MOD Set 2.2: A 75 GLN : amide:sc= -0.995 X(o=-1.5,f=-1.9) USER MOD Set 3.1: A 14 ASN : amide:sc= -2.98! C(o=-3!,f=-9.7!) USER MOD Set 3.2: A 42 SER OG : rot -157:sc= 1.48 USER MOD Set 3.3: A 71 HIS : no HD1:sc= -1.51 K(o=-3,f=-7.7!) USER MOD Set 4.1: A 28 GLN : amide:sc= -0.792 K(o=-1.3,f=-2.6) USER MOD Set 4.2: A 67 TYR OH : rot 180:sc= 0 USER MOD Set 4.3: A 150 HIS : no HE2:sc= -0.535 K(o=-1.3,f=-2.6) USER MOD Set 5.1: A 11 CYS SG : rot 150:sc= 2.72 USER MOD Set 5.2: A 16 CYS SG : rot 180:sc= -0.475! USER MOD Set 5.3: A 18 SER OG : rot 74:sc= 1.43 USER MOD Set 6.1: A 6 HIS : no HE2:sc= -0.349 K(o=-4.3,f=-6.2!) USER MOD Set 6.2: A 8 THR OG1 : rot -140:sc= -0.705 USER MOD Set 6.3: A 41 THR OG1 : rot 180:sc= -0.402 USER MOD Set 6.4: A 80 HIS : no HD1:sc= -2.86! C(o=-4.3!,f=-4.9!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.108 USER MOD Single : A 20 MET CE :methyl 160:sc= -2.92 (180deg=-4.23) USER MOD Single : A 23 LYS NZ :NH3+ 172:sc= 2.34 (180deg=2.11) USER MOD Single : A 24 MET CE :methyl -150:sc= -1.32 (180deg=-2.7!) USER MOD Single : A 27 GLN : amide:sc= -0.731 K(o=-0.73,f=-0.0043) USER MOD Single : A 31 HIS : no HD1:sc=-0.00652 X(o=-0.0065,f=-0.0096) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0.256 USER MOD Single : A 53 CYS SG : rot 40:sc= 0.592 USER MOD Single : A 65 HIS : no HD1:sc= 0.435 K(o=0.44,f=-4.7!) 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= -0.0722 K(o=-0.072,f=-1.3!) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 109 MET CE :methyl -137:sc= -0.824 (180deg=-3.33!) USER MOD Single : A 112 SER OG : rot -15:sc= 0.412 USER MOD Single : A 144 SER OG : rot 95:sc= 1.26 USER MOD ----------------------------------------------------------------- ATOM 50 N PRO A 4 -5.962 21.274 -17.721 1.00 1.00 N ATOM 51 CA PRO A 4 -5.934 21.917 -16.410 1.00 1.00 C ATOM 52 C PRO A 4 -4.722 22.823 -16.221 1.00 1.00 C ATOM 53 O PRO A 4 -3.771 22.779 -16.999 1.00 1.00 O ATOM 54 CB PRO A 4 -5.864 20.744 -15.430 1.00 1.00 C ATOM 55 CG PRO A 4 -5.355 19.591 -16.220 1.00 1.00 C ATOM 56 CD PRO A 4 -5.788 19.816 -17.631 1.00 1.00 C ATOM 0 HA PRO A 4 -6.800 22.563 -16.269 1.00 1.00 H new ATOM 0 HB2 PRO A 4 -5.201 20.970 -14.595 1.00 1.00 H new ATOM 0 HB3 PRO A 4 -6.845 20.527 -15.008 1.00 1.00 H new ATOM 0 HG2 PRO A 4 -4.269 19.525 -16.154 1.00 1.00 H new ATOM 0 HG3 PRO A 4 -5.755 18.652 -15.837 1.00 1.00 H new ATOM 0 HD2 PRO A 4 -5.041 19.459 -18.340 1.00 1.00 H new ATOM 0 HD3 PRO A 4 -6.716 19.289 -17.853 1.00 1.00 H new ATOM 64 N LEU A 5 -4.744 23.589 -15.138 1.00 1.00 N ATOM 65 CA LEU A 5 -3.647 24.489 -14.804 1.00 1.00 C ATOM 66 C LEU A 5 -2.404 23.666 -14.449 1.00 1.00 C ATOM 67 O LEU A 5 -2.462 22.442 -14.369 1.00 1.00 O ATOM 68 CB LEU A 5 -4.055 25.377 -13.619 1.00 1.00 C ATOM 69 CG LEU A 5 -3.834 26.888 -13.770 1.00 1.00 C ATOM 70 CD1 LEU A 5 -2.359 27.240 -13.730 1.00 1.00 C ATOM 71 CD2 LEU A 5 -4.463 27.392 -15.054 1.00 1.00 C ATOM 0 H LEU A 5 -5.516 23.605 -14.471 1.00 1.00 H new ATOM 0 HA LEU A 5 -3.418 25.125 -15.659 1.00 1.00 H new ATOM 0 HB2 LEU A 5 -5.113 25.208 -13.418 1.00 1.00 H new ATOM 0 HB3 LEU A 5 -3.506 25.041 -12.739 1.00 1.00 H new ATOM 0 HG LEU A 5 -4.317 27.379 -12.926 1.00 1.00 H new ATOM 0 HD11 LEU A 5 -2.239 28.318 -13.840 1.00 1.00 H new ATOM 0 HD12 LEU A 5 -1.935 26.923 -12.777 1.00 1.00 H new ATOM 0 HD13 LEU A 5 -1.842 26.733 -14.544 1.00 1.00 H new ATOM 0 HD21 LEU A 5 -4.296 28.465 -15.144 1.00 1.00 H new ATOM 0 HD22 LEU A 5 -4.011 26.882 -15.905 1.00 1.00 H new ATOM 0 HD23 LEU A 5 -5.534 27.191 -15.038 1.00 1.00 H new ATOM 83 N HIS A 6 -1.309 24.340 -14.165 1.00 1.00 N ATOM 84 CA HIS A 6 -0.069 23.655 -13.832 1.00 1.00 C ATOM 85 C HIS A 6 0.821 24.586 -13.041 1.00 1.00 C ATOM 86 O HIS A 6 1.537 25.391 -13.619 1.00 1.00 O ATOM 87 CB HIS A 6 0.654 23.208 -15.098 1.00 1.00 C ATOM 88 CG HIS A 6 1.436 21.938 -14.943 1.00 1.00 C ATOM 89 ND1 HIS A 6 2.151 21.367 -15.974 1.00 1.00 N ATOM 90 CD2 HIS A 6 1.616 21.128 -13.874 1.00 1.00 C ATOM 91 CE1 HIS A 6 2.736 20.268 -15.545 1.00 1.00 C ATOM 92 NE2 HIS A 6 2.428 20.095 -14.273 1.00 1.00 N ATOM 0 H HIS A 6 -1.248 25.358 -14.157 1.00 1.00 H new ATOM 0 HA HIS A 6 -0.303 22.773 -13.236 1.00 1.00 H new ATOM 0 HB2 HIS A 6 -0.079 23.075 -15.894 1.00 1.00 H new ATOM 0 HB3 HIS A 6 1.330 24.001 -15.416 1.00 1.00 H new ATOM 0 HD1 HIS A 6 2.217 21.738 -16.922 1.00 1.00 H new ATOM 0 HD2 HIS A 6 1.198 21.268 -12.888 1.00 1.00 H new ATOM 0 HE1 HIS A 6 3.363 19.617 -16.135 1.00 1.00 H new ATOM 101 N VAL A 7 0.671 24.567 -11.732 1.00 1.00 N ATOM 102 CA VAL A 7 1.476 25.424 -10.873 1.00 1.00 C ATOM 103 C VAL A 7 2.672 24.651 -10.354 1.00 1.00 C ATOM 104 O VAL A 7 2.524 23.756 -9.533 1.00 1.00 O ATOM 105 CB VAL A 7 0.679 25.964 -9.668 1.00 1.00 C ATOM 106 CG1 VAL A 7 1.325 27.205 -9.102 1.00 1.00 C ATOM 107 CG2 VAL A 7 -0.762 26.253 -10.030 1.00 1.00 C ATOM 0 H VAL A 7 0.005 23.973 -11.238 1.00 1.00 H new ATOM 0 HA VAL A 7 1.794 26.273 -11.478 1.00 1.00 H new ATOM 0 HB VAL A 7 0.688 25.183 -8.908 1.00 1.00 H new ATOM 0 HG11 VAL A 7 0.742 27.564 -8.254 1.00 1.00 H new ATOM 0 HG12 VAL A 7 2.337 26.971 -8.773 1.00 1.00 H new ATOM 0 HG13 VAL A 7 1.363 27.978 -9.870 1.00 1.00 H new ATOM 0 HG21 VAL A 7 -1.288 26.631 -9.154 1.00 1.00 H new ATOM 0 HG22 VAL A 7 -0.795 26.999 -10.824 1.00 1.00 H new ATOM 0 HG23 VAL A 7 -1.242 25.337 -10.374 1.00 1.00 H new ATOM 117 N THR A 8 3.846 24.961 -10.863 1.00 1.00 N ATOM 118 CA THR A 8 5.046 24.264 -10.442 1.00 1.00 C ATOM 119 C THR A 8 5.929 25.168 -9.576 1.00 1.00 C ATOM 120 O THR A 8 6.407 26.204 -10.025 1.00 1.00 O ATOM 121 CB THR A 8 5.835 23.721 -11.656 1.00 1.00 C ATOM 122 OG1 THR A 8 6.950 22.936 -11.212 1.00 1.00 O ATOM 123 CG2 THR A 8 6.338 24.834 -12.555 1.00 1.00 C ATOM 0 H THR A 8 3.996 25.686 -11.564 1.00 1.00 H new ATOM 0 HA THR A 8 4.739 23.411 -9.837 1.00 1.00 H new ATOM 0 HB THR A 8 5.147 23.103 -12.233 1.00 1.00 H new ATOM 0 HG1 THR A 8 7.727 23.120 -11.781 1.00 1.00 H new ATOM 0 HG21 THR A 8 6.886 24.405 -13.394 1.00 1.00 H new ATOM 0 HG22 THR A 8 5.492 25.409 -12.931 1.00 1.00 H new ATOM 0 HG23 THR A 8 6.998 25.490 -11.988 1.00 1.00 H new ATOM 131 N PHE A 9 6.095 24.803 -8.313 1.00 1.00 N ATOM 132 CA PHE A 9 6.896 25.607 -7.394 1.00 1.00 C ATOM 133 C PHE A 9 8.357 25.230 -7.505 1.00 1.00 C ATOM 134 O PHE A 9 8.704 24.050 -7.462 1.00 1.00 O ATOM 135 CB PHE A 9 6.437 25.426 -5.956 1.00 1.00 C ATOM 136 CG PHE A 9 5.014 25.000 -5.849 1.00 1.00 C ATOM 137 CD1 PHE A 9 3.985 25.849 -6.213 1.00 1.00 C ATOM 138 CD2 PHE A 9 4.710 23.733 -5.400 1.00 1.00 C ATOM 139 CE1 PHE A 9 2.676 25.435 -6.128 1.00 1.00 C ATOM 140 CE2 PHE A 9 3.407 23.313 -5.316 1.00 1.00 C ATOM 141 CZ PHE A 9 2.386 24.162 -5.679 1.00 1.00 C ATOM 0 H PHE A 9 5.690 23.962 -7.901 1.00 1.00 H new ATOM 0 HA PHE A 9 6.765 26.653 -7.671 1.00 1.00 H new ATOM 0 HB2 PHE A 9 7.070 24.684 -5.469 1.00 1.00 H new ATOM 0 HB3 PHE A 9 6.571 26.364 -5.417 1.00 1.00 H new ATOM 0 HD1 PHE A 9 4.211 26.844 -6.567 1.00 1.00 H new ATOM 0 HD2 PHE A 9 5.507 23.063 -5.111 1.00 1.00 H new ATOM 0 HE1 PHE A 9 1.877 26.104 -6.412 1.00 1.00 H new ATOM 0 HE2 PHE A 9 3.182 22.317 -4.965 1.00 1.00 H new ATOM 0 HZ PHE A 9 1.360 23.833 -5.613 1.00 1.00 H new ATOM 151 N VAL A 10 9.212 26.230 -7.569 1.00 1.00 N ATOM 152 CA VAL A 10 10.629 26.012 -7.764 1.00 1.00 C ATOM 153 C VAL A 10 11.455 26.575 -6.628 1.00 1.00 C ATOM 154 O VAL A 10 11.479 27.787 -6.389 1.00 1.00 O ATOM 155 CB VAL A 10 11.090 26.648 -9.083 1.00 1.00 C ATOM 156 CG1 VAL A 10 12.547 26.341 -9.356 1.00 1.00 C ATOM 157 CG2 VAL A 10 10.228 26.180 -10.235 1.00 1.00 C ATOM 0 H VAL A 10 8.945 27.211 -7.488 1.00 1.00 H new ATOM 0 HA VAL A 10 10.782 24.933 -7.794 1.00 1.00 H new ATOM 0 HB VAL A 10 10.982 27.728 -8.987 1.00 1.00 H new ATOM 0 HG11 VAL A 10 12.846 26.804 -10.296 1.00 1.00 H new ATOM 0 HG12 VAL A 10 13.160 26.736 -8.546 1.00 1.00 H new ATOM 0 HG13 VAL A 10 12.685 25.262 -9.423 1.00 1.00 H new ATOM 0 HG21 VAL A 10 10.573 26.643 -11.159 1.00 1.00 H new ATOM 0 HG22 VAL A 10 10.298 25.096 -10.325 1.00 1.00 H new ATOM 0 HG23 VAL A 10 9.191 26.463 -10.052 1.00 1.00 H new ATOM 167 N CYS A 11 12.188 25.693 -5.975 1.00 1.00 N ATOM 168 CA CYS A 11 13.073 26.093 -4.909 1.00 1.00 C ATOM 169 C CYS A 11 14.333 25.238 -4.948 1.00 1.00 C ATOM 170 O CYS A 11 14.389 24.242 -5.669 1.00 1.00 O ATOM 171 CB CYS A 11 12.372 25.960 -3.558 1.00 1.00 C ATOM 172 SG CYS A 11 12.168 24.259 -2.974 1.00 1.00 S ATOM 0 H CYS A 11 12.184 24.692 -6.169 1.00 1.00 H new ATOM 0 HA CYS A 11 13.350 27.139 -5.044 1.00 1.00 H new ATOM 0 HB2 CYS A 11 12.939 26.519 -2.814 1.00 1.00 H new ATOM 0 HB3 CYS A 11 11.389 26.426 -3.627 1.00 1.00 H new ATOM 0 HG CYS A 11 12.177 24.242 -1.674 1.00 1.00 H new ATOM 178 N THR A 12 15.349 25.635 -4.206 1.00 1.00 N ATOM 179 CA THR A 12 16.588 24.887 -4.163 1.00 1.00 C ATOM 180 C THR A 12 16.448 23.646 -3.288 1.00 1.00 C ATOM 181 O THR A 12 16.495 23.718 -2.061 1.00 1.00 O ATOM 182 CB THR A 12 17.733 25.778 -3.666 1.00 1.00 C ATOM 183 OG1 THR A 12 17.190 26.881 -2.920 1.00 1.00 O ATOM 184 CG2 THR A 12 18.552 26.297 -4.840 1.00 1.00 C ATOM 0 H THR A 12 15.339 26.473 -3.624 1.00 1.00 H new ATOM 0 HA THR A 12 16.822 24.556 -5.175 1.00 1.00 H new ATOM 0 HB THR A 12 18.387 25.190 -3.023 1.00 1.00 H new ATOM 0 HG1 THR A 12 17.920 27.451 -2.600 1.00 1.00 H new ATOM 0 HG21 THR A 12 19.360 26.927 -4.469 1.00 1.00 H new ATOM 0 HG22 THR A 12 18.972 25.455 -5.391 1.00 1.00 H new ATOM 0 HG23 THR A 12 17.911 26.880 -5.501 1.00 1.00 H new ATOM 192 N GLY A 13 16.118 22.537 -3.930 1.00 1.00 N ATOM 193 CA GLY A 13 15.983 21.285 -3.225 1.00 1.00 C ATOM 194 C GLY A 13 14.680 20.584 -3.534 1.00 1.00 C ATOM 195 O GLY A 13 14.647 19.359 -3.633 1.00 1.00 O ATOM 0 H GLY A 13 15.941 22.484 -4.933 1.00 1.00 H new ATOM 0 HA2 GLY A 13 16.815 20.632 -3.489 1.00 1.00 H new ATOM 0 HA3 GLY A 13 16.048 21.467 -2.152 1.00 1.00 H new ATOM 199 N ASN A 14 13.611 21.372 -3.691 1.00 1.00 N ATOM 200 CA ASN A 14 12.264 20.850 -3.977 1.00 1.00 C ATOM 201 C ASN A 14 11.751 20.011 -2.809 1.00 1.00 C ATOM 202 O ASN A 14 10.775 19.268 -2.920 1.00 1.00 O ATOM 203 CB ASN A 14 12.248 20.015 -5.263 1.00 1.00 C ATOM 204 CG ASN A 14 10.840 19.645 -5.685 1.00 1.00 C ATOM 205 OD1 ASN A 14 10.599 18.574 -6.221 1.00 1.00 O ATOM 206 ND2 ASN A 14 9.897 20.540 -5.454 1.00 1.00 N ATOM 0 H ASN A 14 13.652 22.389 -3.624 1.00 1.00 H new ATOM 0 HA ASN A 14 11.605 21.707 -4.117 1.00 1.00 H new ATOM 0 HB2 ASN A 14 12.731 20.575 -6.064 1.00 1.00 H new ATOM 0 HB3 ASN A 14 12.831 19.107 -5.112 1.00 1.00 H new ATOM 0 HD21 ASN A 14 8.933 20.347 -5.725 1.00 1.00 H new ATOM 0 HD22 ASN A 14 10.133 21.425 -5.004 1.00 1.00 H new ATOM 213 N ILE A 15 12.356 20.209 -1.664 1.00 1.00 N ATOM 214 CA ILE A 15 12.007 19.462 -0.484 1.00 1.00 C ATOM 215 C ILE A 15 11.921 20.401 0.705 1.00 1.00 C ATOM 216 O ILE A 15 12.639 20.249 1.682 1.00 1.00 O ATOM 217 CB ILE A 15 13.014 18.328 -0.204 1.00 1.00 C ATOM 218 CG1 ILE A 15 14.442 18.867 -0.129 1.00 1.00 C ATOM 219 CG2 ILE A 15 12.907 17.243 -1.263 1.00 1.00 C ATOM 220 CD1 ILE A 15 15.187 18.344 1.071 1.00 1.00 C ATOM 0 H ILE A 15 13.102 20.891 -1.525 1.00 1.00 H new ATOM 0 HA ILE A 15 11.036 18.996 -0.652 1.00 1.00 H new ATOM 0 HB ILE A 15 12.768 17.891 0.764 1.00 1.00 H new ATOM 0 HG12 ILE A 15 14.980 18.592 -1.036 1.00 1.00 H new ATOM 0 HG13 ILE A 15 14.416 19.956 -0.092 1.00 1.00 H new ATOM 0 HG21 ILE A 15 13.626 16.452 -1.048 1.00 1.00 H new ATOM 0 HG22 ILE A 15 11.899 16.828 -1.259 1.00 1.00 H new ATOM 0 HG23 ILE A 15 13.120 17.669 -2.243 1.00 1.00 H new ATOM 0 HD11 ILE A 15 16.196 18.755 1.080 1.00 1.00 H new ATOM 0 HD12 ILE A 15 14.666 18.641 1.981 1.00 1.00 H new ATOM 0 HD13 ILE A 15 15.239 17.256 1.021 1.00 1.00 H new ATOM 232 N CYS A 16 11.225 21.506 0.490 1.00 1.00 N ATOM 233 CA CYS A 16 10.966 22.458 1.553 1.00 1.00 C ATOM 234 C CYS A 16 9.735 23.321 1.258 1.00 1.00 C ATOM 235 O CYS A 16 8.608 22.891 1.475 1.00 1.00 O ATOM 236 CB CYS A 16 12.201 23.324 1.798 1.00 1.00 C ATOM 237 SG CYS A 16 12.974 23.967 0.287 1.00 1.00 S ATOM 0 H CYS A 16 10.829 21.764 -0.414 1.00 1.00 H new ATOM 0 HA CYS A 16 10.748 21.896 2.461 1.00 1.00 H new ATOM 0 HB2 CYS A 16 11.921 24.163 2.435 1.00 1.00 H new ATOM 0 HB3 CYS A 16 12.938 22.738 2.348 1.00 1.00 H new ATOM 0 HG CYS A 16 14.009 24.688 0.602 1.00 1.00 H new ATOM 243 N ARG A 17 9.939 24.448 0.585 1.00 1.00 N ATOM 244 CA ARG A 17 8.847 25.387 0.337 1.00 1.00 C ATOM 245 C ARG A 17 7.905 24.885 -0.746 1.00 1.00 C ATOM 246 O ARG A 17 6.684 24.977 -0.603 1.00 1.00 O ATOM 247 CB ARG A 17 9.386 26.770 -0.032 1.00 1.00 C ATOM 248 CG ARG A 17 10.130 27.454 1.102 1.00 1.00 C ATOM 249 CD ARG A 17 11.588 27.036 1.156 1.00 1.00 C ATOM 250 NE ARG A 17 12.147 27.166 2.497 1.00 1.00 N ATOM 251 CZ ARG A 17 13.431 27.393 2.749 1.00 1.00 C ATOM 252 NH1 ARG A 17 14.263 27.681 1.753 1.00 1.00 N ATOM 253 NH2 ARG A 17 13.872 27.373 4.002 1.00 1.00 N ATOM 0 H ARG A 17 10.841 24.734 0.204 1.00 1.00 H new ATOM 0 HA ARG A 17 8.279 25.468 1.264 1.00 1.00 H new ATOM 0 HB2 ARG A 17 10.054 26.674 -0.888 1.00 1.00 H new ATOM 0 HB3 ARG A 17 8.556 27.403 -0.345 1.00 1.00 H new ATOM 0 HG2 ARG A 17 10.067 28.535 0.978 1.00 1.00 H new ATOM 0 HG3 ARG A 17 9.648 27.213 2.050 1.00 1.00 H new ATOM 0 HD2 ARG A 17 11.681 26.002 0.824 1.00 1.00 H new ATOM 0 HD3 ARG A 17 12.166 27.647 0.462 1.00 1.00 H new ATOM 0 HE ARG A 17 11.512 27.077 3.290 1.00 1.00 H new ATOM 0 HH11 ARG A 17 13.915 27.728 0.795 1.00 1.00 H new ATOM 0 HH12 ARG A 17 15.249 27.855 1.947 1.00 1.00 H new ATOM 0 HH21 ARG A 17 13.225 27.184 4.767 1.00 1.00 H new ATOM 0 HH22 ARG A 17 14.858 27.547 4.199 1.00 1.00 H new ATOM 267 N SER A 18 8.472 24.348 -1.820 1.00 1.00 N ATOM 268 CA SER A 18 7.677 23.816 -2.918 1.00 1.00 C ATOM 269 C SER A 18 6.658 22.777 -2.424 1.00 1.00 C ATOM 270 O SER A 18 5.455 22.987 -2.574 1.00 1.00 O ATOM 271 CB SER A 18 8.589 23.217 -3.990 1.00 1.00 C ATOM 272 OG SER A 18 9.503 24.183 -4.477 1.00 1.00 O ATOM 0 H SER A 18 9.480 24.270 -1.953 1.00 1.00 H new ATOM 0 HA SER A 18 7.115 24.640 -3.357 1.00 1.00 H new ATOM 0 HB2 SER A 18 9.136 22.370 -3.575 1.00 1.00 H new ATOM 0 HB3 SER A 18 7.986 22.834 -4.813 1.00 1.00 H new ATOM 0 HG SER A 18 10.199 24.343 -3.806 1.00 1.00 H new ATOM 278 N PRO A 19 7.098 21.694 -1.735 1.00 1.00 N ATOM 279 CA PRO A 19 6.173 20.663 -1.254 1.00 1.00 C ATOM 280 C PRO A 19 5.232 21.185 -0.178 1.00 1.00 C ATOM 281 O PRO A 19 4.135 20.665 -0.026 1.00 1.00 O ATOM 282 CB PRO A 19 7.092 19.573 -0.698 1.00 1.00 C ATOM 283 CG PRO A 19 8.345 20.282 -0.340 1.00 1.00 C ATOM 284 CD PRO A 19 8.489 21.406 -1.328 1.00 1.00 C ATOM 0 HA PRO A 19 5.517 20.306 -2.048 1.00 1.00 H new ATOM 0 HB2 PRO A 19 6.649 19.088 0.172 1.00 1.00 H new ATOM 0 HB3 PRO A 19 7.275 18.794 -1.438 1.00 1.00 H new ATOM 0 HG2 PRO A 19 8.298 20.664 0.680 1.00 1.00 H new ATOM 0 HG3 PRO A 19 9.201 19.609 -0.389 1.00 1.00 H new ATOM 0 HD2 PRO A 19 8.963 22.278 -0.877 1.00 1.00 H new ATOM 0 HD3 PRO A 19 9.103 21.114 -2.180 1.00 1.00 H new ATOM 292 N MET A 20 5.629 22.237 0.529 1.00 1.00 N ATOM 293 CA MET A 20 4.762 22.820 1.545 1.00 1.00 C ATOM 294 C MET A 20 3.489 23.366 0.915 1.00 1.00 C ATOM 295 O MET A 20 2.391 22.912 1.228 1.00 1.00 O ATOM 296 CB MET A 20 5.466 23.941 2.303 1.00 1.00 C ATOM 297 CG MET A 20 6.460 23.464 3.349 1.00 1.00 C ATOM 298 SD MET A 20 6.916 24.745 4.525 1.00 1.00 S ATOM 299 CE MET A 20 5.343 25.021 5.325 1.00 1.00 C ATOM 0 H MET A 20 6.532 22.698 0.420 1.00 1.00 H new ATOM 0 HA MET A 20 4.510 22.026 2.248 1.00 1.00 H new ATOM 0 HB2 MET A 20 5.988 24.576 1.587 1.00 1.00 H new ATOM 0 HB3 MET A 20 4.714 24.562 2.790 1.00 1.00 H new ATOM 0 HG2 MET A 20 6.033 22.619 3.889 1.00 1.00 H new ATOM 0 HG3 MET A 20 7.358 23.102 2.849 1.00 1.00 H new ATOM 0 HE1 MET A 20 5.505 25.503 6.289 1.00 1.00 H new ATOM 0 HE2 MET A 20 4.724 25.662 4.698 1.00 1.00 H new ATOM 0 HE3 MET A 20 4.839 24.066 5.477 1.00 1.00 H new ATOM 309 N ALA A 21 3.647 24.264 -0.047 1.00 1.00 N ATOM 310 CA ALA A 21 2.489 24.871 -0.699 1.00 1.00 C ATOM 311 C ALA A 21 1.790 23.856 -1.572 1.00 1.00 C ATOM 312 O ALA A 21 0.572 23.903 -1.738 1.00 1.00 O ATOM 313 CB ALA A 21 2.883 26.079 -1.525 1.00 1.00 C ATOM 0 H ALA A 21 4.551 24.587 -0.392 1.00 1.00 H new ATOM 0 HA ALA A 21 1.808 25.207 0.083 1.00 1.00 H new ATOM 0 HB1 ALA A 21 1.996 26.504 -1.995 1.00 1.00 H new ATOM 0 HB2 ALA A 21 3.345 26.826 -0.880 1.00 1.00 H new ATOM 0 HB3 ALA A 21 3.592 25.777 -2.296 1.00 1.00 H new ATOM 319 N GLU A 22 2.573 22.904 -2.049 1.00 1.00 N ATOM 320 CA GLU A 22 2.084 21.825 -2.885 1.00 1.00 C ATOM 321 C GLU A 22 0.897 21.156 -2.212 1.00 1.00 C ATOM 322 O GLU A 22 -0.218 21.228 -2.688 1.00 1.00 O ATOM 323 CB GLU A 22 3.215 20.813 -3.073 1.00 1.00 C ATOM 324 CG GLU A 22 3.161 19.992 -4.345 1.00 1.00 C ATOM 325 CD GLU A 22 4.243 18.937 -4.348 1.00 1.00 C ATOM 326 OE1 GLU A 22 5.441 19.285 -4.360 1.00 1.00 O ATOM 327 OE2 GLU A 22 3.901 17.746 -4.380 1.00 1.00 O ATOM 0 H GLU A 22 3.575 22.859 -1.864 1.00 1.00 H new ATOM 0 HA GLU A 22 1.765 22.211 -3.853 1.00 1.00 H new ATOM 0 HB2 GLU A 22 4.164 21.349 -3.049 1.00 1.00 H new ATOM 0 HB3 GLU A 22 3.212 20.131 -2.223 1.00 1.00 H new ATOM 0 HG2 GLU A 22 2.184 19.518 -4.436 1.00 1.00 H new ATOM 0 HG3 GLU A 22 3.280 20.645 -5.210 1.00 1.00 H new ATOM 334 N LYS A 23 1.103 20.753 -0.979 1.00 1.00 N ATOM 335 CA LYS A 23 0.083 20.026 -0.253 1.00 1.00 C ATOM 336 C LYS A 23 -0.961 20.983 0.283 1.00 1.00 C ATOM 337 O LYS A 23 -2.134 20.652 0.336 1.00 1.00 O ATOM 338 CB LYS A 23 0.691 19.250 0.915 1.00 1.00 C ATOM 339 CG LYS A 23 2.121 18.784 0.683 1.00 1.00 C ATOM 340 CD LYS A 23 2.174 17.445 -0.010 1.00 1.00 C ATOM 341 CE LYS A 23 3.151 17.460 -1.164 1.00 1.00 C ATOM 342 NZ LYS A 23 2.552 16.852 -2.381 1.00 1.00 N ATOM 0 H LYS A 23 1.965 20.915 -0.458 1.00 1.00 H new ATOM 0 HA LYS A 23 -0.380 19.323 -0.945 1.00 1.00 H new ATOM 0 HB2 LYS A 23 0.666 19.879 1.805 1.00 1.00 H new ATOM 0 HB3 LYS A 23 0.067 18.380 1.122 1.00 1.00 H new ATOM 0 HG2 LYS A 23 2.650 19.524 0.083 1.00 1.00 H new ATOM 0 HG3 LYS A 23 2.640 18.718 1.639 1.00 1.00 H new ATOM 0 HD2 LYS A 23 2.464 16.675 0.705 1.00 1.00 H new ATOM 0 HD3 LYS A 23 1.181 17.183 -0.375 1.00 1.00 H new ATOM 0 HE2 LYS A 23 3.451 18.486 -1.377 1.00 1.00 H new ATOM 0 HE3 LYS A 23 4.053 16.914 -0.888 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 3.189 16.996 -3.190 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 2.413 15.833 -2.227 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 1.635 17.301 -2.578 1.00 1.00 H new ATOM 356 N MET A 24 -0.534 22.188 0.622 1.00 1.00 N ATOM 357 CA MET A 24 -1.410 23.165 1.241 1.00 1.00 C ATOM 358 C MET A 24 -2.589 23.564 0.353 1.00 1.00 C ATOM 359 O MET A 24 -3.718 23.091 0.539 1.00 1.00 O ATOM 360 CB MET A 24 -0.607 24.392 1.637 1.00 1.00 C ATOM 361 CG MET A 24 0.305 24.137 2.820 1.00 1.00 C ATOM 362 SD MET A 24 -0.246 24.978 4.314 1.00 1.00 S ATOM 363 CE MET A 24 0.288 26.652 3.971 1.00 1.00 C ATOM 0 H MET A 24 0.422 22.513 0.477 1.00 1.00 H new ATOM 0 HA MET A 24 -1.839 22.696 2.127 1.00 1.00 H new ATOM 0 HB2 MET A 24 -0.009 24.720 0.787 1.00 1.00 H new ATOM 0 HB3 MET A 24 -1.290 25.206 1.879 1.00 1.00 H new ATOM 0 HG2 MET A 24 0.357 23.065 3.009 1.00 1.00 H new ATOM 0 HG3 MET A 24 1.314 24.466 2.573 1.00 1.00 H new ATOM 0 HE1 MET A 24 0.522 27.158 4.907 1.00 1.00 H new ATOM 0 HE2 MET A 24 1.176 26.628 3.340 1.00 1.00 H new ATOM 0 HE3 MET A 24 -0.508 27.190 3.457 1.00 1.00 H new ATOM 373 N PHE A 25 -2.332 24.384 -0.655 1.00 1.00 N ATOM 374 CA PHE A 25 -3.419 24.890 -1.467 1.00 1.00 C ATOM 375 C PHE A 25 -3.892 23.854 -2.471 1.00 1.00 C ATOM 376 O PHE A 25 -5.058 23.886 -2.869 1.00 1.00 O ATOM 377 CB PHE A 25 -3.038 26.191 -2.180 1.00 1.00 C ATOM 378 CG PHE A 25 -2.232 26.011 -3.422 1.00 1.00 C ATOM 379 CD1 PHE A 25 -0.873 25.855 -3.341 1.00 1.00 C ATOM 380 CD2 PHE A 25 -2.836 25.999 -4.674 1.00 1.00 C ATOM 381 CE1 PHE A 25 -0.118 25.689 -4.473 1.00 1.00 C ATOM 382 CE2 PHE A 25 -2.082 25.833 -5.815 1.00 1.00 C ATOM 383 CZ PHE A 25 -0.720 25.677 -5.710 1.00 1.00 C ATOM 0 H PHE A 25 -1.402 24.705 -0.923 1.00 1.00 H new ATOM 0 HA PHE A 25 -4.244 25.109 -0.788 1.00 1.00 H new ATOM 0 HB2 PHE A 25 -3.950 26.732 -2.431 1.00 1.00 H new ATOM 0 HB3 PHE A 25 -2.477 26.818 -1.487 1.00 1.00 H new ATOM 0 HD1 PHE A 25 -0.391 25.863 -2.374 1.00 1.00 H new ATOM 0 HD2 PHE A 25 -3.906 26.121 -4.753 1.00 1.00 H new ATOM 0 HE1 PHE A 25 0.952 25.567 -4.394 1.00 1.00 H new ATOM 0 HE2 PHE A 25 -2.557 25.825 -6.785 1.00 1.00 H new ATOM 0 HZ PHE A 25 -0.122 25.545 -6.600 1.00 1.00 H new ATOM 393 N ALA A 26 -3.002 22.963 -2.919 1.00 1.00 N ATOM 394 CA ALA A 26 -3.431 21.951 -3.885 1.00 1.00 C ATOM 395 C ALA A 26 -4.466 21.031 -3.265 1.00 1.00 C ATOM 396 O ALA A 26 -5.410 20.605 -3.936 1.00 1.00 O ATOM 397 CB ALA A 26 -2.268 21.164 -4.436 1.00 1.00 C ATOM 0 H ALA A 26 -2.021 22.921 -2.642 1.00 1.00 H new ATOM 0 HA ALA A 26 -3.888 22.473 -4.726 1.00 1.00 H new ATOM 0 HB1 ALA A 26 -2.634 20.425 -5.149 1.00 1.00 H new ATOM 0 HB2 ALA A 26 -1.576 21.840 -4.938 1.00 1.00 H new ATOM 0 HB3 ALA A 26 -1.752 20.657 -3.620 1.00 1.00 H new ATOM 403 N GLN A 27 -4.295 20.729 -1.978 1.00 1.00 N ATOM 404 CA GLN A 27 -5.258 19.911 -1.272 1.00 1.00 C ATOM 405 C GLN A 27 -6.585 20.655 -1.224 1.00 1.00 C ATOM 406 O GLN A 27 -7.644 20.072 -1.455 1.00 1.00 O ATOM 407 CB GLN A 27 -4.746 19.553 0.119 1.00 1.00 C ATOM 408 CG GLN A 27 -5.151 20.504 1.226 1.00 1.00 C ATOM 409 CD GLN A 27 -6.277 19.944 2.058 1.00 1.00 C ATOM 410 OE1 GLN A 27 -7.445 20.280 1.876 1.00 1.00 O ATOM 411 NE2 GLN A 27 -5.925 19.008 2.908 1.00 1.00 N ATOM 0 H GLN A 27 -3.503 21.039 -1.415 1.00 1.00 H new ATOM 0 HA GLN A 27 -5.407 18.968 -1.797 1.00 1.00 H new ATOM 0 HB2 GLN A 27 -5.102 18.555 0.373 1.00 1.00 H new ATOM 0 HB3 GLN A 27 -3.658 19.504 0.085 1.00 1.00 H new ATOM 0 HG2 GLN A 27 -4.291 20.705 1.865 1.00 1.00 H new ATOM 0 HG3 GLN A 27 -5.457 21.457 0.794 1.00 1.00 H new ATOM 0 HE21 GLN A 27 -4.941 18.766 3.022 1.00 1.00 H new ATOM 0 HE22 GLN A 27 -6.636 18.522 3.455 1.00 1.00 H new ATOM 420 N GLN A 28 -6.504 21.971 -1.017 1.00 1.00 N ATOM 421 CA GLN A 28 -7.680 22.830 -1.022 1.00 1.00 C ATOM 422 C GLN A 28 -8.390 22.775 -2.374 1.00 1.00 C ATOM 423 O GLN A 28 -9.614 22.773 -2.444 1.00 1.00 O ATOM 424 CB GLN A 28 -7.275 24.266 -0.709 1.00 1.00 C ATOM 425 CG GLN A 28 -6.630 24.431 0.655 1.00 1.00 C ATOM 426 CD GLN A 28 -6.089 25.832 0.879 1.00 1.00 C ATOM 427 OE1 GLN A 28 -6.566 26.795 0.280 1.00 1.00 O ATOM 428 NE2 GLN A 28 -5.098 25.955 1.750 1.00 1.00 N ATOM 0 H GLN A 28 -5.628 22.463 -0.843 1.00 1.00 H new ATOM 0 HA GLN A 28 -8.369 22.472 -0.257 1.00 1.00 H new ATOM 0 HB2 GLN A 28 -6.581 24.614 -1.474 1.00 1.00 H new ATOM 0 HB3 GLN A 28 -8.157 24.904 -0.764 1.00 1.00 H new ATOM 0 HG2 GLN A 28 -7.362 24.200 1.429 1.00 1.00 H new ATOM 0 HG3 GLN A 28 -5.818 23.711 0.758 1.00 1.00 H new ATOM 0 HE21 GLN A 28 -4.731 25.130 2.225 1.00 1.00 H new ATOM 0 HE22 GLN A 28 -4.702 26.874 1.945 1.00 1.00 H new ATOM 437 N LEU A 29 -7.606 22.738 -3.449 1.00 1.00 N ATOM 438 CA LEU A 29 -8.156 22.683 -4.802 1.00 1.00 C ATOM 439 C LEU A 29 -9.016 21.439 -4.985 1.00 1.00 C ATOM 440 O LEU A 29 -10.185 21.532 -5.340 1.00 1.00 O ATOM 441 CB LEU A 29 -7.039 22.698 -5.846 1.00 1.00 C ATOM 442 CG LEU A 29 -6.124 23.919 -5.792 1.00 1.00 C ATOM 443 CD1 LEU A 29 -5.022 23.810 -6.832 1.00 1.00 C ATOM 444 CD2 LEU A 29 -6.928 25.197 -5.991 1.00 1.00 C ATOM 0 H LEU A 29 -6.587 22.745 -3.410 1.00 1.00 H new ATOM 0 HA LEU A 29 -8.779 23.566 -4.943 1.00 1.00 H new ATOM 0 HB2 LEU A 29 -6.432 21.802 -5.720 1.00 1.00 H new ATOM 0 HB3 LEU A 29 -7.488 22.642 -6.838 1.00 1.00 H new ATOM 0 HG LEU A 29 -5.659 23.956 -4.807 1.00 1.00 H new ATOM 0 HD11 LEU A 29 -4.381 24.690 -6.777 1.00 1.00 H new ATOM 0 HD12 LEU A 29 -4.428 22.916 -6.641 1.00 1.00 H new ATOM 0 HD13 LEU A 29 -5.465 23.745 -7.826 1.00 1.00 H new ATOM 0 HD21 LEU A 29 -6.260 26.057 -5.950 1.00 1.00 H new ATOM 0 HD22 LEU A 29 -7.423 25.168 -6.962 1.00 1.00 H new ATOM 0 HD23 LEU A 29 -7.678 25.282 -5.204 1.00 1.00 H new ATOM 456 N ARG A 30 -8.421 20.275 -4.810 1.00 1.00 N ATOM 457 CA ARG A 30 -9.178 19.033 -4.934 1.00 1.00 C ATOM 458 C ARG A 30 -10.334 18.990 -3.944 1.00 1.00 C ATOM 459 O ARG A 30 -11.419 18.525 -4.277 1.00 1.00 O ATOM 460 CB ARG A 30 -8.277 17.803 -4.806 1.00 1.00 C ATOM 461 CG ARG A 30 -7.328 17.825 -3.618 1.00 1.00 C ATOM 462 CD ARG A 30 -5.896 17.534 -4.049 1.00 1.00 C ATOM 463 NE ARG A 30 -5.759 16.231 -4.705 1.00 1.00 N ATOM 464 CZ ARG A 30 -5.526 16.063 -6.009 1.00 1.00 C ATOM 465 NH1 ARG A 30 -5.390 17.112 -6.811 1.00 1.00 N ATOM 466 NH2 ARG A 30 -5.417 14.843 -6.508 1.00 1.00 N ATOM 0 H ARG A 30 -7.433 20.157 -4.585 1.00 1.00 H new ATOM 0 HA ARG A 30 -9.604 19.010 -5.937 1.00 1.00 H new ATOM 0 HB2 ARG A 30 -8.906 16.916 -4.733 1.00 1.00 H new ATOM 0 HB3 ARG A 30 -7.690 17.704 -5.719 1.00 1.00 H new ATOM 0 HG2 ARG A 30 -7.373 18.799 -3.132 1.00 1.00 H new ATOM 0 HG3 ARG A 30 -7.646 17.087 -2.882 1.00 1.00 H new ATOM 0 HD2 ARG A 30 -5.559 18.316 -4.729 1.00 1.00 H new ATOM 0 HD3 ARG A 30 -5.244 17.568 -3.176 1.00 1.00 H new ATOM 0 HE ARG A 30 -5.848 15.396 -4.126 1.00 1.00 H new ATOM 0 HH11 ARG A 30 -5.463 18.056 -6.432 1.00 1.00 H new ATOM 0 HH12 ARG A 30 -5.212 16.974 -7.806 1.00 1.00 H new ATOM 0 HH21 ARG A 30 -5.511 14.032 -5.897 1.00 1.00 H new ATOM 0 HH22 ARG A 30 -5.239 14.713 -7.504 1.00 1.00 H new ATOM 480 N HIS A 31 -10.111 19.522 -2.752 1.00 1.00 N ATOM 481 CA HIS A 31 -11.155 19.586 -1.738 1.00 1.00 C ATOM 482 C HIS A 31 -12.316 20.494 -2.153 1.00 1.00 C ATOM 483 O HIS A 31 -13.439 20.310 -1.686 1.00 1.00 O ATOM 484 CB HIS A 31 -10.583 20.027 -0.393 1.00 1.00 C ATOM 485 CG HIS A 31 -10.107 18.876 0.443 1.00 1.00 C ATOM 486 ND1 HIS A 31 -10.677 18.539 1.650 1.00 1.00 N ATOM 487 CD2 HIS A 31 -9.127 17.968 0.227 1.00 1.00 C ATOM 488 CE1 HIS A 31 -10.068 17.473 2.138 1.00 1.00 C ATOM 489 NE2 HIS A 31 -9.123 17.103 1.292 1.00 1.00 N ATOM 0 H HIS A 31 -9.216 19.916 -2.462 1.00 1.00 H new ATOM 0 HA HIS A 31 -11.556 18.578 -1.634 1.00 1.00 H new ATOM 0 HB2 HIS A 31 -9.754 20.713 -0.564 1.00 1.00 H new ATOM 0 HB3 HIS A 31 -11.345 20.579 0.157 1.00 1.00 H new ATOM 0 HD2 HIS A 31 -8.468 17.931 -0.628 1.00 1.00 H new ATOM 0 HE1 HIS A 31 -10.303 16.985 3.072 1.00 1.00 H new ATOM 0 HE2 HIS A 31 -8.496 16.308 1.411 1.00 1.00 H new ATOM 498 N ARG A 32 -12.058 21.469 -3.029 1.00 1.00 N ATOM 499 CA ARG A 32 -13.137 22.351 -3.459 1.00 1.00 C ATOM 500 C ARG A 32 -13.760 21.805 -4.736 1.00 1.00 C ATOM 501 O ARG A 32 -14.883 22.154 -5.106 1.00 1.00 O ATOM 502 CB ARG A 32 -12.665 23.802 -3.627 1.00 1.00 C ATOM 503 CG ARG A 32 -11.600 24.014 -4.678 1.00 1.00 C ATOM 504 CD ARG A 32 -10.926 25.371 -4.528 1.00 1.00 C ATOM 505 NE ARG A 32 -11.883 26.483 -4.567 1.00 1.00 N ATOM 506 CZ ARG A 32 -11.658 27.649 -5.184 1.00 1.00 C ATOM 507 NH1 ARG A 32 -10.538 27.834 -5.878 1.00 1.00 N ATOM 508 NH2 ARG A 32 -12.567 28.617 -5.125 1.00 1.00 N ATOM 0 H ARG A 32 -11.144 21.661 -3.440 1.00 1.00 H new ATOM 0 HA ARG A 32 -13.898 22.373 -2.679 1.00 1.00 H new ATOM 0 HB2 ARG A 32 -13.527 24.421 -3.876 1.00 1.00 H new ATOM 0 HB3 ARG A 32 -12.284 24.156 -2.669 1.00 1.00 H new ATOM 0 HG2 ARG A 32 -10.852 23.225 -4.603 1.00 1.00 H new ATOM 0 HG3 ARG A 32 -12.046 23.936 -5.670 1.00 1.00 H new ATOM 0 HD2 ARG A 32 -10.380 25.399 -3.585 1.00 1.00 H new ATOM 0 HD3 ARG A 32 -10.193 25.499 -5.325 1.00 1.00 H new ATOM 0 HE ARG A 32 -12.778 26.359 -4.093 1.00 1.00 H new ATOM 0 HH11 ARG A 32 -9.848 27.086 -5.941 1.00 1.00 H new ATOM 0 HH12 ARG A 32 -10.370 28.724 -6.347 1.00 1.00 H new ATOM 0 HH21 ARG A 32 -13.435 28.471 -4.610 1.00 1.00 H new ATOM 0 HH22 ARG A 32 -12.396 29.506 -5.595 1.00 1.00 H new ATOM 522 N GLY A 33 -13.004 20.947 -5.404 1.00 1.00 N ATOM 523 CA GLY A 33 -13.491 20.302 -6.602 1.00 1.00 C ATOM 524 C GLY A 33 -12.781 20.796 -7.835 1.00 1.00 C ATOM 525 O GLY A 33 -13.367 20.857 -8.915 1.00 1.00 O ATOM 0 H GLY A 33 -12.056 20.686 -5.134 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -13.357 19.224 -6.514 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -14.561 20.483 -6.702 1.00 1.00 H new ATOM 529 N LEU A 34 -11.494 21.098 -7.701 1.00 1.00 N ATOM 530 CA LEU A 34 -10.721 21.637 -8.808 1.00 1.00 C ATOM 531 C LEU A 34 -9.374 20.937 -8.925 1.00 1.00 C ATOM 532 O LEU A 34 -8.538 21.323 -9.732 1.00 1.00 O ATOM 533 CB LEU A 34 -10.494 23.124 -8.569 1.00 1.00 C ATOM 534 CG LEU A 34 -11.764 23.935 -8.351 1.00 1.00 C ATOM 535 CD1 LEU A 34 -11.408 25.328 -7.890 1.00 1.00 C ATOM 536 CD2 LEU A 34 -12.599 23.971 -9.621 1.00 1.00 C ATOM 0 H LEU A 34 -10.967 20.978 -6.836 1.00 1.00 H new ATOM 0 HA LEU A 34 -11.273 21.477 -9.734 1.00 1.00 H new ATOM 0 HB2 LEU A 34 -9.849 23.244 -7.699 1.00 1.00 H new ATOM 0 HB3 LEU A 34 -9.957 23.537 -9.423 1.00 1.00 H new ATOM 0 HG LEU A 34 -12.364 23.459 -7.576 1.00 1.00 H new ATOM 0 HD11 LEU A 34 -12.320 25.904 -7.735 1.00 1.00 H new ATOM 0 HD12 LEU A 34 -10.852 25.271 -6.954 1.00 1.00 H new ATOM 0 HD13 LEU A 34 -10.794 25.816 -8.647 1.00 1.00 H new ATOM 0 HD21 LEU A 34 -13.503 24.555 -9.446 1.00 1.00 H new ATOM 0 HD22 LEU A 34 -12.021 24.429 -10.424 1.00 1.00 H new ATOM 0 HD23 LEU A 34 -12.873 22.955 -9.905 1.00 1.00 H new ATOM 548 N GLY A 35 -9.176 19.902 -8.113 1.00 1.00 N ATOM 549 CA GLY A 35 -7.917 19.171 -8.117 1.00 1.00 C ATOM 550 C GLY A 35 -7.533 18.655 -9.489 1.00 1.00 C ATOM 551 O GLY A 35 -6.351 18.499 -9.791 1.00 1.00 O ATOM 0 H GLY A 35 -9.868 19.554 -7.449 1.00 1.00 H new ATOM 0 HA2 GLY A 35 -7.125 19.821 -7.745 1.00 1.00 H new ATOM 0 HA3 GLY A 35 -7.990 18.331 -7.427 1.00 1.00 H new ATOM 555 N ASP A 36 -8.531 18.370 -10.308 1.00 1.00 N ATOM 556 CA ASP A 36 -8.292 17.907 -11.665 1.00 1.00 C ATOM 557 C ASP A 36 -8.329 19.065 -12.650 1.00 1.00 C ATOM 558 O ASP A 36 -7.773 18.976 -13.742 1.00 1.00 O ATOM 559 CB ASP A 36 -9.329 16.866 -12.071 1.00 1.00 C ATOM 560 CG ASP A 36 -9.065 15.514 -11.449 1.00 1.00 C ATOM 561 OD1 ASP A 36 -8.259 14.744 -12.008 1.00 1.00 O ATOM 562 OD2 ASP A 36 -9.670 15.207 -10.398 1.00 1.00 O ATOM 0 H ASP A 36 -9.516 18.451 -10.057 1.00 1.00 H new ATOM 0 HA ASP A 36 -7.301 17.454 -11.687 1.00 1.00 H new ATOM 0 HB2 ASP A 36 -10.320 17.211 -11.776 1.00 1.00 H new ATOM 0 HB3 ASP A 36 -9.335 16.768 -13.157 1.00 1.00 H new ATOM 567 N ALA A 37 -8.969 20.158 -12.244 1.00 1.00 N ATOM 568 CA ALA A 37 -9.108 21.338 -13.092 1.00 1.00 C ATOM 569 C ALA A 37 -7.831 22.178 -13.090 1.00 1.00 C ATOM 570 O ALA A 37 -7.579 22.963 -14.004 1.00 1.00 O ATOM 571 CB ALA A 37 -10.297 22.166 -12.634 1.00 1.00 C ATOM 0 H ALA A 37 -9.403 20.251 -11.325 1.00 1.00 H new ATOM 0 HA ALA A 37 -9.280 21.006 -14.116 1.00 1.00 H new ATOM 0 HB1 ALA A 37 -10.395 23.045 -13.271 1.00 1.00 H new ATOM 0 HB2 ALA A 37 -11.205 21.567 -12.700 1.00 1.00 H new ATOM 0 HB3 ALA A 37 -10.145 22.481 -11.602 1.00 1.00 H new ATOM 577 N VAL A 38 -7.039 22.029 -12.041 1.00 1.00 N ATOM 578 CA VAL A 38 -5.771 22.727 -11.917 1.00 1.00 C ATOM 579 C VAL A 38 -4.751 21.813 -11.270 1.00 1.00 C ATOM 580 O VAL A 38 -4.955 21.313 -10.163 1.00 1.00 O ATOM 581 CB VAL A 38 -5.904 24.044 -11.109 1.00 1.00 C ATOM 582 CG1 VAL A 38 -6.927 23.904 -10.001 1.00 1.00 C ATOM 583 CG2 VAL A 38 -4.567 24.481 -10.528 1.00 1.00 C ATOM 0 H VAL A 38 -7.257 21.421 -11.252 1.00 1.00 H new ATOM 0 HA VAL A 38 -5.440 23.000 -12.919 1.00 1.00 H new ATOM 0 HB VAL A 38 -6.243 24.812 -11.804 1.00 1.00 H new ATOM 0 HG11 VAL A 38 -6.999 24.843 -9.451 1.00 1.00 H new ATOM 0 HG12 VAL A 38 -7.898 23.660 -10.431 1.00 1.00 H new ATOM 0 HG13 VAL A 38 -6.621 23.108 -9.322 1.00 1.00 H new ATOM 0 HG21 VAL A 38 -4.699 25.407 -9.968 1.00 1.00 H new ATOM 0 HG22 VAL A 38 -4.189 23.705 -9.862 1.00 1.00 H new ATOM 0 HG23 VAL A 38 -3.855 24.644 -11.337 1.00 1.00 H new ATOM 593 N ARG A 39 -3.681 21.546 -11.997 1.00 1.00 N ATOM 594 CA ARG A 39 -2.645 20.667 -11.516 1.00 1.00 C ATOM 595 C ARG A 39 -1.596 21.481 -10.789 1.00 1.00 C ATOM 596 O ARG A 39 -1.322 22.629 -11.153 1.00 1.00 O ATOM 597 CB ARG A 39 -1.998 19.907 -12.678 1.00 1.00 C ATOM 598 CG ARG A 39 -3.001 19.262 -13.631 1.00 1.00 C ATOM 599 CD ARG A 39 -4.008 18.411 -12.878 1.00 1.00 C ATOM 600 NE ARG A 39 -4.935 17.711 -13.771 1.00 1.00 N ATOM 601 CZ ARG A 39 -4.811 16.431 -14.129 1.00 1.00 C ATOM 602 NH1 ARG A 39 -3.793 15.704 -13.682 1.00 1.00 N ATOM 603 NH2 ARG A 39 -5.714 15.879 -14.937 1.00 1.00 N ATOM 0 H ARG A 39 -3.512 21.930 -12.927 1.00 1.00 H new ATOM 0 HA ARG A 39 -3.087 19.941 -10.834 1.00 1.00 H new ATOM 0 HB2 ARG A 39 -1.366 20.594 -13.241 1.00 1.00 H new ATOM 0 HB3 ARG A 39 -1.346 19.133 -12.274 1.00 1.00 H new ATOM 0 HG2 ARG A 39 -3.524 20.037 -14.192 1.00 1.00 H new ATOM 0 HG3 ARG A 39 -2.471 18.645 -14.357 1.00 1.00 H new ATOM 0 HD2 ARG A 39 -3.477 17.681 -12.268 1.00 1.00 H new ATOM 0 HD3 ARG A 39 -4.575 19.044 -12.196 1.00 1.00 H new ATOM 0 HE ARG A 39 -5.726 18.236 -14.143 1.00 1.00 H new ATOM 0 HH11 ARG A 39 -3.100 16.123 -13.062 1.00 1.00 H new ATOM 0 HH12 ARG A 39 -3.704 14.726 -13.959 1.00 1.00 H new ATOM 0 HH21 ARG A 39 -6.498 16.434 -15.281 1.00 1.00 H new ATOM 0 HH22 ARG A 39 -5.622 14.901 -15.212 1.00 1.00 H new ATOM 617 N VAL A 40 -0.978 20.885 -9.793 1.00 1.00 N ATOM 618 CA VAL A 40 0.054 21.552 -9.047 1.00 1.00 C ATOM 619 C VAL A 40 1.250 20.616 -8.939 1.00 1.00 C ATOM 620 O VAL A 40 1.089 19.400 -8.807 1.00 1.00 O ATOM 621 CB VAL A 40 -0.442 22.015 -7.654 1.00 1.00 C ATOM 622 CG1 VAL A 40 -1.947 21.873 -7.535 1.00 1.00 C ATOM 623 CG2 VAL A 40 0.278 21.307 -6.519 1.00 1.00 C ATOM 0 H VAL A 40 -1.177 19.934 -9.483 1.00 1.00 H new ATOM 0 HA VAL A 40 0.348 22.461 -9.572 1.00 1.00 H new ATOM 0 HB VAL A 40 -0.197 23.073 -7.563 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -2.267 22.205 -6.547 1.00 1.00 H new ATOM 0 HG12 VAL A 40 -2.431 22.483 -8.298 1.00 1.00 H new ATOM 0 HG13 VAL A 40 -2.226 20.829 -7.674 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -0.106 21.667 -5.564 1.00 1.00 H new ATOM 0 HG22 VAL A 40 0.111 20.233 -6.596 1.00 1.00 H new ATOM 0 HG23 VAL A 40 1.347 21.513 -6.581 1.00 1.00 H new ATOM 633 N THR A 41 2.423 21.187 -9.079 1.00 1.00 N ATOM 634 CA THR A 41 3.653 20.427 -9.101 1.00 1.00 C ATOM 635 C THR A 41 4.766 21.233 -8.463 1.00 1.00 C ATOM 636 O THR A 41 4.557 22.378 -8.066 1.00 1.00 O ATOM 637 CB THR A 41 4.049 20.068 -10.551 1.00 1.00 C ATOM 638 OG1 THR A 41 3.986 21.239 -11.372 1.00 1.00 O ATOM 639 CG2 THR A 41 3.135 19.001 -11.131 1.00 1.00 C ATOM 0 H THR A 41 2.553 22.194 -9.181 1.00 1.00 H new ATOM 0 HA THR A 41 3.496 19.505 -8.540 1.00 1.00 H new ATOM 0 HB THR A 41 5.066 19.675 -10.532 1.00 1.00 H new ATOM 0 HG1 THR A 41 4.239 21.009 -12.290 1.00 1.00 H new ATOM 0 HG21 THR A 41 3.443 18.774 -12.152 1.00 1.00 H new ATOM 0 HG22 THR A 41 3.198 18.098 -10.523 1.00 1.00 H new ATOM 0 HG23 THR A 41 2.108 19.365 -11.135 1.00 1.00 H new ATOM 647 N SER A 42 5.958 20.688 -8.453 1.00 1.00 N ATOM 648 CA SER A 42 7.081 21.391 -7.889 1.00 1.00 C ATOM 649 C SER A 42 8.375 20.820 -8.432 1.00 1.00 C ATOM 650 O SER A 42 8.379 19.754 -9.060 1.00 1.00 O ATOM 651 CB SER A 42 7.050 21.297 -6.370 1.00 1.00 C ATOM 652 OG SER A 42 7.224 19.963 -5.939 1.00 1.00 O ATOM 0 H SER A 42 6.174 19.764 -8.827 1.00 1.00 H new ATOM 0 HA SER A 42 7.020 22.442 -8.170 1.00 1.00 H new ATOM 0 HB2 SER A 42 7.835 21.924 -5.948 1.00 1.00 H new ATOM 0 HB3 SER A 42 6.100 21.682 -5.998 1.00 1.00 H new ATOM 0 HG SER A 42 6.851 19.859 -5.039 1.00 1.00 H new ATOM 658 N ALA A 43 9.457 21.566 -8.264 1.00 1.00 N ATOM 659 CA ALA A 43 10.750 21.137 -8.754 1.00 1.00 C ATOM 660 C ALA A 43 11.872 21.941 -8.128 1.00 1.00 C ATOM 661 O ALA A 43 11.650 22.991 -7.521 1.00 1.00 O ATOM 662 CB ALA A 43 10.803 21.283 -10.263 1.00 1.00 C ATOM 0 H ALA A 43 9.461 22.470 -7.792 1.00 1.00 H new ATOM 0 HA ALA A 43 10.884 20.091 -8.478 1.00 1.00 H new ATOM 0 HB1 ALA A 43 11.778 20.959 -10.626 1.00 1.00 H new ATOM 0 HB2 ALA A 43 10.025 20.669 -10.716 1.00 1.00 H new ATOM 0 HB3 ALA A 43 10.644 22.327 -10.533 1.00 1.00 H new ATOM 668 N GLY A 44 13.076 21.427 -8.271 1.00 1.00 N ATOM 669 CA GLY A 44 14.243 22.110 -7.780 1.00 1.00 C ATOM 670 C GLY A 44 15.219 22.359 -8.904 1.00 1.00 C ATOM 671 O GLY A 44 15.527 21.445 -9.669 1.00 1.00 O ATOM 0 H GLY A 44 13.267 20.534 -8.726 1.00 1.00 H new ATOM 0 HA2 GLY A 44 13.953 23.057 -7.325 1.00 1.00 H new ATOM 0 HA3 GLY A 44 14.720 21.515 -7.001 1.00 1.00 H new ATOM 675 N THR A 45 15.683 23.592 -9.026 1.00 1.00 N ATOM 676 CA THR A 45 16.583 23.973 -10.105 1.00 1.00 C ATOM 677 C THR A 45 17.933 23.257 -10.001 1.00 1.00 C ATOM 678 O THR A 45 18.597 23.025 -11.010 1.00 1.00 O ATOM 679 CB THR A 45 16.801 25.500 -10.101 1.00 1.00 C ATOM 680 OG1 THR A 45 17.102 25.941 -8.767 1.00 1.00 O ATOM 681 CG2 THR A 45 15.563 26.225 -10.604 1.00 1.00 C ATOM 0 H THR A 45 15.450 24.352 -8.387 1.00 1.00 H new ATOM 0 HA THR A 45 16.116 23.672 -11.043 1.00 1.00 H new ATOM 0 HB THR A 45 17.634 25.730 -10.765 1.00 1.00 H new ATOM 0 HG1 THR A 45 17.545 26.814 -8.803 1.00 1.00 H new ATOM 0 HG21 THR A 45 15.741 27.300 -10.592 1.00 1.00 H new ATOM 0 HG22 THR A 45 15.343 25.905 -11.622 1.00 1.00 H new ATOM 0 HG23 THR A 45 14.716 25.990 -9.959 1.00 1.00 H new ATOM 689 N GLY A 46 18.292 22.833 -8.790 1.00 1.00 N ATOM 690 CA GLY A 46 19.577 22.186 -8.578 1.00 1.00 C ATOM 691 C GLY A 46 19.465 20.692 -8.329 1.00 1.00 C ATOM 692 O GLY A 46 20.446 20.059 -7.938 1.00 1.00 O ATOM 0 H GLY A 46 17.716 22.926 -7.953 1.00 1.00 H new ATOM 0 HA2 GLY A 46 20.209 22.355 -9.450 1.00 1.00 H new ATOM 0 HA3 GLY A 46 20.075 22.652 -7.728 1.00 1.00 H new ATOM 696 N ASN A 47 18.254 20.147 -8.517 1.00 1.00 N ATOM 697 CA ASN A 47 17.965 18.704 -8.342 1.00 1.00 C ATOM 698 C ASN A 47 18.622 18.106 -7.089 1.00 1.00 C ATOM 699 O ASN A 47 19.002 16.936 -7.087 1.00 1.00 O ATOM 700 CB ASN A 47 18.367 17.897 -9.595 1.00 1.00 C ATOM 701 CG ASN A 47 19.858 17.921 -9.915 1.00 1.00 C ATOM 702 OD1 ASN A 47 20.330 18.782 -10.656 1.00 1.00 O ATOM 703 ND2 ASN A 47 20.604 16.972 -9.369 1.00 1.00 N ATOM 0 H ASN A 47 17.439 20.693 -8.796 1.00 1.00 H new ATOM 0 HA ASN A 47 16.887 18.629 -8.203 1.00 1.00 H new ATOM 0 HB2 ASN A 47 18.055 16.862 -9.460 1.00 1.00 H new ATOM 0 HB3 ASN A 47 17.818 18.286 -10.453 1.00 1.00 H new ATOM 0 HD21 ASN A 47 21.606 16.939 -9.558 1.00 1.00 H new ATOM 0 HD22 ASN A 47 20.177 16.275 -8.759 1.00 1.00 H new ATOM 710 N TRP A 48 18.651 18.886 -6.010 1.00 1.00 N ATOM 711 CA TRP A 48 19.250 18.463 -4.743 1.00 1.00 C ATOM 712 C TRP A 48 18.768 17.086 -4.300 1.00 1.00 C ATOM 713 O TRP A 48 19.489 16.097 -4.410 1.00 1.00 O ATOM 714 CB TRP A 48 18.926 19.483 -3.650 1.00 1.00 C ATOM 715 CG TRP A 48 20.105 20.280 -3.210 1.00 1.00 C ATOM 716 CD1 TRP A 48 20.866 20.071 -2.095 1.00 1.00 C ATOM 717 CD2 TRP A 48 20.655 21.423 -3.868 1.00 1.00 C ATOM 718 NE1 TRP A 48 21.868 21.008 -2.031 1.00 1.00 N ATOM 719 CE2 TRP A 48 21.759 21.850 -3.108 1.00 1.00 C ATOM 720 CE3 TRP A 48 20.324 22.119 -5.031 1.00 1.00 C ATOM 721 CZ2 TRP A 48 22.532 22.946 -3.473 1.00 1.00 C ATOM 722 CZ3 TRP A 48 21.091 23.208 -5.393 1.00 1.00 C ATOM 723 CH2 TRP A 48 22.186 23.611 -4.619 1.00 1.00 C ATOM 0 H TRP A 48 18.261 19.828 -5.988 1.00 1.00 H new ATOM 0 HA TRP A 48 20.326 18.403 -4.903 1.00 1.00 H new ATOM 0 HB2 TRP A 48 18.155 20.162 -4.015 1.00 1.00 H new ATOM 0 HB3 TRP A 48 18.509 18.960 -2.789 1.00 1.00 H new ATOM 0 HD1 TRP A 48 20.704 19.286 -1.371 1.00 1.00 H new ATOM 0 HE1 TRP A 48 22.578 21.068 -1.301 1.00 1.00 H new ATOM 0 HE3 TRP A 48 19.484 21.812 -5.636 1.00 1.00 H new ATOM 0 HZ2 TRP A 48 23.374 23.261 -2.875 1.00 1.00 H new ATOM 0 HZ3 TRP A 48 20.842 23.758 -6.288 1.00 1.00 H new ATOM 0 HH2 TRP A 48 22.770 24.464 -4.932 1.00 1.00 H new ATOM 734 N HIS A 49 17.556 17.040 -3.780 1.00 1.00 N ATOM 735 CA HIS A 49 16.996 15.792 -3.288 1.00 1.00 C ATOM 736 C HIS A 49 15.976 15.231 -4.257 1.00 1.00 C ATOM 737 O HIS A 49 14.970 14.668 -3.840 1.00 1.00 O ATOM 738 CB HIS A 49 16.368 15.977 -1.906 1.00 1.00 C ATOM 739 CG HIS A 49 17.370 16.001 -0.797 1.00 1.00 C ATOM 740 ND1 HIS A 49 17.612 14.921 0.021 1.00 1.00 N ATOM 741 CD2 HIS A 49 18.191 16.985 -0.366 1.00 1.00 C ATOM 742 CE1 HIS A 49 18.534 15.240 0.907 1.00 1.00 C ATOM 743 NE2 HIS A 49 18.905 16.487 0.694 1.00 1.00 N ATOM 0 H HIS A 49 16.941 17.848 -3.687 1.00 1.00 H new ATOM 0 HA HIS A 49 17.815 15.078 -3.201 1.00 1.00 H new ATOM 0 HB2 HIS A 49 15.802 16.908 -1.894 1.00 1.00 H new ATOM 0 HB3 HIS A 49 15.658 15.170 -1.727 1.00 1.00 H new ATOM 0 HD2 HIS A 49 18.270 17.979 -0.780 1.00 1.00 H new ATOM 0 HE1 HIS A 49 18.920 14.590 1.678 1.00 1.00 H new ATOM 0 HE2 HIS A 49 19.607 16.997 1.229 1.00 1.00 H new ATOM 752 N VAL A 50 16.263 15.336 -5.546 1.00 1.00 N ATOM 753 CA VAL A 50 15.362 14.807 -6.561 1.00 1.00 C ATOM 754 C VAL A 50 15.165 13.298 -6.365 1.00 1.00 C ATOM 755 O VAL A 50 16.131 12.544 -6.222 1.00 1.00 O ATOM 756 CB VAL A 50 15.873 15.118 -7.986 1.00 1.00 C ATOM 757 CG1 VAL A 50 17.228 14.478 -8.241 1.00 1.00 C ATOM 758 CG2 VAL A 50 14.868 14.676 -9.033 1.00 1.00 C ATOM 0 H VAL A 50 17.106 15.779 -5.913 1.00 1.00 H new ATOM 0 HA VAL A 50 14.397 15.300 -6.446 1.00 1.00 H new ATOM 0 HB VAL A 50 15.993 16.199 -8.062 1.00 1.00 H new ATOM 0 HG11 VAL A 50 17.558 14.716 -9.252 1.00 1.00 H new ATOM 0 HG12 VAL A 50 17.953 14.861 -7.523 1.00 1.00 H new ATOM 0 HG13 VAL A 50 17.146 13.397 -8.132 1.00 1.00 H new ATOM 0 HG21 VAL A 50 15.252 14.907 -10.027 1.00 1.00 H new ATOM 0 HG22 VAL A 50 14.703 13.602 -8.948 1.00 1.00 H new ATOM 0 HG23 VAL A 50 13.926 15.202 -8.878 1.00 1.00 H new ATOM 768 N GLY A 51 13.909 12.881 -6.273 1.00 1.00 N ATOM 769 CA GLY A 51 13.601 11.487 -6.031 1.00 1.00 C ATOM 770 C GLY A 51 13.307 11.218 -4.571 1.00 1.00 C ATOM 771 O GLY A 51 12.776 10.165 -4.224 1.00 1.00 O ATOM 0 H GLY A 51 13.094 13.488 -6.362 1.00 1.00 H new ATOM 0 HA2 GLY A 51 12.741 11.195 -6.634 1.00 1.00 H new ATOM 0 HA3 GLY A 51 14.440 10.869 -6.352 1.00 1.00 H new ATOM 775 N SER A 52 13.660 12.168 -3.715 1.00 1.00 N ATOM 776 CA SER A 52 13.423 12.033 -2.283 1.00 1.00 C ATOM 777 C SER A 52 11.978 12.407 -1.951 1.00 1.00 C ATOM 778 O SER A 52 11.135 12.544 -2.840 1.00 1.00 O ATOM 779 CB SER A 52 14.383 12.916 -1.490 1.00 1.00 C ATOM 780 OG SER A 52 14.527 12.462 -0.151 1.00 1.00 O ATOM 0 H SER A 52 14.112 13.041 -3.987 1.00 1.00 H new ATOM 0 HA SER A 52 13.597 10.994 -2.004 1.00 1.00 H new ATOM 0 HB2 SER A 52 15.357 12.925 -1.978 1.00 1.00 H new ATOM 0 HB3 SER A 52 14.017 13.943 -1.489 1.00 1.00 H new ATOM 0 HG SER A 52 15.149 13.048 0.328 1.00 1.00 H new ATOM 786 N CYS A 53 11.735 12.686 -0.685 1.00 1.00 N ATOM 787 CA CYS A 53 10.414 13.043 -0.213 1.00 1.00 C ATOM 788 C CYS A 53 10.463 14.424 0.419 1.00 1.00 C ATOM 789 O CYS A 53 11.518 15.056 0.436 1.00 1.00 O ATOM 790 CB CYS A 53 9.944 11.992 0.790 1.00 1.00 C ATOM 791 SG CYS A 53 8.205 12.117 1.277 1.00 1.00 S ATOM 0 H CYS A 53 12.448 12.671 0.044 1.00 1.00 H new ATOM 0 HA CYS A 53 9.707 13.072 -1.042 1.00 1.00 H new ATOM 0 HB2 CYS A 53 10.115 11.004 0.364 1.00 1.00 H new ATOM 0 HB3 CYS A 53 10.562 12.065 1.685 1.00 1.00 H new ATOM 0 HG CYS A 53 7.483 12.412 0.237 1.00 1.00 H new ATOM 797 N ALA A 54 9.320 14.914 0.879 1.00 1.00 N ATOM 798 CA ALA A 54 9.261 16.228 1.503 1.00 1.00 C ATOM 799 C ALA A 54 10.020 16.226 2.823 1.00 1.00 C ATOM 800 O ALA A 54 10.090 15.211 3.518 1.00 1.00 O ATOM 801 CB ALA A 54 7.821 16.680 1.692 1.00 1.00 C ATOM 0 H ALA A 54 8.426 14.425 0.832 1.00 1.00 H new ATOM 0 HA ALA A 54 9.743 16.945 0.838 1.00 1.00 H new ATOM 0 HB1 ALA A 54 7.807 17.664 2.160 1.00 1.00 H new ATOM 0 HB2 ALA A 54 7.326 16.732 0.722 1.00 1.00 H new ATOM 0 HB3 ALA A 54 7.297 15.968 2.329 1.00 1.00 H new ATOM 807 N ASP A 55 10.612 17.364 3.124 1.00 1.00 N ATOM 808 CA ASP A 55 11.457 17.541 4.292 1.00 1.00 C ATOM 809 C ASP A 55 10.715 17.386 5.608 1.00 1.00 C ATOM 810 O ASP A 55 9.517 17.638 5.716 1.00 1.00 O ATOM 811 CB ASP A 55 12.080 18.925 4.240 1.00 1.00 C ATOM 812 CG ASP A 55 11.031 20.010 4.203 1.00 1.00 C ATOM 813 OD1 ASP A 55 10.324 20.111 3.190 1.00 1.00 O ATOM 814 OD2 ASP A 55 10.929 20.771 5.187 1.00 1.00 O ATOM 0 H ASP A 55 10.519 18.206 2.556 1.00 1.00 H new ATOM 0 HA ASP A 55 12.212 16.755 4.260 1.00 1.00 H new ATOM 0 HB2 ASP A 55 12.721 19.068 5.110 1.00 1.00 H new ATOM 0 HB3 ASP A 55 12.717 19.004 3.359 1.00 1.00 H new ATOM 819 N GLU A 56 11.475 16.939 6.593 1.00 1.00 N ATOM 820 CA GLU A 56 11.020 16.769 7.969 1.00 1.00 C ATOM 821 C GLU A 56 10.203 17.943 8.506 1.00 1.00 C ATOM 822 O GLU A 56 9.117 17.745 9.050 1.00 1.00 O ATOM 823 CB GLU A 56 12.248 16.583 8.861 1.00 1.00 C ATOM 824 CG GLU A 56 13.407 17.482 8.446 1.00 1.00 C ATOM 825 CD GLU A 56 14.369 17.790 9.568 1.00 1.00 C ATOM 826 OE1 GLU A 56 14.731 16.862 10.319 1.00 1.00 O ATOM 827 OE2 GLU A 56 14.767 18.968 9.696 1.00 1.00 O ATOM 0 H GLU A 56 12.451 16.677 6.458 1.00 1.00 H new ATOM 0 HA GLU A 56 10.360 15.901 7.978 1.00 1.00 H new ATOM 0 HB2 GLU A 56 11.978 16.796 9.895 1.00 1.00 H new ATOM 0 HB3 GLU A 56 12.567 15.542 8.823 1.00 1.00 H new ATOM 0 HG2 GLU A 56 13.953 17.004 7.633 1.00 1.00 H new ATOM 0 HG3 GLU A 56 13.007 18.418 8.055 1.00 1.00 H new ATOM 834 N ARG A 57 10.709 19.159 8.348 1.00 1.00 N ATOM 835 CA ARG A 57 10.057 20.322 8.936 1.00 1.00 C ATOM 836 C ARG A 57 8.755 20.655 8.224 1.00 1.00 C ATOM 837 O ARG A 57 7.764 20.995 8.871 1.00 1.00 O ATOM 838 CB ARG A 57 11.010 21.520 8.963 1.00 1.00 C ATOM 839 CG ARG A 57 11.618 21.873 7.619 1.00 1.00 C ATOM 840 CD ARG A 57 12.936 22.609 7.775 1.00 1.00 C ATOM 841 NE ARG A 57 13.940 21.775 8.436 1.00 1.00 N ATOM 842 CZ ARG A 57 15.230 22.086 8.540 1.00 1.00 C ATOM 843 NH1 ARG A 57 15.689 23.236 8.057 1.00 1.00 N ATOM 844 NH2 ARG A 57 16.055 21.242 9.142 1.00 1.00 N ATOM 0 H ARG A 57 11.559 19.365 7.824 1.00 1.00 H new ATOM 0 HA ARG A 57 9.799 20.077 9.966 1.00 1.00 H new ATOM 0 HB2 ARG A 57 10.471 22.388 9.342 1.00 1.00 H new ATOM 0 HB3 ARG A 57 11.815 21.312 9.668 1.00 1.00 H new ATOM 0 HG2 ARG A 57 11.776 20.963 7.041 1.00 1.00 H new ATOM 0 HG3 ARG A 57 10.920 22.492 7.055 1.00 1.00 H new ATOM 0 HD2 ARG A 57 13.302 22.913 6.795 1.00 1.00 H new ATOM 0 HD3 ARG A 57 12.779 23.519 8.354 1.00 1.00 H new ATOM 0 HE ARG A 57 13.630 20.894 8.846 1.00 1.00 H new ATOM 0 HH11 ARG A 57 15.051 23.889 7.602 1.00 1.00 H new ATOM 0 HH12 ARG A 57 16.679 23.466 8.141 1.00 1.00 H new ATOM 0 HH21 ARG A 57 15.700 20.364 9.520 1.00 1.00 H new ATOM 0 HH22 ARG A 57 17.045 21.470 9.227 1.00 1.00 H new ATOM 858 N ALA A 58 8.729 20.491 6.912 1.00 1.00 N ATOM 859 CA ALA A 58 7.514 20.726 6.155 1.00 1.00 C ATOM 860 C ALA A 58 6.501 19.634 6.451 1.00 1.00 C ATOM 861 O ALA A 58 5.321 19.910 6.654 1.00 1.00 O ATOM 862 CB ALA A 58 7.814 20.786 4.671 1.00 1.00 C ATOM 0 H ALA A 58 9.530 20.198 6.353 1.00 1.00 H new ATOM 0 HA ALA A 58 7.094 21.686 6.455 1.00 1.00 H new ATOM 0 HB1 ALA A 58 6.890 20.963 4.120 1.00 1.00 H new ATOM 0 HB2 ALA A 58 8.515 21.597 4.474 1.00 1.00 H new ATOM 0 HB3 ALA A 58 8.253 19.841 4.350 1.00 1.00 H new ATOM 868 N ALA A 59 6.987 18.400 6.537 1.00 1.00 N ATOM 869 CA ALA A 59 6.128 17.266 6.832 1.00 1.00 C ATOM 870 C ALA A 59 5.507 17.434 8.208 1.00 1.00 C ATOM 871 O ALA A 59 4.299 17.273 8.379 1.00 1.00 O ATOM 872 CB ALA A 59 6.914 15.964 6.755 1.00 1.00 C ATOM 0 H ALA A 59 7.970 18.163 6.406 1.00 1.00 H new ATOM 0 HA ALA A 59 5.332 17.225 6.089 1.00 1.00 H new ATOM 0 HB1 ALA A 59 6.253 15.126 6.979 1.00 1.00 H new ATOM 0 HB2 ALA A 59 7.323 15.845 5.752 1.00 1.00 H new ATOM 0 HB3 ALA A 59 7.729 15.987 7.479 1.00 1.00 H new ATOM 878 N GLY A 60 6.339 17.784 9.178 1.00 1.00 N ATOM 879 CA GLY A 60 5.863 17.988 10.526 1.00 1.00 C ATOM 880 C GLY A 60 4.819 19.084 10.635 1.00 1.00 C ATOM 881 O GLY A 60 3.784 18.878 11.266 1.00 1.00 O ATOM 0 H GLY A 60 7.341 17.930 9.052 1.00 1.00 H new ATOM 0 HA2 GLY A 60 5.441 17.055 10.900 1.00 1.00 H new ATOM 0 HA3 GLY A 60 6.708 18.235 11.169 1.00 1.00 H new ATOM 885 N VAL A 61 5.064 20.240 10.017 1.00 1.00 N ATOM 886 CA VAL A 61 4.117 21.341 10.119 1.00 1.00 C ATOM 887 C VAL A 61 2.846 21.068 9.316 1.00 1.00 C ATOM 888 O VAL A 61 1.751 21.386 9.778 1.00 1.00 O ATOM 889 CB VAL A 61 4.719 22.714 9.723 1.00 1.00 C ATOM 890 CG1 VAL A 61 5.990 22.997 10.500 1.00 1.00 C ATOM 891 CG2 VAL A 61 4.967 22.840 8.234 1.00 1.00 C ATOM 0 H VAL A 61 5.892 20.433 9.453 1.00 1.00 H new ATOM 0 HA VAL A 61 3.860 21.402 11.176 1.00 1.00 H new ATOM 0 HB VAL A 61 3.972 23.463 9.985 1.00 1.00 H new ATOM 0 HG11 VAL A 61 6.390 23.966 10.202 1.00 1.00 H new ATOM 0 HG12 VAL A 61 5.769 23.008 11.567 1.00 1.00 H new ATOM 0 HG13 VAL A 61 6.725 22.220 10.290 1.00 1.00 H new ATOM 0 HG21 VAL A 61 5.389 23.822 8.017 1.00 1.00 H new ATOM 0 HG22 VAL A 61 5.665 22.066 7.915 1.00 1.00 H new ATOM 0 HG23 VAL A 61 4.026 22.723 7.697 1.00 1.00 H new ATOM 901 N LEU A 62 2.970 20.449 8.143 1.00 1.00 N ATOM 902 CA LEU A 62 1.795 20.140 7.344 1.00 1.00 C ATOM 903 C LEU A 62 0.897 19.151 8.081 1.00 1.00 C ATOM 904 O LEU A 62 -0.261 19.453 8.366 1.00 1.00 O ATOM 905 CB LEU A 62 2.205 19.592 5.969 1.00 1.00 C ATOM 906 CG LEU A 62 2.378 20.637 4.852 1.00 1.00 C ATOM 907 CD1 LEU A 62 3.114 21.869 5.351 1.00 1.00 C ATOM 908 CD2 LEU A 62 3.132 20.026 3.684 1.00 1.00 C ATOM 0 H LEU A 62 3.858 20.158 7.734 1.00 1.00 H new ATOM 0 HA LEU A 62 1.231 21.059 7.185 1.00 1.00 H new ATOM 0 HB2 LEU A 62 3.144 19.050 6.081 1.00 1.00 H new ATOM 0 HB3 LEU A 62 1.455 18.868 5.650 1.00 1.00 H new ATOM 0 HG LEU A 62 1.385 20.946 4.526 1.00 1.00 H new ATOM 0 HD11 LEU A 62 3.218 22.585 4.536 1.00 1.00 H new ATOM 0 HD12 LEU A 62 2.550 22.325 6.165 1.00 1.00 H new ATOM 0 HD13 LEU A 62 4.102 21.582 5.710 1.00 1.00 H new ATOM 0 HD21 LEU A 62 3.251 20.771 2.898 1.00 1.00 H new ATOM 0 HD22 LEU A 62 4.114 19.693 4.019 1.00 1.00 H new ATOM 0 HD23 LEU A 62 2.573 19.175 3.296 1.00 1.00 H new ATOM 920 N ARG A 63 1.484 18.041 8.512 1.00 1.00 N ATOM 921 CA ARG A 63 0.743 16.999 9.220 1.00 1.00 C ATOM 922 C ARG A 63 0.166 17.521 10.538 1.00 1.00 C ATOM 923 O ARG A 63 -0.875 17.053 10.994 1.00 1.00 O ATOM 924 CB ARG A 63 1.637 15.774 9.469 1.00 1.00 C ATOM 925 CG ARG A 63 2.566 15.902 10.670 1.00 1.00 C ATOM 926 CD ARG A 63 3.580 14.768 10.719 1.00 1.00 C ATOM 927 NE ARG A 63 2.960 13.455 10.531 1.00 1.00 N ATOM 928 CZ ARG A 63 3.047 12.454 11.403 1.00 1.00 C ATOM 929 NH1 ARG A 63 3.667 12.628 12.564 1.00 1.00 N ATOM 930 NH2 ARG A 63 2.501 11.278 11.116 1.00 1.00 N ATOM 0 H ARG A 63 2.475 17.837 8.384 1.00 1.00 H new ATOM 0 HA ARG A 63 -0.092 16.698 8.588 1.00 1.00 H new ATOM 0 HB2 ARG A 63 1.002 14.899 9.609 1.00 1.00 H new ATOM 0 HB3 ARG A 63 2.239 15.592 8.578 1.00 1.00 H new ATOM 0 HG2 ARG A 63 3.090 16.857 10.625 1.00 1.00 H new ATOM 0 HG3 ARG A 63 1.977 15.904 11.587 1.00 1.00 H new ATOM 0 HD2 ARG A 63 4.333 14.925 9.947 1.00 1.00 H new ATOM 0 HD3 ARG A 63 4.097 14.788 11.678 1.00 1.00 H new ATOM 0 HE ARG A 63 2.427 13.298 9.676 1.00 1.00 H new ATOM 0 HH11 ARG A 63 4.080 13.533 12.791 1.00 1.00 H new ATOM 0 HH12 ARG A 63 3.731 11.857 13.229 1.00 1.00 H new ATOM 0 HH21 ARG A 63 2.016 11.144 10.229 1.00 1.00 H new ATOM 0 HH22 ARG A 63 2.566 10.509 11.783 1.00 1.00 H new ATOM 944 N ALA A 64 0.820 18.523 11.125 1.00 1.00 N ATOM 945 CA ALA A 64 0.355 19.108 12.380 1.00 1.00 C ATOM 946 C ALA A 64 -0.906 19.929 12.159 1.00 1.00 C ATOM 947 O ALA A 64 -1.789 19.970 13.014 1.00 1.00 O ATOM 948 CB ALA A 64 1.434 19.984 12.999 1.00 1.00 C ATOM 0 H ALA A 64 1.671 18.945 10.752 1.00 1.00 H new ATOM 0 HA ALA A 64 0.128 18.290 13.064 1.00 1.00 H new ATOM 0 HB1 ALA A 64 1.066 20.409 13.933 1.00 1.00 H new ATOM 0 HB2 ALA A 64 2.321 19.382 13.199 1.00 1.00 H new ATOM 0 HB3 ALA A 64 1.689 20.789 12.309 1.00 1.00 H new ATOM 954 N HIS A 65 -0.990 20.561 10.996 1.00 1.00 N ATOM 955 CA HIS A 65 -2.130 21.406 10.672 1.00 1.00 C ATOM 956 C HIS A 65 -3.177 20.624 9.888 1.00 1.00 C ATOM 957 O HIS A 65 -4.183 21.176 9.448 1.00 1.00 O ATOM 958 CB HIS A 65 -1.671 22.651 9.901 1.00 1.00 C ATOM 959 CG HIS A 65 -0.811 23.573 10.717 1.00 1.00 C ATOM 960 ND1 HIS A 65 -1.294 24.303 11.781 1.00 1.00 N ATOM 961 CD2 HIS A 65 0.511 23.875 10.627 1.00 1.00 C ATOM 962 CE1 HIS A 65 -0.313 25.014 12.305 1.00 1.00 C ATOM 963 NE2 HIS A 65 0.787 24.775 11.627 1.00 1.00 N ATOM 0 H HIS A 65 -0.283 20.504 10.263 1.00 1.00 H new ATOM 0 HA HIS A 65 -2.593 21.737 11.602 1.00 1.00 H new ATOM 0 HB2 HIS A 65 -1.117 22.338 9.016 1.00 1.00 H new ATOM 0 HB3 HIS A 65 -2.547 23.197 9.552 1.00 1.00 H new ATOM 0 HD2 HIS A 65 1.212 23.482 9.906 1.00 1.00 H new ATOM 0 HE1 HIS A 65 -0.400 25.681 13.150 1.00 1.00 H new ATOM 0 HE2 HIS A 65 1.699 25.191 11.813 1.00 1.00 H new ATOM 972 N GLY A 66 -2.911 19.338 9.697 1.00 1.00 N ATOM 973 CA GLY A 66 -3.862 18.462 9.034 1.00 1.00 C ATOM 974 C GLY A 66 -3.666 18.393 7.531 1.00 1.00 C ATOM 975 O GLY A 66 -4.530 17.894 6.807 1.00 1.00 O ATOM 0 H GLY A 66 -2.047 18.882 9.991 1.00 1.00 H new ATOM 0 HA2 GLY A 66 -3.774 17.459 9.452 1.00 1.00 H new ATOM 0 HA3 GLY A 66 -4.874 18.808 9.246 1.00 1.00 H new ATOM 979 N TYR A 67 -2.535 18.886 7.067 1.00 1.00 N ATOM 980 CA TYR A 67 -2.222 18.867 5.647 1.00 1.00 C ATOM 981 C TYR A 67 -1.481 17.587 5.275 1.00 1.00 C ATOM 982 O TYR A 67 -0.885 16.941 6.133 1.00 1.00 O ATOM 983 CB TYR A 67 -1.394 20.094 5.271 1.00 1.00 C ATOM 984 CG TYR A 67 -2.214 21.356 5.168 1.00 1.00 C ATOM 985 CD1 TYR A 67 -3.058 21.564 4.088 1.00 1.00 C ATOM 986 CD2 TYR A 67 -2.152 22.332 6.150 1.00 1.00 C ATOM 987 CE1 TYR A 67 -3.819 22.711 3.984 1.00 1.00 C ATOM 988 CE2 TYR A 67 -2.911 23.484 6.058 1.00 1.00 C ATOM 989 CZ TYR A 67 -3.743 23.669 4.972 1.00 1.00 C ATOM 990 OH TYR A 67 -4.508 24.809 4.875 1.00 1.00 O ATOM 0 H TYR A 67 -1.814 19.307 7.653 1.00 1.00 H new ATOM 0 HA TYR A 67 -3.157 18.893 5.087 1.00 1.00 H new ATOM 0 HB2 TYR A 67 -0.610 20.237 6.015 1.00 1.00 H new ATOM 0 HB3 TYR A 67 -0.899 19.912 4.317 1.00 1.00 H new ATOM 0 HD1 TYR A 67 -3.121 20.814 3.313 1.00 1.00 H new ATOM 0 HD2 TYR A 67 -1.501 22.191 7.000 1.00 1.00 H new ATOM 0 HE1 TYR A 67 -4.469 22.857 3.134 1.00 1.00 H new ATOM 0 HE2 TYR A 67 -2.853 24.235 6.832 1.00 1.00 H new ATOM 0 HH TYR A 67 -4.340 25.383 5.651 1.00 1.00 H new ATOM 1000 N PRO A 68 -1.560 17.169 4.003 1.00 1.00 N ATOM 1001 CA PRO A 68 -0.845 15.991 3.520 1.00 1.00 C ATOM 1002 C PRO A 68 0.636 16.271 3.401 1.00 1.00 C ATOM 1003 O PRO A 68 1.047 17.427 3.367 1.00 1.00 O ATOM 1004 CB PRO A 68 -1.454 15.746 2.141 1.00 1.00 C ATOM 1005 CG PRO A 68 -1.879 17.097 1.689 1.00 1.00 C ATOM 1006 CD PRO A 68 -2.327 17.821 2.929 1.00 1.00 C ATOM 0 HA PRO A 68 -0.939 15.136 4.189 1.00 1.00 H new ATOM 0 HB2 PRO A 68 -0.728 15.306 1.457 1.00 1.00 H new ATOM 0 HB3 PRO A 68 -2.299 15.059 2.194 1.00 1.00 H new ATOM 0 HG2 PRO A 68 -1.057 17.624 1.204 1.00 1.00 H new ATOM 0 HG3 PRO A 68 -2.688 17.030 0.962 1.00 1.00 H new ATOM 0 HD2 PRO A 68 -2.110 18.888 2.871 1.00 1.00 H new ATOM 0 HD3 PRO A 68 -3.401 17.722 3.086 1.00 1.00 H new ATOM 1014 N THR A 69 1.441 15.232 3.329 1.00 1.00 N ATOM 1015 CA THR A 69 2.874 15.429 3.247 1.00 1.00 C ATOM 1016 C THR A 69 3.507 14.478 2.227 1.00 1.00 C ATOM 1017 O THR A 69 4.731 14.404 2.100 1.00 1.00 O ATOM 1018 CB THR A 69 3.541 15.250 4.636 1.00 1.00 C ATOM 1019 OG1 THR A 69 3.466 13.877 5.044 1.00 1.00 O ATOM 1020 CG2 THR A 69 2.865 16.108 5.694 1.00 1.00 C ATOM 0 H THR A 69 1.136 14.259 3.325 1.00 1.00 H new ATOM 0 HA THR A 69 3.045 16.452 2.912 1.00 1.00 H new ATOM 0 HB THR A 69 4.581 15.562 4.541 1.00 1.00 H new ATOM 0 HG1 THR A 69 3.891 13.773 5.921 1.00 1.00 H new ATOM 0 HG21 THR A 69 3.358 15.957 6.654 1.00 1.00 H new ATOM 0 HG22 THR A 69 2.936 17.158 5.411 1.00 1.00 H new ATOM 0 HG23 THR A 69 1.816 15.824 5.777 1.00 1.00 H new ATOM 1028 N ASP A 70 2.660 13.816 1.443 1.00 1.00 N ATOM 1029 CA ASP A 70 3.131 12.901 0.402 1.00 1.00 C ATOM 1030 C ASP A 70 3.732 13.676 -0.763 1.00 1.00 C ATOM 1031 O ASP A 70 3.037 14.439 -1.430 1.00 1.00 O ATOM 1032 CB ASP A 70 1.986 12.026 -0.113 1.00 1.00 C ATOM 1033 CG ASP A 70 2.381 11.235 -1.351 1.00 1.00 C ATOM 1034 OD1 ASP A 70 3.091 10.219 -1.213 1.00 1.00 O ATOM 1035 OD2 ASP A 70 1.995 11.638 -2.468 1.00 1.00 O ATOM 0 H ASP A 70 1.645 13.895 1.507 1.00 1.00 H new ATOM 0 HA ASP A 70 3.897 12.264 0.845 1.00 1.00 H new ATOM 0 HB2 ASP A 70 1.675 11.337 0.673 1.00 1.00 H new ATOM 0 HB3 ASP A 70 1.126 12.655 -0.344 1.00 1.00 H new ATOM 1040 N HIS A 71 5.019 13.482 -1.009 1.00 1.00 N ATOM 1041 CA HIS A 71 5.712 14.204 -2.071 1.00 1.00 C ATOM 1042 C HIS A 71 6.962 13.462 -2.514 1.00 1.00 C ATOM 1043 O HIS A 71 7.600 12.775 -1.724 1.00 1.00 O ATOM 1044 CB HIS A 71 6.066 15.618 -1.578 1.00 1.00 C ATOM 1045 CG HIS A 71 7.091 16.356 -2.392 1.00 1.00 C ATOM 1046 ND1 HIS A 71 6.800 17.082 -3.526 1.00 1.00 N ATOM 1047 CD2 HIS A 71 8.417 16.513 -2.183 1.00 1.00 C ATOM 1048 CE1 HIS A 71 7.906 17.651 -3.974 1.00 1.00 C ATOM 1049 NE2 HIS A 71 8.903 17.325 -3.174 1.00 1.00 N ATOM 0 H HIS A 71 5.607 12.831 -0.489 1.00 1.00 H new ATOM 0 HA HIS A 71 5.052 14.277 -2.935 1.00 1.00 H new ATOM 0 HB2 HIS A 71 5.153 16.213 -1.552 1.00 1.00 H new ATOM 0 HB3 HIS A 71 6.428 15.545 -0.552 1.00 1.00 H new ATOM 0 HD2 HIS A 71 8.991 16.077 -1.379 1.00 1.00 H new ATOM 0 HE1 HIS A 71 7.981 18.279 -4.850 1.00 1.00 H new ATOM 0 HE2 HIS A 71 9.872 17.626 -3.276 1.00 1.00 H new ATOM 1058 N ARG A 72 7.303 13.630 -3.779 1.00 1.00 N ATOM 1059 CA ARG A 72 8.514 13.061 -4.333 1.00 1.00 C ATOM 1060 C ARG A 72 9.204 14.139 -5.140 1.00 1.00 C ATOM 1061 O ARG A 72 8.628 14.688 -6.077 1.00 1.00 O ATOM 1062 CB ARG A 72 8.215 11.854 -5.216 1.00 1.00 C ATOM 1063 CG ARG A 72 9.232 10.735 -5.066 1.00 1.00 C ATOM 1064 CD ARG A 72 9.035 10.005 -3.748 1.00 1.00 C ATOM 1065 NE ARG A 72 10.003 8.931 -3.548 1.00 1.00 N ATOM 1066 CZ ARG A 72 10.195 8.319 -2.382 1.00 1.00 C ATOM 1067 NH1 ARG A 72 9.450 8.641 -1.330 1.00 1.00 N ATOM 1068 NH2 ARG A 72 11.107 7.359 -2.274 1.00 1.00 N ATOM 0 H ARG A 72 6.748 14.164 -4.448 1.00 1.00 H new ATOM 0 HA ARG A 72 9.154 12.712 -3.522 1.00 1.00 H new ATOM 0 HB2 ARG A 72 7.224 11.471 -4.972 1.00 1.00 H new ATOM 0 HB3 ARG A 72 8.186 12.173 -6.258 1.00 1.00 H new ATOM 0 HG2 ARG A 72 9.133 10.034 -5.894 1.00 1.00 H new ATOM 0 HG3 ARG A 72 10.241 11.145 -5.114 1.00 1.00 H new ATOM 0 HD2 ARG A 72 9.115 10.718 -2.927 1.00 1.00 H new ATOM 0 HD3 ARG A 72 8.027 9.591 -3.714 1.00 1.00 H new ATOM 0 HE ARG A 72 10.563 8.633 -4.346 1.00 1.00 H new ATOM 0 HH11 ARG A 72 8.730 9.358 -1.415 1.00 1.00 H new ATOM 0 HH12 ARG A 72 9.598 8.171 -0.437 1.00 1.00 H new ATOM 0 HH21 ARG A 72 11.662 7.089 -3.086 1.00 1.00 H new ATOM 0 HH22 ARG A 72 11.252 6.892 -1.379 1.00 1.00 H new ATOM 1082 N ALA A 73 10.365 14.533 -4.666 1.00 1.00 N ATOM 1083 CA ALA A 73 11.105 15.632 -5.263 1.00 1.00 C ATOM 1084 C ALA A 73 11.451 15.384 -6.730 1.00 1.00 C ATOM 1085 O ALA A 73 11.815 14.275 -7.122 1.00 1.00 O ATOM 1086 CB ALA A 73 12.347 15.919 -4.442 1.00 1.00 C ATOM 0 H ALA A 73 10.824 14.106 -3.861 1.00 1.00 H new ATOM 0 HA ALA A 73 10.459 16.510 -5.253 1.00 1.00 H new ATOM 0 HB1 ALA A 73 12.899 16.744 -4.893 1.00 1.00 H new ATOM 0 HB2 ALA A 73 12.057 16.189 -3.426 1.00 1.00 H new ATOM 0 HB3 ALA A 73 12.979 15.031 -4.415 1.00 1.00 H new ATOM 1092 N ALA A 74 11.293 16.424 -7.529 1.00 1.00 N ATOM 1093 CA ALA A 74 11.611 16.381 -8.945 1.00 1.00 C ATOM 1094 C ALA A 74 12.493 17.559 -9.317 1.00 1.00 C ATOM 1095 O ALA A 74 12.593 18.530 -8.569 1.00 1.00 O ATOM 1096 CB ALA A 74 10.332 16.406 -9.769 1.00 1.00 C ATOM 0 H ALA A 74 10.939 17.327 -7.212 1.00 1.00 H new ATOM 0 HA ALA A 74 12.149 15.457 -9.157 1.00 1.00 H new ATOM 0 HB1 ALA A 74 10.582 16.373 -10.830 1.00 1.00 H new ATOM 0 HB2 ALA A 74 9.718 15.542 -9.514 1.00 1.00 H new ATOM 0 HB3 ALA A 74 9.779 17.320 -9.554 1.00 1.00 H new ATOM 1102 N GLN A 75 13.166 17.466 -10.453 1.00 1.00 N ATOM 1103 CA GLN A 75 14.005 18.552 -10.907 1.00 1.00 C ATOM 1104 C GLN A 75 13.217 19.373 -11.914 1.00 1.00 C ATOM 1105 O GLN A 75 12.233 18.882 -12.473 1.00 1.00 O ATOM 1106 CB GLN A 75 15.298 18.008 -11.532 1.00 1.00 C ATOM 1107 CG GLN A 75 16.039 19.015 -12.414 1.00 1.00 C ATOM 1108 CD GLN A 75 17.353 18.478 -12.950 1.00 1.00 C ATOM 1109 OE1 GLN A 75 17.499 17.278 -13.178 1.00 1.00 O ATOM 1110 NE2 GLN A 75 18.321 19.359 -13.153 1.00 1.00 N ATOM 0 H GLN A 75 13.145 16.654 -11.070 1.00 1.00 H new ATOM 0 HA GLN A 75 14.291 19.182 -10.065 1.00 1.00 H new ATOM 0 HB2 GLN A 75 15.965 17.681 -10.734 1.00 1.00 H new ATOM 0 HB3 GLN A 75 15.058 17.127 -12.128 1.00 1.00 H new ATOM 0 HG2 GLN A 75 15.400 19.297 -13.251 1.00 1.00 H new ATOM 0 HG3 GLN A 75 16.230 19.921 -11.840 1.00 1.00 H new ATOM 0 HE21 GLN A 75 18.162 20.346 -12.952 1.00 1.00 H new ATOM 0 HE22 GLN A 75 19.225 19.050 -13.510 1.00 1.00 H new ATOM 1119 N VAL A 76 13.584 20.634 -12.097 1.00 1.00 N ATOM 1120 CA VAL A 76 12.900 21.465 -13.073 1.00 1.00 C ATOM 1121 C VAL A 76 13.177 20.946 -14.475 1.00 1.00 C ATOM 1122 O VAL A 76 14.273 21.106 -15.011 1.00 1.00 O ATOM 1123 CB VAL A 76 13.316 22.938 -12.991 1.00 1.00 C ATOM 1124 CG1 VAL A 76 12.374 23.808 -13.779 1.00 1.00 C ATOM 1125 CG2 VAL A 76 13.388 23.408 -11.554 1.00 1.00 C ATOM 0 H VAL A 76 14.339 21.096 -11.591 1.00 1.00 H new ATOM 0 HA VAL A 76 11.835 21.410 -12.846 1.00 1.00 H new ATOM 0 HB VAL A 76 14.311 23.023 -13.427 1.00 1.00 H new ATOM 0 HG11 VAL A 76 12.691 24.848 -13.705 1.00 1.00 H new ATOM 0 HG12 VAL A 76 12.383 23.500 -14.825 1.00 1.00 H new ATOM 0 HG13 VAL A 76 11.365 23.707 -13.379 1.00 1.00 H new ATOM 0 HG21 VAL A 76 13.686 24.456 -11.529 1.00 1.00 H new ATOM 0 HG22 VAL A 76 12.410 23.297 -11.085 1.00 1.00 H new ATOM 0 HG23 VAL A 76 14.120 22.810 -11.012 1.00 1.00 H new ATOM 1135 N GLY A 77 12.187 20.288 -15.033 1.00 1.00 N ATOM 1136 CA GLY A 77 12.325 19.706 -16.346 1.00 1.00 C ATOM 1137 C GLY A 77 11.418 20.380 -17.340 1.00 1.00 C ATOM 1138 O GLY A 77 10.694 21.308 -16.981 1.00 1.00 O ATOM 0 H GLY A 77 11.277 20.143 -14.597 1.00 1.00 H new ATOM 0 HA2 GLY A 77 13.360 19.792 -16.678 1.00 1.00 H new ATOM 0 HA3 GLY A 77 12.092 18.642 -16.301 1.00 1.00 H new ATOM 1142 N THR A 78 11.384 19.865 -18.557 1.00 1.00 N ATOM 1143 CA THR A 78 10.553 20.426 -19.606 1.00 1.00 C ATOM 1144 C THR A 78 9.084 20.482 -19.180 1.00 1.00 C ATOM 1145 O THR A 78 8.409 21.489 -19.379 1.00 1.00 O ATOM 1146 CB THR A 78 10.688 19.590 -20.888 1.00 1.00 C ATOM 1147 OG1 THR A 78 12.053 19.587 -21.323 1.00 1.00 O ATOM 1148 CG2 THR A 78 9.786 20.130 -21.987 1.00 1.00 C ATOM 0 H THR A 78 11.928 19.051 -18.844 1.00 1.00 H new ATOM 0 HA THR A 78 10.894 21.444 -19.796 1.00 1.00 H new ATOM 0 HB THR A 78 10.378 18.568 -20.669 1.00 1.00 H new ATOM 0 HG1 THR A 78 12.135 19.051 -22.140 1.00 1.00 H new ATOM 0 HG21 THR A 78 9.900 19.521 -22.884 1.00 1.00 H new ATOM 0 HG22 THR A 78 8.748 20.096 -21.655 1.00 1.00 H new ATOM 0 HG23 THR A 78 10.062 21.160 -22.211 1.00 1.00 H new ATOM 1156 N GLU A 79 8.615 19.407 -18.559 1.00 1.00 N ATOM 1157 CA GLU A 79 7.241 19.326 -18.072 1.00 1.00 C ATOM 1158 C GLU A 79 6.955 20.411 -17.030 1.00 1.00 C ATOM 1159 O GLU A 79 5.829 20.888 -16.908 1.00 1.00 O ATOM 1160 CB GLU A 79 6.982 17.936 -17.490 1.00 1.00 C ATOM 1161 CG GLU A 79 7.998 17.522 -16.440 1.00 1.00 C ATOM 1162 CD GLU A 79 7.744 16.138 -15.883 1.00 1.00 C ATOM 1163 OE1 GLU A 79 7.221 15.280 -16.619 1.00 1.00 O ATOM 1164 OE2 GLU A 79 8.075 15.904 -14.704 1.00 1.00 O ATOM 0 H GLU A 79 9.171 18.571 -18.379 1.00 1.00 H new ATOM 0 HA GLU A 79 6.566 19.493 -18.911 1.00 1.00 H new ATOM 0 HB2 GLU A 79 5.986 17.915 -17.049 1.00 1.00 H new ATOM 0 HB3 GLU A 79 6.988 17.205 -18.299 1.00 1.00 H new ATOM 0 HG2 GLU A 79 8.996 17.554 -16.876 1.00 1.00 H new ATOM 0 HG3 GLU A 79 7.983 18.244 -15.624 1.00 1.00 H new ATOM 1171 N HIS A 80 7.988 20.812 -16.292 1.00 1.00 N ATOM 1172 CA HIS A 80 7.832 21.863 -15.292 1.00 1.00 C ATOM 1173 C HIS A 80 7.808 23.223 -15.971 1.00 1.00 C ATOM 1174 O HIS A 80 7.016 24.088 -15.621 1.00 1.00 O ATOM 1175 CB HIS A 80 8.934 21.794 -14.224 1.00 1.00 C ATOM 1176 CG HIS A 80 8.851 20.540 -13.406 1.00 1.00 C ATOM 1177 ND1 HIS A 80 9.406 19.340 -13.796 1.00 1.00 N ATOM 1178 CD2 HIS A 80 8.243 20.297 -12.220 1.00 1.00 C ATOM 1179 CE1 HIS A 80 9.144 18.419 -12.890 1.00 1.00 C ATOM 1180 NE2 HIS A 80 8.440 18.972 -11.922 1.00 1.00 N ATOM 0 H HIS A 80 8.931 20.430 -16.366 1.00 1.00 H new ATOM 0 HA HIS A 80 6.882 21.711 -14.779 1.00 1.00 H new ATOM 0 HB2 HIS A 80 9.910 21.847 -14.707 1.00 1.00 H new ATOM 0 HB3 HIS A 80 8.856 22.660 -13.567 1.00 1.00 H new ATOM 0 HD2 HIS A 80 7.703 21.014 -11.620 1.00 1.00 H new ATOM 0 HE1 HIS A 80 9.454 17.385 -12.933 1.00 1.00 H new ATOM 0 HE2 HIS A 80 8.098 18.494 -11.089 1.00 1.00 H new ATOM 1189 N LEU A 81 8.656 23.380 -16.977 1.00 1.00 N ATOM 1190 CA LEU A 81 8.725 24.615 -17.756 1.00 1.00 C ATOM 1191 C LEU A 81 7.462 24.797 -18.595 1.00 1.00 C ATOM 1192 O LEU A 81 7.155 25.895 -19.053 1.00 1.00 O ATOM 1193 CB LEU A 81 9.955 24.577 -18.668 1.00 1.00 C ATOM 1194 CG LEU A 81 11.281 24.276 -17.964 1.00 1.00 C ATOM 1195 CD1 LEU A 81 12.374 24.009 -18.987 1.00 1.00 C ATOM 1196 CD2 LEU A 81 11.676 25.431 -17.056 1.00 1.00 C ATOM 0 H LEU A 81 9.314 22.661 -17.278 1.00 1.00 H new ATOM 0 HA LEU A 81 8.805 25.458 -17.069 1.00 1.00 H new ATOM 0 HB2 LEU A 81 9.792 23.824 -19.439 1.00 1.00 H new ATOM 0 HB3 LEU A 81 10.041 25.538 -19.175 1.00 1.00 H new ATOM 0 HG LEU A 81 11.152 23.384 -17.351 1.00 1.00 H new ATOM 0 HD11 LEU A 81 13.311 23.797 -18.472 1.00 1.00 H new ATOM 0 HD12 LEU A 81 12.096 23.153 -19.602 1.00 1.00 H new ATOM 0 HD13 LEU A 81 12.500 24.886 -19.622 1.00 1.00 H new ATOM 0 HD21 LEU A 81 12.621 25.200 -16.564 1.00 1.00 H new ATOM 0 HD22 LEU A 81 11.788 26.338 -17.649 1.00 1.00 H new ATOM 0 HD23 LEU A 81 10.902 25.583 -16.303 1.00 1.00 H new ATOM 1208 N ALA A 82 6.737 23.705 -18.793 1.00 1.00 N ATOM 1209 CA ALA A 82 5.520 23.716 -19.592 1.00 1.00 C ATOM 1210 C ALA A 82 4.319 24.091 -18.742 1.00 1.00 C ATOM 1211 O ALA A 82 3.195 24.167 -19.236 1.00 1.00 O ATOM 1212 CB ALA A 82 5.302 22.354 -20.225 1.00 1.00 C ATOM 0 H ALA A 82 6.974 22.791 -18.407 1.00 1.00 H new ATOM 0 HA ALA A 82 5.632 24.463 -20.377 1.00 1.00 H new ATOM 0 HB1 ALA A 82 4.389 22.372 -20.821 1.00 1.00 H new ATOM 0 HB2 ALA A 82 6.149 22.111 -20.866 1.00 1.00 H new ATOM 0 HB3 ALA A 82 5.210 21.600 -19.443 1.00 1.00 H new ATOM 1218 N ALA A 83 4.549 24.240 -17.447 1.00 1.00 N ATOM 1219 CA ALA A 83 3.486 24.595 -16.519 1.00 1.00 C ATOM 1220 C ALA A 83 2.851 25.936 -16.876 1.00 1.00 C ATOM 1221 O ALA A 83 3.496 26.803 -17.466 1.00 1.00 O ATOM 1222 CB ALA A 83 4.023 24.639 -15.103 1.00 1.00 C ATOM 0 H ALA A 83 5.465 24.120 -17.014 1.00 1.00 H new ATOM 0 HA ALA A 83 2.714 23.829 -16.592 1.00 1.00 H new ATOM 0 HB1 ALA A 83 3.219 24.906 -14.417 1.00 1.00 H new ATOM 0 HB2 ALA A 83 4.420 23.660 -14.834 1.00 1.00 H new ATOM 0 HB3 ALA A 83 4.817 25.383 -15.038 1.00 1.00 H new ATOM 1228 N ASP A 84 1.596 26.121 -16.481 1.00 1.00 N ATOM 1229 CA ASP A 84 0.893 27.369 -16.761 1.00 1.00 C ATOM 1230 C ASP A 84 1.306 28.423 -15.747 1.00 1.00 C ATOM 1231 O ASP A 84 1.114 29.616 -15.962 1.00 1.00 O ATOM 1232 CB ASP A 84 -0.632 27.174 -16.725 1.00 1.00 C ATOM 1233 CG ASP A 84 -1.371 28.222 -17.547 1.00 1.00 C ATOM 1234 OD1 ASP A 84 -1.091 28.324 -18.764 1.00 1.00 O ATOM 1235 OD2 ASP A 84 -2.246 28.923 -16.993 1.00 1.00 O ATOM 0 H ASP A 84 1.048 25.429 -15.970 1.00 1.00 H new ATOM 0 HA ASP A 84 1.164 27.697 -17.765 1.00 1.00 H new ATOM 0 HB2 ASP A 84 -0.878 26.181 -17.102 1.00 1.00 H new ATOM 0 HB3 ASP A 84 -0.977 27.217 -15.692 1.00 1.00 H new ATOM 1240 N LEU A 85 1.986 27.976 -14.698 1.00 1.00 N ATOM 1241 CA LEU A 85 2.401 28.858 -13.626 1.00 1.00 C ATOM 1242 C LEU A 85 3.579 28.247 -12.908 1.00 1.00 C ATOM 1243 O LEU A 85 3.494 27.142 -12.380 1.00 1.00 O ATOM 1244 CB LEU A 85 1.260 29.062 -12.620 1.00 1.00 C ATOM 1245 CG LEU A 85 1.350 30.308 -11.724 1.00 1.00 C ATOM 1246 CD1 LEU A 85 0.388 30.171 -10.579 1.00 1.00 C ATOM 1247 CD2 LEU A 85 2.741 30.525 -11.176 1.00 1.00 C ATOM 0 H LEU A 85 2.261 27.002 -14.571 1.00 1.00 H new ATOM 0 HA LEU A 85 2.674 29.822 -14.055 1.00 1.00 H new ATOM 0 HB2 LEU A 85 0.322 29.106 -13.173 1.00 1.00 H new ATOM 0 HB3 LEU A 85 1.210 28.183 -11.978 1.00 1.00 H new ATOM 0 HG LEU A 85 1.098 31.170 -12.341 1.00 1.00 H new ATOM 0 HD11 LEU A 85 0.451 31.054 -9.943 1.00 1.00 H new ATOM 0 HD12 LEU A 85 -0.626 30.074 -10.966 1.00 1.00 H new ATOM 0 HD13 LEU A 85 0.640 29.285 -9.996 1.00 1.00 H new ATOM 0 HD21 LEU A 85 2.750 31.417 -10.550 1.00 1.00 H new ATOM 0 HD22 LEU A 85 3.036 29.661 -10.581 1.00 1.00 H new ATOM 0 HD23 LEU A 85 3.441 30.653 -12.001 1.00 1.00 H new ATOM 1259 N LEU A 86 4.690 28.938 -12.945 1.00 1.00 N ATOM 1260 CA LEU A 86 5.857 28.486 -12.261 1.00 1.00 C ATOM 1261 C LEU A 86 6.103 29.354 -11.039 1.00 1.00 C ATOM 1262 O LEU A 86 6.534 30.496 -11.147 1.00 1.00 O ATOM 1263 CB LEU A 86 7.019 28.476 -13.235 1.00 1.00 C ATOM 1264 CG LEU A 86 6.848 27.499 -14.413 1.00 1.00 C ATOM 1265 CD1 LEU A 86 5.788 27.949 -15.401 1.00 1.00 C ATOM 1266 CD2 LEU A 86 8.152 27.336 -15.125 1.00 1.00 C ATOM 0 H LEU A 86 4.803 29.819 -13.446 1.00 1.00 H new ATOM 0 HA LEU A 86 5.730 27.467 -11.894 1.00 1.00 H new ATOM 0 HB2 LEU A 86 7.156 29.483 -13.630 1.00 1.00 H new ATOM 0 HB3 LEU A 86 7.930 28.219 -12.694 1.00 1.00 H new ATOM 0 HG LEU A 86 6.519 26.548 -13.994 1.00 1.00 H new ATOM 0 HD11 LEU A 86 5.712 27.222 -16.209 1.00 1.00 H new ATOM 0 HD12 LEU A 86 4.827 28.029 -14.893 1.00 1.00 H new ATOM 0 HD13 LEU A 86 6.063 28.921 -15.812 1.00 1.00 H new ATOM 0 HD21 LEU A 86 8.028 26.644 -15.958 1.00 1.00 H new ATOM 0 HD22 LEU A 86 8.484 28.303 -15.503 1.00 1.00 H new ATOM 0 HD23 LEU A 86 8.897 26.942 -14.434 1.00 1.00 H new ATOM 1278 N VAL A 87 5.813 28.781 -9.884 1.00 1.00 N ATOM 1279 CA VAL A 87 5.921 29.494 -8.618 1.00 1.00 C ATOM 1280 C VAL A 87 7.336 29.405 -8.058 1.00 1.00 C ATOM 1281 O VAL A 87 7.731 28.417 -7.445 1.00 1.00 O ATOM 1282 CB VAL A 87 4.909 28.969 -7.576 1.00 1.00 C ATOM 1283 CG1 VAL A 87 5.215 29.508 -6.193 1.00 1.00 C ATOM 1284 CG2 VAL A 87 3.495 29.351 -7.970 1.00 1.00 C ATOM 0 H VAL A 87 5.498 27.815 -9.794 1.00 1.00 H new ATOM 0 HA VAL A 87 5.687 30.539 -8.822 1.00 1.00 H new ATOM 0 HB VAL A 87 4.995 27.883 -7.551 1.00 1.00 H new ATOM 0 HG11 VAL A 87 4.485 29.121 -5.482 1.00 1.00 H new ATOM 0 HG12 VAL A 87 6.215 29.195 -5.894 1.00 1.00 H new ATOM 0 HG13 VAL A 87 5.165 30.597 -6.207 1.00 1.00 H new ATOM 0 HG21 VAL A 87 2.795 28.973 -7.225 1.00 1.00 H new ATOM 0 HG22 VAL A 87 3.414 30.436 -8.027 1.00 1.00 H new ATOM 0 HG23 VAL A 87 3.259 28.918 -8.942 1.00 1.00 H new ATOM 1294 N ALA A 88 8.115 30.418 -8.357 1.00 1.00 N ATOM 1295 CA ALA A 88 9.483 30.478 -7.883 1.00 1.00 C ATOM 1296 C ALA A 88 9.543 31.017 -6.462 1.00 1.00 C ATOM 1297 O ALA A 88 8.747 31.877 -6.076 1.00 1.00 O ATOM 1298 CB ALA A 88 10.341 31.301 -8.826 1.00 1.00 C ATOM 0 H ALA A 88 7.827 31.214 -8.927 1.00 1.00 H new ATOM 0 HA ALA A 88 9.885 29.465 -7.866 1.00 1.00 H new ATOM 0 HB1 ALA A 88 11.364 31.334 -8.452 1.00 1.00 H new ATOM 0 HB2 ALA A 88 10.331 30.847 -9.817 1.00 1.00 H new ATOM 0 HB3 ALA A 88 9.945 32.315 -8.887 1.00 1.00 H new ATOM 1304 N LEU A 89 10.476 30.494 -5.680 1.00 1.00 N ATOM 1305 CA LEU A 89 10.654 30.925 -4.302 1.00 1.00 C ATOM 1306 C LEU A 89 11.733 31.997 -4.220 1.00 1.00 C ATOM 1307 O LEU A 89 11.856 32.698 -3.221 1.00 1.00 O ATOM 1308 CB LEU A 89 11.029 29.731 -3.410 1.00 1.00 C ATOM 1309 CG LEU A 89 9.853 28.919 -2.853 1.00 1.00 C ATOM 1310 CD1 LEU A 89 8.929 29.809 -2.040 1.00 1.00 C ATOM 1311 CD2 LEU A 89 9.083 28.228 -3.970 1.00 1.00 C ATOM 0 H LEU A 89 11.125 29.766 -5.979 1.00 1.00 H new ATOM 0 HA LEU A 89 9.712 31.344 -3.947 1.00 1.00 H new ATOM 0 HB2 LEU A 89 11.670 29.061 -3.983 1.00 1.00 H new ATOM 0 HB3 LEU A 89 11.621 30.099 -2.572 1.00 1.00 H new ATOM 0 HG LEU A 89 10.258 28.148 -2.198 1.00 1.00 H new ATOM 0 HD11 LEU A 89 8.100 29.216 -1.653 1.00 1.00 H new ATOM 0 HD12 LEU A 89 9.483 30.245 -1.209 1.00 1.00 H new ATOM 0 HD13 LEU A 89 8.540 30.605 -2.674 1.00 1.00 H new ATOM 0 HD21 LEU A 89 8.256 27.660 -3.544 1.00 1.00 H new ATOM 0 HD22 LEU A 89 8.693 28.976 -4.660 1.00 1.00 H new ATOM 0 HD23 LEU A 89 9.749 27.552 -4.507 1.00 1.00 H new ATOM 1323 N ASP A 90 12.487 32.137 -5.299 1.00 1.00 N ATOM 1324 CA ASP A 90 13.570 33.108 -5.346 1.00 1.00 C ATOM 1325 C ASP A 90 13.780 33.647 -6.762 1.00 1.00 C ATOM 1326 O ASP A 90 13.443 32.988 -7.751 1.00 1.00 O ATOM 1327 CB ASP A 90 14.861 32.480 -4.797 1.00 1.00 C ATOM 1328 CG ASP A 90 16.019 32.530 -5.773 1.00 1.00 C ATOM 1329 OD1 ASP A 90 16.134 31.611 -6.608 1.00 1.00 O ATOM 1330 OD2 ASP A 90 16.810 33.488 -5.720 1.00 1.00 O ATOM 0 H ASP A 90 12.370 31.592 -6.153 1.00 1.00 H new ATOM 0 HA ASP A 90 13.297 33.956 -4.718 1.00 1.00 H new ATOM 0 HB2 ASP A 90 15.146 32.997 -3.880 1.00 1.00 H new ATOM 0 HB3 ASP A 90 14.666 31.441 -4.530 1.00 1.00 H new ATOM 1335 N ARG A 91 14.314 34.862 -6.821 1.00 1.00 N ATOM 1336 CA ARG A 91 14.614 35.584 -8.066 1.00 1.00 C ATOM 1337 C ARG A 91 15.405 34.751 -9.082 1.00 1.00 C ATOM 1338 O ARG A 91 15.202 34.887 -10.290 1.00 1.00 O ATOM 1339 CB ARG A 91 15.415 36.838 -7.707 1.00 1.00 C ATOM 1340 CG ARG A 91 16.291 36.617 -6.486 1.00 1.00 C ATOM 1341 CD ARG A 91 17.145 37.816 -6.135 1.00 1.00 C ATOM 1342 NE ARG A 91 17.820 37.601 -4.859 1.00 1.00 N ATOM 1343 CZ ARG A 91 17.965 38.531 -3.924 1.00 1.00 C ATOM 1344 NH1 ARG A 91 17.636 39.791 -4.174 1.00 1.00 N ATOM 1345 NH2 ARG A 91 18.453 38.201 -2.740 1.00 1.00 N ATOM 0 H ARG A 91 14.559 35.392 -5.985 1.00 1.00 H new ATOM 0 HA ARG A 91 13.665 35.829 -8.542 1.00 1.00 H new ATOM 0 HB2 ARG A 91 16.038 37.126 -8.554 1.00 1.00 H new ATOM 0 HB3 ARG A 91 14.730 37.665 -7.518 1.00 1.00 H new ATOM 0 HG2 ARG A 91 15.658 36.369 -5.634 1.00 1.00 H new ATOM 0 HG3 ARG A 91 16.938 35.758 -6.663 1.00 1.00 H new ATOM 0 HD2 ARG A 91 17.882 37.988 -6.919 1.00 1.00 H new ATOM 0 HD3 ARG A 91 16.524 38.710 -6.079 1.00 1.00 H new ATOM 0 HE ARG A 91 18.206 36.675 -4.674 1.00 1.00 H new ATOM 0 HH11 ARG A 91 17.269 40.050 -5.090 1.00 1.00 H new ATOM 0 HH12 ARG A 91 17.750 40.501 -3.451 1.00 1.00 H new ATOM 0 HH21 ARG A 91 18.716 37.234 -2.548 1.00 1.00 H new ATOM 0 HH22 ARG A 91 18.566 38.913 -2.018 1.00 1.00 H new ATOM 1359 N ASN A 92 16.257 33.859 -8.597 1.00 1.00 N ATOM 1360 CA ASN A 92 17.095 33.065 -9.490 1.00 1.00 C ATOM 1361 C ASN A 92 16.292 31.944 -10.122 1.00 1.00 C ATOM 1362 O ASN A 92 16.372 31.725 -11.328 1.00 1.00 O ATOM 1363 CB ASN A 92 18.291 32.484 -8.739 1.00 1.00 C ATOM 1364 CG ASN A 92 19.396 33.496 -8.525 1.00 1.00 C ATOM 1365 OD1 ASN A 92 19.597 34.399 -9.338 1.00 1.00 O ATOM 1366 ND2 ASN A 92 20.129 33.346 -7.435 1.00 1.00 N ATOM 0 H ASN A 92 16.387 33.667 -7.604 1.00 1.00 H new ATOM 0 HA ASN A 92 17.462 33.724 -10.277 1.00 1.00 H new ATOM 0 HB2 ASN A 92 17.959 32.106 -7.772 1.00 1.00 H new ATOM 0 HB3 ASN A 92 18.686 31.634 -9.295 1.00 1.00 H new ATOM 0 HD21 ASN A 92 20.894 33.992 -7.242 1.00 1.00 H new ATOM 0 HD22 ASN A 92 19.929 32.584 -6.787 1.00 1.00 H new ATOM 1373 N HIS A 93 15.536 31.222 -9.298 1.00 1.00 N ATOM 1374 CA HIS A 93 14.696 30.132 -9.790 1.00 1.00 C ATOM 1375 C HIS A 93 13.777 30.642 -10.893 1.00 1.00 C ATOM 1376 O HIS A 93 13.713 30.058 -11.970 1.00 1.00 O ATOM 1377 CB HIS A 93 13.853 29.502 -8.669 1.00 1.00 C ATOM 1378 CG HIS A 93 14.628 29.140 -7.444 1.00 1.00 C ATOM 1379 ND1 HIS A 93 14.115 29.256 -6.175 1.00 1.00 N ATOM 1380 CD2 HIS A 93 15.886 28.671 -7.296 1.00 1.00 C ATOM 1381 CE1 HIS A 93 15.023 28.881 -5.299 1.00 1.00 C ATOM 1382 NE2 HIS A 93 16.114 28.520 -5.949 1.00 1.00 N ATOM 0 H HIS A 93 15.488 31.371 -8.290 1.00 1.00 H new ATOM 0 HA HIS A 93 15.359 29.361 -10.183 1.00 1.00 H new ATOM 0 HB2 HIS A 93 13.062 30.198 -8.391 1.00 1.00 H new ATOM 0 HB3 HIS A 93 13.368 28.606 -9.056 1.00 1.00 H new ATOM 0 HD1 HIS A 93 13.176 29.582 -5.947 1.00 1.00 H new ATOM 0 HD2 HIS A 93 16.585 28.454 -8.091 1.00 1.00 H new ATOM 0 HE1 HIS A 93 14.897 28.870 -4.226 1.00 1.00 H new ATOM 1391 N ALA A 94 13.116 31.772 -10.634 1.00 1.00 N ATOM 1392 CA ALA A 94 12.211 32.374 -11.609 1.00 1.00 C ATOM 1393 C ALA A 94 12.949 32.700 -12.901 1.00 1.00 C ATOM 1394 O ALA A 94 12.446 32.454 -14.002 1.00 1.00 O ATOM 1395 CB ALA A 94 11.564 33.631 -11.038 1.00 1.00 C ATOM 0 H ALA A 94 13.192 32.287 -9.757 1.00 1.00 H new ATOM 0 HA ALA A 94 11.426 31.651 -11.833 1.00 1.00 H new ATOM 0 HB1 ALA A 94 10.893 34.064 -11.780 1.00 1.00 H new ATOM 0 HB2 ALA A 94 10.997 33.374 -10.143 1.00 1.00 H new ATOM 0 HB3 ALA A 94 12.338 34.355 -10.782 1.00 1.00 H new ATOM 1401 N ARG A 95 14.151 33.251 -12.750 1.00 1.00 N ATOM 1402 CA ARG A 95 14.986 33.601 -13.886 1.00 1.00 C ATOM 1403 C ARG A 95 15.277 32.393 -14.749 1.00 1.00 C ATOM 1404 O ARG A 95 15.071 32.430 -15.959 1.00 1.00 O ATOM 1405 CB ARG A 95 16.309 34.221 -13.427 1.00 1.00 C ATOM 1406 CG ARG A 95 17.414 34.087 -14.462 1.00 1.00 C ATOM 1407 CD ARG A 95 18.596 34.981 -14.149 1.00 1.00 C ATOM 1408 NE ARG A 95 19.589 34.308 -13.310 1.00 1.00 N ATOM 1409 CZ ARG A 95 20.664 34.911 -12.797 1.00 1.00 C ATOM 1410 NH1 ARG A 95 20.848 36.212 -12.964 1.00 1.00 N ATOM 1411 NH2 ARG A 95 21.565 34.207 -12.118 1.00 1.00 N ATOM 0 H ARG A 95 14.567 33.464 -11.843 1.00 1.00 H new ATOM 0 HA ARG A 95 14.432 34.332 -14.475 1.00 1.00 H new ATOM 0 HB2 ARG A 95 16.152 35.276 -13.204 1.00 1.00 H new ATOM 0 HB3 ARG A 95 16.626 33.743 -12.500 1.00 1.00 H new ATOM 0 HG2 ARG A 95 17.746 33.050 -14.506 1.00 1.00 H new ATOM 0 HG3 ARG A 95 17.020 34.338 -15.447 1.00 1.00 H new ATOM 0 HD2 ARG A 95 19.065 35.300 -15.080 1.00 1.00 H new ATOM 0 HD3 ARG A 95 18.245 35.881 -13.644 1.00 1.00 H new ATOM 0 HE ARG A 95 19.451 33.318 -13.105 1.00 1.00 H new ATOM 0 HH11 ARG A 95 20.166 36.760 -13.488 1.00 1.00 H new ATOM 0 HH12 ARG A 95 21.672 36.665 -12.569 1.00 1.00 H new ATOM 0 HH21 ARG A 95 21.436 33.204 -11.988 1.00 1.00 H new ATOM 0 HH22 ARG A 95 22.385 34.670 -11.727 1.00 1.00 H new ATOM 1425 N LEU A 96 15.672 31.303 -14.110 1.00 1.00 N ATOM 1426 CA LEU A 96 16.077 30.114 -14.833 1.00 1.00 C ATOM 1427 C LEU A 96 14.920 29.577 -15.647 1.00 1.00 C ATOM 1428 O LEU A 96 15.036 29.419 -16.850 1.00 1.00 O ATOM 1429 CB LEU A 96 16.582 29.038 -13.870 1.00 1.00 C ATOM 1430 CG LEU A 96 17.656 29.499 -12.884 1.00 1.00 C ATOM 1431 CD1 LEU A 96 18.116 28.348 -12.002 1.00 1.00 C ATOM 1432 CD2 LEU A 96 18.839 30.114 -13.618 1.00 1.00 C ATOM 0 H LEU A 96 15.720 31.220 -13.095 1.00 1.00 H new ATOM 0 HA LEU A 96 16.891 30.385 -15.506 1.00 1.00 H new ATOM 0 HB2 LEU A 96 15.734 28.652 -13.304 1.00 1.00 H new ATOM 0 HB3 LEU A 96 16.980 28.208 -14.454 1.00 1.00 H new ATOM 0 HG LEU A 96 17.215 30.263 -12.244 1.00 1.00 H new ATOM 0 HD11 LEU A 96 18.880 28.703 -11.310 1.00 1.00 H new ATOM 0 HD12 LEU A 96 17.268 27.960 -11.438 1.00 1.00 H new ATOM 0 HD13 LEU A 96 18.531 27.555 -12.625 1.00 1.00 H new ATOM 0 HD21 LEU A 96 19.589 30.434 -12.895 1.00 1.00 H new ATOM 0 HD22 LEU A 96 19.275 29.374 -14.290 1.00 1.00 H new ATOM 0 HD23 LEU A 96 18.501 30.975 -14.196 1.00 1.00 H new ATOM 1444 N LEU A 97 13.774 29.442 -15.000 1.00 1.00 N ATOM 1445 CA LEU A 97 12.577 28.895 -15.634 1.00 1.00 C ATOM 1446 C LEU A 97 12.234 29.632 -16.927 1.00 1.00 C ATOM 1447 O LEU A 97 12.175 29.030 -17.999 1.00 1.00 O ATOM 1448 CB LEU A 97 11.386 29.021 -14.682 1.00 1.00 C ATOM 1449 CG LEU A 97 11.619 28.503 -13.269 1.00 1.00 C ATOM 1450 CD1 LEU A 97 10.447 28.848 -12.368 1.00 1.00 C ATOM 1451 CD2 LEU A 97 11.856 27.011 -13.285 1.00 1.00 C ATOM 0 H LEU A 97 13.643 29.706 -14.024 1.00 1.00 H new ATOM 0 HA LEU A 97 12.781 27.850 -15.867 1.00 1.00 H new ATOM 0 HB2 LEU A 97 11.100 30.071 -14.623 1.00 1.00 H new ATOM 0 HB3 LEU A 97 10.541 28.484 -15.112 1.00 1.00 H new ATOM 0 HG LEU A 97 12.509 28.990 -12.870 1.00 1.00 H new ATOM 0 HD11 LEU A 97 10.636 28.468 -11.364 1.00 1.00 H new ATOM 0 HD12 LEU A 97 10.324 29.930 -12.329 1.00 1.00 H new ATOM 0 HD13 LEU A 97 9.538 28.394 -12.763 1.00 1.00 H new ATOM 0 HD21 LEU A 97 12.021 26.658 -12.267 1.00 1.00 H new ATOM 0 HD22 LEU A 97 10.985 26.509 -13.707 1.00 1.00 H new ATOM 0 HD23 LEU A 97 12.733 26.788 -13.893 1.00 1.00 H new ATOM 1463 N ARG A 98 12.029 30.940 -16.820 1.00 1.00 N ATOM 1464 CA ARG A 98 11.623 31.748 -17.964 1.00 1.00 C ATOM 1465 C ARG A 98 12.651 31.676 -19.098 1.00 1.00 C ATOM 1466 O ARG A 98 12.287 31.507 -20.259 1.00 1.00 O ATOM 1467 CB ARG A 98 11.391 33.201 -17.531 1.00 1.00 C ATOM 1468 CG ARG A 98 12.657 33.917 -17.113 1.00 1.00 C ATOM 1469 CD ARG A 98 12.375 35.099 -16.212 1.00 1.00 C ATOM 1470 NE ARG A 98 13.504 36.027 -16.196 1.00 1.00 N ATOM 1471 CZ ARG A 98 13.599 37.089 -15.402 1.00 1.00 C ATOM 1472 NH1 ARG A 98 12.607 37.423 -14.590 1.00 1.00 N ATOM 1473 NH2 ARG A 98 14.695 37.832 -15.441 1.00 1.00 N ATOM 0 H ARG A 98 12.137 31.464 -15.952 1.00 1.00 H new ATOM 0 HA ARG A 98 10.687 31.342 -18.347 1.00 1.00 H new ATOM 0 HB2 ARG A 98 10.929 33.747 -18.353 1.00 1.00 H new ATOM 0 HB3 ARG A 98 10.684 33.216 -16.701 1.00 1.00 H new ATOM 0 HG2 ARG A 98 13.314 33.217 -16.596 1.00 1.00 H new ATOM 0 HG3 ARG A 98 13.189 34.258 -18.001 1.00 1.00 H new ATOM 0 HD2 ARG A 98 11.479 35.617 -16.555 1.00 1.00 H new ATOM 0 HD3 ARG A 98 12.173 34.749 -15.200 1.00 1.00 H new ATOM 0 HE ARG A 98 14.274 35.847 -16.840 1.00 1.00 H new ATOM 0 HH11 ARG A 98 11.755 36.862 -14.568 1.00 1.00 H new ATOM 0 HH12 ARG A 98 12.695 38.241 -13.987 1.00 1.00 H new ATOM 0 HH21 ARG A 98 15.455 37.587 -16.076 1.00 1.00 H new ATOM 0 HH22 ARG A 98 14.779 38.649 -14.836 1.00 1.00 H new ATOM 1487 N GLN A 99 13.936 31.789 -18.764 1.00 1.00 N ATOM 1488 CA GLN A 99 14.984 31.733 -19.779 1.00 1.00 C ATOM 1489 C GLN A 99 15.135 30.320 -20.341 1.00 1.00 C ATOM 1490 O GLN A 99 15.687 30.127 -21.428 1.00 1.00 O ATOM 1491 CB GLN A 99 16.323 32.268 -19.240 1.00 1.00 C ATOM 1492 CG GLN A 99 16.908 31.496 -18.070 1.00 1.00 C ATOM 1493 CD GLN A 99 18.334 31.905 -17.758 1.00 1.00 C ATOM 1494 OE1 GLN A 99 18.733 33.050 -17.978 1.00 1.00 O ATOM 1495 NE2 GLN A 99 19.113 30.970 -17.238 1.00 1.00 N ATOM 0 H GLN A 99 14.273 31.918 -17.810 1.00 1.00 H new ATOM 0 HA GLN A 99 14.681 32.385 -20.598 1.00 1.00 H new ATOM 0 HB2 GLN A 99 17.049 32.268 -20.053 1.00 1.00 H new ATOM 0 HB3 GLN A 99 16.185 33.306 -18.936 1.00 1.00 H new ATOM 0 HG2 GLN A 99 16.287 31.654 -17.188 1.00 1.00 H new ATOM 0 HG3 GLN A 99 16.880 30.429 -18.293 1.00 1.00 H new ATOM 0 HE21 GLN A 99 18.744 30.034 -17.071 1.00 1.00 H new ATOM 0 HE22 GLN A 99 20.082 31.186 -17.004 1.00 1.00 H new ATOM 1504 N LEU A 100 14.623 29.341 -19.604 1.00 1.00 N ATOM 1505 CA LEU A 100 14.679 27.947 -20.019 1.00 1.00 C ATOM 1506 C LEU A 100 13.601 27.621 -21.050 1.00 1.00 C ATOM 1507 O LEU A 100 13.597 26.533 -21.622 1.00 1.00 O ATOM 1508 CB LEU A 100 14.562 27.016 -18.805 1.00 1.00 C ATOM 1509 CG LEU A 100 15.801 26.955 -17.908 1.00 1.00 C ATOM 1510 CD1 LEU A 100 15.853 25.636 -17.153 1.00 1.00 C ATOM 1511 CD2 LEU A 100 17.070 27.179 -18.720 1.00 1.00 C ATOM 0 H LEU A 100 14.160 29.491 -18.707 1.00 1.00 H new ATOM 0 HA LEU A 100 15.647 27.785 -20.492 1.00 1.00 H new ATOM 0 HB2 LEU A 100 13.712 27.336 -18.202 1.00 1.00 H new ATOM 0 HB3 LEU A 100 14.340 26.009 -19.159 1.00 1.00 H new ATOM 0 HG LEU A 100 15.733 27.758 -17.174 1.00 1.00 H new ATOM 0 HD11 LEU A 100 16.741 25.613 -16.521 1.00 1.00 H new ATOM 0 HD12 LEU A 100 14.963 25.537 -16.531 1.00 1.00 H new ATOM 0 HD13 LEU A 100 15.892 24.811 -17.864 1.00 1.00 H new ATOM 0 HD21 LEU A 100 17.937 27.131 -18.061 1.00 1.00 H new ATOM 0 HD22 LEU A 100 17.153 26.407 -19.485 1.00 1.00 H new ATOM 0 HD23 LEU A 100 17.029 28.159 -19.196 1.00 1.00 H new ATOM 1523 N GLY A 101 12.691 28.557 -21.292 1.00 1.00 N ATOM 1524 CA GLY A 101 11.646 28.318 -22.269 1.00 1.00 C ATOM 1525 C GLY A 101 10.342 28.989 -21.914 1.00 1.00 C ATOM 1526 O GLY A 101 9.556 29.351 -22.792 1.00 1.00 O ATOM 0 H GLY A 101 12.657 29.468 -20.835 1.00 1.00 H new ATOM 0 HA2 GLY A 101 11.979 28.676 -23.243 1.00 1.00 H new ATOM 0 HA3 GLY A 101 11.482 27.244 -22.362 1.00 1.00 H new ATOM 1530 N VAL A 102 10.110 29.127 -20.623 1.00 1.00 N ATOM 1531 CA VAL A 102 8.890 29.728 -20.102 1.00 1.00 C ATOM 1532 C VAL A 102 8.895 31.246 -20.315 1.00 1.00 C ATOM 1533 O VAL A 102 9.591 31.763 -21.190 1.00 1.00 O ATOM 1534 CB VAL A 102 8.721 29.412 -18.602 1.00 1.00 C ATOM 1535 CG1 VAL A 102 7.268 29.473 -18.182 1.00 1.00 C ATOM 1536 CG2 VAL A 102 9.304 28.058 -18.261 1.00 1.00 C ATOM 0 H VAL A 102 10.763 28.825 -19.900 1.00 1.00 H new ATOM 0 HA VAL A 102 8.050 29.300 -20.649 1.00 1.00 H new ATOM 0 HB VAL A 102 9.268 30.176 -18.049 1.00 1.00 H new ATOM 0 HG11 VAL A 102 7.187 29.245 -17.119 1.00 1.00 H new ATOM 0 HG12 VAL A 102 6.877 30.473 -18.370 1.00 1.00 H new ATOM 0 HG13 VAL A 102 6.693 28.745 -18.754 1.00 1.00 H new ATOM 0 HG21 VAL A 102 9.171 27.862 -17.197 1.00 1.00 H new ATOM 0 HG22 VAL A 102 8.795 27.287 -18.839 1.00 1.00 H new ATOM 0 HG23 VAL A 102 10.367 28.049 -18.501 1.00 1.00 H new ATOM 1546 N GLU A 103 8.157 31.953 -19.477 1.00 1.00 N ATOM 1547 CA GLU A 103 8.022 33.394 -19.582 1.00 1.00 C ATOM 1548 C GLU A 103 7.443 33.932 -18.284 1.00 1.00 C ATOM 1549 O GLU A 103 6.921 33.165 -17.471 1.00 1.00 O ATOM 1550 CB GLU A 103 7.094 33.757 -20.749 1.00 1.00 C ATOM 1551 CG GLU A 103 5.673 33.250 -20.581 1.00 1.00 C ATOM 1552 CD GLU A 103 4.821 33.455 -21.816 1.00 1.00 C ATOM 1553 OE1 GLU A 103 4.555 34.625 -22.171 1.00 1.00 O ATOM 1554 OE2 GLU A 103 4.402 32.450 -22.421 1.00 1.00 O ATOM 0 H GLU A 103 7.634 31.543 -18.703 1.00 1.00 H new ATOM 0 HA GLU A 103 9.002 33.836 -19.764 1.00 1.00 H new ATOM 0 HB2 GLU A 103 7.072 34.841 -20.860 1.00 1.00 H new ATOM 0 HB3 GLU A 103 7.509 33.350 -21.671 1.00 1.00 H new ATOM 0 HG2 GLU A 103 5.699 32.188 -20.336 1.00 1.00 H new ATOM 0 HG3 GLU A 103 5.209 33.760 -19.737 1.00 1.00 H new ATOM 1561 N ALA A 104 7.538 35.239 -18.096 1.00 1.00 N ATOM 1562 CA ALA A 104 7.086 35.879 -16.862 1.00 1.00 C ATOM 1563 C ALA A 104 5.577 35.749 -16.684 1.00 1.00 C ATOM 1564 O ALA A 104 5.056 35.902 -15.576 1.00 1.00 O ATOM 1565 CB ALA A 104 7.501 37.339 -16.835 1.00 1.00 C ATOM 0 H ALA A 104 7.926 35.884 -18.784 1.00 1.00 H new ATOM 0 HA ALA A 104 7.564 35.364 -16.029 1.00 1.00 H new ATOM 0 HB1 ALA A 104 7.156 37.798 -15.909 1.00 1.00 H new ATOM 0 HB2 ALA A 104 8.587 37.410 -16.892 1.00 1.00 H new ATOM 0 HB3 ALA A 104 7.059 37.859 -17.685 1.00 1.00 H new ATOM 1571 N ALA A 105 4.871 35.585 -17.792 1.00 1.00 N ATOM 1572 CA ALA A 105 3.437 35.347 -17.746 1.00 1.00 C ATOM 1573 C ALA A 105 3.137 34.097 -16.936 1.00 1.00 C ATOM 1574 O ALA A 105 2.156 34.035 -16.196 1.00 1.00 O ATOM 1575 CB ALA A 105 2.870 35.215 -19.149 1.00 1.00 C ATOM 0 H ALA A 105 5.267 35.612 -18.732 1.00 1.00 H new ATOM 0 HA ALA A 105 2.962 36.201 -17.263 1.00 1.00 H new ATOM 0 HB1 ALA A 105 1.796 35.037 -19.092 1.00 1.00 H new ATOM 0 HB2 ALA A 105 3.057 36.134 -19.705 1.00 1.00 H new ATOM 0 HB3 ALA A 105 3.350 34.379 -19.658 1.00 1.00 H new ATOM 1581 N ARG A 106 4.027 33.117 -17.057 1.00 1.00 N ATOM 1582 CA ARG A 106 3.855 31.835 -16.394 1.00 1.00 C ATOM 1583 C ARG A 106 4.627 31.789 -15.090 1.00 1.00 C ATOM 1584 O ARG A 106 4.121 31.315 -14.079 1.00 1.00 O ATOM 1585 CB ARG A 106 4.324 30.700 -17.303 1.00 1.00 C ATOM 1586 CG ARG A 106 4.012 30.944 -18.774 1.00 1.00 C ATOM 1587 CD ARG A 106 4.088 29.670 -19.592 1.00 1.00 C ATOM 1588 NE ARG A 106 3.147 29.686 -20.714 1.00 1.00 N ATOM 1589 CZ ARG A 106 1.880 29.272 -20.628 1.00 1.00 C ATOM 1590 NH1 ARG A 106 1.415 28.802 -19.479 1.00 1.00 N ATOM 1591 NH2 ARG A 106 1.085 29.319 -21.692 1.00 1.00 N ATOM 0 H ARG A 106 4.879 33.190 -17.613 1.00 1.00 H new ATOM 0 HA ARG A 106 2.794 31.711 -16.177 1.00 1.00 H new ATOM 0 HB2 ARG A 106 5.399 30.567 -17.183 1.00 1.00 H new ATOM 0 HB3 ARG A 106 3.851 29.770 -16.987 1.00 1.00 H new ATOM 0 HG2 ARG A 106 3.015 31.374 -18.866 1.00 1.00 H new ATOM 0 HG3 ARG A 106 4.713 31.675 -19.176 1.00 1.00 H new ATOM 0 HD2 ARG A 106 5.102 29.541 -19.970 1.00 1.00 H new ATOM 0 HD3 ARG A 106 3.875 28.814 -18.952 1.00 1.00 H new ATOM 0 HE ARG A 106 3.479 30.034 -21.614 1.00 1.00 H new ATOM 0 HH11 ARG A 106 2.024 28.757 -18.662 1.00 1.00 H new ATOM 0 HH12 ARG A 106 0.448 28.485 -19.412 1.00 1.00 H new ATOM 0 HH21 ARG A 106 1.442 29.672 -22.580 1.00 1.00 H new ATOM 0 HH22 ARG A 106 0.118 29.002 -21.621 1.00 1.00 H new ATOM 1605 N VAL A 107 5.850 32.294 -15.102 1.00 1.00 N ATOM 1606 CA VAL A 107 6.682 32.248 -13.920 1.00 1.00 C ATOM 1607 C VAL A 107 6.300 33.379 -12.969 1.00 1.00 C ATOM 1608 O VAL A 107 6.282 34.550 -13.342 1.00 1.00 O ATOM 1609 CB VAL A 107 8.191 32.333 -14.270 1.00 1.00 C ATOM 1610 CG1 VAL A 107 8.565 33.704 -14.772 1.00 1.00 C ATOM 1611 CG2 VAL A 107 9.044 31.949 -13.075 1.00 1.00 C ATOM 0 H VAL A 107 6.282 32.737 -15.913 1.00 1.00 H new ATOM 0 HA VAL A 107 6.511 31.288 -13.433 1.00 1.00 H new ATOM 0 HB VAL A 107 8.383 31.622 -15.073 1.00 1.00 H new ATOM 0 HG11 VAL A 107 9.629 33.727 -15.008 1.00 1.00 H new ATOM 0 HG12 VAL A 107 7.990 33.932 -15.669 1.00 1.00 H new ATOM 0 HG13 VAL A 107 8.347 34.445 -14.003 1.00 1.00 H new ATOM 0 HG21 VAL A 107 10.098 32.016 -13.344 1.00 1.00 H new ATOM 0 HG22 VAL A 107 8.837 32.627 -12.247 1.00 1.00 H new ATOM 0 HG23 VAL A 107 8.810 30.928 -12.774 1.00 1.00 H new ATOM 1621 N ARG A 108 5.922 33.018 -11.760 1.00 1.00 N ATOM 1622 CA ARG A 108 5.517 33.998 -10.770 1.00 1.00 C ATOM 1623 C ARG A 108 6.108 33.625 -9.419 1.00 1.00 C ATOM 1624 O ARG A 108 6.288 32.451 -9.106 1.00 1.00 O ATOM 1625 CB ARG A 108 3.985 34.089 -10.659 1.00 1.00 C ATOM 1626 CG ARG A 108 3.255 34.186 -11.994 1.00 1.00 C ATOM 1627 CD ARG A 108 3.517 35.508 -12.700 1.00 1.00 C ATOM 1628 NE ARG A 108 2.688 36.598 -12.183 1.00 1.00 N ATOM 1629 CZ ARG A 108 2.468 37.734 -12.843 1.00 1.00 C ATOM 1630 NH1 ARG A 108 3.038 37.932 -14.028 1.00 1.00 N ATOM 1631 NH2 ARG A 108 1.683 38.667 -12.314 1.00 1.00 N ATOM 0 H ARG A 108 5.886 32.051 -11.438 1.00 1.00 H new ATOM 0 HA ARG A 108 5.888 34.973 -11.085 1.00 1.00 H new ATOM 0 HB2 ARG A 108 3.620 33.212 -10.124 1.00 1.00 H new ATOM 0 HB3 ARG A 108 3.729 34.960 -10.056 1.00 1.00 H new ATOM 0 HG2 ARG A 108 3.569 33.364 -12.638 1.00 1.00 H new ATOM 0 HG3 ARG A 108 2.184 34.071 -11.829 1.00 1.00 H new ATOM 0 HD2 ARG A 108 4.569 35.772 -12.589 1.00 1.00 H new ATOM 0 HD3 ARG A 108 3.329 35.389 -13.767 1.00 1.00 H new ATOM 0 HE ARG A 108 2.255 36.481 -11.267 1.00 1.00 H new ATOM 0 HH11 ARG A 108 3.642 37.215 -14.430 1.00 1.00 H new ATOM 0 HH12 ARG A 108 2.871 38.801 -14.535 1.00 1.00 H new ATOM 0 HH21 ARG A 108 1.250 38.513 -11.404 1.00 1.00 H new ATOM 0 HH22 ARG A 108 1.514 39.537 -12.818 1.00 1.00 H new ATOM 1645 N MET A 109 6.432 34.628 -8.641 1.00 1.00 N ATOM 1646 CA MET A 109 7.004 34.410 -7.321 1.00 1.00 C ATOM 1647 C MET A 109 5.914 34.018 -6.333 1.00 1.00 C ATOM 1648 O MET A 109 4.833 34.598 -6.352 1.00 1.00 O ATOM 1649 CB MET A 109 7.720 35.672 -6.852 1.00 1.00 C ATOM 1650 CG MET A 109 8.913 36.047 -7.718 1.00 1.00 C ATOM 1651 SD MET A 109 10.290 34.905 -7.523 1.00 1.00 S ATOM 1652 CE MET A 109 10.555 35.051 -5.766 1.00 1.00 C ATOM 0 H MET A 109 6.312 35.609 -8.893 1.00 1.00 H new ATOM 0 HA MET A 109 7.727 33.596 -7.377 1.00 1.00 H new ATOM 0 HB2 MET A 109 7.012 36.501 -6.843 1.00 1.00 H new ATOM 0 HB3 MET A 109 8.056 35.530 -5.825 1.00 1.00 H new ATOM 0 HG2 MET A 109 8.607 36.067 -8.764 1.00 1.00 H new ATOM 0 HG3 MET A 109 9.241 37.054 -7.462 1.00 1.00 H new ATOM 0 HE1 MET A 109 11.624 35.111 -5.563 1.00 1.00 H new ATOM 0 HE2 MET A 109 10.064 35.952 -5.398 1.00 1.00 H new ATOM 0 HE3 MET A 109 10.139 34.179 -5.262 1.00 1.00 H new ATOM 1662 N LEU A 110 6.204 33.064 -5.455 1.00 1.00 N ATOM 1663 CA LEU A 110 5.229 32.605 -4.464 1.00 1.00 C ATOM 1664 C LEU A 110 4.718 33.768 -3.617 1.00 1.00 C ATOM 1665 O LEU A 110 3.512 33.978 -3.508 1.00 1.00 O ATOM 1666 CB LEU A 110 5.863 31.511 -3.579 1.00 1.00 C ATOM 1667 CG LEU A 110 4.932 30.781 -2.587 1.00 1.00 C ATOM 1668 CD1 LEU A 110 4.749 31.586 -1.307 1.00 1.00 C ATOM 1669 CD2 LEU A 110 3.580 30.481 -3.226 1.00 1.00 C ATOM 0 H LEU A 110 7.106 32.591 -5.407 1.00 1.00 H new ATOM 0 HA LEU A 110 4.371 32.181 -4.986 1.00 1.00 H new ATOM 0 HB2 LEU A 110 6.312 30.764 -4.234 1.00 1.00 H new ATOM 0 HB3 LEU A 110 6.675 31.965 -3.010 1.00 1.00 H new ATOM 0 HG LEU A 110 5.407 29.835 -2.327 1.00 1.00 H new ATOM 0 HD11 LEU A 110 4.088 31.046 -0.629 1.00 1.00 H new ATOM 0 HD12 LEU A 110 5.717 31.734 -0.829 1.00 1.00 H new ATOM 0 HD13 LEU A 110 4.310 32.555 -1.546 1.00 1.00 H new ATOM 0 HD21 LEU A 110 2.943 29.967 -2.506 1.00 1.00 H new ATOM 0 HD22 LEU A 110 3.105 31.414 -3.528 1.00 1.00 H new ATOM 0 HD23 LEU A 110 3.724 29.847 -4.101 1.00 1.00 H new ATOM 1681 N ARG A 111 5.634 34.585 -3.108 1.00 1.00 N ATOM 1682 CA ARG A 111 5.251 35.713 -2.265 1.00 1.00 C ATOM 1683 C ARG A 111 4.580 36.795 -3.096 1.00 1.00 C ATOM 1684 O ARG A 111 3.885 37.658 -2.568 1.00 1.00 O ATOM 1685 CB ARG A 111 6.455 36.316 -1.545 1.00 1.00 C ATOM 1686 CG ARG A 111 6.050 37.389 -0.549 1.00 1.00 C ATOM 1687 CD ARG A 111 7.231 38.195 -0.041 1.00 1.00 C ATOM 1688 NE ARG A 111 6.831 39.063 1.066 1.00 1.00 N ATOM 1689 CZ ARG A 111 7.307 38.955 2.308 1.00 1.00 C ATOM 1690 NH1 ARG A 111 8.274 38.082 2.575 1.00 1.00 N ATOM 1691 NH2 ARG A 111 6.824 39.726 3.279 1.00 1.00 N ATOM 0 H ARG A 111 6.638 34.490 -3.262 1.00 1.00 H new ATOM 0 HA ARG A 111 4.554 35.332 -1.519 1.00 1.00 H new ATOM 0 HB2 ARG A 111 6.998 35.527 -1.025 1.00 1.00 H new ATOM 0 HB3 ARG A 111 7.138 36.743 -2.279 1.00 1.00 H new ATOM 0 HG2 ARG A 111 5.332 38.061 -1.018 1.00 1.00 H new ATOM 0 HG3 ARG A 111 5.544 36.922 0.296 1.00 1.00 H new ATOM 0 HD2 ARG A 111 8.022 37.521 0.287 1.00 1.00 H new ATOM 0 HD3 ARG A 111 7.641 38.798 -0.851 1.00 1.00 H new ATOM 0 HE ARG A 111 6.147 39.795 0.877 1.00 1.00 H new ATOM 0 HH11 ARG A 111 8.651 37.496 1.831 1.00 1.00 H new ATOM 0 HH12 ARG A 111 8.638 37.999 3.524 1.00 1.00 H new ATOM 0 HH21 ARG A 111 6.088 40.402 3.075 1.00 1.00 H new ATOM 0 HH22 ARG A 111 7.190 39.641 4.227 1.00 1.00 H new ATOM 1705 N SER A 112 4.769 36.731 -4.403 1.00 1.00 N ATOM 1706 CA SER A 112 4.184 37.713 -5.291 1.00 1.00 C ATOM 1707 C SER A 112 2.670 37.530 -5.371 1.00 1.00 C ATOM 1708 O SER A 112 1.970 38.392 -5.903 1.00 1.00 O ATOM 1709 CB SER A 112 4.833 37.642 -6.679 1.00 1.00 C ATOM 1710 OG SER A 112 4.173 38.481 -7.607 1.00 1.00 O ATOM 0 H SER A 112 5.321 36.011 -4.869 1.00 1.00 H new ATOM 0 HA SER A 112 4.377 38.707 -4.887 1.00 1.00 H new ATOM 0 HB2 SER A 112 5.881 37.933 -6.606 1.00 1.00 H new ATOM 0 HB3 SER A 112 4.812 36.613 -7.039 1.00 1.00 H new ATOM 0 HG SER A 112 3.303 38.750 -7.244 1.00 1.00 H new ATOM 1716 N PHE A 113 2.153 36.408 -4.862 1.00 1.00 N ATOM 1717 CA PHE A 113 0.716 36.180 -4.817 1.00 1.00 C ATOM 1718 C PHE A 113 0.143 36.694 -3.496 1.00 1.00 C ATOM 1719 O PHE A 113 -1.034 37.041 -3.413 1.00 1.00 O ATOM 1720 CB PHE A 113 0.429 34.678 -4.936 1.00 1.00 C ATOM 1721 CG PHE A 113 0.805 34.066 -6.257 1.00 1.00 C ATOM 1722 CD1 PHE A 113 -0.053 34.144 -7.343 1.00 1.00 C ATOM 1723 CD2 PHE A 113 2.009 33.396 -6.408 1.00 1.00 C ATOM 1724 CE1 PHE A 113 0.285 33.567 -8.549 1.00 1.00 C ATOM 1725 CE2 PHE A 113 2.349 32.819 -7.614 1.00 1.00 C ATOM 1726 CZ PHE A 113 1.486 32.904 -8.686 1.00 1.00 C ATOM 0 H PHE A 113 2.712 35.647 -4.477 1.00 1.00 H new ATOM 0 HA PHE A 113 0.250 36.713 -5.645 1.00 1.00 H new ATOM 0 HB2 PHE A 113 0.966 34.156 -4.144 1.00 1.00 H new ATOM 0 HB3 PHE A 113 -0.634 34.511 -4.764 1.00 1.00 H new ATOM 0 HD1 PHE A 113 -0.996 34.662 -7.244 1.00 1.00 H new ATOM 0 HD2 PHE A 113 2.689 33.325 -5.572 1.00 1.00 H new ATOM 0 HE1 PHE A 113 -0.392 33.635 -9.388 1.00 1.00 H new ATOM 0 HE2 PHE A 113 3.291 32.301 -7.718 1.00 1.00 H new ATOM 0 HZ PHE A 113 1.750 32.452 -9.631 1.00 1.00 H new ATOM 1736 N ASP A 114 0.999 36.740 -2.480 1.00 1.00 N ATOM 1737 CA ASP A 114 0.604 37.154 -1.133 1.00 1.00 C ATOM 1738 C ASP A 114 0.121 38.600 -1.105 1.00 1.00 C ATOM 1739 O ASP A 114 0.848 39.514 -1.497 1.00 1.00 O ATOM 1740 CB ASP A 114 1.784 36.972 -0.162 1.00 1.00 C ATOM 1741 CG ASP A 114 1.522 37.541 1.221 1.00 1.00 C ATOM 1742 OD1 ASP A 114 0.357 37.534 1.668 1.00 1.00 O ATOM 1743 OD2 ASP A 114 2.486 38.017 1.858 1.00 1.00 O ATOM 0 H ASP A 114 1.985 36.492 -2.564 1.00 1.00 H new ATOM 0 HA ASP A 114 -0.227 36.522 -0.820 1.00 1.00 H new ATOM 0 HB2 ASP A 114 2.010 35.910 -0.072 1.00 1.00 H new ATOM 0 HB3 ASP A 114 2.668 37.452 -0.582 1.00 1.00 H new ATOM 2056 N GLU A 136 7.393 27.224 10.670 1.00 1.00 N ATOM 2057 CA GLU A 136 6.049 27.750 10.531 1.00 1.00 C ATOM 2058 C GLU A 136 6.065 29.163 9.949 1.00 1.00 C ATOM 2059 O GLU A 136 5.030 29.675 9.521 1.00 1.00 O ATOM 2060 CB GLU A 136 5.313 27.711 11.870 1.00 1.00 C ATOM 2061 CG GLU A 136 5.159 26.299 12.410 1.00 1.00 C ATOM 2062 CD GLU A 136 3.892 26.109 13.214 1.00 1.00 C ATOM 2063 OE1 GLU A 136 2.795 26.176 12.616 1.00 1.00 O ATOM 2064 OE2 GLU A 136 3.985 25.863 14.435 1.00 1.00 O ATOM 0 HA GLU A 136 5.508 27.114 9.830 1.00 1.00 H new ATOM 0 HB2 GLU A 136 5.855 28.317 12.596 1.00 1.00 H new ATOM 0 HB3 GLU A 136 4.327 28.161 11.752 1.00 1.00 H new ATOM 0 HG2 GLU A 136 5.164 25.595 11.578 1.00 1.00 H new ATOM 0 HG3 GLU A 136 6.019 26.059 13.035 1.00 1.00 H new ATOM 2071 N GLU A 137 7.231 29.805 9.960 1.00 1.00 N ATOM 2072 CA GLU A 137 7.382 31.106 9.317 1.00 1.00 C ATOM 2073 C GLU A 137 7.188 30.921 7.820 1.00 1.00 C ATOM 2074 O GLU A 137 6.415 31.636 7.183 1.00 1.00 O ATOM 2075 CB GLU A 137 8.761 31.708 9.600 1.00 1.00 C ATOM 2076 CG GLU A 137 8.981 33.061 8.941 1.00 1.00 C ATOM 2077 CD GLU A 137 8.098 34.142 9.528 1.00 1.00 C ATOM 2078 OE1 GLU A 137 8.101 34.316 10.764 1.00 1.00 O ATOM 2079 OE2 GLU A 137 7.384 34.814 8.757 1.00 1.00 O ATOM 0 H GLU A 137 8.078 29.449 10.403 1.00 1.00 H new ATOM 0 HA GLU A 137 6.638 31.795 9.716 1.00 1.00 H new ATOM 0 HB2 GLU A 137 8.888 31.813 10.677 1.00 1.00 H new ATOM 0 HB3 GLU A 137 9.529 31.016 9.254 1.00 1.00 H new ATOM 0 HG2 GLU A 137 10.026 33.350 9.052 1.00 1.00 H new ATOM 0 HG3 GLU A 137 8.785 32.977 7.872 1.00 1.00 H new ATOM 2086 N VAL A 138 7.857 29.895 7.297 1.00 1.00 N ATOM 2087 CA VAL A 138 7.729 29.498 5.900 1.00 1.00 C ATOM 2088 C VAL A 138 6.275 29.127 5.614 1.00 1.00 C ATOM 2089 O VAL A 138 5.687 29.539 4.616 1.00 1.00 O ATOM 2090 CB VAL A 138 8.642 28.289 5.605 1.00 1.00 C ATOM 2091 CG1 VAL A 138 8.420 27.754 4.196 1.00 1.00 C ATOM 2092 CG2 VAL A 138 10.109 28.644 5.848 1.00 1.00 C ATOM 0 H VAL A 138 8.504 29.316 7.833 1.00 1.00 H new ATOM 0 HA VAL A 138 8.029 30.329 5.261 1.00 1.00 H new ATOM 0 HB VAL A 138 8.375 27.490 6.296 1.00 1.00 H new ATOM 0 HG11 VAL A 138 9.079 26.903 4.022 1.00 1.00 H new ATOM 0 HG12 VAL A 138 7.383 27.438 4.086 1.00 1.00 H new ATOM 0 HG13 VAL A 138 8.640 28.537 3.471 1.00 1.00 H new ATOM 0 HG21 VAL A 138 10.734 27.777 5.634 1.00 1.00 H new ATOM 0 HG22 VAL A 138 10.397 29.468 5.196 1.00 1.00 H new ATOM 0 HG23 VAL A 138 10.244 28.940 6.888 1.00 1.00 H new ATOM 2102 N PHE A 139 5.706 28.368 6.548 1.00 1.00 N ATOM 2103 CA PHE A 139 4.300 27.973 6.492 1.00 1.00 C ATOM 2104 C PHE A 139 3.420 29.211 6.346 1.00 1.00 C ATOM 2105 O PHE A 139 2.497 29.239 5.530 1.00 1.00 O ATOM 2106 CB PHE A 139 3.918 27.181 7.748 1.00 1.00 C ATOM 2107 CG PHE A 139 2.457 26.828 7.852 1.00 1.00 C ATOM 2108 CD1 PHE A 139 1.553 27.702 8.439 1.00 1.00 C ATOM 2109 CD2 PHE A 139 1.995 25.612 7.379 1.00 1.00 C ATOM 2110 CE1 PHE A 139 0.217 27.369 8.551 1.00 1.00 C ATOM 2111 CE2 PHE A 139 0.659 25.273 7.493 1.00 1.00 C ATOM 2112 CZ PHE A 139 -0.230 26.153 8.078 1.00 1.00 C ATOM 0 H PHE A 139 6.205 28.010 7.363 1.00 1.00 H new ATOM 0 HA PHE A 139 4.145 27.330 5.625 1.00 1.00 H new ATOM 0 HB2 PHE A 139 4.502 26.261 7.772 1.00 1.00 H new ATOM 0 HB3 PHE A 139 4.201 27.761 8.626 1.00 1.00 H new ATOM 0 HD1 PHE A 139 1.898 28.655 8.813 1.00 1.00 H new ATOM 0 HD2 PHE A 139 2.684 24.921 6.916 1.00 1.00 H new ATOM 0 HE1 PHE A 139 -0.476 28.060 9.008 1.00 1.00 H new ATOM 0 HE2 PHE A 139 0.311 24.319 7.124 1.00 1.00 H new ATOM 0 HZ PHE A 139 -1.274 25.889 8.165 1.00 1.00 H new ATOM 2122 N ALA A 140 3.759 30.247 7.109 1.00 1.00 N ATOM 2123 CA ALA A 140 3.034 31.509 7.076 1.00 1.00 C ATOM 2124 C ALA A 140 3.161 32.176 5.715 1.00 1.00 C ATOM 2125 O ALA A 140 2.184 32.702 5.191 1.00 1.00 O ATOM 2126 CB ALA A 140 3.542 32.438 8.166 1.00 1.00 C ATOM 0 H ALA A 140 4.541 30.233 7.764 1.00 1.00 H new ATOM 0 HA ALA A 140 1.980 31.298 7.254 1.00 1.00 H new ATOM 0 HB1 ALA A 140 2.991 33.378 8.129 1.00 1.00 H new ATOM 0 HB2 ALA A 140 3.397 31.970 9.140 1.00 1.00 H new ATOM 0 HB3 ALA A 140 4.603 32.634 8.012 1.00 1.00 H new ATOM 2132 N VAL A 141 4.363 32.149 5.147 1.00 1.00 N ATOM 2133 CA VAL A 141 4.592 32.725 3.825 1.00 1.00 C ATOM 2134 C VAL A 141 3.663 32.085 2.804 1.00 1.00 C ATOM 2135 O VAL A 141 2.909 32.765 2.103 1.00 1.00 O ATOM 2136 CB VAL A 141 6.045 32.516 3.332 1.00 1.00 C ATOM 2137 CG1 VAL A 141 6.303 33.330 2.078 1.00 1.00 C ATOM 2138 CG2 VAL A 141 7.072 32.843 4.408 1.00 1.00 C ATOM 0 H VAL A 141 5.190 31.737 5.579 1.00 1.00 H new ATOM 0 HA VAL A 141 4.400 33.794 3.919 1.00 1.00 H new ATOM 0 HB VAL A 141 6.157 31.458 3.095 1.00 1.00 H new ATOM 0 HG11 VAL A 141 7.329 33.171 1.746 1.00 1.00 H new ATOM 0 HG12 VAL A 141 5.615 33.017 1.293 1.00 1.00 H new ATOM 0 HG13 VAL A 141 6.151 34.388 2.293 1.00 1.00 H new ATOM 0 HG21 VAL A 141 8.075 32.681 4.014 1.00 1.00 H new ATOM 0 HG22 VAL A 141 6.964 33.885 4.709 1.00 1.00 H new ATOM 0 HG23 VAL A 141 6.912 32.197 5.272 1.00 1.00 H new ATOM 2148 N ILE A 142 3.703 30.770 2.751 1.00 1.00 N ATOM 2149 CA ILE A 142 2.894 30.015 1.816 1.00 1.00 C ATOM 2150 C ILE A 142 1.399 30.237 2.033 1.00 1.00 C ATOM 2151 O ILE A 142 0.686 30.561 1.092 1.00 1.00 O ATOM 2152 CB ILE A 142 3.217 28.520 1.911 1.00 1.00 C ATOM 2153 CG1 ILE A 142 4.621 28.259 1.351 1.00 1.00 C ATOM 2154 CG2 ILE A 142 2.170 27.707 1.170 1.00 1.00 C ATOM 2155 CD1 ILE A 142 5.466 27.371 2.230 1.00 1.00 C ATOM 0 H ILE A 142 4.294 30.196 3.352 1.00 1.00 H new ATOM 0 HA ILE A 142 3.141 30.378 0.818 1.00 1.00 H new ATOM 0 HB ILE A 142 3.200 28.211 2.956 1.00 1.00 H new ATOM 0 HG12 ILE A 142 4.531 27.801 0.366 1.00 1.00 H new ATOM 0 HG13 ILE A 142 5.131 29.212 1.214 1.00 1.00 H new ATOM 0 HG21 ILE A 142 2.412 26.647 1.246 1.00 1.00 H new ATOM 0 HG22 ILE A 142 1.190 27.888 1.611 1.00 1.00 H new ATOM 0 HG23 ILE A 142 2.156 28.002 0.121 1.00 1.00 H new ATOM 0 HD11 ILE A 142 6.445 27.230 1.771 1.00 1.00 H new ATOM 0 HD12 ILE A 142 5.587 27.837 3.208 1.00 1.00 H new ATOM 0 HD13 ILE A 142 4.977 26.404 2.347 1.00 1.00 H new ATOM 2167 N GLU A 143 0.930 30.057 3.265 1.00 1.00 N ATOM 2168 CA GLU A 143 -0.493 30.233 3.567 1.00 1.00 C ATOM 2169 C GLU A 143 -0.959 31.629 3.156 1.00 1.00 C ATOM 2170 O GLU A 143 -2.103 31.819 2.751 1.00 1.00 O ATOM 2171 CB GLU A 143 -0.776 29.981 5.056 1.00 1.00 C ATOM 2172 CG GLU A 143 -0.404 31.145 5.966 1.00 1.00 C ATOM 2173 CD GLU A 143 -0.696 30.875 7.433 1.00 1.00 C ATOM 2174 OE1 GLU A 143 -1.857 30.561 7.769 1.00 1.00 O ATOM 2175 OE2 GLU A 143 0.234 30.998 8.258 1.00 1.00 O ATOM 0 H GLU A 143 1.505 29.792 4.065 1.00 1.00 H new ATOM 0 HA GLU A 143 -1.055 29.499 2.991 1.00 1.00 H new ATOM 0 HB2 GLU A 143 -1.836 29.761 5.181 1.00 1.00 H new ATOM 0 HB3 GLU A 143 -0.227 29.095 5.374 1.00 1.00 H new ATOM 0 HG2 GLU A 143 0.657 31.365 5.848 1.00 1.00 H new ATOM 0 HG3 GLU A 143 -0.951 32.033 5.651 1.00 1.00 H new ATOM 2182 N SER A 144 -0.048 32.590 3.256 1.00 1.00 N ATOM 2183 CA SER A 144 -0.328 33.969 2.895 1.00 1.00 C ATOM 2184 C SER A 144 -0.422 34.128 1.379 1.00 1.00 C ATOM 2185 O SER A 144 -1.114 35.006 0.878 1.00 1.00 O ATOM 2186 CB SER A 144 0.753 34.884 3.464 1.00 1.00 C ATOM 2187 OG SER A 144 0.737 34.870 4.884 1.00 1.00 O ATOM 0 H SER A 144 0.903 32.433 3.589 1.00 1.00 H new ATOM 0 HA SER A 144 -1.291 34.251 3.321 1.00 1.00 H new ATOM 0 HB2 SER A 144 1.731 34.564 3.105 1.00 1.00 H new ATOM 0 HB3 SER A 144 0.599 35.902 3.105 1.00 1.00 H new ATOM 0 HG SER A 144 1.383 34.210 5.212 1.00 1.00 H new ATOM 2193 N ALA A 145 0.296 33.281 0.656 1.00 1.00 N ATOM 2194 CA ALA A 145 0.282 33.323 -0.801 1.00 1.00 C ATOM 2195 C ALA A 145 -0.837 32.498 -1.370 1.00 1.00 C ATOM 2196 O ALA A 145 -1.262 32.728 -2.500 1.00 1.00 O ATOM 2197 CB ALA A 145 1.581 32.828 -1.396 1.00 1.00 C ATOM 0 H ALA A 145 0.895 32.557 1.053 1.00 1.00 H new ATOM 0 HA ALA A 145 0.139 34.371 -1.064 1.00 1.00 H new ATOM 0 HB1 ALA A 145 1.525 32.877 -2.483 1.00 1.00 H new ATOM 0 HB2 ALA A 145 2.403 33.453 -1.046 1.00 1.00 H new ATOM 0 HB3 ALA A 145 1.753 31.797 -1.088 1.00 1.00 H new ATOM 2203 N LEU A 146 -1.318 31.520 -0.618 1.00 1.00 N ATOM 2204 CA LEU A 146 -2.367 30.653 -1.116 1.00 1.00 C ATOM 2205 C LEU A 146 -3.618 31.442 -1.572 1.00 1.00 C ATOM 2206 O LEU A 146 -4.227 31.073 -2.570 1.00 1.00 O ATOM 2207 CB LEU A 146 -2.727 29.597 -0.065 1.00 1.00 C ATOM 2208 CG LEU A 146 -1.562 28.706 0.379 1.00 1.00 C ATOM 2209 CD1 LEU A 146 -2.079 27.454 1.065 1.00 1.00 C ATOM 2210 CD2 LEU A 146 -0.665 28.344 -0.800 1.00 1.00 C ATOM 0 H LEU A 146 -1.001 31.310 0.329 1.00 1.00 H new ATOM 0 HA LEU A 146 -1.982 30.148 -2.002 1.00 1.00 H new ATOM 0 HB2 LEU A 146 -3.134 30.101 0.811 1.00 1.00 H new ATOM 0 HB3 LEU A 146 -3.519 28.963 -0.464 1.00 1.00 H new ATOM 0 HG LEU A 146 -0.962 29.269 1.094 1.00 1.00 H new ATOM 0 HD11 LEU A 146 -1.237 26.834 1.373 1.00 1.00 H new ATOM 0 HD12 LEU A 146 -2.663 27.734 1.942 1.00 1.00 H new ATOM 0 HD13 LEU A 146 -2.708 26.894 0.374 1.00 1.00 H new ATOM 0 HD21 LEU A 146 0.153 27.711 -0.454 1.00 1.00 H new ATOM 0 HD22 LEU A 146 -1.247 27.807 -1.549 1.00 1.00 H new ATOM 0 HD23 LEU A 146 -0.258 29.254 -1.241 1.00 1.00 H new ATOM 2222 N PRO A 147 -4.009 32.554 -0.882 1.00 1.00 N ATOM 2223 CA PRO A 147 -5.154 33.390 -1.297 1.00 1.00 C ATOM 2224 C PRO A 147 -4.869 34.166 -2.583 1.00 1.00 C ATOM 2225 O PRO A 147 -5.776 34.704 -3.215 1.00 1.00 O ATOM 2226 CB PRO A 147 -5.329 34.369 -0.132 1.00 1.00 C ATOM 2227 CG PRO A 147 -3.985 34.440 0.496 1.00 1.00 C ATOM 2228 CD PRO A 147 -3.407 33.067 0.364 1.00 1.00 C ATOM 0 HA PRO A 147 -6.036 32.785 -1.506 1.00 1.00 H new ATOM 0 HB2 PRO A 147 -5.656 35.348 -0.482 1.00 1.00 H new ATOM 0 HB3 PRO A 147 -6.080 34.015 0.575 1.00 1.00 H new ATOM 0 HG2 PRO A 147 -3.358 35.179 -0.003 1.00 1.00 H new ATOM 0 HG3 PRO A 147 -4.056 34.736 1.542 1.00 1.00 H new ATOM 0 HD2 PRO A 147 -2.319 33.095 0.302 1.00 1.00 H new ATOM 0 HD3 PRO A 147 -3.662 32.441 1.219 1.00 1.00 H new ATOM 2236 N GLY A 148 -3.612 34.151 -2.988 1.00 1.00 N ATOM 2237 CA GLY A 148 -3.206 34.843 -4.195 1.00 1.00 C ATOM 2238 C GLY A 148 -2.956 33.856 -5.311 1.00 1.00 C ATOM 2239 O GLY A 148 -3.261 34.112 -6.476 1.00 1.00 O ATOM 0 H GLY A 148 -2.858 33.668 -2.500 1.00 1.00 H new ATOM 0 HA2 GLY A 148 -3.980 35.550 -4.494 1.00 1.00 H new ATOM 0 HA3 GLY A 148 -2.302 35.421 -4.003 1.00 1.00 H new ATOM 2243 N LEU A 149 -2.484 32.682 -4.917 1.00 1.00 N ATOM 2244 CA LEU A 149 -2.205 31.602 -5.845 1.00 1.00 C ATOM 2245 C LEU A 149 -3.532 30.989 -6.296 1.00 1.00 C ATOM 2246 O LEU A 149 -3.733 30.703 -7.473 1.00 1.00 O ATOM 2247 CB LEU A 149 -1.299 30.556 -5.163 1.00 1.00 C ATOM 2248 CG LEU A 149 -0.034 30.204 -5.933 1.00 1.00 C ATOM 2249 CD1 LEU A 149 0.618 28.968 -5.346 1.00 1.00 C ATOM 2250 CD2 LEU A 149 -0.345 29.999 -7.397 1.00 1.00 C ATOM 0 H LEU A 149 -2.284 32.454 -3.943 1.00 1.00 H new ATOM 0 HA LEU A 149 -1.678 31.975 -6.723 1.00 1.00 H new ATOM 0 HB2 LEU A 149 -1.016 30.929 -4.179 1.00 1.00 H new ATOM 0 HB3 LEU A 149 -1.876 29.645 -5.005 1.00 1.00 H new ATOM 0 HG LEU A 149 0.666 31.035 -5.845 1.00 1.00 H new ATOM 0 HD11 LEU A 149 1.521 28.731 -5.909 1.00 1.00 H new ATOM 0 HD12 LEU A 149 0.878 29.154 -4.304 1.00 1.00 H new ATOM 0 HD13 LEU A 149 -0.076 28.129 -5.403 1.00 1.00 H new ATOM 0 HD21 LEU A 149 0.571 29.748 -7.932 1.00 1.00 H new ATOM 0 HD22 LEU A 149 -1.063 29.186 -7.506 1.00 1.00 H new ATOM 0 HD23 LEU A 149 -0.768 30.915 -7.811 1.00 1.00 H new ATOM 2262 N HIS A 150 -4.438 30.846 -5.331 1.00 1.00 N ATOM 2263 CA HIS A 150 -5.797 30.366 -5.580 1.00 1.00 C ATOM 2264 C HIS A 150 -6.472 31.188 -6.660 1.00 1.00 C ATOM 2265 O HIS A 150 -6.917 30.663 -7.674 1.00 1.00 O ATOM 2266 CB HIS A 150 -6.641 30.466 -4.304 1.00 1.00 C ATOM 2267 CG HIS A 150 -6.892 29.167 -3.613 1.00 1.00 C ATOM 2268 ND1 HIS A 150 -8.152 28.756 -3.246 1.00 1.00 N ATOM 2269 CD2 HIS A 150 -6.045 28.203 -3.189 1.00 1.00 C ATOM 2270 CE1 HIS A 150 -8.073 27.596 -2.623 1.00 1.00 C ATOM 2271 NE2 HIS A 150 -6.803 27.232 -2.572 1.00 1.00 N ATOM 0 H HIS A 150 -4.251 31.060 -4.352 1.00 1.00 H new ATOM 0 HA HIS A 150 -5.723 29.327 -5.902 1.00 1.00 H new ATOM 0 HB2 HIS A 150 -6.142 31.141 -3.608 1.00 1.00 H new ATOM 0 HB3 HIS A 150 -7.600 30.919 -4.555 1.00 1.00 H new ATOM 0 HD1 HIS A 150 -9.015 29.269 -3.428 1.00 1.00 H new ATOM 0 HD2 HIS A 150 -4.972 28.195 -3.311 1.00 1.00 H new ATOM 0 HE1 HIS A 150 -8.906 27.037 -2.222 1.00 1.00 H new ATOM 2280 N ASP A 151 -6.510 32.489 -6.445 1.00 1.00 N ATOM 2281 CA ASP A 151 -7.196 33.398 -7.346 1.00 1.00 C ATOM 2282 C ASP A 151 -6.602 33.353 -8.746 1.00 1.00 C ATOM 2283 O ASP A 151 -7.327 33.337 -9.743 1.00 1.00 O ATOM 2284 CB ASP A 151 -7.125 34.809 -6.780 1.00 1.00 C ATOM 2285 CG ASP A 151 -8.212 35.705 -7.336 1.00 1.00 C ATOM 2286 OD1 ASP A 151 -9.293 35.193 -7.686 1.00 1.00 O ATOM 2287 OD2 ASP A 151 -7.980 36.927 -7.445 1.00 1.00 O ATOM 0 H ASP A 151 -6.069 32.945 -5.646 1.00 1.00 H new ATOM 0 HA ASP A 151 -8.237 33.087 -7.429 1.00 1.00 H new ATOM 0 HB2 ASP A 151 -7.211 34.768 -5.694 1.00 1.00 H new ATOM 0 HB3 ASP A 151 -6.150 35.241 -7.006 1.00 1.00 H new ATOM 2292 N TRP A 152 -5.279 33.278 -8.804 1.00 1.00 N ATOM 2293 CA TRP A 152 -4.558 33.236 -10.067 1.00 1.00 C ATOM 2294 C TRP A 152 -4.916 31.981 -10.851 1.00 1.00 C ATOM 2295 O TRP A 152 -5.337 32.065 -12.003 1.00 1.00 O ATOM 2296 CB TRP A 152 -3.053 33.281 -9.805 1.00 1.00 C ATOM 2297 CG TRP A 152 -2.229 33.557 -11.025 1.00 1.00 C ATOM 2298 CD1 TRP A 152 -1.667 34.746 -11.379 1.00 1.00 C ATOM 2299 CD2 TRP A 152 -1.867 32.623 -12.050 1.00 1.00 C ATOM 2300 NE1 TRP A 152 -0.974 34.609 -12.555 1.00 1.00 N ATOM 2301 CE2 TRP A 152 -1.086 33.315 -12.989 1.00 1.00 C ATOM 2302 CE3 TRP A 152 -2.132 31.270 -12.268 1.00 1.00 C ATOM 2303 CZ2 TRP A 152 -0.560 32.700 -14.119 1.00 1.00 C ATOM 2304 CZ3 TRP A 152 -1.612 30.659 -13.390 1.00 1.00 C ATOM 2305 CH2 TRP A 152 -0.834 31.375 -14.306 1.00 1.00 C ATOM 0 H TRP A 152 -4.679 33.245 -7.980 1.00 1.00 H new ATOM 0 HA TRP A 152 -4.846 34.103 -10.661 1.00 1.00 H new ATOM 0 HB2 TRP A 152 -2.847 34.049 -9.059 1.00 1.00 H new ATOM 0 HB3 TRP A 152 -2.741 32.329 -9.376 1.00 1.00 H new ATOM 0 HD1 TRP A 152 -1.754 35.663 -10.816 1.00 1.00 H new ATOM 0 HE1 TRP A 152 -0.459 35.351 -13.029 1.00 1.00 H new ATOM 0 HE3 TRP A 152 -2.735 30.710 -11.569 1.00 1.00 H new ATOM 0 HZ2 TRP A 152 0.044 33.251 -14.825 1.00 1.00 H new ATOM 0 HZ3 TRP A 152 -1.809 29.611 -13.564 1.00 1.00 H new ATOM 0 HH2 TRP A 152 -0.443 30.871 -15.177 1.00 1.00 H new ATOM 2316 N VAL A 153 -4.759 30.814 -10.229 1.00 1.00 N ATOM 2317 CA VAL A 153 -5.060 29.558 -10.908 1.00 1.00 C ATOM 2318 C VAL A 153 -6.529 29.529 -11.331 1.00 1.00 C ATOM 2319 O VAL A 153 -6.834 29.131 -12.451 1.00 1.00 O ATOM 2320 CB VAL A 153 -4.709 28.315 -10.041 1.00 1.00 C ATOM 2321 CG1 VAL A 153 -3.276 28.409 -9.544 1.00 1.00 C ATOM 2322 CG2 VAL A 153 -5.656 28.149 -8.863 1.00 1.00 C ATOM 0 H VAL A 153 -4.430 30.713 -9.269 1.00 1.00 H new ATOM 0 HA VAL A 153 -4.430 29.507 -11.796 1.00 1.00 H new ATOM 0 HB VAL A 153 -4.819 27.437 -10.677 1.00 1.00 H new ATOM 0 HG11 VAL A 153 -3.043 27.533 -8.938 1.00 1.00 H new ATOM 0 HG12 VAL A 153 -2.598 28.452 -10.396 1.00 1.00 H new ATOM 0 HG13 VAL A 153 -3.159 29.309 -8.941 1.00 1.00 H new ATOM 0 HG21 VAL A 153 -5.370 27.268 -8.288 1.00 1.00 H new ATOM 0 HG22 VAL A 153 -5.602 29.032 -8.226 1.00 1.00 H new ATOM 0 HG23 VAL A 153 -6.675 28.028 -9.230 1.00 1.00 H new ATOM 2332 N ASP A 154 -7.413 30.048 -10.467 1.00 1.00 N ATOM 2333 CA ASP A 154 -8.848 30.109 -10.761 1.00 1.00 C ATOM 2334 C ASP A 154 -9.113 30.930 -12.019 1.00 1.00 C ATOM 2335 O ASP A 154 -9.798 30.485 -12.940 1.00 1.00 O ATOM 2336 CB ASP A 154 -9.632 30.717 -9.586 1.00 1.00 C ATOM 2337 CG ASP A 154 -10.026 29.707 -8.519 1.00 1.00 C ATOM 2338 OD1 ASP A 154 -10.599 28.651 -8.875 1.00 1.00 O ATOM 2339 OD2 ASP A 154 -9.725 29.939 -7.331 1.00 1.00 O ATOM 0 H ASP A 154 -7.156 30.432 -9.557 1.00 1.00 H new ATOM 0 HA ASP A 154 -9.187 29.086 -10.922 1.00 1.00 H new ATOM 0 HB2 ASP A 154 -9.029 31.500 -9.126 1.00 1.00 H new ATOM 0 HB3 ASP A 154 -10.533 31.194 -9.971 1.00 1.00 H new ATOM 2344 N GLU A 155 -8.557 32.136 -12.040 1.00 1.00 N ATOM 2345 CA GLU A 155 -8.756 33.055 -13.158 1.00 1.00 C ATOM 2346 C GLU A 155 -8.167 32.472 -14.438 1.00 1.00 C ATOM 2347 O GLU A 155 -8.765 32.552 -15.512 1.00 1.00 O ATOM 2348 CB GLU A 155 -8.131 34.434 -12.867 1.00 1.00 C ATOM 2349 CG GLU A 155 -6.668 34.543 -13.274 1.00 1.00 C ATOM 2350 CD GLU A 155 -6.084 35.929 -13.091 1.00 1.00 C ATOM 2351 OE1 GLU A 155 -6.404 36.827 -13.893 1.00 1.00 O ATOM 2352 OE2 GLU A 155 -5.342 36.132 -12.106 1.00 1.00 O ATOM 0 H GLU A 155 -7.964 32.502 -11.295 1.00 1.00 H new ATOM 0 HA GLU A 155 -9.829 33.190 -13.291 1.00 1.00 H new ATOM 0 HB2 GLU A 155 -8.703 35.200 -13.392 1.00 1.00 H new ATOM 0 HB3 GLU A 155 -8.219 34.645 -11.801 1.00 1.00 H new ATOM 0 HG2 GLU A 155 -6.084 33.833 -12.689 1.00 1.00 H new ATOM 0 HG3 GLU A 155 -6.569 34.252 -14.320 1.00 1.00 H new ATOM 2359 N ARG A 156 -7.029 31.816 -14.296 1.00 1.00 N ATOM 2360 CA ARG A 156 -6.325 31.265 -15.434 1.00 1.00 C ATOM 2361 C ARG A 156 -7.003 30.015 -15.960 1.00 1.00 C ATOM 2362 O ARG A 156 -7.170 29.860 -17.165 1.00 1.00 O ATOM 2363 CB ARG A 156 -4.872 31.008 -15.075 1.00 1.00 C ATOM 2364 CG ARG A 156 -4.111 32.291 -14.799 1.00 1.00 C ATOM 2365 CD ARG A 156 -4.490 33.373 -15.785 1.00 1.00 C ATOM 2366 NE ARG A 156 -3.875 34.658 -15.452 1.00 1.00 N ATOM 2367 CZ ARG A 156 -3.645 35.631 -16.333 1.00 1.00 C ATOM 2368 NH1 ARG A 156 -3.860 35.430 -17.627 1.00 1.00 N ATOM 2369 NH2 ARG A 156 -3.196 36.803 -15.914 1.00 1.00 N ATOM 0 H ARG A 156 -6.573 31.653 -13.398 1.00 1.00 H new ATOM 0 HA ARG A 156 -6.353 31.997 -16.241 1.00 1.00 H new ATOM 0 HB2 ARG A 156 -4.826 30.365 -14.196 1.00 1.00 H new ATOM 0 HB3 ARG A 156 -4.388 30.470 -15.890 1.00 1.00 H new ATOM 0 HG2 ARG A 156 -4.320 32.630 -13.784 1.00 1.00 H new ATOM 0 HG3 ARG A 156 -3.039 32.101 -14.857 1.00 1.00 H new ATOM 0 HD2 ARG A 156 -4.184 33.073 -16.787 1.00 1.00 H new ATOM 0 HD3 ARG A 156 -5.574 33.484 -15.803 1.00 1.00 H new ATOM 0 HE ARG A 156 -3.605 34.820 -14.482 1.00 1.00 H new ATOM 0 HH11 ARG A 156 -4.203 34.526 -17.953 1.00 1.00 H new ATOM 0 HH12 ARG A 156 -3.682 36.179 -18.296 1.00 1.00 H new ATOM 0 HH21 ARG A 156 -3.027 36.959 -14.920 1.00 1.00 H new ATOM 0 HH22 ARG A 156 -3.019 37.551 -16.585 1.00 1.00 H new ATOM 2383 N LEU A 157 -7.433 29.146 -15.061 1.00 1.00 N ATOM 2384 CA LEU A 157 -8.116 27.921 -15.467 1.00 1.00 C ATOM 2385 C LEU A 157 -9.434 28.267 -16.150 1.00 1.00 C ATOM 2386 O LEU A 157 -9.929 27.521 -16.991 1.00 1.00 O ATOM 2387 CB LEU A 157 -8.321 26.955 -14.276 1.00 1.00 C ATOM 2388 CG LEU A 157 -9.268 27.399 -13.148 1.00 1.00 C ATOM 2389 CD1 LEU A 157 -10.726 27.160 -13.520 1.00 1.00 C ATOM 2390 CD2 LEU A 157 -8.927 26.658 -11.859 1.00 1.00 C ATOM 0 H LEU A 157 -7.325 29.260 -14.053 1.00 1.00 H new ATOM 0 HA LEU A 157 -7.484 27.394 -16.182 1.00 1.00 H new ATOM 0 HB2 LEU A 157 -8.691 26.009 -14.672 1.00 1.00 H new ATOM 0 HB3 LEU A 157 -7.345 26.755 -13.835 1.00 1.00 H new ATOM 0 HG LEU A 157 -9.133 28.470 -12.996 1.00 1.00 H new ATOM 0 HD11 LEU A 157 -11.368 27.485 -12.701 1.00 1.00 H new ATOM 0 HD12 LEU A 157 -10.970 27.726 -14.419 1.00 1.00 H new ATOM 0 HD13 LEU A 157 -10.885 26.098 -13.706 1.00 1.00 H new ATOM 0 HD21 LEU A 157 -9.602 26.978 -11.066 1.00 1.00 H new ATOM 0 HD22 LEU A 157 -9.036 25.585 -12.017 1.00 1.00 H new ATOM 0 HD23 LEU A 157 -7.899 26.880 -11.572 1.00 1.00 H new