USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 804 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 161 TYR OH : rot 179:sc= 1.24 USER MOD Set 1.2: A 186 HIS : no HE2:sc= 1.05 K(o=2.3,f=-3.6!) USER MOD Set 1.3: A 190 THR OG1 : rot -129:sc= 0 USER MOD Set 2.1: A 148 TYR OH : rot -98:sc= 1.52 USER MOD Set 2.2: A 203 LYS NZ :NH3+ -123:sc= 0.646 (180deg=0) USER MOD Set 3.1: A 133 MET CE :methyl -128:sc= -9.88! (180deg=-18.3!) USER MOD Set 3.2: A 212 MET CE :methyl 130:sc= -2.98! (180deg=-6.84!) USER MOD Set 4.1: A 131 SER OG : rot -170:sc= 0 USER MOD Set 4.2: A 216 GLN : amide:sc= -1.73! K(o=-1.7!,f=-2.3) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 MET CE :methyl 177:sc= -3.17! (180deg=-3.51!) USER MOD Single : A 134 SER OG : rot -43:sc= 0.496 USER MOD Single : A 139 HIS : no HD1:sc= -4.21! K(o=-4.2!,f=-0.44) USER MOD Single : A 142 ASN : amide:sc= -0.776! C(o=-0.78!,f=-10!) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot -130:sc= -0.242 USER MOD Single : A 152 ASN : amide:sc= -3.84! C(o=-3.8!,f=-10!) USER MOD Single : A 153 MET CE :methyl -161:sc= -2.98! (180deg=-4.63!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot -169:sc= -1.09 USER MOD Single : A 158 ASN : amide:sc= -1.23! X(o=-1.2!,f=-1.1) USER MOD Single : A 159 GLN : amide:sc= -2.04! C(o=-2!,f=-7.2!) USER MOD Single : A 162 TYR OH : rot -140:sc= -2.12! USER MOD Single : A 167 GLN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 170 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 GLN : amide:sc= -5.07! K(o=-5.1!,f=-0.68) USER MOD Single : A 172 ASN : amide:sc= -1.11 K(o=-1.1,f=-9.7!) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 176 HIS : no HE2:sc= 1.16 K(o=1.2,f=-3.9!) USER MOD Single : A 180 ASN : amide:sc=-0.00281 X(o=-0.0028,f=-0.018) USER MOD Single : A 182 THR OG1 : rot 79:sc= -4.32! USER MOD Single : A 184 LYS NZ :NH3+ 166:sc= -0.13 (180deg=-0.479) USER MOD Single : A 185 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 187 THR OG1 : rot -167:sc= 1.27 USER MOD Single : A 189 THR OG1 : rot 9:sc= 0.782 USER MOD Single : A 191 THR OG1 : rot 170:sc= -0.483 USER MOD Single : A 192 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 193 LYS NZ :NH3+ -158:sc= 1.25 (180deg=0.541) USER MOD Single : A 196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 198 THR OG1 : rot 180:sc= -0.0561 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 205 MET CE :methyl 149:sc= -4.19! (180deg=-7.41!) USER MOD Single : A 211 GLN : amide:sc= -0.229 K(o=-0.23,f=-2) USER MOD Single : A 215 THR OG1 : rot 57:sc= 1.07 USER MOD Single : A 217 TYR OH : rot 30:sc= 0.22 USER MOD Single : A 218 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 219 GLN : amide:sc= -2.13! K(o=-2.1!,f=-0.18) USER MOD Single : A 221 SER OG : rot 180:sc= 0 USER MOD Single : A 222 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= -1.75! K(o=-1.7!,f=-0.09) USER MOD ----------------------------------------------------------------- ATOM 34 N TYR A 127 -10.269 10.183 -5.255 1.00 0.61 N ATOM 35 CA TYR A 127 -8.894 9.984 -4.809 1.00 0.44 C ATOM 36 C TYR A 127 -7.932 10.094 -5.974 1.00 0.45 C ATOM 37 O TYR A 127 -8.320 10.358 -7.113 1.00 0.71 O ATOM 38 CB TYR A 127 -8.704 8.645 -4.051 1.00 0.37 C ATOM 39 CG TYR A 127 -9.056 8.733 -2.581 1.00 0.46 C ATOM 40 CD1 TYR A 127 -8.907 9.922 -1.883 1.00 1.26 C ATOM 41 CD2 TYR A 127 -9.535 7.626 -1.891 1.00 0.86 C ATOM 42 CE1 TYR A 127 -9.226 10.007 -0.541 1.00 1.38 C ATOM 43 CE2 TYR A 127 -9.855 7.703 -0.554 1.00 0.92 C ATOM 44 CZ TYR A 127 -9.704 8.899 0.115 1.00 0.78 C ATOM 45 OH TYR A 127 -10.011 8.959 1.449 1.00 0.96 O ATOM 0 HA TYR A 127 -8.670 10.779 -4.098 1.00 0.44 H new ATOM 0 HB2 TYR A 127 -9.322 7.879 -4.520 1.00 0.37 H new ATOM 0 HB3 TYR A 127 -7.667 8.323 -4.150 1.00 0.37 H new ATOM 0 HD1 TYR A 127 -8.535 10.796 -2.397 1.00 1.26 H new ATOM 0 HD2 TYR A 127 -9.658 6.688 -2.413 1.00 0.86 H new ATOM 0 HE1 TYR A 127 -9.100 10.940 -0.011 1.00 1.38 H new ATOM 0 HE2 TYR A 127 -10.222 6.832 -0.032 1.00 0.92 H new ATOM 0 HH TYR A 127 -10.337 8.085 1.749 1.00 0.96 H new ATOM 55 N MET A 128 -6.676 9.935 -5.677 1.00 0.38 N ATOM 56 CA MET A 128 -5.656 10.007 -6.667 1.00 0.41 C ATOM 57 C MET A 128 -4.814 8.775 -6.467 1.00 0.42 C ATOM 58 O MET A 128 -4.132 8.637 -5.458 1.00 0.43 O ATOM 59 CB MET A 128 -4.908 11.363 -6.519 1.00 0.46 C ATOM 60 CG MET A 128 -3.673 11.372 -5.635 1.00 0.45 C ATOM 61 SD MET A 128 -2.212 10.734 -6.468 1.00 0.52 S ATOM 62 CE MET A 128 -1.353 10.056 -5.060 1.00 0.46 C ATOM 0 H MET A 128 -6.334 9.751 -4.734 1.00 0.38 H new ATOM 0 HA MET A 128 -6.016 10.004 -7.696 1.00 0.41 H new ATOM 0 HB2 MET A 128 -4.616 11.700 -7.514 1.00 0.46 H new ATOM 0 HB3 MET A 128 -5.611 12.098 -6.127 1.00 0.46 H new ATOM 0 HG2 MET A 128 -3.479 12.391 -5.301 1.00 0.45 H new ATOM 0 HG3 MET A 128 -3.866 10.776 -4.743 1.00 0.45 H new ATOM 0 HE1 MET A 128 -0.439 9.565 -5.393 1.00 0.46 H new ATOM 0 HE2 MET A 128 -1.102 10.858 -4.366 1.00 0.46 H new ATOM 0 HE3 MET A 128 -1.993 9.330 -4.559 1.00 0.46 H new ATOM 72 N LEU A 129 -4.969 7.800 -7.351 1.00 0.57 N ATOM 73 CA LEU A 129 -4.327 6.532 -7.113 1.00 0.66 C ATOM 74 C LEU A 129 -2.868 6.779 -6.856 1.00 0.56 C ATOM 75 O LEU A 129 -2.164 7.331 -7.704 1.00 0.56 O ATOM 76 CB LEU A 129 -4.506 5.545 -8.250 1.00 0.92 C ATOM 77 CG LEU A 129 -4.193 4.123 -7.831 1.00 0.37 C ATOM 78 CD1 LEU A 129 -5.383 3.207 -8.047 1.00 1.12 C ATOM 79 CD2 LEU A 129 -2.972 3.634 -8.584 1.00 1.15 C ATOM 0 H LEU A 129 -5.516 7.864 -8.210 1.00 0.57 H new ATOM 0 HA LEU A 129 -4.802 6.073 -6.246 1.00 0.66 H new ATOM 0 HB2 LEU A 129 -5.532 5.597 -8.615 1.00 0.92 H new ATOM 0 HB3 LEU A 129 -3.858 5.828 -9.079 1.00 0.92 H new ATOM 0 HG LEU A 129 -3.977 4.109 -6.763 1.00 0.37 H new ATOM 0 HD11 LEU A 129 -5.124 2.195 -7.736 1.00 1.12 H new ATOM 0 HD12 LEU A 129 -6.228 3.563 -7.457 1.00 1.12 H new ATOM 0 HD13 LEU A 129 -5.653 3.204 -9.103 1.00 1.12 H new ATOM 0 HD21 LEU A 129 -2.745 2.611 -8.284 1.00 1.15 H new ATOM 0 HD22 LEU A 129 -3.170 3.662 -9.656 1.00 1.15 H new ATOM 0 HD23 LEU A 129 -2.122 4.276 -8.355 1.00 1.15 H new ATOM 91 N GLY A 130 -2.460 6.431 -5.651 1.00 0.57 N ATOM 92 CA GLY A 130 -1.143 6.735 -5.179 1.00 0.55 C ATOM 93 C GLY A 130 -0.103 5.892 -5.854 1.00 0.53 C ATOM 94 O GLY A 130 0.529 5.054 -5.215 1.00 0.58 O ATOM 0 H GLY A 130 -3.040 5.929 -4.979 1.00 0.57 H new ATOM 0 HA2 GLY A 130 -0.928 7.789 -5.355 1.00 0.55 H new ATOM 0 HA3 GLY A 130 -1.097 6.576 -4.102 1.00 0.55 H new ATOM 98 N SER A 131 -0.011 6.099 -7.169 1.00 0.56 N ATOM 99 CA SER A 131 1.008 5.507 -8.031 1.00 0.62 C ATOM 100 C SER A 131 0.991 3.982 -8.035 1.00 0.63 C ATOM 101 O SER A 131 1.051 3.330 -6.992 1.00 1.04 O ATOM 102 CB SER A 131 2.394 6.012 -7.630 1.00 0.71 C ATOM 103 OG SER A 131 2.488 7.416 -7.793 1.00 1.30 O ATOM 0 H SER A 131 -0.662 6.700 -7.675 1.00 0.56 H new ATOM 0 HA SER A 131 0.772 5.823 -9.047 1.00 0.62 H new ATOM 0 HB2 SER A 131 2.595 5.748 -6.592 1.00 0.71 H new ATOM 0 HB3 SER A 131 3.154 5.520 -8.237 1.00 0.71 H new ATOM 0 HG SER A 131 3.421 7.696 -7.684 1.00 1.30 H new ATOM 109 N ALA A 132 0.917 3.402 -9.222 1.00 0.64 N ATOM 110 CA ALA A 132 1.168 1.983 -9.349 1.00 0.58 C ATOM 111 C ALA A 132 2.670 1.762 -9.195 1.00 0.53 C ATOM 112 O ALA A 132 3.415 1.725 -10.176 1.00 0.65 O ATOM 113 CB ALA A 132 0.662 1.430 -10.671 1.00 0.71 C ATOM 0 H ALA A 132 0.690 3.883 -10.092 1.00 0.64 H new ATOM 0 HA ALA A 132 0.624 1.445 -8.573 1.00 0.58 H new ATOM 0 HB1 ALA A 132 0.872 0.362 -10.723 1.00 0.71 H new ATOM 0 HB2 ALA A 132 -0.413 1.593 -10.746 1.00 0.71 H new ATOM 0 HB3 ALA A 132 1.164 1.939 -11.494 1.00 0.71 H new ATOM 119 N MET A 133 3.104 1.678 -7.945 1.00 0.46 N ATOM 120 CA MET A 133 4.524 1.727 -7.591 1.00 0.49 C ATOM 121 C MET A 133 5.336 0.585 -8.182 1.00 0.61 C ATOM 122 O MET A 133 6.558 0.689 -8.298 1.00 1.65 O ATOM 123 CB MET A 133 4.692 1.708 -6.073 1.00 0.48 C ATOM 124 CG MET A 133 3.829 0.672 -5.403 1.00 0.41 C ATOM 125 SD MET A 133 4.690 -0.149 -4.071 1.00 0.73 S ATOM 126 CE MET A 133 3.344 -0.692 -3.042 1.00 0.40 C ATOM 0 H MET A 133 2.483 1.574 -7.143 1.00 0.46 H new ATOM 0 HA MET A 133 4.904 2.656 -8.015 1.00 0.49 H new ATOM 0 HB2 MET A 133 5.737 1.516 -5.830 1.00 0.48 H new ATOM 0 HB3 MET A 133 4.447 2.692 -5.673 1.00 0.48 H new ATOM 0 HG2 MET A 133 2.927 1.146 -5.015 1.00 0.41 H new ATOM 0 HG3 MET A 133 3.510 -0.066 -6.139 1.00 0.41 H new ATOM 0 HE1 MET A 133 3.513 -0.362 -2.017 1.00 0.40 H new ATOM 0 HE2 MET A 133 2.410 -0.268 -3.411 1.00 0.40 H new ATOM 0 HE3 MET A 133 3.283 -1.780 -3.067 1.00 0.40 H new ATOM 136 N SER A 134 4.658 -0.497 -8.534 1.00 0.72 N ATOM 137 CA SER A 134 5.310 -1.720 -9.000 1.00 0.60 C ATOM 138 C SER A 134 6.056 -2.399 -7.845 1.00 0.52 C ATOM 139 O SER A 134 6.931 -3.241 -8.068 1.00 0.74 O ATOM 140 CB SER A 134 6.258 -1.419 -10.173 1.00 0.71 C ATOM 141 OG SER A 134 6.739 -2.607 -10.780 1.00 1.49 O ATOM 0 H SER A 134 3.640 -0.556 -8.506 1.00 0.72 H new ATOM 0 HA SER A 134 4.544 -2.407 -9.360 1.00 0.60 H new ATOM 0 HB2 SER A 134 5.736 -0.817 -10.917 1.00 0.71 H new ATOM 0 HB3 SER A 134 7.100 -0.826 -9.817 1.00 0.71 H new ATOM 0 HG SER A 134 6.981 -3.255 -10.085 1.00 1.49 H new ATOM 147 N ARG A 135 5.671 -2.032 -6.612 1.00 0.47 N ATOM 148 CA ARG A 135 6.186 -2.627 -5.386 1.00 0.43 C ATOM 149 C ARG A 135 7.624 -2.134 -5.092 1.00 0.47 C ATOM 150 O ARG A 135 8.522 -2.305 -5.911 1.00 0.59 O ATOM 151 CB ARG A 135 6.085 -4.146 -5.485 1.00 0.55 C ATOM 152 CG ARG A 135 6.222 -4.856 -4.162 1.00 0.49 C ATOM 153 CD ARG A 135 7.667 -4.948 -3.768 1.00 1.38 C ATOM 154 NE ARG A 135 8.510 -5.433 -4.866 1.00 2.40 N ATOM 155 CZ ARG A 135 8.432 -6.657 -5.404 1.00 3.22 C ATOM 156 NH1 ARG A 135 7.580 -7.560 -4.926 1.00 3.47 N ATOM 157 NH2 ARG A 135 9.212 -6.983 -6.426 1.00 4.16 N ATOM 0 H ARG A 135 4.981 -1.300 -6.445 1.00 0.47 H new ATOM 0 HA ARG A 135 5.582 -2.308 -4.536 1.00 0.43 H new ATOM 0 HB2 ARG A 135 5.125 -4.408 -5.929 1.00 0.55 H new ATOM 0 HB3 ARG A 135 6.859 -4.508 -6.162 1.00 0.55 H new ATOM 0 HG2 ARG A 135 5.662 -4.321 -3.395 1.00 0.49 H new ATOM 0 HG3 ARG A 135 5.793 -5.855 -4.232 1.00 0.49 H new ATOM 0 HD2 ARG A 135 8.018 -3.967 -3.449 1.00 1.38 H new ATOM 0 HD3 ARG A 135 7.767 -5.616 -2.913 1.00 1.38 H new ATOM 0 HE ARG A 135 9.206 -4.792 -5.247 1.00 2.40 H new ATOM 0 HH11 ARG A 135 6.975 -7.324 -4.139 1.00 3.47 H new ATOM 0 HH12 ARG A 135 7.532 -8.488 -5.346 1.00 3.47 H new ATOM 0 HH21 ARG A 135 9.871 -6.302 -6.802 1.00 4.16 H new ATOM 0 HH22 ARG A 135 9.153 -7.915 -6.836 1.00 4.16 H new ATOM 171 N PRO A 136 7.867 -1.544 -3.892 1.00 0.43 N ATOM 172 CA PRO A 136 9.112 -0.830 -3.575 1.00 0.49 C ATOM 173 C PRO A 136 10.196 -1.746 -3.022 1.00 0.46 C ATOM 174 O PRO A 136 11.202 -1.282 -2.488 1.00 0.58 O ATOM 175 CB PRO A 136 8.680 0.171 -2.490 1.00 0.52 C ATOM 176 CG PRO A 136 7.265 -0.173 -2.136 1.00 0.47 C ATOM 177 CD PRO A 136 6.980 -1.525 -2.730 1.00 0.40 C ATOM 0 HA PRO A 136 9.546 -0.375 -4.465 1.00 0.49 H new ATOM 0 HB2 PRO A 136 9.327 0.100 -1.616 1.00 0.52 H new ATOM 0 HB3 PRO A 136 8.751 1.195 -2.856 1.00 0.52 H new ATOM 0 HG2 PRO A 136 7.131 -0.191 -1.054 1.00 0.47 H new ATOM 0 HG3 PRO A 136 6.576 0.574 -2.530 1.00 0.47 H new ATOM 0 HD2 PRO A 136 7.205 -2.332 -2.033 1.00 0.40 H new ATOM 0 HD3 PRO A 136 5.933 -1.632 -3.015 1.00 0.40 H new ATOM 185 N LEU A 137 9.968 -3.044 -3.160 1.00 0.42 N ATOM 186 CA LEU A 137 10.883 -4.064 -2.663 1.00 0.48 C ATOM 187 C LEU A 137 10.974 -4.021 -1.140 1.00 0.45 C ATOM 188 O LEU A 137 11.855 -3.387 -0.570 1.00 0.62 O ATOM 189 CB LEU A 137 12.272 -3.932 -3.308 1.00 0.70 C ATOM 190 CG LEU A 137 12.398 -4.482 -4.740 1.00 0.77 C ATOM 191 CD1 LEU A 137 12.103 -5.973 -4.765 1.00 1.32 C ATOM 192 CD2 LEU A 137 11.475 -3.745 -5.706 1.00 1.33 C ATOM 0 H LEU A 137 9.140 -3.422 -3.621 1.00 0.42 H new ATOM 0 HA LEU A 137 10.482 -5.037 -2.947 1.00 0.48 H new ATOM 0 HB2 LEU A 137 12.549 -2.878 -3.318 1.00 0.70 H new ATOM 0 HB3 LEU A 137 12.996 -4.446 -2.676 1.00 0.70 H new ATOM 0 HG LEU A 137 13.425 -4.318 -5.067 1.00 0.77 H new ATOM 0 HD11 LEU A 137 12.197 -6.345 -5.785 1.00 1.32 H new ATOM 0 HD12 LEU A 137 12.811 -6.495 -4.122 1.00 1.32 H new ATOM 0 HD13 LEU A 137 11.089 -6.149 -4.406 1.00 1.32 H new ATOM 0 HD21 LEU A 137 11.590 -4.160 -6.707 1.00 1.33 H new ATOM 0 HD22 LEU A 137 10.441 -3.862 -5.382 1.00 1.33 H new ATOM 0 HD23 LEU A 137 11.733 -2.686 -5.720 1.00 1.33 H new ATOM 204 N ILE A 138 10.028 -4.687 -0.491 1.00 0.38 N ATOM 205 CA ILE A 138 10.012 -4.800 0.960 1.00 0.39 C ATOM 206 C ILE A 138 10.850 -6.003 1.380 1.00 0.50 C ATOM 207 O ILE A 138 11.198 -6.146 2.546 1.00 1.19 O ATOM 208 CB ILE A 138 8.576 -4.977 1.483 1.00 0.38 C ATOM 209 CG1 ILE A 138 7.631 -3.948 0.852 1.00 0.25 C ATOM 210 CG2 ILE A 138 8.525 -4.861 2.996 1.00 0.57 C ATOM 211 CD1 ILE A 138 7.857 -2.534 1.332 1.00 0.31 C ATOM 0 H ILE A 138 9.253 -5.162 -0.954 1.00 0.38 H new ATOM 0 HA ILE A 138 10.425 -3.884 1.383 1.00 0.39 H new ATOM 0 HB ILE A 138 8.248 -5.977 1.199 1.00 0.38 H new ATOM 0 HG12 ILE A 138 7.749 -3.977 -0.231 1.00 0.25 H new ATOM 0 HG13 ILE A 138 6.602 -4.234 1.068 1.00 0.25 H new ATOM 0 HG21 ILE A 138 7.498 -4.990 3.336 1.00 0.57 H new ATOM 0 HG22 ILE A 138 9.155 -5.631 3.441 1.00 0.57 H new ATOM 0 HG23 ILE A 138 8.886 -3.878 3.298 1.00 0.57 H new ATOM 0 HD11 ILE A 138 7.150 -1.865 0.840 1.00 0.31 H new ATOM 0 HD12 ILE A 138 7.709 -2.488 2.411 1.00 0.31 H new ATOM 0 HD13 ILE A 138 8.875 -2.227 1.092 1.00 0.31 H new ATOM 223 N HIS A 139 11.146 -6.855 0.385 1.00 0.65 N ATOM 224 CA HIS A 139 12.052 -8.029 0.497 1.00 0.75 C ATOM 225 C HIS A 139 11.859 -8.883 1.760 1.00 0.84 C ATOM 226 O HIS A 139 11.246 -9.942 1.692 1.00 1.80 O ATOM 227 CB HIS A 139 13.545 -7.638 0.318 1.00 0.84 C ATOM 228 CG HIS A 139 13.919 -6.289 0.851 1.00 0.72 C ATOM 229 ND1 HIS A 139 14.247 -5.231 0.042 1.00 1.02 N ATOM 230 CD2 HIS A 139 13.930 -5.812 2.111 1.00 1.15 C ATOM 231 CE1 HIS A 139 14.430 -4.158 0.782 1.00 1.08 C ATOM 232 NE2 HIS A 139 14.235 -4.476 2.051 1.00 1.33 N ATOM 0 H HIS A 139 10.754 -6.750 -0.551 1.00 0.65 H new ATOM 0 HA HIS A 139 11.754 -8.668 -0.334 1.00 0.75 H new ATOM 0 HB2 HIS A 139 14.162 -8.389 0.810 1.00 0.84 H new ATOM 0 HB3 HIS A 139 13.788 -7.672 -0.744 1.00 0.84 H new ATOM 0 HD2 HIS A 139 13.734 -6.380 3.008 1.00 1.15 H new ATOM 0 HE1 HIS A 139 14.696 -3.178 0.413 1.00 1.08 H new ATOM 0 HE2 HIS A 139 14.300 -3.840 2.845 1.00 1.33 H new ATOM 241 N PHE A 140 12.374 -8.408 2.895 1.00 0.66 N ATOM 242 CA PHE A 140 12.507 -9.185 4.138 1.00 0.54 C ATOM 243 C PHE A 140 13.731 -10.086 4.075 1.00 0.63 C ATOM 244 O PHE A 140 14.379 -10.329 5.090 1.00 0.76 O ATOM 245 CB PHE A 140 11.265 -10.035 4.474 1.00 0.53 C ATOM 246 CG PHE A 140 9.990 -9.254 4.566 1.00 0.40 C ATOM 247 CD1 PHE A 140 9.847 -8.236 5.491 1.00 0.72 C ATOM 248 CD2 PHE A 140 8.931 -9.542 3.720 1.00 0.71 C ATOM 249 CE1 PHE A 140 8.672 -7.519 5.570 1.00 0.74 C ATOM 250 CE2 PHE A 140 7.755 -8.827 3.794 1.00 0.67 C ATOM 251 CZ PHE A 140 7.625 -7.816 4.718 1.00 0.35 C ATOM 0 H PHE A 140 12.719 -7.452 2.982 1.00 0.66 H new ATOM 0 HA PHE A 140 12.616 -8.450 4.936 1.00 0.54 H new ATOM 0 HB2 PHE A 140 11.151 -10.807 3.713 1.00 0.53 H new ATOM 0 HB3 PHE A 140 11.434 -10.545 5.422 1.00 0.53 H new ATOM 0 HD1 PHE A 140 10.663 -8.000 6.158 1.00 0.72 H new ATOM 0 HD2 PHE A 140 9.028 -10.336 2.994 1.00 0.71 H new ATOM 0 HE1 PHE A 140 8.570 -6.726 6.297 1.00 0.74 H new ATOM 0 HE2 PHE A 140 6.937 -9.060 3.128 1.00 0.67 H new ATOM 0 HZ PHE A 140 6.705 -7.254 4.778 1.00 0.35 H new ATOM 261 N GLY A 141 14.045 -10.579 2.883 1.00 0.66 N ATOM 262 CA GLY A 141 15.158 -11.494 2.732 1.00 0.77 C ATOM 263 C GLY A 141 14.765 -12.880 3.178 1.00 0.74 C ATOM 264 O GLY A 141 15.608 -13.710 3.525 1.00 0.86 O ATOM 0 H GLY A 141 13.548 -10.361 2.019 1.00 0.66 H new ATOM 0 HA2 GLY A 141 15.478 -11.518 1.690 1.00 0.77 H new ATOM 0 HA3 GLY A 141 16.007 -11.144 3.319 1.00 0.77 H new ATOM 268 N ASN A 142 13.465 -13.116 3.168 1.00 0.63 N ATOM 269 CA ASN A 142 12.901 -14.368 3.649 1.00 0.63 C ATOM 270 C ASN A 142 12.655 -15.318 2.481 1.00 0.63 C ATOM 271 O ASN A 142 13.016 -15.031 1.340 1.00 0.65 O ATOM 272 CB ASN A 142 11.591 -14.080 4.401 1.00 0.61 C ATOM 273 CG ASN A 142 11.092 -15.246 5.244 1.00 0.81 C ATOM 274 OD1 ASN A 142 10.341 -16.099 4.769 1.00 1.68 O ATOM 275 ND2 ASN A 142 11.485 -15.274 6.506 1.00 1.02 N ATOM 0 H ASN A 142 12.772 -12.449 2.828 1.00 0.63 H new ATOM 0 HA ASN A 142 13.604 -14.846 4.331 1.00 0.63 H new ATOM 0 HB2 ASN A 142 11.738 -13.214 5.047 1.00 0.61 H new ATOM 0 HB3 ASN A 142 10.821 -13.812 3.678 1.00 0.61 H new ATOM 0 HD21 ASN A 142 11.165 -16.021 7.123 1.00 1.02 H new ATOM 0 HD22 ASN A 142 12.108 -14.549 6.862 1.00 1.02 H new ATOM 282 N ASP A 143 12.096 -16.466 2.788 1.00 0.66 N ATOM 283 CA ASP A 143 11.694 -17.437 1.778 1.00 0.67 C ATOM 284 C ASP A 143 10.195 -17.358 1.515 1.00 0.61 C ATOM 285 O ASP A 143 9.757 -17.014 0.426 1.00 0.57 O ATOM 286 CB ASP A 143 12.085 -18.852 2.221 1.00 0.79 C ATOM 287 CG ASP A 143 11.525 -19.927 1.312 1.00 1.34 C ATOM 288 OD1 ASP A 143 12.082 -20.132 0.211 1.00 1.77 O ATOM 289 OD2 ASP A 143 10.524 -20.570 1.683 1.00 2.11 O ATOM 0 H ASP A 143 11.904 -16.760 3.746 1.00 0.66 H new ATOM 0 HA ASP A 143 12.214 -17.202 0.849 1.00 0.67 H new ATOM 0 HB2 ASP A 143 13.172 -18.933 2.245 1.00 0.79 H new ATOM 0 HB3 ASP A 143 11.730 -19.021 3.238 1.00 0.79 H new ATOM 294 N TYR A 144 9.420 -17.645 2.550 1.00 0.64 N ATOM 295 CA TYR A 144 7.975 -17.808 2.437 1.00 0.62 C ATOM 296 C TYR A 144 7.258 -16.470 2.600 1.00 0.55 C ATOM 297 O TYR A 144 6.262 -16.224 1.936 1.00 0.53 O ATOM 298 CB TYR A 144 7.524 -18.796 3.520 1.00 0.76 C ATOM 299 CG TYR A 144 6.151 -19.398 3.324 1.00 0.80 C ATOM 300 CD1 TYR A 144 5.955 -20.445 2.433 1.00 1.17 C ATOM 301 CD2 TYR A 144 5.060 -18.943 4.053 1.00 0.98 C ATOM 302 CE1 TYR A 144 4.708 -21.020 2.271 1.00 1.28 C ATOM 303 CE2 TYR A 144 3.810 -19.510 3.896 1.00 1.09 C ATOM 304 CZ TYR A 144 3.639 -20.549 3.004 1.00 1.08 C ATOM 305 OH TYR A 144 2.394 -21.118 2.846 1.00 1.26 O ATOM 0 H TYR A 144 9.776 -17.772 3.497 1.00 0.64 H new ATOM 0 HA TYR A 144 7.723 -18.190 1.448 1.00 0.62 H new ATOM 0 HB2 TYR A 144 8.252 -19.606 3.574 1.00 0.76 H new ATOM 0 HB3 TYR A 144 7.543 -18.286 4.483 1.00 0.76 H new ATOM 0 HD1 TYR A 144 6.790 -20.816 1.857 1.00 1.17 H new ATOM 0 HD2 TYR A 144 5.191 -18.132 4.754 1.00 0.98 H new ATOM 0 HE1 TYR A 144 4.572 -21.834 1.574 1.00 1.28 H new ATOM 0 HE2 TYR A 144 2.971 -19.142 4.468 1.00 1.09 H new ATOM 0 HH TYR A 144 1.753 -20.671 3.437 1.00 1.26 H new ATOM 315 N GLU A 145 7.782 -15.610 3.473 1.00 0.58 N ATOM 316 CA GLU A 145 7.178 -14.295 3.751 1.00 0.54 C ATOM 317 C GLU A 145 7.634 -13.280 2.732 1.00 0.51 C ATOM 318 O GLU A 145 6.848 -12.439 2.297 1.00 0.50 O ATOM 319 CB GLU A 145 7.588 -13.821 5.135 1.00 0.61 C ATOM 320 CG GLU A 145 7.468 -14.900 6.192 1.00 0.76 C ATOM 321 CD GLU A 145 7.883 -14.414 7.562 1.00 1.31 C ATOM 322 OE1 GLU A 145 7.147 -13.613 8.166 1.00 1.71 O ATOM 323 OE2 GLU A 145 8.945 -14.853 8.044 1.00 1.74 O ATOM 0 H GLU A 145 8.631 -15.797 4.007 1.00 0.58 H new ATOM 0 HA GLU A 145 6.094 -14.397 3.699 1.00 0.54 H new ATOM 0 HB2 GLU A 145 8.618 -13.467 5.101 1.00 0.61 H new ATOM 0 HB3 GLU A 145 6.968 -12.971 5.420 1.00 0.61 H new ATOM 0 HG2 GLU A 145 6.437 -15.253 6.232 1.00 0.76 H new ATOM 0 HG3 GLU A 145 8.086 -15.752 5.909 1.00 0.76 H new ATOM 330 N ASP A 146 8.915 -13.349 2.381 1.00 0.54 N ATOM 331 CA ASP A 146 9.431 -12.621 1.233 1.00 0.54 C ATOM 332 C ASP A 146 8.469 -12.847 0.109 1.00 0.48 C ATOM 333 O ASP A 146 7.775 -11.951 -0.347 1.00 0.51 O ATOM 334 CB ASP A 146 10.781 -13.191 0.807 1.00 0.57 C ATOM 335 CG ASP A 146 11.499 -12.382 -0.267 1.00 0.87 C ATOM 336 OD1 ASP A 146 11.064 -12.418 -1.439 1.00 1.38 O ATOM 337 OD2 ASP A 146 12.476 -11.676 0.061 1.00 1.30 O ATOM 0 H ASP A 146 9.613 -13.903 2.878 1.00 0.54 H new ATOM 0 HA ASP A 146 9.547 -11.566 1.481 1.00 0.54 H new ATOM 0 HB2 ASP A 146 11.425 -13.259 1.684 1.00 0.57 H new ATOM 0 HB3 ASP A 146 10.633 -14.207 0.440 1.00 0.57 H new ATOM 342 N ARG A 147 8.387 -14.111 -0.243 1.00 0.44 N ATOM 343 CA ARG A 147 7.538 -14.586 -1.297 1.00 0.45 C ATOM 344 C ARG A 147 6.079 -14.196 -1.058 1.00 0.38 C ATOM 345 O ARG A 147 5.412 -13.744 -1.979 1.00 0.35 O ATOM 346 CB ARG A 147 7.684 -16.094 -1.367 1.00 0.59 C ATOM 347 CG ARG A 147 6.947 -16.770 -2.501 1.00 0.80 C ATOM 348 CD ARG A 147 5.480 -16.846 -2.184 1.00 0.67 C ATOM 349 NE ARG A 147 5.227 -17.387 -0.852 1.00 1.38 N ATOM 350 CZ ARG A 147 4.061 -17.915 -0.466 1.00 1.78 C ATOM 351 NH1 ARG A 147 3.048 -18.010 -1.313 1.00 1.90 N ATOM 352 NH2 ARG A 147 3.903 -18.343 0.775 1.00 2.55 N ATOM 0 H ARG A 147 8.924 -14.850 0.211 1.00 0.44 H new ATOM 0 HA ARG A 147 7.835 -14.130 -2.241 1.00 0.45 H new ATOM 0 HB2 ARG A 147 8.744 -16.335 -1.452 1.00 0.59 H new ATOM 0 HB3 ARG A 147 7.335 -16.519 -0.426 1.00 0.59 H new ATOM 0 HG2 ARG A 147 7.100 -16.216 -3.427 1.00 0.80 H new ATOM 0 HG3 ARG A 147 7.346 -17.772 -2.660 1.00 0.80 H new ATOM 0 HD2 ARG A 147 5.043 -15.850 -2.258 1.00 0.67 H new ATOM 0 HD3 ARG A 147 4.982 -17.469 -2.927 1.00 0.67 H new ATOM 0 HE ARG A 147 5.988 -17.361 -0.173 1.00 1.38 H new ATOM 0 HH11 ARG A 147 3.152 -17.678 -2.272 1.00 1.90 H new ATOM 0 HH12 ARG A 147 2.163 -18.415 -1.007 1.00 1.90 H new ATOM 0 HH21 ARG A 147 4.672 -18.271 1.441 1.00 2.55 H new ATOM 0 HH22 ARG A 147 3.012 -18.745 1.066 1.00 2.55 H new ATOM 366 N TYR A 148 5.563 -14.392 0.158 1.00 0.39 N ATOM 367 CA TYR A 148 4.144 -14.168 0.372 1.00 0.38 C ATOM 368 C TYR A 148 3.785 -12.709 0.198 1.00 0.32 C ATOM 369 O TYR A 148 2.771 -12.424 -0.408 1.00 0.44 O ATOM 370 CB TYR A 148 3.548 -14.838 1.653 1.00 0.53 C ATOM 371 CG TYR A 148 3.935 -14.380 3.046 1.00 0.90 C ATOM 372 CD1 TYR A 148 4.062 -13.052 3.386 1.00 1.93 C ATOM 373 CD2 TYR A 148 4.091 -15.328 4.057 1.00 1.13 C ATOM 374 CE1 TYR A 148 4.354 -12.673 4.682 1.00 2.86 C ATOM 375 CE2 TYR A 148 4.370 -14.954 5.356 1.00 1.93 C ATOM 376 CZ TYR A 148 4.502 -13.618 5.662 1.00 2.73 C ATOM 377 OH TYR A 148 4.768 -13.222 6.955 1.00 3.74 O ATOM 0 H TYR A 148 6.089 -14.694 0.978 1.00 0.39 H new ATOM 0 HA TYR A 148 3.633 -14.712 -0.422 1.00 0.38 H new ATOM 0 HB2 TYR A 148 2.464 -14.748 1.581 1.00 0.53 H new ATOM 0 HB3 TYR A 148 3.785 -15.900 1.593 1.00 0.53 H new ATOM 0 HD1 TYR A 148 3.931 -12.294 2.627 1.00 1.93 H new ATOM 0 HD2 TYR A 148 3.991 -16.377 3.818 1.00 1.13 H new ATOM 0 HE1 TYR A 148 4.466 -11.626 4.923 1.00 2.86 H new ATOM 0 HE2 TYR A 148 4.484 -15.703 6.126 1.00 1.93 H new ATOM 0 HH TYR A 148 5.731 -13.286 7.125 1.00 3.74 H new ATOM 387 N TYR A 149 4.618 -11.782 0.662 1.00 0.27 N ATOM 388 CA TYR A 149 4.493 -10.401 0.226 1.00 0.25 C ATOM 389 C TYR A 149 4.761 -10.254 -1.288 1.00 0.25 C ATOM 390 O TYR A 149 4.115 -9.447 -1.949 1.00 0.29 O ATOM 391 CB TYR A 149 5.414 -9.483 1.041 1.00 0.35 C ATOM 392 CG TYR A 149 6.478 -8.787 0.234 1.00 0.31 C ATOM 393 CD1 TYR A 149 6.161 -7.736 -0.617 1.00 0.85 C ATOM 394 CD2 TYR A 149 7.795 -9.195 0.314 1.00 1.17 C ATOM 395 CE1 TYR A 149 7.137 -7.117 -1.365 1.00 0.80 C ATOM 396 CE2 TYR A 149 8.773 -8.585 -0.428 1.00 1.32 C ATOM 397 CZ TYR A 149 8.445 -7.547 -1.267 1.00 0.63 C ATOM 398 OH TYR A 149 9.426 -6.942 -2.016 1.00 0.81 O ATOM 0 H TYR A 149 5.371 -11.959 1.326 1.00 0.27 H new ATOM 0 HA TYR A 149 3.463 -10.093 0.405 1.00 0.25 H new ATOM 0 HB2 TYR A 149 4.805 -8.730 1.541 1.00 0.35 H new ATOM 0 HB3 TYR A 149 5.896 -10.073 1.821 1.00 0.35 H new ATOM 0 HD1 TYR A 149 5.137 -7.401 -0.693 1.00 0.85 H new ATOM 0 HD2 TYR A 149 8.059 -10.009 0.973 1.00 1.17 H new ATOM 0 HE1 TYR A 149 6.881 -6.301 -2.024 1.00 0.80 H new ATOM 0 HE2 TYR A 149 9.797 -8.919 -0.354 1.00 1.32 H new ATOM 0 HH TYR A 149 9.952 -7.626 -2.480 1.00 0.81 H new ATOM 408 N ARG A 150 5.709 -11.010 -1.841 1.00 0.27 N ATOM 409 CA ARG A 150 6.024 -10.912 -3.278 1.00 0.30 C ATOM 410 C ARG A 150 4.800 -11.053 -4.104 1.00 0.33 C ATOM 411 O ARG A 150 4.579 -10.315 -5.035 1.00 0.40 O ATOM 412 CB ARG A 150 6.955 -12.003 -3.755 1.00 0.32 C ATOM 413 CG ARG A 150 8.289 -11.990 -3.105 1.00 0.78 C ATOM 414 CD ARG A 150 9.294 -12.715 -3.954 1.00 0.83 C ATOM 415 NE ARG A 150 9.463 -12.068 -5.253 1.00 0.94 N ATOM 416 CZ ARG A 150 10.648 -11.812 -5.801 1.00 1.23 C ATOM 417 NH1 ARG A 150 11.763 -12.032 -5.114 1.00 1.61 N ATOM 418 NH2 ARG A 150 10.715 -11.312 -7.026 1.00 1.36 N ATOM 0 H ARG A 150 6.270 -11.691 -1.329 1.00 0.27 H new ATOM 0 HA ARG A 150 6.492 -9.934 -3.391 1.00 0.30 H new ATOM 0 HB2 ARG A 150 6.485 -12.970 -3.576 1.00 0.32 H new ATOM 0 HB3 ARG A 150 7.087 -11.907 -4.833 1.00 0.32 H new ATOM 0 HG2 ARG A 150 8.613 -10.961 -2.946 1.00 0.78 H new ATOM 0 HG3 ARG A 150 8.227 -12.460 -2.123 1.00 0.78 H new ATOM 0 HD2 ARG A 150 10.252 -12.749 -3.436 1.00 0.83 H new ATOM 0 HD3 ARG A 150 8.973 -13.746 -4.099 1.00 0.83 H new ATOM 0 HE ARG A 150 8.626 -11.797 -5.769 1.00 0.94 H new ATOM 0 HH11 ARG A 150 11.712 -12.398 -4.163 1.00 1.61 H new ATOM 0 HH12 ARG A 150 12.670 -11.835 -5.537 1.00 1.61 H new ATOM 0 HH21 ARG A 150 9.859 -11.124 -7.548 1.00 1.36 H new ATOM 0 HH22 ARG A 150 11.623 -11.115 -7.448 1.00 1.36 H new ATOM 432 N GLU A 151 4.005 -12.004 -3.736 1.00 0.36 N ATOM 433 CA GLU A 151 2.922 -12.411 -4.536 1.00 0.45 C ATOM 434 C GLU A 151 1.732 -11.676 -4.022 1.00 0.49 C ATOM 435 O GLU A 151 0.798 -11.387 -4.767 1.00 0.59 O ATOM 436 CB GLU A 151 2.813 -13.916 -4.443 1.00 0.57 C ATOM 437 CG GLU A 151 2.669 -14.433 -3.037 1.00 0.82 C ATOM 438 CD GLU A 151 2.057 -15.810 -3.014 1.00 1.60 C ATOM 439 OE1 GLU A 151 2.675 -16.736 -3.583 1.00 2.16 O ATOM 440 OE2 GLU A 151 0.971 -15.982 -2.440 1.00 2.11 O ATOM 0 H GLU A 151 4.099 -12.519 -2.860 1.00 0.36 H new ATOM 0 HA GLU A 151 3.031 -12.180 -5.596 1.00 0.45 H new ATOM 0 HB2 GLU A 151 1.955 -14.245 -5.030 1.00 0.57 H new ATOM 0 HB3 GLU A 151 3.699 -14.363 -4.895 1.00 0.57 H new ATOM 0 HG2 GLU A 151 3.647 -14.460 -2.557 1.00 0.82 H new ATOM 0 HG3 GLU A 151 2.049 -13.748 -2.458 1.00 0.82 H new ATOM 447 N ASN A 152 1.820 -11.329 -2.735 1.00 0.45 N ATOM 448 CA ASN A 152 0.903 -10.406 -2.112 1.00 0.50 C ATOM 449 C ASN A 152 0.836 -9.135 -2.893 1.00 0.55 C ATOM 450 O ASN A 152 -0.194 -8.568 -2.996 1.00 0.88 O ATOM 451 CB ASN A 152 1.259 -10.151 -0.650 1.00 0.46 C ATOM 452 CG ASN A 152 1.303 -8.691 -0.277 1.00 0.51 C ATOM 453 OD1 ASN A 152 0.349 -8.140 0.236 1.00 0.85 O ATOM 454 ND2 ASN A 152 2.417 -8.061 -0.564 1.00 0.67 N ATOM 0 H ASN A 152 2.536 -11.689 -2.104 1.00 0.45 H new ATOM 0 HA ASN A 152 -0.088 -10.861 -2.116 1.00 0.50 H new ATOM 0 HB2 ASN A 152 0.531 -10.656 -0.016 1.00 0.46 H new ATOM 0 HB3 ASN A 152 2.230 -10.599 -0.439 1.00 0.46 H new ATOM 0 HD21 ASN A 152 2.508 -7.067 -0.357 1.00 0.67 H new ATOM 0 HD22 ASN A 152 3.192 -8.566 -0.995 1.00 0.67 H new ATOM 461 N MET A 153 1.917 -8.741 -3.505 1.00 0.43 N ATOM 462 CA MET A 153 1.927 -7.520 -4.284 1.00 0.46 C ATOM 463 C MET A 153 0.977 -7.590 -5.498 1.00 0.51 C ATOM 464 O MET A 153 0.487 -6.568 -5.985 1.00 0.63 O ATOM 465 CB MET A 153 3.357 -7.273 -4.706 1.00 0.42 C ATOM 466 CG MET A 153 3.550 -6.302 -5.870 1.00 0.92 C ATOM 467 SD MET A 153 3.294 -7.064 -7.484 1.00 1.27 S ATOM 468 CE MET A 153 3.948 -8.691 -7.153 1.00 1.39 C ATOM 0 H MET A 153 2.805 -9.242 -3.484 1.00 0.43 H new ATOM 0 HA MET A 153 1.557 -6.691 -3.680 1.00 0.46 H new ATOM 0 HB2 MET A 153 3.909 -6.894 -3.846 1.00 0.42 H new ATOM 0 HB3 MET A 153 3.806 -8.229 -4.977 1.00 0.42 H new ATOM 0 HG2 MET A 153 2.858 -5.467 -5.756 1.00 0.92 H new ATOM 0 HG3 MET A 153 4.558 -5.889 -5.827 1.00 0.92 H new ATOM 0 HE1 MET A 153 4.185 -9.186 -8.095 1.00 1.39 H new ATOM 0 HE2 MET A 153 4.853 -8.604 -6.551 1.00 1.39 H new ATOM 0 HE3 MET A 153 3.207 -9.278 -6.611 1.00 1.39 H new ATOM 478 N TYR A 154 0.718 -8.800 -5.969 1.00 0.49 N ATOM 479 CA TYR A 154 -0.112 -9.022 -7.152 1.00 0.55 C ATOM 480 C TYR A 154 -1.585 -9.089 -6.757 1.00 0.47 C ATOM 481 O TYR A 154 -2.460 -8.509 -7.401 1.00 0.59 O ATOM 482 CB TYR A 154 0.327 -10.332 -7.804 1.00 0.66 C ATOM 483 CG TYR A 154 -0.381 -10.678 -9.091 1.00 1.18 C ATOM 484 CD1 TYR A 154 -0.036 -10.051 -10.282 1.00 1.57 C ATOM 485 CD2 TYR A 154 -1.406 -11.612 -9.114 1.00 2.12 C ATOM 486 CE1 TYR A 154 -0.692 -10.348 -11.459 1.00 2.39 C ATOM 487 CE2 TYR A 154 -2.068 -11.913 -10.288 1.00 3.05 C ATOM 488 CZ TYR A 154 -1.663 -11.348 -11.462 1.00 3.08 C ATOM 489 OH TYR A 154 -2.367 -11.569 -12.627 1.00 4.05 O ATOM 0 H TYR A 154 1.075 -9.657 -5.546 1.00 0.49 H new ATOM 0 HA TYR A 154 0.009 -8.199 -7.856 1.00 0.55 H new ATOM 0 HB2 TYR A 154 1.398 -10.281 -8.000 1.00 0.66 H new ATOM 0 HB3 TYR A 154 0.171 -11.143 -7.093 1.00 0.66 H new ATOM 0 HD1 TYR A 154 0.758 -9.319 -10.287 1.00 1.57 H new ATOM 0 HD2 TYR A 154 -1.691 -12.112 -8.200 1.00 2.12 H new ATOM 0 HE1 TYR A 154 -0.456 -9.812 -12.367 1.00 2.39 H new ATOM 0 HE2 TYR A 154 -2.905 -12.595 -10.277 1.00 3.05 H new ATOM 0 HH TYR A 154 -3.011 -12.295 -12.488 1.00 4.05 H new ATOM 499 N ARG A 155 -1.818 -9.816 -5.684 1.00 0.37 N ATOM 500 CA ARG A 155 -3.133 -9.982 -5.072 1.00 0.36 C ATOM 501 C ARG A 155 -3.503 -8.704 -4.317 1.00 0.31 C ATOM 502 O ARG A 155 -4.553 -8.119 -4.517 1.00 0.41 O ATOM 503 CB ARG A 155 -3.018 -11.185 -4.139 1.00 0.43 C ATOM 504 CG ARG A 155 -1.699 -11.198 -3.399 1.00 0.63 C ATOM 505 CD ARG A 155 -1.376 -12.573 -2.800 1.00 0.58 C ATOM 506 NE ARG A 155 -0.696 -13.411 -3.778 1.00 0.78 N ATOM 507 CZ ARG A 155 -1.114 -14.621 -4.160 1.00 1.20 C ATOM 508 NH1 ARG A 155 -2.152 -15.182 -3.559 1.00 1.05 N ATOM 509 NH2 ARG A 155 -0.474 -15.278 -5.125 1.00 1.89 N ATOM 0 H ARG A 155 -1.081 -10.325 -5.195 1.00 0.37 H new ATOM 0 HA ARG A 155 -3.920 -10.155 -5.806 1.00 0.36 H new ATOM 0 HB2 ARG A 155 -3.838 -11.167 -3.421 1.00 0.43 H new ATOM 0 HB3 ARG A 155 -3.120 -12.104 -4.716 1.00 0.43 H new ATOM 0 HG2 ARG A 155 -0.900 -10.905 -4.081 1.00 0.63 H new ATOM 0 HG3 ARG A 155 -1.726 -10.455 -2.602 1.00 0.63 H new ATOM 0 HD2 ARG A 155 -0.748 -12.453 -1.917 1.00 0.58 H new ATOM 0 HD3 ARG A 155 -2.296 -13.059 -2.474 1.00 0.58 H new ATOM 0 HE ARG A 155 0.159 -13.049 -4.201 1.00 0.78 H new ATOM 0 HH11 ARG A 155 -2.632 -14.690 -2.805 1.00 1.05 H new ATOM 0 HH12 ARG A 155 -2.472 -16.106 -3.850 1.00 1.05 H new ATOM 0 HH21 ARG A 155 0.339 -14.858 -5.576 1.00 1.89 H new ATOM 0 HH22 ARG A 155 -0.796 -16.202 -5.414 1.00 1.89 H new ATOM 523 N TYR A 156 -2.574 -8.261 -3.507 1.00 0.27 N ATOM 524 CA TYR A 156 -2.683 -7.059 -2.693 1.00 0.28 C ATOM 525 C TYR A 156 -1.801 -6.011 -3.321 1.00 0.39 C ATOM 526 O TYR A 156 -0.584 -6.131 -3.309 1.00 0.78 O ATOM 527 CB TYR A 156 -2.183 -7.376 -1.299 1.00 0.35 C ATOM 528 CG TYR A 156 -2.872 -8.582 -0.717 1.00 0.95 C ATOM 529 CD1 TYR A 156 -4.220 -8.555 -0.402 1.00 1.51 C ATOM 530 CD2 TYR A 156 -2.176 -9.761 -0.528 1.00 1.36 C ATOM 531 CE1 TYR A 156 -4.854 -9.678 0.081 1.00 2.14 C ATOM 532 CE2 TYR A 156 -2.798 -10.881 -0.039 1.00 1.99 C ATOM 533 CZ TYR A 156 -4.135 -10.837 0.263 1.00 2.31 C ATOM 534 OH TYR A 156 -4.760 -11.963 0.722 1.00 2.98 O ATOM 0 H TYR A 156 -1.682 -8.742 -3.386 1.00 0.27 H new ATOM 0 HA TYR A 156 -3.713 -6.706 -2.635 1.00 0.28 H new ATOM 0 HB2 TYR A 156 -1.108 -7.552 -1.330 1.00 0.35 H new ATOM 0 HB3 TYR A 156 -2.347 -6.516 -0.650 1.00 0.35 H new ATOM 0 HD1 TYR A 156 -4.781 -7.642 -0.537 1.00 1.51 H new ATOM 0 HD2 TYR A 156 -1.124 -9.801 -0.770 1.00 1.36 H new ATOM 0 HE1 TYR A 156 -5.908 -9.649 0.315 1.00 2.14 H new ATOM 0 HE2 TYR A 156 -2.238 -11.793 0.108 1.00 1.99 H new ATOM 0 HH TYR A 156 -4.088 -12.636 0.960 1.00 2.98 H new ATOM 544 N PRO A 157 -2.359 -4.949 -3.843 1.00 0.28 N ATOM 545 CA PRO A 157 -1.720 -4.283 -4.950 1.00 0.29 C ATOM 546 C PRO A 157 -0.537 -3.432 -4.539 1.00 0.34 C ATOM 547 O PRO A 157 -0.302 -3.175 -3.356 1.00 0.66 O ATOM 548 CB PRO A 157 -2.831 -3.378 -5.444 1.00 0.31 C ATOM 549 CG PRO A 157 -3.420 -2.926 -4.158 1.00 0.32 C ATOM 550 CD PRO A 157 -3.528 -4.194 -3.346 1.00 0.33 C ATOM 0 HA PRO A 157 -1.319 -4.991 -5.675 1.00 0.29 H new ATOM 0 HB2 PRO A 157 -2.452 -2.547 -6.039 1.00 0.31 H new ATOM 0 HB3 PRO A 157 -3.552 -3.911 -6.063 1.00 0.31 H new ATOM 0 HG2 PRO A 157 -2.787 -2.188 -3.665 1.00 0.32 H new ATOM 0 HG3 PRO A 157 -4.395 -2.461 -4.306 1.00 0.32 H new ATOM 0 HD2 PRO A 157 -3.470 -4.003 -2.274 1.00 0.33 H new ATOM 0 HD3 PRO A 157 -4.465 -4.720 -3.526 1.00 0.33 H new ATOM 558 N ASN A 158 0.182 -2.958 -5.529 1.00 0.32 N ATOM 559 CA ASN A 158 1.225 -2.000 -5.292 1.00 0.31 C ATOM 560 C ASN A 158 0.734 -0.614 -5.654 1.00 0.33 C ATOM 561 O ASN A 158 1.259 0.047 -6.547 1.00 0.42 O ATOM 562 CB ASN A 158 2.507 -2.372 -6.041 1.00 0.40 C ATOM 563 CG ASN A 158 2.309 -2.763 -7.502 1.00 0.74 C ATOM 564 OD1 ASN A 158 2.982 -3.659 -8.002 1.00 1.47 O ATOM 565 ND2 ASN A 158 1.425 -2.073 -8.210 1.00 1.42 N ATOM 0 H ASN A 158 0.060 -3.223 -6.506 1.00 0.32 H new ATOM 0 HA ASN A 158 1.478 -2.006 -4.232 1.00 0.31 H new ATOM 0 HB2 ASN A 158 3.194 -1.527 -5.996 1.00 0.40 H new ATOM 0 HB3 ASN A 158 2.987 -3.201 -5.520 1.00 0.40 H new ATOM 0 HD21 ASN A 158 1.289 -2.281 -9.199 1.00 1.42 H new ATOM 0 HD22 ASN A 158 0.881 -1.334 -7.765 1.00 1.42 H new ATOM 572 N GLN A 159 -0.320 -0.207 -4.979 1.00 0.30 N ATOM 573 CA GLN A 159 -0.925 1.087 -5.209 1.00 0.31 C ATOM 574 C GLN A 159 -1.890 1.426 -4.088 1.00 0.28 C ATOM 575 O GLN A 159 -2.469 0.528 -3.476 1.00 0.29 O ATOM 576 CB GLN A 159 -1.644 1.087 -6.549 1.00 0.38 C ATOM 577 CG GLN A 159 -2.654 -0.047 -6.687 1.00 0.44 C ATOM 578 CD GLN A 159 -3.114 -0.288 -8.114 1.00 0.92 C ATOM 579 OE1 GLN A 159 -3.152 0.619 -8.937 1.00 1.63 O ATOM 580 NE2 GLN A 159 -3.468 -1.527 -8.412 1.00 1.50 N ATOM 0 H GLN A 159 -0.780 -0.762 -4.258 1.00 0.30 H new ATOM 0 HA GLN A 159 -0.143 1.846 -5.228 1.00 0.31 H new ATOM 0 HB2 GLN A 159 -2.157 2.040 -6.679 1.00 0.38 H new ATOM 0 HB3 GLN A 159 -0.908 1.009 -7.349 1.00 0.38 H new ATOM 0 HG2 GLN A 159 -2.212 -0.964 -6.298 1.00 0.44 H new ATOM 0 HG3 GLN A 159 -3.523 0.176 -6.068 1.00 0.44 H new ATOM 0 HE21 GLN A 159 -3.423 -2.256 -7.700 1.00 1.50 H new ATOM 0 HE22 GLN A 159 -3.786 -1.754 -9.354 1.00 1.50 H new ATOM 589 N VAL A 160 -2.082 2.711 -3.828 1.00 0.30 N ATOM 590 CA VAL A 160 -2.934 3.132 -2.743 1.00 0.28 C ATOM 591 C VAL A 160 -3.920 4.185 -3.194 1.00 0.31 C ATOM 592 O VAL A 160 -3.824 4.708 -4.297 1.00 0.53 O ATOM 593 CB VAL A 160 -2.151 3.645 -1.533 1.00 0.28 C ATOM 594 CG1 VAL A 160 -1.739 2.487 -0.629 1.00 0.30 C ATOM 595 CG2 VAL A 160 -0.949 4.458 -1.977 1.00 0.29 C ATOM 0 H VAL A 160 -1.657 3.473 -4.356 1.00 0.30 H new ATOM 0 HA VAL A 160 -3.477 2.240 -2.430 1.00 0.28 H new ATOM 0 HB VAL A 160 -2.799 4.303 -0.954 1.00 0.28 H new ATOM 0 HG11 VAL A 160 -1.183 2.873 0.226 1.00 0.30 H new ATOM 0 HG12 VAL A 160 -2.629 1.965 -0.278 1.00 0.30 H new ATOM 0 HG13 VAL A 160 -1.110 1.795 -1.188 1.00 0.30 H new ATOM 0 HG21 VAL A 160 -0.406 4.813 -1.101 1.00 0.29 H new ATOM 0 HG22 VAL A 160 -0.292 3.834 -2.583 1.00 0.29 H new ATOM 0 HG23 VAL A 160 -1.285 5.311 -2.567 1.00 0.29 H new ATOM 605 N TYR A 161 -4.892 4.462 -2.354 1.00 0.32 N ATOM 606 CA TYR A 161 -5.970 5.355 -2.714 1.00 0.36 C ATOM 607 C TYR A 161 -6.025 6.565 -1.777 1.00 0.34 C ATOM 608 O TYR A 161 -6.478 6.458 -0.641 1.00 0.42 O ATOM 609 CB TYR A 161 -7.276 4.575 -2.637 1.00 0.49 C ATOM 610 CG TYR A 161 -7.409 3.451 -3.644 1.00 0.44 C ATOM 611 CD1 TYR A 161 -7.957 3.688 -4.897 1.00 0.65 C ATOM 612 CD2 TYR A 161 -6.967 2.166 -3.356 1.00 0.38 C ATOM 613 CE1 TYR A 161 -8.065 2.683 -5.834 1.00 0.74 C ATOM 614 CE2 TYR A 161 -7.075 1.150 -4.290 1.00 0.49 C ATOM 615 CZ TYR A 161 -7.682 1.357 -5.454 1.00 0.63 C ATOM 616 OH TYR A 161 -7.725 0.418 -6.469 1.00 0.82 O ATOM 0 H TYR A 161 -4.958 4.079 -1.411 1.00 0.32 H new ATOM 0 HA TYR A 161 -5.807 5.731 -3.724 1.00 0.36 H new ATOM 0 HB2 TYR A 161 -7.375 4.158 -1.635 1.00 0.49 H new ATOM 0 HB3 TYR A 161 -8.105 5.269 -2.777 1.00 0.49 H new ATOM 0 HD1 TYR A 161 -8.306 4.680 -5.143 1.00 0.65 H new ATOM 0 HD2 TYR A 161 -6.533 1.957 -2.390 1.00 0.38 H new ATOM 0 HE1 TYR A 161 -8.429 2.891 -6.829 1.00 0.74 H new ATOM 0 HE2 TYR A 161 -6.661 0.177 -4.070 1.00 0.49 H new ATOM 0 HH TYR A 161 -7.432 -0.451 -6.123 1.00 0.82 H new ATOM 626 N TYR A 162 -5.554 7.707 -2.261 1.00 0.31 N ATOM 627 CA TYR A 162 -5.675 8.968 -1.534 1.00 0.27 C ATOM 628 C TYR A 162 -5.509 10.113 -2.499 1.00 0.31 C ATOM 629 O TYR A 162 -5.107 9.907 -3.607 1.00 0.55 O ATOM 630 CB TYR A 162 -4.659 9.115 -0.392 1.00 0.39 C ATOM 631 CG TYR A 162 -3.215 9.273 -0.812 1.00 0.46 C ATOM 632 CD1 TYR A 162 -2.532 8.287 -1.516 1.00 0.77 C ATOM 633 CD2 TYR A 162 -2.530 10.422 -0.477 1.00 0.89 C ATOM 634 CE1 TYR A 162 -1.206 8.463 -1.871 1.00 1.16 C ATOM 635 CE2 TYR A 162 -1.217 10.605 -0.823 1.00 1.29 C ATOM 636 CZ TYR A 162 -0.558 9.630 -1.515 1.00 1.35 C ATOM 637 OH TYR A 162 0.751 9.828 -1.850 1.00 1.82 O ATOM 0 H TYR A 162 -5.081 7.788 -3.161 1.00 0.31 H new ATOM 0 HA TYR A 162 -6.665 8.977 -1.077 1.00 0.27 H new ATOM 0 HB2 TYR A 162 -4.939 9.980 0.209 1.00 0.39 H new ATOM 0 HB3 TYR A 162 -4.736 8.240 0.253 1.00 0.39 H new ATOM 0 HD1 TYR A 162 -3.042 7.375 -1.788 1.00 0.77 H new ATOM 0 HD2 TYR A 162 -3.042 11.198 0.073 1.00 0.89 H new ATOM 0 HE1 TYR A 162 -0.683 7.695 -2.421 1.00 1.16 H new ATOM 0 HE2 TYR A 162 -0.706 11.516 -0.550 1.00 1.29 H new ATOM 0 HH TYR A 162 1.218 10.260 -1.105 1.00 1.82 H new ATOM 647 N ARG A 163 -5.815 11.306 -2.070 1.00 0.26 N ATOM 648 CA ARG A 163 -5.646 12.485 -2.886 1.00 0.32 C ATOM 649 C ARG A 163 -4.333 13.133 -2.463 1.00 0.36 C ATOM 650 O ARG A 163 -3.770 12.718 -1.460 1.00 0.41 O ATOM 651 CB ARG A 163 -6.822 13.451 -2.705 1.00 0.41 C ATOM 652 CG ARG A 163 -6.731 14.283 -1.439 1.00 0.75 C ATOM 653 CD ARG A 163 -7.667 15.473 -1.493 1.00 1.28 C ATOM 654 NE ARG A 163 -8.916 15.228 -0.775 1.00 1.93 N ATOM 655 CZ ARG A 163 -9.802 16.175 -0.476 1.00 2.58 C ATOM 656 NH1 ARG A 163 -9.593 17.433 -0.849 1.00 2.91 N ATOM 657 NH2 ARG A 163 -10.901 15.853 0.192 1.00 3.26 N ATOM 0 H ARG A 163 -6.191 11.493 -1.140 1.00 0.26 H new ATOM 0 HA ARG A 163 -5.621 12.222 -3.944 1.00 0.32 H new ATOM 0 HB2 ARG A 163 -6.870 14.118 -3.566 1.00 0.41 H new ATOM 0 HB3 ARG A 163 -7.751 12.881 -2.690 1.00 0.41 H new ATOM 0 HG2 ARG A 163 -6.976 13.664 -0.576 1.00 0.75 H new ATOM 0 HG3 ARG A 163 -5.707 14.629 -1.302 1.00 0.75 H new ATOM 0 HD2 ARG A 163 -7.169 16.344 -1.066 1.00 1.28 H new ATOM 0 HD3 ARG A 163 -7.889 15.711 -2.533 1.00 1.28 H new ATOM 0 HE ARG A 163 -9.121 14.272 -0.485 1.00 1.93 H new ATOM 0 HH11 ARG A 163 -8.750 17.678 -1.368 1.00 2.91 H new ATOM 0 HH12 ARG A 163 -10.276 18.154 -0.617 1.00 2.91 H new ATOM 0 HH21 ARG A 163 -11.062 14.886 0.473 1.00 3.26 H new ATOM 0 HH22 ARG A 163 -11.585 16.573 0.425 1.00 3.26 H new ATOM 671 N PRO A 164 -3.818 14.167 -3.139 1.00 0.45 N ATOM 672 CA PRO A 164 -2.414 14.517 -2.999 1.00 0.51 C ATOM 673 C PRO A 164 -2.159 15.423 -1.812 1.00 0.51 C ATOM 674 O PRO A 164 -2.681 16.534 -1.693 1.00 0.57 O ATOM 675 CB PRO A 164 -2.108 15.292 -4.288 1.00 0.65 C ATOM 676 CG PRO A 164 -3.359 15.236 -5.109 1.00 0.80 C ATOM 677 CD PRO A 164 -4.475 15.008 -4.136 1.00 0.53 C ATOM 0 HA PRO A 164 -1.799 13.631 -2.842 1.00 0.51 H new ATOM 0 HB2 PRO A 164 -1.832 16.323 -4.067 1.00 0.65 H new ATOM 0 HB3 PRO A 164 -1.270 14.845 -4.823 1.00 0.65 H new ATOM 0 HG2 PRO A 164 -3.506 16.164 -5.662 1.00 0.80 H new ATOM 0 HG3 PRO A 164 -3.310 14.432 -5.843 1.00 0.80 H new ATOM 0 HD2 PRO A 164 -4.844 15.940 -3.708 1.00 0.53 H new ATOM 0 HD3 PRO A 164 -5.327 14.509 -4.597 1.00 0.53 H new ATOM 685 N VAL A 165 -1.357 14.868 -0.925 1.00 0.52 N ATOM 686 CA VAL A 165 -1.039 15.443 0.356 1.00 0.50 C ATOM 687 C VAL A 165 0.410 15.920 0.340 1.00 0.49 C ATOM 688 O VAL A 165 1.174 15.540 -0.546 1.00 0.47 O ATOM 689 CB VAL A 165 -1.211 14.362 1.441 1.00 0.50 C ATOM 690 CG1 VAL A 165 -0.129 13.308 1.279 1.00 1.31 C ATOM 691 CG2 VAL A 165 -1.199 14.967 2.840 1.00 1.15 C ATOM 0 H VAL A 165 -0.895 13.973 -1.087 1.00 0.52 H new ATOM 0 HA VAL A 165 -1.699 16.285 0.566 1.00 0.50 H new ATOM 0 HB VAL A 165 -2.185 13.888 1.315 1.00 0.50 H new ATOM 0 HG11 VAL A 165 -0.249 12.543 2.046 1.00 1.31 H new ATOM 0 HG12 VAL A 165 -0.212 12.850 0.293 1.00 1.31 H new ATOM 0 HG13 VAL A 165 0.851 13.774 1.382 1.00 1.31 H new ATOM 0 HG21 VAL A 165 -1.323 14.176 3.580 1.00 1.15 H new ATOM 0 HG22 VAL A 165 -0.250 15.476 3.008 1.00 1.15 H new ATOM 0 HG23 VAL A 165 -2.016 15.682 2.934 1.00 1.15 H new ATOM 701 N ASP A 166 0.785 16.733 1.313 1.00 0.62 N ATOM 702 CA ASP A 166 2.164 17.183 1.430 1.00 0.67 C ATOM 703 C ASP A 166 2.359 17.972 2.713 1.00 0.90 C ATOM 704 O ASP A 166 3.470 18.064 3.233 1.00 1.48 O ATOM 705 CB ASP A 166 2.567 18.015 0.203 1.00 0.62 C ATOM 706 CG ASP A 166 2.789 19.497 0.503 1.00 0.70 C ATOM 707 OD1 ASP A 166 1.803 20.267 0.494 1.00 1.07 O ATOM 708 OD2 ASP A 166 3.952 19.900 0.737 1.00 0.90 O ATOM 0 H ASP A 166 0.158 17.094 2.031 1.00 0.62 H new ATOM 0 HA ASP A 166 2.812 16.308 1.470 1.00 0.67 H new ATOM 0 HB2 ASP A 166 3.481 17.600 -0.221 1.00 0.62 H new ATOM 0 HB3 ASP A 166 1.792 17.921 -0.558 1.00 0.62 H new ATOM 713 N GLN A 167 1.268 18.514 3.236 1.00 0.75 N ATOM 714 CA GLN A 167 1.328 19.330 4.438 1.00 0.96 C ATOM 715 C GLN A 167 0.370 18.820 5.517 1.00 0.87 C ATOM 716 O GLN A 167 -0.622 19.472 5.858 1.00 1.10 O ATOM 717 CB GLN A 167 1.042 20.792 4.086 1.00 1.34 C ATOM 718 CG GLN A 167 -0.182 20.991 3.205 1.00 1.50 C ATOM 719 CD GLN A 167 -0.235 22.375 2.593 1.00 2.16 C ATOM 720 OE1 GLN A 167 -0.803 23.309 3.167 1.00 2.71 O ATOM 721 NE2 GLN A 167 0.368 22.515 1.425 1.00 2.72 N ATOM 0 H GLN A 167 0.332 18.403 2.846 1.00 0.75 H new ATOM 0 HA GLN A 167 2.334 19.259 4.852 1.00 0.96 H new ATOM 0 HB2 GLN A 167 0.908 21.357 5.008 1.00 1.34 H new ATOM 0 HB3 GLN A 167 1.912 21.210 3.580 1.00 1.34 H new ATOM 0 HG2 GLN A 167 -0.179 20.245 2.410 1.00 1.50 H new ATOM 0 HG3 GLN A 167 -1.082 20.823 3.796 1.00 1.50 H new ATOM 0 HE21 GLN A 167 0.825 21.715 0.988 1.00 2.72 H new ATOM 0 HE22 GLN A 167 0.377 23.423 0.961 1.00 2.72 H new ATOM 730 N TYR A 168 0.664 17.637 6.039 1.00 0.82 N ATOM 731 CA TYR A 168 -0.114 17.063 7.126 1.00 0.92 C ATOM 732 C TYR A 168 0.752 16.981 8.385 1.00 0.95 C ATOM 733 O TYR A 168 1.979 17.056 8.299 1.00 1.61 O ATOM 734 CB TYR A 168 -0.618 15.672 6.729 1.00 1.02 C ATOM 735 CG TYR A 168 -1.865 15.229 7.463 1.00 1.24 C ATOM 736 CD1 TYR A 168 -3.119 15.657 7.049 1.00 1.62 C ATOM 737 CD2 TYR A 168 -1.791 14.385 8.561 1.00 2.02 C ATOM 738 CE1 TYR A 168 -4.264 15.257 7.711 1.00 2.11 C ATOM 739 CE2 TYR A 168 -2.930 13.978 9.227 1.00 2.63 C ATOM 740 CZ TYR A 168 -4.164 14.417 8.798 1.00 2.50 C ATOM 741 OH TYR A 168 -5.298 14.021 9.466 1.00 3.21 O ATOM 0 H TYR A 168 1.440 17.054 5.725 1.00 0.82 H new ATOM 0 HA TYR A 168 -0.977 17.697 7.331 1.00 0.92 H new ATOM 0 HB2 TYR A 168 -0.819 15.663 5.658 1.00 1.02 H new ATOM 0 HB3 TYR A 168 0.174 14.946 6.911 1.00 1.02 H new ATOM 0 HD1 TYR A 168 -3.201 16.313 6.195 1.00 1.62 H new ATOM 0 HD2 TYR A 168 -0.826 14.040 8.901 1.00 2.02 H new ATOM 0 HE1 TYR A 168 -5.232 15.601 7.378 1.00 2.11 H new ATOM 0 HE2 TYR A 168 -2.854 13.319 10.079 1.00 2.63 H new ATOM 0 HH TYR A 168 -5.051 13.429 10.207 1.00 3.21 H new ATOM 751 N SER A 169 0.118 16.841 9.545 1.00 1.17 N ATOM 752 CA SER A 169 0.843 16.766 10.808 1.00 1.17 C ATOM 753 C SER A 169 1.492 15.393 10.992 1.00 1.05 C ATOM 754 O SER A 169 2.691 15.294 11.262 1.00 1.12 O ATOM 755 CB SER A 169 -0.102 17.079 11.971 1.00 1.40 C ATOM 756 OG SER A 169 -0.692 18.361 11.806 1.00 1.94 O ATOM 0 H SER A 169 -0.896 16.777 9.636 1.00 1.17 H new ATOM 0 HA SER A 169 1.641 17.508 10.792 1.00 1.17 H new ATOM 0 HB2 SER A 169 -0.881 16.319 12.028 1.00 1.40 H new ATOM 0 HB3 SER A 169 0.447 17.044 12.912 1.00 1.40 H new ATOM 0 HG SER A 169 -1.294 18.543 12.558 1.00 1.94 H new ATOM 762 N ASN A 170 0.702 14.337 10.839 1.00 0.98 N ATOM 763 CA ASN A 170 1.218 12.974 10.941 1.00 0.89 C ATOM 764 C ASN A 170 1.089 12.266 9.605 1.00 0.68 C ATOM 765 O ASN A 170 -0.017 11.937 9.168 1.00 0.75 O ATOM 766 CB ASN A 170 0.482 12.171 12.019 1.00 1.08 C ATOM 767 CG ASN A 170 0.805 12.634 13.426 1.00 1.74 C ATOM 768 OD1 ASN A 170 0.126 13.496 13.980 1.00 2.20 O ATOM 769 ND2 ASN A 170 1.842 12.063 14.017 1.00 2.25 N ATOM 0 H ASN A 170 -0.297 14.396 10.644 1.00 0.98 H new ATOM 0 HA ASN A 170 2.269 13.040 11.223 1.00 0.89 H new ATOM 0 HB2 ASN A 170 -0.592 12.251 11.854 1.00 1.08 H new ATOM 0 HB3 ASN A 170 0.742 11.117 11.920 1.00 1.08 H new ATOM 0 HD21 ASN A 170 2.102 12.335 14.965 1.00 2.25 H new ATOM 0 HD22 ASN A 170 2.381 11.351 13.524 1.00 2.25 H new ATOM 776 N GLN A 171 2.221 12.011 8.963 1.00 0.63 N ATOM 777 CA GLN A 171 2.217 11.457 7.617 1.00 0.56 C ATOM 778 C GLN A 171 1.704 10.024 7.626 1.00 0.47 C ATOM 779 O GLN A 171 1.108 9.568 6.662 1.00 0.60 O ATOM 780 CB GLN A 171 3.614 11.529 6.970 1.00 0.86 C ATOM 781 CG GLN A 171 4.636 10.514 7.478 1.00 0.71 C ATOM 782 CD GLN A 171 5.050 10.735 8.920 1.00 1.11 C ATOM 783 OE1 GLN A 171 5.960 11.510 9.203 1.00 1.63 O ATOM 784 NE2 GLN A 171 4.409 10.032 9.835 1.00 1.41 N ATOM 0 H GLN A 171 3.150 12.178 9.351 1.00 0.63 H new ATOM 0 HA GLN A 171 1.542 12.064 7.014 1.00 0.56 H new ATOM 0 HB2 GLN A 171 3.502 11.396 5.894 1.00 0.86 H new ATOM 0 HB3 GLN A 171 4.015 12.530 7.128 1.00 0.86 H new ATOM 0 HG2 GLN A 171 4.220 9.512 7.378 1.00 0.71 H new ATOM 0 HG3 GLN A 171 5.522 10.556 6.844 1.00 0.71 H new ATOM 0 HE21 GLN A 171 3.659 9.399 9.559 1.00 1.41 H new ATOM 0 HE22 GLN A 171 4.664 10.122 10.818 1.00 1.41 H new ATOM 793 N ASN A 172 1.889 9.345 8.747 1.00 0.47 N ATOM 794 CA ASN A 172 1.536 7.936 8.860 1.00 0.49 C ATOM 795 C ASN A 172 0.037 7.772 8.998 1.00 0.42 C ATOM 796 O ASN A 172 -0.537 6.830 8.474 1.00 0.52 O ATOM 797 CB ASN A 172 2.243 7.287 10.057 1.00 0.65 C ATOM 798 CG ASN A 172 1.958 8.000 11.372 1.00 1.19 C ATOM 799 OD1 ASN A 172 1.676 9.200 11.396 1.00 1.88 O ATOM 800 ND2 ASN A 172 2.051 7.281 12.475 1.00 1.56 N ATOM 0 H ASN A 172 2.284 9.748 9.597 1.00 0.47 H new ATOM 0 HA ASN A 172 1.865 7.436 7.949 1.00 0.49 H new ATOM 0 HB2 ASN A 172 1.928 6.247 10.138 1.00 0.65 H new ATOM 0 HB3 ASN A 172 3.318 7.282 9.878 1.00 0.65 H new ATOM 0 HD21 ASN A 172 1.888 7.716 13.383 1.00 1.56 H new ATOM 0 HD22 ASN A 172 2.286 6.290 12.420 1.00 1.56 H new ATOM 807 N SER A 173 -0.590 8.704 9.691 1.00 0.41 N ATOM 808 CA SER A 173 -2.023 8.656 9.911 1.00 0.46 C ATOM 809 C SER A 173 -2.771 8.858 8.600 1.00 0.37 C ATOM 810 O SER A 173 -3.677 8.094 8.269 1.00 0.36 O ATOM 811 CB SER A 173 -2.411 9.721 10.941 1.00 0.60 C ATOM 812 OG SER A 173 -3.799 9.694 11.233 1.00 0.74 O ATOM 0 H SER A 173 -0.126 9.508 10.113 1.00 0.41 H new ATOM 0 HA SER A 173 -2.300 7.675 10.298 1.00 0.46 H new ATOM 0 HB2 SER A 173 -1.844 9.562 11.858 1.00 0.60 H new ATOM 0 HB3 SER A 173 -2.138 10.707 10.564 1.00 0.60 H new ATOM 0 HG SER A 173 -4.008 10.386 11.895 1.00 0.74 H new ATOM 818 N PHE A 174 -2.367 9.868 7.844 1.00 0.33 N ATOM 819 CA PHE A 174 -2.987 10.148 6.559 1.00 0.32 C ATOM 820 C PHE A 174 -2.653 9.041 5.556 1.00 0.24 C ATOM 821 O PHE A 174 -3.510 8.601 4.788 1.00 0.30 O ATOM 822 CB PHE A 174 -2.523 11.515 6.042 1.00 0.40 C ATOM 823 CG PHE A 174 -3.049 11.868 4.678 1.00 0.61 C ATOM 824 CD1 PHE A 174 -2.422 11.411 3.527 1.00 0.99 C ATOM 825 CD2 PHE A 174 -4.176 12.657 4.550 1.00 1.12 C ATOM 826 CE1 PHE A 174 -2.917 11.740 2.274 1.00 1.29 C ATOM 827 CE2 PHE A 174 -4.671 12.988 3.309 1.00 1.41 C ATOM 828 CZ PHE A 174 -3.998 12.507 2.144 1.00 1.33 C ATOM 0 H PHE A 174 -1.613 10.506 8.098 1.00 0.33 H new ATOM 0 HA PHE A 174 -4.070 10.176 6.683 1.00 0.32 H new ATOM 0 HB2 PHE A 174 -2.834 12.284 6.749 1.00 0.40 H new ATOM 0 HB3 PHE A 174 -1.433 11.530 6.014 1.00 0.40 H new ATOM 0 HD1 PHE A 174 -1.540 10.793 3.608 1.00 0.99 H new ATOM 0 HD2 PHE A 174 -4.676 13.019 5.436 1.00 1.12 H new ATOM 0 HE1 PHE A 174 -2.419 11.369 1.391 1.00 1.29 H new ATOM 0 HE2 PHE A 174 -5.555 13.602 3.217 1.00 1.41 H new ATOM 0 HZ PHE A 174 -4.365 12.765 1.161 1.00 1.33 H new ATOM 838 N VAL A 175 -1.407 8.589 5.578 1.00 0.20 N ATOM 839 CA VAL A 175 -0.962 7.531 4.682 1.00 0.20 C ATOM 840 C VAL A 175 -1.670 6.211 4.976 1.00 0.22 C ATOM 841 O VAL A 175 -2.410 5.703 4.141 1.00 0.25 O ATOM 842 CB VAL A 175 0.558 7.335 4.784 1.00 0.28 C ATOM 843 CG1 VAL A 175 0.949 5.943 4.354 1.00 0.33 C ATOM 844 CG2 VAL A 175 1.286 8.362 3.942 1.00 0.41 C ATOM 0 H VAL A 175 -0.685 8.939 6.208 1.00 0.20 H new ATOM 0 HA VAL A 175 -1.217 7.839 3.668 1.00 0.20 H new ATOM 0 HB VAL A 175 0.845 7.470 5.827 1.00 0.28 H new ATOM 0 HG11 VAL A 175 2.030 5.827 4.435 1.00 0.33 H new ATOM 0 HG12 VAL A 175 0.457 5.212 4.996 1.00 0.33 H new ATOM 0 HG13 VAL A 175 0.643 5.782 3.320 1.00 0.33 H new ATOM 0 HG21 VAL A 175 2.361 8.206 4.028 1.00 0.41 H new ATOM 0 HG22 VAL A 175 0.986 8.256 2.899 1.00 0.41 H new ATOM 0 HG23 VAL A 175 1.035 9.363 4.292 1.00 0.41 H new ATOM 854 N HIS A 176 -1.400 5.638 6.145 1.00 0.26 N ATOM 855 CA HIS A 176 -2.157 4.478 6.640 1.00 0.33 C ATOM 856 C HIS A 176 -3.674 4.597 6.373 1.00 0.30 C ATOM 857 O HIS A 176 -4.353 3.585 6.244 1.00 0.32 O ATOM 858 CB HIS A 176 -1.904 4.270 8.138 1.00 0.46 C ATOM 859 CG HIS A 176 -2.356 2.935 8.655 1.00 0.73 C ATOM 860 ND1 HIS A 176 -1.527 1.831 8.731 1.00 0.97 N ATOM 861 CD2 HIS A 176 -3.561 2.527 9.123 1.00 1.40 C ATOM 862 CE1 HIS A 176 -2.204 0.808 9.220 1.00 1.32 C ATOM 863 NE2 HIS A 176 -3.437 1.207 9.464 1.00 1.69 N ATOM 0 H HIS A 176 -0.662 5.954 6.774 1.00 0.26 H new ATOM 0 HA HIS A 176 -1.798 3.611 6.085 1.00 0.33 H new ATOM 0 HB2 HIS A 176 -0.838 4.382 8.335 1.00 0.46 H new ATOM 0 HB3 HIS A 176 -2.415 5.056 8.695 1.00 0.46 H new ATOM 0 HD1 HIS A 176 -0.546 1.810 8.453 1.00 0.97 H new ATOM 0 HD2 HIS A 176 -4.452 3.131 9.210 1.00 1.40 H new ATOM 0 HE1 HIS A 176 -1.815 -0.185 9.391 1.00 1.32 H new ATOM 872 N ASP A 177 -4.207 5.817 6.292 1.00 0.30 N ATOM 873 CA ASP A 177 -5.626 6.014 5.955 1.00 0.33 C ATOM 874 C ASP A 177 -5.900 5.664 4.503 1.00 0.28 C ATOM 875 O ASP A 177 -6.873 4.988 4.217 1.00 0.29 O ATOM 876 CB ASP A 177 -6.057 7.452 6.249 1.00 0.41 C ATOM 877 CG ASP A 177 -7.560 7.592 6.343 1.00 0.60 C ATOM 878 OD1 ASP A 177 -8.165 6.935 7.223 1.00 0.81 O ATOM 879 OD2 ASP A 177 -8.147 8.374 5.568 1.00 0.84 O ATOM 0 H ASP A 177 -3.687 6.679 6.453 1.00 0.30 H new ATOM 0 HA ASP A 177 -6.213 5.341 6.580 1.00 0.33 H new ATOM 0 HB2 ASP A 177 -5.604 7.781 7.184 1.00 0.41 H new ATOM 0 HB3 ASP A 177 -5.681 8.109 5.465 1.00 0.41 H new ATOM 884 N CYS A 178 -5.013 6.077 3.605 1.00 0.26 N ATOM 885 CA CYS A 178 -5.130 5.774 2.186 1.00 0.27 C ATOM 886 C CYS A 178 -5.108 4.265 1.978 1.00 0.24 C ATOM 887 O CYS A 178 -5.667 3.737 1.019 1.00 0.29 O ATOM 888 CB CYS A 178 -3.967 6.399 1.410 1.00 0.34 C ATOM 889 SG CYS A 178 -2.566 5.268 1.169 1.00 0.79 S ATOM 0 H CYS A 178 -4.191 6.633 3.842 1.00 0.26 H new ATOM 0 HA CYS A 178 -6.071 6.186 1.821 1.00 0.27 H new ATOM 0 HB2 CYS A 178 -4.327 6.731 0.436 1.00 0.34 H new ATOM 0 HB3 CYS A 178 -3.621 7.286 1.941 1.00 0.34 H new ATOM 894 N VAL A 179 -4.437 3.573 2.886 1.00 0.23 N ATOM 895 CA VAL A 179 -4.377 2.130 2.842 1.00 0.22 C ATOM 896 C VAL A 179 -5.567 1.551 3.580 1.00 0.22 C ATOM 897 O VAL A 179 -6.069 0.494 3.232 1.00 0.22 O ATOM 898 CB VAL A 179 -3.068 1.595 3.436 1.00 0.21 C ATOM 899 CG1 VAL A 179 -1.987 2.636 3.339 1.00 0.21 C ATOM 900 CG2 VAL A 179 -3.241 1.100 4.856 1.00 0.24 C ATOM 0 H VAL A 179 -3.927 3.994 3.662 1.00 0.23 H new ATOM 0 HA VAL A 179 -4.408 1.821 1.797 1.00 0.22 H new ATOM 0 HB VAL A 179 -2.766 0.729 2.846 1.00 0.21 H new ATOM 0 HG11 VAL A 179 -1.064 2.243 3.764 1.00 0.21 H new ATOM 0 HG12 VAL A 179 -1.823 2.894 2.293 1.00 0.21 H new ATOM 0 HG13 VAL A 179 -2.289 3.527 3.890 1.00 0.21 H new ATOM 0 HG21 VAL A 179 -2.286 0.732 5.232 1.00 0.24 H new ATOM 0 HG22 VAL A 179 -3.588 1.918 5.487 1.00 0.24 H new ATOM 0 HG23 VAL A 179 -3.974 0.293 4.873 1.00 0.24 H new ATOM 910 N ASN A 180 -6.054 2.278 4.576 1.00 0.25 N ATOM 911 CA ASN A 180 -7.299 1.920 5.231 1.00 0.27 C ATOM 912 C ASN A 180 -8.426 2.045 4.212 1.00 0.27 C ATOM 913 O ASN A 180 -9.586 1.763 4.492 1.00 0.30 O ATOM 914 CB ASN A 180 -7.543 2.806 6.456 1.00 0.31 C ATOM 915 CG ASN A 180 -8.620 2.256 7.372 1.00 0.77 C ATOM 916 OD1 ASN A 180 -9.792 2.613 7.270 1.00 1.41 O ATOM 917 ND2 ASN A 180 -8.225 1.364 8.267 1.00 1.30 N ATOM 0 H ASN A 180 -5.606 3.116 4.945 1.00 0.25 H new ATOM 0 HA ASN A 180 -7.253 0.893 5.593 1.00 0.27 H new ATOM 0 HB2 ASN A 180 -6.613 2.909 7.016 1.00 0.31 H new ATOM 0 HB3 ASN A 180 -7.828 3.805 6.126 1.00 0.31 H new ATOM 0 HD21 ASN A 180 -8.903 0.946 8.904 1.00 1.30 H new ATOM 0 HD22 ASN A 180 -7.243 1.095 8.319 1.00 1.30 H new ATOM 924 N ILE A 181 -8.053 2.533 3.036 1.00 0.25 N ATOM 925 CA ILE A 181 -8.853 2.420 1.836 1.00 0.29 C ATOM 926 C ILE A 181 -8.375 1.221 1.001 1.00 0.27 C ATOM 927 O ILE A 181 -9.135 0.324 0.709 1.00 0.36 O ATOM 928 CB ILE A 181 -8.742 3.690 0.973 1.00 0.35 C ATOM 929 CG1 ILE A 181 -8.366 4.882 1.823 1.00 0.49 C ATOM 930 CG2 ILE A 181 -10.048 3.986 0.298 1.00 0.40 C ATOM 931 CD1 ILE A 181 -9.495 5.416 2.681 1.00 1.14 C ATOM 0 H ILE A 181 -7.171 3.025 2.893 1.00 0.25 H new ATOM 0 HA ILE A 181 -9.891 2.283 2.140 1.00 0.29 H new ATOM 0 HB ILE A 181 -7.970 3.511 0.225 1.00 0.35 H new ATOM 0 HG12 ILE A 181 -7.534 4.604 2.470 1.00 0.49 H new ATOM 0 HG13 ILE A 181 -8.011 5.681 1.172 1.00 0.49 H new ATOM 0 HG21 ILE A 181 -9.949 4.887 -0.307 1.00 0.40 H new ATOM 0 HG22 ILE A 181 -10.325 3.148 -0.342 1.00 0.40 H new ATOM 0 HG23 ILE A 181 -10.821 4.138 1.052 1.00 0.40 H new ATOM 0 HD11 ILE A 181 -9.141 6.270 3.259 1.00 1.14 H new ATOM 0 HD12 ILE A 181 -10.321 5.728 2.042 1.00 1.14 H new ATOM 0 HD13 ILE A 181 -9.836 4.635 3.360 1.00 1.14 H new ATOM 943 N THR A 182 -7.085 1.183 0.693 1.00 0.20 N ATOM 944 CA THR A 182 -6.516 0.235 -0.276 1.00 0.20 C ATOM 945 C THR A 182 -6.665 -1.186 0.163 1.00 0.24 C ATOM 946 O THR A 182 -7.167 -2.043 -0.572 1.00 0.26 O ATOM 947 CB THR A 182 -5.017 0.473 -0.508 1.00 0.20 C ATOM 948 OG1 THR A 182 -4.840 1.689 -1.194 1.00 0.22 O ATOM 949 CG2 THR A 182 -4.415 -0.652 -1.335 1.00 0.26 C ATOM 0 H THR A 182 -6.394 1.809 1.107 1.00 0.20 H new ATOM 0 HA THR A 182 -7.077 0.408 -1.194 1.00 0.20 H new ATOM 0 HB THR A 182 -4.517 0.507 0.460 1.00 0.20 H new ATOM 0 HG1 THR A 182 -4.915 2.435 -0.563 1.00 0.22 H new ATOM 0 HG21 THR A 182 -3.352 -0.463 -1.487 1.00 0.26 H new ATOM 0 HG22 THR A 182 -4.544 -1.599 -0.810 1.00 0.26 H new ATOM 0 HG23 THR A 182 -4.917 -0.702 -2.301 1.00 0.26 H new ATOM 957 N VAL A 183 -6.223 -1.417 1.371 1.00 0.28 N ATOM 958 CA VAL A 183 -6.223 -2.725 1.950 1.00 0.36 C ATOM 959 C VAL A 183 -7.659 -3.140 2.196 1.00 0.44 C ATOM 960 O VAL A 183 -7.944 -4.208 2.722 1.00 0.74 O ATOM 961 CB VAL A 183 -5.383 -2.729 3.248 1.00 0.34 C ATOM 962 CG1 VAL A 183 -4.255 -1.735 3.136 1.00 0.26 C ATOM 963 CG2 VAL A 183 -6.214 -2.453 4.493 1.00 0.40 C ATOM 0 H VAL A 183 -5.850 -0.691 1.983 1.00 0.28 H new ATOM 0 HA VAL A 183 -5.765 -3.447 1.274 1.00 0.36 H new ATOM 0 HB VAL A 183 -4.977 -3.734 3.362 1.00 0.34 H new ATOM 0 HG11 VAL A 183 -3.669 -1.745 4.055 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -3.616 -2.003 2.295 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -4.664 -0.737 2.977 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -5.569 -2.469 5.372 1.00 0.40 H new ATOM 0 HG22 VAL A 183 -6.685 -1.474 4.406 1.00 0.40 H new ATOM 0 HG23 VAL A 183 -6.983 -3.218 4.594 1.00 0.40 H new ATOM 973 N LYS A 184 -8.562 -2.229 1.871 1.00 0.32 N ATOM 974 CA LYS A 184 -9.969 -2.509 1.910 1.00 0.34 C ATOM 975 C LYS A 184 -10.467 -2.873 0.533 1.00 0.35 C ATOM 976 O LYS A 184 -10.759 -4.018 0.238 1.00 0.37 O ATOM 977 CB LYS A 184 -10.747 -1.295 2.389 1.00 0.38 C ATOM 978 CG LYS A 184 -10.407 -0.842 3.792 1.00 0.43 C ATOM 979 CD LYS A 184 -9.509 -1.815 4.481 1.00 0.76 C ATOM 980 CE LYS A 184 -9.255 -1.456 5.932 1.00 0.60 C ATOM 981 NZ LYS A 184 -10.517 -1.286 6.704 1.00 1.00 N ATOM 0 H LYS A 184 -8.331 -1.281 1.575 1.00 0.32 H new ATOM 0 HA LYS A 184 -10.122 -3.340 2.599 1.00 0.34 H new ATOM 0 HB2 LYS A 184 -10.566 -0.469 1.701 1.00 0.38 H new ATOM 0 HB3 LYS A 184 -11.812 -1.521 2.342 1.00 0.38 H new ATOM 0 HG2 LYS A 184 -9.924 0.135 3.753 1.00 0.43 H new ATOM 0 HG3 LYS A 184 -11.324 -0.721 4.368 1.00 0.43 H new ATOM 0 HD2 LYS A 184 -9.952 -2.810 4.430 1.00 0.76 H new ATOM 0 HD3 LYS A 184 -8.557 -1.862 3.951 1.00 0.76 H new ATOM 0 HE2 LYS A 184 -8.651 -2.236 6.396 1.00 0.60 H new ATOM 0 HE3 LYS A 184 -8.676 -0.534 5.979 1.00 0.60 H new ATOM 0 HZ1 LYS A 184 -10.303 -1.278 7.722 1.00 1.00 H new ATOM 0 HZ2 LYS A 184 -10.968 -0.388 6.438 1.00 1.00 H new ATOM 0 HZ3 LYS A 184 -11.162 -2.074 6.492 1.00 1.00 H new ATOM 995 N GLN A 185 -10.444 -1.872 -0.325 1.00 0.38 N ATOM 996 CA GLN A 185 -11.091 -1.902 -1.632 1.00 0.49 C ATOM 997 C GLN A 185 -10.626 -3.076 -2.462 1.00 0.51 C ATOM 998 O GLN A 185 -11.294 -3.500 -3.404 1.00 0.64 O ATOM 999 CB GLN A 185 -10.779 -0.589 -2.322 1.00 0.60 C ATOM 1000 CG GLN A 185 -10.894 0.561 -1.346 1.00 0.78 C ATOM 1001 CD GLN A 185 -12.291 0.708 -0.788 1.00 1.38 C ATOM 1002 OE1 GLN A 185 -13.267 0.370 -1.445 1.00 1.83 O ATOM 1003 NE2 GLN A 185 -12.396 1.199 0.435 1.00 2.13 N ATOM 0 H GLN A 185 -9.965 -0.992 -0.133 1.00 0.38 H new ATOM 0 HA GLN A 185 -12.167 -2.026 -1.510 1.00 0.49 H new ATOM 0 HB2 GLN A 185 -9.773 -0.621 -2.739 1.00 0.60 H new ATOM 0 HB3 GLN A 185 -11.465 -0.437 -3.155 1.00 0.60 H new ATOM 0 HG2 GLN A 185 -10.193 0.409 -0.526 1.00 0.78 H new ATOM 0 HG3 GLN A 185 -10.606 1.487 -1.844 1.00 0.78 H new ATOM 0 HE21 GLN A 185 -11.558 1.469 0.950 1.00 2.13 H new ATOM 0 HE22 GLN A 185 -13.315 1.308 0.864 1.00 2.13 H new ATOM 1012 N HIS A 186 -9.470 -3.587 -2.114 1.00 0.45 N ATOM 1013 CA HIS A 186 -8.990 -4.799 -2.707 1.00 0.54 C ATOM 1014 C HIS A 186 -9.333 -5.989 -1.810 1.00 0.69 C ATOM 1015 O HIS A 186 -10.220 -6.762 -2.114 1.00 1.31 O ATOM 1016 CB HIS A 186 -7.484 -4.665 -2.934 1.00 0.49 C ATOM 1017 CG HIS A 186 -7.169 -3.838 -4.146 1.00 0.53 C ATOM 1018 ND1 HIS A 186 -6.721 -4.361 -5.337 1.00 0.68 N ATOM 1019 CD2 HIS A 186 -7.284 -2.504 -4.348 1.00 0.54 C ATOM 1020 CE1 HIS A 186 -6.577 -3.387 -6.216 1.00 0.72 C ATOM 1021 NE2 HIS A 186 -6.913 -2.248 -5.642 1.00 0.66 N ATOM 0 H HIS A 186 -8.846 -3.176 -1.420 1.00 0.45 H new ATOM 0 HA HIS A 186 -9.471 -4.975 -3.669 1.00 0.54 H new ATOM 0 HB2 HIS A 186 -7.024 -4.211 -2.056 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -7.045 -5.656 -3.047 1.00 0.49 H new ATOM 0 HD1 HIS A 186 -6.530 -5.347 -5.513 1.00 0.68 H new ATOM 0 HD2 HIS A 186 -7.609 -1.774 -3.621 1.00 0.54 H new ATOM 0 HE1 HIS A 186 -6.240 -3.503 -7.236 1.00 0.72 H new ATOM 1030 N THR A 187 -8.655 -6.066 -0.691 1.00 0.38 N ATOM 1031 CA THR A 187 -8.867 -7.038 0.390 1.00 0.45 C ATOM 1032 C THR A 187 -10.322 -7.148 0.934 1.00 0.54 C ATOM 1033 O THR A 187 -10.535 -7.618 2.057 1.00 0.83 O ATOM 1034 CB THR A 187 -7.915 -6.616 1.517 1.00 0.57 C ATOM 1035 OG1 THR A 187 -6.702 -6.160 0.910 1.00 1.63 O ATOM 1036 CG2 THR A 187 -7.599 -7.734 2.502 1.00 0.88 C ATOM 0 H THR A 187 -7.893 -5.421 -0.484 1.00 0.38 H new ATOM 0 HA THR A 187 -8.672 -8.033 -0.010 1.00 0.45 H new ATOM 0 HB THR A 187 -8.407 -5.835 2.096 1.00 0.57 H new ATOM 0 HG1 THR A 187 -6.004 -6.082 1.593 1.00 1.63 H new ATOM 0 HG21 THR A 187 -6.921 -7.362 3.270 1.00 0.88 H new ATOM 0 HG22 THR A 187 -8.522 -8.079 2.969 1.00 0.88 H new ATOM 0 HG23 THR A 187 -7.128 -8.563 1.973 1.00 0.88 H new ATOM 1044 N VAL A 188 -11.319 -6.755 0.148 1.00 0.41 N ATOM 1045 CA VAL A 188 -12.719 -6.989 0.498 1.00 0.46 C ATOM 1046 C VAL A 188 -13.471 -7.601 -0.692 1.00 0.45 C ATOM 1047 O VAL A 188 -14.685 -7.803 -0.652 1.00 0.57 O ATOM 1048 CB VAL A 188 -13.437 -5.699 0.964 1.00 0.51 C ATOM 1049 CG1 VAL A 188 -12.648 -5.033 2.082 1.00 0.53 C ATOM 1050 CG2 VAL A 188 -13.664 -4.735 -0.196 1.00 0.49 C ATOM 0 H VAL A 188 -11.184 -6.271 -0.740 1.00 0.41 H new ATOM 0 HA VAL A 188 -12.724 -7.687 1.335 1.00 0.46 H new ATOM 0 HB VAL A 188 -14.418 -5.977 1.349 1.00 0.51 H new ATOM 0 HG11 VAL A 188 -13.163 -4.127 2.401 1.00 0.53 H new ATOM 0 HG12 VAL A 188 -12.563 -5.718 2.925 1.00 0.53 H new ATOM 0 HG13 VAL A 188 -11.652 -4.776 1.721 1.00 0.53 H new ATOM 0 HG21 VAL A 188 -14.170 -3.841 0.168 1.00 0.49 H new ATOM 0 HG22 VAL A 188 -12.704 -4.457 -0.631 1.00 0.49 H new ATOM 0 HG23 VAL A 188 -14.280 -5.217 -0.955 1.00 0.49 H new ATOM 1060 N THR A 189 -12.721 -7.888 -1.750 1.00 0.38 N ATOM 1061 CA THR A 189 -13.253 -8.479 -2.978 1.00 0.41 C ATOM 1062 C THR A 189 -12.109 -9.138 -3.739 1.00 0.34 C ATOM 1063 O THR A 189 -12.208 -10.274 -4.197 1.00 0.35 O ATOM 1064 CB THR A 189 -13.941 -7.425 -3.875 1.00 0.50 C ATOM 1065 OG1 THR A 189 -15.153 -6.966 -3.259 1.00 0.64 O ATOM 1066 CG2 THR A 189 -14.249 -7.991 -5.255 1.00 0.51 C ATOM 0 H THR A 189 -11.716 -7.716 -1.782 1.00 0.38 H new ATOM 0 HA THR A 189 -14.008 -9.217 -2.707 1.00 0.41 H new ATOM 0 HB THR A 189 -13.254 -6.587 -3.993 1.00 0.50 H new ATOM 0 HG1 THR A 189 -15.209 -7.317 -2.346 1.00 0.64 H new ATOM 0 HG21 THR A 189 -14.733 -7.226 -5.862 1.00 0.51 H new ATOM 0 HG22 THR A 189 -13.322 -8.303 -5.735 1.00 0.51 H new ATOM 0 HG23 THR A 189 -14.913 -8.849 -5.156 1.00 0.51 H new ATOM 1074 N THR A 190 -11.016 -8.397 -3.845 1.00 0.32 N ATOM 1075 CA THR A 190 -9.741 -8.917 -4.304 1.00 0.34 C ATOM 1076 C THR A 190 -9.339 -10.144 -3.495 1.00 0.34 C ATOM 1077 O THR A 190 -8.704 -11.066 -4.005 1.00 0.42 O ATOM 1078 CB THR A 190 -8.658 -7.832 -4.187 1.00 0.39 C ATOM 1079 OG1 THR A 190 -8.660 -6.990 -5.348 1.00 0.54 O ATOM 1080 CG2 THR A 190 -7.286 -8.426 -3.969 1.00 0.55 C ATOM 0 H THR A 190 -10.992 -7.405 -3.611 1.00 0.32 H new ATOM 0 HA THR A 190 -9.843 -9.210 -5.349 1.00 0.34 H new ATOM 0 HB THR A 190 -8.897 -7.228 -3.312 1.00 0.39 H new ATOM 0 HG1 THR A 190 -7.750 -6.924 -5.706 1.00 0.54 H new ATOM 0 HG21 THR A 190 -6.551 -7.625 -3.892 1.00 0.55 H new ATOM 0 HG22 THR A 190 -7.284 -9.010 -3.049 1.00 0.55 H new ATOM 0 HG23 THR A 190 -7.032 -9.072 -4.809 1.00 0.55 H new ATOM 1088 N THR A 191 -9.714 -10.156 -2.231 1.00 0.34 N ATOM 1089 CA THR A 191 -9.430 -11.286 -1.392 1.00 0.47 C ATOM 1090 C THR A 191 -10.449 -12.392 -1.609 1.00 0.35 C ATOM 1091 O THR A 191 -10.105 -13.550 -1.804 1.00 0.34 O ATOM 1092 CB THR A 191 -9.418 -10.893 0.078 1.00 0.83 C ATOM 1093 OG1 THR A 191 -10.473 -9.963 0.341 1.00 1.66 O ATOM 1094 CG2 THR A 191 -8.074 -10.300 0.437 1.00 1.23 C ATOM 0 H THR A 191 -10.214 -9.395 -1.771 1.00 0.34 H new ATOM 0 HA THR A 191 -8.440 -11.651 -1.667 1.00 0.47 H new ATOM 0 HB THR A 191 -9.580 -11.778 0.693 1.00 0.83 H new ATOM 0 HG1 THR A 191 -10.564 -9.837 1.309 1.00 1.66 H new ATOM 0 HG21 THR A 191 -8.070 -10.020 1.490 1.00 1.23 H new ATOM 0 HG22 THR A 191 -7.291 -11.036 0.254 1.00 1.23 H new ATOM 0 HG23 THR A 191 -7.891 -9.416 -0.174 1.00 1.23 H new ATOM 1102 N THR A 192 -11.710 -12.011 -1.615 1.00 0.46 N ATOM 1103 CA THR A 192 -12.794 -12.970 -1.694 1.00 0.60 C ATOM 1104 C THR A 192 -13.087 -13.390 -3.132 1.00 0.59 C ATOM 1105 O THR A 192 -14.164 -13.912 -3.432 1.00 0.73 O ATOM 1106 CB THR A 192 -14.060 -12.397 -1.054 1.00 0.76 C ATOM 1107 OG1 THR A 192 -14.254 -11.052 -1.505 1.00 0.69 O ATOM 1108 CG2 THR A 192 -13.952 -12.422 0.460 1.00 0.90 C ATOM 0 H THR A 192 -12.011 -11.038 -1.566 1.00 0.46 H new ATOM 0 HA THR A 192 -12.477 -13.858 -1.147 1.00 0.60 H new ATOM 0 HB THR A 192 -14.912 -13.009 -1.349 1.00 0.76 H new ATOM 0 HG1 THR A 192 -15.066 -10.684 -1.097 1.00 0.69 H new ATOM 0 HG21 THR A 192 -14.862 -12.010 0.897 1.00 0.90 H new ATOM 0 HG22 THR A 192 -13.820 -13.450 0.798 1.00 0.90 H new ATOM 0 HG23 THR A 192 -13.096 -11.824 0.774 1.00 0.90 H new ATOM 1116 N LYS A 193 -12.122 -13.186 -4.023 1.00 0.51 N ATOM 1117 CA LYS A 193 -12.249 -13.667 -5.390 1.00 0.58 C ATOM 1118 C LYS A 193 -11.751 -15.101 -5.485 1.00 0.69 C ATOM 1119 O LYS A 193 -11.556 -15.646 -6.572 1.00 0.82 O ATOM 1120 CB LYS A 193 -11.517 -12.745 -6.385 1.00 0.53 C ATOM 1121 CG LYS A 193 -10.034 -12.523 -6.106 1.00 0.45 C ATOM 1122 CD LYS A 193 -9.160 -13.662 -6.599 1.00 0.53 C ATOM 1123 CE LYS A 193 -7.691 -13.365 -6.357 1.00 0.57 C ATOM 1124 NZ LYS A 193 -6.811 -14.466 -6.829 1.00 1.12 N ATOM 0 H LYS A 193 -11.251 -12.695 -3.823 1.00 0.51 H new ATOM 0 HA LYS A 193 -13.304 -13.650 -5.665 1.00 0.58 H new ATOM 0 HB2 LYS A 193 -11.622 -13.164 -7.386 1.00 0.53 H new ATOM 0 HB3 LYS A 193 -12.017 -11.776 -6.391 1.00 0.53 H new ATOM 0 HG2 LYS A 193 -9.715 -11.596 -6.582 1.00 0.45 H new ATOM 0 HG3 LYS A 193 -9.887 -12.398 -5.033 1.00 0.45 H new ATOM 0 HD2 LYS A 193 -9.437 -14.585 -6.089 1.00 0.53 H new ATOM 0 HD3 LYS A 193 -9.332 -13.822 -7.663 1.00 0.53 H new ATOM 0 HE2 LYS A 193 -7.420 -12.441 -6.868 1.00 0.57 H new ATOM 0 HE3 LYS A 193 -7.526 -13.201 -5.292 1.00 0.57 H new ATOM 0 HZ1 LYS A 193 -5.897 -14.416 -6.335 1.00 1.12 H new ATOM 0 HZ2 LYS A 193 -7.263 -15.381 -6.630 1.00 1.12 H new ATOM 0 HZ3 LYS A 193 -6.656 -14.372 -7.853 1.00 1.12 H new ATOM 1138 N GLY A 194 -11.592 -15.716 -4.325 1.00 0.70 N ATOM 1139 CA GLY A 194 -11.033 -17.041 -4.244 1.00 0.81 C ATOM 1140 C GLY A 194 -9.595 -16.993 -3.789 1.00 0.75 C ATOM 1141 O GLY A 194 -8.829 -17.934 -3.994 1.00 0.86 O ATOM 0 H GLY A 194 -11.846 -15.310 -3.425 1.00 0.70 H new ATOM 0 HA2 GLY A 194 -11.618 -17.645 -3.550 1.00 0.81 H new ATOM 0 HA3 GLY A 194 -11.094 -17.526 -5.218 1.00 0.81 H new ATOM 1145 N GLU A 195 -9.232 -15.879 -3.172 1.00 0.63 N ATOM 1146 CA GLU A 195 -7.885 -15.671 -2.683 1.00 0.60 C ATOM 1147 C GLU A 195 -7.876 -15.837 -1.166 1.00 0.59 C ATOM 1148 O GLU A 195 -8.913 -15.704 -0.515 1.00 0.63 O ATOM 1149 CB GLU A 195 -7.395 -14.271 -3.093 1.00 0.64 C ATOM 1150 CG GLU A 195 -5.894 -14.089 -2.980 1.00 0.72 C ATOM 1151 CD GLU A 195 -5.147 -14.943 -3.981 1.00 0.84 C ATOM 1152 OE1 GLU A 195 -4.877 -16.124 -3.676 1.00 1.29 O ATOM 1153 OE2 GLU A 195 -4.805 -14.429 -5.067 1.00 1.40 O ATOM 0 H GLU A 195 -9.864 -15.098 -2.998 1.00 0.63 H new ATOM 0 HA GLU A 195 -7.208 -16.406 -3.119 1.00 0.60 H new ATOM 0 HB2 GLU A 195 -7.698 -14.077 -4.122 1.00 0.64 H new ATOM 0 HB3 GLU A 195 -7.890 -13.526 -2.469 1.00 0.64 H new ATOM 0 HG2 GLU A 195 -5.642 -13.040 -3.138 1.00 0.72 H new ATOM 0 HG3 GLU A 195 -5.572 -14.346 -1.971 1.00 0.72 H new ATOM 1160 N ASN A 196 -6.730 -16.165 -0.607 1.00 0.64 N ATOM 1161 CA ASN A 196 -6.623 -16.382 0.830 1.00 0.69 C ATOM 1162 C ASN A 196 -5.951 -15.207 1.498 1.00 0.63 C ATOM 1163 O ASN A 196 -4.835 -14.847 1.140 1.00 0.80 O ATOM 1164 CB ASN A 196 -5.835 -17.655 1.138 1.00 0.91 C ATOM 1165 CG ASN A 196 -6.592 -18.915 0.776 1.00 1.07 C ATOM 1166 OD1 ASN A 196 -6.515 -19.403 -0.352 1.00 1.13 O ATOM 1167 ND2 ASN A 196 -7.334 -19.455 1.731 1.00 1.99 N ATOM 0 H ASN A 196 -5.857 -16.288 -1.121 1.00 0.64 H new ATOM 0 HA ASN A 196 -7.635 -16.490 1.220 1.00 0.69 H new ATOM 0 HB2 ASN A 196 -4.892 -17.634 0.592 1.00 0.91 H new ATOM 0 HB3 ASN A 196 -5.589 -17.677 2.200 1.00 0.91 H new ATOM 0 HD21 ASN A 196 -7.867 -20.304 1.544 1.00 1.99 H new ATOM 0 HD22 ASN A 196 -7.373 -19.021 2.653 1.00 1.99 H new ATOM 1174 N PHE A 197 -6.633 -14.608 2.459 1.00 0.54 N ATOM 1175 CA PHE A 197 -6.039 -13.540 3.237 1.00 0.53 C ATOM 1176 C PHE A 197 -6.106 -13.857 4.708 1.00 0.56 C ATOM 1177 O PHE A 197 -7.179 -13.972 5.305 1.00 0.68 O ATOM 1178 CB PHE A 197 -6.681 -12.178 2.956 1.00 0.52 C ATOM 1179 CG PHE A 197 -8.136 -12.064 3.325 1.00 1.12 C ATOM 1180 CD1 PHE A 197 -9.092 -12.869 2.729 1.00 1.63 C ATOM 1181 CD2 PHE A 197 -8.541 -11.133 4.267 1.00 1.49 C ATOM 1182 CE1 PHE A 197 -10.426 -12.751 3.067 1.00 2.36 C ATOM 1183 CE2 PHE A 197 -9.873 -11.010 4.611 1.00 2.19 C ATOM 1184 CZ PHE A 197 -10.817 -11.819 4.009 1.00 2.61 C ATOM 0 H PHE A 197 -7.592 -14.842 2.716 1.00 0.54 H new ATOM 0 HA PHE A 197 -4.995 -13.470 2.931 1.00 0.53 H new ATOM 0 HB2 PHE A 197 -6.125 -11.414 3.499 1.00 0.52 H new ATOM 0 HB3 PHE A 197 -6.574 -11.957 1.894 1.00 0.52 H new ATOM 0 HD1 PHE A 197 -8.791 -13.598 1.991 1.00 1.63 H new ATOM 0 HD2 PHE A 197 -7.807 -10.496 4.738 1.00 1.49 H new ATOM 0 HE1 PHE A 197 -11.162 -13.386 2.596 1.00 2.36 H new ATOM 0 HE2 PHE A 197 -10.176 -10.282 5.349 1.00 2.19 H new ATOM 0 HZ PHE A 197 -11.859 -11.723 4.274 1.00 2.61 H new ATOM 1194 N THR A 198 -4.949 -14.027 5.278 1.00 0.55 N ATOM 1195 CA THR A 198 -4.829 -14.236 6.683 1.00 0.60 C ATOM 1196 C THR A 198 -4.182 -13.014 7.306 1.00 0.52 C ATOM 1197 O THR A 198 -3.721 -12.134 6.591 1.00 0.43 O ATOM 1198 CB THR A 198 -4.041 -15.530 6.989 1.00 0.74 C ATOM 1199 OG1 THR A 198 -4.029 -15.790 8.396 1.00 1.12 O ATOM 1200 CG2 THR A 198 -2.614 -15.452 6.477 1.00 0.78 C ATOM 0 H THR A 198 -4.061 -14.024 4.776 1.00 0.55 H new ATOM 0 HA THR A 198 -5.818 -14.370 7.120 1.00 0.60 H new ATOM 0 HB THR A 198 -4.547 -16.345 6.472 1.00 0.74 H new ATOM 0 HG1 THR A 198 -3.528 -16.613 8.572 1.00 1.12 H new ATOM 0 HG21 THR A 198 -2.092 -16.380 6.711 1.00 0.78 H new ATOM 0 HG22 THR A 198 -2.622 -15.303 5.397 1.00 0.78 H new ATOM 0 HG23 THR A 198 -2.101 -14.617 6.955 1.00 0.78 H new ATOM 1208 N GLU A 199 -4.222 -12.929 8.627 1.00 0.59 N ATOM 1209 CA GLU A 199 -3.572 -11.853 9.383 1.00 0.63 C ATOM 1210 C GLU A 199 -2.156 -11.603 8.852 1.00 0.55 C ATOM 1211 O GLU A 199 -1.646 -10.476 8.861 1.00 0.53 O ATOM 1212 CB GLU A 199 -3.525 -12.224 10.868 1.00 0.82 C ATOM 1213 CG GLU A 199 -3.085 -11.089 11.776 1.00 1.14 C ATOM 1214 CD GLU A 199 -4.056 -9.927 11.763 1.00 2.11 C ATOM 1215 OE1 GLU A 199 -5.129 -10.040 12.391 1.00 2.55 O ATOM 1216 OE2 GLU A 199 -3.750 -8.894 11.135 1.00 2.91 O ATOM 0 H GLU A 199 -4.708 -13.606 9.215 1.00 0.59 H new ATOM 0 HA GLU A 199 -4.149 -10.936 9.261 1.00 0.63 H new ATOM 0 HB2 GLU A 199 -4.514 -12.561 11.179 1.00 0.82 H new ATOM 0 HB3 GLU A 199 -2.845 -13.065 11.000 1.00 0.82 H new ATOM 0 HG2 GLU A 199 -2.983 -11.462 12.795 1.00 1.14 H new ATOM 0 HG3 GLU A 199 -2.101 -10.739 11.465 1.00 1.14 H new ATOM 1223 N THR A 200 -1.543 -12.663 8.367 1.00 0.56 N ATOM 1224 CA THR A 200 -0.255 -12.581 7.724 1.00 0.57 C ATOM 1225 C THR A 200 -0.317 -11.746 6.439 1.00 0.44 C ATOM 1226 O THR A 200 0.539 -10.884 6.213 1.00 0.44 O ATOM 1227 CB THR A 200 0.253 -13.981 7.401 1.00 0.73 C ATOM 1228 OG1 THR A 200 0.299 -14.769 8.597 1.00 0.92 O ATOM 1229 CG2 THR A 200 1.619 -13.903 6.783 1.00 0.99 C ATOM 0 H THR A 200 -1.928 -13.607 8.410 1.00 0.56 H new ATOM 0 HA THR A 200 0.431 -12.089 8.414 1.00 0.57 H new ATOM 0 HB THR A 200 -0.427 -14.451 6.691 1.00 0.73 H new ATOM 0 HG1 THR A 200 0.624 -15.668 8.384 1.00 0.92 H new ATOM 0 HG21 THR A 200 1.973 -14.908 6.556 1.00 0.99 H new ATOM 0 HG22 THR A 200 1.570 -13.319 5.864 1.00 0.99 H new ATOM 0 HG23 THR A 200 2.307 -13.425 7.480 1.00 0.99 H new ATOM 1237 N ASP A 201 -1.334 -11.989 5.608 1.00 0.41 N ATOM 1238 CA ASP A 201 -1.522 -11.215 4.382 1.00 0.36 C ATOM 1239 C ASP A 201 -1.679 -9.765 4.701 1.00 0.31 C ATOM 1240 O ASP A 201 -1.227 -8.882 3.976 1.00 0.34 O ATOM 1241 CB ASP A 201 -2.734 -11.645 3.583 1.00 0.45 C ATOM 1242 CG ASP A 201 -2.595 -13.042 3.017 1.00 0.92 C ATOM 1243 OD1 ASP A 201 -2.752 -14.016 3.775 1.00 1.27 O ATOM 1244 OD2 ASP A 201 -2.312 -13.163 1.810 1.00 1.49 O ATOM 0 H ASP A 201 -2.036 -12.713 5.762 1.00 0.41 H new ATOM 0 HA ASP A 201 -0.631 -11.396 3.781 1.00 0.36 H new ATOM 0 HB2 ASP A 201 -3.618 -11.602 4.220 1.00 0.45 H new ATOM 0 HB3 ASP A 201 -2.894 -10.941 2.767 1.00 0.45 H new ATOM 1249 N ILE A 202 -2.321 -9.542 5.808 1.00 0.30 N ATOM 1250 CA ILE A 202 -2.627 -8.224 6.269 1.00 0.32 C ATOM 1251 C ILE A 202 -1.377 -7.416 6.452 1.00 0.31 C ATOM 1252 O ILE A 202 -1.266 -6.315 5.936 1.00 0.34 O ATOM 1253 CB ILE A 202 -3.353 -8.327 7.584 1.00 0.41 C ATOM 1254 CG1 ILE A 202 -4.391 -9.420 7.437 1.00 0.48 C ATOM 1255 CG2 ILE A 202 -3.965 -7.002 7.967 1.00 0.54 C ATOM 1256 CD1 ILE A 202 -5.492 -9.101 6.453 1.00 0.53 C ATOM 0 H ILE A 202 -2.652 -10.284 6.425 1.00 0.30 H new ATOM 0 HA ILE A 202 -3.251 -7.726 5.527 1.00 0.32 H new ATOM 0 HB ILE A 202 -2.667 -8.580 8.392 1.00 0.41 H new ATOM 0 HG12 ILE A 202 -3.894 -10.338 7.123 1.00 0.48 H new ATOM 0 HG13 ILE A 202 -4.836 -9.616 8.412 1.00 0.48 H new ATOM 0 HG21 ILE A 202 -4.484 -7.103 8.920 1.00 0.54 H new ATOM 0 HG22 ILE A 202 -3.180 -6.251 8.059 1.00 0.54 H new ATOM 0 HG23 ILE A 202 -4.674 -6.693 7.199 1.00 0.54 H new ATOM 0 HD11 ILE A 202 -6.192 -9.935 6.408 1.00 0.53 H new ATOM 0 HD12 ILE A 202 -6.018 -8.202 6.775 1.00 0.53 H new ATOM 0 HD13 ILE A 202 -5.061 -8.935 5.466 1.00 0.53 H new ATOM 1268 N LYS A 203 -0.415 -7.980 7.157 1.00 0.32 N ATOM 1269 CA LYS A 203 0.793 -7.251 7.438 1.00 0.35 C ATOM 1270 C LYS A 203 1.515 -6.953 6.165 1.00 0.30 C ATOM 1271 O LYS A 203 1.644 -5.801 5.827 1.00 0.31 O ATOM 1272 CB LYS A 203 1.707 -7.979 8.416 1.00 0.44 C ATOM 1273 CG LYS A 203 1.377 -9.432 8.607 1.00 0.49 C ATOM 1274 CD LYS A 203 2.553 -10.202 9.180 1.00 0.61 C ATOM 1275 CE LYS A 203 3.690 -10.298 8.174 1.00 0.77 C ATOM 1276 NZ LYS A 203 4.905 -10.922 8.761 1.00 1.14 N ATOM 0 H LYS A 203 -0.450 -8.926 7.538 1.00 0.32 H new ATOM 0 HA LYS A 203 0.503 -6.318 7.921 1.00 0.35 H new ATOM 0 HB2 LYS A 203 2.735 -7.895 8.065 1.00 0.44 H new ATOM 0 HB3 LYS A 203 1.658 -7.477 9.383 1.00 0.44 H new ATOM 0 HG2 LYS A 203 0.520 -9.526 9.274 1.00 0.49 H new ATOM 0 HG3 LYS A 203 1.087 -9.868 7.651 1.00 0.49 H new ATOM 0 HD2 LYS A 203 2.906 -9.710 10.086 1.00 0.61 H new ATOM 0 HD3 LYS A 203 2.231 -11.203 9.466 1.00 0.61 H new ATOM 0 HE2 LYS A 203 3.363 -10.881 7.313 1.00 0.77 H new ATOM 0 HE3 LYS A 203 3.936 -9.301 7.809 1.00 0.77 H new ATOM 0 HZ1 LYS A 203 5.711 -10.272 8.664 1.00 1.14 H new ATOM 0 HZ2 LYS A 203 4.741 -11.122 9.768 1.00 1.14 H new ATOM 0 HZ3 LYS A 203 5.115 -11.810 8.262 1.00 1.14 H new ATOM 1290 N ILE A 204 1.933 -7.967 5.428 1.00 0.29 N ATOM 1291 CA ILE A 204 2.686 -7.735 4.218 1.00 0.28 C ATOM 1292 C ILE A 204 2.002 -6.742 3.312 1.00 0.24 C ATOM 1293 O ILE A 204 2.627 -5.826 2.817 1.00 0.27 O ATOM 1294 CB ILE A 204 2.885 -9.032 3.470 1.00 0.28 C ATOM 1295 CG1 ILE A 204 1.620 -9.850 3.609 1.00 0.26 C ATOM 1296 CG2 ILE A 204 4.080 -9.748 4.036 1.00 0.38 C ATOM 1297 CD1 ILE A 204 1.566 -11.108 2.774 1.00 0.28 C ATOM 0 H ILE A 204 1.764 -8.949 5.647 1.00 0.29 H new ATOM 0 HA ILE A 204 3.651 -7.322 4.513 1.00 0.28 H new ATOM 0 HB ILE A 204 3.075 -8.858 2.411 1.00 0.28 H new ATOM 0 HG12 ILE A 204 1.498 -10.124 4.657 1.00 0.26 H new ATOM 0 HG13 ILE A 204 0.770 -9.221 3.343 1.00 0.26 H new ATOM 0 HG21 ILE A 204 4.230 -10.686 3.501 1.00 0.38 H new ATOM 0 HG22 ILE A 204 4.965 -9.122 3.926 1.00 0.38 H new ATOM 0 HG23 ILE A 204 3.912 -9.956 5.093 1.00 0.38 H new ATOM 0 HD11 ILE A 204 0.619 -11.619 2.947 1.00 0.28 H new ATOM 0 HD12 ILE A 204 1.650 -10.848 1.719 1.00 0.28 H new ATOM 0 HD13 ILE A 204 2.390 -11.765 3.053 1.00 0.28 H new ATOM 1309 N MET A 205 0.718 -6.893 3.128 1.00 0.21 N ATOM 1310 CA MET A 205 0.010 -6.005 2.249 1.00 0.23 C ATOM 1311 C MET A 205 -0.115 -4.610 2.830 1.00 0.22 C ATOM 1312 O MET A 205 0.328 -3.645 2.209 1.00 0.22 O ATOM 1313 CB MET A 205 -1.359 -6.553 1.935 1.00 0.29 C ATOM 1314 CG MET A 205 -2.384 -5.472 1.715 1.00 0.29 C ATOM 1315 SD MET A 205 -4.054 -6.067 1.952 1.00 0.41 S ATOM 1316 CE MET A 205 -3.875 -6.726 3.602 1.00 0.35 C ATOM 0 H MET A 205 0.147 -7.614 3.570 1.00 0.21 H new ATOM 0 HA MET A 205 0.591 -5.933 1.330 1.00 0.23 H new ATOM 0 HB2 MET A 205 -1.300 -7.178 1.044 1.00 0.29 H new ATOM 0 HB3 MET A 205 -1.685 -7.195 2.753 1.00 0.29 H new ATOM 0 HG2 MET A 205 -2.193 -4.647 2.402 1.00 0.29 H new ATOM 0 HG3 MET A 205 -2.281 -5.076 0.705 1.00 0.29 H new ATOM 0 HE1 MET A 205 -4.822 -6.638 4.134 1.00 0.35 H new ATOM 0 HE2 MET A 205 -3.587 -7.776 3.545 1.00 0.35 H new ATOM 0 HE3 MET A 205 -3.106 -6.167 4.136 1.00 0.35 H new ATOM 1326 N GLU A 206 -0.731 -4.501 4.008 1.00 0.23 N ATOM 1327 CA GLU A 206 -0.933 -3.200 4.615 1.00 0.25 C ATOM 1328 C GLU A 206 0.403 -2.533 4.784 1.00 0.24 C ATOM 1329 O GLU A 206 0.556 -1.379 4.460 1.00 0.26 O ATOM 1330 CB GLU A 206 -1.628 -3.279 5.974 1.00 0.29 C ATOM 1331 CG GLU A 206 -3.005 -3.920 5.948 1.00 0.37 C ATOM 1332 CD GLU A 206 -3.885 -3.415 7.074 1.00 0.57 C ATOM 1333 OE1 GLU A 206 -3.703 -2.267 7.515 1.00 1.00 O ATOM 1334 OE2 GLU A 206 -4.774 -4.172 7.530 1.00 1.25 O ATOM 0 H GLU A 206 -1.091 -5.288 4.548 1.00 0.23 H new ATOM 0 HA GLU A 206 -1.583 -2.627 3.954 1.00 0.25 H new ATOM 0 HB2 GLU A 206 -0.993 -3.842 6.659 1.00 0.29 H new ATOM 0 HB3 GLU A 206 -1.719 -2.271 6.379 1.00 0.29 H new ATOM 0 HG2 GLU A 206 -3.484 -3.712 4.991 1.00 0.37 H new ATOM 0 HG3 GLU A 206 -2.903 -5.003 6.025 1.00 0.37 H new ATOM 1341 N ARG A 207 1.376 -3.297 5.239 1.00 0.24 N ATOM 1342 CA ARG A 207 2.703 -2.781 5.485 1.00 0.25 C ATOM 1343 C ARG A 207 3.320 -2.228 4.203 1.00 0.26 C ATOM 1344 O ARG A 207 3.916 -1.157 4.216 1.00 0.35 O ATOM 1345 CB ARG A 207 3.601 -3.872 6.069 1.00 0.25 C ATOM 1346 CG ARG A 207 4.251 -4.737 5.027 1.00 0.25 C ATOM 1347 CD ARG A 207 5.186 -5.706 5.673 1.00 0.32 C ATOM 1348 NE ARG A 207 6.358 -5.025 6.216 1.00 0.47 N ATOM 1349 CZ ARG A 207 6.805 -5.166 7.464 1.00 0.69 C ATOM 1350 NH1 ARG A 207 6.183 -5.972 8.314 1.00 0.87 N ATOM 1351 NH2 ARG A 207 7.869 -4.484 7.861 1.00 0.89 N ATOM 0 H ARG A 207 1.267 -4.290 5.447 1.00 0.24 H new ATOM 0 HA ARG A 207 2.619 -1.968 6.206 1.00 0.25 H new ATOM 0 HB2 ARG A 207 4.376 -3.406 6.677 1.00 0.25 H new ATOM 0 HB3 ARG A 207 3.009 -4.501 6.734 1.00 0.25 H new ATOM 0 HG2 ARG A 207 3.489 -5.276 4.464 1.00 0.25 H new ATOM 0 HG3 ARG A 207 4.794 -4.116 4.315 1.00 0.25 H new ATOM 0 HD2 ARG A 207 4.669 -6.238 6.471 1.00 0.32 H new ATOM 0 HD3 ARG A 207 5.501 -6.453 4.944 1.00 0.32 H new ATOM 0 HE ARG A 207 6.871 -4.397 5.597 1.00 0.47 H new ATOM 0 HH11 ARG A 207 5.357 -6.489 8.014 1.00 0.87 H new ATOM 0 HH12 ARG A 207 6.531 -6.075 9.267 1.00 0.87 H new ATOM 0 HH21 ARG A 207 8.342 -3.854 7.213 1.00 0.89 H new ATOM 0 HH22 ARG A 207 8.215 -4.588 8.815 1.00 0.89 H new ATOM 1365 N VAL A 208 3.177 -2.959 3.095 1.00 0.23 N ATOM 1366 CA VAL A 208 3.718 -2.502 1.837 1.00 0.23 C ATOM 1367 C VAL A 208 2.960 -1.286 1.390 1.00 0.25 C ATOM 1368 O VAL A 208 3.530 -0.212 1.231 1.00 0.34 O ATOM 1369 CB VAL A 208 3.663 -3.579 0.713 1.00 0.22 C ATOM 1370 CG1 VAL A 208 4.134 -3.001 -0.607 1.00 0.28 C ATOM 1371 CG2 VAL A 208 4.500 -4.789 1.067 1.00 0.22 C ATOM 0 H VAL A 208 2.696 -3.857 3.054 1.00 0.23 H new ATOM 0 HA VAL A 208 4.770 -2.274 2.007 1.00 0.23 H new ATOM 0 HB VAL A 208 2.624 -3.894 0.615 1.00 0.22 H new ATOM 0 HG11 VAL A 208 4.088 -3.770 -1.378 1.00 0.28 H new ATOM 0 HG12 VAL A 208 3.492 -2.166 -0.888 1.00 0.28 H new ATOM 0 HG13 VAL A 208 5.161 -2.651 -0.505 1.00 0.28 H new ATOM 0 HG21 VAL A 208 4.440 -5.521 0.262 1.00 0.22 H new ATOM 0 HG22 VAL A 208 5.538 -4.486 1.205 1.00 0.22 H new ATOM 0 HG23 VAL A 208 4.126 -5.233 1.990 1.00 0.22 H new ATOM 1381 N VAL A 209 1.666 -1.466 1.264 1.00 0.22 N ATOM 1382 CA VAL A 209 0.788 -0.454 0.737 1.00 0.25 C ATOM 1383 C VAL A 209 0.831 0.816 1.604 1.00 0.27 C ATOM 1384 O VAL A 209 0.748 1.934 1.107 1.00 0.32 O ATOM 1385 CB VAL A 209 -0.637 -1.040 0.609 1.00 0.31 C ATOM 1386 CG1 VAL A 209 -1.615 -0.404 1.569 1.00 1.11 C ATOM 1387 CG2 VAL A 209 -1.126 -0.938 -0.821 1.00 1.19 C ATOM 0 H VAL A 209 1.191 -2.329 1.528 1.00 0.22 H new ATOM 0 HA VAL A 209 1.121 -0.153 -0.256 1.00 0.25 H new ATOM 0 HB VAL A 209 -0.578 -2.093 0.883 1.00 0.31 H new ATOM 0 HG11 VAL A 209 -2.599 -0.853 1.436 1.00 1.11 H new ATOM 0 HG12 VAL A 209 -1.278 -0.566 2.593 1.00 1.11 H new ATOM 0 HG13 VAL A 209 -1.675 0.666 1.372 1.00 1.11 H new ATOM 0 HG21 VAL A 209 -2.130 -1.355 -0.893 1.00 1.19 H new ATOM 0 HG22 VAL A 209 -1.145 0.109 -1.125 1.00 1.19 H new ATOM 0 HG23 VAL A 209 -0.455 -1.494 -1.476 1.00 1.19 H new ATOM 1397 N GLU A 210 0.997 0.630 2.898 1.00 0.26 N ATOM 1398 CA GLU A 210 1.111 1.739 3.832 1.00 0.29 C ATOM 1399 C GLU A 210 2.429 2.488 3.684 1.00 0.29 C ATOM 1400 O GLU A 210 2.436 3.702 3.540 1.00 0.33 O ATOM 1401 CB GLU A 210 0.910 1.226 5.266 1.00 0.31 C ATOM 1402 CG GLU A 210 2.171 1.081 6.109 1.00 0.32 C ATOM 1403 CD GLU A 210 1.868 0.693 7.540 1.00 0.70 C ATOM 1404 OE1 GLU A 210 1.165 1.456 8.230 1.00 1.12 O ATOM 1405 OE2 GLU A 210 2.316 -0.395 7.975 1.00 1.19 O ATOM 0 H GLU A 210 1.057 -0.290 3.334 1.00 0.26 H new ATOM 0 HA GLU A 210 0.328 2.461 3.600 1.00 0.29 H new ATOM 0 HB2 GLU A 210 0.229 1.904 5.781 1.00 0.31 H new ATOM 0 HB3 GLU A 210 0.416 0.255 5.217 1.00 0.31 H new ATOM 0 HG2 GLU A 210 2.819 0.328 5.661 1.00 0.32 H new ATOM 0 HG3 GLU A 210 2.721 2.022 6.099 1.00 0.32 H new ATOM 1412 N GLN A 211 3.543 1.791 3.654 1.00 0.27 N ATOM 1413 CA GLN A 211 4.813 2.479 3.759 1.00 0.31 C ATOM 1414 C GLN A 211 5.165 3.107 2.424 1.00 0.31 C ATOM 1415 O GLN A 211 6.030 3.975 2.331 1.00 0.34 O ATOM 1416 CB GLN A 211 5.917 1.532 4.256 1.00 0.34 C ATOM 1417 CG GLN A 211 6.243 0.381 3.314 1.00 0.39 C ATOM 1418 CD GLN A 211 7.383 0.696 2.366 1.00 0.97 C ATOM 1419 OE1 GLN A 211 7.173 1.175 1.253 1.00 1.55 O ATOM 1420 NE2 GLN A 211 8.603 0.435 2.805 1.00 1.56 N ATOM 0 H GLN A 211 3.599 0.777 3.561 1.00 0.27 H new ATOM 0 HA GLN A 211 4.727 3.275 4.499 1.00 0.31 H new ATOM 0 HB2 GLN A 211 6.824 2.112 4.426 1.00 0.34 H new ATOM 0 HB3 GLN A 211 5.617 1.120 5.220 1.00 0.34 H new ATOM 0 HG2 GLN A 211 6.499 -0.501 3.902 1.00 0.39 H new ATOM 0 HG3 GLN A 211 5.355 0.130 2.734 1.00 0.39 H new ATOM 0 HE21 GLN A 211 8.736 0.038 3.735 1.00 1.56 H new ATOM 0 HE22 GLN A 211 9.411 0.631 2.214 1.00 1.56 H new ATOM 1429 N MET A 212 4.462 2.675 1.393 1.00 0.30 N ATOM 1430 CA MET A 212 4.648 3.216 0.065 1.00 0.31 C ATOM 1431 C MET A 212 3.690 4.351 -0.191 1.00 0.30 C ATOM 1432 O MET A 212 3.933 5.179 -1.049 1.00 0.33 O ATOM 1433 CB MET A 212 4.478 2.134 -0.968 1.00 0.34 C ATOM 1434 CG MET A 212 3.124 1.468 -0.948 1.00 1.17 C ATOM 1435 SD MET A 212 1.789 2.454 -1.642 1.00 1.65 S ATOM 1436 CE MET A 212 2.534 2.904 -3.184 1.00 0.37 C ATOM 0 H MET A 212 3.752 1.945 1.454 1.00 0.30 H new ATOM 0 HA MET A 212 5.662 3.609 -0.007 1.00 0.31 H new ATOM 0 HB2 MET A 212 4.646 2.561 -1.957 1.00 0.34 H new ATOM 0 HB3 MET A 212 5.246 1.376 -0.814 1.00 0.34 H new ATOM 0 HG2 MET A 212 3.188 0.529 -1.499 1.00 1.17 H new ATOM 0 HG3 MET A 212 2.873 1.216 0.083 1.00 1.17 H new ATOM 0 HE1 MET A 212 1.842 2.691 -3.999 1.00 0.37 H new ATOM 0 HE2 MET A 212 2.770 3.968 -3.177 1.00 0.37 H new ATOM 0 HE3 MET A 212 3.450 2.331 -3.327 1.00 0.37 H new ATOM 1446 N CYS A 213 2.592 4.370 0.537 1.00 0.28 N ATOM 1447 CA CYS A 213 1.719 5.523 0.537 1.00 0.27 C ATOM 1448 C CYS A 213 2.459 6.633 1.256 1.00 0.25 C ATOM 1449 O CYS A 213 2.327 7.811 0.943 1.00 0.25 O ATOM 1450 CB CYS A 213 0.408 5.182 1.240 1.00 0.36 C ATOM 1451 SG CYS A 213 -0.911 6.430 1.087 1.00 0.42 S ATOM 0 H CYS A 213 2.285 3.602 1.134 1.00 0.28 H new ATOM 0 HA CYS A 213 1.467 5.835 -0.476 1.00 0.27 H new ATOM 0 HB2 CYS A 213 0.038 4.237 0.843 1.00 0.36 H new ATOM 0 HB3 CYS A 213 0.614 5.024 2.299 1.00 0.36 H new ATOM 1456 N ILE A 214 3.266 6.206 2.221 1.00 0.25 N ATOM 1457 CA ILE A 214 4.200 7.067 2.922 1.00 0.27 C ATOM 1458 C ILE A 214 5.335 7.487 1.987 1.00 0.27 C ATOM 1459 O ILE A 214 5.745 8.648 1.966 1.00 0.29 O ATOM 1460 CB ILE A 214 4.766 6.327 4.153 1.00 0.30 C ATOM 1461 CG1 ILE A 214 3.966 6.657 5.416 1.00 0.33 C ATOM 1462 CG2 ILE A 214 6.222 6.657 4.354 1.00 0.31 C ATOM 1463 CD1 ILE A 214 4.420 5.893 6.642 1.00 0.36 C ATOM 0 H ILE A 214 3.287 5.237 2.540 1.00 0.25 H new ATOM 0 HA ILE A 214 3.678 7.964 3.256 1.00 0.27 H new ATOM 0 HB ILE A 214 4.675 5.257 3.965 1.00 0.30 H new ATOM 0 HG12 ILE A 214 4.044 7.726 5.616 1.00 0.33 H new ATOM 0 HG13 ILE A 214 2.913 6.442 5.235 1.00 0.33 H new ATOM 0 HG21 ILE A 214 6.599 6.124 5.227 1.00 0.31 H new ATOM 0 HG22 ILE A 214 6.788 6.356 3.473 1.00 0.31 H new ATOM 0 HG23 ILE A 214 6.334 7.730 4.508 1.00 0.31 H new ATOM 0 HD11 ILE A 214 3.807 6.179 7.497 1.00 0.36 H new ATOM 0 HD12 ILE A 214 4.316 4.823 6.463 1.00 0.36 H new ATOM 0 HD13 ILE A 214 5.464 6.126 6.850 1.00 0.36 H new ATOM 1475 N THR A 215 5.841 6.533 1.217 1.00 0.28 N ATOM 1476 CA THR A 215 6.832 6.827 0.199 1.00 0.30 C ATOM 1477 C THR A 215 6.224 7.773 -0.828 1.00 0.30 C ATOM 1478 O THR A 215 6.855 8.729 -1.273 1.00 0.34 O ATOM 1479 CB THR A 215 7.320 5.541 -0.498 1.00 0.34 C ATOM 1480 OG1 THR A 215 7.853 4.628 0.473 1.00 0.37 O ATOM 1481 CG2 THR A 215 8.383 5.849 -1.542 1.00 0.39 C ATOM 0 H THR A 215 5.579 5.549 1.281 1.00 0.28 H new ATOM 0 HA THR A 215 7.693 7.294 0.677 1.00 0.30 H new ATOM 0 HB THR A 215 6.465 5.087 -1.000 1.00 0.34 H new ATOM 0 HG1 THR A 215 7.172 4.439 1.152 1.00 0.37 H new ATOM 0 HG21 THR A 215 8.707 4.922 -2.016 1.00 0.39 H new ATOM 0 HG22 THR A 215 7.969 6.517 -2.297 1.00 0.39 H new ATOM 0 HG23 THR A 215 9.236 6.329 -1.062 1.00 0.39 H new ATOM 1489 N GLN A 216 4.984 7.505 -1.187 1.00 0.30 N ATOM 1490 CA GLN A 216 4.253 8.390 -2.063 1.00 0.32 C ATOM 1491 C GLN A 216 3.890 9.707 -1.364 1.00 0.30 C ATOM 1492 O GLN A 216 3.566 10.675 -2.023 1.00 0.45 O ATOM 1493 CB GLN A 216 3.008 7.676 -2.602 1.00 0.44 C ATOM 1494 CG GLN A 216 2.332 8.387 -3.762 1.00 1.08 C ATOM 1495 CD GLN A 216 3.220 8.526 -4.979 1.00 1.76 C ATOM 1496 OE1 GLN A 216 4.081 7.685 -5.244 1.00 2.17 O ATOM 1497 NE2 GLN A 216 3.017 9.592 -5.732 1.00 2.60 N ATOM 0 H GLN A 216 4.464 6.681 -0.884 1.00 0.30 H new ATOM 0 HA GLN A 216 4.895 8.651 -2.904 1.00 0.32 H new ATOM 0 HB2 GLN A 216 3.289 6.672 -2.920 1.00 0.44 H new ATOM 0 HB3 GLN A 216 2.288 7.564 -1.791 1.00 0.44 H new ATOM 0 HG2 GLN A 216 1.431 7.840 -4.039 1.00 1.08 H new ATOM 0 HG3 GLN A 216 2.016 9.378 -3.437 1.00 1.08 H new ATOM 0 HE21 GLN A 216 2.294 10.265 -5.478 1.00 2.60 H new ATOM 0 HE22 GLN A 216 3.583 9.742 -6.567 1.00 2.60 H new ATOM 1506 N TYR A 217 3.972 9.749 -0.036 1.00 0.27 N ATOM 1507 CA TYR A 217 3.740 10.987 0.720 1.00 0.29 C ATOM 1508 C TYR A 217 4.901 11.951 0.519 1.00 0.30 C ATOM 1509 O TYR A 217 4.695 13.114 0.190 1.00 0.31 O ATOM 1510 CB TYR A 217 3.563 10.678 2.215 1.00 0.37 C ATOM 1511 CG TYR A 217 3.261 11.885 3.085 1.00 0.56 C ATOM 1512 CD1 TYR A 217 4.274 12.738 3.513 1.00 0.80 C ATOM 1513 CD2 TYR A 217 1.961 12.163 3.482 1.00 1.06 C ATOM 1514 CE1 TYR A 217 3.995 13.835 4.309 1.00 0.95 C ATOM 1515 CE2 TYR A 217 1.676 13.257 4.280 1.00 1.26 C ATOM 1516 CZ TYR A 217 2.695 14.088 4.688 1.00 1.04 C ATOM 1517 OH TYR A 217 2.414 15.171 5.489 1.00 1.26 O ATOM 0 H TYR A 217 4.198 8.941 0.544 1.00 0.27 H new ATOM 0 HA TYR A 217 2.827 11.453 0.350 1.00 0.29 H new ATOM 0 HB2 TYR A 217 2.755 9.955 2.329 1.00 0.37 H new ATOM 0 HB3 TYR A 217 4.472 10.201 2.583 1.00 0.37 H new ATOM 0 HD1 TYR A 217 5.294 12.541 3.219 1.00 0.80 H new ATOM 0 HD2 TYR A 217 1.158 11.515 3.163 1.00 1.06 H new ATOM 0 HE1 TYR A 217 4.792 14.489 4.631 1.00 0.95 H new ATOM 0 HE2 TYR A 217 0.659 13.458 4.581 1.00 1.26 H new ATOM 0 HH TYR A 217 3.066 15.882 5.318 1.00 1.26 H new ATOM 1527 N GLN A 218 6.120 11.469 0.718 1.00 0.33 N ATOM 1528 CA GLN A 218 7.303 12.291 0.476 1.00 0.42 C ATOM 1529 C GLN A 218 7.398 12.627 -1.014 1.00 0.46 C ATOM 1530 O GLN A 218 7.875 13.694 -1.399 1.00 0.58 O ATOM 1531 CB GLN A 218 8.569 11.575 0.954 1.00 0.47 C ATOM 1532 CG GLN A 218 8.797 10.243 0.271 1.00 0.63 C ATOM 1533 CD GLN A 218 10.052 9.535 0.734 1.00 1.23 C ATOM 1534 OE1 GLN A 218 10.490 9.693 1.877 1.00 1.83 O ATOM 1535 NE2 GLN A 218 10.633 8.739 -0.150 1.00 1.97 N ATOM 0 H GLN A 218 6.318 10.523 1.043 1.00 0.33 H new ATOM 0 HA GLN A 218 7.213 13.218 1.043 1.00 0.42 H new ATOM 0 HB2 GLN A 218 9.431 12.218 0.777 1.00 0.47 H new ATOM 0 HB3 GLN A 218 8.504 11.417 2.031 1.00 0.47 H new ATOM 0 HG2 GLN A 218 7.937 9.598 0.453 1.00 0.63 H new ATOM 0 HG3 GLN A 218 8.855 10.401 -0.806 1.00 0.63 H new ATOM 0 HE21 GLN A 218 10.236 8.638 -1.084 1.00 1.97 H new ATOM 0 HE22 GLN A 218 11.478 8.226 0.103 1.00 1.97 H new ATOM 1544 N GLN A 219 6.924 11.700 -1.838 1.00 0.42 N ATOM 1545 CA GLN A 219 6.791 11.918 -3.270 1.00 0.53 C ATOM 1546 C GLN A 219 5.780 13.024 -3.547 1.00 0.51 C ATOM 1547 O GLN A 219 6.085 14.002 -4.217 1.00 0.58 O ATOM 1548 CB GLN A 219 6.321 10.628 -3.941 1.00 0.60 C ATOM 1549 CG GLN A 219 5.939 10.802 -5.398 1.00 0.78 C ATOM 1550 CD GLN A 219 7.109 10.611 -6.342 1.00 0.98 C ATOM 1551 OE1 GLN A 219 7.144 11.193 -7.427 1.00 1.58 O ATOM 1552 NE2 GLN A 219 8.067 9.790 -5.945 1.00 1.70 N ATOM 0 H GLN A 219 6.621 10.776 -1.530 1.00 0.42 H new ATOM 0 HA GLN A 219 7.761 12.214 -3.671 1.00 0.53 H new ATOM 0 HB2 GLN A 219 7.113 9.882 -3.869 1.00 0.60 H new ATOM 0 HB3 GLN A 219 5.463 10.236 -3.394 1.00 0.60 H new ATOM 0 HG2 GLN A 219 5.155 10.088 -5.650 1.00 0.78 H new ATOM 0 HG3 GLN A 219 5.521 11.798 -5.542 1.00 0.78 H new ATOM 0 HE21 GLN A 219 7.999 9.328 -5.038 1.00 1.70 H new ATOM 0 HE22 GLN A 219 8.874 9.619 -6.546 1.00 1.70 H new ATOM 1561 N GLU A 220 4.579 12.842 -3.013 1.00 0.45 N ATOM 1562 CA GLU A 220 3.472 13.773 -3.188 1.00 0.46 C ATOM 1563 C GLU A 220 3.837 15.140 -2.626 1.00 0.46 C ATOM 1564 O GLU A 220 3.426 16.173 -3.155 1.00 0.49 O ATOM 1565 CB GLU A 220 2.236 13.212 -2.480 1.00 0.45 C ATOM 1566 CG GLU A 220 0.967 13.244 -3.311 1.00 0.75 C ATOM 1567 CD GLU A 220 1.211 12.888 -4.766 1.00 1.21 C ATOM 1568 OE1 GLU A 220 1.411 11.694 -5.076 1.00 1.74 O ATOM 1569 OE2 GLU A 220 1.196 13.809 -5.609 1.00 1.62 O ATOM 0 H GLU A 220 4.343 12.033 -2.439 1.00 0.45 H new ATOM 0 HA GLU A 220 3.258 13.893 -4.250 1.00 0.46 H new ATOM 0 HB2 GLU A 220 2.437 12.182 -2.186 1.00 0.45 H new ATOM 0 HB3 GLU A 220 2.070 13.778 -1.563 1.00 0.45 H new ATOM 0 HG2 GLU A 220 0.243 12.548 -2.888 1.00 0.75 H new ATOM 0 HG3 GLU A 220 0.525 14.239 -3.254 1.00 0.75 H new ATOM 1576 N SER A 221 4.629 15.125 -1.564 1.00 0.46 N ATOM 1577 CA SER A 221 5.148 16.340 -0.965 1.00 0.51 C ATOM 1578 C SER A 221 5.956 17.129 -1.995 1.00 0.56 C ATOM 1579 O SER A 221 5.862 18.354 -2.080 1.00 0.63 O ATOM 1580 CB SER A 221 6.028 15.980 0.238 1.00 0.52 C ATOM 1581 OG SER A 221 6.313 17.114 1.043 1.00 0.74 O ATOM 0 H SER A 221 4.928 14.270 -1.096 1.00 0.46 H new ATOM 0 HA SER A 221 4.317 16.960 -0.628 1.00 0.51 H new ATOM 0 HB2 SER A 221 5.526 15.223 0.841 1.00 0.52 H new ATOM 0 HB3 SER A 221 6.961 15.540 -0.113 1.00 0.52 H new ATOM 0 HG SER A 221 6.874 16.845 1.800 1.00 0.74 H new ATOM 1587 N GLN A 222 6.735 16.407 -2.790 1.00 0.57 N ATOM 1588 CA GLN A 222 7.565 17.012 -3.818 1.00 0.68 C ATOM 1589 C GLN A 222 6.779 17.176 -5.117 1.00 0.69 C ATOM 1590 O GLN A 222 7.114 17.999 -5.961 1.00 0.79 O ATOM 1591 CB GLN A 222 8.808 16.151 -4.034 1.00 0.77 C ATOM 1592 CG GLN A 222 8.969 15.645 -5.453 1.00 1.19 C ATOM 1593 CD GLN A 222 10.272 14.902 -5.663 1.00 1.31 C ATOM 1594 OE1 GLN A 222 10.347 13.690 -5.463 1.00 1.81 O ATOM 1595 NE2 GLN A 222 11.306 15.617 -6.075 1.00 1.52 N ATOM 0 H GLN A 222 6.808 15.391 -2.739 1.00 0.57 H new ATOM 0 HA GLN A 222 7.875 18.006 -3.494 1.00 0.68 H new ATOM 0 HB2 GLN A 222 9.690 16.731 -3.764 1.00 0.77 H new ATOM 0 HB3 GLN A 222 8.768 15.297 -3.357 1.00 0.77 H new ATOM 0 HG2 GLN A 222 8.136 14.986 -5.696 1.00 1.19 H new ATOM 0 HG3 GLN A 222 8.920 16.488 -6.143 1.00 1.19 H new ATOM 0 HE21 GLN A 222 11.203 16.620 -6.229 1.00 1.52 H new ATOM 0 HE22 GLN A 222 12.206 15.165 -6.238 1.00 1.52 H new ATOM 1604 N ALA A 223 5.741 16.378 -5.283 1.00 0.64 N ATOM 1605 CA ALA A 223 4.817 16.564 -6.391 1.00 0.71 C ATOM 1606 C ALA A 223 4.128 17.905 -6.242 1.00 0.71 C ATOM 1607 O ALA A 223 3.882 18.602 -7.223 1.00 0.82 O ATOM 1608 CB ALA A 223 3.809 15.430 -6.465 1.00 0.72 C ATOM 0 H ALA A 223 5.515 15.596 -4.668 1.00 0.64 H new ATOM 0 HA ALA A 223 5.375 16.552 -7.327 1.00 0.71 H new ATOM 0 HB1 ALA A 223 3.133 15.598 -7.303 1.00 0.72 H new ATOM 0 HB2 ALA A 223 4.334 14.485 -6.606 1.00 0.72 H new ATOM 0 HB3 ALA A 223 3.236 15.392 -5.539 1.00 0.72 H new ATOM 1614 N ALA A 224 3.868 18.281 -4.996 1.00 0.65 N ATOM 1615 CA ALA A 224 3.362 19.607 -4.677 1.00 0.72 C ATOM 1616 C ALA A 224 4.433 20.656 -4.919 1.00 0.82 C ATOM 1617 O ALA A 224 4.155 21.847 -4.926 1.00 0.93 O ATOM 1618 CB ALA A 224 2.878 19.657 -3.237 1.00 0.75 C ATOM 0 H ALA A 224 4.001 17.679 -4.184 1.00 0.65 H new ATOM 0 HA ALA A 224 2.517 19.823 -5.331 1.00 0.72 H new ATOM 0 HB1 ALA A 224 2.503 20.656 -3.014 1.00 0.75 H new ATOM 0 HB2 ALA A 224 2.079 18.929 -3.096 1.00 0.75 H new ATOM 0 HB3 ALA A 224 3.705 19.422 -2.567 1.00 0.75 H new ATOM 1624 N TYR A 225 5.659 20.198 -5.121 1.00 0.88 N ATOM 1625 CA TYR A 225 6.764 21.078 -5.449 1.00 1.02 C ATOM 1626 C TYR A 225 6.957 21.132 -6.962 1.00 1.13 C ATOM 1627 O TYR A 225 7.627 22.019 -7.489 1.00 1.30 O ATOM 1628 CB TYR A 225 8.044 20.602 -4.761 1.00 1.02 C ATOM 1629 CG TYR A 225 9.084 21.683 -4.623 1.00 1.29 C ATOM 1630 CD1 TYR A 225 8.798 22.882 -3.985 1.00 1.62 C ATOM 1631 CD2 TYR A 225 10.352 21.499 -5.146 1.00 2.15 C ATOM 1632 CE1 TYR A 225 9.755 23.871 -3.870 1.00 2.22 C ATOM 1633 CE2 TYR A 225 11.317 22.481 -5.039 1.00 2.88 C ATOM 1634 CZ TYR A 225 10.986 23.684 -4.334 1.00 2.75 C ATOM 1635 OH TYR A 225 11.971 24.649 -4.293 1.00 3.57 O ATOM 0 H TYR A 225 5.912 19.212 -5.062 1.00 0.88 H new ATOM 0 HA TYR A 225 6.535 22.082 -5.091 1.00 1.02 H new ATOM 0 HB2 TYR A 225 7.795 20.218 -3.772 1.00 1.02 H new ATOM 0 HB3 TYR A 225 8.466 19.772 -5.328 1.00 1.02 H new ATOM 0 HD1 TYR A 225 7.813 23.044 -3.573 1.00 1.62 H new ATOM 0 HD2 TYR A 225 10.591 20.572 -5.646 1.00 2.15 H new ATOM 0 HE1 TYR A 225 9.500 24.808 -3.397 1.00 2.22 H new ATOM 0 HE2 TYR A 225 12.296 22.346 -5.475 1.00 2.88 H new ATOM 0 HH TYR A 225 12.794 24.293 -4.688 1.00 3.57 H new ATOM 1645 N GLN A 226 6.360 20.172 -7.656 1.00 1.09 N ATOM 1646 CA GLN A 226 6.428 20.115 -9.107 1.00 1.27 C ATOM 1647 C GLN A 226 5.265 20.879 -9.724 1.00 1.36 C ATOM 1648 O GLN A 226 5.450 21.698 -10.622 1.00 1.55 O ATOM 1649 CB GLN A 226 6.418 18.660 -9.585 1.00 1.32 C ATOM 1650 CG GLN A 226 7.674 17.891 -9.215 1.00 1.60 C ATOM 1651 CD GLN A 226 7.615 16.434 -9.627 1.00 2.19 C ATOM 1652 OE1 GLN A 226 7.983 16.077 -10.745 1.00 2.87 O ATOM 1653 NE2 GLN A 226 7.172 15.580 -8.717 1.00 2.60 N ATOM 0 H GLN A 226 5.820 19.418 -7.232 1.00 1.09 H new ATOM 0 HA GLN A 226 7.360 20.581 -9.427 1.00 1.27 H new ATOM 0 HB2 GLN A 226 5.552 18.152 -9.160 1.00 1.32 H new ATOM 0 HB3 GLN A 226 6.297 18.643 -10.668 1.00 1.32 H new ATOM 0 HG2 GLN A 226 8.535 18.363 -9.688 1.00 1.60 H new ATOM 0 HG3 GLN A 226 7.828 17.953 -8.138 1.00 1.60 H new ATOM 0 HE21 GLN A 226 6.876 15.918 -7.801 1.00 2.60 H new ATOM 0 HE22 GLN A 226 7.126 14.584 -8.932 1.00 2.60 H new ATOM 1662 N ARG A 227 4.063 20.623 -9.215 1.00 1.25 N ATOM 1663 CA ARG A 227 2.861 21.290 -9.709 1.00 1.35 C ATOM 1664 C ARG A 227 2.799 22.732 -9.213 1.00 1.38 C ATOM 1665 O ARG A 227 1.965 23.515 -9.663 1.00 1.46 O ATOM 1666 CB ARG A 227 1.602 20.529 -9.279 1.00 1.32 C ATOM 1667 CG ARG A 227 1.490 20.336 -7.776 1.00 1.00 C ATOM 1668 CD ARG A 227 0.195 19.641 -7.387 1.00 1.08 C ATOM 1669 NE ARG A 227 -0.994 20.403 -7.767 1.00 1.97 N ATOM 1670 CZ ARG A 227 -2.240 19.927 -7.686 1.00 2.50 C ATOM 1671 NH1 ARG A 227 -2.456 18.677 -7.298 1.00 2.39 N ATOM 1672 NH2 ARG A 227 -3.270 20.699 -8.011 1.00 3.59 N ATOM 0 H ARG A 227 3.895 19.958 -8.460 1.00 1.25 H new ATOM 0 HA ARG A 227 2.906 21.300 -10.798 1.00 1.35 H new ATOM 0 HB2 ARG A 227 0.723 21.068 -9.634 1.00 1.32 H new ATOM 0 HB3 ARG A 227 1.595 19.553 -9.764 1.00 1.32 H new ATOM 0 HG2 ARG A 227 2.337 19.749 -7.422 1.00 1.00 H new ATOM 0 HG3 ARG A 227 1.544 21.305 -7.281 1.00 1.00 H new ATOM 0 HD2 ARG A 227 0.158 18.660 -7.860 1.00 1.08 H new ATOM 0 HD3 ARG A 227 0.186 19.476 -6.310 1.00 1.08 H new ATOM 0 HE ARG A 227 -0.865 21.353 -8.114 1.00 1.97 H new ATOM 0 HH11 ARG A 227 -1.669 18.074 -7.060 1.00 2.39 H new ATOM 0 HH12 ARG A 227 -3.409 18.319 -7.238 1.00 2.39 H new ATOM 0 HH21 ARG A 227 -3.111 21.657 -8.323 1.00 3.59 H new ATOM 0 HH22 ARG A 227 -4.220 20.334 -7.949 1.00 3.59 H new ATOM 1686 N ALA A 228 3.686 23.072 -8.286 1.00 1.34 N ATOM 1687 CA ALA A 228 3.754 24.424 -7.757 1.00 1.43 C ATOM 1688 C ALA A 228 4.531 25.320 -8.714 1.00 1.64 C ATOM 1689 CB ALA A 228 4.401 24.424 -6.379 1.00 1.40 C ATOM 0 H ALA A 228 4.368 22.428 -7.886 1.00 1.34 H new ATOM 0 HA ALA A 228 2.741 24.814 -7.658 1.00 1.43 H new ATOM 0 HB1 ALA A 228 4.444 25.444 -5.997 1.00 1.40 H new ATOM 0 HB2 ALA A 228 3.812 23.807 -5.700 1.00 1.40 H new ATOM 0 HB3 ALA A 228 5.411 24.021 -6.451 1.00 1.40 H new