USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=34 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 216 GLN : amide:sc= 0.422 K(o=-0.24,f=-0.84) USER MOD Set 1.2: A 219 GLN : amide:sc= -0.658 K(o=-0.24,f=0.75) USER MOD Set 2.1: A 159 GLN : amide:sc= -5.88! K(o=-5.9!,f=-2.3) USER MOD Set 2.2: A 161 TYR OH : rot 165:sc= 0.373 USER MOD Set 2.3: A 186 HIS : no HE2:sc= -0.367 K(o=-5.9,f=-3.3) USER MOD Set 3.1: A 133 MET CE :methyl -120:sc= -5.37! (180deg=-11.3!) USER MOD Set 3.2: A 212 MET CE :methyl -130:sc= -4.81! (180deg=-5.66!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 MET CE :methyl -171:sc= -4.54! (180deg=-4.6!) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc= -3.68! K(o=-3.7!,f=-0.65) USER MOD Single : A 142 ASN : amide:sc= -4.36! C(o=-4.4!,f=-8.8!) USER MOD Single : A 144 TYR OH : rot -100:sc= 0.281 USER MOD Single : A 148 TYR OH : rot -117:sc= 0.191 USER MOD Single : A 149 TYR OH : rot -135:sc= -0.954 USER MOD Single : A 152 ASN : amide:sc= -7.59! C(o=-7.6!,f=-12!) USER MOD Single : A 153 MET CE :methyl -165:sc= -1.39! (180deg=-3.11!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot 173:sc= -1.75! USER MOD Single : A 158 ASN : amide:sc= -3.71! C(o=-3.7!,f=-3.5!) USER MOD Single : A 162 TYR OH : rot 180:sc= -2.92! USER MOD Single : A 167 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 168 TYR OH : rot 151:sc= 0 USER MOD Single : A 169 SER OG : rot 180:sc= 0.0189 USER MOD Single : A 170 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 GLN : amide:sc= -5! K(o=-5!,f=-0.69) USER MOD Single : A 172 ASN : amide:sc= 0.0905 K(o=0.091,f=-7!) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 176 HIS : no HD1:sc= -0.864 K(o=-0.86,f=-2!) USER MOD Single : A 180 ASN : amide:sc= 1.25 K(o=1.3,f=-0.095) USER MOD Single : A 182 THR OG1 : rot 100:sc= -4.26! USER MOD Single : A 184 LYS NZ :NH3+ 165:sc= -0.0925 (180deg=-0.356) USER MOD Single : A 185 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 187 THR OG1 : rot -155:sc= 1.63 USER MOD Single : A 189 THR OG1 : rot -3:sc= 0.935 USER MOD Single : A 190 THR OG1 : rot -150:sc= -1.6! USER MOD Single : A 191 THR OG1 : rot 160:sc= -0.513 USER MOD Single : A 192 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 193 LYS NZ :NH3+ -155:sc= 1.18 (180deg=-0.137) USER MOD Single : A 196 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 198 THR OG1 : rot 180:sc= -0.0623 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ 151:sc= 1.26 (180deg=1.21) USER MOD Single : A 205 MET CE :methyl -128:sc= -4.79! (180deg=-10.2!) USER MOD Single : A 211 GLN : amide:sc= -0.972 X(o=-0.97,f=-1.4) USER MOD Single : A 215 THR OG1 : rot 64:sc= 1.16 USER MOD Single : A 217 TYR OH : rot 14:sc= 0.00388 USER MOD Single : A 218 GLN : amide:sc= -0.642 K(o=-0.64,f=0) USER MOD Single : A 221 SER OG : rot 54:sc= 1.27 USER MOD Single : A 222 GLN : amide:sc= -1.43! K(o=-1.4!,f=-0.054) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= -0.86 K(o=-0.86,f=0) USER MOD ----------------------------------------------------------------- ATOM 34 N TYR A 127 -10.088 9.635 -5.343 1.00 0.61 N ATOM 35 CA TYR A 127 -8.714 9.595 -4.858 1.00 0.44 C ATOM 36 C TYR A 127 -7.733 9.574 -6.018 1.00 0.45 C ATOM 37 O TYR A 127 -8.109 9.425 -7.183 1.00 0.71 O ATOM 38 CB TYR A 127 -8.487 8.408 -3.901 1.00 0.37 C ATOM 39 CG TYR A 127 -8.903 8.721 -2.479 1.00 0.46 C ATOM 40 CD1 TYR A 127 -8.795 10.012 -1.971 1.00 1.26 C ATOM 41 CD2 TYR A 127 -9.411 7.734 -1.648 1.00 0.86 C ATOM 42 CE1 TYR A 127 -9.179 10.306 -0.680 1.00 1.38 C ATOM 43 CE2 TYR A 127 -9.801 8.024 -0.353 1.00 0.92 C ATOM 44 CZ TYR A 127 -9.681 9.312 0.122 1.00 0.78 C ATOM 45 OH TYR A 127 -10.067 9.610 1.403 1.00 0.96 O ATOM 0 HA TYR A 127 -8.534 10.505 -4.286 1.00 0.44 H new ATOM 0 HB2 TYR A 127 -9.048 7.545 -4.259 1.00 0.37 H new ATOM 0 HB3 TYR A 127 -7.433 8.131 -3.915 1.00 0.37 H new ATOM 0 HD1 TYR A 127 -8.403 10.798 -2.600 1.00 1.26 H new ATOM 0 HD2 TYR A 127 -9.504 6.723 -2.018 1.00 0.86 H new ATOM 0 HE1 TYR A 127 -9.085 11.313 -0.302 1.00 1.38 H new ATOM 0 HE2 TYR A 127 -10.197 7.246 0.282 1.00 0.92 H new ATOM 0 HH TYR A 127 -10.401 8.800 1.841 1.00 0.96 H new ATOM 55 N MET A 128 -6.479 9.755 -5.701 1.00 0.38 N ATOM 56 CA MET A 128 -5.453 9.775 -6.698 1.00 0.41 C ATOM 57 C MET A 128 -4.621 8.546 -6.446 1.00 0.42 C ATOM 58 O MET A 128 -3.963 8.425 -5.426 1.00 0.43 O ATOM 59 CB MET A 128 -4.690 11.126 -6.633 1.00 0.46 C ATOM 60 CG MET A 128 -3.469 11.185 -5.732 1.00 0.45 C ATOM 61 SD MET A 128 -2.015 10.426 -6.465 1.00 0.52 S ATOM 62 CE MET A 128 -1.239 9.816 -4.979 1.00 0.46 C ATOM 0 H MET A 128 -6.145 9.892 -4.747 1.00 0.38 H new ATOM 0 HA MET A 128 -5.823 9.730 -7.722 1.00 0.41 H new ATOM 0 HB2 MET A 128 -4.378 11.388 -7.644 1.00 0.46 H new ATOM 0 HB3 MET A 128 -5.390 11.895 -6.306 1.00 0.46 H new ATOM 0 HG2 MET A 128 -3.248 12.226 -5.497 1.00 0.45 H new ATOM 0 HG3 MET A 128 -3.696 10.686 -4.790 1.00 0.45 H new ATOM 0 HE1 MET A 128 -0.239 9.451 -5.214 1.00 0.46 H new ATOM 0 HE2 MET A 128 -1.169 10.622 -4.248 1.00 0.46 H new ATOM 0 HE3 MET A 128 -1.834 9.002 -4.566 1.00 0.46 H new ATOM 72 N LEU A 129 -4.768 7.563 -7.312 1.00 0.57 N ATOM 73 CA LEU A 129 -4.181 6.281 -7.028 1.00 0.66 C ATOM 74 C LEU A 129 -2.717 6.472 -6.720 1.00 0.56 C ATOM 75 O LEU A 129 -1.944 6.891 -7.580 1.00 0.56 O ATOM 76 CB LEU A 129 -4.380 5.289 -8.156 1.00 0.92 C ATOM 77 CG LEU A 129 -4.136 3.859 -7.722 1.00 0.37 C ATOM 78 CD1 LEU A 129 -5.367 3.001 -7.963 1.00 1.12 C ATOM 79 CD2 LEU A 129 -2.916 3.304 -8.435 1.00 1.15 C ATOM 0 H LEU A 129 -5.276 7.628 -8.194 1.00 0.57 H new ATOM 0 HA LEU A 129 -4.687 5.855 -6.162 1.00 0.66 H new ATOM 0 HB2 LEU A 129 -5.396 5.380 -8.540 1.00 0.92 H new ATOM 0 HB3 LEU A 129 -3.706 5.536 -8.976 1.00 0.92 H new ATOM 0 HG LEU A 129 -3.940 3.842 -6.650 1.00 0.37 H new ATOM 0 HD11 LEU A 129 -5.166 1.979 -7.643 1.00 1.12 H new ATOM 0 HD12 LEU A 129 -6.206 3.401 -7.394 1.00 1.12 H new ATOM 0 HD13 LEU A 129 -5.613 3.007 -9.025 1.00 1.12 H new ATOM 0 HD21 LEU A 129 -2.746 2.275 -8.118 1.00 1.15 H new ATOM 0 HD22 LEU A 129 -3.081 3.329 -9.512 1.00 1.15 H new ATOM 0 HD23 LEU A 129 -2.043 3.909 -8.187 1.00 1.15 H new ATOM 91 N GLY A 130 -2.384 6.208 -5.461 1.00 0.57 N ATOM 92 CA GLY A 130 -1.103 6.566 -4.904 1.00 0.55 C ATOM 93 C GLY A 130 0.028 5.771 -5.488 1.00 0.53 C ATOM 94 O GLY A 130 0.636 4.943 -4.807 1.00 0.58 O ATOM 0 H GLY A 130 -3.005 5.737 -4.803 1.00 0.57 H new ATOM 0 HA2 GLY A 130 -0.921 7.627 -5.075 1.00 0.55 H new ATOM 0 HA3 GLY A 130 -1.127 6.417 -3.825 1.00 0.55 H new ATOM 98 N SER A 131 0.262 6.021 -6.769 1.00 0.56 N ATOM 99 CA SER A 131 1.360 5.434 -7.524 1.00 0.62 C ATOM 100 C SER A 131 1.206 3.937 -7.718 1.00 0.63 C ATOM 101 O SER A 131 0.935 3.182 -6.785 1.00 1.04 O ATOM 102 CB SER A 131 2.701 5.738 -6.864 1.00 0.71 C ATOM 103 OG SER A 131 3.769 5.068 -7.515 1.00 1.30 O ATOM 0 H SER A 131 -0.318 6.650 -7.324 1.00 0.56 H new ATOM 0 HA SER A 131 1.332 5.895 -8.511 1.00 0.62 H new ATOM 0 HB2 SER A 131 2.880 6.813 -6.882 1.00 0.71 H new ATOM 0 HB3 SER A 131 2.668 5.438 -5.817 1.00 0.71 H new ATOM 0 HG SER A 131 4.613 5.286 -7.068 1.00 1.30 H new ATOM 109 N ALA A 132 1.384 3.518 -8.949 1.00 0.64 N ATOM 110 CA ALA A 132 1.512 2.107 -9.238 1.00 0.58 C ATOM 111 C ALA A 132 2.983 1.753 -9.126 1.00 0.53 C ATOM 112 O ALA A 132 3.689 1.611 -10.125 1.00 0.65 O ATOM 113 CB ALA A 132 0.967 1.749 -10.608 1.00 0.71 C ATOM 0 H ALA A 132 1.443 4.129 -9.763 1.00 0.64 H new ATOM 0 HA ALA A 132 0.921 1.533 -8.525 1.00 0.58 H new ATOM 0 HB1 ALA A 132 1.086 0.679 -10.779 1.00 0.71 H new ATOM 0 HB2 ALA A 132 -0.090 2.009 -10.658 1.00 0.71 H new ATOM 0 HB3 ALA A 132 1.513 2.301 -11.373 1.00 0.71 H new ATOM 119 N MET A 133 3.441 1.659 -7.889 1.00 0.46 N ATOM 120 CA MET A 133 4.867 1.629 -7.579 1.00 0.49 C ATOM 121 C MET A 133 5.574 0.386 -8.092 1.00 0.61 C ATOM 122 O MET A 133 6.804 0.360 -8.174 1.00 1.65 O ATOM 123 CB MET A 133 5.078 1.738 -6.071 1.00 0.48 C ATOM 124 CG MET A 133 4.158 0.847 -5.271 1.00 0.41 C ATOM 125 SD MET A 133 5.021 -0.127 -4.033 1.00 0.73 S ATOM 126 CE MET A 133 3.710 -0.474 -2.859 1.00 0.40 C ATOM 0 H MET A 133 2.837 1.601 -7.069 1.00 0.46 H new ATOM 0 HA MET A 133 5.306 2.483 -8.094 1.00 0.49 H new ATOM 0 HB2 MET A 133 6.112 1.484 -5.837 1.00 0.48 H new ATOM 0 HB3 MET A 133 4.927 2.773 -5.764 1.00 0.48 H new ATOM 0 HG2 MET A 133 3.403 1.461 -4.780 1.00 0.41 H new ATOM 0 HG3 MET A 133 3.631 0.176 -5.950 1.00 0.41 H new ATOM 0 HE1 MET A 133 3.976 -0.064 -1.885 1.00 0.40 H new ATOM 0 HE2 MET A 133 2.782 -0.017 -3.204 1.00 0.40 H new ATOM 0 HE3 MET A 133 3.573 -1.552 -2.774 1.00 0.40 H new ATOM 136 N SER A 134 4.799 -0.632 -8.424 1.00 0.72 N ATOM 137 CA SER A 134 5.341 -1.928 -8.817 1.00 0.60 C ATOM 138 C SER A 134 6.168 -2.535 -7.683 1.00 0.52 C ATOM 139 O SER A 134 7.077 -3.334 -7.916 1.00 0.74 O ATOM 140 CB SER A 134 6.157 -1.802 -10.106 1.00 0.71 C ATOM 141 OG SER A 134 5.318 -1.410 -11.183 1.00 1.49 O ATOM 0 H SER A 134 3.780 -0.588 -8.430 1.00 0.72 H new ATOM 0 HA SER A 134 4.511 -2.606 -9.017 1.00 0.60 H new ATOM 0 HB2 SER A 134 6.953 -1.070 -9.971 1.00 0.71 H new ATOM 0 HB3 SER A 134 6.635 -2.754 -10.336 1.00 0.71 H new ATOM 0 HG SER A 134 5.851 -1.331 -12.001 1.00 1.49 H new ATOM 147 N ARG A 135 5.816 -2.137 -6.452 1.00 0.47 N ATOM 148 CA ARG A 135 6.353 -2.715 -5.236 1.00 0.43 C ATOM 149 C ARG A 135 7.785 -2.210 -4.954 1.00 0.47 C ATOM 150 O ARG A 135 8.665 -2.284 -5.811 1.00 0.59 O ATOM 151 CB ARG A 135 6.248 -4.232 -5.331 1.00 0.55 C ATOM 152 CG ARG A 135 6.402 -4.940 -4.016 1.00 0.49 C ATOM 153 CD ARG A 135 7.853 -5.024 -3.651 1.00 1.38 C ATOM 154 NE ARG A 135 8.673 -5.426 -4.799 1.00 2.40 N ATOM 155 CZ ARG A 135 9.018 -6.684 -5.097 1.00 3.22 C ATOM 156 NH1 ARG A 135 8.675 -7.687 -4.304 1.00 3.47 N ATOM 157 NH2 ARG A 135 9.699 -6.933 -6.204 1.00 4.16 N ATOM 0 H ARG A 135 5.139 -1.393 -6.283 1.00 0.47 H new ATOM 0 HA ARG A 135 5.768 -2.392 -4.375 1.00 0.43 H new ATOM 0 HB2 ARG A 135 5.281 -4.492 -5.761 1.00 0.55 H new ATOM 0 HB3 ARG A 135 7.011 -4.596 -6.019 1.00 0.55 H new ATOM 0 HG2 ARG A 135 5.853 -4.408 -3.240 1.00 0.49 H new ATOM 0 HG3 ARG A 135 5.975 -5.941 -4.079 1.00 0.49 H new ATOM 0 HD2 ARG A 135 8.193 -4.057 -3.281 1.00 1.38 H new ATOM 0 HD3 ARG A 135 7.985 -5.740 -2.840 1.00 1.38 H new ATOM 0 HE ARG A 135 9.007 -4.688 -5.419 1.00 2.40 H new ATOM 0 HH11 ARG A 135 8.141 -7.506 -3.454 1.00 3.47 H new ATOM 0 HH12 ARG A 135 8.944 -8.641 -4.543 1.00 3.47 H new ATOM 0 HH21 ARG A 135 9.959 -6.168 -6.826 1.00 4.16 H new ATOM 0 HH22 ARG A 135 9.964 -7.890 -6.435 1.00 4.16 H new ATOM 171 N PRO A 136 8.034 -1.710 -3.719 1.00 0.43 N ATOM 172 CA PRO A 136 9.261 -0.994 -3.360 1.00 0.49 C ATOM 173 C PRO A 136 10.333 -1.891 -2.745 1.00 0.46 C ATOM 174 O PRO A 136 11.249 -1.409 -2.076 1.00 0.58 O ATOM 175 CB PRO A 136 8.751 -0.003 -2.318 1.00 0.52 C ATOM 176 CG PRO A 136 7.597 -0.684 -1.653 1.00 0.47 C ATOM 177 CD PRO A 136 7.139 -1.804 -2.558 1.00 0.40 C ATOM 0 HA PRO A 136 9.747 -0.553 -4.230 1.00 0.49 H new ATOM 0 HB2 PRO A 136 9.530 0.244 -1.597 1.00 0.52 H new ATOM 0 HB3 PRO A 136 8.440 0.932 -2.784 1.00 0.52 H new ATOM 0 HG2 PRO A 136 7.894 -1.076 -0.680 1.00 0.47 H new ATOM 0 HG3 PRO A 136 6.785 0.022 -1.478 1.00 0.47 H new ATOM 0 HD2 PRO A 136 7.222 -2.774 -2.067 1.00 0.40 H new ATOM 0 HD3 PRO A 136 6.095 -1.682 -2.847 1.00 0.40 H new ATOM 185 N LEU A 137 10.199 -3.188 -2.972 1.00 0.42 N ATOM 186 CA LEU A 137 11.144 -4.181 -2.472 1.00 0.48 C ATOM 187 C LEU A 137 11.194 -4.184 -0.945 1.00 0.45 C ATOM 188 O LEU A 137 12.037 -3.539 -0.328 1.00 0.62 O ATOM 189 CB LEU A 137 12.543 -3.962 -3.069 1.00 0.70 C ATOM 190 CG LEU A 137 12.744 -4.483 -4.503 1.00 0.77 C ATOM 191 CD1 LEU A 137 12.632 -5.998 -4.533 1.00 1.32 C ATOM 192 CD2 LEU A 137 11.741 -3.860 -5.469 1.00 1.33 C ATOM 0 H LEU A 137 9.429 -3.586 -3.510 1.00 0.42 H new ATOM 0 HA LEU A 137 10.791 -5.161 -2.792 1.00 0.48 H new ATOM 0 HB2 LEU A 137 12.761 -2.894 -3.056 1.00 0.70 H new ATOM 0 HB3 LEU A 137 13.274 -4.444 -2.421 1.00 0.70 H new ATOM 0 HG LEU A 137 13.744 -4.193 -4.826 1.00 0.77 H new ATOM 0 HD11 LEU A 137 12.776 -6.353 -5.553 1.00 1.32 H new ATOM 0 HD12 LEU A 137 13.395 -6.432 -3.886 1.00 1.32 H new ATOM 0 HD13 LEU A 137 11.645 -6.297 -4.181 1.00 1.32 H new ATOM 0 HD21 LEU A 137 11.912 -4.250 -6.472 1.00 1.33 H new ATOM 0 HD22 LEU A 137 10.728 -4.107 -5.151 1.00 1.33 H new ATOM 0 HD23 LEU A 137 11.866 -2.777 -5.475 1.00 1.33 H new ATOM 204 N ILE A 138 10.253 -4.901 -0.345 1.00 0.38 N ATOM 205 CA ILE A 138 10.193 -5.052 1.100 1.00 0.39 C ATOM 206 C ILE A 138 10.936 -6.312 1.518 1.00 0.50 C ATOM 207 O ILE A 138 11.192 -6.516 2.696 1.00 1.19 O ATOM 208 CB ILE A 138 8.740 -5.153 1.580 1.00 0.38 C ATOM 209 CG1 ILE A 138 7.884 -4.063 0.944 1.00 0.25 C ATOM 210 CG2 ILE A 138 8.660 -5.049 3.092 1.00 0.57 C ATOM 211 CD1 ILE A 138 8.202 -2.675 1.449 1.00 0.31 C ATOM 0 H ILE A 138 9.513 -5.392 -0.846 1.00 0.38 H new ATOM 0 HA ILE A 138 10.657 -4.175 1.551 1.00 0.39 H new ATOM 0 HB ILE A 138 8.358 -6.127 1.275 1.00 0.38 H new ATOM 0 HG12 ILE A 138 8.022 -4.088 -0.137 1.00 0.25 H new ATOM 0 HG13 ILE A 138 6.833 -4.279 1.136 1.00 0.25 H new ATOM 0 HG21 ILE A 138 7.619 -5.123 3.407 1.00 0.57 H new ATOM 0 HG22 ILE A 138 9.235 -5.858 3.543 1.00 0.57 H new ATOM 0 HG23 ILE A 138 9.069 -4.091 3.413 1.00 0.57 H new ATOM 0 HD11 ILE A 138 7.555 -1.951 0.954 1.00 0.31 H new ATOM 0 HD12 ILE A 138 8.037 -2.633 2.526 1.00 0.31 H new ATOM 0 HD13 ILE A 138 9.244 -2.439 1.233 1.00 0.31 H new ATOM 223 N HIS A 139 11.258 -7.146 0.519 1.00 0.65 N ATOM 224 CA HIS A 139 12.081 -8.374 0.666 1.00 0.75 C ATOM 225 C HIS A 139 11.683 -9.280 1.837 1.00 0.84 C ATOM 226 O HIS A 139 11.074 -10.324 1.626 1.00 1.80 O ATOM 227 CB HIS A 139 13.597 -8.067 0.729 1.00 0.84 C ATOM 228 CG HIS A 139 13.955 -6.783 1.413 1.00 0.72 C ATOM 229 ND1 HIS A 139 14.223 -5.622 0.733 1.00 1.02 N ATOM 230 CD2 HIS A 139 13.984 -6.462 2.723 1.00 1.15 C ATOM 231 CE1 HIS A 139 14.384 -4.639 1.594 1.00 1.08 C ATOM 232 NE2 HIS A 139 14.237 -5.118 2.818 1.00 1.33 N ATOM 0 H HIS A 139 10.950 -6.989 -0.441 1.00 0.65 H new ATOM 0 HA HIS A 139 11.867 -8.934 -0.244 1.00 0.75 H new ATOM 0 HB2 HIS A 139 14.097 -8.887 1.244 1.00 0.84 H new ATOM 0 HB3 HIS A 139 13.990 -8.042 -0.287 1.00 0.84 H new ATOM 0 HD2 HIS A 139 13.835 -7.142 3.549 1.00 1.15 H new ATOM 0 HE1 HIS A 139 14.600 -3.611 1.342 1.00 1.08 H new ATOM 0 HE2 HIS A 139 14.301 -4.581 3.683 1.00 1.33 H new ATOM 241 N PHE A 140 12.044 -8.872 3.055 1.00 0.66 N ATOM 242 CA PHE A 140 11.975 -9.699 4.260 1.00 0.54 C ATOM 243 C PHE A 140 13.130 -10.685 4.291 1.00 0.63 C ATOM 244 O PHE A 140 13.654 -11.008 5.359 1.00 0.76 O ATOM 245 CB PHE A 140 10.649 -10.454 4.383 1.00 0.53 C ATOM 246 CG PHE A 140 9.441 -9.572 4.406 1.00 0.40 C ATOM 247 CD1 PHE A 140 9.278 -8.624 5.398 1.00 0.72 C ATOM 248 CD2 PHE A 140 8.469 -9.692 3.429 1.00 0.71 C ATOM 249 CE1 PHE A 140 8.168 -7.810 5.415 1.00 0.74 C ATOM 250 CE2 PHE A 140 7.357 -8.879 3.441 1.00 0.67 C ATOM 251 CZ PHE A 140 7.207 -7.937 4.434 1.00 0.35 C ATOM 0 H PHE A 140 12.401 -7.934 3.235 1.00 0.66 H new ATOM 0 HA PHE A 140 12.044 -9.020 5.110 1.00 0.54 H new ATOM 0 HB2 PHE A 140 10.561 -11.150 3.549 1.00 0.53 H new ATOM 0 HB3 PHE A 140 10.667 -11.051 5.295 1.00 0.53 H new ATOM 0 HD1 PHE A 140 10.029 -8.521 6.167 1.00 0.72 H new ATOM 0 HD2 PHE A 140 8.583 -10.430 2.649 1.00 0.71 H new ATOM 0 HE1 PHE A 140 8.050 -7.073 6.195 1.00 0.74 H new ATOM 0 HE2 PHE A 140 6.604 -8.980 2.673 1.00 0.67 H new ATOM 0 HZ PHE A 140 6.337 -7.298 4.445 1.00 0.35 H new ATOM 261 N GLY A 141 13.537 -11.151 3.119 1.00 0.66 N ATOM 262 CA GLY A 141 14.569 -12.156 3.046 1.00 0.77 C ATOM 263 C GLY A 141 14.027 -13.500 3.460 1.00 0.74 C ATOM 264 O GLY A 141 14.765 -14.376 3.913 1.00 0.86 O ATOM 0 H GLY A 141 13.168 -10.848 2.218 1.00 0.66 H new ATOM 0 HA2 GLY A 141 14.959 -12.212 2.030 1.00 0.77 H new ATOM 0 HA3 GLY A 141 15.402 -11.878 3.692 1.00 0.77 H new ATOM 268 N ASN A 142 12.720 -13.657 3.304 1.00 0.63 N ATOM 269 CA ASN A 142 12.043 -14.869 3.748 1.00 0.63 C ATOM 270 C ASN A 142 11.853 -15.844 2.606 1.00 0.63 C ATOM 271 O ASN A 142 12.324 -15.626 1.490 1.00 0.65 O ATOM 272 CB ASN A 142 10.669 -14.566 4.360 1.00 0.61 C ATOM 273 CG ASN A 142 10.743 -13.670 5.586 1.00 0.81 C ATOM 274 OD1 ASN A 142 9.826 -12.899 5.859 1.00 1.68 O ATOM 275 ND2 ASN A 142 11.820 -13.779 6.349 1.00 1.02 N ATOM 0 H ASN A 142 12.108 -12.963 2.875 1.00 0.63 H new ATOM 0 HA ASN A 142 12.685 -15.313 4.509 1.00 0.63 H new ATOM 0 HB2 ASN A 142 10.040 -14.090 3.608 1.00 0.61 H new ATOM 0 HB3 ASN A 142 10.185 -15.504 4.632 1.00 0.61 H new ATOM 0 HD21 ASN A 142 11.907 -13.213 7.193 1.00 1.02 H new ATOM 0 HD22 ASN A 142 12.563 -14.429 6.093 1.00 1.02 H new ATOM 282 N ASP A 143 11.211 -16.944 2.925 1.00 0.66 N ATOM 283 CA ASP A 143 10.778 -17.909 1.935 1.00 0.67 C ATOM 284 C ASP A 143 9.311 -17.727 1.633 1.00 0.61 C ATOM 285 O ASP A 143 8.925 -17.471 0.498 1.00 0.57 O ATOM 286 CB ASP A 143 11.032 -19.334 2.419 1.00 0.79 C ATOM 287 CG ASP A 143 12.496 -19.708 2.362 1.00 1.34 C ATOM 288 OD1 ASP A 143 12.987 -20.055 1.267 1.00 1.77 O ATOM 289 OD2 ASP A 143 13.160 -19.663 3.419 1.00 2.11 O ATOM 0 H ASP A 143 10.972 -17.198 3.884 1.00 0.66 H new ATOM 0 HA ASP A 143 11.354 -17.742 1.025 1.00 0.67 H new ATOM 0 HB2 ASP A 143 10.673 -19.437 3.443 1.00 0.79 H new ATOM 0 HB3 ASP A 143 10.457 -20.030 1.808 1.00 0.79 H new ATOM 294 N TYR A 144 8.490 -17.838 2.668 1.00 0.64 N ATOM 295 CA TYR A 144 7.057 -17.840 2.477 1.00 0.62 C ATOM 296 C TYR A 144 6.477 -16.442 2.593 1.00 0.55 C ATOM 297 O TYR A 144 5.601 -16.101 1.827 1.00 0.53 O ATOM 298 CB TYR A 144 6.363 -18.790 3.452 1.00 0.76 C ATOM 299 CG TYR A 144 4.929 -19.077 3.067 1.00 0.80 C ATOM 300 CD1 TYR A 144 4.607 -19.458 1.767 1.00 1.17 C ATOM 301 CD2 TYR A 144 3.900 -18.968 3.991 1.00 0.98 C ATOM 302 CE1 TYR A 144 3.303 -19.724 1.403 1.00 1.28 C ATOM 303 CE2 TYR A 144 2.591 -19.232 3.636 1.00 1.09 C ATOM 304 CZ TYR A 144 2.298 -19.610 2.343 1.00 1.08 C ATOM 305 OH TYR A 144 0.994 -19.883 1.990 1.00 1.26 O ATOM 0 H TYR A 144 8.793 -17.927 3.638 1.00 0.64 H new ATOM 0 HA TYR A 144 6.872 -18.199 1.465 1.00 0.62 H new ATOM 0 HB2 TYR A 144 6.917 -19.727 3.496 1.00 0.76 H new ATOM 0 HB3 TYR A 144 6.387 -18.358 4.453 1.00 0.76 H new ATOM 0 HD1 TYR A 144 5.392 -19.547 1.031 1.00 1.17 H new ATOM 0 HD2 TYR A 144 4.126 -18.672 5.005 1.00 0.98 H new ATOM 0 HE1 TYR A 144 3.070 -20.019 0.391 1.00 1.28 H new ATOM 0 HE2 TYR A 144 1.802 -19.143 4.368 1.00 1.09 H new ATOM 0 HH TYR A 144 0.516 -19.043 1.827 1.00 1.26 H new ATOM 315 N GLU A 145 6.956 -15.631 3.536 1.00 0.58 N ATOM 316 CA GLU A 145 6.458 -14.255 3.655 1.00 0.54 C ATOM 317 C GLU A 145 6.989 -13.402 2.516 1.00 0.51 C ATOM 318 O GLU A 145 6.283 -12.540 1.989 1.00 0.50 O ATOM 319 CB GLU A 145 6.858 -13.608 4.969 1.00 0.61 C ATOM 320 CG GLU A 145 6.532 -14.428 6.195 1.00 0.76 C ATOM 321 CD GLU A 145 6.791 -13.651 7.465 1.00 1.31 C ATOM 322 OE1 GLU A 145 6.085 -12.653 7.714 1.00 1.71 O ATOM 323 OE2 GLU A 145 7.700 -14.042 8.228 1.00 1.74 O ATOM 0 H GLU A 145 7.671 -15.891 4.215 1.00 0.58 H new ATOM 0 HA GLU A 145 5.370 -14.313 3.616 1.00 0.54 H new ATOM 0 HB2 GLU A 145 7.930 -13.413 4.952 1.00 0.61 H new ATOM 0 HB3 GLU A 145 6.360 -12.642 5.050 1.00 0.61 H new ATOM 0 HG2 GLU A 145 5.487 -14.735 6.162 1.00 0.76 H new ATOM 0 HG3 GLU A 145 7.132 -15.338 6.195 1.00 0.76 H new ATOM 330 N ASP A 146 8.250 -13.644 2.164 1.00 0.54 N ATOM 331 CA ASP A 146 8.881 -13.010 1.007 1.00 0.54 C ATOM 332 C ASP A 146 8.008 -13.225 -0.199 1.00 0.48 C ATOM 333 O ASP A 146 7.537 -12.293 -0.843 1.00 0.51 O ATOM 334 CB ASP A 146 10.220 -13.674 0.725 1.00 0.57 C ATOM 335 CG ASP A 146 11.027 -13.006 -0.377 1.00 0.87 C ATOM 336 OD1 ASP A 146 10.707 -13.209 -1.569 1.00 1.38 O ATOM 337 OD2 ASP A 146 12.017 -12.315 -0.057 1.00 1.30 O ATOM 0 H ASP A 146 8.862 -14.283 2.671 1.00 0.54 H new ATOM 0 HA ASP A 146 9.019 -11.948 1.212 1.00 0.54 H new ATOM 0 HB2 ASP A 146 10.811 -13.678 1.641 1.00 0.57 H new ATOM 0 HB3 ASP A 146 10.046 -14.715 0.453 1.00 0.57 H new ATOM 342 N ARG A 147 7.806 -14.497 -0.471 1.00 0.44 N ATOM 343 CA ARG A 147 6.964 -14.942 -1.541 1.00 0.45 C ATOM 344 C ARG A 147 5.544 -14.409 -1.350 1.00 0.38 C ATOM 345 O ARG A 147 4.939 -13.896 -2.280 1.00 0.35 O ATOM 346 CB ARG A 147 6.972 -16.463 -1.553 1.00 0.59 C ATOM 347 CG ARG A 147 6.335 -17.084 -2.779 1.00 0.80 C ATOM 348 CD ARG A 147 4.836 -16.940 -2.749 1.00 0.67 C ATOM 349 NE ARG A 147 4.223 -17.451 -3.969 1.00 1.38 N ATOM 350 CZ ARG A 147 3.290 -18.404 -3.994 1.00 1.78 C ATOM 351 NH1 ARG A 147 2.751 -18.841 -2.864 1.00 1.90 N ATOM 352 NH2 ARG A 147 2.865 -18.889 -5.154 1.00 2.55 N ATOM 0 H ARG A 147 8.233 -15.257 0.059 1.00 0.44 H new ATOM 0 HA ARG A 147 7.335 -14.566 -2.495 1.00 0.45 H new ATOM 0 HB2 ARG A 147 8.003 -16.809 -1.480 1.00 0.59 H new ATOM 0 HB3 ARG A 147 6.451 -16.824 -0.666 1.00 0.59 H new ATOM 0 HG2 ARG A 147 6.730 -16.609 -3.677 1.00 0.80 H new ATOM 0 HG3 ARG A 147 6.600 -18.140 -2.834 1.00 0.80 H new ATOM 0 HD2 ARG A 147 4.436 -17.476 -1.888 1.00 0.67 H new ATOM 0 HD3 ARG A 147 4.573 -15.890 -2.621 1.00 0.67 H new ATOM 0 HE ARG A 147 4.526 -17.055 -4.859 1.00 1.38 H new ATOM 0 HH11 ARG A 147 3.050 -18.448 -1.971 1.00 1.90 H new ATOM 0 HH12 ARG A 147 2.038 -19.570 -2.888 1.00 1.90 H new ATOM 0 HH21 ARG A 147 3.252 -18.533 -6.028 1.00 2.55 H new ATOM 0 HH22 ARG A 147 2.152 -19.618 -5.171 1.00 2.55 H new ATOM 366 N TYR A 148 5.024 -14.561 -0.142 1.00 0.39 N ATOM 367 CA TYR A 148 3.687 -14.096 0.213 1.00 0.38 C ATOM 368 C TYR A 148 3.484 -12.682 -0.261 1.00 0.32 C ATOM 369 O TYR A 148 2.610 -12.432 -1.068 1.00 0.44 O ATOM 370 CB TYR A 148 3.491 -14.177 1.724 1.00 0.53 C ATOM 371 CG TYR A 148 2.254 -14.921 2.163 1.00 0.90 C ATOM 372 CD1 TYR A 148 1.740 -15.943 1.383 1.00 1.93 C ATOM 373 CD2 TYR A 148 1.595 -14.599 3.346 1.00 1.13 C ATOM 374 CE1 TYR A 148 0.608 -16.627 1.763 1.00 2.86 C ATOM 375 CE2 TYR A 148 0.462 -15.286 3.736 1.00 1.93 C ATOM 376 CZ TYR A 148 -0.017 -16.280 3.000 1.00 2.73 C ATOM 377 OH TYR A 148 -1.146 -16.998 3.327 1.00 3.74 O ATOM 0 H TYR A 148 5.519 -15.013 0.627 1.00 0.39 H new ATOM 0 HA TYR A 148 2.951 -14.736 -0.274 1.00 0.38 H new ATOM 0 HB2 TYR A 148 4.364 -14.660 2.164 1.00 0.53 H new ATOM 0 HB3 TYR A 148 3.451 -13.165 2.126 1.00 0.53 H new ATOM 0 HD1 TYR A 148 2.236 -16.208 0.461 1.00 1.93 H new ATOM 0 HD2 TYR A 148 1.975 -13.801 3.967 1.00 1.13 H new ATOM 0 HE1 TYR A 148 0.201 -17.409 1.140 1.00 2.86 H new ATOM 0 HE2 TYR A 148 -0.040 -15.010 4.652 1.00 1.93 H new ATOM 0 HH TYR A 148 -1.917 -16.394 3.368 1.00 3.74 H new ATOM 387 N TYR A 149 4.291 -11.766 0.238 1.00 0.27 N ATOM 388 CA TYR A 149 4.272 -10.399 -0.237 1.00 0.25 C ATOM 389 C TYR A 149 4.675 -10.270 -1.726 1.00 0.25 C ATOM 390 O TYR A 149 4.225 -9.353 -2.410 1.00 0.29 O ATOM 391 CB TYR A 149 5.150 -9.543 0.675 1.00 0.35 C ATOM 392 CG TYR A 149 6.316 -8.891 0.003 1.00 0.31 C ATOM 393 CD1 TYR A 149 6.144 -7.759 -0.775 1.00 0.85 C ATOM 394 CD2 TYR A 149 7.583 -9.424 0.128 1.00 1.17 C ATOM 395 CE1 TYR A 149 7.209 -7.169 -1.411 1.00 0.80 C ATOM 396 CE2 TYR A 149 8.653 -8.847 -0.505 1.00 1.32 C ATOM 397 CZ TYR A 149 8.472 -7.658 -1.199 1.00 0.63 C ATOM 398 OH TYR A 149 9.535 -7.146 -1.916 1.00 0.81 O ATOM 0 H TYR A 149 4.971 -11.947 0.976 1.00 0.27 H new ATOM 0 HA TYR A 149 3.246 -10.035 -0.192 1.00 0.25 H new ATOM 0 HB2 TYR A 149 4.531 -8.768 1.127 1.00 0.35 H new ATOM 0 HB3 TYR A 149 5.521 -10.168 1.487 1.00 0.35 H new ATOM 0 HD1 TYR A 149 5.157 -7.333 -0.884 1.00 0.85 H new ATOM 0 HD2 TYR A 149 7.733 -10.307 0.732 1.00 1.17 H new ATOM 0 HE1 TYR A 149 7.053 -6.329 -2.071 1.00 0.80 H new ATOM 0 HE2 TYR A 149 9.627 -9.312 -0.464 1.00 1.32 H new ATOM 0 HH TYR A 149 10.095 -7.882 -2.241 1.00 0.81 H new ATOM 408 N ARG A 150 5.491 -11.180 -2.246 1.00 0.27 N ATOM 409 CA ARG A 150 5.938 -11.072 -3.642 1.00 0.30 C ATOM 410 C ARG A 150 4.796 -11.359 -4.611 1.00 0.33 C ATOM 411 O ARG A 150 4.773 -10.854 -5.727 1.00 0.40 O ATOM 412 CB ARG A 150 7.112 -12.010 -3.950 1.00 0.32 C ATOM 413 CG ARG A 150 6.697 -13.354 -4.518 1.00 0.78 C ATOM 414 CD ARG A 150 7.835 -14.020 -5.264 1.00 0.83 C ATOM 415 NE ARG A 150 8.303 -13.207 -6.387 1.00 0.94 N ATOM 416 CZ ARG A 150 9.549 -13.250 -6.863 1.00 1.23 C ATOM 417 NH1 ARG A 150 10.449 -14.045 -6.303 1.00 1.61 N ATOM 418 NH2 ARG A 150 9.894 -12.492 -7.895 1.00 1.36 N ATOM 0 H ARG A 150 5.854 -11.988 -1.740 1.00 0.27 H new ATOM 0 HA ARG A 150 6.276 -10.045 -3.776 1.00 0.30 H new ATOM 0 HB2 ARG A 150 7.780 -11.519 -4.658 1.00 0.32 H new ATOM 0 HB3 ARG A 150 7.682 -12.174 -3.035 1.00 0.32 H new ATOM 0 HG2 ARG A 150 6.362 -14.004 -3.709 1.00 0.78 H new ATOM 0 HG3 ARG A 150 5.850 -13.219 -5.191 1.00 0.78 H new ATOM 0 HD2 ARG A 150 8.662 -14.201 -4.578 1.00 0.83 H new ATOM 0 HD3 ARG A 150 7.508 -14.992 -5.632 1.00 0.83 H new ATOM 0 HE ARG A 150 7.640 -12.572 -6.831 1.00 0.94 H new ATOM 0 HH11 ARG A 150 10.190 -14.626 -5.506 1.00 1.61 H new ATOM 0 HH12 ARG A 150 11.401 -14.076 -6.669 1.00 1.61 H new ATOM 0 HH21 ARG A 150 9.206 -11.874 -8.327 1.00 1.36 H new ATOM 0 HH22 ARG A 150 10.847 -12.527 -8.257 1.00 1.36 H new ATOM 432 N GLU A 151 3.861 -12.178 -4.176 1.00 0.36 N ATOM 433 CA GLU A 151 2.719 -12.532 -4.971 1.00 0.45 C ATOM 434 C GLU A 151 1.608 -11.623 -4.514 1.00 0.49 C ATOM 435 O GLU A 151 0.677 -11.295 -5.253 1.00 0.59 O ATOM 436 CB GLU A 151 2.360 -13.999 -4.747 1.00 0.57 C ATOM 437 CG GLU A 151 2.137 -14.309 -3.288 1.00 0.82 C ATOM 438 CD GLU A 151 1.216 -15.486 -3.048 1.00 1.60 C ATOM 439 OE1 GLU A 151 0.162 -15.550 -3.704 1.00 2.11 O ATOM 440 OE2 GLU A 151 1.557 -16.354 -2.213 1.00 2.16 O ATOM 0 H GLU A 151 3.878 -12.616 -3.255 1.00 0.36 H new ATOM 0 HA GLU A 151 2.907 -12.414 -6.038 1.00 0.45 H new ATOM 0 HB2 GLU A 151 1.460 -14.242 -5.311 1.00 0.57 H new ATOM 0 HB3 GLU A 151 3.159 -14.631 -5.134 1.00 0.57 H new ATOM 0 HG2 GLU A 151 3.099 -14.511 -2.818 1.00 0.82 H new ATOM 0 HG3 GLU A 151 1.721 -13.428 -2.798 1.00 0.82 H new ATOM 447 N ASN A 152 1.759 -11.210 -3.251 1.00 0.45 N ATOM 448 CA ASN A 152 0.878 -10.266 -2.615 1.00 0.50 C ATOM 449 C ASN A 152 0.783 -9.055 -3.444 1.00 0.55 C ATOM 450 O ASN A 152 -0.269 -8.559 -3.659 1.00 0.88 O ATOM 451 CB ASN A 152 1.355 -9.962 -1.185 1.00 0.46 C ATOM 452 CG ASN A 152 1.604 -8.495 -0.795 1.00 0.51 C ATOM 453 OD1 ASN A 152 1.976 -7.629 -1.575 1.00 0.85 O ATOM 454 ND2 ASN A 152 1.457 -8.245 0.473 1.00 0.67 N ATOM 0 H ASN A 152 2.513 -11.536 -2.646 1.00 0.45 H new ATOM 0 HA ASN A 152 -0.122 -10.692 -2.527 1.00 0.50 H new ATOM 0 HB2 ASN A 152 0.616 -10.369 -0.495 1.00 0.46 H new ATOM 0 HB3 ASN A 152 2.282 -10.512 -1.020 1.00 0.46 H new ATOM 0 HD21 ASN A 152 1.653 -7.312 0.835 1.00 0.67 H new ATOM 0 HD22 ASN A 152 1.146 -8.982 1.105 1.00 0.67 H new ATOM 461 N MET A 153 1.884 -8.651 -3.991 1.00 0.43 N ATOM 462 CA MET A 153 1.957 -7.386 -4.655 1.00 0.46 C ATOM 463 C MET A 153 0.987 -7.299 -5.849 1.00 0.51 C ATOM 464 O MET A 153 0.691 -6.212 -6.349 1.00 0.63 O ATOM 465 CB MET A 153 3.410 -7.156 -5.016 1.00 0.42 C ATOM 466 CG MET A 153 3.669 -6.158 -6.137 1.00 0.92 C ATOM 467 SD MET A 153 3.444 -6.884 -7.770 1.00 1.27 S ATOM 468 CE MET A 153 4.002 -8.548 -7.425 1.00 1.39 C ATOM 0 H MET A 153 2.754 -9.183 -3.991 1.00 0.43 H new ATOM 0 HA MET A 153 1.625 -6.580 -4.000 1.00 0.46 H new ATOM 0 HB2 MET A 153 3.936 -6.815 -4.124 1.00 0.42 H new ATOM 0 HB3 MET A 153 3.849 -8.113 -5.299 1.00 0.42 H new ATOM 0 HG2 MET A 153 2.996 -5.308 -6.025 1.00 0.92 H new ATOM 0 HG3 MET A 153 4.685 -5.774 -6.050 1.00 0.92 H new ATOM 0 HE1 MET A 153 4.188 -9.071 -8.363 1.00 1.39 H new ATOM 0 HE2 MET A 153 4.923 -8.510 -6.842 1.00 1.39 H new ATOM 0 HE3 MET A 153 3.236 -9.079 -6.859 1.00 1.39 H new ATOM 478 N TYR A 154 0.465 -8.448 -6.274 1.00 0.49 N ATOM 479 CA TYR A 154 -0.547 -8.491 -7.318 1.00 0.55 C ATOM 480 C TYR A 154 -1.952 -8.662 -6.718 1.00 0.47 C ATOM 481 O TYR A 154 -2.926 -8.092 -7.211 1.00 0.59 O ATOM 482 CB TYR A 154 -0.245 -9.631 -8.294 1.00 0.66 C ATOM 483 CG TYR A 154 -1.182 -9.664 -9.479 1.00 1.18 C ATOM 484 CD1 TYR A 154 -1.154 -8.665 -10.444 1.00 1.57 C ATOM 485 CD2 TYR A 154 -2.089 -10.702 -9.634 1.00 2.12 C ATOM 486 CE1 TYR A 154 -2.007 -8.703 -11.531 1.00 2.39 C ATOM 487 CE2 TYR A 154 -2.941 -10.750 -10.719 1.00 3.05 C ATOM 488 CZ TYR A 154 -2.910 -9.701 -11.655 1.00 3.08 C ATOM 489 OH TYR A 154 -3.745 -9.797 -12.752 1.00 4.05 O ATOM 0 H TYR A 154 0.730 -9.362 -5.908 1.00 0.49 H new ATOM 0 HA TYR A 154 -0.523 -7.544 -7.857 1.00 0.55 H new ATOM 0 HB2 TYR A 154 0.780 -9.532 -8.652 1.00 0.66 H new ATOM 0 HB3 TYR A 154 -0.307 -10.581 -7.763 1.00 0.66 H new ATOM 0 HD1 TYR A 154 -0.456 -7.847 -10.343 1.00 1.57 H new ATOM 0 HD2 TYR A 154 -2.129 -11.486 -8.893 1.00 2.12 H new ATOM 0 HE1 TYR A 154 -1.952 -7.932 -12.285 1.00 2.39 H new ATOM 0 HE2 TYR A 154 -3.620 -11.580 -10.847 1.00 3.05 H new ATOM 0 HH TYR A 154 -4.322 -10.584 -12.656 1.00 4.05 H new ATOM 499 N ARG A 155 -2.042 -9.442 -5.646 1.00 0.37 N ATOM 500 CA ARG A 155 -3.326 -9.730 -4.984 1.00 0.36 C ATOM 501 C ARG A 155 -3.630 -8.671 -3.916 1.00 0.31 C ATOM 502 O ARG A 155 -4.754 -8.512 -3.456 1.00 0.41 O ATOM 503 CB ARG A 155 -3.248 -11.124 -4.365 1.00 0.43 C ATOM 504 CG ARG A 155 -2.194 -11.259 -3.285 1.00 0.63 C ATOM 505 CD ARG A 155 -1.529 -12.633 -3.336 1.00 0.58 C ATOM 506 NE ARG A 155 -0.561 -12.819 -2.268 1.00 0.78 N ATOM 507 CZ ARG A 155 -0.807 -13.480 -1.142 1.00 1.20 C ATOM 508 NH1 ARG A 155 -1.960 -14.113 -0.963 1.00 1.05 N ATOM 509 NH2 ARG A 155 0.125 -13.541 -0.208 1.00 1.89 N ATOM 0 H ARG A 155 -1.239 -9.893 -5.208 1.00 0.37 H new ATOM 0 HA ARG A 155 -4.136 -9.700 -5.713 1.00 0.36 H new ATOM 0 HB2 ARG A 155 -4.220 -11.378 -3.943 1.00 0.43 H new ATOM 0 HB3 ARG A 155 -3.042 -11.849 -5.152 1.00 0.43 H new ATOM 0 HG2 ARG A 155 -1.440 -10.482 -3.409 1.00 0.63 H new ATOM 0 HG3 ARG A 155 -2.650 -11.108 -2.306 1.00 0.63 H new ATOM 0 HD2 ARG A 155 -2.294 -13.407 -3.269 1.00 0.58 H new ATOM 0 HD3 ARG A 155 -1.033 -12.758 -4.298 1.00 0.58 H new ATOM 0 HE ARG A 155 0.368 -12.416 -2.391 1.00 0.78 H new ATOM 0 HH11 ARG A 155 -2.670 -14.096 -1.695 1.00 1.05 H new ATOM 0 HH12 ARG A 155 -2.136 -14.617 -0.094 1.00 1.05 H new ATOM 0 HH21 ARG A 155 1.025 -13.083 -0.354 1.00 1.89 H new ATOM 0 HH22 ARG A 155 -0.055 -14.046 0.660 1.00 1.89 H new ATOM 523 N TYR A 156 -2.583 -7.970 -3.563 1.00 0.27 N ATOM 524 CA TYR A 156 -2.544 -6.909 -2.569 1.00 0.28 C ATOM 525 C TYR A 156 -1.649 -5.851 -3.164 1.00 0.39 C ATOM 526 O TYR A 156 -0.435 -6.016 -3.195 1.00 0.78 O ATOM 527 CB TYR A 156 -1.905 -7.421 -1.279 1.00 0.35 C ATOM 528 CG TYR A 156 -2.546 -8.674 -0.744 1.00 0.95 C ATOM 529 CD1 TYR A 156 -3.923 -8.790 -0.643 1.00 1.51 C ATOM 530 CD2 TYR A 156 -1.770 -9.762 -0.390 1.00 1.36 C ATOM 531 CE1 TYR A 156 -4.503 -9.963 -0.212 1.00 2.14 C ATOM 532 CE2 TYR A 156 -2.342 -10.928 0.055 1.00 1.99 C ATOM 533 CZ TYR A 156 -3.706 -11.027 0.134 1.00 2.31 C ATOM 534 OH TYR A 156 -4.272 -12.206 0.529 1.00 2.98 O ATOM 0 H TYR A 156 -1.669 -8.131 -3.987 1.00 0.27 H new ATOM 0 HA TYR A 156 -3.542 -6.541 -2.332 1.00 0.28 H new ATOM 0 HB2 TYR A 156 -0.847 -7.613 -1.459 1.00 0.35 H new ATOM 0 HB3 TYR A 156 -1.963 -6.641 -0.520 1.00 0.35 H new ATOM 0 HD1 TYR A 156 -4.550 -7.950 -0.905 1.00 1.51 H new ATOM 0 HD2 TYR A 156 -0.695 -9.693 -0.465 1.00 1.36 H new ATOM 0 HE1 TYR A 156 -5.578 -10.046 -0.147 1.00 2.14 H new ATOM 0 HE2 TYR A 156 -1.720 -11.763 0.341 1.00 1.99 H new ATOM 0 HH TYR A 156 -3.575 -12.888 0.625 1.00 2.98 H new ATOM 544 N PRO A 157 -2.194 -4.755 -3.639 1.00 0.28 N ATOM 545 CA PRO A 157 -1.559 -4.038 -4.724 1.00 0.29 C ATOM 546 C PRO A 157 -0.360 -3.217 -4.292 1.00 0.34 C ATOM 547 O PRO A 157 -0.124 -2.973 -3.109 1.00 0.66 O ATOM 548 CB PRO A 157 -2.671 -3.103 -5.155 1.00 0.31 C ATOM 549 CG PRO A 157 -3.222 -2.708 -3.838 1.00 0.32 C ATOM 550 CD PRO A 157 -3.359 -4.018 -3.109 1.00 0.33 C ATOM 0 HA PRO A 157 -1.171 -4.713 -5.487 1.00 0.29 H new ATOM 0 HB2 PRO A 157 -2.298 -2.249 -5.721 1.00 0.31 H new ATOM 0 HB3 PRO A 157 -3.411 -3.601 -5.781 1.00 0.31 H new ATOM 0 HG2 PRO A 157 -2.556 -2.024 -3.313 1.00 0.32 H new ATOM 0 HG3 PRO A 157 -4.182 -2.203 -3.940 1.00 0.32 H new ATOM 0 HD2 PRO A 157 -3.313 -3.895 -2.027 1.00 0.33 H new ATOM 0 HD3 PRO A 157 -4.301 -4.519 -3.333 1.00 0.33 H new ATOM 558 N ASN A 158 0.365 -2.760 -5.280 1.00 0.32 N ATOM 559 CA ASN A 158 1.447 -1.836 -5.062 1.00 0.31 C ATOM 560 C ASN A 158 0.965 -0.426 -5.318 1.00 0.33 C ATOM 561 O ASN A 158 1.506 0.294 -6.153 1.00 0.42 O ATOM 562 CB ASN A 158 2.627 -2.189 -5.959 1.00 0.40 C ATOM 563 CG ASN A 158 2.231 -2.484 -7.406 1.00 0.74 C ATOM 564 OD1 ASN A 158 2.796 -3.369 -8.044 1.00 1.47 O ATOM 565 ND2 ASN A 158 1.290 -1.726 -7.949 1.00 1.42 N ATOM 0 H ASN A 158 0.222 -3.017 -6.257 1.00 0.32 H new ATOM 0 HA ASN A 158 1.784 -1.903 -4.027 1.00 0.31 H new ATOM 0 HB2 ASN A 158 3.340 -1.365 -5.947 1.00 0.40 H new ATOM 0 HB3 ASN A 158 3.138 -3.059 -5.547 1.00 0.40 H new ATOM 0 HD21 ASN A 158 1.017 -1.870 -8.921 1.00 1.42 H new ATOM 0 HD22 ASN A 158 0.838 -0.999 -7.395 1.00 1.42 H new ATOM 572 N GLN A 159 -0.088 -0.062 -4.628 1.00 0.30 N ATOM 573 CA GLN A 159 -0.691 1.237 -4.791 1.00 0.31 C ATOM 574 C GLN A 159 -1.654 1.495 -3.657 1.00 0.28 C ATOM 575 O GLN A 159 -2.172 0.561 -3.052 1.00 0.29 O ATOM 576 CB GLN A 159 -1.401 1.321 -6.146 1.00 0.38 C ATOM 577 CG GLN A 159 -2.344 0.152 -6.422 1.00 0.44 C ATOM 578 CD GLN A 159 -3.815 0.469 -6.181 1.00 0.92 C ATOM 579 OE1 GLN A 159 -4.693 -0.137 -6.787 1.00 1.63 O ATOM 580 NE2 GLN A 159 -4.100 1.431 -5.315 1.00 1.50 N ATOM 0 H GLN A 159 -0.550 -0.656 -3.940 1.00 0.30 H new ATOM 0 HA GLN A 159 0.084 2.003 -4.768 1.00 0.31 H new ATOM 0 HB2 GLN A 159 -1.968 2.251 -6.192 1.00 0.38 H new ATOM 0 HB3 GLN A 159 -0.651 1.365 -6.936 1.00 0.38 H new ATOM 0 HG2 GLN A 159 -2.217 -0.167 -7.457 1.00 0.44 H new ATOM 0 HG3 GLN A 159 -2.057 -0.689 -5.791 1.00 0.44 H new ATOM 0 HE21 GLN A 159 -3.348 1.917 -4.826 1.00 1.50 H new ATOM 0 HE22 GLN A 159 -5.072 1.686 -5.137 1.00 1.50 H new ATOM 589 N VAL A 160 -1.917 2.753 -3.388 1.00 0.30 N ATOM 590 CA VAL A 160 -2.803 3.121 -2.322 1.00 0.28 C ATOM 591 C VAL A 160 -3.825 4.117 -2.820 1.00 0.31 C ATOM 592 O VAL A 160 -3.712 4.624 -3.928 1.00 0.53 O ATOM 593 CB VAL A 160 -2.054 3.672 -1.105 1.00 0.28 C ATOM 594 CG1 VAL A 160 -1.668 2.533 -0.166 1.00 0.30 C ATOM 595 CG2 VAL A 160 -0.825 4.461 -1.542 1.00 0.29 C ATOM 0 H VAL A 160 -1.523 3.541 -3.902 1.00 0.30 H new ATOM 0 HA VAL A 160 -3.314 2.217 -1.992 1.00 0.28 H new ATOM 0 HB VAL A 160 -2.713 4.353 -0.566 1.00 0.28 H new ATOM 0 HG11 VAL A 160 -1.136 2.936 0.696 1.00 0.30 H new ATOM 0 HG12 VAL A 160 -2.568 2.019 0.171 1.00 0.30 H new ATOM 0 HG13 VAL A 160 -1.024 1.829 -0.693 1.00 0.30 H new ATOM 0 HG21 VAL A 160 -0.307 4.844 -0.663 1.00 0.29 H new ATOM 0 HG22 VAL A 160 -0.155 3.810 -2.103 1.00 0.29 H new ATOM 0 HG23 VAL A 160 -1.133 5.295 -2.173 1.00 0.29 H new ATOM 605 N TYR A 161 -4.847 4.351 -2.038 1.00 0.32 N ATOM 606 CA TYR A 161 -5.931 5.206 -2.464 1.00 0.36 C ATOM 607 C TYR A 161 -5.986 6.485 -1.648 1.00 0.34 C ATOM 608 O TYR A 161 -6.436 6.475 -0.504 1.00 0.42 O ATOM 609 CB TYR A 161 -7.237 4.459 -2.292 1.00 0.49 C ATOM 610 CG TYR A 161 -7.481 3.359 -3.300 1.00 0.44 C ATOM 611 CD1 TYR A 161 -8.020 3.653 -4.545 1.00 0.65 C ATOM 612 CD2 TYR A 161 -7.164 2.035 -3.019 1.00 0.38 C ATOM 613 CE1 TYR A 161 -8.239 2.665 -5.482 1.00 0.74 C ATOM 614 CE2 TYR A 161 -7.383 1.037 -3.953 1.00 0.49 C ATOM 615 CZ TYR A 161 -7.940 1.308 -5.122 1.00 0.63 C ATOM 616 OH TYR A 161 -8.133 0.378 -6.121 1.00 0.82 O ATOM 0 H TYR A 161 -4.954 3.962 -1.101 1.00 0.32 H new ATOM 0 HA TYR A 161 -5.767 5.474 -3.508 1.00 0.36 H new ATOM 0 HB2 TYR A 161 -7.262 4.027 -1.292 1.00 0.49 H new ATOM 0 HB3 TYR A 161 -8.058 5.174 -2.351 1.00 0.49 H new ATOM 0 HD1 TYR A 161 -8.273 4.675 -4.785 1.00 0.65 H new ATOM 0 HD2 TYR A 161 -6.741 1.781 -2.058 1.00 0.38 H new ATOM 0 HE1 TYR A 161 -8.625 2.906 -6.461 1.00 0.74 H new ATOM 0 HE2 TYR A 161 -7.095 0.022 -3.724 1.00 0.49 H new ATOM 0 HH TYR A 161 -7.687 -0.460 -5.878 1.00 0.82 H new ATOM 626 N TYR A 162 -5.530 7.584 -2.232 1.00 0.31 N ATOM 627 CA TYR A 162 -5.663 8.879 -1.592 1.00 0.27 C ATOM 628 C TYR A 162 -5.374 9.990 -2.589 1.00 0.31 C ATOM 629 O TYR A 162 -4.829 9.741 -3.621 1.00 0.55 O ATOM 630 CB TYR A 162 -4.743 8.982 -0.377 1.00 0.39 C ATOM 631 CG TYR A 162 -3.272 9.109 -0.696 1.00 0.46 C ATOM 632 CD1 TYR A 162 -2.571 8.024 -1.183 1.00 0.77 C ATOM 633 CD2 TYR A 162 -2.596 10.313 -0.548 1.00 0.89 C ATOM 634 CE1 TYR A 162 -1.239 8.117 -1.508 1.00 1.16 C ATOM 635 CE2 TYR A 162 -1.259 10.418 -0.879 1.00 1.29 C ATOM 636 CZ TYR A 162 -0.561 9.369 -1.201 1.00 1.35 C ATOM 637 OH TYR A 162 0.730 9.406 -1.701 1.00 1.82 O ATOM 0 H TYR A 162 -5.068 7.603 -3.141 1.00 0.31 H new ATOM 0 HA TYR A 162 -6.689 8.989 -1.242 1.00 0.27 H new ATOM 0 HB2 TYR A 162 -5.046 9.845 0.217 1.00 0.39 H new ATOM 0 HB3 TYR A 162 -4.889 8.099 0.246 1.00 0.39 H new ATOM 0 HD1 TYR A 162 -3.081 7.081 -1.311 1.00 0.77 H new ATOM 0 HD2 TYR A 162 -3.122 11.177 -0.170 1.00 0.89 H new ATOM 0 HE1 TYR A 162 -0.716 7.294 -1.973 1.00 1.16 H new ATOM 0 HE2 TYR A 162 -0.785 11.388 -0.870 1.00 1.29 H new ATOM 0 HH TYR A 162 1.145 10.264 -1.472 1.00 1.82 H new ATOM 647 N ARG A 163 -5.728 11.209 -2.265 1.00 0.26 N ATOM 648 CA ARG A 163 -5.474 12.353 -3.138 1.00 0.32 C ATOM 649 C ARG A 163 -4.230 13.054 -2.602 1.00 0.36 C ATOM 650 O ARG A 163 -3.790 12.715 -1.509 1.00 0.41 O ATOM 651 CB ARG A 163 -6.701 13.286 -3.201 1.00 0.41 C ATOM 652 CG ARG A 163 -6.695 14.439 -2.206 1.00 0.75 C ATOM 653 CD ARG A 163 -6.769 13.957 -0.773 1.00 1.28 C ATOM 654 NE ARG A 163 -6.815 15.076 0.169 1.00 1.93 N ATOM 655 CZ ARG A 163 -7.793 15.281 1.050 1.00 2.58 C ATOM 656 NH1 ARG A 163 -8.831 14.453 1.112 1.00 2.91 N ATOM 657 NH2 ARG A 163 -7.742 16.330 1.862 1.00 3.26 N ATOM 0 H ARG A 163 -6.200 11.447 -1.393 1.00 0.26 H new ATOM 0 HA ARG A 163 -5.300 12.034 -4.166 1.00 0.32 H new ATOM 0 HB2 ARG A 163 -6.772 13.697 -4.208 1.00 0.41 H new ATOM 0 HB3 ARG A 163 -7.599 12.690 -3.036 1.00 0.41 H new ATOM 0 HG2 ARG A 163 -5.789 15.030 -2.343 1.00 0.75 H new ATOM 0 HG3 ARG A 163 -7.539 15.098 -2.410 1.00 0.75 H new ATOM 0 HD2 ARG A 163 -7.654 13.334 -0.643 1.00 1.28 H new ATOM 0 HD3 ARG A 163 -5.904 13.331 -0.554 1.00 1.28 H new ATOM 0 HE ARG A 163 -6.045 15.745 0.150 1.00 1.93 H new ATOM 0 HH11 ARG A 163 -8.883 13.653 0.482 1.00 2.91 H new ATOM 0 HH12 ARG A 163 -9.575 14.618 1.790 1.00 2.91 H new ATOM 0 HH21 ARG A 163 -6.955 16.977 1.811 1.00 3.26 H new ATOM 0 HH22 ARG A 163 -8.490 16.489 2.537 1.00 3.26 H new ATOM 671 N PRO A 164 -3.644 14.049 -3.285 1.00 0.45 N ATOM 672 CA PRO A 164 -2.255 14.404 -3.022 1.00 0.51 C ATOM 673 C PRO A 164 -2.103 15.361 -1.862 1.00 0.51 C ATOM 674 O PRO A 164 -2.855 16.327 -1.699 1.00 0.57 O ATOM 675 CB PRO A 164 -1.825 15.147 -4.292 1.00 0.65 C ATOM 676 CG PRO A 164 -2.979 15.067 -5.241 1.00 0.80 C ATOM 677 CD PRO A 164 -4.196 14.832 -4.394 1.00 0.53 C ATOM 0 HA PRO A 164 -1.674 13.515 -2.777 1.00 0.51 H new ATOM 0 HB2 PRO A 164 -1.577 16.185 -4.069 1.00 0.65 H new ATOM 0 HB3 PRO A 164 -0.934 14.692 -4.725 1.00 0.65 H new ATOM 0 HG2 PRO A 164 -3.076 15.988 -5.816 1.00 0.80 H new ATOM 0 HG3 PRO A 164 -2.840 14.257 -5.957 1.00 0.80 H new ATOM 0 HD2 PRO A 164 -4.643 15.766 -4.052 1.00 0.53 H new ATOM 0 HD3 PRO A 164 -4.970 14.287 -4.934 1.00 0.53 H new ATOM 685 N VAL A 165 -1.113 15.046 -1.051 1.00 0.52 N ATOM 686 CA VAL A 165 -0.922 15.672 0.231 1.00 0.50 C ATOM 687 C VAL A 165 0.448 16.320 0.323 1.00 0.49 C ATOM 688 O VAL A 165 1.456 15.745 -0.090 1.00 0.47 O ATOM 689 CB VAL A 165 -1.064 14.632 1.354 1.00 0.50 C ATOM 690 CG1 VAL A 165 -0.081 13.493 1.139 1.00 1.31 C ATOM 691 CG2 VAL A 165 -0.861 15.271 2.718 1.00 1.15 C ATOM 0 H VAL A 165 -0.412 14.338 -1.272 1.00 0.52 H new ATOM 0 HA VAL A 165 -1.684 16.443 0.343 1.00 0.50 H new ATOM 0 HB VAL A 165 -2.076 14.229 1.325 1.00 0.50 H new ATOM 0 HG11 VAL A 165 -0.190 12.762 1.940 1.00 1.31 H new ATOM 0 HG12 VAL A 165 -0.283 13.014 0.181 1.00 1.31 H new ATOM 0 HG13 VAL A 165 0.936 13.885 1.142 1.00 1.31 H new ATOM 0 HG21 VAL A 165 -0.967 14.513 3.494 1.00 1.15 H new ATOM 0 HG22 VAL A 165 0.136 15.707 2.771 1.00 1.15 H new ATOM 0 HG23 VAL A 165 -1.607 16.051 2.869 1.00 1.15 H new ATOM 701 N ASP A 166 0.459 17.521 0.859 1.00 0.62 N ATOM 702 CA ASP A 166 1.680 18.266 1.083 1.00 0.67 C ATOM 703 C ASP A 166 1.320 19.526 1.872 1.00 0.90 C ATOM 704 O ASP A 166 1.958 20.570 1.797 1.00 1.48 O ATOM 705 CB ASP A 166 2.354 18.545 -0.274 1.00 0.62 C ATOM 706 CG ASP A 166 3.495 19.549 -0.205 1.00 0.70 C ATOM 707 OD1 ASP A 166 4.538 19.230 0.403 1.00 0.90 O ATOM 708 OD2 ASP A 166 3.349 20.664 -0.755 1.00 1.07 O ATOM 0 H ASP A 166 -0.385 18.012 1.154 1.00 0.62 H new ATOM 0 HA ASP A 166 2.408 17.709 1.673 1.00 0.67 H new ATOM 0 HB2 ASP A 166 2.734 17.607 -0.679 1.00 0.62 H new ATOM 0 HB3 ASP A 166 1.602 18.913 -0.972 1.00 0.62 H new ATOM 713 N GLN A 167 0.278 19.374 2.684 1.00 0.75 N ATOM 714 CA GLN A 167 -0.262 20.471 3.472 1.00 0.96 C ATOM 715 C GLN A 167 -0.634 19.998 4.876 1.00 0.87 C ATOM 716 O GLN A 167 -1.471 20.599 5.544 1.00 1.10 O ATOM 717 CB GLN A 167 -1.486 21.065 2.765 1.00 1.34 C ATOM 718 CG GLN A 167 -2.544 20.035 2.402 1.00 1.50 C ATOM 719 CD GLN A 167 -3.698 20.635 1.627 1.00 2.16 C ATOM 720 OE1 GLN A 167 -4.694 21.067 2.202 1.00 2.71 O ATOM 721 NE2 GLN A 167 -3.567 20.667 0.312 1.00 2.72 N ATOM 0 H GLN A 167 -0.213 18.489 2.812 1.00 0.75 H new ATOM 0 HA GLN A 167 0.502 21.242 3.567 1.00 0.96 H new ATOM 0 HB2 GLN A 167 -1.934 21.822 3.409 1.00 1.34 H new ATOM 0 HB3 GLN A 167 -1.159 21.572 1.857 1.00 1.34 H new ATOM 0 HG2 GLN A 167 -2.086 19.243 1.810 1.00 1.50 H new ATOM 0 HG3 GLN A 167 -2.924 19.573 3.313 1.00 1.50 H new ATOM 0 HE21 GLN A 167 -2.723 20.297 -0.126 1.00 2.72 H new ATOM 0 HE22 GLN A 167 -4.310 21.061 -0.265 1.00 2.72 H new ATOM 730 N TYR A 168 -0.004 18.914 5.317 1.00 0.82 N ATOM 731 CA TYR A 168 -0.207 18.397 6.665 1.00 0.92 C ATOM 732 C TYR A 168 1.143 18.126 7.318 1.00 0.95 C ATOM 733 O TYR A 168 2.165 18.075 6.631 1.00 1.61 O ATOM 734 CB TYR A 168 -1.037 17.108 6.649 1.00 1.02 C ATOM 735 CG TYR A 168 -2.447 17.272 6.119 1.00 1.24 C ATOM 736 CD1 TYR A 168 -3.369 18.088 6.760 1.00 1.62 C ATOM 737 CD2 TYR A 168 -2.855 16.594 4.981 1.00 2.02 C ATOM 738 CE1 TYR A 168 -4.659 18.222 6.278 1.00 2.11 C ATOM 739 CE2 TYR A 168 -4.138 16.723 4.491 1.00 2.63 C ATOM 740 CZ TYR A 168 -5.036 17.538 5.141 1.00 2.50 C ATOM 741 OH TYR A 168 -6.319 17.656 4.657 1.00 3.21 O ATOM 0 H TYR A 168 0.655 18.374 4.756 1.00 0.82 H new ATOM 0 HA TYR A 168 -0.753 19.147 7.237 1.00 0.92 H new ATOM 0 HB2 TYR A 168 -0.519 16.365 6.042 1.00 1.02 H new ATOM 0 HB3 TYR A 168 -1.088 16.712 7.663 1.00 1.02 H new ATOM 0 HD1 TYR A 168 -3.075 18.627 7.649 1.00 1.62 H new ATOM 0 HD2 TYR A 168 -2.154 15.952 4.468 1.00 2.02 H new ATOM 0 HE1 TYR A 168 -5.366 18.858 6.789 1.00 2.11 H new ATOM 0 HE2 TYR A 168 -4.436 16.187 3.602 1.00 2.63 H new ATOM 0 HH TYR A 168 -6.314 17.535 3.685 1.00 3.21 H new ATOM 751 N SER A 169 1.145 17.956 8.631 1.00 1.17 N ATOM 752 CA SER A 169 2.378 17.714 9.366 1.00 1.17 C ATOM 753 C SER A 169 2.580 16.226 9.663 1.00 1.05 C ATOM 754 O SER A 169 3.674 15.686 9.471 1.00 1.12 O ATOM 755 CB SER A 169 2.363 18.518 10.662 1.00 1.40 C ATOM 756 OG SER A 169 1.111 18.391 11.320 1.00 1.94 O ATOM 0 H SER A 169 0.306 17.981 9.211 1.00 1.17 H new ATOM 0 HA SER A 169 3.214 18.035 8.745 1.00 1.17 H new ATOM 0 HB2 SER A 169 3.161 18.172 11.319 1.00 1.40 H new ATOM 0 HB3 SER A 169 2.561 19.568 10.446 1.00 1.40 H new ATOM 0 HG SER A 169 1.123 18.913 12.150 1.00 1.94 H new ATOM 762 N ASN A 170 1.532 15.567 10.142 1.00 0.98 N ATOM 763 CA ASN A 170 1.611 14.145 10.461 1.00 0.89 C ATOM 764 C ASN A 170 1.344 13.306 9.222 1.00 0.68 C ATOM 765 O ASN A 170 0.220 13.267 8.715 1.00 0.75 O ATOM 766 CB ASN A 170 0.626 13.771 11.572 1.00 1.08 C ATOM 767 CG ASN A 170 0.912 14.498 12.871 1.00 1.74 C ATOM 768 OD1 ASN A 170 0.325 15.543 13.154 1.00 2.20 O ATOM 769 ND2 ASN A 170 1.823 13.959 13.668 1.00 2.25 N ATOM 0 H ASN A 170 0.621 15.991 10.318 1.00 0.98 H new ATOM 0 HA ASN A 170 2.620 13.939 10.817 1.00 0.89 H new ATOM 0 HB2 ASN A 170 -0.388 14.001 11.246 1.00 1.08 H new ATOM 0 HB3 ASN A 170 0.669 12.696 11.744 1.00 1.08 H new ATOM 0 HD21 ASN A 170 2.060 14.411 14.551 1.00 2.25 H new ATOM 0 HD22 ASN A 170 2.288 13.092 13.398 1.00 2.25 H new ATOM 776 N GLN A 171 2.374 12.620 8.747 1.00 0.63 N ATOM 777 CA GLN A 171 2.283 11.903 7.483 1.00 0.56 C ATOM 778 C GLN A 171 1.666 10.522 7.666 1.00 0.47 C ATOM 779 O GLN A 171 0.994 10.011 6.778 1.00 0.60 O ATOM 780 CB GLN A 171 3.665 11.767 6.824 1.00 0.86 C ATOM 781 CG GLN A 171 4.579 10.703 7.429 1.00 0.71 C ATOM 782 CD GLN A 171 5.136 11.080 8.789 1.00 1.11 C ATOM 783 OE1 GLN A 171 6.177 11.724 8.883 1.00 1.63 O ATOM 784 NE2 GLN A 171 4.463 10.663 9.852 1.00 1.41 N ATOM 0 H GLN A 171 3.277 12.545 9.215 1.00 0.63 H new ATOM 0 HA GLN A 171 1.635 12.488 6.831 1.00 0.56 H new ATOM 0 HB2 GLN A 171 3.524 11.542 5.767 1.00 0.86 H new ATOM 0 HB3 GLN A 171 4.171 12.731 6.880 1.00 0.86 H new ATOM 0 HG2 GLN A 171 4.024 9.769 7.519 1.00 0.71 H new ATOM 0 HG3 GLN A 171 5.408 10.517 6.746 1.00 0.71 H new ATOM 0 HE21 GLN A 171 3.601 10.130 9.733 1.00 1.41 H new ATOM 0 HE22 GLN A 171 4.807 10.875 10.789 1.00 1.41 H new ATOM 793 N ASN A 172 1.859 9.941 8.837 1.00 0.47 N ATOM 794 CA ASN A 172 1.519 8.541 9.058 1.00 0.49 C ATOM 795 C ASN A 172 0.018 8.345 9.111 1.00 0.42 C ATOM 796 O ASN A 172 -0.504 7.409 8.521 1.00 0.52 O ATOM 797 CB ASN A 172 2.158 8.010 10.346 1.00 0.65 C ATOM 798 CG ASN A 172 1.800 8.836 11.572 1.00 1.19 C ATOM 799 OD1 ASN A 172 1.601 10.050 11.484 1.00 1.88 O ATOM 800 ND2 ASN A 172 1.713 8.190 12.717 1.00 1.56 N ATOM 0 H ASN A 172 2.249 10.415 9.652 1.00 0.47 H new ATOM 0 HA ASN A 172 1.916 7.976 8.215 1.00 0.49 H new ATOM 0 HB2 ASN A 172 1.841 6.979 10.504 1.00 0.65 H new ATOM 0 HB3 ASN A 172 3.242 7.996 10.228 1.00 0.65 H new ATOM 0 HD21 ASN A 172 1.474 8.695 13.570 1.00 1.56 H new ATOM 0 HD22 ASN A 172 1.885 7.185 12.750 1.00 1.56 H new ATOM 807 N SER A 173 -0.660 9.238 9.805 1.00 0.41 N ATOM 808 CA SER A 173 -2.097 9.154 9.981 1.00 0.46 C ATOM 809 C SER A 173 -2.817 9.258 8.642 1.00 0.37 C ATOM 810 O SER A 173 -3.704 8.457 8.339 1.00 0.36 O ATOM 811 CB SER A 173 -2.540 10.268 10.928 1.00 0.60 C ATOM 812 OG SER A 173 -3.932 10.215 11.182 1.00 0.74 O ATOM 0 H SER A 173 -0.231 10.042 10.263 1.00 0.41 H new ATOM 0 HA SER A 173 -2.355 8.186 10.411 1.00 0.46 H new ATOM 0 HB2 SER A 173 -1.995 10.185 11.868 1.00 0.60 H new ATOM 0 HB3 SER A 173 -2.285 11.236 10.496 1.00 0.60 H new ATOM 0 HG SER A 173 -4.181 10.940 11.792 1.00 0.74 H new ATOM 818 N PHE A 174 -2.415 10.232 7.839 1.00 0.33 N ATOM 819 CA PHE A 174 -3.001 10.435 6.524 1.00 0.32 C ATOM 820 C PHE A 174 -2.687 9.247 5.616 1.00 0.24 C ATOM 821 O PHE A 174 -3.550 8.755 4.891 1.00 0.30 O ATOM 822 CB PHE A 174 -2.468 11.739 5.923 1.00 0.40 C ATOM 823 CG PHE A 174 -2.961 12.021 4.534 1.00 0.61 C ATOM 824 CD1 PHE A 174 -2.263 11.545 3.443 1.00 0.99 C ATOM 825 CD2 PHE A 174 -4.113 12.765 4.317 1.00 1.12 C ATOM 826 CE1 PHE A 174 -2.699 11.796 2.165 1.00 1.29 C ATOM 827 CE2 PHE A 174 -4.553 13.023 3.032 1.00 1.41 C ATOM 828 CZ PHE A 174 -3.841 12.536 1.952 1.00 1.33 C ATOM 0 H PHE A 174 -1.680 10.898 8.078 1.00 0.33 H new ATOM 0 HA PHE A 174 -4.084 10.509 6.617 1.00 0.32 H new ATOM 0 HB2 PHE A 174 -2.751 12.568 6.572 1.00 0.40 H new ATOM 0 HB3 PHE A 174 -1.379 11.702 5.910 1.00 0.40 H new ATOM 0 HD1 PHE A 174 -1.363 10.968 3.596 1.00 0.99 H new ATOM 0 HD2 PHE A 174 -4.671 13.146 5.160 1.00 1.12 H new ATOM 0 HE1 PHE A 174 -2.143 11.411 1.323 1.00 1.29 H new ATOM 0 HE2 PHE A 174 -5.450 13.603 2.873 1.00 1.41 H new ATOM 0 HZ PHE A 174 -4.179 12.735 0.946 1.00 1.33 H new ATOM 838 N VAL A 175 -1.447 8.789 5.678 1.00 0.20 N ATOM 839 CA VAL A 175 -0.999 7.655 4.885 1.00 0.20 C ATOM 840 C VAL A 175 -1.724 6.365 5.274 1.00 0.22 C ATOM 841 O VAL A 175 -2.434 5.781 4.461 1.00 0.25 O ATOM 842 CB VAL A 175 0.514 7.470 5.041 1.00 0.28 C ATOM 843 CG1 VAL A 175 0.928 6.058 4.694 1.00 0.33 C ATOM 844 CG2 VAL A 175 1.250 8.474 4.173 1.00 0.41 C ATOM 0 H VAL A 175 -0.725 9.191 6.277 1.00 0.20 H new ATOM 0 HA VAL A 175 -1.237 7.868 3.843 1.00 0.20 H new ATOM 0 HB VAL A 175 0.778 7.645 6.084 1.00 0.28 H new ATOM 0 HG11 VAL A 175 2.007 5.955 4.814 1.00 0.33 H new ATOM 0 HG12 VAL A 175 0.421 5.357 5.357 1.00 0.33 H new ATOM 0 HG13 VAL A 175 0.655 5.842 3.661 1.00 0.33 H new ATOM 0 HG21 VAL A 175 2.325 8.336 4.289 1.00 0.41 H new ATOM 0 HG22 VAL A 175 0.976 8.323 3.129 1.00 0.41 H new ATOM 0 HG23 VAL A 175 0.979 9.485 4.476 1.00 0.41 H new ATOM 854 N HIS A 176 -1.488 5.903 6.498 1.00 0.26 N ATOM 855 CA HIS A 176 -2.292 4.816 7.104 1.00 0.33 C ATOM 856 C HIS A 176 -3.761 4.849 6.670 1.00 0.30 C ATOM 857 O HIS A 176 -4.365 3.811 6.426 1.00 0.32 O ATOM 858 CB HIS A 176 -2.230 4.882 8.635 1.00 0.46 C ATOM 859 CG HIS A 176 -0.901 4.476 9.166 1.00 0.73 C ATOM 860 ND1 HIS A 176 -0.615 4.305 10.499 1.00 0.97 N ATOM 861 CD2 HIS A 176 0.223 4.195 8.498 1.00 1.40 C ATOM 862 CE1 HIS A 176 0.643 3.927 10.623 1.00 1.32 C ATOM 863 NE2 HIS A 176 1.181 3.846 9.417 1.00 1.69 N ATOM 0 H HIS A 176 -0.746 6.258 7.102 1.00 0.26 H new ATOM 0 HA HIS A 176 -1.853 3.884 6.747 1.00 0.33 H new ATOM 0 HB2 HIS A 176 -2.454 5.897 8.962 1.00 0.46 H new ATOM 0 HB3 HIS A 176 -3.000 4.235 9.055 1.00 0.46 H new ATOM 0 HD2 HIS A 176 0.354 4.235 7.427 1.00 1.40 H new ATOM 0 HE1 HIS A 176 1.149 3.718 11.554 1.00 1.32 H new ATOM 0 HE2 HIS A 176 2.141 3.572 9.207 1.00 1.69 H new ATOM 872 N ASP A 177 -4.317 6.043 6.569 1.00 0.30 N ATOM 873 CA ASP A 177 -5.722 6.218 6.157 1.00 0.33 C ATOM 874 C ASP A 177 -5.931 5.771 4.721 1.00 0.28 C ATOM 875 O ASP A 177 -6.851 5.016 4.445 1.00 0.29 O ATOM 876 CB ASP A 177 -6.158 7.676 6.338 1.00 0.41 C ATOM 877 CG ASP A 177 -7.618 7.909 5.996 1.00 0.60 C ATOM 878 OD1 ASP A 177 -8.488 7.195 6.544 1.00 0.81 O ATOM 879 OD2 ASP A 177 -7.902 8.836 5.211 1.00 0.84 O ATOM 0 H ASP A 177 -3.826 6.915 6.764 1.00 0.30 H new ATOM 0 HA ASP A 177 -6.341 5.590 6.797 1.00 0.33 H new ATOM 0 HB2 ASP A 177 -5.981 7.976 7.371 1.00 0.41 H new ATOM 0 HB3 ASP A 177 -5.538 8.315 5.710 1.00 0.41 H new ATOM 884 N CYS A 178 -5.034 6.177 3.834 1.00 0.26 N ATOM 885 CA CYS A 178 -5.114 5.849 2.422 1.00 0.27 C ATOM 886 C CYS A 178 -5.113 4.330 2.238 1.00 0.24 C ATOM 887 O CYS A 178 -5.670 3.800 1.276 1.00 0.29 O ATOM 888 CB CYS A 178 -3.913 6.446 1.689 1.00 0.34 C ATOM 889 SG CYS A 178 -2.514 5.296 1.538 1.00 0.79 S ATOM 0 H CYS A 178 -4.225 6.748 4.078 1.00 0.26 H new ATOM 0 HA CYS A 178 -6.037 6.261 2.013 1.00 0.27 H new ATOM 0 HB2 CYS A 178 -4.224 6.760 0.693 1.00 0.34 H new ATOM 0 HB3 CYS A 178 -3.583 7.341 2.217 1.00 0.34 H new ATOM 894 N VAL A 179 -4.466 3.630 3.166 1.00 0.23 N ATOM 895 CA VAL A 179 -4.423 2.182 3.122 1.00 0.22 C ATOM 896 C VAL A 179 -5.631 1.594 3.831 1.00 0.22 C ATOM 897 O VAL A 179 -6.114 0.531 3.462 1.00 0.22 O ATOM 898 CB VAL A 179 -3.134 1.621 3.735 1.00 0.21 C ATOM 899 CG1 VAL A 179 -2.024 2.634 3.657 1.00 0.21 C ATOM 900 CG2 VAL A 179 -3.335 1.129 5.152 1.00 0.24 C ATOM 0 H VAL A 179 -3.968 4.046 3.953 1.00 0.23 H new ATOM 0 HA VAL A 179 -4.441 1.893 2.071 1.00 0.22 H new ATOM 0 HB VAL A 179 -2.847 0.751 3.144 1.00 0.21 H new ATOM 0 HG11 VAL A 179 -1.119 2.216 4.097 1.00 0.21 H new ATOM 0 HG12 VAL A 179 -1.836 2.888 2.614 1.00 0.21 H new ATOM 0 HG13 VAL A 179 -2.312 3.532 4.203 1.00 0.21 H new ATOM 0 HG21 VAL A 179 -2.393 0.742 5.540 1.00 0.24 H new ATOM 0 HG22 VAL A 179 -3.674 1.954 5.779 1.00 0.24 H new ATOM 0 HG23 VAL A 179 -4.083 0.336 5.159 1.00 0.24 H new ATOM 910 N ASN A 180 -6.144 2.309 4.826 1.00 0.25 N ATOM 911 CA ASN A 180 -7.420 1.951 5.436 1.00 0.27 C ATOM 912 C ASN A 180 -8.511 2.063 4.385 1.00 0.27 C ATOM 913 O ASN A 180 -9.676 1.785 4.639 1.00 0.30 O ATOM 914 CB ASN A 180 -7.735 2.847 6.638 1.00 0.31 C ATOM 915 CG ASN A 180 -7.190 2.289 7.941 1.00 0.77 C ATOM 916 OD1 ASN A 180 -7.884 1.570 8.662 1.00 1.41 O ATOM 917 ND2 ASN A 180 -5.948 2.608 8.256 1.00 1.30 N ATOM 0 H ASN A 180 -5.699 3.135 5.226 1.00 0.25 H new ATOM 0 HA ASN A 180 -7.364 0.927 5.805 1.00 0.27 H new ATOM 0 HB2 ASN A 180 -7.315 3.838 6.468 1.00 0.31 H new ATOM 0 HB3 ASN A 180 -8.815 2.969 6.723 1.00 0.31 H new ATOM 0 HD21 ASN A 180 -5.535 2.257 9.120 1.00 1.30 H new ATOM 0 HD22 ASN A 180 -5.402 3.206 7.636 1.00 1.30 H new ATOM 924 N ILE A 181 -8.110 2.558 3.225 1.00 0.25 N ATOM 925 CA ILE A 181 -8.892 2.476 2.009 1.00 0.29 C ATOM 926 C ILE A 181 -8.419 1.292 1.143 1.00 0.27 C ATOM 927 O ILE A 181 -9.207 0.455 0.750 1.00 0.36 O ATOM 928 CB ILE A 181 -8.747 3.770 1.194 1.00 0.35 C ATOM 929 CG1 ILE A 181 -8.393 4.921 2.108 1.00 0.49 C ATOM 930 CG2 ILE A 181 -10.025 4.099 0.474 1.00 0.40 C ATOM 931 CD1 ILE A 181 -9.550 5.444 2.936 1.00 1.14 C ATOM 0 H ILE A 181 -7.217 3.035 3.104 1.00 0.25 H new ATOM 0 HA ILE A 181 -9.935 2.331 2.289 1.00 0.29 H new ATOM 0 HB ILE A 181 -7.954 3.616 0.462 1.00 0.35 H new ATOM 0 HG12 ILE A 181 -7.596 4.603 2.780 1.00 0.49 H new ATOM 0 HG13 ILE A 181 -7.995 5.738 1.506 1.00 0.49 H new ATOM 0 HG21 ILE A 181 -9.895 5.019 -0.095 1.00 0.40 H new ATOM 0 HG22 ILE A 181 -10.280 3.285 -0.205 1.00 0.40 H new ATOM 0 HG23 ILE A 181 -10.828 4.231 1.199 1.00 0.40 H new ATOM 0 HD11 ILE A 181 -9.206 6.268 3.562 1.00 1.14 H new ATOM 0 HD12 ILE A 181 -10.341 5.797 2.274 1.00 1.14 H new ATOM 0 HD13 ILE A 181 -9.936 4.644 3.568 1.00 1.14 H new ATOM 943 N THR A 182 -7.111 1.200 0.917 1.00 0.20 N ATOM 944 CA THR A 182 -6.529 0.272 -0.065 1.00 0.20 C ATOM 945 C THR A 182 -6.699 -1.156 0.337 1.00 0.24 C ATOM 946 O THR A 182 -7.191 -1.992 -0.429 1.00 0.26 O ATOM 947 CB THR A 182 -5.022 0.501 -0.253 1.00 0.20 C ATOM 948 OG1 THR A 182 -4.811 1.703 -0.951 1.00 0.22 O ATOM 949 CG2 THR A 182 -4.393 -0.636 -1.043 1.00 0.26 C ATOM 0 H THR A 182 -6.418 1.766 1.408 1.00 0.20 H new ATOM 0 HA THR A 182 -7.066 0.473 -0.992 1.00 0.20 H new ATOM 0 HB THR A 182 -4.561 0.547 0.734 1.00 0.20 H new ATOM 0 HG1 THR A 182 -4.575 2.412 -0.317 1.00 0.22 H new ATOM 0 HG21 THR A 182 -3.326 -0.449 -1.162 1.00 0.26 H new ATOM 0 HG22 THR A 182 -4.540 -1.575 -0.509 1.00 0.26 H new ATOM 0 HG23 THR A 182 -4.862 -0.700 -2.025 1.00 0.26 H new ATOM 957 N VAL A 183 -6.278 -1.414 1.546 1.00 0.28 N ATOM 958 CA VAL A 183 -6.305 -2.730 2.108 1.00 0.36 C ATOM 959 C VAL A 183 -7.755 -3.136 2.322 1.00 0.44 C ATOM 960 O VAL A 183 -8.064 -4.186 2.865 1.00 0.74 O ATOM 961 CB VAL A 183 -5.463 -2.769 3.405 1.00 0.34 C ATOM 962 CG1 VAL A 183 -4.332 -1.767 3.315 1.00 0.26 C ATOM 963 CG2 VAL A 183 -6.302 -2.535 4.655 1.00 0.40 C ATOM 0 H VAL A 183 -5.902 -0.703 2.174 1.00 0.28 H new ATOM 0 HA VAL A 183 -5.854 -3.455 1.430 1.00 0.36 H new ATOM 0 HB VAL A 183 -5.048 -3.773 3.497 1.00 0.34 H new ATOM 0 HG11 VAL A 183 -3.743 -1.800 4.232 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -3.695 -2.013 2.465 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -4.742 -0.766 3.183 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -5.661 -2.573 5.536 1.00 0.40 H new ATOM 0 HG22 VAL A 183 -6.779 -1.557 4.595 1.00 0.40 H new ATOM 0 HG23 VAL A 183 -7.067 -3.308 4.730 1.00 0.40 H new ATOM 973 N LYS A 184 -8.642 -2.225 1.951 1.00 0.32 N ATOM 974 CA LYS A 184 -10.056 -2.499 1.932 1.00 0.34 C ATOM 975 C LYS A 184 -10.502 -2.887 0.537 1.00 0.35 C ATOM 976 O LYS A 184 -10.823 -4.030 0.255 1.00 0.37 O ATOM 977 CB LYS A 184 -10.844 -1.268 2.360 1.00 0.38 C ATOM 978 CG LYS A 184 -10.480 -0.745 3.732 1.00 0.43 C ATOM 979 CD LYS A 184 -9.715 -1.765 4.512 1.00 0.76 C ATOM 980 CE LYS A 184 -9.431 -1.342 5.941 1.00 0.60 C ATOM 981 NZ LYS A 184 -10.657 -0.921 6.671 1.00 1.00 N ATOM 0 H LYS A 184 -8.395 -1.280 1.657 1.00 0.32 H new ATOM 0 HA LYS A 184 -10.244 -3.320 2.624 1.00 0.34 H new ATOM 0 HB2 LYS A 184 -10.685 -0.476 1.628 1.00 0.38 H new ATOM 0 HB3 LYS A 184 -11.907 -1.508 2.345 1.00 0.38 H new ATOM 0 HG2 LYS A 184 -9.885 0.163 3.632 1.00 0.43 H new ATOM 0 HG3 LYS A 184 -11.386 -0.474 4.273 1.00 0.43 H new ATOM 0 HD2 LYS A 184 -10.276 -2.700 4.522 1.00 0.76 H new ATOM 0 HD3 LYS A 184 -8.771 -1.966 4.006 1.00 0.76 H new ATOM 0 HE2 LYS A 184 -8.962 -2.169 6.474 1.00 0.60 H new ATOM 0 HE3 LYS A 184 -8.716 -0.520 5.937 1.00 0.60 H new ATOM 0 HZ1 LYS A 184 -10.459 -0.888 7.691 1.00 1.00 H new ATOM 0 HZ2 LYS A 184 -10.949 0.022 6.344 1.00 1.00 H new ATOM 0 HZ3 LYS A 184 -11.421 -1.603 6.489 1.00 1.00 H new ATOM 995 N GLN A 185 -10.428 -1.907 -0.345 1.00 0.38 N ATOM 996 CA GLN A 185 -11.002 -1.980 -1.682 1.00 0.49 C ATOM 997 C GLN A 185 -10.499 -3.189 -2.442 1.00 0.51 C ATOM 998 O GLN A 185 -11.138 -3.666 -3.378 1.00 0.64 O ATOM 999 CB GLN A 185 -10.656 -0.693 -2.407 1.00 0.60 C ATOM 1000 CG GLN A 185 -10.795 0.494 -1.478 1.00 0.78 C ATOM 1001 CD GLN A 185 -12.231 0.768 -1.084 1.00 1.38 C ATOM 1002 OE1 GLN A 185 -13.157 0.529 -1.855 1.00 1.83 O ATOM 1003 NE2 GLN A 185 -12.427 1.259 0.130 1.00 2.13 N ATOM 0 H GLN A 185 -9.960 -1.022 -0.152 1.00 0.38 H new ATOM 0 HA GLN A 185 -12.084 -2.093 -1.612 1.00 0.49 H new ATOM 0 HB2 GLN A 185 -9.636 -0.746 -2.788 1.00 0.60 H new ATOM 0 HB3 GLN A 185 -11.312 -0.567 -3.268 1.00 0.60 H new ATOM 0 HG2 GLN A 185 -10.204 0.317 -0.579 1.00 0.78 H new ATOM 0 HG3 GLN A 185 -10.381 1.379 -1.962 1.00 0.78 H new ATOM 0 HE21 GLN A 185 -11.631 1.444 0.740 1.00 2.13 H new ATOM 0 HE22 GLN A 185 -13.374 1.452 0.455 1.00 2.13 H new ATOM 1012 N HIS A 186 -9.343 -3.673 -2.044 1.00 0.45 N ATOM 1013 CA HIS A 186 -8.835 -4.904 -2.585 1.00 0.54 C ATOM 1014 C HIS A 186 -9.171 -6.076 -1.658 1.00 0.69 C ATOM 1015 O HIS A 186 -10.062 -6.862 -1.929 1.00 1.31 O ATOM 1016 CB HIS A 186 -7.320 -4.759 -2.795 1.00 0.49 C ATOM 1017 CG HIS A 186 -6.991 -3.972 -4.026 1.00 0.53 C ATOM 1018 ND1 HIS A 186 -6.434 -4.525 -5.160 1.00 0.68 N ATOM 1019 CD2 HIS A 186 -7.166 -2.656 -4.303 1.00 0.54 C ATOM 1020 CE1 HIS A 186 -6.293 -3.588 -6.078 1.00 0.72 C ATOM 1021 NE2 HIS A 186 -6.726 -2.444 -5.584 1.00 0.66 N ATOM 0 H HIS A 186 -8.742 -3.230 -1.349 1.00 0.45 H new ATOM 0 HA HIS A 186 -9.305 -5.115 -3.546 1.00 0.54 H new ATOM 0 HB2 HIS A 186 -6.880 -4.271 -1.926 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -6.869 -5.749 -2.867 1.00 0.49 H new ATOM 0 HD1 HIS A 186 -6.172 -5.505 -5.271 1.00 0.68 H new ATOM 0 HD2 HIS A 186 -7.577 -1.912 -3.637 1.00 0.54 H new ATOM 0 HE1 HIS A 186 -5.890 -3.733 -7.069 1.00 0.72 H new ATOM 1030 N THR A 187 -8.493 -6.106 -0.547 1.00 0.38 N ATOM 1031 CA THR A 187 -8.621 -7.093 0.530 1.00 0.45 C ATOM 1032 C THR A 187 -10.053 -7.353 1.073 1.00 0.54 C ATOM 1033 O THR A 187 -10.208 -7.957 2.135 1.00 0.83 O ATOM 1034 CB THR A 187 -7.732 -6.584 1.665 1.00 0.57 C ATOM 1035 OG1 THR A 187 -6.529 -6.058 1.092 1.00 1.63 O ATOM 1036 CG2 THR A 187 -7.385 -7.650 2.691 1.00 0.88 C ATOM 0 H THR A 187 -7.784 -5.402 -0.339 1.00 0.38 H new ATOM 0 HA THR A 187 -8.329 -8.059 0.118 1.00 0.45 H new ATOM 0 HB THR A 187 -8.291 -5.818 2.202 1.00 0.57 H new ATOM 0 HG1 THR A 187 -5.806 -6.102 1.752 1.00 1.63 H new ATOM 0 HG21 THR A 187 -6.752 -7.217 3.466 1.00 0.88 H new ATOM 0 HG22 THR A 187 -8.301 -8.033 3.142 1.00 0.88 H new ATOM 0 HG23 THR A 187 -6.853 -8.466 2.202 1.00 0.88 H new ATOM 1044 N VAL A 188 -11.096 -6.941 0.368 1.00 0.41 N ATOM 1045 CA VAL A 188 -12.458 -7.253 0.799 1.00 0.46 C ATOM 1046 C VAL A 188 -13.272 -7.848 -0.354 1.00 0.45 C ATOM 1047 O VAL A 188 -14.484 -8.042 -0.253 1.00 0.57 O ATOM 1048 CB VAL A 188 -13.168 -6.014 1.383 1.00 0.51 C ATOM 1049 CG1 VAL A 188 -12.248 -5.327 2.385 1.00 0.53 C ATOM 1050 CG2 VAL A 188 -13.604 -5.051 0.287 1.00 0.49 C ATOM 0 H VAL A 188 -11.032 -6.398 -0.493 1.00 0.41 H new ATOM 0 HA VAL A 188 -12.387 -7.997 1.592 1.00 0.46 H new ATOM 0 HB VAL A 188 -14.073 -6.340 1.896 1.00 0.51 H new ATOM 0 HG11 VAL A 188 -12.749 -4.451 2.798 1.00 0.53 H new ATOM 0 HG12 VAL A 188 -12.005 -6.020 3.191 1.00 0.53 H new ATOM 0 HG13 VAL A 188 -11.331 -5.018 1.884 1.00 0.53 H new ATOM 0 HG21 VAL A 188 -14.100 -4.190 0.735 1.00 0.49 H new ATOM 0 HG22 VAL A 188 -12.730 -4.716 -0.272 1.00 0.49 H new ATOM 0 HG23 VAL A 188 -14.294 -5.557 -0.388 1.00 0.49 H new ATOM 1060 N THR A 189 -12.574 -8.145 -1.443 1.00 0.38 N ATOM 1061 CA THR A 189 -13.156 -8.756 -2.637 1.00 0.41 C ATOM 1062 C THR A 189 -12.024 -9.322 -3.480 1.00 0.34 C ATOM 1063 O THR A 189 -12.066 -10.461 -3.945 1.00 0.35 O ATOM 1064 CB THR A 189 -13.956 -7.745 -3.487 1.00 0.50 C ATOM 1065 OG1 THR A 189 -15.080 -7.244 -2.750 1.00 0.64 O ATOM 1066 CG2 THR A 189 -14.433 -8.389 -4.783 1.00 0.51 C ATOM 0 H THR A 189 -11.573 -7.967 -1.525 1.00 0.38 H new ATOM 0 HA THR A 189 -13.849 -9.534 -2.317 1.00 0.41 H new ATOM 0 HB THR A 189 -13.295 -6.913 -3.731 1.00 0.50 H new ATOM 0 HG1 THR A 189 -15.128 -7.693 -1.880 1.00 0.64 H new ATOM 0 HG21 THR A 189 -14.994 -7.659 -5.367 1.00 0.51 H new ATOM 0 HG22 THR A 189 -13.572 -8.729 -5.359 1.00 0.51 H new ATOM 0 HG23 THR A 189 -15.074 -9.240 -4.552 1.00 0.51 H new ATOM 1074 N THR A 190 -11.006 -8.494 -3.640 1.00 0.32 N ATOM 1075 CA THR A 190 -9.750 -8.876 -4.245 1.00 0.34 C ATOM 1076 C THR A 190 -9.138 -10.066 -3.506 1.00 0.34 C ATOM 1077 O THR A 190 -8.412 -10.873 -4.085 1.00 0.42 O ATOM 1078 CB THR A 190 -8.800 -7.676 -4.220 1.00 0.39 C ATOM 1079 OG1 THR A 190 -9.318 -6.622 -5.044 1.00 0.54 O ATOM 1080 CG2 THR A 190 -7.406 -8.037 -4.649 1.00 0.55 C ATOM 0 H THR A 190 -11.034 -7.518 -3.345 1.00 0.32 H new ATOM 0 HA THR A 190 -9.921 -9.179 -5.278 1.00 0.34 H new ATOM 0 HB THR A 190 -8.736 -7.335 -3.187 1.00 0.39 H new ATOM 0 HG1 THR A 190 -8.575 -6.100 -5.412 1.00 0.54 H new ATOM 0 HG21 THR A 190 -6.773 -7.150 -4.613 1.00 0.55 H new ATOM 0 HG22 THR A 190 -7.004 -8.797 -3.979 1.00 0.55 H new ATOM 0 HG23 THR A 190 -7.428 -8.426 -5.667 1.00 0.55 H new ATOM 1088 N THR A 191 -9.452 -10.181 -2.224 1.00 0.34 N ATOM 1089 CA THR A 191 -9.014 -11.315 -1.440 1.00 0.47 C ATOM 1090 C THR A 191 -9.921 -12.517 -1.653 1.00 0.35 C ATOM 1091 O THR A 191 -9.469 -13.650 -1.778 1.00 0.34 O ATOM 1092 CB THR A 191 -9.012 -10.979 0.045 1.00 0.83 C ATOM 1093 OG1 THR A 191 -10.123 -10.123 0.332 1.00 1.66 O ATOM 1094 CG2 THR A 191 -7.706 -10.321 0.442 1.00 1.23 C ATOM 0 H THR A 191 -10.009 -9.500 -1.709 1.00 0.34 H new ATOM 0 HA THR A 191 -8.004 -11.556 -1.770 1.00 0.47 H new ATOM 0 HB THR A 191 -9.108 -11.897 0.625 1.00 0.83 H new ATOM 0 HG1 THR A 191 -10.324 -10.158 1.290 1.00 1.66 H new ATOM 0 HG21 THR A 191 -7.725 -10.089 1.507 1.00 1.23 H new ATOM 0 HG22 THR A 191 -6.879 -10.999 0.233 1.00 1.23 H new ATOM 0 HG23 THR A 191 -7.574 -9.401 -0.128 1.00 1.23 H new ATOM 1102 N THR A 192 -11.213 -12.262 -1.710 1.00 0.46 N ATOM 1103 CA THR A 192 -12.189 -13.337 -1.742 1.00 0.60 C ATOM 1104 C THR A 192 -12.421 -13.880 -3.150 1.00 0.59 C ATOM 1105 O THR A 192 -13.369 -14.625 -3.378 1.00 0.73 O ATOM 1106 CB THR A 192 -13.524 -12.882 -1.136 1.00 0.76 C ATOM 1107 OG1 THR A 192 -13.961 -11.674 -1.773 1.00 0.69 O ATOM 1108 CG2 THR A 192 -13.383 -12.656 0.363 1.00 0.90 C ATOM 0 H THR A 192 -11.612 -11.324 -1.735 1.00 0.46 H new ATOM 0 HA THR A 192 -11.774 -14.146 -1.141 1.00 0.60 H new ATOM 0 HB THR A 192 -14.265 -13.665 -1.300 1.00 0.76 H new ATOM 0 HG1 THR A 192 -14.814 -11.389 -1.384 1.00 0.69 H new ATOM 0 HG21 THR A 192 -14.340 -12.334 0.774 1.00 0.90 H new ATOM 0 HG22 THR A 192 -13.076 -13.585 0.844 1.00 0.90 H new ATOM 0 HG23 THR A 192 -12.632 -11.887 0.546 1.00 0.90 H new ATOM 1116 N LYS A 193 -11.543 -13.535 -4.089 1.00 0.51 N ATOM 1117 CA LYS A 193 -11.627 -14.096 -5.435 1.00 0.58 C ATOM 1118 C LYS A 193 -10.906 -15.439 -5.493 1.00 0.69 C ATOM 1119 O LYS A 193 -10.466 -15.891 -6.550 1.00 0.82 O ATOM 1120 CB LYS A 193 -11.080 -13.108 -6.484 1.00 0.53 C ATOM 1121 CG LYS A 193 -9.688 -12.553 -6.196 1.00 0.45 C ATOM 1122 CD LYS A 193 -8.586 -13.547 -6.515 1.00 0.53 C ATOM 1123 CE LYS A 193 -7.217 -12.975 -6.195 1.00 0.57 C ATOM 1124 NZ LYS A 193 -6.125 -13.953 -6.468 1.00 1.12 N ATOM 0 H LYS A 193 -10.775 -12.879 -3.946 1.00 0.51 H new ATOM 0 HA LYS A 193 -12.676 -14.267 -5.676 1.00 0.58 H new ATOM 0 HB2 LYS A 193 -11.061 -13.607 -7.453 1.00 0.53 H new ATOM 0 HB3 LYS A 193 -11.775 -12.273 -6.569 1.00 0.53 H new ATOM 0 HG2 LYS A 193 -9.534 -11.646 -6.781 1.00 0.45 H new ATOM 0 HG3 LYS A 193 -9.624 -12.270 -5.145 1.00 0.45 H new ATOM 0 HD2 LYS A 193 -8.743 -14.462 -5.944 1.00 0.53 H new ATOM 0 HD3 LYS A 193 -8.632 -13.818 -7.570 1.00 0.53 H new ATOM 0 HE2 LYS A 193 -7.053 -12.074 -6.787 1.00 0.57 H new ATOM 0 HE3 LYS A 193 -7.184 -12.678 -5.147 1.00 0.57 H new ATOM 0 HZ1 LYS A 193 -5.300 -13.727 -5.876 1.00 1.12 H new ATOM 0 HZ2 LYS A 193 -6.456 -14.914 -6.248 1.00 1.12 H new ATOM 0 HZ3 LYS A 193 -5.856 -13.901 -7.471 1.00 1.12 H new ATOM 1138 N GLY A 194 -10.819 -16.086 -4.345 1.00 0.70 N ATOM 1139 CA GLY A 194 -10.098 -17.327 -4.246 1.00 0.81 C ATOM 1140 C GLY A 194 -8.657 -17.087 -3.870 1.00 0.75 C ATOM 1141 O GLY A 194 -7.772 -17.872 -4.206 1.00 0.86 O ATOM 0 H GLY A 194 -11.241 -15.767 -3.473 1.00 0.70 H new ATOM 0 HA2 GLY A 194 -10.570 -17.967 -3.501 1.00 0.81 H new ATOM 0 HA3 GLY A 194 -10.146 -17.856 -5.198 1.00 0.81 H new ATOM 1145 N GLU A 195 -8.425 -15.986 -3.170 1.00 0.63 N ATOM 1146 CA GLU A 195 -7.096 -15.630 -2.712 1.00 0.60 C ATOM 1147 C GLU A 195 -6.976 -15.951 -1.232 1.00 0.59 C ATOM 1148 O GLU A 195 -7.978 -15.989 -0.513 1.00 0.63 O ATOM 1149 CB GLU A 195 -6.827 -14.138 -2.971 1.00 0.64 C ATOM 1150 CG GLU A 195 -5.413 -13.696 -2.655 1.00 0.72 C ATOM 1151 CD GLU A 195 -4.386 -14.468 -3.445 1.00 0.84 C ATOM 1152 OE1 GLU A 195 -4.239 -14.201 -4.649 1.00 1.40 O ATOM 1153 OE2 GLU A 195 -3.718 -15.346 -2.860 1.00 1.29 O ATOM 0 H GLU A 195 -9.151 -15.319 -2.906 1.00 0.63 H new ATOM 0 HA GLU A 195 -6.352 -16.206 -3.262 1.00 0.60 H new ATOM 0 HB2 GLU A 195 -7.038 -13.919 -4.018 1.00 0.64 H new ATOM 0 HB3 GLU A 195 -7.522 -13.547 -2.375 1.00 0.64 H new ATOM 0 HG2 GLU A 195 -5.310 -12.632 -2.870 1.00 0.72 H new ATOM 0 HG3 GLU A 195 -5.223 -13.826 -1.590 1.00 0.72 H new ATOM 1160 N ASN A 196 -5.764 -16.195 -0.781 1.00 0.64 N ATOM 1161 CA ASN A 196 -5.544 -16.573 0.601 1.00 0.69 C ATOM 1162 C ASN A 196 -5.006 -15.397 1.377 1.00 0.63 C ATOM 1163 O ASN A 196 -3.859 -15.004 1.184 1.00 0.80 O ATOM 1164 CB ASN A 196 -4.548 -17.732 0.700 1.00 0.91 C ATOM 1165 CG ASN A 196 -5.028 -18.983 -0.007 1.00 1.07 C ATOM 1166 OD1 ASN A 196 -6.221 -19.282 -0.029 1.00 1.13 O ATOM 1167 ND2 ASN A 196 -4.105 -19.713 -0.611 1.00 1.99 N ATOM 0 H ASN A 196 -4.918 -16.139 -1.348 1.00 0.64 H new ATOM 0 HA ASN A 196 -6.499 -16.890 1.019 1.00 0.69 H new ATOM 0 HB2 ASN A 196 -3.594 -17.422 0.273 1.00 0.91 H new ATOM 0 HB3 ASN A 196 -4.367 -17.961 1.750 1.00 0.91 H new ATOM 0 HD21 ASN A 196 -4.373 -20.557 -1.118 1.00 1.99 H new ATOM 0 HD22 ASN A 196 -3.125 -19.432 -0.570 1.00 1.99 H new ATOM 1174 N PHE A 197 -5.833 -14.815 2.231 1.00 0.54 N ATOM 1175 CA PHE A 197 -5.352 -13.765 3.098 1.00 0.53 C ATOM 1176 C PHE A 197 -5.487 -14.168 4.556 1.00 0.56 C ATOM 1177 O PHE A 197 -6.580 -14.305 5.107 1.00 0.68 O ATOM 1178 CB PHE A 197 -6.013 -12.408 2.820 1.00 0.52 C ATOM 1179 CG PHE A 197 -7.415 -12.258 3.304 1.00 1.12 C ATOM 1180 CD1 PHE A 197 -8.433 -13.051 2.805 1.00 1.63 C ATOM 1181 CD2 PHE A 197 -7.707 -11.304 4.256 1.00 1.49 C ATOM 1182 CE1 PHE A 197 -9.729 -12.896 3.258 1.00 2.36 C ATOM 1183 CE2 PHE A 197 -9.000 -11.140 4.716 1.00 2.19 C ATOM 1184 CZ PHE A 197 -10.014 -11.939 4.215 1.00 2.61 C ATOM 0 H PHE A 197 -6.820 -15.049 2.338 1.00 0.54 H new ATOM 0 HA PHE A 197 -4.293 -13.631 2.876 1.00 0.53 H new ATOM 0 HB2 PHE A 197 -5.405 -11.628 3.279 1.00 0.52 H new ATOM 0 HB3 PHE A 197 -5.999 -12.232 1.744 1.00 0.52 H new ATOM 0 HD1 PHE A 197 -8.213 -13.797 2.056 1.00 1.63 H new ATOM 0 HD2 PHE A 197 -6.917 -10.679 4.646 1.00 1.49 H new ATOM 0 HE1 PHE A 197 -10.518 -13.521 2.866 1.00 2.36 H new ATOM 0 HE2 PHE A 197 -9.219 -10.392 5.463 1.00 2.19 H new ATOM 0 HZ PHE A 197 -11.026 -11.815 4.571 1.00 2.61 H new ATOM 1194 N THR A 198 -4.348 -14.419 5.142 1.00 0.55 N ATOM 1195 CA THR A 198 -4.241 -14.687 6.543 1.00 0.60 C ATOM 1196 C THR A 198 -3.659 -13.458 7.219 1.00 0.52 C ATOM 1197 O THR A 198 -3.294 -12.513 6.537 1.00 0.43 O ATOM 1198 CB THR A 198 -3.379 -15.941 6.823 1.00 0.74 C ATOM 1199 OG1 THR A 198 -3.417 -16.278 8.215 1.00 1.12 O ATOM 1200 CG2 THR A 198 -1.938 -15.726 6.395 1.00 0.78 C ATOM 0 H THR A 198 -3.456 -14.442 4.648 1.00 0.55 H new ATOM 0 HA THR A 198 -5.231 -14.900 6.947 1.00 0.60 H new ATOM 0 HB THR A 198 -3.797 -16.762 6.240 1.00 0.74 H new ATOM 0 HG1 THR A 198 -2.868 -17.074 8.374 1.00 1.12 H new ATOM 0 HG21 THR A 198 -1.358 -16.625 6.605 1.00 0.78 H new ATOM 0 HG22 THR A 198 -1.904 -15.513 5.327 1.00 0.78 H new ATOM 0 HG23 THR A 198 -1.516 -14.885 6.946 1.00 0.78 H new ATOM 1208 N GLU A 199 -3.665 -13.435 8.538 1.00 0.59 N ATOM 1209 CA GLU A 199 -3.022 -12.373 9.317 1.00 0.63 C ATOM 1210 C GLU A 199 -1.644 -12.012 8.748 1.00 0.55 C ATOM 1211 O GLU A 199 -1.217 -10.853 8.783 1.00 0.53 O ATOM 1212 CB GLU A 199 -2.902 -12.810 10.778 1.00 0.82 C ATOM 1213 CG GLU A 199 -2.208 -11.798 11.670 1.00 1.14 C ATOM 1214 CD GLU A 199 -2.340 -12.142 13.134 1.00 2.11 C ATOM 1215 OE1 GLU A 199 -1.711 -13.129 13.573 1.00 2.55 O ATOM 1216 OE2 GLU A 199 -3.051 -11.415 13.858 1.00 2.91 O ATOM 0 H GLU A 199 -4.115 -14.150 9.109 1.00 0.59 H new ATOM 0 HA GLU A 199 -3.643 -11.479 9.256 1.00 0.63 H new ATOM 0 HB2 GLU A 199 -3.900 -13.002 11.172 1.00 0.82 H new ATOM 0 HB3 GLU A 199 -2.355 -13.752 10.821 1.00 0.82 H new ATOM 0 HG2 GLU A 199 -1.152 -11.746 11.405 1.00 1.14 H new ATOM 0 HG3 GLU A 199 -2.630 -10.809 11.491 1.00 1.14 H new ATOM 1223 N THR A 200 -0.961 -13.000 8.200 1.00 0.56 N ATOM 1224 CA THR A 200 0.315 -12.763 7.562 1.00 0.57 C ATOM 1225 C THR A 200 0.153 -11.964 6.265 1.00 0.44 C ATOM 1226 O THR A 200 1.039 -11.195 5.897 1.00 0.44 O ATOM 1227 CB THR A 200 1.041 -14.083 7.280 1.00 0.73 C ATOM 1228 OG1 THR A 200 1.018 -14.896 8.461 1.00 0.92 O ATOM 1229 CG2 THR A 200 2.476 -13.815 6.864 1.00 0.99 C ATOM 0 H THR A 200 -1.270 -13.972 8.185 1.00 0.56 H new ATOM 0 HA THR A 200 0.918 -12.173 8.253 1.00 0.57 H new ATOM 0 HB THR A 200 0.536 -14.605 6.467 1.00 0.73 H new ATOM 0 HG1 THR A 200 1.480 -15.742 8.285 1.00 0.92 H new ATOM 0 HG21 THR A 200 2.980 -14.761 6.667 1.00 0.99 H new ATOM 0 HG22 THR A 200 2.485 -13.204 5.962 1.00 0.99 H new ATOM 0 HG23 THR A 200 2.994 -13.288 7.665 1.00 0.99 H new ATOM 1237 N ASP A 201 -0.989 -12.118 5.586 1.00 0.41 N ATOM 1238 CA ASP A 201 -1.244 -11.359 4.363 1.00 0.36 C ATOM 1239 C ASP A 201 -1.565 -9.938 4.679 1.00 0.31 C ATOM 1240 O ASP A 201 -1.381 -9.031 3.868 1.00 0.34 O ATOM 1241 CB ASP A 201 -2.351 -11.926 3.490 1.00 0.45 C ATOM 1242 CG ASP A 201 -1.991 -13.286 2.940 1.00 0.92 C ATOM 1243 OD1 ASP A 201 -1.372 -13.352 1.860 1.00 1.49 O ATOM 1244 OD2 ASP A 201 -2.346 -14.289 3.570 1.00 1.27 O ATOM 0 H ASP A 201 -1.740 -12.752 5.859 1.00 0.41 H new ATOM 0 HA ASP A 201 -0.318 -11.432 3.792 1.00 0.36 H new ATOM 0 HB2 ASP A 201 -3.270 -12.001 4.071 1.00 0.45 H new ATOM 0 HB3 ASP A 201 -2.550 -11.242 2.665 1.00 0.45 H new ATOM 1249 N ILE A 202 -2.028 -9.761 5.869 1.00 0.30 N ATOM 1250 CA ILE A 202 -2.383 -8.471 6.359 1.00 0.32 C ATOM 1251 C ILE A 202 -1.141 -7.626 6.479 1.00 0.31 C ATOM 1252 O ILE A 202 -1.037 -6.576 5.865 1.00 0.34 O ATOM 1253 CB ILE A 202 -3.049 -8.632 7.714 1.00 0.41 C ATOM 1254 CG1 ILE A 202 -3.945 -9.854 7.647 1.00 0.48 C ATOM 1255 CG2 ILE A 202 -3.832 -7.402 8.108 1.00 0.54 C ATOM 1256 CD1 ILE A 202 -5.093 -9.735 6.662 1.00 0.53 C ATOM 0 H ILE A 202 -2.173 -10.517 6.538 1.00 0.30 H new ATOM 0 HA ILE A 202 -3.075 -7.980 5.675 1.00 0.32 H new ATOM 0 HB ILE A 202 -2.287 -8.762 8.482 1.00 0.41 H new ATOM 0 HG12 ILE A 202 -3.339 -10.719 7.378 1.00 0.48 H new ATOM 0 HG13 ILE A 202 -4.352 -10.046 8.640 1.00 0.48 H new ATOM 0 HG21 ILE A 202 -4.292 -7.560 9.083 1.00 0.54 H new ATOM 0 HG22 ILE A 202 -3.161 -6.544 8.158 1.00 0.54 H new ATOM 0 HG23 ILE A 202 -4.609 -7.212 7.367 1.00 0.54 H new ATOM 0 HD11 ILE A 202 -5.683 -10.652 6.678 1.00 0.53 H new ATOM 0 HD12 ILE A 202 -5.725 -8.892 6.940 1.00 0.53 H new ATOM 0 HD13 ILE A 202 -4.697 -9.576 5.659 1.00 0.53 H new ATOM 1268 N LYS A 203 -0.162 -8.140 7.199 1.00 0.32 N ATOM 1269 CA LYS A 203 1.043 -7.384 7.454 1.00 0.35 C ATOM 1270 C LYS A 203 1.776 -7.096 6.174 1.00 0.30 C ATOM 1271 O LYS A 203 1.963 -5.944 5.852 1.00 0.31 O ATOM 1272 CB LYS A 203 1.955 -8.109 8.435 1.00 0.44 C ATOM 1273 CG LYS A 203 2.158 -9.558 8.086 1.00 0.49 C ATOM 1274 CD LYS A 203 3.585 -10.017 8.324 1.00 0.61 C ATOM 1275 CE LYS A 203 4.526 -9.481 7.253 1.00 0.77 C ATOM 1276 NZ LYS A 203 5.912 -9.993 7.434 1.00 1.14 N ATOM 0 H LYS A 203 -0.179 -9.072 7.614 1.00 0.32 H new ATOM 0 HA LYS A 203 0.747 -6.437 7.905 1.00 0.35 H new ATOM 0 HB2 LYS A 203 2.923 -7.608 8.461 1.00 0.44 H new ATOM 0 HB3 LYS A 203 1.532 -8.038 9.437 1.00 0.44 H new ATOM 0 HG2 LYS A 203 1.479 -10.170 8.679 1.00 0.49 H new ATOM 0 HG3 LYS A 203 1.898 -9.716 7.039 1.00 0.49 H new ATOM 0 HD2 LYS A 203 3.918 -9.680 9.305 1.00 0.61 H new ATOM 0 HD3 LYS A 203 3.622 -11.106 8.331 1.00 0.61 H new ATOM 0 HE2 LYS A 203 4.158 -9.767 6.268 1.00 0.77 H new ATOM 0 HE3 LYS A 203 4.533 -8.392 7.286 1.00 0.77 H new ATOM 0 HZ1 LYS A 203 6.387 -10.044 6.510 1.00 1.14 H new ATOM 0 HZ2 LYS A 203 6.440 -9.352 8.060 1.00 1.14 H new ATOM 0 HZ3 LYS A 203 5.879 -10.942 7.859 1.00 1.14 H new ATOM 1290 N ILE A 204 2.157 -8.131 5.425 1.00 0.29 N ATOM 1291 CA ILE A 204 2.871 -7.941 4.178 1.00 0.28 C ATOM 1292 C ILE A 204 2.225 -6.863 3.343 1.00 0.24 C ATOM 1293 O ILE A 204 2.896 -6.018 2.798 1.00 0.27 O ATOM 1294 CB ILE A 204 2.847 -9.214 3.356 1.00 0.28 C ATOM 1295 CG1 ILE A 204 1.438 -9.750 3.420 1.00 0.26 C ATOM 1296 CG2 ILE A 204 3.872 -10.216 3.856 1.00 0.38 C ATOM 1297 CD1 ILE A 204 1.150 -10.931 2.540 1.00 0.28 C ATOM 0 H ILE A 204 1.980 -9.106 5.666 1.00 0.29 H new ATOM 0 HA ILE A 204 3.893 -7.661 4.435 1.00 0.28 H new ATOM 0 HB ILE A 204 3.122 -9.015 2.320 1.00 0.28 H new ATOM 0 HG12 ILE A 204 1.221 -10.027 4.452 1.00 0.26 H new ATOM 0 HG13 ILE A 204 0.751 -8.946 3.155 1.00 0.26 H new ATOM 0 HG21 ILE A 204 3.828 -11.117 3.245 1.00 0.38 H new ATOM 0 HG22 ILE A 204 4.869 -9.781 3.789 1.00 0.38 H new ATOM 0 HG23 ILE A 204 3.656 -10.471 4.894 1.00 0.38 H new ATOM 0 HD11 ILE A 204 0.110 -11.233 2.665 1.00 0.28 H new ATOM 0 HD12 ILE A 204 1.327 -10.661 1.499 1.00 0.28 H new ATOM 0 HD13 ILE A 204 1.804 -11.758 2.816 1.00 0.28 H new ATOM 1309 N MET A 205 0.914 -6.884 3.268 1.00 0.21 N ATOM 1310 CA MET A 205 0.230 -6.012 2.362 1.00 0.23 C ATOM 1311 C MET A 205 -0.015 -4.642 2.951 1.00 0.22 C ATOM 1312 O MET A 205 0.364 -3.640 2.344 1.00 0.22 O ATOM 1313 CB MET A 205 -1.066 -6.639 1.909 1.00 0.29 C ATOM 1314 CG MET A 205 -2.176 -5.634 1.745 1.00 0.29 C ATOM 1315 SD MET A 205 -3.780 -6.360 2.042 1.00 0.41 S ATOM 1316 CE MET A 205 -3.559 -6.744 3.770 1.00 0.35 C ATOM 0 H MET A 205 0.311 -7.492 3.821 1.00 0.21 H new ATOM 0 HA MET A 205 0.879 -5.871 1.498 1.00 0.23 H new ATOM 0 HB2 MET A 205 -0.904 -7.152 0.961 1.00 0.29 H new ATOM 0 HB3 MET A 205 -1.371 -7.395 2.633 1.00 0.29 H new ATOM 0 HG2 MET A 205 -2.020 -4.804 2.435 1.00 0.29 H new ATOM 0 HG3 MET A 205 -2.146 -5.221 0.737 1.00 0.29 H new ATOM 0 HE1 MET A 205 -3.806 -7.791 3.944 1.00 0.35 H new ATOM 0 HE2 MET A 205 -2.522 -6.563 4.053 1.00 0.35 H new ATOM 0 HE3 MET A 205 -4.214 -6.112 4.370 1.00 0.35 H new ATOM 1326 N GLU A 206 -0.653 -4.592 4.119 1.00 0.23 N ATOM 1327 CA GLU A 206 -0.943 -3.320 4.743 1.00 0.25 C ATOM 1328 C GLU A 206 0.344 -2.563 4.900 1.00 0.24 C ATOM 1329 O GLU A 206 0.403 -1.390 4.619 1.00 0.26 O ATOM 1330 CB GLU A 206 -1.590 -3.484 6.111 1.00 0.29 C ATOM 1331 CG GLU A 206 -2.824 -4.364 6.128 1.00 0.37 C ATOM 1332 CD GLU A 206 -3.574 -4.232 7.438 1.00 0.57 C ATOM 1333 OE1 GLU A 206 -2.973 -4.480 8.505 1.00 1.25 O ATOM 1334 OE2 GLU A 206 -4.776 -3.897 7.410 1.00 1.00 O ATOM 0 H GLU A 206 -0.972 -5.409 4.639 1.00 0.23 H new ATOM 0 HA GLU A 206 -1.647 -2.783 4.107 1.00 0.25 H new ATOM 0 HB2 GLU A 206 -0.854 -3.901 6.798 1.00 0.29 H new ATOM 0 HB3 GLU A 206 -1.858 -2.498 6.491 1.00 0.29 H new ATOM 0 HG2 GLU A 206 -3.480 -4.091 5.301 1.00 0.37 H new ATOM 0 HG3 GLU A 206 -2.534 -5.404 5.975 1.00 0.37 H new ATOM 1341 N ARG A 207 1.379 -3.282 5.297 1.00 0.24 N ATOM 1342 CA ARG A 207 2.688 -2.702 5.503 1.00 0.25 C ATOM 1343 C ARG A 207 3.219 -2.077 4.214 1.00 0.26 C ATOM 1344 O ARG A 207 3.576 -0.906 4.202 1.00 0.35 O ATOM 1345 CB ARG A 207 3.651 -3.776 6.016 1.00 0.25 C ATOM 1346 CG ARG A 207 4.416 -4.485 4.917 1.00 0.25 C ATOM 1347 CD ARG A 207 4.974 -5.763 5.408 1.00 0.32 C ATOM 1348 NE ARG A 207 6.045 -5.553 6.375 1.00 0.47 N ATOM 1349 CZ ARG A 207 6.013 -5.959 7.642 1.00 0.69 C ATOM 1350 NH1 ARG A 207 4.881 -6.398 8.177 1.00 0.87 N ATOM 1351 NH2 ARG A 207 7.104 -5.869 8.392 1.00 0.89 N ATOM 0 H ARG A 207 1.333 -4.284 5.485 1.00 0.24 H new ATOM 0 HA ARG A 207 2.606 -1.910 6.247 1.00 0.25 H new ATOM 0 HB2 ARG A 207 4.362 -3.316 6.702 1.00 0.25 H new ATOM 0 HB3 ARG A 207 3.087 -4.513 6.588 1.00 0.25 H new ATOM 0 HG2 ARG A 207 3.756 -4.672 4.070 1.00 0.25 H new ATOM 0 HG3 ARG A 207 5.222 -3.845 4.557 1.00 0.25 H new ATOM 0 HD2 ARG A 207 4.181 -6.353 5.867 1.00 0.32 H new ATOM 0 HD3 ARG A 207 5.354 -6.341 4.565 1.00 0.32 H new ATOM 0 HE ARG A 207 6.879 -5.059 6.057 1.00 0.47 H new ATOM 0 HH11 ARG A 207 4.029 -6.426 7.617 1.00 0.87 H new ATOM 0 HH12 ARG A 207 4.863 -6.708 9.149 1.00 0.87 H new ATOM 0 HH21 ARG A 207 7.964 -5.489 7.997 1.00 0.89 H new ATOM 0 HH22 ARG A 207 7.082 -6.179 9.363 1.00 0.89 H new ATOM 1365 N VAL A 208 3.256 -2.849 3.124 1.00 0.23 N ATOM 1366 CA VAL A 208 3.853 -2.376 1.903 1.00 0.23 C ATOM 1367 C VAL A 208 3.068 -1.205 1.393 1.00 0.25 C ATOM 1368 O VAL A 208 3.621 -0.161 1.064 1.00 0.34 O ATOM 1369 CB VAL A 208 3.922 -3.480 0.818 1.00 0.22 C ATOM 1370 CG1 VAL A 208 4.526 -2.940 -0.437 1.00 0.28 C ATOM 1371 CG2 VAL A 208 4.745 -4.657 1.288 1.00 0.22 C ATOM 0 H VAL A 208 2.879 -3.795 3.076 1.00 0.23 H new ATOM 0 HA VAL A 208 4.878 -2.078 2.123 1.00 0.23 H new ATOM 0 HB VAL A 208 2.902 -3.813 0.625 1.00 0.22 H new ATOM 0 HG11 VAL A 208 4.567 -3.728 -1.189 1.00 0.28 H new ATOM 0 HG12 VAL A 208 3.917 -2.115 -0.808 1.00 0.28 H new ATOM 0 HG13 VAL A 208 5.535 -2.582 -0.231 1.00 0.28 H new ATOM 0 HG21 VAL A 208 4.775 -5.415 0.506 1.00 0.22 H new ATOM 0 HG22 VAL A 208 5.759 -4.326 1.512 1.00 0.22 H new ATOM 0 HG23 VAL A 208 4.295 -5.080 2.186 1.00 0.22 H new ATOM 1381 N VAL A 209 1.774 -1.377 1.403 1.00 0.22 N ATOM 1382 CA VAL A 209 0.873 -0.364 0.955 1.00 0.25 C ATOM 1383 C VAL A 209 0.969 0.880 1.867 1.00 0.27 C ATOM 1384 O VAL A 209 1.046 2.013 1.388 1.00 0.32 O ATOM 1385 CB VAL A 209 -0.553 -0.965 0.880 1.00 0.31 C ATOM 1386 CG1 VAL A 209 -1.518 -0.317 1.844 1.00 1.11 C ATOM 1387 CG2 VAL A 209 -1.075 -0.901 -0.538 1.00 1.19 C ATOM 0 H VAL A 209 1.318 -2.231 1.725 1.00 0.22 H new ATOM 0 HA VAL A 209 1.139 -0.022 -0.045 1.00 0.25 H new ATOM 0 HB VAL A 209 -0.476 -2.009 1.185 1.00 0.31 H new ATOM 0 HG11 VAL A 209 -2.499 -0.781 1.744 1.00 1.11 H new ATOM 0 HG12 VAL A 209 -1.157 -0.449 2.864 1.00 1.11 H new ATOM 0 HG13 VAL A 209 -1.595 0.747 1.621 1.00 1.11 H new ATOM 0 HG21 VAL A 209 -2.078 -1.327 -0.576 1.00 1.19 H new ATOM 0 HG22 VAL A 209 -1.109 0.138 -0.867 1.00 1.19 H new ATOM 0 HG23 VAL A 209 -0.415 -1.468 -1.195 1.00 1.19 H new ATOM 1397 N GLU A 210 1.024 0.643 3.177 1.00 0.26 N ATOM 1398 CA GLU A 210 1.137 1.705 4.181 1.00 0.29 C ATOM 1399 C GLU A 210 2.424 2.509 4.045 1.00 0.29 C ATOM 1400 O GLU A 210 2.381 3.724 3.900 1.00 0.33 O ATOM 1401 CB GLU A 210 1.017 1.114 5.607 1.00 0.31 C ATOM 1402 CG GLU A 210 2.303 1.094 6.426 1.00 0.32 C ATOM 1403 CD GLU A 210 2.117 0.554 7.825 1.00 0.70 C ATOM 1404 OE1 GLU A 210 2.184 -0.676 8.005 1.00 1.19 O ATOM 1405 OE2 GLU A 210 1.933 1.364 8.758 1.00 1.12 O ATOM 0 H GLU A 210 0.991 -0.295 3.576 1.00 0.26 H new ATOM 0 HA GLU A 210 0.313 2.396 4.006 1.00 0.29 H new ATOM 0 HB2 GLU A 210 0.268 1.685 6.155 1.00 0.31 H new ATOM 0 HB3 GLU A 210 0.643 0.093 5.527 1.00 0.31 H new ATOM 0 HG2 GLU A 210 3.046 0.488 5.907 1.00 0.32 H new ATOM 0 HG3 GLU A 210 2.702 2.106 6.486 1.00 0.32 H new ATOM 1412 N GLN A 211 3.570 1.854 4.044 1.00 0.27 N ATOM 1413 CA GLN A 211 4.802 2.587 4.216 1.00 0.31 C ATOM 1414 C GLN A 211 5.226 3.147 2.878 1.00 0.31 C ATOM 1415 O GLN A 211 6.145 3.959 2.770 1.00 0.34 O ATOM 1416 CB GLN A 211 5.901 1.710 4.841 1.00 0.34 C ATOM 1417 CG GLN A 211 6.122 0.366 4.150 1.00 0.39 C ATOM 1418 CD GLN A 211 7.394 -0.320 4.605 1.00 0.97 C ATOM 1419 OE1 GLN A 211 8.374 0.331 4.960 1.00 1.55 O ATOM 1420 NE2 GLN A 211 7.380 -1.644 4.607 1.00 1.56 N ATOM 0 H GLN A 211 3.670 0.845 3.929 1.00 0.27 H new ATOM 0 HA GLN A 211 4.637 3.410 4.912 1.00 0.31 H new ATOM 0 HB2 GLN A 211 6.839 2.266 4.831 1.00 0.34 H new ATOM 0 HB3 GLN A 211 5.650 1.528 5.886 1.00 0.34 H new ATOM 0 HG2 GLN A 211 5.271 -0.285 4.349 1.00 0.39 H new ATOM 0 HG3 GLN A 211 6.161 0.518 3.071 1.00 0.39 H new ATOM 0 HE21 GLN A 211 6.545 -2.146 4.304 1.00 1.56 H new ATOM 0 HE22 GLN A 211 8.204 -2.162 4.911 1.00 1.56 H new ATOM 1429 N MET A 212 4.516 2.707 1.863 1.00 0.30 N ATOM 1430 CA MET A 212 4.707 3.194 0.524 1.00 0.31 C ATOM 1431 C MET A 212 3.817 4.385 0.275 1.00 0.30 C ATOM 1432 O MET A 212 4.204 5.313 -0.412 1.00 0.33 O ATOM 1433 CB MET A 212 4.376 2.096 -0.434 1.00 0.34 C ATOM 1434 CG MET A 212 5.204 2.106 -1.682 1.00 1.17 C ATOM 1435 SD MET A 212 4.672 3.360 -2.851 1.00 1.65 S ATOM 1436 CE MET A 212 2.932 2.953 -2.908 1.00 0.37 C ATOM 0 H MET A 212 3.788 1.998 1.948 1.00 0.30 H new ATOM 0 HA MET A 212 5.743 3.505 0.387 1.00 0.31 H new ATOM 0 HB2 MET A 212 4.507 1.138 0.069 1.00 0.34 H new ATOM 0 HB3 MET A 212 3.324 2.172 -0.708 1.00 0.34 H new ATOM 0 HG2 MET A 212 6.248 2.278 -1.420 1.00 1.17 H new ATOM 0 HG3 MET A 212 5.152 1.126 -2.157 1.00 1.17 H new ATOM 0 HE1 MET A 212 2.613 2.863 -3.946 1.00 0.37 H new ATOM 0 HE2 MET A 212 2.762 2.008 -2.393 1.00 0.37 H new ATOM 0 HE3 MET A 212 2.358 3.740 -2.420 1.00 0.37 H new ATOM 1446 N CYS A 213 2.619 4.348 0.832 1.00 0.28 N ATOM 1447 CA CYS A 213 1.747 5.510 0.837 1.00 0.27 C ATOM 1448 C CYS A 213 2.474 6.651 1.532 1.00 0.25 C ATOM 1449 O CYS A 213 2.355 7.814 1.160 1.00 0.25 O ATOM 1450 CB CYS A 213 0.457 5.170 1.573 1.00 0.36 C ATOM 1451 SG CYS A 213 -0.845 6.440 1.505 1.00 0.42 S ATOM 0 H CYS A 213 2.227 3.524 1.288 1.00 0.28 H new ATOM 0 HA CYS A 213 1.495 5.807 -0.181 1.00 0.27 H new ATOM 0 HB2 CYS A 213 0.058 4.243 1.160 1.00 0.36 H new ATOM 0 HB3 CYS A 213 0.696 4.976 2.619 1.00 0.36 H new ATOM 1456 N ILE A 214 3.246 6.276 2.543 1.00 0.25 N ATOM 1457 CA ILE A 214 4.115 7.194 3.251 1.00 0.27 C ATOM 1458 C ILE A 214 5.246 7.676 2.339 1.00 0.27 C ATOM 1459 O ILE A 214 5.619 8.848 2.352 1.00 0.29 O ATOM 1460 CB ILE A 214 4.688 6.507 4.507 1.00 0.30 C ATOM 1461 CG1 ILE A 214 3.934 6.943 5.763 1.00 0.33 C ATOM 1462 CG2 ILE A 214 6.159 6.795 4.648 1.00 0.31 C ATOM 1463 CD1 ILE A 214 4.378 6.228 7.023 1.00 0.36 C ATOM 0 H ILE A 214 3.284 5.319 2.894 1.00 0.25 H new ATOM 0 HA ILE A 214 3.534 8.064 3.558 1.00 0.27 H new ATOM 0 HB ILE A 214 4.557 5.431 4.389 1.00 0.30 H new ATOM 0 HG12 ILE A 214 4.066 8.016 5.900 1.00 0.33 H new ATOM 0 HG13 ILE A 214 2.868 6.769 5.614 1.00 0.33 H new ATOM 0 HG21 ILE A 214 6.543 6.301 5.541 1.00 0.31 H new ATOM 0 HG22 ILE A 214 6.688 6.422 3.771 1.00 0.31 H new ATOM 0 HG23 ILE A 214 6.312 7.871 4.735 1.00 0.31 H new ATOM 0 HD11 ILE A 214 3.797 6.591 7.871 1.00 0.36 H new ATOM 0 HD12 ILE A 214 4.220 5.156 6.908 1.00 0.36 H new ATOM 0 HD13 ILE A 214 5.436 6.422 7.198 1.00 0.36 H new ATOM 1475 N THR A 215 5.781 6.762 1.544 1.00 0.28 N ATOM 1476 CA THR A 215 6.803 7.104 0.577 1.00 0.30 C ATOM 1477 C THR A 215 6.207 8.018 -0.482 1.00 0.30 C ATOM 1478 O THR A 215 6.813 9.003 -0.899 1.00 0.34 O ATOM 1479 CB THR A 215 7.378 5.841 -0.086 1.00 0.34 C ATOM 1480 OG1 THR A 215 7.896 4.957 0.922 1.00 0.37 O ATOM 1481 CG2 THR A 215 8.474 6.204 -1.076 1.00 0.39 C ATOM 0 H THR A 215 5.521 5.776 1.553 1.00 0.28 H new ATOM 0 HA THR A 215 7.615 7.616 1.093 1.00 0.30 H new ATOM 0 HB THR A 215 6.579 5.338 -0.630 1.00 0.34 H new ATOM 0 HG1 THR A 215 7.163 4.651 1.497 1.00 0.37 H new ATOM 0 HG21 THR A 215 8.867 5.296 -1.533 1.00 0.39 H new ATOM 0 HG22 THR A 215 8.064 6.852 -1.851 1.00 0.39 H new ATOM 0 HG23 THR A 215 9.277 6.724 -0.555 1.00 0.39 H new ATOM 1489 N GLN A 216 5.000 7.691 -0.901 1.00 0.30 N ATOM 1490 CA GLN A 216 4.275 8.529 -1.822 1.00 0.32 C ATOM 1491 C GLN A 216 3.852 9.835 -1.159 1.00 0.30 C ATOM 1492 O GLN A 216 3.577 10.792 -1.839 1.00 0.45 O ATOM 1493 CB GLN A 216 3.073 7.771 -2.396 1.00 0.44 C ATOM 1494 CG GLN A 216 2.440 8.437 -3.612 1.00 1.08 C ATOM 1495 CD GLN A 216 3.392 8.544 -4.781 1.00 1.76 C ATOM 1496 OE1 GLN A 216 4.282 7.715 -4.943 1.00 2.17 O ATOM 1497 NE2 GLN A 216 3.213 9.566 -5.602 1.00 2.60 N ATOM 0 H GLN A 216 4.504 6.847 -0.614 1.00 0.30 H new ATOM 0 HA GLN A 216 4.936 8.789 -2.649 1.00 0.32 H new ATOM 0 HB2 GLN A 216 3.389 6.764 -2.670 1.00 0.44 H new ATOM 0 HB3 GLN A 216 2.317 7.667 -1.618 1.00 0.44 H new ATOM 0 HG2 GLN A 216 1.561 7.869 -3.916 1.00 1.08 H new ATOM 0 HG3 GLN A 216 2.096 9.434 -3.337 1.00 1.08 H new ATOM 0 HE21 GLN A 216 2.460 10.232 -5.430 1.00 2.60 H new ATOM 0 HE22 GLN A 216 3.828 9.687 -6.407 1.00 2.60 H new ATOM 1506 N TYR A 217 3.825 9.885 0.167 1.00 0.27 N ATOM 1507 CA TYR A 217 3.553 11.139 0.875 1.00 0.29 C ATOM 1508 C TYR A 217 4.647 12.153 0.568 1.00 0.30 C ATOM 1509 O TYR A 217 4.365 13.315 0.290 1.00 0.31 O ATOM 1510 CB TYR A 217 3.461 10.892 2.387 1.00 0.37 C ATOM 1511 CG TYR A 217 3.015 12.090 3.203 1.00 0.56 C ATOM 1512 CD1 TYR A 217 3.896 13.120 3.512 1.00 0.80 C ATOM 1513 CD2 TYR A 217 1.712 12.182 3.673 1.00 1.06 C ATOM 1514 CE1 TYR A 217 3.490 14.206 4.263 1.00 0.95 C ATOM 1515 CE2 TYR A 217 1.299 13.263 4.425 1.00 1.26 C ATOM 1516 CZ TYR A 217 2.191 14.274 4.717 1.00 1.04 C ATOM 1517 OH TYR A 217 1.782 15.348 5.475 1.00 1.26 O ATOM 0 H TYR A 217 3.986 9.081 0.774 1.00 0.27 H new ATOM 0 HA TYR A 217 2.597 11.536 0.535 1.00 0.29 H new ATOM 0 HB2 TYR A 217 2.767 10.071 2.565 1.00 0.37 H new ATOM 0 HB3 TYR A 217 4.437 10.568 2.748 1.00 0.37 H new ATOM 0 HD1 TYR A 217 4.915 13.070 3.159 1.00 0.80 H new ATOM 0 HD2 TYR A 217 1.009 11.394 3.446 1.00 1.06 H new ATOM 0 HE1 TYR A 217 4.187 14.998 4.493 1.00 0.95 H new ATOM 0 HE2 TYR A 217 0.282 13.317 4.783 1.00 1.26 H new ATOM 0 HH TYR A 217 2.448 16.064 5.414 1.00 1.26 H new ATOM 1527 N GLN A 218 5.898 11.710 0.601 1.00 0.33 N ATOM 1528 CA GLN A 218 7.007 12.603 0.311 1.00 0.42 C ATOM 1529 C GLN A 218 7.184 12.774 -1.195 1.00 0.46 C ATOM 1530 O GLN A 218 7.589 13.839 -1.660 1.00 0.58 O ATOM 1531 CB GLN A 218 8.304 12.112 0.961 1.00 0.47 C ATOM 1532 CG GLN A 218 8.716 10.709 0.552 1.00 0.63 C ATOM 1533 CD GLN A 218 10.104 10.333 1.031 1.00 1.23 C ATOM 1534 OE1 GLN A 218 10.795 9.541 0.395 1.00 1.83 O ATOM 1535 NE2 GLN A 218 10.521 10.895 2.155 1.00 1.97 N ATOM 0 H GLN A 218 6.165 10.751 0.823 1.00 0.33 H new ATOM 0 HA GLN A 218 6.771 13.577 0.740 1.00 0.42 H new ATOM 0 HB2 GLN A 218 9.108 12.803 0.707 1.00 0.47 H new ATOM 0 HB3 GLN A 218 8.188 12.143 2.044 1.00 0.47 H new ATOM 0 HG2 GLN A 218 7.995 9.995 0.950 1.00 0.63 H new ATOM 0 HG3 GLN A 218 8.679 10.628 -0.534 1.00 0.63 H new ATOM 0 HE21 GLN A 218 9.916 11.548 2.654 1.00 1.97 H new ATOM 0 HE22 GLN A 218 11.447 10.675 2.522 1.00 1.97 H new ATOM 1544 N GLN A 219 6.867 11.734 -1.958 1.00 0.42 N ATOM 1545 CA GLN A 219 6.888 11.836 -3.407 1.00 0.53 C ATOM 1546 C GLN A 219 5.762 12.752 -3.882 1.00 0.51 C ATOM 1547 O GLN A 219 5.939 13.516 -4.823 1.00 0.58 O ATOM 1548 CB GLN A 219 6.792 10.453 -4.065 1.00 0.60 C ATOM 1549 CG GLN A 219 6.676 10.522 -5.580 1.00 0.78 C ATOM 1550 CD GLN A 219 7.098 9.246 -6.286 1.00 0.98 C ATOM 1551 OE1 GLN A 219 7.600 9.290 -7.407 1.00 1.58 O ATOM 1552 NE2 GLN A 219 6.883 8.105 -5.657 1.00 1.70 N ATOM 0 H GLN A 219 6.595 10.819 -1.598 1.00 0.42 H new ATOM 0 HA GLN A 219 7.841 12.271 -3.708 1.00 0.53 H new ATOM 0 HB2 GLN A 219 7.673 9.869 -3.800 1.00 0.60 H new ATOM 0 HB3 GLN A 219 5.927 9.925 -3.664 1.00 0.60 H new ATOM 0 HG2 GLN A 219 5.644 10.749 -5.846 1.00 0.78 H new ATOM 0 HG3 GLN A 219 7.288 11.347 -5.945 1.00 0.78 H new ATOM 0 HE21 GLN A 219 6.464 8.106 -4.727 1.00 1.70 H new ATOM 0 HE22 GLN A 219 7.136 7.222 -6.101 1.00 1.70 H new ATOM 1561 N GLU A 220 4.617 12.680 -3.211 1.00 0.45 N ATOM 1562 CA GLU A 220 3.504 13.587 -3.464 1.00 0.46 C ATOM 1563 C GLU A 220 3.859 14.994 -3.024 1.00 0.46 C ATOM 1564 O GLU A 220 3.483 15.966 -3.667 1.00 0.49 O ATOM 1565 CB GLU A 220 2.243 13.135 -2.726 1.00 0.45 C ATOM 1566 CG GLU A 220 1.408 12.117 -3.480 1.00 0.75 C ATOM 1567 CD GLU A 220 1.187 12.501 -4.928 1.00 1.21 C ATOM 1568 OE1 GLU A 220 0.747 13.642 -5.179 1.00 1.62 O ATOM 1569 OE2 GLU A 220 1.457 11.668 -5.818 1.00 1.74 O ATOM 0 H GLU A 220 4.435 11.993 -2.479 1.00 0.45 H new ATOM 0 HA GLU A 220 3.308 13.575 -4.536 1.00 0.46 H new ATOM 0 HB2 GLU A 220 2.532 12.710 -1.765 1.00 0.45 H new ATOM 0 HB3 GLU A 220 1.626 14.009 -2.516 1.00 0.45 H new ATOM 0 HG2 GLU A 220 1.900 11.146 -3.437 1.00 0.75 H new ATOM 0 HG3 GLU A 220 0.443 12.007 -2.986 1.00 0.75 H new ATOM 1576 N SER A 221 4.581 15.091 -1.915 1.00 0.46 N ATOM 1577 CA SER A 221 5.077 16.369 -1.439 1.00 0.51 C ATOM 1578 C SER A 221 5.874 17.051 -2.549 1.00 0.56 C ATOM 1579 O SER A 221 5.660 18.218 -2.864 1.00 0.63 O ATOM 1580 CB SER A 221 5.955 16.168 -0.198 1.00 0.52 C ATOM 1581 OG SER A 221 6.345 17.408 0.370 1.00 0.74 O ATOM 0 H SER A 221 4.835 14.296 -1.329 1.00 0.46 H new ATOM 0 HA SER A 221 4.234 17.002 -1.164 1.00 0.51 H new ATOM 0 HB2 SER A 221 5.411 15.583 0.543 1.00 0.52 H new ATOM 0 HB3 SER A 221 6.842 15.595 -0.468 1.00 0.52 H new ATOM 0 HG SER A 221 5.549 17.954 0.541 1.00 0.74 H new ATOM 1587 N GLN A 222 6.772 16.292 -3.161 1.00 0.57 N ATOM 1588 CA GLN A 222 7.579 16.795 -4.259 1.00 0.68 C ATOM 1589 C GLN A 222 6.763 16.858 -5.551 1.00 0.69 C ATOM 1590 O GLN A 222 7.051 17.661 -6.433 1.00 0.79 O ATOM 1591 CB GLN A 222 8.821 15.923 -4.432 1.00 0.77 C ATOM 1592 CG GLN A 222 9.015 15.400 -5.843 1.00 1.19 C ATOM 1593 CD GLN A 222 10.348 14.703 -6.042 1.00 1.31 C ATOM 1594 OE1 GLN A 222 10.465 13.794 -6.863 1.00 1.81 O ATOM 1595 NE2 GLN A 222 11.358 15.111 -5.291 1.00 1.52 N ATOM 0 H GLN A 222 6.959 15.321 -2.913 1.00 0.57 H new ATOM 0 HA GLN A 222 7.899 17.810 -4.025 1.00 0.68 H new ATOM 0 HB2 GLN A 222 9.700 16.500 -4.145 1.00 0.77 H new ATOM 0 HB3 GLN A 222 8.757 15.077 -3.747 1.00 0.77 H new ATOM 0 HG2 GLN A 222 8.210 14.705 -6.080 1.00 1.19 H new ATOM 0 HG3 GLN A 222 8.937 16.230 -6.545 1.00 1.19 H new ATOM 0 HE21 GLN A 222 11.222 15.868 -4.621 1.00 1.52 H new ATOM 0 HE22 GLN A 222 12.272 14.668 -5.382 1.00 1.52 H new ATOM 1604 N ALA A 223 5.754 16.006 -5.666 1.00 0.64 N ATOM 1605 CA ALA A 223 4.831 16.074 -6.794 1.00 0.71 C ATOM 1606 C ALA A 223 4.092 17.401 -6.762 1.00 0.71 C ATOM 1607 O ALA A 223 3.836 18.012 -7.800 1.00 0.82 O ATOM 1608 CB ALA A 223 3.853 14.908 -6.775 1.00 0.72 C ATOM 0 H ALA A 223 5.553 15.263 -4.997 1.00 0.64 H new ATOM 0 HA ALA A 223 5.401 16.004 -7.720 1.00 0.71 H new ATOM 0 HB1 ALA A 223 3.178 14.985 -7.627 1.00 0.72 H new ATOM 0 HB2 ALA A 223 4.404 13.970 -6.833 1.00 0.72 H new ATOM 0 HB3 ALA A 223 3.275 14.933 -5.851 1.00 0.72 H new ATOM 1614 N ALA A 224 3.779 17.854 -5.556 1.00 0.65 N ATOM 1615 CA ALA A 224 3.236 19.183 -5.350 1.00 0.72 C ATOM 1616 C ALA A 224 4.255 20.233 -5.773 1.00 0.82 C ATOM 1617 O ALA A 224 3.894 21.311 -6.227 1.00 0.93 O ATOM 1618 CB ALA A 224 2.837 19.378 -3.898 1.00 0.75 C ATOM 0 H ALA A 224 3.895 17.312 -4.700 1.00 0.65 H new ATOM 0 HA ALA A 224 2.343 19.296 -5.964 1.00 0.72 H new ATOM 0 HB1 ALA A 224 2.432 20.381 -3.764 1.00 0.75 H new ATOM 0 HB2 ALA A 224 2.081 18.642 -3.627 1.00 0.75 H new ATOM 0 HB3 ALA A 224 3.712 19.251 -3.260 1.00 0.75 H new ATOM 1624 N TYR A 225 5.531 19.898 -5.627 1.00 0.88 N ATOM 1625 CA TYR A 225 6.618 20.757 -6.082 1.00 1.02 C ATOM 1626 C TYR A 225 6.797 20.671 -7.600 1.00 1.13 C ATOM 1627 O TYR A 225 7.491 21.495 -8.199 1.00 1.30 O ATOM 1628 CB TYR A 225 7.927 20.396 -5.368 1.00 1.02 C ATOM 1629 CG TYR A 225 8.067 21.020 -3.995 1.00 1.29 C ATOM 1630 CD1 TYR A 225 8.601 22.290 -3.837 1.00 1.62 C ATOM 1631 CD2 TYR A 225 7.661 20.336 -2.857 1.00 2.15 C ATOM 1632 CE1 TYR A 225 8.729 22.862 -2.586 1.00 2.22 C ATOM 1633 CE2 TYR A 225 7.784 20.902 -1.602 1.00 2.88 C ATOM 1634 CZ TYR A 225 8.333 22.168 -1.474 1.00 2.75 C ATOM 1635 OH TYR A 225 8.444 22.731 -0.222 1.00 3.57 O ATOM 0 H TYR A 225 5.841 19.029 -5.193 1.00 0.88 H new ATOM 0 HA TYR A 225 6.356 21.785 -5.832 1.00 1.02 H new ATOM 0 HB2 TYR A 225 7.991 19.312 -5.272 1.00 1.02 H new ATOM 0 HB3 TYR A 225 8.767 20.711 -5.987 1.00 1.02 H new ATOM 0 HD1 TYR A 225 8.923 22.842 -4.708 1.00 1.62 H new ATOM 0 HD2 TYR A 225 7.242 19.345 -2.954 1.00 2.15 H new ATOM 0 HE1 TYR A 225 9.141 23.855 -2.485 1.00 2.22 H new ATOM 0 HE2 TYR A 225 7.454 20.361 -0.727 1.00 2.88 H new ATOM 0 HH TYR A 225 8.115 22.099 0.451 1.00 3.57 H new ATOM 1645 N GLN A 226 6.168 19.679 -8.220 1.00 1.09 N ATOM 1646 CA GLN A 226 6.230 19.526 -9.670 1.00 1.27 C ATOM 1647 C GLN A 226 5.041 20.204 -10.333 1.00 1.36 C ATOM 1648 O GLN A 226 5.194 20.892 -11.342 1.00 1.55 O ATOM 1649 CB GLN A 226 6.282 18.050 -10.072 1.00 1.32 C ATOM 1650 CG GLN A 226 7.485 17.304 -9.518 1.00 1.60 C ATOM 1651 CD GLN A 226 7.601 15.887 -10.051 1.00 2.19 C ATOM 1652 OE1 GLN A 226 8.698 15.337 -10.149 1.00 2.87 O ATOM 1653 NE2 GLN A 226 6.476 15.290 -10.416 1.00 2.60 N ATOM 0 H GLN A 226 5.611 18.970 -7.743 1.00 1.09 H new ATOM 0 HA GLN A 226 7.147 20.006 -10.012 1.00 1.27 H new ATOM 0 HB2 GLN A 226 5.372 17.558 -9.729 1.00 1.32 H new ATOM 0 HB3 GLN A 226 6.292 17.980 -11.160 1.00 1.32 H new ATOM 0 HG2 GLN A 226 8.393 17.855 -9.765 1.00 1.60 H new ATOM 0 HG3 GLN A 226 7.417 17.273 -8.431 1.00 1.60 H new ATOM 0 HE21 GLN A 226 5.585 15.778 -10.320 1.00 2.60 H new ATOM 0 HE22 GLN A 226 6.501 14.343 -10.793 1.00 2.60 H new ATOM 1662 N ARG A 227 3.861 20.010 -9.758 1.00 1.25 N ATOM 1663 CA ARG A 227 2.651 20.662 -10.252 1.00 1.35 C ATOM 1664 C ARG A 227 2.692 22.158 -9.930 1.00 1.38 C ATOM 1665 O ARG A 227 1.896 22.941 -10.452 1.00 1.46 O ATOM 1666 CB ARG A 227 1.405 20.035 -9.616 1.00 1.32 C ATOM 1667 CG ARG A 227 1.400 20.158 -8.104 1.00 1.00 C ATOM 1668 CD ARG A 227 0.028 19.893 -7.497 1.00 1.08 C ATOM 1669 NE ARG A 227 -0.122 20.576 -6.211 1.00 1.97 N ATOM 1670 CZ ARG A 227 -1.284 20.793 -5.593 1.00 2.50 C ATOM 1671 NH1 ARG A 227 -2.426 20.339 -6.097 1.00 2.39 N ATOM 1672 NH2 ARG A 227 -1.300 21.476 -4.453 1.00 3.59 N ATOM 0 H ARG A 227 3.714 19.407 -8.949 1.00 1.25 H new ATOM 0 HA ARG A 227 2.603 20.525 -11.332 1.00 1.35 H new ATOM 0 HB2 ARG A 227 0.514 20.516 -10.019 1.00 1.32 H new ATOM 0 HB3 ARG A 227 1.351 18.982 -9.892 1.00 1.32 H new ATOM 0 HG2 ARG A 227 2.120 19.456 -7.684 1.00 1.00 H new ATOM 0 HG3 ARG A 227 1.730 21.158 -7.824 1.00 1.00 H new ATOM 0 HD2 ARG A 227 -0.748 20.231 -8.184 1.00 1.08 H new ATOM 0 HD3 ARG A 227 -0.112 18.821 -7.361 1.00 1.08 H new ATOM 0 HE ARG A 227 0.726 20.911 -5.753 1.00 1.97 H new ATOM 0 HH11 ARG A 227 -2.425 19.814 -6.972 1.00 2.39 H new ATOM 0 HH12 ARG A 227 -3.304 20.515 -5.609 1.00 2.39 H new ATOM 0 HH21 ARG A 227 -0.429 21.829 -4.058 1.00 3.59 H new ATOM 0 HH22 ARG A 227 -2.184 21.647 -3.973 1.00 3.59 H new ATOM 1686 N ALA A 228 3.613 22.535 -9.049 1.00 1.34 N ATOM 1687 CA ALA A 228 3.785 23.921 -8.649 1.00 1.43 C ATOM 1688 C ALA A 228 4.469 24.713 -9.755 1.00 1.64 C ATOM 1689 CB ALA A 228 4.591 24.004 -7.361 1.00 1.40 C ATOM 0 H ALA A 228 4.258 21.888 -8.595 1.00 1.34 H new ATOM 0 HA ALA A 228 2.801 24.355 -8.471 1.00 1.43 H new ATOM 0 HB1 ALA A 228 4.712 25.049 -7.074 1.00 1.40 H new ATOM 0 HB2 ALA A 228 4.068 23.468 -6.569 1.00 1.40 H new ATOM 0 HB3 ALA A 228 5.572 23.555 -7.516 1.00 1.40 H new