USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 805 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 187 HIS : no HE2:sc= -0.524 K(o=-0.31,f=-1.3) USER MOD Set 1.2: A 191 THR OG1 : rot 73:sc= 0.215 USER MOD Set 2.1: A 186 GLN : amide:sc= -0.316 X(o=-0.32,f=-0.23) USER MOD Set 2.2: A 190 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 177 HIS :FLIP no HD1:sc= -0.0188 F(o=-0.91,f=-0.063) USER MOD Set 3.2: A 181 ASN : amide:sc= -0.0438 K(o=-0.063,f=-1.3!) USER MOD Set 4.1: A 138 MET CE :methyl -110:sc= -0.155 (180deg=-1.55) USER MOD Set 4.2: A 154 MET CE :methyl -168:sc= -1.43 (180deg=-1.87!) USER MOD Single : A 128 TYR OH : rot 153:sc= 1.21 USER MOD Single : A 129 MET CE :methyl 156:sc= -3.37! (180deg=-5.12!) USER MOD Single : A 132 SER OG : rot 180:sc= 0.0819 USER MOD Single : A 134 MET CE :methyl -170:sc= 0 (180deg=-0.171) USER MOD Single : A 135 SER OG : rot 180:sc= 0.0901 USER MOD Single : A 140 HIS : no HD1:sc= -0.491 X(o=-0.49,f=-0.31) USER MOD Single : A 143 ASN : amide:sc= 0.734 K(o=0.73,f=-0.11) USER MOD Single : A 149 TYR OH : rot 180:sc= -0.205 USER MOD Single : A 150 TYR OH : rot 176:sc= 0.734 USER MOD Single : A 153 ASN : amide:sc= 0.628 K(o=0.63,f=-3.7!) USER MOD Single : A 155 TYR OH : rot -64:sc= 1.25 USER MOD Single : A 157 TYR OH : rot 37:sc= 1.3 USER MOD Single : A 159 ASN : amide:sc=-0.00382 X(o=-0.0038,f=0) USER MOD Single : A 160 GLN : amide:sc= 0.74 K(o=0.74,f=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= -0.0277 X(o=-0.028,f=0) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc= -1.09 K(o=-1.1,f=-5.5!) USER MOD Single : A 172 GLN : amide:sc= -0.0207 X(o=-0.021,f=-0.1) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 ASN : amide:sc= -1.18 K(o=-1.2,f=-4.2!) USER MOD Single : A 183 THR OG1 : rot 180:sc= 0.475 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 THR OG1 : rot 83:sc= 1.27 USER MOD Single : A 192 THR OG1 : rot 75:sc= 1.15 USER MOD Single : A 193 THR OG1 : rot -44:sc= 0.0105 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0.0182 X(o=0.018,f=0) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.0471 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0.0559 USER MOD Single : A 204 LYS NZ :NH3+ 153:sc= 1.11 (180deg=0.105) USER MOD Single : A 205 MET CE :methyl -156:sc= -0.0314 (180deg=-0.67) USER MOD Single : A 206 MET CE :methyl 172:sc= -0.0346 (180deg=-0.208) USER MOD Single : A 212 GLN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 213 MET CE :methyl 169:sc= -0.5 (180deg=-0.923) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 GLN : amide:sc= -0.585 K(o=-0.58,f=-2.5!) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= -0.598 X(o=-0.6,f=-0.18) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 223 GLN :FLIP amide:sc= -0.332 F(o=-1,f=-0.33) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 9.003 -13.320 -1.633 1.00 0.00 N ATOM 66 CA LEU A 125 9.112 -12.355 -2.705 1.00 0.00 C ATOM 67 C LEU A 125 10.583 -12.285 -3.114 1.00 0.00 C ATOM 68 O LEU A 125 11.466 -12.605 -2.320 1.00 0.00 O ATOM 69 CB LEU A 125 8.565 -11.001 -2.263 1.00 0.00 C ATOM 70 CG LEU A 125 7.155 -10.965 -1.658 1.00 0.00 C ATOM 71 CD1 LEU A 125 7.216 -10.787 -0.134 1.00 0.00 C ATOM 72 CD2 LEU A 125 6.329 -9.812 -2.245 1.00 0.00 C ATOM 0 HA LEU A 125 8.515 -12.655 -3.566 1.00 0.00 H new ATOM 0 HB2 LEU A 125 9.255 -10.583 -1.530 1.00 0.00 H new ATOM 0 HB3 LEU A 125 8.577 -10.336 -3.127 1.00 0.00 H new ATOM 0 HG LEU A 125 6.681 -11.916 -1.901 1.00 0.00 H new ATOM 0 HD11 LEU A 125 6.204 -10.765 0.270 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.765 -11.619 0.308 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.722 -9.851 0.103 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.335 -9.812 -1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.823 -8.864 -2.031 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.241 -9.940 -3.324 1.00 0.00 H new ATOM 84 N GLY A 126 10.883 -11.815 -4.317 1.00 0.00 N ATOM 85 CA GLY A 126 12.212 -11.687 -4.902 1.00 0.00 C ATOM 86 C GLY A 126 13.015 -10.535 -4.316 1.00 0.00 C ATOM 87 O GLY A 126 13.460 -9.645 -5.045 1.00 0.00 O ATOM 0 H GLY A 126 10.155 -11.491 -4.954 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.760 -12.617 -4.751 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.116 -11.544 -5.978 1.00 0.00 H new ATOM 91 N GLY A 127 13.183 -10.545 -2.995 1.00 0.00 N ATOM 92 CA GLY A 127 14.003 -9.559 -2.303 1.00 0.00 C ATOM 93 C GLY A 127 13.249 -8.242 -2.199 1.00 0.00 C ATOM 94 O GLY A 127 13.783 -7.174 -2.505 1.00 0.00 O ATOM 0 H GLY A 127 12.755 -11.235 -2.378 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.260 -9.921 -1.307 1.00 0.00 H new ATOM 0 HA3 GLY A 127 14.940 -9.411 -2.840 1.00 0.00 H new ATOM 98 N TYR A 128 11.974 -8.326 -1.814 1.00 0.00 N ATOM 99 CA TYR A 128 11.182 -7.199 -1.354 1.00 0.00 C ATOM 100 C TYR A 128 11.430 -7.029 0.156 1.00 0.00 C ATOM 101 O TYR A 128 12.129 -7.846 0.765 1.00 0.00 O ATOM 102 CB TYR A 128 9.707 -7.494 -1.680 1.00 0.00 C ATOM 103 CG TYR A 128 9.371 -7.512 -3.162 1.00 0.00 C ATOM 104 CD1 TYR A 128 9.840 -8.551 -3.985 1.00 0.00 C ATOM 105 CD2 TYR A 128 8.544 -6.523 -3.718 1.00 0.00 C ATOM 106 CE1 TYR A 128 9.407 -8.677 -5.311 1.00 0.00 C ATOM 107 CE2 TYR A 128 8.107 -6.627 -5.055 1.00 0.00 C ATOM 108 CZ TYR A 128 8.515 -7.728 -5.846 1.00 0.00 C ATOM 109 OH TYR A 128 8.073 -7.908 -7.118 1.00 0.00 O ATOM 0 H TYR A 128 11.457 -9.205 -1.816 1.00 0.00 H new ATOM 0 HA TYR A 128 11.456 -6.266 -1.846 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.441 -8.460 -1.250 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.085 -6.745 -1.190 1.00 0.00 H new ATOM 0 HD1 TYR A 128 10.547 -9.265 -3.588 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.241 -5.678 -3.118 1.00 0.00 H new ATOM 0 HE1 TYR A 128 9.756 -9.498 -5.920 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.463 -5.869 -5.474 1.00 0.00 H new ATOM 0 HH TYR A 128 7.194 -7.488 -7.221 1.00 0.00 H new ATOM 119 N MET A 129 10.836 -6.020 0.784 1.00 0.00 N ATOM 120 CA MET A 129 10.793 -5.808 2.222 1.00 0.00 C ATOM 121 C MET A 129 9.385 -5.421 2.615 1.00 0.00 C ATOM 122 O MET A 129 8.831 -4.526 1.996 1.00 0.00 O ATOM 123 CB MET A 129 11.744 -4.667 2.659 1.00 0.00 C ATOM 124 CG MET A 129 13.243 -4.982 2.743 1.00 0.00 C ATOM 125 SD MET A 129 13.789 -5.810 4.258 1.00 0.00 S ATOM 126 CE MET A 129 12.912 -7.361 4.022 1.00 0.00 C ATOM 0 H MET A 129 10.344 -5.288 0.272 1.00 0.00 H new ATOM 0 HA MET A 129 11.106 -6.731 2.709 1.00 0.00 H new ATOM 0 HB2 MET A 129 11.614 -3.837 1.964 1.00 0.00 H new ATOM 0 HB3 MET A 129 11.419 -4.316 3.639 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.512 -5.608 1.892 1.00 0.00 H new ATOM 0 HG3 MET A 129 13.798 -4.049 2.641 1.00 0.00 H new ATOM 0 HE1 MET A 129 13.414 -8.151 4.580 1.00 0.00 H new ATOM 0 HE2 MET A 129 11.888 -7.258 4.380 1.00 0.00 H new ATOM 0 HE3 MET A 129 12.902 -7.616 2.962 1.00 0.00 H new ATOM 136 N LEU A 130 8.815 -6.050 3.645 1.00 0.00 N ATOM 137 CA LEU A 130 7.630 -5.520 4.315 1.00 0.00 C ATOM 138 C LEU A 130 8.052 -4.333 5.192 1.00 0.00 C ATOM 139 O LEU A 130 9.145 -4.339 5.766 1.00 0.00 O ATOM 140 CB LEU A 130 6.965 -6.647 5.119 1.00 0.00 C ATOM 141 CG LEU A 130 5.708 -6.231 5.912 1.00 0.00 C ATOM 142 CD1 LEU A 130 4.503 -6.062 4.986 1.00 0.00 C ATOM 143 CD2 LEU A 130 5.360 -7.306 6.941 1.00 0.00 C ATOM 0 H LEU A 130 9.157 -6.929 4.033 1.00 0.00 H new ATOM 0 HA LEU A 130 6.894 -5.156 3.598 1.00 0.00 H new ATOM 0 HB2 LEU A 130 6.694 -7.450 4.434 1.00 0.00 H new ATOM 0 HB3 LEU A 130 7.697 -7.056 5.816 1.00 0.00 H new ATOM 0 HG LEU A 130 5.929 -5.283 6.402 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.632 -5.769 5.572 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.718 -5.292 4.246 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.298 -7.005 4.479 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.472 -7.004 7.496 1.00 0.00 H new ATOM 0 HD22 LEU A 130 5.166 -8.249 6.430 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.194 -7.432 7.631 1.00 0.00 H new ATOM 155 N GLY A 131 7.185 -3.333 5.291 1.00 0.00 N ATOM 156 CA GLY A 131 7.360 -2.072 5.985 1.00 0.00 C ATOM 157 C GLY A 131 6.680 -2.046 7.344 1.00 0.00 C ATOM 158 O GLY A 131 5.999 -2.993 7.745 1.00 0.00 O ATOM 0 H GLY A 131 6.267 -3.392 4.850 1.00 0.00 H new ATOM 0 HA2 GLY A 131 8.425 -1.878 6.113 1.00 0.00 H new ATOM 0 HA3 GLY A 131 6.961 -1.266 5.369 1.00 0.00 H new ATOM 162 N SER A 132 6.860 -0.938 8.058 1.00 0.00 N ATOM 163 CA SER A 132 6.274 -0.746 9.371 1.00 0.00 C ATOM 164 C SER A 132 4.783 -0.442 9.283 1.00 0.00 C ATOM 165 O SER A 132 4.272 0.040 8.274 1.00 0.00 O ATOM 166 CB SER A 132 7.035 0.343 10.138 1.00 0.00 C ATOM 167 OG SER A 132 7.625 1.336 9.308 1.00 0.00 O ATOM 0 H SER A 132 7.419 -0.148 7.736 1.00 0.00 H new ATOM 0 HA SER A 132 6.368 -1.679 9.927 1.00 0.00 H new ATOM 0 HB2 SER A 132 6.350 0.827 10.834 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.817 -0.127 10.735 1.00 0.00 H new ATOM 0 HG SER A 132 8.090 1.995 9.866 1.00 0.00 H new ATOM 173 N ALA A 133 4.071 -0.732 10.366 1.00 0.00 N ATOM 174 CA ALA A 133 2.637 -0.553 10.474 1.00 0.00 C ATOM 175 C ALA A 133 2.275 0.927 10.498 1.00 0.00 C ATOM 176 O ALA A 133 2.581 1.607 11.479 1.00 0.00 O ATOM 177 CB ALA A 133 2.199 -1.258 11.750 1.00 0.00 C ATOM 0 H ALA A 133 4.492 -1.109 11.215 1.00 0.00 H new ATOM 0 HA ALA A 133 2.123 -0.978 9.612 1.00 0.00 H new ATOM 0 HB1 ALA A 133 1.122 -1.150 11.874 1.00 0.00 H new ATOM 0 HB2 ALA A 133 2.452 -2.316 11.686 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.709 -0.814 12.605 1.00 0.00 H new ATOM 183 N MET A 134 1.656 1.413 9.423 1.00 0.00 N ATOM 184 CA MET A 134 1.243 2.798 9.260 1.00 0.00 C ATOM 185 C MET A 134 -0.262 2.979 9.508 1.00 0.00 C ATOM 186 O MET A 134 -0.884 2.222 10.262 1.00 0.00 O ATOM 187 CB MET A 134 1.772 3.352 7.919 1.00 0.00 C ATOM 188 CG MET A 134 3.277 3.101 7.716 1.00 0.00 C ATOM 189 SD MET A 134 4.172 4.369 6.767 1.00 0.00 S ATOM 190 CE MET A 134 3.706 3.869 5.089 1.00 0.00 C ATOM 0 H MET A 134 1.423 0.831 8.618 1.00 0.00 H new ATOM 0 HA MET A 134 1.702 3.416 10.032 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.219 2.893 7.099 1.00 0.00 H new ATOM 0 HB3 MET A 134 1.579 4.424 7.873 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.746 3.009 8.696 1.00 0.00 H new ATOM 0 HG3 MET A 134 3.401 2.142 7.212 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.303 4.423 4.365 1.00 0.00 H new ATOM 0 HE2 MET A 134 3.885 2.801 4.965 1.00 0.00 H new ATOM 0 HE3 MET A 134 2.649 4.082 4.926 1.00 0.00 H new ATOM 200 N SER A 135 -0.856 4.016 8.921 1.00 0.00 N ATOM 201 CA SER A 135 -2.243 4.409 9.105 1.00 0.00 C ATOM 202 C SER A 135 -2.890 4.635 7.735 1.00 0.00 C ATOM 203 O SER A 135 -2.300 4.340 6.688 1.00 0.00 O ATOM 204 CB SER A 135 -2.272 5.638 10.026 1.00 0.00 C ATOM 205 OG SER A 135 -3.585 5.932 10.471 1.00 0.00 O ATOM 0 H SER A 135 -0.358 4.630 8.276 1.00 0.00 H new ATOM 0 HA SER A 135 -2.833 3.631 9.589 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.627 5.462 10.887 1.00 0.00 H new ATOM 0 HB3 SER A 135 -1.867 6.499 9.495 1.00 0.00 H new ATOM 0 HG SER A 135 -3.564 6.718 11.056 1.00 0.00 H new ATOM 211 N ARG A 136 -4.123 5.139 7.721 1.00 0.00 N ATOM 212 CA ARG A 136 -4.908 5.361 6.513 1.00 0.00 C ATOM 213 C ARG A 136 -4.716 6.797 5.990 1.00 0.00 C ATOM 214 O ARG A 136 -5.152 7.732 6.664 1.00 0.00 O ATOM 215 CB ARG A 136 -6.382 5.029 6.792 1.00 0.00 C ATOM 216 CG ARG A 136 -7.012 5.820 7.952 1.00 0.00 C ATOM 217 CD ARG A 136 -7.582 4.974 9.094 1.00 0.00 C ATOM 218 NE ARG A 136 -6.636 3.989 9.626 1.00 0.00 N ATOM 219 CZ ARG A 136 -6.869 3.232 10.699 1.00 0.00 C ATOM 220 NH1 ARG A 136 -7.742 3.578 11.640 1.00 0.00 N ATOM 221 NH2 ARG A 136 -6.245 2.072 10.798 1.00 0.00 N ATOM 0 H ARG A 136 -4.614 5.410 8.573 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.559 4.696 5.723 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.960 5.216 5.887 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -6.465 3.964 7.009 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.258 6.492 8.362 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -7.811 6.444 7.552 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -7.897 5.635 9.901 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -8.473 4.455 8.740 1.00 0.00 H new ATOM 0 HE ARG A 136 -5.743 3.875 9.145 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -8.263 4.451 11.556 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -7.891 2.970 12.446 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -5.603 1.774 10.064 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.406 1.474 11.609 1.00 0.00 H new ATOM 235 N PRO A 137 -4.115 7.023 4.810 1.00 0.00 N ATOM 236 CA PRO A 137 -4.073 8.348 4.183 1.00 0.00 C ATOM 237 C PRO A 137 -5.495 8.846 3.856 1.00 0.00 C ATOM 238 O PRO A 137 -6.434 8.050 3.802 1.00 0.00 O ATOM 239 CB PRO A 137 -3.186 8.180 2.940 1.00 0.00 C ATOM 240 CG PRO A 137 -3.187 6.680 2.648 1.00 0.00 C ATOM 241 CD PRO A 137 -3.472 6.019 3.984 1.00 0.00 C ATOM 0 HA PRO A 137 -3.659 9.112 4.841 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.580 8.746 2.096 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.176 8.545 3.125 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -3.947 6.422 1.910 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.228 6.356 2.244 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.117 5.150 3.857 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.550 5.667 4.447 1.00 0.00 H new ATOM 249 N MET A 138 -5.690 10.148 3.639 1.00 0.00 N ATOM 250 CA MET A 138 -6.952 10.702 3.143 1.00 0.00 C ATOM 251 C MET A 138 -6.926 10.688 1.618 1.00 0.00 C ATOM 252 O MET A 138 -5.912 11.066 1.027 1.00 0.00 O ATOM 253 CB MET A 138 -7.140 12.128 3.682 1.00 0.00 C ATOM 254 CG MET A 138 -8.126 12.206 4.853 1.00 0.00 C ATOM 255 SD MET A 138 -7.962 11.008 6.215 1.00 0.00 S ATOM 256 CE MET A 138 -9.257 9.797 5.825 1.00 0.00 C ATOM 0 H MET A 138 -4.972 10.853 3.804 1.00 0.00 H new ATOM 0 HA MET A 138 -7.793 10.100 3.488 1.00 0.00 H new ATOM 0 HB2 MET A 138 -6.174 12.519 4.002 1.00 0.00 H new ATOM 0 HB3 MET A 138 -7.492 12.771 2.875 1.00 0.00 H new ATOM 0 HG2 MET A 138 -8.052 13.206 5.281 1.00 0.00 H new ATOM 0 HG3 MET A 138 -9.132 12.107 4.445 1.00 0.00 H new ATOM 0 HE1 MET A 138 -10.062 9.877 6.555 1.00 0.00 H new ATOM 0 HE2 MET A 138 -9.651 9.994 4.828 1.00 0.00 H new ATOM 0 HE3 MET A 138 -8.837 8.792 5.857 1.00 0.00 H new ATOM 266 N ILE A 139 -8.022 10.265 0.981 1.00 0.00 N ATOM 267 CA ILE A 139 -8.099 10.042 -0.460 1.00 0.00 C ATOM 268 C ILE A 139 -9.418 10.635 -0.945 1.00 0.00 C ATOM 269 O ILE A 139 -10.487 10.094 -0.662 1.00 0.00 O ATOM 270 CB ILE A 139 -7.949 8.550 -0.817 1.00 0.00 C ATOM 271 CG1 ILE A 139 -6.772 7.929 -0.031 1.00 0.00 C ATOM 272 CG2 ILE A 139 -7.758 8.426 -2.341 1.00 0.00 C ATOM 273 CD1 ILE A 139 -6.291 6.602 -0.590 1.00 0.00 C ATOM 0 H ILE A 139 -8.897 10.065 1.466 1.00 0.00 H new ATOM 0 HA ILE A 139 -7.270 10.536 -0.967 1.00 0.00 H new ATOM 0 HB ILE A 139 -8.845 7.998 -0.534 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -5.940 8.633 -0.026 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -7.075 7.787 1.006 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -7.650 7.375 -2.610 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -8.625 8.844 -2.852 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -6.863 8.971 -2.641 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.464 6.230 0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -7.108 5.881 -0.570 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.955 6.740 -1.618 1.00 0.00 H new ATOM 285 N HIS A 140 -9.329 11.763 -1.641 1.00 0.00 N ATOM 286 CA HIS A 140 -10.470 12.559 -2.080 1.00 0.00 C ATOM 287 C HIS A 140 -10.717 12.347 -3.574 1.00 0.00 C ATOM 288 O HIS A 140 -10.365 13.165 -4.429 1.00 0.00 O ATOM 289 CB HIS A 140 -10.342 14.019 -1.618 1.00 0.00 C ATOM 290 CG HIS A 140 -9.395 14.932 -2.362 1.00 0.00 C ATOM 291 ND1 HIS A 140 -9.606 16.277 -2.539 1.00 0.00 N ATOM 292 CD2 HIS A 140 -8.217 14.620 -2.991 1.00 0.00 C ATOM 293 CE1 HIS A 140 -8.595 16.769 -3.262 1.00 0.00 C ATOM 294 NE2 HIS A 140 -7.719 15.797 -3.566 1.00 0.00 N ATOM 0 H HIS A 140 -8.434 12.161 -1.924 1.00 0.00 H new ATOM 0 HA HIS A 140 -11.382 12.214 -1.593 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -11.335 14.467 -1.659 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -10.039 14.010 -0.571 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -7.757 13.644 -3.035 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -8.496 17.802 -3.560 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -6.861 15.896 -4.108 1.00 0.00 H new ATOM 302 N PHE A 141 -11.290 11.186 -3.895 1.00 0.00 N ATOM 303 CA PHE A 141 -11.547 10.753 -5.266 1.00 0.00 C ATOM 304 C PHE A 141 -12.308 11.833 -6.032 1.00 0.00 C ATOM 305 O PHE A 141 -11.817 12.371 -7.022 1.00 0.00 O ATOM 306 CB PHE A 141 -12.350 9.449 -5.258 1.00 0.00 C ATOM 307 CG PHE A 141 -11.609 8.243 -4.720 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.444 8.069 -3.332 1.00 0.00 C ATOM 309 CD2 PHE A 141 -11.104 7.279 -5.613 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.727 6.969 -2.841 1.00 0.00 C ATOM 311 CE2 PHE A 141 -10.399 6.169 -5.121 1.00 0.00 C ATOM 312 CZ PHE A 141 -10.187 6.028 -3.738 1.00 0.00 C ATOM 0 H PHE A 141 -11.593 10.509 -3.195 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.593 10.582 -5.764 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -13.251 9.598 -4.662 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.673 9.233 -6.276 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.871 8.784 -2.645 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.259 7.393 -6.676 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.589 6.844 -1.777 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -10.020 5.424 -5.804 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.609 5.196 -3.363 1.00 0.00 H new ATOM 322 N GLY A 142 -13.496 12.181 -5.546 1.00 0.00 N ATOM 323 CA GLY A 142 -14.341 13.243 -6.059 1.00 0.00 C ATOM 324 C GLY A 142 -15.793 12.841 -5.889 1.00 0.00 C ATOM 325 O GLY A 142 -16.612 13.662 -5.481 1.00 0.00 O ATOM 0 H GLY A 142 -13.911 11.704 -4.745 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -14.143 14.173 -5.526 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.121 13.425 -7.111 1.00 0.00 H new ATOM 329 N ASN A 143 -16.115 11.563 -6.121 1.00 0.00 N ATOM 330 CA ASN A 143 -17.447 11.066 -5.846 1.00 0.00 C ATOM 331 C ASN A 143 -17.678 11.118 -4.352 1.00 0.00 C ATOM 332 O ASN A 143 -16.862 10.606 -3.581 1.00 0.00 O ATOM 333 CB ASN A 143 -17.630 9.613 -6.257 1.00 0.00 C ATOM 334 CG ASN A 143 -17.435 9.364 -7.732 1.00 0.00 C ATOM 335 OD1 ASN A 143 -18.350 9.488 -8.542 1.00 0.00 O ATOM 336 ND2 ASN A 143 -16.238 8.976 -8.113 1.00 0.00 N ATOM 0 H ASN A 143 -15.470 10.867 -6.496 1.00 0.00 H new ATOM 0 HA ASN A 143 -18.142 11.686 -6.412 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -16.926 8.997 -5.699 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.631 9.289 -5.973 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -16.057 8.772 -9.096 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -15.491 8.879 -7.426 1.00 0.00 H new ATOM 343 N ASP A 144 -18.840 11.629 -3.965 1.00 0.00 N ATOM 344 CA ASP A 144 -19.250 11.675 -2.567 1.00 0.00 C ATOM 345 C ASP A 144 -19.479 10.267 -2.000 1.00 0.00 C ATOM 346 O ASP A 144 -19.440 10.071 -0.785 1.00 0.00 O ATOM 347 CB ASP A 144 -20.523 12.519 -2.462 1.00 0.00 C ATOM 348 CG ASP A 144 -20.620 13.200 -1.106 1.00 0.00 C ATOM 349 OD1 ASP A 144 -20.014 14.288 -0.961 1.00 0.00 O ATOM 350 OD2 ASP A 144 -21.326 12.694 -0.209 1.00 0.00 O ATOM 0 H ASP A 144 -19.524 12.023 -4.611 1.00 0.00 H new ATOM 0 HA ASP A 144 -18.455 12.127 -1.974 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.530 13.271 -3.251 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -21.396 11.886 -2.617 1.00 0.00 H new ATOM 355 N TRP A 145 -19.697 9.267 -2.871 1.00 0.00 N ATOM 356 CA TRP A 145 -19.801 7.870 -2.467 1.00 0.00 C ATOM 357 C TRP A 145 -18.419 7.255 -2.313 1.00 0.00 C ATOM 358 O TRP A 145 -18.254 6.446 -1.409 1.00 0.00 O ATOM 359 CB TRP A 145 -20.707 7.064 -3.407 1.00 0.00 C ATOM 360 CG TRP A 145 -20.351 7.062 -4.859 1.00 0.00 C ATOM 361 CD1 TRP A 145 -20.789 7.956 -5.769 1.00 0.00 C ATOM 362 CD2 TRP A 145 -19.469 6.156 -5.583 1.00 0.00 C ATOM 363 NE1 TRP A 145 -20.239 7.665 -7.002 1.00 0.00 N ATOM 364 CE2 TRP A 145 -19.385 6.587 -6.940 1.00 0.00 C ATOM 365 CE3 TRP A 145 -18.693 5.044 -5.209 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -18.533 5.979 -7.873 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -17.859 4.411 -6.146 1.00 0.00 C ATOM 368 CH2 TRP A 145 -17.756 4.884 -7.465 1.00 0.00 C ATOM 0 H TRP A 145 -19.805 9.413 -3.875 1.00 0.00 H new ATOM 0 HA TRP A 145 -20.284 7.835 -1.490 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.720 6.031 -3.060 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -21.723 7.446 -3.308 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -21.465 8.773 -5.565 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -20.441 8.186 -7.855 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.739 4.674 -4.195 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -18.476 6.347 -8.887 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -17.287 3.545 -5.847 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -17.082 4.407 -8.161 1.00 0.00 H new ATOM 379 N GLU A 146 -17.427 7.629 -3.128 1.00 0.00 N ATOM 380 CA GLU A 146 -16.083 7.079 -2.957 1.00 0.00 C ATOM 381 C GLU A 146 -15.440 7.539 -1.657 1.00 0.00 C ATOM 382 O GLU A 146 -14.919 6.698 -0.935 1.00 0.00 O ATOM 383 CB GLU A 146 -15.178 7.400 -4.148 1.00 0.00 C ATOM 384 CG GLU A 146 -15.596 6.522 -5.326 1.00 0.00 C ATOM 385 CD GLU A 146 -14.570 6.461 -6.441 1.00 0.00 C ATOM 386 OE1 GLU A 146 -14.232 7.541 -6.979 1.00 0.00 O ATOM 387 OE2 GLU A 146 -14.166 5.336 -6.825 1.00 0.00 O ATOM 0 H GLU A 146 -17.527 8.294 -3.895 1.00 0.00 H new ATOM 0 HA GLU A 146 -16.199 5.996 -2.907 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.261 8.454 -4.413 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.135 7.217 -3.891 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.785 5.511 -4.964 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.536 6.897 -5.731 1.00 0.00 H new ATOM 394 N ASP A 147 -15.476 8.838 -1.341 1.00 0.00 N ATOM 395 CA ASP A 147 -14.838 9.371 -0.123 1.00 0.00 C ATOM 396 C ASP A 147 -15.448 8.706 1.122 1.00 0.00 C ATOM 397 O ASP A 147 -14.738 8.252 2.022 1.00 0.00 O ATOM 398 CB ASP A 147 -15.041 10.893 -0.056 1.00 0.00 C ATOM 399 CG ASP A 147 -13.937 11.653 0.699 1.00 0.00 C ATOM 400 OD1 ASP A 147 -13.725 11.439 1.914 1.00 0.00 O ATOM 401 OD2 ASP A 147 -13.341 12.566 0.072 1.00 0.00 O ATOM 0 H ASP A 147 -15.941 9.545 -1.911 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.770 9.153 -0.153 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -15.103 11.283 -1.072 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.998 11.098 0.423 1.00 0.00 H new ATOM 406 N ARG A 148 -16.785 8.574 1.134 1.00 0.00 N ATOM 407 CA ARG A 148 -17.517 7.838 2.159 1.00 0.00 C ATOM 408 C ARG A 148 -17.055 6.386 2.178 1.00 0.00 C ATOM 409 O ARG A 148 -16.636 5.921 3.229 1.00 0.00 O ATOM 410 CB ARG A 148 -19.032 7.932 1.902 1.00 0.00 C ATOM 411 CG ARG A 148 -19.831 7.035 2.867 1.00 0.00 C ATOM 412 CD ARG A 148 -21.241 6.760 2.359 1.00 0.00 C ATOM 413 NE ARG A 148 -22.243 7.709 2.846 1.00 0.00 N ATOM 414 CZ ARG A 148 -23.546 7.586 2.563 1.00 0.00 C ATOM 415 NH1 ARG A 148 -23.971 6.703 1.664 1.00 0.00 N ATOM 416 NH2 ARG A 148 -24.428 8.342 3.194 1.00 0.00 N ATOM 0 H ARG A 148 -17.388 8.983 0.420 1.00 0.00 H new ATOM 0 HA ARG A 148 -17.313 8.279 3.135 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.357 8.967 2.014 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.245 7.641 0.874 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.304 6.090 3.003 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -19.885 7.513 3.845 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.234 6.781 1.269 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.534 5.753 2.657 1.00 0.00 H new ATOM 0 HE ARG A 148 -21.938 8.493 3.422 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -23.301 6.107 1.178 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -24.967 6.622 1.460 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -24.115 9.016 3.893 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -25.422 8.252 2.982 1.00 0.00 H new ATOM 430 N TYR A 149 -17.207 5.647 1.077 1.00 0.00 N ATOM 431 CA TYR A 149 -16.939 4.212 1.031 1.00 0.00 C ATOM 432 C TYR A 149 -15.519 3.927 1.517 1.00 0.00 C ATOM 433 O TYR A 149 -15.285 2.977 2.266 1.00 0.00 O ATOM 434 CB TYR A 149 -17.143 3.699 -0.403 1.00 0.00 C ATOM 435 CG TYR A 149 -16.776 2.241 -0.607 1.00 0.00 C ATOM 436 CD1 TYR A 149 -15.424 1.850 -0.615 1.00 0.00 C ATOM 437 CD2 TYR A 149 -17.773 1.272 -0.814 1.00 0.00 C ATOM 438 CE1 TYR A 149 -15.070 0.498 -0.700 1.00 0.00 C ATOM 439 CE2 TYR A 149 -17.418 -0.081 -0.950 1.00 0.00 C ATOM 440 CZ TYR A 149 -16.070 -0.479 -0.839 1.00 0.00 C ATOM 441 OH TYR A 149 -15.737 -1.794 -0.835 1.00 0.00 O ATOM 0 H TYR A 149 -17.522 6.033 0.187 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.632 3.690 1.691 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.188 3.840 -0.681 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.547 4.309 -1.082 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -14.651 2.601 -0.555 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -18.811 1.567 -0.868 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -14.031 0.207 -0.659 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -18.182 -0.820 -1.141 1.00 0.00 H new ATOM 0 HH TYR A 149 -16.546 -2.337 -0.940 1.00 0.00 H new ATOM 451 N TYR A 150 -14.567 4.752 1.078 1.00 0.00 N ATOM 452 CA TYR A 150 -13.193 4.706 1.518 1.00 0.00 C ATOM 453 C TYR A 150 -13.149 4.801 3.043 1.00 0.00 C ATOM 454 O TYR A 150 -12.611 3.914 3.713 1.00 0.00 O ATOM 455 CB TYR A 150 -12.403 5.841 0.851 1.00 0.00 C ATOM 456 CG TYR A 150 -10.992 5.894 1.369 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.169 4.766 1.215 1.00 0.00 C ATOM 458 CD2 TYR A 150 -10.566 6.992 2.135 1.00 0.00 C ATOM 459 CE1 TYR A 150 -8.946 4.692 1.893 1.00 0.00 C ATOM 460 CE2 TYR A 150 -9.331 6.937 2.795 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.539 5.772 2.703 1.00 0.00 C ATOM 462 OH TYR A 150 -7.396 5.681 3.422 1.00 0.00 O ATOM 0 H TYR A 150 -14.746 5.484 0.391 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.731 3.763 1.226 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.392 5.695 -0.229 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -12.899 6.793 1.039 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.480 3.955 0.573 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.186 7.873 2.215 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.321 3.817 1.796 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -8.986 7.783 3.372 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.226 6.533 3.875 1.00 0.00 H new ATOM 472 N ARG A 151 -13.756 5.848 3.609 1.00 0.00 N ATOM 473 CA ARG A 151 -13.821 6.008 5.056 1.00 0.00 C ATOM 474 C ARG A 151 -14.547 4.856 5.760 1.00 0.00 C ATOM 475 O ARG A 151 -14.143 4.514 6.867 1.00 0.00 O ATOM 476 CB ARG A 151 -14.449 7.365 5.405 1.00 0.00 C ATOM 477 CG ARG A 151 -13.495 8.532 5.113 1.00 0.00 C ATOM 478 CD ARG A 151 -14.213 9.868 5.304 1.00 0.00 C ATOM 479 NE ARG A 151 -13.279 10.997 5.220 1.00 0.00 N ATOM 480 CZ ARG A 151 -12.525 11.485 6.213 1.00 0.00 C ATOM 481 NH1 ARG A 151 -12.512 10.931 7.425 1.00 0.00 N ATOM 482 NH2 ARG A 151 -11.744 12.532 5.987 1.00 0.00 N ATOM 0 H ARG A 151 -14.208 6.596 3.083 1.00 0.00 H new ATOM 0 HA ARG A 151 -12.798 5.981 5.430 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.368 7.497 4.834 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -14.724 7.377 6.460 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -12.631 8.478 5.775 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.119 8.456 4.093 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -14.988 9.978 4.545 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -14.712 9.879 6.273 1.00 0.00 H new ATOM 0 HE ARG A 151 -13.196 11.456 4.313 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -13.088 10.111 7.617 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -11.926 11.327 8.160 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -11.720 12.960 5.062 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -11.167 12.909 6.739 1.00 0.00 H new ATOM 496 N GLU A 152 -15.546 4.225 5.143 1.00 0.00 N ATOM 497 CA GLU A 152 -16.311 3.124 5.726 1.00 0.00 C ATOM 498 C GLU A 152 -15.458 1.857 5.896 1.00 0.00 C ATOM 499 O GLU A 152 -15.869 0.956 6.632 1.00 0.00 O ATOM 500 CB GLU A 152 -17.546 2.805 4.866 1.00 0.00 C ATOM 501 CG GLU A 152 -18.640 3.886 4.914 1.00 0.00 C ATOM 502 CD GLU A 152 -19.761 3.680 5.943 1.00 0.00 C ATOM 503 OE1 GLU A 152 -20.040 2.532 6.374 1.00 0.00 O ATOM 504 OE2 GLU A 152 -20.433 4.679 6.289 1.00 0.00 O ATOM 0 H GLU A 152 -15.853 4.471 4.202 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.633 3.449 6.715 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.230 2.668 3.832 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -17.971 1.858 5.197 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.163 4.845 5.116 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -19.093 3.957 3.925 1.00 0.00 H new ATOM 511 N ASN A 153 -14.305 1.738 5.225 1.00 0.00 N ATOM 512 CA ASN A 153 -13.492 0.513 5.202 1.00 0.00 C ATOM 513 C ASN A 153 -12.020 0.773 5.520 1.00 0.00 C ATOM 514 O ASN A 153 -11.227 -0.166 5.510 1.00 0.00 O ATOM 515 CB ASN A 153 -13.631 -0.183 3.839 1.00 0.00 C ATOM 516 CG ASN A 153 -15.025 -0.749 3.627 1.00 0.00 C ATOM 517 OD1 ASN A 153 -15.423 -1.722 4.274 1.00 0.00 O ATOM 518 ND2 ASN A 153 -15.826 -0.112 2.789 1.00 0.00 N ATOM 0 H ASN A 153 -13.905 2.499 4.676 1.00 0.00 H new ATOM 0 HA ASN A 153 -13.871 -0.140 5.988 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -13.404 0.528 3.044 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -12.899 -0.987 3.766 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -16.790 -0.423 2.669 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -15.480 0.690 2.263 1.00 0.00 H new ATOM 525 N MET A 154 -11.652 2.013 5.865 1.00 0.00 N ATOM 526 CA MET A 154 -10.276 2.477 6.064 1.00 0.00 C ATOM 527 C MET A 154 -9.424 1.605 7.003 1.00 0.00 C ATOM 528 O MET A 154 -8.195 1.648 6.932 1.00 0.00 O ATOM 529 CB MET A 154 -10.301 3.935 6.557 1.00 0.00 C ATOM 530 CG MET A 154 -10.973 4.121 7.933 1.00 0.00 C ATOM 531 SD MET A 154 -10.758 5.739 8.741 1.00 0.00 S ATOM 532 CE MET A 154 -11.156 6.886 7.410 1.00 0.00 C ATOM 0 H MET A 154 -12.337 2.753 6.020 1.00 0.00 H new ATOM 0 HA MET A 154 -9.786 2.399 5.094 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.278 4.307 6.611 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.825 4.547 5.823 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.041 3.939 7.816 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.590 3.353 8.605 1.00 0.00 H new ATOM 0 HE1 MET A 154 -10.862 7.895 7.699 1.00 0.00 H new ATOM 0 HE2 MET A 154 -10.619 6.596 6.507 1.00 0.00 H new ATOM 0 HE3 MET A 154 -12.229 6.862 7.218 1.00 0.00 H new ATOM 542 N TYR A 155 -10.069 0.855 7.895 1.00 0.00 N ATOM 543 CA TYR A 155 -9.470 0.003 8.907 1.00 0.00 C ATOM 544 C TYR A 155 -9.206 -1.431 8.402 1.00 0.00 C ATOM 545 O TYR A 155 -8.283 -2.085 8.900 1.00 0.00 O ATOM 546 CB TYR A 155 -10.370 0.057 10.161 1.00 0.00 C ATOM 547 CG TYR A 155 -11.855 0.349 9.935 1.00 0.00 C ATOM 548 CD1 TYR A 155 -12.696 -0.611 9.343 1.00 0.00 C ATOM 549 CD2 TYR A 155 -12.390 1.607 10.280 1.00 0.00 C ATOM 550 CE1 TYR A 155 -14.062 -0.348 9.139 1.00 0.00 C ATOM 551 CE2 TYR A 155 -13.754 1.883 10.068 1.00 0.00 C ATOM 552 CZ TYR A 155 -14.601 0.901 9.514 1.00 0.00 C ATOM 553 OH TYR A 155 -15.920 1.174 9.315 1.00 0.00 O ATOM 0 H TYR A 155 -11.088 0.828 7.928 1.00 0.00 H new ATOM 0 HA TYR A 155 -8.477 0.374 9.163 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -10.287 -0.898 10.679 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -9.973 0.819 10.831 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -12.286 -1.564 9.041 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -11.750 2.363 10.709 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -14.698 -1.101 8.696 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -14.154 2.851 10.331 1.00 0.00 H new ATOM 0 HH TYR A 155 -16.112 1.176 8.354 1.00 0.00 H new ATOM 563 N ARG A 156 -9.944 -1.925 7.398 1.00 0.00 N ATOM 564 CA ARG A 156 -9.761 -3.284 6.863 1.00 0.00 C ATOM 565 C ARG A 156 -8.535 -3.366 5.954 1.00 0.00 C ATOM 566 O ARG A 156 -7.908 -4.421 5.886 1.00 0.00 O ATOM 567 CB ARG A 156 -11.026 -3.757 6.118 1.00 0.00 C ATOM 568 CG ARG A 156 -12.176 -4.059 7.093 1.00 0.00 C ATOM 569 CD ARG A 156 -13.562 -4.048 6.437 1.00 0.00 C ATOM 570 NE ARG A 156 -13.961 -5.355 5.884 1.00 0.00 N ATOM 571 CZ ARG A 156 -15.118 -5.559 5.234 1.00 0.00 C ATOM 572 NH1 ARG A 156 -15.826 -4.532 4.756 1.00 0.00 N ATOM 573 NH2 ARG A 156 -15.591 -6.794 5.094 1.00 0.00 N ATOM 0 H ARG A 156 -10.683 -1.396 6.934 1.00 0.00 H new ATOM 0 HA ARG A 156 -9.592 -3.951 7.709 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.340 -2.990 5.410 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -10.795 -4.651 5.538 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.007 -5.035 7.548 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.160 -3.325 7.898 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.301 -3.733 7.173 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.571 -3.306 5.638 1.00 0.00 H new ATOM 0 HE ARG A 156 -13.326 -6.144 6.001 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -15.489 -3.578 4.883 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -16.703 -4.702 4.264 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -15.075 -7.585 5.480 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -16.470 -6.951 4.600 1.00 0.00 H new ATOM 587 N TYR A 157 -8.165 -2.270 5.294 1.00 0.00 N ATOM 588 CA TYR A 157 -7.017 -2.198 4.392 1.00 0.00 C ATOM 589 C TYR A 157 -5.674 -2.499 5.083 1.00 0.00 C ATOM 590 O TYR A 157 -5.593 -2.488 6.317 1.00 0.00 O ATOM 591 CB TYR A 157 -7.009 -0.798 3.759 1.00 0.00 C ATOM 592 CG TYR A 157 -8.225 -0.488 2.907 1.00 0.00 C ATOM 593 CD1 TYR A 157 -8.756 -1.453 2.026 1.00 0.00 C ATOM 594 CD2 TYR A 157 -8.839 0.771 3.012 1.00 0.00 C ATOM 595 CE1 TYR A 157 -9.953 -1.203 1.340 1.00 0.00 C ATOM 596 CE2 TYR A 157 -10.029 1.040 2.318 1.00 0.00 C ATOM 597 CZ TYR A 157 -10.624 0.028 1.523 1.00 0.00 C ATOM 598 OH TYR A 157 -11.835 0.242 0.943 1.00 0.00 O ATOM 0 H TYR A 157 -8.667 -1.386 5.374 1.00 0.00 H new ATOM 0 HA TYR A 157 -7.124 -2.972 3.632 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -6.938 -0.054 4.553 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -6.114 -0.696 3.145 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -8.238 -2.389 1.879 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.393 1.536 3.630 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.361 -1.949 0.674 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.490 2.014 2.389 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.357 -0.587 0.959 1.00 0.00 H new ATOM 608 N PRO A 158 -4.597 -2.750 4.308 1.00 0.00 N ATOM 609 CA PRO A 158 -3.255 -2.867 4.860 1.00 0.00 C ATOM 610 C PRO A 158 -2.823 -1.562 5.547 1.00 0.00 C ATOM 611 O PRO A 158 -3.257 -0.474 5.164 1.00 0.00 O ATOM 612 CB PRO A 158 -2.330 -3.254 3.696 1.00 0.00 C ATOM 613 CG PRO A 158 -3.152 -3.111 2.420 1.00 0.00 C ATOM 614 CD PRO A 158 -4.602 -2.999 2.870 1.00 0.00 C ATOM 0 HA PRO A 158 -3.211 -3.630 5.637 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.453 -2.607 3.666 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -1.969 -4.276 3.812 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.848 -2.229 1.856 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -3.011 -3.971 1.766 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -5.106 -2.189 2.342 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -5.146 -3.915 2.641 1.00 0.00 H new ATOM 622 N ASN A 159 -1.891 -1.664 6.495 1.00 0.00 N ATOM 623 CA ASN A 159 -1.100 -0.557 7.039 1.00 0.00 C ATOM 624 C ASN A 159 0.382 -0.765 6.766 1.00 0.00 C ATOM 625 O ASN A 159 1.119 0.214 6.798 1.00 0.00 O ATOM 626 CB ASN A 159 -1.262 -0.310 8.557 1.00 0.00 C ATOM 627 CG ASN A 159 -1.895 -1.402 9.401 1.00 0.00 C ATOM 628 OD1 ASN A 159 -3.013 -1.261 9.895 1.00 0.00 O ATOM 629 ND2 ASN A 159 -1.164 -2.476 9.642 1.00 0.00 N ATOM 0 H ASN A 159 -1.656 -2.559 6.924 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.494 0.319 6.524 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -0.274 -0.104 8.967 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -1.856 0.595 8.685 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -1.524 -3.212 10.250 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -0.240 -2.569 9.220 1.00 0.00 H new ATOM 636 N GLN A 160 0.834 -1.997 6.538 1.00 0.00 N ATOM 637 CA GLN A 160 2.204 -2.268 6.137 1.00 0.00 C ATOM 638 C GLN A 160 2.190 -2.472 4.624 1.00 0.00 C ATOM 639 O GLN A 160 1.320 -3.192 4.116 1.00 0.00 O ATOM 640 CB GLN A 160 2.693 -3.547 6.826 1.00 0.00 C ATOM 641 CG GLN A 160 2.758 -3.430 8.351 1.00 0.00 C ATOM 642 CD GLN A 160 3.199 -4.745 8.983 1.00 0.00 C ATOM 643 OE1 GLN A 160 2.383 -5.631 9.233 1.00 0.00 O ATOM 644 NE2 GLN A 160 4.485 -4.881 9.254 1.00 0.00 N ATOM 0 H GLN A 160 0.256 -2.833 6.628 1.00 0.00 H new ATOM 0 HA GLN A 160 2.867 -1.449 6.415 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.030 -4.370 6.560 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.683 -3.800 6.446 1.00 0.00 H new ATOM 0 HG2 GLN A 160 3.453 -2.638 8.629 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.780 -3.146 8.739 1.00 0.00 H new ATOM 0 HE21 GLN A 160 5.135 -4.127 9.034 1.00 0.00 H new ATOM 0 HE22 GLN A 160 4.828 -5.740 9.683 1.00 0.00 H new ATOM 653 N VAL A 161 3.138 -1.873 3.909 1.00 0.00 N ATOM 654 CA VAL A 161 3.360 -2.166 2.493 1.00 0.00 C ATOM 655 C VAL A 161 4.540 -3.120 2.360 1.00 0.00 C ATOM 656 O VAL A 161 5.385 -3.154 3.249 1.00 0.00 O ATOM 657 CB VAL A 161 3.623 -0.862 1.718 1.00 0.00 C ATOM 658 CG1 VAL A 161 2.377 0.032 1.708 1.00 0.00 C ATOM 659 CG2 VAL A 161 4.816 -0.041 2.210 1.00 0.00 C ATOM 0 H VAL A 161 3.773 -1.173 4.292 1.00 0.00 H new ATOM 0 HA VAL A 161 2.472 -2.637 2.071 1.00 0.00 H new ATOM 0 HB VAL A 161 3.873 -1.197 0.711 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.590 0.946 1.154 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.553 -0.498 1.231 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.102 0.284 2.732 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.916 0.857 1.600 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.658 0.243 3.250 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.725 -0.637 2.131 1.00 0.00 H new ATOM 669 N TYR A 162 4.650 -3.845 1.246 1.00 0.00 N ATOM 670 CA TYR A 162 5.950 -4.326 0.797 1.00 0.00 C ATOM 671 C TYR A 162 6.535 -3.315 -0.175 1.00 0.00 C ATOM 672 O TYR A 162 5.775 -2.659 -0.899 1.00 0.00 O ATOM 673 CB TYR A 162 5.849 -5.670 0.089 1.00 0.00 C ATOM 674 CG TYR A 162 5.338 -6.807 0.944 1.00 0.00 C ATOM 675 CD1 TYR A 162 3.952 -6.950 1.155 1.00 0.00 C ATOM 676 CD2 TYR A 162 6.247 -7.687 1.569 1.00 0.00 C ATOM 677 CE1 TYR A 162 3.468 -7.955 2.002 1.00 0.00 C ATOM 678 CE2 TYR A 162 5.758 -8.694 2.421 1.00 0.00 C ATOM 679 CZ TYR A 162 4.368 -8.841 2.638 1.00 0.00 C ATOM 680 OH TYR A 162 3.899 -9.761 3.528 1.00 0.00 O ATOM 0 H TYR A 162 3.866 -4.107 0.649 1.00 0.00 H new ATOM 0 HA TYR A 162 6.583 -4.450 1.676 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.192 -5.560 -0.774 1.00 0.00 H new ATOM 0 HB3 TYR A 162 6.834 -5.937 -0.293 1.00 0.00 H new ATOM 0 HD1 TYR A 162 3.261 -6.282 0.662 1.00 0.00 H new ATOM 0 HD2 TYR A 162 7.308 -7.588 1.395 1.00 0.00 H new ATOM 0 HE1 TYR A 162 2.406 -8.053 2.170 1.00 0.00 H new ATOM 0 HE2 TYR A 162 6.450 -9.361 2.914 1.00 0.00 H new ATOM 0 HH TYR A 162 4.646 -10.292 3.874 1.00 0.00 H new ATOM 690 N TYR A 163 7.862 -3.266 -0.264 1.00 0.00 N ATOM 691 CA TYR A 163 8.596 -2.454 -1.225 1.00 0.00 C ATOM 692 C TYR A 163 9.830 -3.228 -1.681 1.00 0.00 C ATOM 693 O TYR A 163 10.097 -4.309 -1.167 1.00 0.00 O ATOM 694 CB TYR A 163 8.948 -1.093 -0.601 1.00 0.00 C ATOM 695 CG TYR A 163 9.752 -1.104 0.695 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.133 -1.454 1.912 1.00 0.00 C ATOM 697 CD2 TYR A 163 11.098 -0.686 0.707 1.00 0.00 C ATOM 698 CE1 TYR A 163 9.855 -1.437 3.117 1.00 0.00 C ATOM 699 CE2 TYR A 163 11.805 -0.610 1.923 1.00 0.00 C ATOM 700 CZ TYR A 163 11.191 -0.995 3.135 1.00 0.00 C ATOM 701 OH TYR A 163 11.855 -0.865 4.318 1.00 0.00 O ATOM 0 H TYR A 163 8.472 -3.807 0.349 1.00 0.00 H new ATOM 0 HA TYR A 163 7.985 -2.248 -2.104 1.00 0.00 H new ATOM 0 HB2 TYR A 163 9.507 -0.518 -1.339 1.00 0.00 H new ATOM 0 HB3 TYR A 163 8.018 -0.556 -0.416 1.00 0.00 H new ATOM 0 HD1 TYR A 163 8.091 -1.739 1.918 1.00 0.00 H new ATOM 0 HD2 TYR A 163 11.589 -0.423 -0.219 1.00 0.00 H new ATOM 0 HE1 TYR A 163 9.384 -1.764 4.032 1.00 0.00 H new ATOM 0 HE2 TYR A 163 12.825 -0.254 1.928 1.00 0.00 H new ATOM 0 HH TYR A 163 12.767 -0.550 4.148 1.00 0.00 H new ATOM 711 N ARG A 164 10.596 -2.714 -2.642 1.00 0.00 N ATOM 712 CA ARG A 164 11.915 -3.255 -3.001 1.00 0.00 C ATOM 713 C ARG A 164 13.011 -2.269 -2.608 1.00 0.00 C ATOM 714 O ARG A 164 12.734 -1.072 -2.550 1.00 0.00 O ATOM 715 CB ARG A 164 11.977 -3.537 -4.506 1.00 0.00 C ATOM 716 CG ARG A 164 11.087 -4.705 -4.918 1.00 0.00 C ATOM 717 CD ARG A 164 11.846 -6.015 -5.121 1.00 0.00 C ATOM 718 NE ARG A 164 12.671 -6.002 -6.334 1.00 0.00 N ATOM 719 CZ ARG A 164 13.978 -6.280 -6.407 1.00 0.00 C ATOM 720 NH1 ARG A 164 14.712 -6.473 -5.308 1.00 0.00 N ATOM 721 NH2 ARG A 164 14.554 -6.378 -7.599 1.00 0.00 N ATOM 0 H ARG A 164 10.321 -1.905 -3.200 1.00 0.00 H new ATOM 0 HA ARG A 164 12.071 -4.189 -2.461 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.675 -2.644 -5.053 1.00 0.00 H new ATOM 0 HB3 ARG A 164 13.007 -3.751 -4.790 1.00 0.00 H new ATOM 0 HG2 ARG A 164 10.322 -4.853 -4.156 1.00 0.00 H new ATOM 0 HG3 ARG A 164 10.570 -4.448 -5.843 1.00 0.00 H new ATOM 0 HD2 ARG A 164 12.481 -6.201 -4.255 1.00 0.00 H new ATOM 0 HD3 ARG A 164 11.134 -6.839 -5.178 1.00 0.00 H new ATOM 0 HE ARG A 164 12.203 -5.757 -7.207 1.00 0.00 H new ATOM 0 HH11 ARG A 164 14.278 -6.410 -4.387 1.00 0.00 H new ATOM 0 HH12 ARG A 164 15.707 -6.684 -5.390 1.00 0.00 H new ATOM 0 HH21 ARG A 164 14.001 -6.242 -8.445 1.00 0.00 H new ATOM 0 HH22 ARG A 164 15.549 -6.589 -7.669 1.00 0.00 H new ATOM 735 N PRO A 165 14.249 -2.737 -2.395 1.00 0.00 N ATOM 736 CA PRO A 165 15.326 -1.886 -1.918 1.00 0.00 C ATOM 737 C PRO A 165 15.760 -0.881 -2.980 1.00 0.00 C ATOM 738 O PRO A 165 16.191 -1.272 -4.072 1.00 0.00 O ATOM 739 CB PRO A 165 16.437 -2.838 -1.473 1.00 0.00 C ATOM 740 CG PRO A 165 16.154 -4.157 -2.193 1.00 0.00 C ATOM 741 CD PRO A 165 14.645 -4.137 -2.415 1.00 0.00 C ATOM 0 HA PRO A 165 15.018 -1.259 -1.081 1.00 0.00 H new ATOM 0 HB2 PRO A 165 17.419 -2.448 -1.740 1.00 0.00 H new ATOM 0 HB3 PRO A 165 16.430 -2.972 -0.391 1.00 0.00 H new ATOM 0 HG2 PRO A 165 16.696 -4.221 -3.137 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.458 -5.014 -1.592 1.00 0.00 H new ATOM 0 HD2 PRO A 165 14.386 -4.601 -3.367 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.130 -4.698 -1.636 1.00 0.00 H new ATOM 749 N VAL A 166 15.650 0.409 -2.655 1.00 0.00 N ATOM 750 CA VAL A 166 16.180 1.527 -3.424 1.00 0.00 C ATOM 751 C VAL A 166 17.695 1.410 -3.473 1.00 0.00 C ATOM 752 O VAL A 166 18.361 1.604 -2.453 1.00 0.00 O ATOM 753 CB VAL A 166 15.742 2.888 -2.836 1.00 0.00 C ATOM 754 CG1 VAL A 166 14.481 3.346 -3.557 1.00 0.00 C ATOM 755 CG2 VAL A 166 15.496 2.935 -1.319 1.00 0.00 C ATOM 0 H VAL A 166 15.166 0.712 -1.810 1.00 0.00 H new ATOM 0 HA VAL A 166 15.777 1.485 -4.436 1.00 0.00 H new ATOM 0 HB VAL A 166 16.592 3.551 -2.996 1.00 0.00 H new ATOM 0 HG11 VAL A 166 14.159 4.306 -3.153 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.689 3.452 -4.622 1.00 0.00 H new ATOM 0 HG13 VAL A 166 13.691 2.609 -3.413 1.00 0.00 H new ATOM 0 HG21 VAL A 166 15.195 3.942 -1.030 1.00 0.00 H new ATOM 0 HG22 VAL A 166 14.707 2.231 -1.056 1.00 0.00 H new ATOM 0 HG23 VAL A 166 16.412 2.666 -0.793 1.00 0.00 H new ATOM 765 N ASP A 167 18.226 1.037 -4.631 1.00 0.00 N ATOM 766 CA ASP A 167 19.646 1.094 -4.943 1.00 0.00 C ATOM 767 C ASP A 167 19.828 0.875 -6.436 1.00 0.00 C ATOM 768 O ASP A 167 20.590 1.595 -7.070 1.00 0.00 O ATOM 769 CB ASP A 167 20.454 0.034 -4.176 1.00 0.00 C ATOM 770 CG ASP A 167 21.234 0.665 -3.032 1.00 0.00 C ATOM 771 OD1 ASP A 167 21.988 1.629 -3.276 1.00 0.00 O ATOM 772 OD2 ASP A 167 21.056 0.255 -1.862 1.00 0.00 O ATOM 0 H ASP A 167 17.662 0.676 -5.401 1.00 0.00 H new ATOM 0 HA ASP A 167 20.017 2.073 -4.641 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.781 -0.729 -3.785 1.00 0.00 H new ATOM 0 HB3 ASP A 167 21.142 -0.467 -4.857 1.00 0.00 H new ATOM 777 N GLN A 168 19.116 -0.093 -7.019 1.00 0.00 N ATOM 778 CA GLN A 168 19.077 -0.363 -8.435 1.00 0.00 C ATOM 779 C GLN A 168 17.927 0.417 -9.080 1.00 0.00 C ATOM 780 O GLN A 168 18.147 1.345 -9.860 1.00 0.00 O ATOM 781 CB GLN A 168 18.930 -1.889 -8.584 1.00 0.00 C ATOM 782 CG GLN A 168 20.223 -2.554 -9.051 1.00 0.00 C ATOM 783 CD GLN A 168 21.274 -2.789 -7.966 1.00 0.00 C ATOM 784 OE1 GLN A 168 21.593 -3.936 -7.645 1.00 0.00 O ATOM 785 NE2 GLN A 168 21.839 -1.742 -7.378 1.00 0.00 N ATOM 0 H GLN A 168 18.529 -0.731 -6.482 1.00 0.00 H new ATOM 0 HA GLN A 168 19.982 -0.038 -8.948 1.00 0.00 H new ATOM 0 HB2 GLN A 168 18.629 -2.318 -7.628 1.00 0.00 H new ATOM 0 HB3 GLN A 168 18.134 -2.107 -9.296 1.00 0.00 H new ATOM 0 HG2 GLN A 168 19.974 -3.513 -9.504 1.00 0.00 H new ATOM 0 HG3 GLN A 168 20.666 -1.937 -9.833 1.00 0.00 H new ATOM 0 HE21 GLN A 168 21.569 -0.797 -7.650 1.00 0.00 H new ATOM 0 HE22 GLN A 168 22.544 -1.882 -6.654 1.00 0.00 H new ATOM 794 N ALA A 169 16.690 0.006 -8.789 1.00 0.00 N ATOM 795 CA ALA A 169 15.542 0.331 -9.629 1.00 0.00 C ATOM 796 C ALA A 169 15.050 1.763 -9.451 1.00 0.00 C ATOM 797 O ALA A 169 14.586 2.374 -10.416 1.00 0.00 O ATOM 798 CB ALA A 169 14.414 -0.633 -9.291 1.00 0.00 C ATOM 0 H ALA A 169 16.460 -0.557 -7.970 1.00 0.00 H new ATOM 0 HA ALA A 169 15.857 0.237 -10.668 1.00 0.00 H new ATOM 0 HB1 ALA A 169 13.545 -0.407 -9.909 1.00 0.00 H new ATOM 0 HB2 ALA A 169 14.739 -1.655 -9.483 1.00 0.00 H new ATOM 0 HB3 ALA A 169 14.149 -0.528 -8.239 1.00 0.00 H new ATOM 804 N SER A 170 15.014 2.176 -8.187 1.00 0.00 N ATOM 805 CA SER A 170 14.843 3.494 -7.619 1.00 0.00 C ATOM 806 C SER A 170 14.087 4.470 -8.492 1.00 0.00 C ATOM 807 O SER A 170 14.654 5.371 -9.124 1.00 0.00 O ATOM 808 CB SER A 170 16.200 4.007 -7.106 1.00 0.00 C ATOM 809 OG SER A 170 17.139 2.961 -6.836 1.00 0.00 O ATOM 0 H SER A 170 15.120 1.489 -7.440 1.00 0.00 H new ATOM 0 HA SER A 170 14.172 3.404 -6.765 1.00 0.00 H new ATOM 0 HB2 SER A 170 16.626 4.686 -7.845 1.00 0.00 H new ATOM 0 HB3 SER A 170 16.041 4.586 -6.196 1.00 0.00 H new ATOM 0 HG SER A 170 17.979 3.350 -6.516 1.00 0.00 H new ATOM 815 N ASN A 171 12.780 4.271 -8.598 1.00 0.00 N ATOM 816 CA ASN A 171 11.889 5.130 -9.368 1.00 0.00 C ATOM 817 C ASN A 171 10.535 5.226 -8.679 1.00 0.00 C ATOM 818 O ASN A 171 9.982 4.216 -8.250 1.00 0.00 O ATOM 819 CB ASN A 171 11.674 4.530 -10.761 1.00 0.00 C ATOM 820 CG ASN A 171 10.948 5.461 -11.718 1.00 0.00 C ATOM 821 OD1 ASN A 171 10.619 6.591 -11.394 1.00 0.00 O ATOM 822 ND2 ASN A 171 10.592 4.975 -12.887 1.00 0.00 N ATOM 0 H ASN A 171 12.300 3.494 -8.143 1.00 0.00 H new ATOM 0 HA ASN A 171 12.340 6.119 -9.445 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.642 4.267 -11.188 1.00 0.00 H new ATOM 0 HB3 ASN A 171 11.105 3.605 -10.665 1.00 0.00 H new ATOM 0 HD21 ASN A 171 10.038 5.543 -13.528 1.00 0.00 H new ATOM 0 HD22 ASN A 171 10.870 4.030 -13.152 1.00 0.00 H new ATOM 829 N GLN A 172 9.952 6.419 -8.717 1.00 0.00 N ATOM 830 CA GLN A 172 8.637 6.748 -8.181 1.00 0.00 C ATOM 831 C GLN A 172 7.542 6.149 -9.074 1.00 0.00 C ATOM 832 O GLN A 172 6.367 6.202 -8.724 1.00 0.00 O ATOM 833 CB GLN A 172 8.542 8.282 -8.050 1.00 0.00 C ATOM 834 CG GLN A 172 7.390 8.795 -7.155 1.00 0.00 C ATOM 835 CD GLN A 172 7.848 9.760 -6.052 1.00 0.00 C ATOM 836 OE1 GLN A 172 8.701 10.620 -6.247 1.00 0.00 O ATOM 837 NE2 GLN A 172 7.316 9.651 -4.848 1.00 0.00 N ATOM 0 H GLN A 172 10.408 7.225 -9.145 1.00 0.00 H new ATOM 0 HA GLN A 172 8.492 6.315 -7.191 1.00 0.00 H new ATOM 0 HB2 GLN A 172 9.485 8.656 -7.651 1.00 0.00 H new ATOM 0 HB3 GLN A 172 8.425 8.709 -9.046 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.651 9.296 -7.781 1.00 0.00 H new ATOM 0 HG3 GLN A 172 6.892 7.942 -6.695 1.00 0.00 H new ATOM 0 HE21 GLN A 172 6.605 8.942 -4.667 1.00 0.00 H new ATOM 0 HE22 GLN A 172 7.616 10.276 -4.100 1.00 0.00 H new ATOM 846 N ASN A 173 7.896 5.581 -10.230 1.00 0.00 N ATOM 847 CA ASN A 173 7.048 4.638 -10.938 1.00 0.00 C ATOM 848 C ASN A 173 7.249 3.249 -10.382 1.00 0.00 C ATOM 849 O ASN A 173 6.332 2.671 -9.816 1.00 0.00 O ATOM 850 CB ASN A 173 7.313 4.643 -12.452 1.00 0.00 C ATOM 851 CG ASN A 173 6.023 5.013 -13.123 1.00 0.00 C ATOM 852 OD1 ASN A 173 5.271 4.174 -13.601 1.00 0.00 O ATOM 853 ND2 ASN A 173 5.763 6.293 -13.122 1.00 0.00 N ATOM 0 H ASN A 173 8.783 5.768 -10.697 1.00 0.00 H new ATOM 0 HA ASN A 173 6.014 4.949 -10.788 1.00 0.00 H new ATOM 0 HB2 ASN A 173 8.097 5.357 -12.704 1.00 0.00 H new ATOM 0 HB3 ASN A 173 7.655 3.664 -12.787 1.00 0.00 H new ATOM 0 HD21 ASN A 173 4.896 6.638 -13.534 1.00 0.00 H new ATOM 0 HD22 ASN A 173 6.427 6.948 -12.709 1.00 0.00 H new ATOM 860 N ASN A 174 8.425 2.666 -10.613 1.00 0.00 N ATOM 861 CA ASN A 174 8.502 1.209 -10.631 1.00 0.00 C ATOM 862 C ASN A 174 8.630 0.615 -9.232 1.00 0.00 C ATOM 863 O ASN A 174 8.198 -0.517 -9.021 1.00 0.00 O ATOM 864 CB ASN A 174 9.583 0.734 -11.606 1.00 0.00 C ATOM 865 CG ASN A 174 10.943 0.493 -10.969 1.00 0.00 C ATOM 866 OD1 ASN A 174 11.142 -0.476 -10.238 1.00 0.00 O ATOM 867 ND2 ASN A 174 11.868 1.397 -11.240 1.00 0.00 N ATOM 0 H ASN A 174 9.303 3.157 -10.784 1.00 0.00 H new ATOM 0 HA ASN A 174 7.554 0.825 -11.008 1.00 0.00 H new ATOM 0 HB2 ASN A 174 9.248 -0.189 -12.079 1.00 0.00 H new ATOM 0 HB3 ASN A 174 9.692 1.476 -12.397 1.00 0.00 H new ATOM 0 HD21 ASN A 174 12.800 1.310 -10.836 1.00 0.00 H new ATOM 0 HD22 ASN A 174 11.650 2.182 -11.853 1.00 0.00 H new ATOM 874 N PHE A 175 9.147 1.387 -8.274 1.00 0.00 N ATOM 875 CA PHE A 175 9.048 1.052 -6.859 1.00 0.00 C ATOM 876 C PHE A 175 7.556 0.984 -6.503 1.00 0.00 C ATOM 877 O PHE A 175 7.086 0.000 -5.946 1.00 0.00 O ATOM 878 CB PHE A 175 9.813 2.119 -6.044 1.00 0.00 C ATOM 879 CG PHE A 175 9.862 1.929 -4.539 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.772 2.327 -3.741 1.00 0.00 C ATOM 881 CD2 PHE A 175 11.050 1.497 -3.921 1.00 0.00 C ATOM 882 CE1 PHE A 175 8.871 2.311 -2.340 1.00 0.00 C ATOM 883 CE2 PHE A 175 11.160 1.530 -2.517 1.00 0.00 C ATOM 884 CZ PHE A 175 10.077 1.946 -1.725 1.00 0.00 C ATOM 0 H PHE A 175 9.644 2.258 -8.460 1.00 0.00 H new ATOM 0 HA PHE A 175 9.498 0.087 -6.626 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.837 2.159 -6.414 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.362 3.090 -6.249 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.853 2.647 -4.210 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.875 1.141 -4.521 1.00 0.00 H new ATOM 0 HE1 PHE A 175 8.017 2.580 -1.736 1.00 0.00 H new ATOM 0 HE2 PHE A 175 12.085 1.233 -2.045 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.173 1.984 -0.650 1.00 0.00 H new ATOM 894 N VAL A 176 6.794 2.015 -6.875 1.00 0.00 N ATOM 895 CA VAL A 176 5.411 2.248 -6.472 1.00 0.00 C ATOM 896 C VAL A 176 4.443 1.256 -7.134 1.00 0.00 C ATOM 897 O VAL A 176 3.495 0.816 -6.484 1.00 0.00 O ATOM 898 CB VAL A 176 5.045 3.714 -6.785 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.624 4.103 -6.359 1.00 0.00 C ATOM 900 CG2 VAL A 176 5.995 4.660 -6.036 1.00 0.00 C ATOM 0 H VAL A 176 7.145 2.744 -7.496 1.00 0.00 H new ATOM 0 HA VAL A 176 5.316 2.078 -5.400 1.00 0.00 H new ATOM 0 HB VAL A 176 5.124 3.804 -7.868 1.00 0.00 H new ATOM 0 HG11 VAL A 176 3.441 5.147 -6.612 1.00 0.00 H new ATOM 0 HG12 VAL A 176 2.903 3.472 -6.879 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.516 3.966 -5.283 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.732 5.693 -6.261 1.00 0.00 H new ATOM 0 HG22 VAL A 176 5.908 4.489 -4.963 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.021 4.470 -6.352 1.00 0.00 H new ATOM 910 N HIS A 177 4.651 0.887 -8.401 1.00 0.00 N ATOM 911 CA HIS A 177 3.755 -0.035 -9.086 1.00 0.00 C ATOM 912 C HIS A 177 3.914 -1.436 -8.476 1.00 0.00 C ATOM 913 O HIS A 177 2.927 -2.034 -8.055 1.00 0.00 O ATOM 914 CB HIS A 177 3.993 0.007 -10.607 1.00 0.00 C ATOM 915 CG HIS A 177 2.864 -0.580 -11.435 1.00 0.00 C ATOM 916 ND1 HIS A 177 2.006 -1.578 -11.053 1.00 0.00 N flip ATOM 917 CD2 HIS A 177 2.471 -0.178 -12.700 1.00 0.00 C flip ATOM 918 CE1 HIS A 177 1.095 -1.784 -12.083 1.00 0.00 C flip ATOM 919 NE2 HIS A 177 1.425 -0.940 -13.072 1.00 0.00 N flip ATOM 0 H HIS A 177 5.433 1.215 -8.969 1.00 0.00 H new ATOM 0 HA HIS A 177 2.717 0.264 -8.943 1.00 0.00 H new ATOM 0 HB2 HIS A 177 4.149 1.043 -10.910 1.00 0.00 H new ATOM 0 HB3 HIS A 177 4.912 -0.533 -10.834 1.00 0.00 H new ATOM 0 HD2 HIS A 177 2.924 0.608 -13.286 1.00 0.00 H new ATOM 0 HE1 HIS A 177 0.277 -2.489 -12.086 1.00 0.00 H new ATOM 0 HE2 HIS A 177 0.953 -0.884 -13.974 1.00 0.00 H new ATOM 927 N ASP A 178 5.137 -1.968 -8.405 1.00 0.00 N ATOM 928 CA ASP A 178 5.397 -3.292 -7.822 1.00 0.00 C ATOM 929 C ASP A 178 4.963 -3.333 -6.349 1.00 0.00 C ATOM 930 O ASP A 178 4.453 -4.347 -5.890 1.00 0.00 O ATOM 931 CB ASP A 178 6.881 -3.665 -7.974 1.00 0.00 C ATOM 932 CG ASP A 178 7.131 -5.151 -8.272 1.00 0.00 C ATOM 933 OD1 ASP A 178 6.356 -6.048 -7.877 1.00 0.00 O ATOM 934 OD2 ASP A 178 8.159 -5.453 -8.924 1.00 0.00 O ATOM 0 H ASP A 178 5.974 -1.497 -8.748 1.00 0.00 H new ATOM 0 HA ASP A 178 4.806 -4.030 -8.364 1.00 0.00 H new ATOM 0 HB2 ASP A 178 7.314 -3.068 -8.777 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.407 -3.397 -7.058 1.00 0.00 H new ATOM 939 N CYS A 179 5.082 -2.210 -5.629 1.00 0.00 N ATOM 940 CA CYS A 179 4.403 -1.934 -4.359 1.00 0.00 C ATOM 941 C CYS A 179 2.913 -2.262 -4.459 1.00 0.00 C ATOM 942 O CYS A 179 2.471 -3.201 -3.802 1.00 0.00 O ATOM 943 CB CYS A 179 4.600 -0.457 -3.973 1.00 0.00 C ATOM 944 SG CYS A 179 5.689 -0.008 -2.610 1.00 0.00 S ATOM 0 H CYS A 179 5.678 -1.439 -5.929 1.00 0.00 H new ATOM 0 HA CYS A 179 4.839 -2.567 -3.586 1.00 0.00 H new ATOM 0 HB2 CYS A 179 4.963 0.062 -4.860 1.00 0.00 H new ATOM 0 HB3 CYS A 179 3.615 -0.049 -3.746 1.00 0.00 H new ATOM 949 N VAL A 180 2.157 -1.497 -5.255 1.00 0.00 N ATOM 950 CA VAL A 180 0.716 -1.639 -5.444 1.00 0.00 C ATOM 951 C VAL A 180 0.383 -3.104 -5.705 1.00 0.00 C ATOM 952 O VAL A 180 -0.286 -3.719 -4.878 1.00 0.00 O ATOM 953 CB VAL A 180 0.237 -0.622 -6.509 1.00 0.00 C ATOM 954 CG1 VAL A 180 -1.145 -0.900 -7.116 1.00 0.00 C ATOM 955 CG2 VAL A 180 0.174 0.771 -5.864 1.00 0.00 C ATOM 0 H VAL A 180 2.551 -0.734 -5.805 1.00 0.00 H new ATOM 0 HA VAL A 180 0.151 -1.385 -4.547 1.00 0.00 H new ATOM 0 HB VAL A 180 0.959 -0.701 -7.322 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.382 -0.129 -7.849 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.139 -1.875 -7.604 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.897 -0.894 -6.327 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -0.162 1.499 -6.602 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.525 0.753 -5.028 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.164 1.050 -5.504 1.00 0.00 H new ATOM 965 N ASN A 181 0.910 -3.667 -6.792 1.00 0.00 N ATOM 966 CA ASN A 181 0.747 -5.050 -7.215 1.00 0.00 C ATOM 967 C ASN A 181 0.943 -6.020 -6.066 1.00 0.00 C ATOM 968 O ASN A 181 0.089 -6.882 -5.864 1.00 0.00 O ATOM 969 CB ASN A 181 1.745 -5.391 -8.336 1.00 0.00 C ATOM 970 CG ASN A 181 1.275 -4.947 -9.711 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.079 -4.843 -9.979 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.210 -4.666 -10.600 1.00 0.00 N ATOM 0 H ASN A 181 1.496 -3.135 -7.436 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.274 -5.152 -7.582 1.00 0.00 H new ATOM 0 HB2 ASN A 181 2.703 -4.919 -8.117 1.00 0.00 H new ATOM 0 HB3 ASN A 181 1.915 -6.468 -8.347 1.00 0.00 H new ATOM 0 HD21 ASN A 181 1.947 -4.354 -11.535 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.195 -4.761 -10.352 1.00 0.00 H new ATOM 979 N ILE A 182 2.076 -5.955 -5.366 1.00 0.00 N ATOM 980 CA ILE A 182 2.369 -6.888 -4.293 1.00 0.00 C ATOM 981 C ILE A 182 1.439 -6.654 -3.109 1.00 0.00 C ATOM 982 O ILE A 182 0.781 -7.595 -2.686 1.00 0.00 O ATOM 983 CB ILE A 182 3.873 -6.839 -3.926 1.00 0.00 C ATOM 984 CG1 ILE A 182 4.789 -7.691 -4.838 1.00 0.00 C ATOM 985 CG2 ILE A 182 4.155 -7.234 -2.478 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.178 -9.002 -5.341 1.00 0.00 C ATOM 0 H ILE A 182 2.805 -5.260 -5.529 1.00 0.00 H new ATOM 0 HA ILE A 182 2.174 -7.906 -4.631 1.00 0.00 H new ATOM 0 HB ILE A 182 4.116 -5.788 -4.079 1.00 0.00 H new ATOM 0 HG12 ILE A 182 5.076 -7.089 -5.700 1.00 0.00 H new ATOM 0 HG13 ILE A 182 5.704 -7.922 -4.292 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.227 -7.178 -2.288 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.631 -6.553 -1.807 1.00 0.00 H new ATOM 0 HG23 ILE A 182 3.808 -8.253 -2.305 1.00 0.00 H new ATOM 0 HD11 ILE A 182 4.900 -9.522 -5.970 1.00 0.00 H new ATOM 0 HD12 ILE A 182 3.918 -9.632 -4.490 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.281 -8.786 -5.921 1.00 0.00 H new ATOM 998 N THR A 183 1.390 -5.465 -2.520 1.00 0.00 N ATOM 999 CA THR A 183 0.684 -5.263 -1.262 1.00 0.00 C ATOM 1000 C THR A 183 -0.797 -5.618 -1.441 1.00 0.00 C ATOM 1001 O THR A 183 -1.381 -6.246 -0.555 1.00 0.00 O ATOM 1002 CB THR A 183 0.941 -3.828 -0.797 1.00 0.00 C ATOM 1003 OG1 THR A 183 2.324 -3.673 -0.560 1.00 0.00 O ATOM 1004 CG2 THR A 183 0.193 -3.423 0.474 1.00 0.00 C ATOM 0 H THR A 183 1.832 -4.625 -2.895 1.00 0.00 H new ATOM 0 HA THR A 183 1.048 -5.923 -0.475 1.00 0.00 H new ATOM 0 HB THR A 183 0.571 -3.182 -1.594 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.504 -2.757 -0.263 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.437 -2.391 0.726 1.00 0.00 H new ATOM 0 HG22 THR A 183 -0.881 -3.512 0.308 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.489 -4.077 1.294 1.00 0.00 H new ATOM 1012 N ILE A 184 -1.370 -5.323 -2.608 1.00 0.00 N ATOM 1013 CA ILE A 184 -2.691 -5.770 -3.022 1.00 0.00 C ATOM 1014 C ILE A 184 -2.719 -7.281 -3.081 1.00 0.00 C ATOM 1015 O ILE A 184 -3.517 -7.883 -2.369 1.00 0.00 O ATOM 1016 CB ILE A 184 -3.041 -5.091 -4.356 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.381 -3.649 -3.942 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -4.150 -5.761 -5.171 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.638 -2.675 -5.059 1.00 0.00 C ATOM 0 H ILE A 184 -0.908 -4.747 -3.311 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.457 -5.481 -2.302 1.00 0.00 H new ATOM 0 HB ILE A 184 -2.209 -5.158 -5.057 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.263 -3.676 -3.303 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.560 -3.265 -3.336 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.315 -5.200 -6.091 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.856 -6.781 -5.416 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -5.070 -5.779 -4.587 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.867 -1.694 -4.641 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.752 -2.603 -5.690 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.482 -3.021 -5.656 1.00 0.00 H new ATOM 1031 N LYS A 185 -1.855 -7.911 -3.875 1.00 0.00 N ATOM 1032 CA LYS A 185 -1.806 -9.358 -4.004 1.00 0.00 C ATOM 1033 C LYS A 185 -1.735 -10.034 -2.639 1.00 0.00 C ATOM 1034 O LYS A 185 -2.447 -11.004 -2.388 1.00 0.00 O ATOM 1035 CB LYS A 185 -0.621 -9.709 -4.906 1.00 0.00 C ATOM 1036 CG LYS A 185 -0.405 -11.208 -5.095 1.00 0.00 C ATOM 1037 CD LYS A 185 -0.672 -11.722 -6.517 1.00 0.00 C ATOM 1038 CE LYS A 185 0.623 -12.166 -7.210 1.00 0.00 C ATOM 1039 NZ LYS A 185 0.384 -13.337 -8.074 1.00 0.00 N ATOM 0 H LYS A 185 -1.166 -7.424 -4.449 1.00 0.00 H new ATOM 0 HA LYS A 185 -2.721 -9.733 -4.462 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.772 -9.249 -5.882 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.285 -9.272 -4.485 1.00 0.00 H new ATOM 0 HG2 LYS A 185 0.622 -11.450 -4.823 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -1.053 -11.745 -4.402 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -1.369 -12.559 -6.477 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -1.149 -10.937 -7.104 1.00 0.00 H new ATOM 0 HE2 LYS A 185 1.021 -11.345 -7.806 1.00 0.00 H new ATOM 0 HE3 LYS A 185 1.376 -12.410 -6.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 1.275 -13.618 -8.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 0.026 -14.126 -7.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -0.318 -13.094 -8.802 1.00 0.00 H new ATOM 1053 N GLN A 186 -0.956 -9.508 -1.701 1.00 0.00 N ATOM 1054 CA GLN A 186 -0.755 -10.143 -0.418 1.00 0.00 C ATOM 1055 C GLN A 186 -2.036 -10.036 0.400 1.00 0.00 C ATOM 1056 O GLN A 186 -2.350 -10.965 1.132 1.00 0.00 O ATOM 1057 CB GLN A 186 0.490 -9.571 0.294 1.00 0.00 C ATOM 1058 CG GLN A 186 1.812 -9.818 -0.465 1.00 0.00 C ATOM 1059 CD GLN A 186 1.892 -11.153 -1.193 1.00 0.00 C ATOM 1060 OE1 GLN A 186 1.999 -11.213 -2.407 1.00 0.00 O ATOM 1061 NE2 GLN A 186 1.794 -12.262 -0.479 1.00 0.00 N ATOM 0 H GLN A 186 -0.449 -8.630 -1.815 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.546 -11.204 -0.551 1.00 0.00 H new ATOM 0 HB2 GLN A 186 0.357 -8.498 0.432 1.00 0.00 H new ATOM 0 HB3 GLN A 186 0.564 -10.014 1.287 1.00 0.00 H new ATOM 0 HG2 GLN A 186 1.953 -9.016 -1.190 1.00 0.00 H new ATOM 0 HG3 GLN A 186 2.638 -9.757 0.244 1.00 0.00 H new ATOM 0 HE21 GLN A 186 1.705 -12.209 0.536 1.00 0.00 H new ATOM 0 HE22 GLN A 186 1.808 -13.170 -0.943 1.00 0.00 H new ATOM 1070 N HIS A 187 -2.829 -8.988 0.201 1.00 0.00 N ATOM 1071 CA HIS A 187 -4.139 -8.861 0.805 1.00 0.00 C ATOM 1072 C HIS A 187 -5.224 -9.653 0.050 1.00 0.00 C ATOM 1073 O HIS A 187 -6.262 -10.007 0.616 1.00 0.00 O ATOM 1074 CB HIS A 187 -4.452 -7.366 0.925 1.00 0.00 C ATOM 1075 CG HIS A 187 -4.613 -6.955 2.365 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -5.701 -6.348 2.944 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -3.677 -7.151 3.342 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -5.428 -6.191 4.253 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -4.193 -6.648 4.538 1.00 0.00 N ATOM 0 H HIS A 187 -2.572 -8.198 -0.391 1.00 0.00 H new ATOM 0 HA HIS A 187 -4.134 -9.309 1.798 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -3.651 -6.786 0.467 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.365 -7.138 0.375 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -6.559 -6.068 2.469 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -2.710 -7.613 3.212 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -6.105 -5.759 4.975 1.00 0.00 H new ATOM 1087 N THR A 188 -4.982 -10.017 -1.207 1.00 0.00 N ATOM 1088 CA THR A 188 -5.997 -10.580 -2.097 1.00 0.00 C ATOM 1089 C THR A 188 -5.780 -12.087 -2.256 1.00 0.00 C ATOM 1090 O THR A 188 -6.676 -12.808 -2.688 1.00 0.00 O ATOM 1091 CB THR A 188 -6.025 -9.785 -3.419 1.00 0.00 C ATOM 1092 OG1 THR A 188 -5.959 -8.396 -3.153 1.00 0.00 O ATOM 1093 CG2 THR A 188 -7.325 -9.984 -4.193 1.00 0.00 C ATOM 0 H THR A 188 -4.064 -9.929 -1.643 1.00 0.00 H new ATOM 0 HA THR A 188 -6.994 -10.477 -1.668 1.00 0.00 H new ATOM 0 HB THR A 188 -5.176 -10.147 -3.999 1.00 0.00 H new ATOM 0 HG1 THR A 188 -5.024 -8.132 -3.025 1.00 0.00 H new ATOM 0 HG21 THR A 188 -7.292 -9.403 -5.115 1.00 0.00 H new ATOM 0 HG22 THR A 188 -7.447 -11.040 -4.434 1.00 0.00 H new ATOM 0 HG23 THR A 188 -8.166 -9.652 -3.584 1.00 0.00 H new ATOM 1101 N VAL A 189 -4.636 -12.599 -1.798 1.00 0.00 N ATOM 1102 CA VAL A 189 -4.310 -14.012 -1.780 1.00 0.00 C ATOM 1103 C VAL A 189 -3.886 -14.418 -0.384 1.00 0.00 C ATOM 1104 O VAL A 189 -4.415 -15.367 0.174 1.00 0.00 O ATOM 1105 CB VAL A 189 -3.262 -14.316 -2.869 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -1.778 -14.259 -2.473 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -3.581 -15.696 -3.450 1.00 0.00 C ATOM 0 H VAL A 189 -3.891 -12.015 -1.418 1.00 0.00 H new ATOM 0 HA VAL A 189 -5.184 -14.617 -2.021 1.00 0.00 H new ATOM 0 HB VAL A 189 -3.357 -13.499 -3.585 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -1.161 -14.495 -3.340 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -1.535 -13.258 -2.116 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -1.584 -14.983 -1.682 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -2.855 -15.941 -4.225 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -3.533 -16.444 -2.659 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -4.582 -15.687 -3.880 1.00 0.00 H new ATOM 1117 N THR A 190 -2.961 -13.668 0.204 1.00 0.00 N ATOM 1118 CA THR A 190 -2.339 -14.020 1.487 1.00 0.00 C ATOM 1119 C THR A 190 -3.201 -13.562 2.692 1.00 0.00 C ATOM 1120 O THR A 190 -2.808 -13.786 3.838 1.00 0.00 O ATOM 1121 CB THR A 190 -0.847 -13.579 1.441 1.00 0.00 C ATOM 1122 OG1 THR A 190 -0.046 -14.641 0.951 1.00 0.00 O ATOM 1123 CG2 THR A 190 -0.194 -13.041 2.715 1.00 0.00 C ATOM 0 H THR A 190 -2.616 -12.794 -0.193 1.00 0.00 H new ATOM 0 HA THR A 190 -2.312 -15.097 1.653 1.00 0.00 H new ATOM 0 HB THR A 190 -0.890 -12.712 0.782 1.00 0.00 H new ATOM 0 HG1 THR A 190 0.892 -14.357 0.923 1.00 0.00 H new ATOM 0 HG21 THR A 190 0.844 -12.780 2.510 1.00 0.00 H new ATOM 0 HG22 THR A 190 -0.731 -12.154 3.052 1.00 0.00 H new ATOM 0 HG23 THR A 190 -0.229 -13.804 3.492 1.00 0.00 H new ATOM 1131 N THR A 191 -4.402 -13.016 2.461 1.00 0.00 N ATOM 1132 CA THR A 191 -5.330 -12.537 3.495 1.00 0.00 C ATOM 1133 C THR A 191 -6.773 -12.964 3.150 1.00 0.00 C ATOM 1134 O THR A 191 -7.462 -13.535 3.987 1.00 0.00 O ATOM 1135 CB THR A 191 -5.143 -11.012 3.634 1.00 0.00 C ATOM 1136 OG1 THR A 191 -3.783 -10.689 3.876 1.00 0.00 O ATOM 1137 CG2 THR A 191 -5.989 -10.290 4.670 1.00 0.00 C ATOM 0 H THR A 191 -4.767 -12.891 1.517 1.00 0.00 H new ATOM 0 HA THR A 191 -5.119 -12.985 4.466 1.00 0.00 H new ATOM 0 HB THR A 191 -5.499 -10.650 2.669 1.00 0.00 H new ATOM 0 HG1 THR A 191 -3.264 -10.822 3.055 1.00 0.00 H new ATOM 0 HG21 THR A 191 -5.752 -9.226 4.656 1.00 0.00 H new ATOM 0 HG22 THR A 191 -7.045 -10.429 4.439 1.00 0.00 H new ATOM 0 HG23 THR A 191 -5.778 -10.696 5.659 1.00 0.00 H new ATOM 1145 N THR A 192 -7.211 -12.836 1.893 1.00 0.00 N ATOM 1146 CA THR A 192 -8.545 -13.252 1.409 1.00 0.00 C ATOM 1147 C THR A 192 -8.786 -14.788 1.422 1.00 0.00 C ATOM 1148 O THR A 192 -9.807 -15.292 0.956 1.00 0.00 O ATOM 1149 CB THR A 192 -8.723 -12.610 0.028 1.00 0.00 C ATOM 1150 OG1 THR A 192 -8.733 -11.200 0.164 1.00 0.00 O ATOM 1151 CG2 THR A 192 -9.962 -12.990 -0.781 1.00 0.00 C ATOM 0 H THR A 192 -6.634 -12.428 1.157 1.00 0.00 H new ATOM 0 HA THR A 192 -9.314 -12.901 2.097 1.00 0.00 H new ATOM 0 HB THR A 192 -7.877 -13.005 -0.535 1.00 0.00 H new ATOM 0 HG1 THR A 192 -7.820 -10.880 0.321 1.00 0.00 H new ATOM 0 HG21 THR A 192 -9.952 -12.459 -1.733 1.00 0.00 H new ATOM 0 HG22 THR A 192 -9.961 -14.064 -0.965 1.00 0.00 H new ATOM 0 HG23 THR A 192 -10.858 -12.718 -0.223 1.00 0.00 H new ATOM 1159 N THR A 193 -7.848 -15.565 1.952 1.00 0.00 N ATOM 1160 CA THR A 193 -8.007 -16.998 2.240 1.00 0.00 C ATOM 1161 C THR A 193 -7.865 -17.292 3.747 1.00 0.00 C ATOM 1162 O THR A 193 -7.679 -18.442 4.157 1.00 0.00 O ATOM 1163 CB THR A 193 -7.066 -17.775 1.299 1.00 0.00 C ATOM 1164 OG1 THR A 193 -7.385 -19.143 1.190 1.00 0.00 O ATOM 1165 CG2 THR A 193 -5.584 -17.648 1.657 1.00 0.00 C ATOM 0 H THR A 193 -6.925 -15.210 2.203 1.00 0.00 H new ATOM 0 HA THR A 193 -9.018 -17.347 2.027 1.00 0.00 H new ATOM 0 HB THR A 193 -7.231 -17.293 0.335 1.00 0.00 H new ATOM 0 HG1 THR A 193 -7.579 -19.506 2.080 1.00 0.00 H new ATOM 0 HG21 THR A 193 -4.988 -18.223 0.948 1.00 0.00 H new ATOM 0 HG22 THR A 193 -5.288 -16.600 1.614 1.00 0.00 H new ATOM 0 HG23 THR A 193 -5.419 -18.031 2.664 1.00 0.00 H new ATOM 1173 N LYS A 194 -7.890 -16.258 4.596 1.00 0.00 N ATOM 1174 CA LYS A 194 -7.517 -16.305 6.011 1.00 0.00 C ATOM 1175 C LYS A 194 -8.498 -15.534 6.898 1.00 0.00 C ATOM 1176 O LYS A 194 -8.165 -15.250 8.052 1.00 0.00 O ATOM 1177 CB LYS A 194 -6.089 -15.782 6.201 1.00 0.00 C ATOM 1178 CG LYS A 194 -5.083 -16.587 5.368 1.00 0.00 C ATOM 1179 CD LYS A 194 -3.653 -16.193 5.702 1.00 0.00 C ATOM 1180 CE LYS A 194 -3.244 -16.691 7.084 1.00 0.00 C ATOM 1181 NZ LYS A 194 -1.780 -16.677 7.255 1.00 0.00 N ATOM 0 H LYS A 194 -8.184 -15.327 4.301 1.00 0.00 H new ATOM 0 HA LYS A 194 -7.560 -17.348 6.324 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -6.043 -14.731 5.914 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -5.817 -15.836 7.255 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -5.223 -17.652 5.554 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.270 -16.421 4.307 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -2.977 -16.603 4.952 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -3.554 -15.108 5.661 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -3.706 -16.066 7.848 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -3.618 -17.704 7.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -1.538 -17.022 8.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -1.341 -17.293 6.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -1.426 -15.706 7.139 1.00 0.00 H new ATOM 1195 N GLY A 195 -9.674 -15.180 6.382 1.00 0.00 N ATOM 1196 CA GLY A 195 -10.681 -14.444 7.127 1.00 0.00 C ATOM 1197 C GLY A 195 -11.275 -13.293 6.328 1.00 0.00 C ATOM 1198 O GLY A 195 -12.307 -12.773 6.743 1.00 0.00 O ATOM 0 H GLY A 195 -9.952 -15.400 5.426 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -11.479 -15.125 7.423 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -10.237 -14.055 8.043 1.00 0.00 H new ATOM 1202 N GLU A 196 -10.674 -12.888 5.206 1.00 0.00 N ATOM 1203 CA GLU A 196 -11.190 -11.790 4.393 1.00 0.00 C ATOM 1204 C GLU A 196 -11.819 -12.294 3.099 1.00 0.00 C ATOM 1205 O GLU A 196 -11.611 -13.436 2.680 1.00 0.00 O ATOM 1206 CB GLU A 196 -10.070 -10.774 4.094 1.00 0.00 C ATOM 1207 CG GLU A 196 -10.197 -9.523 4.972 1.00 0.00 C ATOM 1208 CD GLU A 196 -11.458 -8.667 4.693 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -12.323 -9.059 3.861 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -11.662 -7.611 5.328 1.00 0.00 O ATOM 0 H GLU A 196 -9.821 -13.311 4.840 1.00 0.00 H new ATOM 0 HA GLU A 196 -11.974 -11.293 4.964 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -9.099 -11.241 4.262 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.108 -10.488 3.043 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -10.205 -9.828 6.018 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -9.313 -8.902 4.828 1.00 0.00 H new ATOM 1217 N ASN A 197 -12.555 -11.398 2.444 1.00 0.00 N ATOM 1218 CA ASN A 197 -13.097 -11.547 1.111 1.00 0.00 C ATOM 1219 C ASN A 197 -13.390 -10.167 0.519 1.00 0.00 C ATOM 1220 O ASN A 197 -14.547 -9.759 0.368 1.00 0.00 O ATOM 1221 CB ASN A 197 -14.349 -12.425 1.153 1.00 0.00 C ATOM 1222 CG ASN A 197 -14.561 -13.023 -0.219 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -14.265 -14.198 -0.417 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -14.978 -12.239 -1.193 1.00 0.00 N ATOM 0 H ASN A 197 -12.798 -10.499 2.861 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.369 -12.041 0.467 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -14.234 -13.214 1.896 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.216 -11.834 1.447 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -15.062 -12.605 -2.142 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -15.217 -11.267 -0.998 1.00 0.00 H new ATOM 1231 N PHE A 198 -12.330 -9.431 0.210 1.00 0.00 N ATOM 1232 CA PHE A 198 -12.418 -8.132 -0.448 1.00 0.00 C ATOM 1233 C PHE A 198 -13.063 -8.259 -1.840 1.00 0.00 C ATOM 1234 O PHE A 198 -13.164 -9.348 -2.420 1.00 0.00 O ATOM 1235 CB PHE A 198 -11.022 -7.504 -0.554 1.00 0.00 C ATOM 1236 CG PHE A 198 -10.345 -7.177 0.766 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -10.788 -6.085 1.535 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -9.265 -7.955 1.225 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -10.199 -5.814 2.784 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -8.690 -7.697 2.482 1.00 0.00 C ATOM 1241 CZ PHE A 198 -9.172 -6.640 3.277 1.00 0.00 C ATOM 0 H PHE A 198 -11.373 -9.722 0.411 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.053 -7.482 0.154 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.379 -8.184 -1.112 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.100 -6.587 -1.138 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -11.582 -5.453 1.166 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -8.877 -8.753 0.609 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -10.536 -4.969 3.366 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -7.876 -8.311 2.838 1.00 0.00 H new ATOM 0 HZ PHE A 198 -8.757 -6.464 4.258 1.00 0.00 H new ATOM 1251 N THR A 199 -13.469 -7.119 -2.388 1.00 0.00 N ATOM 1252 CA THR A 199 -14.186 -6.985 -3.648 1.00 0.00 C ATOM 1253 C THR A 199 -13.326 -6.200 -4.633 1.00 0.00 C ATOM 1254 O THR A 199 -12.279 -5.663 -4.264 1.00 0.00 O ATOM 1255 CB THR A 199 -15.522 -6.282 -3.353 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.293 -5.078 -2.639 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.419 -7.215 -2.542 1.00 0.00 C ATOM 0 H THR A 199 -13.297 -6.218 -1.941 1.00 0.00 H new ATOM 0 HA THR A 199 -14.393 -7.954 -4.101 1.00 0.00 H new ATOM 0 HB THR A 199 -16.016 -6.038 -4.293 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.149 -4.637 -2.458 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.366 -6.718 -2.332 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.605 -8.126 -3.111 1.00 0.00 H new ATOM 0 HG23 THR A 199 -15.926 -7.468 -1.603 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.767 -6.077 -5.887 1.00 0.00 N ATOM 1266 CA GLU A 200 -13.181 -5.143 -6.821 1.00 0.00 C ATOM 1267 C GLU A 200 -13.179 -3.736 -6.228 1.00 0.00 C ATOM 1268 O GLU A 200 -12.159 -3.065 -6.286 1.00 0.00 O ATOM 1269 CB GLU A 200 -13.972 -5.200 -8.125 1.00 0.00 C ATOM 1270 CG GLU A 200 -13.126 -4.651 -9.277 1.00 0.00 C ATOM 1271 CD GLU A 200 -13.957 -3.942 -10.347 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -15.050 -4.442 -10.690 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -13.535 -2.844 -10.785 1.00 0.00 O ATOM 0 H GLU A 200 -14.537 -6.624 -6.272 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.144 -5.410 -7.024 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -14.266 -6.228 -8.337 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -14.890 -4.620 -8.029 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -12.388 -3.955 -8.878 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -12.575 -5.471 -9.738 1.00 0.00 H new ATOM 1280 N THR A 201 -14.283 -3.298 -5.623 1.00 0.00 N ATOM 1281 CA THR A 201 -14.422 -1.971 -5.043 1.00 0.00 C ATOM 1282 C THR A 201 -13.347 -1.731 -3.974 1.00 0.00 C ATOM 1283 O THR A 201 -12.698 -0.687 -3.968 1.00 0.00 O ATOM 1284 CB THR A 201 -15.832 -1.854 -4.424 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.797 -2.594 -5.156 1.00 0.00 O ATOM 1286 CG2 THR A 201 -16.282 -0.397 -4.319 1.00 0.00 C ATOM 0 H THR A 201 -15.121 -3.871 -5.523 1.00 0.00 H new ATOM 0 HA THR A 201 -14.292 -1.216 -5.819 1.00 0.00 H new ATOM 0 HB THR A 201 -15.760 -2.275 -3.421 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.675 -2.496 -4.732 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.278 -0.355 -3.879 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.584 0.155 -3.690 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.305 0.049 -5.313 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.126 -2.703 -3.082 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.144 -2.556 -2.010 1.00 0.00 C ATOM 1296 C ASP A 202 -10.725 -2.603 -2.545 1.00 0.00 C ATOM 1297 O ASP A 202 -9.888 -1.840 -2.070 1.00 0.00 O ATOM 1298 CB ASP A 202 -12.329 -3.609 -0.906 1.00 0.00 C ATOM 1299 CG ASP A 202 -13.276 -3.125 0.186 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -13.338 -1.907 0.454 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -14.016 -3.957 0.755 1.00 0.00 O ATOM 0 H ASP A 202 -13.615 -3.598 -3.084 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.316 -1.575 -1.568 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -12.718 -4.529 -1.343 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -11.361 -3.849 -0.467 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.448 -3.417 -3.564 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.193 -3.334 -4.299 1.00 0.00 C ATOM 1308 C VAL A 203 -9.068 -1.933 -4.895 1.00 0.00 C ATOM 1309 O VAL A 203 -8.035 -1.312 -4.707 1.00 0.00 O ATOM 1310 CB VAL A 203 -9.095 -4.486 -5.323 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.863 -4.348 -6.223 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -8.988 -5.845 -4.611 1.00 0.00 C ATOM 0 H VAL A 203 -11.081 -4.143 -3.898 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.335 -3.471 -3.641 1.00 0.00 H new ATOM 0 HB VAL A 203 -10.002 -4.433 -5.926 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.833 -5.179 -6.928 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.917 -3.408 -6.772 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -6.962 -4.359 -5.610 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -8.920 -6.640 -5.353 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -8.097 -5.858 -3.983 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -9.871 -6.002 -3.991 1.00 0.00 H new ATOM 1322 N LYS A 204 -10.083 -1.375 -5.549 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.991 -0.071 -6.217 1.00 0.00 C ATOM 1324 C LYS A 204 -9.711 1.063 -5.236 1.00 0.00 C ATOM 1325 O LYS A 204 -9.026 2.018 -5.613 1.00 0.00 O ATOM 1326 CB LYS A 204 -11.284 0.180 -7.006 1.00 0.00 C ATOM 1327 CG LYS A 204 -11.415 -0.845 -8.144 1.00 0.00 C ATOM 1328 CD LYS A 204 -11.029 -0.263 -9.497 1.00 0.00 C ATOM 1329 CE LYS A 204 -10.499 -1.400 -10.371 1.00 0.00 C ATOM 1330 NZ LYS A 204 -9.061 -1.235 -10.643 1.00 0.00 N ATOM 0 H LYS A 204 -11.000 -1.814 -5.634 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.144 -0.093 -6.903 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -12.145 0.109 -6.341 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.280 1.190 -7.415 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.783 -1.706 -7.928 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -12.442 -1.207 -8.187 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.891 0.209 -9.968 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -10.270 0.510 -9.376 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -10.671 -2.355 -9.874 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -11.049 -1.426 -11.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -8.631 -2.166 -10.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -8.933 -0.634 -11.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -8.602 -0.788 -9.824 1.00 0.00 H new ATOM 1344 N MET A 205 -10.200 0.958 -4.001 1.00 0.00 N ATOM 1345 CA MET A 205 -9.827 1.849 -2.912 1.00 0.00 C ATOM 1346 C MET A 205 -8.390 1.586 -2.489 1.00 0.00 C ATOM 1347 O MET A 205 -7.585 2.514 -2.393 1.00 0.00 O ATOM 1348 CB MET A 205 -10.751 1.620 -1.715 1.00 0.00 C ATOM 1349 CG MET A 205 -12.161 2.115 -1.982 1.00 0.00 C ATOM 1350 SD MET A 205 -12.223 3.892 -2.255 1.00 0.00 S ATOM 1351 CE MET A 205 -13.791 4.023 -3.120 1.00 0.00 C ATOM 0 H MET A 205 -10.874 0.242 -3.729 1.00 0.00 H new ATOM 0 HA MET A 205 -9.920 2.879 -3.257 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.779 0.557 -1.477 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.346 2.132 -0.842 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.564 1.602 -2.855 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.800 1.857 -1.137 1.00 0.00 H new ATOM 0 HE1 MET A 205 -13.798 4.930 -3.725 1.00 0.00 H new ATOM 0 HE2 MET A 205 -13.924 3.155 -3.766 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.604 4.064 -2.395 1.00 0.00 H new ATOM 1361 N MET A 206 -8.065 0.320 -2.221 1.00 0.00 N ATOM 1362 CA MET A 206 -6.753 -0.104 -1.780 1.00 0.00 C ATOM 1363 C MET A 206 -5.696 0.385 -2.774 1.00 0.00 C ATOM 1364 O MET A 206 -4.705 0.952 -2.342 1.00 0.00 O ATOM 1365 CB MET A 206 -6.735 -1.615 -1.513 1.00 0.00 C ATOM 1366 CG MET A 206 -5.357 -2.162 -1.123 1.00 0.00 C ATOM 1367 SD MET A 206 -5.276 -3.856 -0.495 1.00 0.00 S ATOM 1368 CE MET A 206 -6.537 -4.676 -1.502 1.00 0.00 C ATOM 0 H MET A 206 -8.728 -0.450 -2.309 1.00 0.00 H new ATOM 0 HA MET A 206 -6.502 0.353 -0.823 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.443 -1.841 -0.716 1.00 0.00 H new ATOM 0 HB3 MET A 206 -7.082 -2.136 -2.406 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.710 -2.097 -1.998 1.00 0.00 H new ATOM 0 HG3 MET A 206 -4.936 -1.502 -0.365 1.00 0.00 H new ATOM 0 HE1 MET A 206 -6.500 -5.751 -1.326 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.522 -4.297 -1.230 1.00 0.00 H new ATOM 0 HE3 MET A 206 -6.349 -4.474 -2.556 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.951 0.322 -4.081 1.00 0.00 N ATOM 1379 CA GLU A 207 -5.101 0.770 -5.184 1.00 0.00 C ATOM 1380 C GLU A 207 -4.589 2.199 -5.006 1.00 0.00 C ATOM 1381 O GLU A 207 -3.591 2.559 -5.622 1.00 0.00 O ATOM 1382 CB GLU A 207 -5.848 0.606 -6.523 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.864 -0.853 -7.005 1.00 0.00 C ATOM 1384 CD GLU A 207 -6.642 -1.107 -8.305 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -7.171 -0.151 -8.926 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -6.741 -2.285 -8.722 1.00 0.00 O ATOM 0 H GLU A 207 -6.826 -0.075 -4.423 1.00 0.00 H new ATOM 0 HA GLU A 207 -4.214 0.136 -5.187 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.873 0.961 -6.411 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -5.375 1.232 -7.280 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -4.835 -1.183 -7.147 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.292 -1.474 -6.218 1.00 0.00 H new ATOM 1393 N ARG A 208 -5.222 3.003 -4.154 1.00 0.00 N ATOM 1394 CA ARG A 208 -4.749 4.319 -3.765 1.00 0.00 C ATOM 1395 C ARG A 208 -4.176 4.305 -2.355 1.00 0.00 C ATOM 1396 O ARG A 208 -3.124 4.901 -2.134 1.00 0.00 O ATOM 1397 CB ARG A 208 -5.892 5.329 -3.880 1.00 0.00 C ATOM 1398 CG ARG A 208 -6.266 5.653 -5.321 1.00 0.00 C ATOM 1399 CD ARG A 208 -7.186 4.648 -6.011 1.00 0.00 C ATOM 1400 NE ARG A 208 -7.512 5.145 -7.352 1.00 0.00 N ATOM 1401 CZ ARG A 208 -8.010 4.420 -8.362 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -8.388 3.157 -8.183 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -8.130 4.954 -9.570 1.00 0.00 N ATOM 0 H ARG A 208 -6.101 2.745 -3.706 1.00 0.00 H new ATOM 0 HA ARG A 208 -3.944 4.614 -4.439 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -6.768 4.936 -3.364 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -5.607 6.249 -3.370 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -6.748 6.631 -5.340 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -5.349 5.738 -5.904 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -6.699 3.675 -6.078 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -8.097 4.509 -5.429 1.00 0.00 H new ATOM 0 HE ARG A 208 -7.344 6.135 -7.532 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -8.301 2.724 -7.264 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -8.765 2.622 -8.965 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -7.843 5.919 -9.732 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -8.510 4.399 -10.337 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.826 3.635 -1.399 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.340 3.555 -0.017 1.00 0.00 C ATOM 1419 C VAL A 209 -2.906 3.016 0.036 1.00 0.00 C ATOM 1420 O VAL A 209 -2.040 3.637 0.654 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.369 2.810 0.878 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.098 1.324 1.142 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.519 3.473 2.249 1.00 0.00 C ATOM 0 H VAL A 209 -5.700 3.135 -1.559 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.265 4.555 0.410 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.275 2.879 0.276 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.885 0.918 1.778 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.081 0.783 0.196 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.135 1.213 1.641 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.248 2.921 2.843 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.557 3.471 2.761 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.860 4.500 2.121 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.627 1.900 -0.645 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.348 1.209 -0.523 1.00 0.00 C ATOM 1435 C VAL A 210 -0.308 2.065 -1.241 1.00 0.00 C ATOM 1436 O VAL A 210 0.865 2.075 -0.882 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.373 -0.204 -1.160 1.00 0.00 C ATOM 1438 CG1 VAL A 210 -2.654 -0.838 -1.580 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -0.271 -0.602 -2.134 1.00 0.00 C ATOM 0 H VAL A 210 -3.279 1.456 -1.291 1.00 0.00 H new ATOM 0 HA VAL A 210 -1.116 1.074 0.534 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.143 -0.633 -0.185 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -2.452 -1.823 -2.001 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -3.310 -0.941 -0.715 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -3.139 -0.215 -2.331 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -0.444 -1.620 -2.482 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -0.275 0.078 -2.986 1.00 0.00 H new ATOM 0 HG23 VAL A 210 0.695 -0.549 -1.632 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.758 2.729 -2.302 1.00 0.00 N ATOM 1450 CA GLU A 211 0.014 3.592 -3.161 1.00 0.00 C ATOM 1451 C GLU A 211 0.505 4.758 -2.321 1.00 0.00 C ATOM 1452 O GLU A 211 1.691 4.821 -2.055 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.799 4.021 -4.389 1.00 0.00 C ATOM 1454 CG GLU A 211 0.163 4.564 -5.438 1.00 0.00 C ATOM 1455 CD GLU A 211 -0.539 4.977 -6.732 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -1.001 6.139 -6.817 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -0.606 4.157 -7.674 1.00 0.00 O ATOM 0 H GLU A 211 -1.733 2.668 -2.594 1.00 0.00 H new ATOM 0 HA GLU A 211 0.879 3.069 -3.567 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.357 3.174 -4.789 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.529 4.782 -4.113 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.693 5.424 -5.028 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.913 3.806 -5.663 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.379 5.617 -1.814 1.00 0.00 N ATOM 1465 CA GLN A 212 -0.086 6.674 -0.852 1.00 0.00 C ATOM 1466 C GLN A 212 0.838 6.224 0.285 1.00 0.00 C ATOM 1467 O GLN A 212 1.762 6.956 0.661 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.425 7.118 -0.265 1.00 0.00 C ATOM 1469 CG GLN A 212 -2.317 7.843 -1.272 1.00 0.00 C ATOM 1470 CD GLN A 212 -2.144 9.352 -1.176 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -2.317 9.964 -0.122 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.751 9.971 -2.267 1.00 0.00 N ATOM 0 H GLN A 212 -1.364 5.592 -2.076 1.00 0.00 H new ATOM 0 HA GLN A 212 0.438 7.478 -1.368 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.954 6.244 0.116 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.241 7.775 0.585 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.075 7.510 -2.281 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.360 7.582 -1.092 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.613 9.445 -3.130 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.584 10.977 -2.250 1.00 0.00 H new ATOM 1481 N MET A 213 0.587 5.044 0.861 1.00 0.00 N ATOM 1482 CA MET A 213 1.445 4.482 1.900 1.00 0.00 C ATOM 1483 C MET A 213 2.850 4.253 1.331 1.00 0.00 C ATOM 1484 O MET A 213 3.816 4.784 1.876 1.00 0.00 O ATOM 1485 CB MET A 213 0.817 3.203 2.466 1.00 0.00 C ATOM 1486 CG MET A 213 -0.346 3.514 3.423 1.00 0.00 C ATOM 1487 SD MET A 213 -1.603 2.212 3.622 1.00 0.00 S ATOM 1488 CE MET A 213 -0.584 0.716 3.618 1.00 0.00 C ATOM 0 H MET A 213 -0.212 4.458 0.620 1.00 0.00 H new ATOM 0 HA MET A 213 1.539 5.180 2.732 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.457 2.581 1.646 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.578 2.627 2.993 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.071 3.739 4.405 1.00 0.00 H new ATOM 0 HG3 MET A 213 -0.844 4.418 3.073 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.189 -0.137 3.925 1.00 0.00 H new ATOM 0 HE2 MET A 213 -0.196 0.543 2.614 1.00 0.00 H new ATOM 0 HE3 MET A 213 0.247 0.840 4.312 1.00 0.00 H new ATOM 1498 N CYS A 214 2.966 3.532 0.214 1.00 0.00 N ATOM 1499 CA CYS A 214 4.211 3.277 -0.498 1.00 0.00 C ATOM 1500 C CYS A 214 4.901 4.580 -0.905 1.00 0.00 C ATOM 1501 O CYS A 214 6.118 4.659 -0.815 1.00 0.00 O ATOM 1502 CB CYS A 214 3.962 2.406 -1.737 1.00 0.00 C ATOM 1503 SG CYS A 214 5.483 2.015 -2.638 1.00 0.00 S ATOM 0 H CYS A 214 2.161 3.094 -0.234 1.00 0.00 H new ATOM 0 HA CYS A 214 4.871 2.741 0.184 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.477 1.479 -1.432 1.00 0.00 H new ATOM 0 HB3 CYS A 214 3.272 2.921 -2.405 1.00 0.00 H new ATOM 1508 N VAL A 215 4.166 5.607 -1.328 1.00 0.00 N ATOM 1509 CA VAL A 215 4.708 6.883 -1.768 1.00 0.00 C ATOM 1510 C VAL A 215 5.418 7.558 -0.596 1.00 0.00 C ATOM 1511 O VAL A 215 6.502 8.109 -0.771 1.00 0.00 O ATOM 1512 CB VAL A 215 3.595 7.749 -2.402 1.00 0.00 C ATOM 1513 CG1 VAL A 215 4.079 9.174 -2.703 1.00 0.00 C ATOM 1514 CG2 VAL A 215 3.048 7.171 -3.720 1.00 0.00 C ATOM 0 H VAL A 215 3.148 5.569 -1.374 1.00 0.00 H new ATOM 0 HA VAL A 215 5.452 6.735 -2.550 1.00 0.00 H new ATOM 0 HB VAL A 215 2.803 7.757 -1.654 1.00 0.00 H new ATOM 0 HG11 VAL A 215 3.266 9.748 -3.147 1.00 0.00 H new ATOM 0 HG12 VAL A 215 4.398 9.653 -1.777 1.00 0.00 H new ATOM 0 HG13 VAL A 215 4.917 9.134 -3.398 1.00 0.00 H new ATOM 0 HG21 VAL A 215 2.271 7.828 -4.110 1.00 0.00 H new ATOM 0 HG22 VAL A 215 3.857 7.094 -4.447 1.00 0.00 H new ATOM 0 HG23 VAL A 215 2.629 6.182 -3.537 1.00 0.00 H new ATOM 1524 N THR A 216 4.860 7.512 0.610 1.00 0.00 N ATOM 1525 CA THR A 216 5.554 8.014 1.788 1.00 0.00 C ATOM 1526 C THR A 216 6.693 7.069 2.176 1.00 0.00 C ATOM 1527 O THR A 216 7.768 7.552 2.504 1.00 0.00 O ATOM 1528 CB THR A 216 4.505 8.153 2.906 1.00 0.00 C ATOM 1529 OG1 THR A 216 3.622 9.211 2.579 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.027 8.331 4.334 1.00 0.00 C ATOM 0 H THR A 216 3.931 7.133 0.796 1.00 0.00 H new ATOM 0 HA THR A 216 6.014 8.984 1.598 1.00 0.00 H new ATOM 0 HB THR A 216 4.005 7.185 2.936 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.949 9.306 3.285 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.185 8.416 5.021 1.00 0.00 H new ATOM 0 HG22 THR A 216 5.634 7.469 4.610 1.00 0.00 H new ATOM 0 HG23 THR A 216 5.634 9.235 4.390 1.00 0.00 H new ATOM 1538 N GLN A 217 6.500 5.749 2.123 1.00 0.00 N ATOM 1539 CA GLN A 217 7.548 4.778 2.431 1.00 0.00 C ATOM 1540 C GLN A 217 8.765 4.977 1.528 1.00 0.00 C ATOM 1541 O GLN A 217 9.882 4.930 2.025 1.00 0.00 O ATOM 1542 CB GLN A 217 6.992 3.341 2.341 1.00 0.00 C ATOM 1543 CG GLN A 217 6.926 2.642 3.708 1.00 0.00 C ATOM 1544 CD GLN A 217 7.910 1.483 3.801 1.00 0.00 C ATOM 1545 OE1 GLN A 217 7.519 0.330 3.749 1.00 0.00 O ATOM 1546 NE2 GLN A 217 9.200 1.749 3.910 1.00 0.00 N ATOM 0 H GLN A 217 5.609 5.324 1.864 1.00 0.00 H new ATOM 0 HA GLN A 217 7.883 4.941 3.455 1.00 0.00 H new ATOM 0 HB2 GLN A 217 5.994 3.369 1.904 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.618 2.755 1.668 1.00 0.00 H new ATOM 0 HG2 GLN A 217 7.140 3.364 4.496 1.00 0.00 H new ATOM 0 HG3 GLN A 217 5.914 2.274 3.879 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.519 2.717 3.953 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.876 0.987 3.951 1.00 0.00 H new ATOM 1555 N TYR A 218 8.560 5.259 0.241 1.00 0.00 N ATOM 1556 CA TYR A 218 9.587 5.600 -0.731 1.00 0.00 C ATOM 1557 C TYR A 218 10.301 6.868 -0.301 1.00 0.00 C ATOM 1558 O TYR A 218 11.521 6.881 -0.227 1.00 0.00 O ATOM 1559 CB TYR A 218 8.946 5.807 -2.110 1.00 0.00 C ATOM 1560 CG TYR A 218 9.918 6.091 -3.242 1.00 0.00 C ATOM 1561 CD1 TYR A 218 10.840 5.104 -3.637 1.00 0.00 C ATOM 1562 CD2 TYR A 218 9.872 7.316 -3.937 1.00 0.00 C ATOM 1563 CE1 TYR A 218 11.675 5.309 -4.748 1.00 0.00 C ATOM 1564 CE2 TYR A 218 10.706 7.529 -5.050 1.00 0.00 C ATOM 1565 CZ TYR A 218 11.606 6.522 -5.464 1.00 0.00 C ATOM 1566 OH TYR A 218 12.387 6.712 -6.559 1.00 0.00 O ATOM 0 H TYR A 218 7.625 5.254 -0.167 1.00 0.00 H new ATOM 0 HA TYR A 218 10.309 4.786 -0.790 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.371 4.916 -2.362 1.00 0.00 H new ATOM 0 HB3 TYR A 218 8.240 6.635 -2.043 1.00 0.00 H new ATOM 0 HD1 TYR A 218 10.906 4.181 -3.081 1.00 0.00 H new ATOM 0 HD2 TYR A 218 9.195 8.093 -3.615 1.00 0.00 H new ATOM 0 HE1 TYR A 218 12.368 4.539 -5.053 1.00 0.00 H new ATOM 0 HE2 TYR A 218 10.658 8.464 -5.589 1.00 0.00 H new ATOM 0 HH TYR A 218 12.214 7.601 -6.934 1.00 0.00 H new ATOM 1576 N GLN A 219 9.560 7.939 -0.011 1.00 0.00 N ATOM 1577 CA GLN A 219 10.139 9.212 0.396 1.00 0.00 C ATOM 1578 C GLN A 219 10.980 9.038 1.664 1.00 0.00 C ATOM 1579 O GLN A 219 12.108 9.538 1.729 1.00 0.00 O ATOM 1580 CB GLN A 219 9.025 10.263 0.558 1.00 0.00 C ATOM 1581 CG GLN A 219 8.452 10.609 -0.820 1.00 0.00 C ATOM 1582 CD GLN A 219 7.302 11.598 -0.794 1.00 0.00 C ATOM 1583 OE1 GLN A 219 7.480 12.808 -0.873 1.00 0.00 O ATOM 1584 NE2 GLN A 219 6.087 11.093 -0.787 1.00 0.00 N ATOM 0 H GLN A 219 8.541 7.944 -0.053 1.00 0.00 H new ATOM 0 HA GLN A 219 10.816 9.573 -0.378 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.237 9.878 1.206 1.00 0.00 H new ATOM 0 HB3 GLN A 219 9.421 11.159 1.035 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.251 11.017 -1.440 1.00 0.00 H new ATOM 0 HG3 GLN A 219 8.114 9.691 -1.300 1.00 0.00 H new ATOM 0 HE21 GLN A 219 5.955 10.084 -0.721 1.00 0.00 H new ATOM 0 HE22 GLN A 219 5.278 11.711 -0.848 1.00 0.00 H new ATOM 1593 N LYS A 220 10.457 8.306 2.651 1.00 0.00 N ATOM 1594 CA LYS A 220 11.122 7.978 3.891 1.00 0.00 C ATOM 1595 C LYS A 220 12.379 7.180 3.594 1.00 0.00 C ATOM 1596 O LYS A 220 13.439 7.611 4.033 1.00 0.00 O ATOM 1597 CB LYS A 220 10.183 7.230 4.847 1.00 0.00 C ATOM 1598 CG LYS A 220 9.123 8.167 5.454 1.00 0.00 C ATOM 1599 CD LYS A 220 7.918 7.409 6.032 1.00 0.00 C ATOM 1600 CE LYS A 220 8.235 6.469 7.199 1.00 0.00 C ATOM 1601 NZ LYS A 220 8.665 7.178 8.421 1.00 0.00 N ATOM 0 H LYS A 220 9.517 7.914 2.594 1.00 0.00 H new ATOM 0 HA LYS A 220 11.409 8.900 4.397 1.00 0.00 H new ATOM 0 HB2 LYS A 220 9.688 6.420 4.311 1.00 0.00 H new ATOM 0 HB3 LYS A 220 10.766 6.774 5.647 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.582 8.765 6.241 1.00 0.00 H new ATOM 0 HG3 LYS A 220 8.776 8.861 4.688 1.00 0.00 H new ATOM 0 HD2 LYS A 220 7.177 8.136 6.364 1.00 0.00 H new ATOM 0 HD3 LYS A 220 7.458 6.827 5.233 1.00 0.00 H new ATOM 0 HE2 LYS A 220 7.352 5.872 7.426 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.019 5.775 6.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 8.864 6.486 9.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 9.525 7.727 8.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.909 7.821 8.734 1.00 0.00 H new ATOM 1615 N GLU A 221 12.299 6.082 2.846 1.00 0.00 N ATOM 1616 CA GLU A 221 13.438 5.226 2.567 1.00 0.00 C ATOM 1617 C GLU A 221 14.506 5.941 1.747 1.00 0.00 C ATOM 1618 O GLU A 221 15.682 5.811 2.073 1.00 0.00 O ATOM 1619 CB GLU A 221 13.024 3.919 1.871 1.00 0.00 C ATOM 1620 CG GLU A 221 12.704 2.805 2.875 1.00 0.00 C ATOM 1621 CD GLU A 221 13.991 2.264 3.520 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.516 2.931 4.444 1.00 0.00 O ATOM 1623 OE2 GLU A 221 14.514 1.220 3.078 1.00 0.00 O ATOM 0 H GLU A 221 11.431 5.763 2.415 1.00 0.00 H new ATOM 0 HA GLU A 221 13.867 4.973 3.537 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.151 4.103 1.245 1.00 0.00 H new ATOM 0 HB3 GLU A 221 13.827 3.591 1.210 1.00 0.00 H new ATOM 0 HG2 GLU A 221 12.037 3.187 3.648 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.177 1.995 2.371 1.00 0.00 H new ATOM 1630 N SER A 222 14.143 6.710 0.723 1.00 0.00 N ATOM 1631 CA SER A 222 15.095 7.478 -0.052 1.00 0.00 C ATOM 1632 C SER A 222 15.738 8.563 0.791 1.00 0.00 C ATOM 1633 O SER A 222 16.901 8.878 0.554 1.00 0.00 O ATOM 1634 CB SER A 222 14.434 8.126 -1.268 1.00 0.00 C ATOM 1635 OG SER A 222 14.745 7.379 -2.423 1.00 0.00 O ATOM 0 H SER A 222 13.177 6.813 0.412 1.00 0.00 H new ATOM 0 HA SER A 222 15.860 6.779 -0.391 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.354 8.169 -1.129 1.00 0.00 H new ATOM 0 HB3 SER A 222 14.782 9.153 -1.381 1.00 0.00 H new ATOM 0 HG SER A 222 14.321 7.792 -3.204 1.00 0.00 H new ATOM 1641 N GLN A 223 15.052 9.173 1.765 1.00 0.00 N ATOM 1642 CA GLN A 223 15.718 10.055 2.673 1.00 0.00 C ATOM 1643 C GLN A 223 16.631 9.178 3.525 1.00 0.00 C ATOM 1644 O GLN A 223 17.794 9.490 3.705 1.00 0.00 O ATOM 1645 CB GLN A 223 14.610 10.776 3.448 1.00 0.00 C ATOM 1646 CG GLN A 223 15.007 11.201 4.868 1.00 0.00 C ATOM 1647 CD GLN A 223 13.910 10.955 5.912 1.00 0.00 C ATOM 1648 OE1 GLN A 223 13.170 9.856 5.796 1.00 0.00 O flip ATOM 1649 NE2 GLN A 223 13.790 11.688 6.886 1.00 0.00 N flip ATOM 0 H GLN A 223 14.051 9.062 1.927 1.00 0.00 H new ATOM 0 HA GLN A 223 16.345 10.821 2.217 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.307 11.661 2.888 1.00 0.00 H new ATOM 0 HB3 GLN A 223 13.739 10.123 3.507 1.00 0.00 H new ATOM 0 HG2 GLN A 223 15.906 10.659 5.163 1.00 0.00 H new ATOM 0 HG3 GLN A 223 15.261 12.261 4.863 1.00 0.00 H new ATOM 0 HE21 GLN A 223 14.362 12.529 6.965 1.00 0.00 H new ATOM 0 HE22 GLN A 223 13.118 11.458 7.618 1.00 0.00 H new ATOM 1658 N ALA A 224 16.139 8.076 4.076 1.00 0.00 N ATOM 1659 CA ALA A 224 16.898 7.313 5.048 1.00 0.00 C ATOM 1660 C ALA A 224 18.190 6.767 4.437 1.00 0.00 C ATOM 1661 O ALA A 224 19.195 6.698 5.135 1.00 0.00 O ATOM 1662 CB ALA A 224 15.995 6.220 5.628 1.00 0.00 C ATOM 0 H ALA A 224 15.217 7.694 3.864 1.00 0.00 H new ATOM 0 HA ALA A 224 17.216 7.958 5.867 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.553 5.638 6.361 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.132 6.679 6.110 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.656 5.564 4.826 1.00 0.00 H new ATOM 1668 N ALA A 225 18.181 6.501 3.130 1.00 0.00 N ATOM 1669 CA ALA A 225 19.337 6.184 2.315 1.00 0.00 C ATOM 1670 C ALA A 225 20.264 7.401 2.194 1.00 0.00 C ATOM 1671 O ALA A 225 21.416 7.344 2.624 1.00 0.00 O ATOM 1672 CB ALA A 225 18.865 5.704 0.931 1.00 0.00 C ATOM 0 H ALA A 225 17.316 6.503 2.590 1.00 0.00 H new ATOM 0 HA ALA A 225 19.908 5.386 2.789 1.00 0.00 H new ATOM 0 HB1 ALA A 225 19.731 5.464 0.314 1.00 0.00 H new ATOM 0 HB2 ALA A 225 18.244 4.815 1.046 1.00 0.00 H new ATOM 0 HB3 ALA A 225 18.285 6.492 0.451 1.00 0.00 H new ATOM 1678 N ALA A 226 19.772 8.474 1.560 1.00 0.00 N ATOM 1679 CA ALA A 226 20.582 9.596 1.085 1.00 0.00 C ATOM 1680 C ALA A 226 20.885 10.626 2.161 1.00 0.00 C ATOM 1681 O ALA A 226 21.985 11.171 2.225 1.00 0.00 O ATOM 1682 CB ALA A 226 19.837 10.279 -0.070 1.00 0.00 C ATOM 0 H ALA A 226 18.778 8.585 1.360 1.00 0.00 H new ATOM 0 HA ALA A 226 21.541 9.190 0.765 1.00 0.00 H new ATOM 0 HB1 ALA A 226 20.427 11.119 -0.437 1.00 0.00 H new ATOM 0 HB2 ALA A 226 19.683 9.563 -0.877 1.00 0.00 H new ATOM 0 HB3 ALA A 226 18.871 10.641 0.283 1.00 0.00 H new ATOM 1688 N ASP A 227 19.881 10.944 2.963 1.00 0.00 N ATOM 1689 CA ASP A 227 20.009 11.781 4.138 1.00 0.00 C ATOM 1690 C ASP A 227 20.770 11.011 5.211 1.00 0.00 C ATOM 1691 O ASP A 227 21.588 11.565 5.942 1.00 0.00 O ATOM 1692 CB ASP A 227 18.622 12.199 4.652 1.00 0.00 C ATOM 1693 CG ASP A 227 18.667 13.481 5.498 1.00 0.00 C ATOM 1694 OD1 ASP A 227 19.631 13.714 6.264 1.00 0.00 O ATOM 1695 OD2 ASP A 227 17.704 14.272 5.409 1.00 0.00 O ATOM 0 H ASP A 227 18.928 10.615 2.807 1.00 0.00 H new ATOM 0 HA ASP A 227 20.558 12.688 3.884 1.00 0.00 H new ATOM 0 HB2 ASP A 227 17.955 12.351 3.804 1.00 0.00 H new ATOM 0 HB3 ASP A 227 18.200 11.390 5.248 1.00 0.00 H new ATOM 1700 N GLY A 228 20.548 9.695 5.268 1.00 0.00 N ATOM 1701 CA GLY A 228 21.145 8.819 6.259 1.00 0.00 C ATOM 1702 C GLY A 228 20.225 8.596 7.458 1.00 0.00 C ATOM 1703 O GLY A 228 20.662 8.048 8.466 1.00 0.00 O ATOM 0 H GLY A 228 19.937 9.208 4.612 1.00 0.00 H new ATOM 0 HA2 GLY A 228 21.380 7.859 5.799 1.00 0.00 H new ATOM 0 HA3 GLY A 228 22.087 9.248 6.600 1.00 0.00 H new ATOM 1707 N ARG A 229 18.961 9.021 7.367 1.00 0.00 N ATOM 1708 CA ARG A 229 17.915 8.954 8.395 1.00 0.00 C ATOM 1709 C ARG A 229 17.390 7.531 8.538 1.00 0.00 C ATOM 1710 O ARG A 229 16.203 7.278 8.331 1.00 0.00 O ATOM 1711 CB ARG A 229 16.785 9.923 8.002 1.00 0.00 C ATOM 1712 CG ARG A 229 17.237 11.380 7.856 1.00 0.00 C ATOM 1713 CD ARG A 229 17.240 12.122 9.180 1.00 0.00 C ATOM 1714 NE ARG A 229 15.872 12.480 9.570 1.00 0.00 N ATOM 1715 CZ ARG A 229 15.545 13.446 10.426 1.00 0.00 C ATOM 1716 NH1 ARG A 229 16.457 14.056 11.174 1.00 0.00 N ATOM 1717 NH2 ARG A 229 14.271 13.777 10.583 1.00 0.00 N ATOM 0 H ARG A 229 18.616 9.453 6.510 1.00 0.00 H new ATOM 0 HA ARG A 229 18.326 9.245 9.362 1.00 0.00 H new ATOM 0 HB2 ARG A 229 16.348 9.593 7.060 1.00 0.00 H new ATOM 0 HB3 ARG A 229 15.998 9.871 8.754 1.00 0.00 H new ATOM 0 HG2 ARG A 229 18.239 11.405 7.427 1.00 0.00 H new ATOM 0 HG3 ARG A 229 16.577 11.894 7.157 1.00 0.00 H new ATOM 0 HD2 ARG A 229 17.694 11.500 9.952 1.00 0.00 H new ATOM 0 HD3 ARG A 229 17.849 13.022 9.098 1.00 0.00 H new ATOM 0 HE ARG A 229 15.110 11.946 9.152 1.00 0.00 H new ATOM 0 HH11 ARG A 229 17.438 13.788 11.101 1.00 0.00 H new ATOM 0 HH12 ARG A 229 16.176 14.793 11.821 1.00 0.00 H new ATOM 0 HH21 ARG A 229 13.549 13.293 10.050 1.00 0.00 H new ATOM 0 HH22 ARG A 229 14.013 14.516 11.237 1.00 0.00 H new