USER MOD reduce.3.24.130724 H: found=0, std=0, add=805, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 803 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 159 ASN : amide:sc= -0.121 K(o=-1.8,f=-8.5!) USER MOD Set 1.2: A 160 GLN : amide:sc= -1.63 K(o=-1.8,f=-2.3) USER MOD Set 2.1: A 153 ASN : amide:sc= 1.92 K(o=3.2,f=0.17) USER MOD Set 2.2: A 157 TYR OH : rot 88:sc= 1.24 USER MOD Set 3.1: A 129 MET CE :methyl 146:sc= -0.0415 (180deg=-2.42!) USER MOD Set 3.2: A 163 TYR OH : rot 123:sc= 0.422 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl -179:sc= -0.414 (180deg=-0.428) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.166 X(o=-0.17,f=-0.57) USER MOD Single : A 143 ASN : amide:sc= -0.0621 X(o=-0.062,f=0) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 180:sc= -0.0573 USER MOD Single : A 154 MET CE :methyl -147:sc= -0.713 (180deg=-1.01) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= -0.372 X(o=-0.37,f=-0.22) USER MOD Single : A 169 TYR OH : rot 0:sc= 0.584 USER MOD Single : A 170 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 172 GLN :FLIP amide:sc= -0.0502 F(o=-1.7,f=-0.05) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 HIS : no HD1:sc= -0.0037 X(o=-0.0037,f=0) USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 THR OG1 : rot 91:sc= 2.03 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -0.247 X(o=-0.25,f=-0.47) USER MOD Single : A 187 HIS : no HD1:sc= -0.178 X(o=-0.18,f=-0.064) USER MOD Single : A 188 THR OG1 : rot 62:sc= 1.19 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 109:sc= 1.21 USER MOD Single : A 192 THR OG1 : rot 180:sc= 0 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 199 THR OG1 : rot -86:sc= 1.05 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -115:sc= -0.0195 (180deg=-0.8) USER MOD Single : A 206 MET CE :methyl -165:sc= -0.678 (180deg=-1.44) USER MOD Single : A 212 GLN : amide:sc= 0.814 K(o=0.81,f=-0.17) USER MOD Single : A 213 MET CE :methyl -161:sc= -0.678 (180deg=-1.57) USER MOD Single : A 216 THR OG1 : rot 81:sc= 0.211 USER MOD Single : A 217 GLN : amide:sc= 0.311 K(o=0.31,f=-4.1!) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= -0.471 X(o=-0.47,f=0) USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 40 N GLY A 124 1.119 -17.013 -1.294 1.00 0.00 N ATOM 41 CA GLY A 124 1.132 -15.881 -2.203 1.00 0.00 C ATOM 42 C GLY A 124 2.431 -15.112 -2.045 1.00 0.00 C ATOM 43 O GLY A 124 3.265 -15.115 -2.952 1.00 0.00 O ATOM 0 HA2 GLY A 124 1.026 -16.227 -3.231 1.00 0.00 H new ATOM 0 HA3 GLY A 124 0.284 -15.228 -1.997 1.00 0.00 H new ATOM 47 N LEU A 125 2.621 -14.452 -0.901 1.00 0.00 N ATOM 48 CA LEU A 125 3.900 -13.810 -0.610 1.00 0.00 C ATOM 49 C LEU A 125 4.996 -14.863 -0.434 1.00 0.00 C ATOM 50 O LEU A 125 6.108 -14.694 -0.915 1.00 0.00 O ATOM 51 CB LEU A 125 3.822 -12.856 0.594 1.00 0.00 C ATOM 52 CG LEU A 125 3.690 -13.473 1.997 1.00 0.00 C ATOM 53 CD1 LEU A 125 3.772 -12.315 2.993 1.00 0.00 C ATOM 54 CD2 LEU A 125 2.344 -14.168 2.206 1.00 0.00 C ATOM 0 H LEU A 125 1.915 -14.350 -0.172 1.00 0.00 H new ATOM 0 HA LEU A 125 4.158 -13.187 -1.467 1.00 0.00 H new ATOM 0 HB2 LEU A 125 4.717 -12.234 0.586 1.00 0.00 H new ATOM 0 HB3 LEU A 125 2.971 -12.192 0.440 1.00 0.00 H new ATOM 0 HG LEU A 125 4.475 -14.218 2.129 1.00 0.00 H new ATOM 0 HD11 LEU A 125 3.683 -12.701 4.008 1.00 0.00 H new ATOM 0 HD12 LEU A 125 4.729 -11.806 2.881 1.00 0.00 H new ATOM 0 HD13 LEU A 125 2.962 -11.611 2.800 1.00 0.00 H new ATOM 0 HD21 LEU A 125 2.303 -14.586 3.212 1.00 0.00 H new ATOM 0 HD22 LEU A 125 1.538 -13.445 2.080 1.00 0.00 H new ATOM 0 HD23 LEU A 125 2.231 -14.969 1.475 1.00 0.00 H new ATOM 66 N GLY A 126 4.712 -15.956 0.266 1.00 0.00 N ATOM 67 CA GLY A 126 5.714 -16.953 0.586 1.00 0.00 C ATOM 68 C GLY A 126 6.472 -16.544 1.838 1.00 0.00 C ATOM 69 O GLY A 126 6.329 -17.182 2.881 1.00 0.00 O ATOM 0 H GLY A 126 3.782 -16.171 0.624 1.00 0.00 H new ATOM 0 HA2 GLY A 126 5.239 -17.922 0.739 1.00 0.00 H new ATOM 0 HA3 GLY A 126 6.407 -17.065 -0.248 1.00 0.00 H new ATOM 73 N GLY A 127 7.249 -15.468 1.741 1.00 0.00 N ATOM 74 CA GLY A 127 8.052 -14.941 2.832 1.00 0.00 C ATOM 75 C GLY A 127 8.564 -13.553 2.485 1.00 0.00 C ATOM 76 O GLY A 127 9.770 -13.337 2.378 1.00 0.00 O ATOM 0 H GLY A 127 7.337 -14.929 0.880 1.00 0.00 H new ATOM 0 HA2 GLY A 127 7.457 -14.899 3.744 1.00 0.00 H new ATOM 0 HA3 GLY A 127 8.892 -15.607 3.030 1.00 0.00 H new ATOM 80 N TYR A 128 7.645 -12.620 2.234 1.00 0.00 N ATOM 81 CA TYR A 128 7.983 -11.222 1.982 1.00 0.00 C ATOM 82 C TYR A 128 8.314 -10.515 3.288 1.00 0.00 C ATOM 83 O TYR A 128 8.066 -11.010 4.388 1.00 0.00 O ATOM 84 CB TYR A 128 6.850 -10.501 1.223 1.00 0.00 C ATOM 85 CG TYR A 128 6.769 -10.714 -0.283 1.00 0.00 C ATOM 86 CD1 TYR A 128 7.101 -11.944 -0.884 1.00 0.00 C ATOM 87 CD2 TYR A 128 6.306 -9.663 -1.096 1.00 0.00 C ATOM 88 CE1 TYR A 128 6.961 -12.127 -2.271 1.00 0.00 C ATOM 89 CE2 TYR A 128 6.194 -9.825 -2.486 1.00 0.00 C ATOM 90 CZ TYR A 128 6.494 -11.070 -3.079 1.00 0.00 C ATOM 91 OH TYR A 128 6.346 -11.230 -4.421 1.00 0.00 O ATOM 0 H TYR A 128 6.644 -12.814 2.200 1.00 0.00 H new ATOM 0 HA TYR A 128 8.867 -11.192 1.345 1.00 0.00 H new ATOM 0 HB2 TYR A 128 5.901 -10.813 1.659 1.00 0.00 H new ATOM 0 HB3 TYR A 128 6.949 -9.431 1.407 1.00 0.00 H new ATOM 0 HD1 TYR A 128 7.467 -12.755 -0.273 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.033 -8.720 -0.645 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.211 -13.078 -2.718 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.878 -8.996 -3.102 1.00 0.00 H new ATOM 0 HH TYR A 128 6.013 -10.397 -4.815 1.00 0.00 H new ATOM 101 N MET A 129 8.888 -9.336 3.120 1.00 0.00 N ATOM 102 CA MET A 129 9.006 -8.305 4.115 1.00 0.00 C ATOM 103 C MET A 129 7.687 -7.535 4.226 1.00 0.00 C ATOM 104 O MET A 129 6.771 -7.652 3.404 1.00 0.00 O ATOM 105 CB MET A 129 10.146 -7.357 3.695 1.00 0.00 C ATOM 106 CG MET A 129 11.380 -7.530 4.567 1.00 0.00 C ATOM 107 SD MET A 129 11.395 -6.401 5.975 1.00 0.00 S ATOM 108 CE MET A 129 11.980 -4.920 5.113 1.00 0.00 C ATOM 0 H MET A 129 9.306 -9.065 2.230 1.00 0.00 H new ATOM 0 HA MET A 129 9.228 -8.742 5.088 1.00 0.00 H new ATOM 0 HB2 MET A 129 10.408 -7.544 2.654 1.00 0.00 H new ATOM 0 HB3 MET A 129 9.801 -6.325 3.756 1.00 0.00 H new ATOM 0 HG2 MET A 129 11.424 -8.557 4.929 1.00 0.00 H new ATOM 0 HG3 MET A 129 12.273 -7.366 3.964 1.00 0.00 H new ATOM 0 HE1 MET A 129 11.522 -4.036 5.556 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.064 -4.851 5.203 1.00 0.00 H new ATOM 0 HE3 MET A 129 11.707 -4.980 4.059 1.00 0.00 H new ATOM 118 N LEU A 130 7.613 -6.679 5.234 1.00 0.00 N ATOM 119 CA LEU A 130 6.470 -5.855 5.561 1.00 0.00 C ATOM 120 C LEU A 130 7.016 -4.518 6.057 1.00 0.00 C ATOM 121 O LEU A 130 8.080 -4.448 6.674 1.00 0.00 O ATOM 122 CB LEU A 130 5.653 -6.626 6.598 1.00 0.00 C ATOM 123 CG LEU A 130 4.166 -6.247 6.719 1.00 0.00 C ATOM 124 CD1 LEU A 130 3.490 -7.376 7.461 1.00 0.00 C ATOM 125 CD2 LEU A 130 3.940 -4.970 7.493 1.00 0.00 C ATOM 0 H LEU A 130 8.392 -6.537 5.877 1.00 0.00 H new ATOM 0 HA LEU A 130 5.808 -5.641 4.722 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.716 -7.688 6.362 1.00 0.00 H new ATOM 0 HB3 LEU A 130 6.121 -6.488 7.573 1.00 0.00 H new ATOM 0 HG LEU A 130 3.767 -6.087 5.718 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.429 -7.154 7.573 1.00 0.00 H new ATOM 0 HD12 LEU A 130 3.610 -8.303 6.900 1.00 0.00 H new ATOM 0 HD13 LEU A 130 3.943 -7.487 8.446 1.00 0.00 H new ATOM 0 HD21 LEU A 130 2.872 -4.759 7.542 1.00 0.00 H new ATOM 0 HD22 LEU A 130 4.335 -5.082 8.503 1.00 0.00 H new ATOM 0 HD23 LEU A 130 4.450 -4.147 6.993 1.00 0.00 H new ATOM 137 N GLY A 131 6.317 -3.446 5.712 1.00 0.00 N ATOM 138 CA GLY A 131 6.692 -2.086 6.089 1.00 0.00 C ATOM 139 C GLY A 131 6.306 -1.809 7.536 1.00 0.00 C ATOM 140 O GLY A 131 5.696 -2.661 8.185 1.00 0.00 O ATOM 0 H GLY A 131 5.463 -3.494 5.156 1.00 0.00 H new ATOM 0 HA2 GLY A 131 7.766 -1.949 5.960 1.00 0.00 H new ATOM 0 HA3 GLY A 131 6.198 -1.371 5.431 1.00 0.00 H new ATOM 144 N SER A 132 6.590 -0.613 8.045 1.00 0.00 N ATOM 145 CA SER A 132 6.037 -0.221 9.335 1.00 0.00 C ATOM 146 C SER A 132 4.769 0.596 9.164 1.00 0.00 C ATOM 147 O SER A 132 4.500 1.149 8.094 1.00 0.00 O ATOM 148 CB SER A 132 7.081 0.485 10.198 1.00 0.00 C ATOM 149 OG SER A 132 8.287 -0.253 10.219 1.00 0.00 O ATOM 0 H SER A 132 7.184 0.085 7.597 1.00 0.00 H new ATOM 0 HA SER A 132 5.755 -1.127 9.871 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.267 1.486 9.808 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.702 0.603 11.213 1.00 0.00 H new ATOM 0 HG SER A 132 8.946 0.213 10.775 1.00 0.00 H new ATOM 155 N ALA A 133 3.970 0.615 10.229 1.00 0.00 N ATOM 156 CA ALA A 133 2.690 1.283 10.242 1.00 0.00 C ATOM 157 C ALA A 133 2.874 2.784 10.079 1.00 0.00 C ATOM 158 O ALA A 133 3.816 3.365 10.629 1.00 0.00 O ATOM 159 CB ALA A 133 1.951 0.938 11.530 1.00 0.00 C ATOM 0 H ALA A 133 4.204 0.160 11.111 1.00 0.00 H new ATOM 0 HA ALA A 133 2.087 0.939 9.401 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.984 1.442 11.541 1.00 0.00 H new ATOM 0 HB2 ALA A 133 1.799 -0.140 11.585 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.540 1.265 12.386 1.00 0.00 H new ATOM 165 N MET A 134 1.963 3.406 9.340 1.00 0.00 N ATOM 166 CA MET A 134 1.993 4.819 9.010 1.00 0.00 C ATOM 167 C MET A 134 0.605 5.438 9.168 1.00 0.00 C ATOM 168 O MET A 134 -0.415 4.748 9.235 1.00 0.00 O ATOM 169 CB MET A 134 2.538 4.961 7.582 1.00 0.00 C ATOM 170 CG MET A 134 1.618 4.314 6.536 1.00 0.00 C ATOM 171 SD MET A 134 2.461 3.280 5.311 1.00 0.00 S ATOM 172 CE MET A 134 3.412 4.537 4.433 1.00 0.00 C ATOM 0 H MET A 134 1.158 2.921 8.943 1.00 0.00 H new ATOM 0 HA MET A 134 2.647 5.361 9.693 1.00 0.00 H new ATOM 0 HB2 MET A 134 2.663 6.018 7.347 1.00 0.00 H new ATOM 0 HB3 MET A 134 3.526 4.503 7.526 1.00 0.00 H new ATOM 0 HG2 MET A 134 0.876 3.706 7.053 1.00 0.00 H new ATOM 0 HG3 MET A 134 1.076 5.102 6.013 1.00 0.00 H new ATOM 0 HE1 MET A 134 3.979 4.068 3.628 1.00 0.00 H new ATOM 0 HE2 MET A 134 2.733 5.280 4.014 1.00 0.00 H new ATOM 0 HE3 MET A 134 4.099 5.023 5.125 1.00 0.00 H new ATOM 182 N SER A 135 0.551 6.769 9.159 1.00 0.00 N ATOM 183 CA SER A 135 -0.681 7.535 9.362 1.00 0.00 C ATOM 184 C SER A 135 -1.509 7.661 8.073 1.00 0.00 C ATOM 185 O SER A 135 -2.587 8.259 8.098 1.00 0.00 O ATOM 186 CB SER A 135 -0.303 8.894 9.961 1.00 0.00 C ATOM 187 OG SER A 135 -1.257 9.359 10.889 1.00 0.00 O ATOM 0 H SER A 135 1.372 7.355 9.009 1.00 0.00 H new ATOM 0 HA SER A 135 -1.332 7.006 10.058 1.00 0.00 H new ATOM 0 HB2 SER A 135 0.667 8.814 10.451 1.00 0.00 H new ATOM 0 HB3 SER A 135 -0.196 9.624 9.159 1.00 0.00 H new ATOM 0 HG SER A 135 -0.972 10.227 11.244 1.00 0.00 H new ATOM 193 N ARG A 136 -1.007 7.070 6.978 1.00 0.00 N ATOM 194 CA ARG A 136 -1.477 7.127 5.588 1.00 0.00 C ATOM 195 C ARG A 136 -1.471 8.567 5.029 1.00 0.00 C ATOM 196 O ARG A 136 -1.594 9.529 5.800 1.00 0.00 O ATOM 197 CB ARG A 136 -2.891 6.522 5.437 1.00 0.00 C ATOM 198 CG ARG A 136 -3.086 4.999 5.514 1.00 0.00 C ATOM 199 CD ARG A 136 -3.163 4.402 6.928 1.00 0.00 C ATOM 200 NE ARG A 136 -4.070 3.233 6.971 1.00 0.00 N ATOM 201 CZ ARG A 136 -5.333 3.196 7.428 1.00 0.00 C ATOM 202 NH1 ARG A 136 -5.892 4.238 8.033 1.00 0.00 N ATOM 203 NH2 ARG A 136 -6.061 2.094 7.285 1.00 0.00 N ATOM 0 H ARG A 136 -0.178 6.481 7.053 1.00 0.00 H new ATOM 0 HA ARG A 136 -0.773 6.530 5.008 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.519 6.969 6.208 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.284 6.851 4.475 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -4.002 4.742 4.982 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -2.264 4.520 4.983 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -2.166 4.104 7.254 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -3.513 5.162 7.627 1.00 0.00 H new ATOM 0 HE ARG A 136 -3.693 2.355 6.613 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.360 5.099 8.162 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -6.853 4.178 8.369 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -5.661 1.274 6.828 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -7.020 2.067 7.632 1.00 0.00 H new ATOM 217 N PRO A 137 -1.334 8.758 3.709 1.00 0.00 N ATOM 218 CA PRO A 137 -1.866 9.927 3.029 1.00 0.00 C ATOM 219 C PRO A 137 -3.362 9.749 2.773 1.00 0.00 C ATOM 220 O PRO A 137 -3.866 8.633 2.663 1.00 0.00 O ATOM 221 CB PRO A 137 -1.061 10.029 1.735 1.00 0.00 C ATOM 222 CG PRO A 137 -0.698 8.581 1.402 1.00 0.00 C ATOM 223 CD PRO A 137 -0.784 7.826 2.738 1.00 0.00 C ATOM 0 HA PRO A 137 -1.774 10.842 3.615 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -1.646 10.486 0.937 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -0.170 10.642 1.868 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -1.386 8.162 0.668 1.00 0.00 H new ATOM 0 HG3 PRO A 137 0.303 8.514 0.976 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -1.419 6.945 2.645 1.00 0.00 H new ATOM 0 HD3 PRO A 137 0.201 7.478 3.050 1.00 0.00 H new ATOM 231 N LEU A 138 -4.076 10.864 2.701 1.00 0.00 N ATOM 232 CA LEU A 138 -5.479 11.020 2.397 1.00 0.00 C ATOM 233 C LEU A 138 -5.527 11.703 1.029 1.00 0.00 C ATOM 234 O LEU A 138 -4.898 12.755 0.865 1.00 0.00 O ATOM 235 CB LEU A 138 -6.143 11.878 3.503 1.00 0.00 C ATOM 236 CG LEU A 138 -7.337 11.180 4.159 1.00 0.00 C ATOM 237 CD1 LEU A 138 -7.885 11.944 5.365 1.00 0.00 C ATOM 238 CD2 LEU A 138 -8.494 10.978 3.193 1.00 0.00 C ATOM 0 H LEU A 138 -3.636 11.768 2.872 1.00 0.00 H new ATOM 0 HA LEU A 138 -6.021 10.075 2.365 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -5.402 12.115 4.267 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -6.472 12.824 3.074 1.00 0.00 H new ATOM 0 HG LEU A 138 -6.940 10.217 4.481 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -8.730 11.400 5.787 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.104 12.043 6.119 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -8.213 12.935 5.050 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -9.315 10.479 3.708 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.832 11.946 2.823 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.165 10.364 2.355 1.00 0.00 H new ATOM 250 N ILE A 139 -6.188 11.089 0.046 1.00 0.00 N ATOM 251 CA ILE A 139 -6.145 11.468 -1.367 1.00 0.00 C ATOM 252 C ILE A 139 -7.580 11.558 -1.881 1.00 0.00 C ATOM 253 O ILE A 139 -8.433 10.712 -1.594 1.00 0.00 O ATOM 254 CB ILE A 139 -5.315 10.460 -2.209 1.00 0.00 C ATOM 255 CG1 ILE A 139 -3.919 10.222 -1.608 1.00 0.00 C ATOM 256 CG2 ILE A 139 -5.140 10.937 -3.665 1.00 0.00 C ATOM 257 CD1 ILE A 139 -3.198 9.014 -2.220 1.00 0.00 C ATOM 0 H ILE A 139 -6.790 10.284 0.219 1.00 0.00 H new ATOM 0 HA ILE A 139 -5.650 12.434 -1.466 1.00 0.00 H new ATOM 0 HB ILE A 139 -5.880 9.528 -2.196 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -3.310 11.114 -1.755 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -4.014 10.074 -0.532 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -4.554 10.204 -4.220 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -6.119 11.048 -4.132 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -4.623 11.897 -3.674 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -2.219 8.900 -1.754 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -3.788 8.114 -2.050 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -3.074 9.169 -3.292 1.00 0.00 H new ATOM 269 N HIS A 140 -7.836 12.589 -2.669 1.00 0.00 N ATOM 270 CA HIS A 140 -9.115 12.817 -3.325 1.00 0.00 C ATOM 271 C HIS A 140 -9.252 11.952 -4.586 1.00 0.00 C ATOM 272 O HIS A 140 -8.263 11.565 -5.213 1.00 0.00 O ATOM 273 CB HIS A 140 -9.241 14.303 -3.691 1.00 0.00 C ATOM 274 CG HIS A 140 -8.283 14.715 -4.782 1.00 0.00 C ATOM 275 ND1 HIS A 140 -6.948 15.007 -4.618 1.00 0.00 N ATOM 276 CD2 HIS A 140 -8.541 14.689 -6.123 1.00 0.00 C ATOM 277 CE1 HIS A 140 -6.401 15.137 -5.837 1.00 0.00 C ATOM 278 NE2 HIS A 140 -7.341 14.965 -6.786 1.00 0.00 N ATOM 0 H HIS A 140 -7.144 13.309 -2.876 1.00 0.00 H new ATOM 0 HA HIS A 140 -9.914 12.538 -2.638 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -10.262 14.509 -4.012 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -9.058 14.909 -2.804 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -9.496 14.492 -6.586 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -5.359 15.349 -6.029 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -7.204 15.025 -7.795 1.00 0.00 H new ATOM 286 N PHE A 141 -10.491 11.763 -5.046 1.00 0.00 N ATOM 287 CA PHE A 141 -10.814 11.121 -6.330 1.00 0.00 C ATOM 288 C PHE A 141 -11.915 11.859 -7.086 1.00 0.00 C ATOM 289 O PHE A 141 -12.082 11.672 -8.288 1.00 0.00 O ATOM 290 CB PHE A 141 -11.335 9.704 -6.090 1.00 0.00 C ATOM 291 CG PHE A 141 -10.393 8.772 -5.373 1.00 0.00 C ATOM 292 CD1 PHE A 141 -10.273 8.840 -3.972 1.00 0.00 C ATOM 293 CD2 PHE A 141 -9.653 7.827 -6.105 1.00 0.00 C ATOM 294 CE1 PHE A 141 -9.378 7.988 -3.310 1.00 0.00 C ATOM 295 CE2 PHE A 141 -8.785 6.952 -5.436 1.00 0.00 C ATOM 296 CZ PHE A 141 -8.626 7.061 -4.046 1.00 0.00 C ATOM 0 H PHE A 141 -11.319 12.057 -4.527 1.00 0.00 H new ATOM 0 HA PHE A 141 -9.893 11.129 -6.913 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -12.259 9.769 -5.515 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -11.589 9.263 -7.054 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -10.868 9.545 -3.410 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -9.753 7.775 -7.179 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -9.268 8.045 -2.237 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -8.242 6.199 -5.987 1.00 0.00 H new ATOM 0 HZ PHE A 141 -7.917 6.424 -3.538 1.00 0.00 H new ATOM 306 N GLY A 142 -12.696 12.651 -6.361 1.00 0.00 N ATOM 307 CA GLY A 142 -13.946 13.247 -6.777 1.00 0.00 C ATOM 308 C GLY A 142 -14.316 14.273 -5.725 1.00 0.00 C ATOM 309 O GLY A 142 -15.405 14.223 -5.161 1.00 0.00 O ATOM 0 H GLY A 142 -12.451 12.907 -5.405 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -13.843 13.717 -7.755 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.724 12.489 -6.868 1.00 0.00 H new ATOM 313 N ASN A 143 -13.358 15.151 -5.425 1.00 0.00 N ATOM 314 CA ASN A 143 -13.462 16.275 -4.505 1.00 0.00 C ATOM 315 C ASN A 143 -13.760 15.770 -3.101 1.00 0.00 C ATOM 316 O ASN A 143 -13.658 14.577 -2.818 1.00 0.00 O ATOM 317 CB ASN A 143 -14.499 17.319 -5.001 1.00 0.00 C ATOM 318 CG ASN A 143 -14.425 17.631 -6.489 1.00 0.00 C ATOM 319 OD1 ASN A 143 -15.448 17.789 -7.151 1.00 0.00 O ATOM 320 ND2 ASN A 143 -13.236 17.691 -7.061 1.00 0.00 N ATOM 0 H ASN A 143 -12.432 15.088 -5.847 1.00 0.00 H new ATOM 0 HA ASN A 143 -12.505 16.796 -4.471 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -15.500 16.955 -4.769 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -14.359 18.244 -4.442 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -13.160 17.870 -8.062 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -12.394 17.558 -6.501 1.00 0.00 H new ATOM 327 N ASP A 144 -14.177 16.688 -2.238 1.00 0.00 N ATOM 328 CA ASP A 144 -14.771 16.466 -0.923 1.00 0.00 C ATOM 329 C ASP A 144 -15.929 15.465 -0.934 1.00 0.00 C ATOM 330 O ASP A 144 -16.425 15.106 0.128 1.00 0.00 O ATOM 331 CB ASP A 144 -15.238 17.823 -0.364 1.00 0.00 C ATOM 332 CG ASP A 144 -14.681 18.091 1.035 1.00 0.00 C ATOM 333 OD1 ASP A 144 -15.024 17.364 1.995 1.00 0.00 O ATOM 334 OD2 ASP A 144 -13.871 19.033 1.199 1.00 0.00 O ATOM 0 H ASP A 144 -14.104 17.682 -2.454 1.00 0.00 H new ATOM 0 HA ASP A 144 -14.007 16.022 -0.285 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -14.923 18.620 -1.038 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -16.327 17.845 -0.331 1.00 0.00 H new ATOM 339 N TYR A 145 -16.371 14.985 -2.097 1.00 0.00 N ATOM 340 CA TYR A 145 -17.274 13.864 -2.190 1.00 0.00 C ATOM 341 C TYR A 145 -16.530 12.580 -1.892 1.00 0.00 C ATOM 342 O TYR A 145 -16.734 11.977 -0.836 1.00 0.00 O ATOM 343 CB TYR A 145 -18.028 13.879 -3.533 1.00 0.00 C ATOM 344 CG TYR A 145 -19.502 13.544 -3.469 1.00 0.00 C ATOM 345 CD1 TYR A 145 -20.406 14.508 -2.988 1.00 0.00 C ATOM 346 CD2 TYR A 145 -19.987 12.326 -3.984 1.00 0.00 C ATOM 347 CE1 TYR A 145 -21.789 14.268 -3.033 1.00 0.00 C ATOM 348 CE2 TYR A 145 -21.371 12.085 -4.049 1.00 0.00 C ATOM 349 CZ TYR A 145 -22.280 13.064 -3.583 1.00 0.00 C ATOM 350 OH TYR A 145 -23.625 12.884 -3.701 1.00 0.00 O ATOM 0 H TYR A 145 -16.104 15.374 -3.001 1.00 0.00 H new ATOM 0 HA TYR A 145 -18.054 13.940 -1.432 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -17.919 14.868 -3.977 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -17.544 13.172 -4.207 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -20.035 15.437 -2.582 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -19.293 11.574 -4.330 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -22.477 15.005 -2.647 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -21.739 11.154 -4.454 1.00 0.00 H new ATOM 0 HH TYR A 145 -23.804 12.006 -4.098 1.00 0.00 H new ATOM 360 N GLU A 146 -15.652 12.174 -2.795 1.00 0.00 N ATOM 361 CA GLU A 146 -15.019 10.875 -2.734 1.00 0.00 C ATOM 362 C GLU A 146 -13.842 10.867 -1.766 1.00 0.00 C ATOM 363 O GLU A 146 -13.375 9.807 -1.357 1.00 0.00 O ATOM 364 CB GLU A 146 -14.550 10.528 -4.121 1.00 0.00 C ATOM 365 CG GLU A 146 -15.740 10.212 -5.016 1.00 0.00 C ATOM 366 CD GLU A 146 -16.165 8.748 -4.924 1.00 0.00 C ATOM 367 OE1 GLU A 146 -16.666 8.296 -3.877 1.00 0.00 O ATOM 368 OE2 GLU A 146 -16.039 8.053 -5.965 1.00 0.00 O ATOM 0 H GLU A 146 -15.360 12.741 -3.591 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.736 10.140 -2.369 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -13.982 11.359 -4.539 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -13.878 9.671 -4.081 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -16.579 10.849 -4.738 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.487 10.450 -6.049 1.00 0.00 H new ATOM 375 N ASP A 147 -13.353 12.056 -1.419 1.00 0.00 N ATOM 376 CA ASP A 147 -12.242 12.198 -0.465 1.00 0.00 C ATOM 377 C ASP A 147 -12.737 11.782 0.925 1.00 0.00 C ATOM 378 O ASP A 147 -12.145 10.982 1.653 1.00 0.00 O ATOM 379 CB ASP A 147 -11.801 13.665 -0.503 1.00 0.00 C ATOM 380 CG ASP A 147 -10.511 14.025 0.226 1.00 0.00 C ATOM 381 OD1 ASP A 147 -9.818 13.168 0.803 1.00 0.00 O ATOM 382 OD2 ASP A 147 -10.179 15.235 0.196 1.00 0.00 O ATOM 0 H ASP A 147 -13.707 12.941 -1.783 1.00 0.00 H new ATOM 0 HA ASP A 147 -11.392 11.564 -0.716 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -11.692 13.958 -1.547 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -12.605 14.270 -0.085 1.00 0.00 H new ATOM 387 N ARG A 148 -13.937 12.258 1.248 1.00 0.00 N ATOM 388 CA ARG A 148 -14.703 11.935 2.414 1.00 0.00 C ATOM 389 C ARG A 148 -15.187 10.494 2.332 1.00 0.00 C ATOM 390 O ARG A 148 -15.102 9.784 3.326 1.00 0.00 O ATOM 391 CB ARG A 148 -15.814 12.980 2.424 1.00 0.00 C ATOM 392 CG ARG A 148 -17.038 12.610 3.236 1.00 0.00 C ATOM 393 CD ARG A 148 -18.168 11.991 2.405 1.00 0.00 C ATOM 394 NE ARG A 148 -18.624 12.875 1.319 1.00 0.00 N ATOM 395 CZ ARG A 148 -19.495 13.890 1.403 1.00 0.00 C ATOM 396 NH1 ARG A 148 -19.919 14.340 2.582 1.00 0.00 N ATOM 397 NH2 ARG A 148 -19.943 14.456 0.287 1.00 0.00 N ATOM 0 H ARG A 148 -14.420 12.926 0.648 1.00 0.00 H new ATOM 0 HA ARG A 148 -14.147 11.974 3.351 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -15.409 13.915 2.812 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -16.123 13.169 1.396 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -16.746 11.907 4.016 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -17.414 13.503 3.736 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -17.826 11.047 1.980 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -19.010 11.761 3.058 1.00 0.00 H new ATOM 0 HE ARG A 148 -18.231 12.694 0.395 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -19.581 13.911 3.443 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -20.582 15.114 2.624 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -19.624 14.117 -0.620 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -20.606 15.229 0.338 1.00 0.00 H new ATOM 411 N TYR A 149 -15.670 10.041 1.173 1.00 0.00 N ATOM 412 CA TYR A 149 -16.064 8.644 1.003 1.00 0.00 C ATOM 413 C TYR A 149 -14.933 7.725 1.449 1.00 0.00 C ATOM 414 O TYR A 149 -15.160 6.836 2.265 1.00 0.00 O ATOM 415 CB TYR A 149 -16.453 8.327 -0.443 1.00 0.00 C ATOM 416 CG TYR A 149 -16.897 6.889 -0.656 1.00 0.00 C ATOM 417 CD1 TYR A 149 -18.201 6.476 -0.319 1.00 0.00 C ATOM 418 CD2 TYR A 149 -15.980 5.953 -1.165 1.00 0.00 C ATOM 419 CE1 TYR A 149 -18.594 5.140 -0.512 1.00 0.00 C ATOM 420 CE2 TYR A 149 -16.362 4.617 -1.363 1.00 0.00 C ATOM 421 CZ TYR A 149 -17.674 4.208 -1.040 1.00 0.00 C ATOM 422 OH TYR A 149 -18.068 2.935 -1.310 1.00 0.00 O ATOM 0 H TYR A 149 -15.797 10.620 0.343 1.00 0.00 H new ATOM 0 HA TYR A 149 -16.943 8.475 1.625 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -17.258 8.995 -0.748 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -15.603 8.535 -1.092 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -18.902 7.189 0.089 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -14.974 6.264 -1.405 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -19.596 4.828 -0.257 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -15.655 3.904 -1.761 1.00 0.00 H new ATOM 0 HH TYR A 149 -17.311 2.427 -1.669 1.00 0.00 H new ATOM 432 N TYR A 150 -13.712 7.943 0.959 1.00 0.00 N ATOM 433 CA TYR A 150 -12.548 7.160 1.340 1.00 0.00 C ATOM 434 C TYR A 150 -12.338 7.235 2.848 1.00 0.00 C ATOM 435 O TYR A 150 -12.245 6.190 3.490 1.00 0.00 O ATOM 436 CB TYR A 150 -11.346 7.694 0.549 1.00 0.00 C ATOM 437 CG TYR A 150 -9.995 7.183 0.997 1.00 0.00 C ATOM 438 CD1 TYR A 150 -9.466 6.018 0.432 1.00 0.00 C ATOM 439 CD2 TYR A 150 -9.239 7.906 1.933 1.00 0.00 C ATOM 440 CE1 TYR A 150 -8.222 5.529 0.859 1.00 0.00 C ATOM 441 CE2 TYR A 150 -7.949 7.480 2.318 1.00 0.00 C ATOM 442 CZ TYR A 150 -7.471 6.242 1.820 1.00 0.00 C ATOM 443 OH TYR A 150 -6.300 5.714 2.256 1.00 0.00 O ATOM 0 H TYR A 150 -13.507 8.676 0.280 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.683 6.105 1.101 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -11.482 7.438 -0.502 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -11.344 8.782 0.615 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.016 5.493 -0.335 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -9.652 8.805 2.367 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -7.838 4.605 0.452 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -7.341 8.083 2.976 1.00 0.00 H new ATOM 0 HH TYR A 150 -5.895 6.316 2.914 1.00 0.00 H new ATOM 453 N ARG A 151 -12.330 8.425 3.458 1.00 0.00 N ATOM 454 CA ARG A 151 -12.092 8.526 4.898 1.00 0.00 C ATOM 455 C ARG A 151 -13.202 7.912 5.757 1.00 0.00 C ATOM 456 O ARG A 151 -12.967 7.641 6.938 1.00 0.00 O ATOM 457 CB ARG A 151 -11.726 9.963 5.289 1.00 0.00 C ATOM 458 CG ARG A 151 -12.906 10.859 5.656 1.00 0.00 C ATOM 459 CD ARG A 151 -12.462 12.321 5.750 1.00 0.00 C ATOM 460 NE ARG A 151 -12.258 12.733 7.140 1.00 0.00 N ATOM 461 CZ ARG A 151 -12.279 14.020 7.505 1.00 0.00 C ATOM 462 NH1 ARG A 151 -11.973 14.967 6.627 1.00 0.00 N ATOM 463 NH2 ARG A 151 -12.609 14.352 8.742 1.00 0.00 N ATOM 0 H ARG A 151 -12.483 9.316 2.986 1.00 0.00 H new ATOM 0 HA ARG A 151 -11.227 7.903 5.123 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -11.040 9.928 6.135 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -11.187 10.422 4.460 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.692 10.759 4.908 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.330 10.540 6.608 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -11.537 12.458 5.190 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -13.213 12.961 5.287 1.00 0.00 H new ATOM 0 HE ARG A 151 -12.095 12.019 7.850 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -11.721 14.714 5.671 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -11.990 15.947 6.908 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -12.848 13.627 9.418 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -12.625 15.333 9.020 1.00 0.00 H new ATOM 477 N GLU A 152 -14.366 7.618 5.175 1.00 0.00 N ATOM 478 CA GLU A 152 -15.443 6.918 5.868 1.00 0.00 C ATOM 479 C GLU A 152 -15.052 5.456 6.034 1.00 0.00 C ATOM 480 O GLU A 152 -15.385 4.851 7.055 1.00 0.00 O ATOM 481 CB GLU A 152 -16.801 6.978 5.135 1.00 0.00 C ATOM 482 CG GLU A 152 -17.639 8.244 5.411 1.00 0.00 C ATOM 483 CD GLU A 152 -19.133 7.919 5.503 1.00 0.00 C ATOM 484 OE1 GLU A 152 -19.515 7.117 6.394 1.00 0.00 O ATOM 485 OE2 GLU A 152 -19.938 8.490 4.732 1.00 0.00 O ATOM 0 H GLU A 152 -14.586 7.860 4.209 1.00 0.00 H new ATOM 0 HA GLU A 152 -15.575 7.422 6.826 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -16.621 6.907 4.062 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -17.388 6.104 5.418 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -17.308 8.705 6.342 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -17.472 8.972 4.617 1.00 0.00 H new ATOM 492 N ASN A 153 -14.375 4.870 5.041 1.00 0.00 N ATOM 493 CA ASN A 153 -14.157 3.433 4.958 1.00 0.00 C ATOM 494 C ASN A 153 -12.684 3.033 4.946 1.00 0.00 C ATOM 495 O ASN A 153 -12.384 1.846 4.850 1.00 0.00 O ATOM 496 CB ASN A 153 -14.948 2.844 3.782 1.00 0.00 C ATOM 497 CG ASN A 153 -14.365 3.068 2.404 1.00 0.00 C ATOM 498 OD1 ASN A 153 -13.820 2.151 1.795 1.00 0.00 O ATOM 499 ND2 ASN A 153 -14.536 4.247 1.849 1.00 0.00 N ATOM 0 H ASN A 153 -13.961 5.390 4.267 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.542 2.995 5.879 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -15.049 1.770 3.941 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -15.953 3.265 3.801 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -14.214 4.413 0.896 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -14.991 4.996 2.372 1.00 0.00 H new ATOM 506 N MET A 154 -11.750 3.971 5.117 1.00 0.00 N ATOM 507 CA MET A 154 -10.324 3.687 5.269 1.00 0.00 C ATOM 508 C MET A 154 -9.934 2.773 6.439 1.00 0.00 C ATOM 509 O MET A 154 -8.783 2.344 6.531 1.00 0.00 O ATOM 510 CB MET A 154 -9.534 4.997 5.277 1.00 0.00 C ATOM 511 CG MET A 154 -9.939 5.941 6.416 1.00 0.00 C ATOM 512 SD MET A 154 -9.096 7.536 6.533 1.00 0.00 S ATOM 513 CE MET A 154 -7.422 6.914 6.611 1.00 0.00 C ATOM 0 H MET A 154 -11.969 4.967 5.154 1.00 0.00 H new ATOM 0 HA MET A 154 -10.055 3.089 4.398 1.00 0.00 H new ATOM 0 HB2 MET A 154 -8.471 4.772 5.361 1.00 0.00 H new ATOM 0 HB3 MET A 154 -9.677 5.506 4.324 1.00 0.00 H new ATOM 0 HG2 MET A 154 -11.008 6.134 6.326 1.00 0.00 H new ATOM 0 HG3 MET A 154 -9.788 5.413 7.358 1.00 0.00 H new ATOM 0 HE1 MET A 154 -6.818 7.572 7.236 1.00 0.00 H new ATOM 0 HE2 MET A 154 -7.426 5.911 7.037 1.00 0.00 H new ATOM 0 HE3 MET A 154 -6.999 6.880 5.607 1.00 0.00 H new ATOM 523 N TYR A 155 -10.877 2.396 7.298 1.00 0.00 N ATOM 524 CA TYR A 155 -10.727 1.339 8.289 1.00 0.00 C ATOM 525 C TYR A 155 -10.333 0.003 7.648 1.00 0.00 C ATOM 526 O TYR A 155 -9.628 -0.803 8.254 1.00 0.00 O ATOM 527 CB TYR A 155 -12.061 1.222 9.040 1.00 0.00 C ATOM 528 CG TYR A 155 -12.509 2.515 9.697 1.00 0.00 C ATOM 529 CD1 TYR A 155 -11.582 3.242 10.457 1.00 0.00 C ATOM 530 CD2 TYR A 155 -13.788 3.053 9.462 1.00 0.00 C ATOM 531 CE1 TYR A 155 -11.881 4.539 10.888 1.00 0.00 C ATOM 532 CE2 TYR A 155 -14.114 4.338 9.931 1.00 0.00 C ATOM 533 CZ TYR A 155 -13.140 5.105 10.612 1.00 0.00 C ATOM 534 OH TYR A 155 -13.406 6.388 10.973 1.00 0.00 O ATOM 0 H TYR A 155 -11.798 2.834 7.323 1.00 0.00 H new ATOM 0 HA TYR A 155 -9.920 1.590 8.977 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -12.832 0.893 8.343 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -11.971 0.449 9.804 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -10.631 2.798 10.711 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -14.522 2.476 8.919 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -11.143 5.108 11.434 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -15.105 4.738 9.772 1.00 0.00 H new ATOM 0 HH TYR A 155 -14.320 6.620 10.707 1.00 0.00 H new ATOM 544 N ARG A 156 -10.768 -0.226 6.409 1.00 0.00 N ATOM 545 CA ARG A 156 -10.664 -1.502 5.694 1.00 0.00 C ATOM 546 C ARG A 156 -9.312 -1.730 5.039 1.00 0.00 C ATOM 547 O ARG A 156 -9.035 -2.797 4.489 1.00 0.00 O ATOM 548 CB ARG A 156 -11.765 -1.506 4.628 1.00 0.00 C ATOM 549 CG ARG A 156 -13.101 -1.288 5.329 1.00 0.00 C ATOM 550 CD ARG A 156 -14.304 -1.538 4.422 1.00 0.00 C ATOM 551 NE ARG A 156 -15.415 -2.158 5.154 1.00 0.00 N ATOM 552 CZ ARG A 156 -16.672 -2.316 4.731 1.00 0.00 C ATOM 553 NH1 ARG A 156 -17.092 -1.746 3.604 1.00 0.00 N ATOM 554 NH2 ARG A 156 -17.495 -3.039 5.475 1.00 0.00 N ATOM 0 H ARG A 156 -11.220 0.499 5.853 1.00 0.00 H new ATOM 0 HA ARG A 156 -10.777 -2.312 6.415 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.587 -0.720 3.894 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -11.768 -2.452 4.087 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.162 -1.949 6.194 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -13.144 -0.266 5.705 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.635 -0.594 3.988 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -14.008 -2.183 3.594 1.00 0.00 H new ATOM 0 HE ARG A 156 -15.204 -2.507 6.089 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -16.451 -1.179 3.050 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -18.055 -1.876 3.295 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -17.163 -3.457 6.344 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -18.461 -3.178 5.179 1.00 0.00 H new ATOM 568 N TYR A 157 -8.517 -0.677 5.030 1.00 0.00 N ATOM 569 CA TYR A 157 -7.267 -0.571 4.277 1.00 0.00 C ATOM 570 C TYR A 157 -6.043 -0.825 5.171 1.00 0.00 C ATOM 571 O TYR A 157 -6.103 -0.554 6.372 1.00 0.00 O ATOM 572 CB TYR A 157 -7.202 0.805 3.603 1.00 0.00 C ATOM 573 CG TYR A 157 -8.376 1.192 2.714 1.00 0.00 C ATOM 574 CD1 TYR A 157 -9.088 0.226 1.981 1.00 0.00 C ATOM 575 CD2 TYR A 157 -8.703 2.551 2.549 1.00 0.00 C ATOM 576 CE1 TYR A 157 -10.193 0.590 1.191 1.00 0.00 C ATOM 577 CE2 TYR A 157 -9.826 2.919 1.791 1.00 0.00 C ATOM 578 CZ TYR A 157 -10.573 1.945 1.101 1.00 0.00 C ATOM 579 OH TYR A 157 -11.619 2.327 0.324 1.00 0.00 O ATOM 0 H TYR A 157 -8.726 0.165 5.566 1.00 0.00 H new ATOM 0 HA TYR A 157 -7.249 -1.343 3.508 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.103 1.560 4.383 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -6.293 0.846 3.002 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -8.782 -0.809 2.025 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.089 3.312 3.006 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.749 -0.165 0.655 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.119 3.957 1.737 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.449 2.271 0.842 1.00 0.00 H new ATOM 589 N PRO A 158 -4.893 -1.274 4.631 1.00 0.00 N ATOM 590 CA PRO A 158 -3.714 -1.561 5.440 1.00 0.00 C ATOM 591 C PRO A 158 -3.125 -0.267 5.997 1.00 0.00 C ATOM 592 O PRO A 158 -3.383 0.844 5.517 1.00 0.00 O ATOM 593 CB PRO A 158 -2.733 -2.285 4.511 1.00 0.00 C ATOM 594 CG PRO A 158 -3.080 -1.704 3.156 1.00 0.00 C ATOM 595 CD PRO A 158 -4.598 -1.532 3.232 1.00 0.00 C ATOM 0 HA PRO A 158 -3.950 -2.182 6.304 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.696 -2.089 4.783 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -2.871 -3.366 4.537 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.575 -0.754 2.983 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.790 -2.372 2.345 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.931 -0.707 2.603 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -5.112 -2.427 2.882 1.00 0.00 H new ATOM 603 N ASN A 159 -2.287 -0.429 7.008 1.00 0.00 N ATOM 604 CA ASN A 159 -1.605 0.606 7.763 1.00 0.00 C ATOM 605 C ASN A 159 -0.117 0.563 7.445 1.00 0.00 C ATOM 606 O ASN A 159 0.573 1.515 7.770 1.00 0.00 O ATOM 607 CB ASN A 159 -1.826 0.386 9.272 1.00 0.00 C ATOM 608 CG ASN A 159 -1.282 -0.968 9.723 1.00 0.00 C ATOM 609 OD1 ASN A 159 -1.536 -1.977 9.081 1.00 0.00 O ATOM 610 ND2 ASN A 159 -0.477 -1.039 10.761 1.00 0.00 N ATOM 0 H ASN A 159 -2.048 -1.361 7.347 1.00 0.00 H new ATOM 0 HA ASN A 159 -2.007 1.581 7.487 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -1.336 1.182 9.833 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -2.891 0.446 9.498 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -0.067 -1.934 11.028 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -0.263 -0.199 11.299 1.00 0.00 H new ATOM 617 N GLN A 160 0.381 -0.494 6.803 1.00 0.00 N ATOM 618 CA GLN A 160 1.742 -0.636 6.294 1.00 0.00 C ATOM 619 C GLN A 160 1.646 -1.104 4.827 1.00 0.00 C ATOM 620 O GLN A 160 0.554 -1.120 4.258 1.00 0.00 O ATOM 621 CB GLN A 160 2.531 -1.652 7.128 1.00 0.00 C ATOM 622 CG GLN A 160 2.070 -1.917 8.565 1.00 0.00 C ATOM 623 CD GLN A 160 1.185 -3.141 8.763 1.00 0.00 C ATOM 624 OE1 GLN A 160 1.026 -3.574 9.900 1.00 0.00 O ATOM 625 NE2 GLN A 160 0.619 -3.742 7.724 1.00 0.00 N ATOM 0 H GLN A 160 -0.188 -1.319 6.615 1.00 0.00 H new ATOM 0 HA GLN A 160 2.268 0.317 6.358 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.521 -2.602 6.594 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.568 -1.319 7.166 1.00 0.00 H new ATOM 0 HG2 GLN A 160 2.953 -2.025 9.196 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.529 -1.040 8.921 1.00 0.00 H new ATOM 0 HE21 GLN A 160 0.758 -3.373 6.783 1.00 0.00 H new ATOM 0 HE22 GLN A 160 0.045 -4.573 7.866 1.00 0.00 H new ATOM 634 N VAL A 161 2.730 -1.607 4.229 1.00 0.00 N ATOM 635 CA VAL A 161 2.717 -2.306 2.935 1.00 0.00 C ATOM 636 C VAL A 161 3.425 -3.669 3.058 1.00 0.00 C ATOM 637 O VAL A 161 3.995 -3.952 4.112 1.00 0.00 O ATOM 638 CB VAL A 161 3.297 -1.391 1.839 1.00 0.00 C ATOM 639 CG1 VAL A 161 2.435 -0.125 1.696 1.00 0.00 C ATOM 640 CG2 VAL A 161 4.759 -0.997 2.114 1.00 0.00 C ATOM 0 H VAL A 161 3.662 -1.540 4.638 1.00 0.00 H new ATOM 0 HA VAL A 161 1.693 -2.529 2.634 1.00 0.00 H new ATOM 0 HB VAL A 161 3.281 -1.958 0.908 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.854 0.514 0.919 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.417 -0.406 1.425 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.422 0.415 2.643 1.00 0.00 H new ATOM 0 HG21 VAL A 161 5.119 -0.352 1.312 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.820 -0.464 3.063 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.375 -1.895 2.162 1.00 0.00 H new ATOM 650 N TYR A 162 3.363 -4.518 2.031 1.00 0.00 N ATOM 651 CA TYR A 162 4.014 -5.822 1.917 1.00 0.00 C ATOM 652 C TYR A 162 4.891 -5.838 0.672 1.00 0.00 C ATOM 653 O TYR A 162 4.448 -5.415 -0.395 1.00 0.00 O ATOM 654 CB TYR A 162 2.959 -6.921 1.759 1.00 0.00 C ATOM 655 CG TYR A 162 2.646 -7.672 3.024 1.00 0.00 C ATOM 656 CD1 TYR A 162 3.558 -8.636 3.491 1.00 0.00 C ATOM 657 CD2 TYR A 162 1.429 -7.454 3.693 1.00 0.00 C ATOM 658 CE1 TYR A 162 3.209 -9.457 4.571 1.00 0.00 C ATOM 659 CE2 TYR A 162 1.105 -8.227 4.822 1.00 0.00 C ATOM 660 CZ TYR A 162 1.992 -9.238 5.255 1.00 0.00 C ATOM 661 OH TYR A 162 1.696 -9.999 6.345 1.00 0.00 O ATOM 0 H TYR A 162 2.817 -4.296 1.198 1.00 0.00 H new ATOM 0 HA TYR A 162 4.608 -5.996 2.814 1.00 0.00 H new ATOM 0 HB2 TYR A 162 2.040 -6.473 1.381 1.00 0.00 H new ATOM 0 HB3 TYR A 162 3.302 -7.630 1.006 1.00 0.00 H new ATOM 0 HD1 TYR A 162 4.523 -8.743 3.019 1.00 0.00 H new ATOM 0 HD2 TYR A 162 0.745 -6.696 3.341 1.00 0.00 H new ATOM 0 HE1 TYR A 162 3.868 -10.255 4.880 1.00 0.00 H new ATOM 0 HE2 TYR A 162 0.183 -8.049 5.355 1.00 0.00 H new ATOM 0 HH TYR A 162 0.826 -9.728 6.706 1.00 0.00 H new ATOM 671 N TYR A 163 6.117 -6.350 0.788 1.00 0.00 N ATOM 672 CA TYR A 163 7.113 -6.272 -0.302 1.00 0.00 C ATOM 673 C TYR A 163 8.358 -7.098 0.024 1.00 0.00 C ATOM 674 O TYR A 163 8.489 -7.510 1.161 1.00 0.00 O ATOM 675 CB TYR A 163 7.542 -4.812 -0.519 1.00 0.00 C ATOM 676 CG TYR A 163 8.425 -4.207 0.562 1.00 0.00 C ATOM 677 CD1 TYR A 163 8.100 -4.323 1.929 1.00 0.00 C ATOM 678 CD2 TYR A 163 9.596 -3.521 0.183 1.00 0.00 C ATOM 679 CE1 TYR A 163 8.937 -3.779 2.901 1.00 0.00 C ATOM 680 CE2 TYR A 163 10.421 -2.925 1.152 1.00 0.00 C ATOM 681 CZ TYR A 163 10.078 -3.059 2.511 1.00 0.00 C ATOM 682 OH TYR A 163 10.708 -2.371 3.482 1.00 0.00 O ATOM 0 H TYR A 163 6.453 -6.826 1.625 1.00 0.00 H new ATOM 0 HA TYR A 163 6.646 -6.669 -1.203 1.00 0.00 H new ATOM 0 HB2 TYR A 163 8.071 -4.747 -1.470 1.00 0.00 H new ATOM 0 HB3 TYR A 163 6.644 -4.201 -0.611 1.00 0.00 H new ATOM 0 HD1 TYR A 163 7.197 -4.837 2.224 1.00 0.00 H new ATOM 0 HD2 TYR A 163 9.862 -3.453 -0.862 1.00 0.00 H new ATOM 0 HE1 TYR A 163 8.710 -3.910 3.949 1.00 0.00 H new ATOM 0 HE2 TYR A 163 11.303 -2.374 0.859 1.00 0.00 H new ATOM 0 HH TYR A 163 11.644 -2.658 3.532 1.00 0.00 H new ATOM 692 N ARG A 164 9.306 -7.329 -0.890 1.00 0.00 N ATOM 693 CA ARG A 164 10.644 -7.800 -0.480 1.00 0.00 C ATOM 694 C ARG A 164 11.520 -6.590 -0.154 1.00 0.00 C ATOM 695 O ARG A 164 11.304 -5.545 -0.761 1.00 0.00 O ATOM 696 CB ARG A 164 11.318 -8.637 -1.575 1.00 0.00 C ATOM 697 CG ARG A 164 10.589 -9.923 -1.980 1.00 0.00 C ATOM 698 CD ARG A 164 9.519 -9.748 -3.065 1.00 0.00 C ATOM 699 NE ARG A 164 9.976 -8.969 -4.230 1.00 0.00 N ATOM 700 CZ ARG A 164 10.877 -9.354 -5.146 1.00 0.00 C ATOM 701 NH1 ARG A 164 11.511 -10.517 -5.044 1.00 0.00 N ATOM 702 NH2 ARG A 164 11.187 -8.531 -6.138 1.00 0.00 N ATOM 0 H ARG A 164 9.183 -7.203 -1.895 1.00 0.00 H new ATOM 0 HA ARG A 164 10.524 -8.436 0.397 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.434 -8.014 -2.462 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.320 -8.901 -1.238 1.00 0.00 H new ATOM 0 HG2 ARG A 164 11.326 -10.645 -2.331 1.00 0.00 H new ATOM 0 HG3 ARG A 164 10.120 -10.351 -1.094 1.00 0.00 H new ATOM 0 HD2 ARG A 164 9.193 -10.732 -3.403 1.00 0.00 H new ATOM 0 HD3 ARG A 164 8.650 -9.256 -2.629 1.00 0.00 H new ATOM 0 HE ARG A 164 9.565 -8.043 -4.352 1.00 0.00 H new ATOM 0 HH11 ARG A 164 11.316 -11.137 -4.258 1.00 0.00 H new ATOM 0 HH12 ARG A 164 12.193 -10.790 -5.752 1.00 0.00 H new ATOM 0 HH21 ARG A 164 10.742 -7.615 -6.199 1.00 0.00 H new ATOM 0 HH22 ARG A 164 11.871 -8.813 -6.840 1.00 0.00 H new ATOM 716 N PRO A 165 12.531 -6.700 0.725 1.00 0.00 N ATOM 717 CA PRO A 165 13.338 -5.547 1.106 1.00 0.00 C ATOM 718 C PRO A 165 14.134 -5.011 -0.080 1.00 0.00 C ATOM 719 O PRO A 165 14.431 -5.740 -1.031 1.00 0.00 O ATOM 720 CB PRO A 165 14.256 -6.031 2.227 1.00 0.00 C ATOM 721 CG PRO A 165 14.330 -7.546 2.051 1.00 0.00 C ATOM 722 CD PRO A 165 13.024 -7.918 1.357 1.00 0.00 C ATOM 0 HA PRO A 165 12.714 -4.718 1.440 1.00 0.00 H new ATOM 0 HB2 PRO A 165 15.244 -5.576 2.152 1.00 0.00 H new ATOM 0 HB3 PRO A 165 13.857 -5.766 3.206 1.00 0.00 H new ATOM 0 HG2 PRO A 165 15.193 -7.833 1.451 1.00 0.00 H new ATOM 0 HG3 PRO A 165 14.427 -8.052 3.011 1.00 0.00 H new ATOM 0 HD2 PRO A 165 13.187 -8.701 0.616 1.00 0.00 H new ATOM 0 HD3 PRO A 165 12.300 -8.304 2.074 1.00 0.00 H new ATOM 730 N VAL A 166 14.557 -3.750 0.044 1.00 0.00 N ATOM 731 CA VAL A 166 15.432 -3.027 -0.881 1.00 0.00 C ATOM 732 C VAL A 166 16.714 -3.803 -1.217 1.00 0.00 C ATOM 733 O VAL A 166 17.294 -3.594 -2.280 1.00 0.00 O ATOM 734 CB VAL A 166 15.704 -1.617 -0.312 1.00 0.00 C ATOM 735 CG1 VAL A 166 16.211 -1.651 1.133 1.00 0.00 C ATOM 736 CG2 VAL A 166 16.680 -0.802 -1.167 1.00 0.00 C ATOM 0 H VAL A 166 14.281 -3.174 0.839 1.00 0.00 H new ATOM 0 HA VAL A 166 14.925 -2.921 -1.840 1.00 0.00 H new ATOM 0 HB VAL A 166 14.733 -1.123 -0.333 1.00 0.00 H new ATOM 0 HG11 VAL A 166 16.385 -0.633 1.481 1.00 0.00 H new ATOM 0 HG12 VAL A 166 15.466 -2.130 1.769 1.00 0.00 H new ATOM 0 HG13 VAL A 166 17.143 -2.215 1.178 1.00 0.00 H new ATOM 0 HG21 VAL A 166 16.829 0.178 -0.714 1.00 0.00 H new ATOM 0 HG22 VAL A 166 17.635 -1.324 -1.226 1.00 0.00 H new ATOM 0 HG23 VAL A 166 16.271 -0.680 -2.170 1.00 0.00 H new ATOM 746 N ASP A 167 17.085 -4.763 -0.374 1.00 0.00 N ATOM 747 CA ASP A 167 18.171 -5.734 -0.499 1.00 0.00 C ATOM 748 C ASP A 167 18.153 -6.575 -1.794 1.00 0.00 C ATOM 749 O ASP A 167 18.964 -7.482 -1.954 1.00 0.00 O ATOM 750 CB ASP A 167 18.097 -6.628 0.745 1.00 0.00 C ATOM 751 CG ASP A 167 19.312 -7.535 0.991 1.00 0.00 C ATOM 752 OD1 ASP A 167 20.440 -7.215 0.559 1.00 0.00 O ATOM 753 OD2 ASP A 167 19.125 -8.585 1.670 1.00 0.00 O ATOM 0 H ASP A 167 16.582 -4.894 0.503 1.00 0.00 H new ATOM 0 HA ASP A 167 19.113 -5.190 -0.567 1.00 0.00 H new ATOM 0 HB2 ASP A 167 17.960 -5.991 1.619 1.00 0.00 H new ATOM 0 HB3 ASP A 167 17.209 -7.256 0.666 1.00 0.00 H new ATOM 758 N GLN A 168 17.217 -6.351 -2.725 1.00 0.00 N ATOM 759 CA GLN A 168 17.247 -6.906 -4.073 1.00 0.00 C ATOM 760 C GLN A 168 16.767 -5.948 -5.169 1.00 0.00 C ATOM 761 O GLN A 168 16.598 -6.398 -6.306 1.00 0.00 O ATOM 762 CB GLN A 168 16.438 -8.201 -4.055 1.00 0.00 C ATOM 763 CG GLN A 168 14.976 -8.078 -3.591 1.00 0.00 C ATOM 764 CD GLN A 168 14.749 -9.079 -2.475 1.00 0.00 C ATOM 765 OE1 GLN A 168 14.526 -10.265 -2.711 1.00 0.00 O ATOM 766 NE2 GLN A 168 14.886 -8.645 -1.237 1.00 0.00 N ATOM 0 H GLN A 168 16.401 -5.764 -2.552 1.00 0.00 H new ATOM 0 HA GLN A 168 18.287 -7.096 -4.339 1.00 0.00 H new ATOM 0 HB2 GLN A 168 16.445 -8.624 -5.059 1.00 0.00 H new ATOM 0 HB3 GLN A 168 16.946 -8.914 -3.405 1.00 0.00 H new ATOM 0 HG2 GLN A 168 14.772 -7.066 -3.242 1.00 0.00 H new ATOM 0 HG3 GLN A 168 14.296 -8.272 -4.420 1.00 0.00 H new ATOM 0 HE21 GLN A 168 15.071 -7.658 -1.060 1.00 0.00 H new ATOM 0 HE22 GLN A 168 14.807 -9.297 -0.456 1.00 0.00 H new ATOM 775 N TYR A 169 16.523 -4.667 -4.868 1.00 0.00 N ATOM 776 CA TYR A 169 15.827 -3.739 -5.760 1.00 0.00 C ATOM 777 C TYR A 169 16.745 -2.684 -6.366 1.00 0.00 C ATOM 778 O TYR A 169 17.737 -2.275 -5.763 1.00 0.00 O ATOM 779 CB TYR A 169 14.684 -3.049 -5.005 1.00 0.00 C ATOM 780 CG TYR A 169 13.407 -3.849 -5.041 1.00 0.00 C ATOM 781 CD1 TYR A 169 12.705 -3.943 -6.252 1.00 0.00 C ATOM 782 CD2 TYR A 169 12.937 -4.530 -3.906 1.00 0.00 C ATOM 783 CE1 TYR A 169 11.531 -4.701 -6.323 1.00 0.00 C ATOM 784 CE2 TYR A 169 11.760 -5.292 -3.979 1.00 0.00 C ATOM 785 CZ TYR A 169 11.034 -5.362 -5.186 1.00 0.00 C ATOM 786 OH TYR A 169 9.878 -6.072 -5.291 1.00 0.00 O ATOM 0 H TYR A 169 16.808 -4.243 -3.985 1.00 0.00 H new ATOM 0 HA TYR A 169 15.437 -4.334 -6.586 1.00 0.00 H new ATOM 0 HB2 TYR A 169 14.981 -2.890 -3.968 1.00 0.00 H new ATOM 0 HB3 TYR A 169 14.506 -2.066 -5.440 1.00 0.00 H new ATOM 0 HD1 TYR A 169 13.071 -3.430 -7.129 1.00 0.00 H new ATOM 0 HD2 TYR A 169 13.482 -4.467 -2.976 1.00 0.00 H new ATOM 0 HE1 TYR A 169 11.001 -4.779 -7.261 1.00 0.00 H new ATOM 0 HE2 TYR A 169 11.410 -5.826 -3.108 1.00 0.00 H new ATOM 0 HH TYR A 169 9.539 -6.012 -6.209 1.00 0.00 H new ATOM 796 N ASN A 170 16.358 -2.193 -7.546 1.00 0.00 N ATOM 797 CA ASN A 170 17.090 -1.182 -8.304 1.00 0.00 C ATOM 798 C ASN A 170 16.254 0.077 -8.548 1.00 0.00 C ATOM 799 O ASN A 170 16.732 1.185 -8.304 1.00 0.00 O ATOM 800 CB ASN A 170 17.568 -1.781 -9.630 1.00 0.00 C ATOM 801 CG ASN A 170 18.129 -0.691 -10.514 1.00 0.00 C ATOM 802 OD1 ASN A 170 19.037 0.037 -10.136 1.00 0.00 O ATOM 803 ND2 ASN A 170 17.562 -0.522 -11.689 1.00 0.00 N ATOM 0 H ASN A 170 15.503 -2.498 -8.011 1.00 0.00 H new ATOM 0 HA ASN A 170 17.952 -0.876 -7.711 1.00 0.00 H new ATOM 0 HB2 ASN A 170 18.330 -2.538 -9.444 1.00 0.00 H new ATOM 0 HB3 ASN A 170 16.740 -2.279 -10.134 1.00 0.00 H new ATOM 0 HD21 ASN A 170 17.878 0.227 -12.305 1.00 0.00 H new ATOM 0 HD22 ASN A 170 16.807 -1.140 -11.984 1.00 0.00 H new ATOM 810 N ASN A 171 15.015 -0.084 -9.030 1.00 0.00 N ATOM 811 CA ASN A 171 14.097 1.025 -9.270 1.00 0.00 C ATOM 812 C ASN A 171 13.014 0.922 -8.211 1.00 0.00 C ATOM 813 O ASN A 171 12.539 -0.186 -7.954 1.00 0.00 O ATOM 814 CB ASN A 171 13.397 0.905 -10.641 1.00 0.00 C ATOM 815 CG ASN A 171 14.327 0.696 -11.824 1.00 0.00 C ATOM 816 OD1 ASN A 171 15.203 1.500 -12.102 1.00 0.00 O ATOM 817 ND2 ASN A 171 14.126 -0.369 -12.584 1.00 0.00 N ATOM 0 H ASN A 171 14.623 -0.996 -9.264 1.00 0.00 H new ATOM 0 HA ASN A 171 14.653 1.962 -9.243 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.693 0.073 -10.601 1.00 0.00 H new ATOM 0 HB3 ASN A 171 12.813 1.809 -10.813 1.00 0.00 H new ATOM 0 HD21 ASN A 171 14.705 -0.523 -13.409 1.00 0.00 H new ATOM 0 HD22 ASN A 171 13.392 -1.035 -12.344 1.00 0.00 H new ATOM 824 N GLN A 172 12.467 2.034 -7.723 1.00 0.00 N ATOM 825 CA GLN A 172 11.175 1.953 -7.051 1.00 0.00 C ATOM 826 C GLN A 172 10.096 1.510 -8.049 1.00 0.00 C ATOM 827 O GLN A 172 9.106 0.923 -7.642 1.00 0.00 O ATOM 828 CB GLN A 172 10.783 3.283 -6.387 1.00 0.00 C ATOM 829 CG GLN A 172 10.487 4.369 -7.426 1.00 0.00 C ATOM 830 CD GLN A 172 9.043 4.855 -7.478 1.00 0.00 C ATOM 831 OE1 GLN A 172 8.083 3.993 -7.751 1.00 0.00 O flip ATOM 832 NE2 GLN A 172 8.765 6.033 -7.308 1.00 0.00 N flip ATOM 0 H GLN A 172 12.879 2.966 -7.776 1.00 0.00 H new ATOM 0 HA GLN A 172 11.259 1.213 -6.256 1.00 0.00 H new ATOM 0 HB2 GLN A 172 9.905 3.131 -5.759 1.00 0.00 H new ATOM 0 HB3 GLN A 172 11.589 3.615 -5.733 1.00 0.00 H new ATOM 0 HG2 GLN A 172 11.132 5.224 -7.225 1.00 0.00 H new ATOM 0 HG3 GLN A 172 10.759 3.989 -8.411 1.00 0.00 H new ATOM 0 HE21 GLN A 172 9.502 6.706 -7.096 1.00 0.00 H new ATOM 0 HE22 GLN A 172 7.796 6.343 -7.378 1.00 0.00 H new ATOM 841 N ASN A 173 10.237 1.779 -9.356 1.00 0.00 N ATOM 842 CA ASN A 173 9.175 1.529 -10.330 1.00 0.00 C ATOM 843 C ASN A 173 8.942 0.041 -10.559 1.00 0.00 C ATOM 844 O ASN A 173 7.908 -0.354 -11.083 1.00 0.00 O ATOM 845 CB ASN A 173 9.479 2.244 -11.653 1.00 0.00 C ATOM 846 CG ASN A 173 8.486 3.386 -11.815 1.00 0.00 C ATOM 847 OD1 ASN A 173 7.410 3.214 -12.381 1.00 0.00 O ATOM 848 ND2 ASN A 173 8.763 4.531 -11.223 1.00 0.00 N ATOM 0 H ASN A 173 11.086 2.173 -9.761 1.00 0.00 H new ATOM 0 HA ASN A 173 8.252 1.935 -9.915 1.00 0.00 H new ATOM 0 HB2 ASN A 173 10.500 2.625 -11.653 1.00 0.00 H new ATOM 0 HB3 ASN A 173 9.398 1.549 -12.488 1.00 0.00 H new ATOM 0 HD21 ASN A 173 8.079 5.288 -11.231 1.00 0.00 H new ATOM 0 HD22 ASN A 173 9.661 4.660 -10.757 1.00 0.00 H new ATOM 855 N THR A 174 9.894 -0.784 -10.134 1.00 0.00 N ATOM 856 CA THR A 174 9.782 -2.250 -10.196 1.00 0.00 C ATOM 857 C THR A 174 9.440 -2.848 -8.820 1.00 0.00 C ATOM 858 O THR A 174 9.171 -4.040 -8.689 1.00 0.00 O ATOM 859 CB THR A 174 11.059 -2.793 -10.855 1.00 0.00 C ATOM 860 OG1 THR A 174 10.900 -4.031 -11.508 1.00 0.00 O ATOM 861 CG2 THR A 174 12.270 -2.934 -9.945 1.00 0.00 C ATOM 0 H THR A 174 10.774 -0.459 -9.733 1.00 0.00 H new ATOM 0 HA THR A 174 8.943 -2.561 -10.818 1.00 0.00 H new ATOM 0 HB THR A 174 11.249 -2.000 -11.578 1.00 0.00 H new ATOM 0 HG1 THR A 174 11.755 -4.306 -11.901 1.00 0.00 H new ATOM 0 HG21 THR A 174 13.111 -3.325 -10.517 1.00 0.00 H new ATOM 0 HG22 THR A 174 12.532 -1.959 -9.535 1.00 0.00 H new ATOM 0 HG23 THR A 174 12.035 -3.619 -9.130 1.00 0.00 H new ATOM 869 N PHE A 175 9.432 -2.010 -7.786 1.00 0.00 N ATOM 870 CA PHE A 175 9.061 -2.344 -6.426 1.00 0.00 C ATOM 871 C PHE A 175 7.603 -1.960 -6.204 1.00 0.00 C ATOM 872 O PHE A 175 6.834 -2.814 -5.796 1.00 0.00 O ATOM 873 CB PHE A 175 10.002 -1.607 -5.466 1.00 0.00 C ATOM 874 CG PHE A 175 9.363 -1.132 -4.184 1.00 0.00 C ATOM 875 CD1 PHE A 175 8.931 -2.054 -3.215 1.00 0.00 C ATOM 876 CD2 PHE A 175 9.089 0.237 -4.027 1.00 0.00 C ATOM 877 CE1 PHE A 175 8.204 -1.595 -2.104 1.00 0.00 C ATOM 878 CE2 PHE A 175 8.328 0.680 -2.940 1.00 0.00 C ATOM 879 CZ PHE A 175 7.892 -0.237 -1.971 1.00 0.00 C ATOM 0 H PHE A 175 9.699 -1.031 -7.887 1.00 0.00 H new ATOM 0 HA PHE A 175 9.157 -3.414 -6.241 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.833 -2.268 -5.217 1.00 0.00 H new ATOM 0 HB3 PHE A 175 10.424 -0.746 -5.985 1.00 0.00 H new ATOM 0 HD1 PHE A 175 9.156 -3.105 -3.323 1.00 0.00 H new ATOM 0 HD2 PHE A 175 9.466 0.948 -4.747 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.883 -2.295 -1.347 1.00 0.00 H new ATOM 0 HE2 PHE A 175 8.076 1.726 -2.847 1.00 0.00 H new ATOM 0 HZ PHE A 175 7.316 0.105 -1.124 1.00 0.00 H new ATOM 889 N VAL A 176 7.203 -0.710 -6.457 1.00 0.00 N ATOM 890 CA VAL A 176 5.857 -0.219 -6.177 1.00 0.00 C ATOM 891 C VAL A 176 4.847 -1.054 -6.955 1.00 0.00 C ATOM 892 O VAL A 176 3.914 -1.596 -6.362 1.00 0.00 O ATOM 893 CB VAL A 176 5.738 1.276 -6.532 1.00 0.00 C ATOM 894 CG1 VAL A 176 4.295 1.759 -6.337 1.00 0.00 C ATOM 895 CG2 VAL A 176 6.670 2.136 -5.671 1.00 0.00 C ATOM 0 H VAL A 176 7.815 -0.005 -6.867 1.00 0.00 H new ATOM 0 HA VAL A 176 5.649 -0.317 -5.112 1.00 0.00 H new ATOM 0 HB VAL A 176 6.028 1.383 -7.577 1.00 0.00 H new ATOM 0 HG11 VAL A 176 4.228 2.817 -6.592 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.629 1.187 -6.983 1.00 0.00 H new ATOM 0 HG13 VAL A 176 4.001 1.617 -5.297 1.00 0.00 H new ATOM 0 HG21 VAL A 176 6.559 3.184 -5.950 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.412 2.011 -4.619 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.703 1.826 -5.831 1.00 0.00 H new ATOM 905 N HIS A 177 5.080 -1.210 -8.264 1.00 0.00 N ATOM 906 CA HIS A 177 4.209 -1.964 -9.151 1.00 0.00 C ATOM 907 C HIS A 177 4.102 -3.442 -8.742 1.00 0.00 C ATOM 908 O HIS A 177 3.329 -4.182 -9.352 1.00 0.00 O ATOM 909 CB HIS A 177 4.740 -1.865 -10.594 1.00 0.00 C ATOM 910 CG HIS A 177 4.524 -0.546 -11.305 1.00 0.00 C ATOM 911 ND1 HIS A 177 4.853 -0.293 -12.623 1.00 0.00 N ATOM 912 CD2 HIS A 177 3.901 0.573 -10.817 1.00 0.00 C ATOM 913 CE1 HIS A 177 4.444 0.951 -12.921 1.00 0.00 C ATOM 914 NE2 HIS A 177 3.855 1.515 -11.851 1.00 0.00 N ATOM 0 H HIS A 177 5.891 -0.808 -8.735 1.00 0.00 H new ATOM 0 HA HIS A 177 3.211 -1.532 -9.082 1.00 0.00 H new ATOM 0 HB2 HIS A 177 5.810 -2.073 -10.579 1.00 0.00 H new ATOM 0 HB3 HIS A 177 4.271 -2.652 -11.185 1.00 0.00 H new ATOM 0 HD2 HIS A 177 3.516 0.704 -9.817 1.00 0.00 H new ATOM 0 HE1 HIS A 177 4.570 1.430 -13.881 1.00 0.00 H new ATOM 0 HE2 HIS A 177 3.452 2.451 -11.803 1.00 0.00 H new ATOM 922 N ASP A 178 4.879 -3.904 -7.756 1.00 0.00 N ATOM 923 CA ASP A 178 4.719 -5.218 -7.143 1.00 0.00 C ATOM 924 C ASP A 178 4.109 -5.093 -5.749 1.00 0.00 C ATOM 925 O ASP A 178 3.050 -5.651 -5.503 1.00 0.00 O ATOM 926 CB ASP A 178 6.093 -5.870 -7.043 1.00 0.00 C ATOM 927 CG ASP A 178 5.994 -7.296 -6.518 1.00 0.00 C ATOM 928 OD1 ASP A 178 5.665 -8.194 -7.330 1.00 0.00 O ATOM 929 OD2 ASP A 178 6.331 -7.512 -5.331 1.00 0.00 O ATOM 0 H ASP A 178 5.647 -3.363 -7.359 1.00 0.00 H new ATOM 0 HA ASP A 178 4.050 -5.825 -7.754 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.568 -5.874 -8.024 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.730 -5.281 -6.383 1.00 0.00 H new ATOM 934 N CYS A 179 4.743 -4.319 -4.867 1.00 0.00 N ATOM 935 CA CYS A 179 4.377 -3.979 -3.495 1.00 0.00 C ATOM 936 C CYS A 179 2.886 -3.719 -3.370 1.00 0.00 C ATOM 937 O CYS A 179 2.232 -4.332 -2.531 1.00 0.00 O ATOM 938 CB CYS A 179 5.171 -2.717 -3.104 1.00 0.00 C ATOM 939 SG CYS A 179 4.844 -1.947 -1.489 1.00 0.00 S ATOM 0 H CYS A 179 5.620 -3.867 -5.127 1.00 0.00 H new ATOM 0 HA CYS A 179 4.614 -4.811 -2.832 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.231 -2.968 -3.142 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.994 -1.964 -3.872 1.00 0.00 H new ATOM 944 N VAL A 180 2.339 -2.850 -4.216 1.00 0.00 N ATOM 945 CA VAL A 180 0.912 -2.539 -4.242 1.00 0.00 C ATOM 946 C VAL A 180 0.146 -3.812 -4.550 1.00 0.00 C ATOM 947 O VAL A 180 -0.712 -4.213 -3.769 1.00 0.00 O ATOM 948 CB VAL A 180 0.662 -1.417 -5.275 1.00 0.00 C ATOM 949 CG1 VAL A 180 -0.825 -1.088 -5.395 1.00 0.00 C ATOM 950 CG2 VAL A 180 1.395 -0.119 -4.916 1.00 0.00 C ATOM 0 H VAL A 180 2.880 -2.336 -4.911 1.00 0.00 H new ATOM 0 HA VAL A 180 0.561 -2.171 -3.278 1.00 0.00 H new ATOM 0 HB VAL A 180 1.045 -1.802 -6.220 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.964 -0.295 -6.130 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.370 -1.977 -5.713 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.204 -0.757 -4.428 1.00 0.00 H new ATOM 0 HG21 VAL A 180 1.187 0.638 -5.673 1.00 0.00 H new ATOM 0 HG22 VAL A 180 1.052 0.236 -3.944 1.00 0.00 H new ATOM 0 HG23 VAL A 180 2.468 -0.306 -4.876 1.00 0.00 H new ATOM 960 N ASN A 181 0.488 -4.472 -5.650 1.00 0.00 N ATOM 961 CA ASN A 181 -0.208 -5.649 -6.135 1.00 0.00 C ATOM 962 C ASN A 181 -0.158 -6.808 -5.156 1.00 0.00 C ATOM 963 O ASN A 181 -1.039 -7.660 -5.215 1.00 0.00 O ATOM 964 CB ASN A 181 0.394 -6.078 -7.478 1.00 0.00 C ATOM 965 CG ASN A 181 -0.388 -5.447 -8.606 1.00 0.00 C ATOM 966 OD1 ASN A 181 -1.115 -6.110 -9.341 1.00 0.00 O ATOM 967 ND2 ASN A 181 -0.218 -4.151 -8.757 1.00 0.00 N ATOM 0 H ASN A 181 1.273 -4.195 -6.239 1.00 0.00 H new ATOM 0 HA ASN A 181 -1.257 -5.380 -6.255 1.00 0.00 H new ATOM 0 HB2 ASN A 181 1.440 -5.776 -7.533 1.00 0.00 H new ATOM 0 HB3 ASN A 181 0.371 -7.164 -7.568 1.00 0.00 H new ATOM 0 HD21 ASN A 181 -0.700 -3.658 -9.508 1.00 0.00 H new ATOM 0 HD22 ASN A 181 0.396 -3.640 -8.123 1.00 0.00 H new ATOM 974 N ILE A 182 0.847 -6.895 -4.287 1.00 0.00 N ATOM 975 CA ILE A 182 0.889 -7.867 -3.222 1.00 0.00 C ATOM 976 C ILE A 182 0.078 -7.338 -2.055 1.00 0.00 C ATOM 977 O ILE A 182 -0.729 -8.097 -1.545 1.00 0.00 O ATOM 978 CB ILE A 182 2.362 -8.138 -2.872 1.00 0.00 C ATOM 979 CG1 ILE A 182 3.152 -8.603 -4.122 1.00 0.00 C ATOM 980 CG2 ILE A 182 2.553 -9.119 -1.694 1.00 0.00 C ATOM 981 CD1 ILE A 182 2.422 -9.307 -5.274 1.00 0.00 C ATOM 0 H ILE A 182 1.660 -6.280 -4.312 1.00 0.00 H new ATOM 0 HA ILE A 182 0.446 -8.819 -3.513 1.00 0.00 H new ATOM 0 HB ILE A 182 2.769 -7.186 -2.531 1.00 0.00 H new ATOM 0 HG12 ILE A 182 3.645 -7.725 -4.539 1.00 0.00 H new ATOM 0 HG13 ILE A 182 3.938 -9.275 -3.777 1.00 0.00 H new ATOM 0 HG21 ILE A 182 3.618 -9.260 -1.507 1.00 0.00 H new ATOM 0 HG22 ILE A 182 2.078 -8.712 -0.801 1.00 0.00 H new ATOM 0 HG23 ILE A 182 2.098 -10.078 -1.942 1.00 0.00 H new ATOM 0 HD11 ILE A 182 3.136 -9.557 -6.058 1.00 0.00 H new ATOM 0 HD12 ILE A 182 1.954 -10.219 -4.905 1.00 0.00 H new ATOM 0 HD13 ILE A 182 1.657 -8.645 -5.678 1.00 0.00 H new ATOM 993 N THR A 183 0.237 -6.082 -1.640 1.00 0.00 N ATOM 994 CA THR A 183 -0.440 -5.527 -0.481 1.00 0.00 C ATOM 995 C THR A 183 -1.952 -5.654 -0.663 1.00 0.00 C ATOM 996 O THR A 183 -2.598 -6.314 0.150 1.00 0.00 O ATOM 997 CB THR A 183 0.027 -4.083 -0.243 1.00 0.00 C ATOM 998 OG1 THR A 183 1.423 -4.040 -0.028 1.00 0.00 O ATOM 999 CG2 THR A 183 -0.632 -3.468 0.991 1.00 0.00 C ATOM 0 H THR A 183 0.850 -5.416 -2.110 1.00 0.00 H new ATOM 0 HA THR A 183 -0.181 -6.087 0.418 1.00 0.00 H new ATOM 0 HB THR A 183 -0.253 -3.521 -1.134 1.00 0.00 H new ATOM 0 HG1 THR A 183 1.882 -3.914 -0.885 1.00 0.00 H new ATOM 0 HG21 THR A 183 -0.275 -2.447 1.124 1.00 0.00 H new ATOM 0 HG22 THR A 183 -1.714 -3.460 0.860 1.00 0.00 H new ATOM 0 HG23 THR A 183 -0.378 -4.058 1.871 1.00 0.00 H new ATOM 1007 N VAL A 184 -2.543 -5.080 -1.717 1.00 0.00 N ATOM 1008 CA VAL A 184 -3.926 -5.111 -1.965 1.00 0.00 C ATOM 1009 C VAL A 184 -4.481 -6.535 -2.054 1.00 0.00 C ATOM 1010 O VAL A 184 -5.516 -6.844 -1.466 1.00 0.00 O ATOM 1011 CB VAL A 184 -3.986 -4.306 -3.255 1.00 0.00 C ATOM 1012 CG1 VAL A 184 -3.600 -2.822 -3.086 1.00 0.00 C ATOM 1013 CG2 VAL A 184 -3.573 -4.932 -4.588 1.00 0.00 C ATOM 0 H VAL A 184 -2.020 -4.569 -2.429 1.00 0.00 H new ATOM 0 HA VAL A 184 -4.556 -4.701 -1.176 1.00 0.00 H new ATOM 0 HB VAL A 184 -5.062 -4.352 -3.420 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -3.668 -2.317 -4.049 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -4.280 -2.347 -2.379 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -2.579 -2.752 -2.710 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -3.687 -4.198 -5.386 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -2.532 -5.250 -4.534 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -4.205 -5.795 -4.796 1.00 0.00 H new ATOM 1023 N LYS A 185 -3.755 -7.426 -2.719 1.00 0.00 N ATOM 1024 CA LYS A 185 -4.070 -8.846 -2.826 1.00 0.00 C ATOM 1025 C LYS A 185 -3.987 -9.581 -1.500 1.00 0.00 C ATOM 1026 O LYS A 185 -4.881 -10.368 -1.223 1.00 0.00 O ATOM 1027 CB LYS A 185 -3.152 -9.465 -3.875 1.00 0.00 C ATOM 1028 CG LYS A 185 -3.620 -10.861 -4.305 1.00 0.00 C ATOM 1029 CD LYS A 185 -2.796 -11.354 -5.499 1.00 0.00 C ATOM 1030 CE LYS A 185 -1.395 -11.801 -5.080 1.00 0.00 C ATOM 1031 NZ LYS A 185 -1.360 -13.206 -4.634 1.00 0.00 N ATOM 0 H LYS A 185 -2.901 -7.171 -3.216 1.00 0.00 H new ATOM 0 HA LYS A 185 -5.111 -8.946 -3.135 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -3.109 -8.813 -4.748 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -2.140 -9.530 -3.476 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -3.520 -11.558 -3.473 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -4.677 -10.832 -4.571 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -3.314 -12.185 -5.979 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -2.717 -10.558 -6.239 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -0.710 -11.672 -5.918 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -1.038 -11.159 -4.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -0.389 -13.460 -4.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -1.992 -13.327 -3.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -1.674 -13.824 -5.409 1.00 0.00 H new ATOM 1045 N GLN A 186 -2.976 -9.370 -0.665 1.00 0.00 N ATOM 1046 CA GLN A 186 -2.936 -9.989 0.653 1.00 0.00 C ATOM 1047 C GLN A 186 -4.141 -9.528 1.468 1.00 0.00 C ATOM 1048 O GLN A 186 -4.743 -10.328 2.183 1.00 0.00 O ATOM 1049 CB GLN A 186 -1.616 -9.670 1.375 1.00 0.00 C ATOM 1050 CG GLN A 186 -0.400 -10.387 0.778 1.00 0.00 C ATOM 1051 CD GLN A 186 -0.597 -11.895 0.648 1.00 0.00 C ATOM 1052 OE1 GLN A 186 -0.842 -12.591 1.626 1.00 0.00 O ATOM 1053 NE2 GLN A 186 -0.513 -12.431 -0.562 1.00 0.00 N ATOM 0 H GLN A 186 -2.175 -8.776 -0.878 1.00 0.00 H new ATOM 0 HA GLN A 186 -2.984 -11.072 0.539 1.00 0.00 H new ATOM 0 HB2 GLN A 186 -1.445 -8.594 1.342 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -1.710 -9.946 2.425 1.00 0.00 H new ATOM 0 HG2 GLN A 186 -0.186 -9.969 -0.206 1.00 0.00 H new ATOM 0 HG3 GLN A 186 0.471 -10.193 1.403 1.00 0.00 H new ATOM 0 HE21 GLN A 186 -0.308 -11.841 -1.368 1.00 0.00 H new ATOM 0 HE22 GLN A 186 -0.653 -13.434 -0.686 1.00 0.00 H new ATOM 1062 N HIS A 187 -4.559 -8.275 1.285 1.00 0.00 N ATOM 1063 CA HIS A 187 -5.749 -7.758 1.919 1.00 0.00 C ATOM 1064 C HIS A 187 -6.999 -8.389 1.306 1.00 0.00 C ATOM 1065 O HIS A 187 -7.957 -8.679 2.019 1.00 0.00 O ATOM 1066 CB HIS A 187 -5.745 -6.229 1.829 1.00 0.00 C ATOM 1067 CG HIS A 187 -5.727 -5.615 3.201 1.00 0.00 C ATOM 1068 ND1 HIS A 187 -4.600 -5.482 3.971 1.00 0.00 N ATOM 1069 CD2 HIS A 187 -6.799 -5.254 3.970 1.00 0.00 C ATOM 1070 CE1 HIS A 187 -4.972 -5.007 5.168 1.00 0.00 C ATOM 1071 NE2 HIS A 187 -6.304 -4.840 5.212 1.00 0.00 N ATOM 0 H HIS A 187 -4.076 -7.600 0.693 1.00 0.00 H new ATOM 0 HA HIS A 187 -5.759 -8.025 2.976 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -4.874 -5.895 1.265 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -6.626 -5.890 1.285 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -7.837 -5.283 3.673 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -4.296 -4.789 5.982 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -6.848 -4.482 5.997 1.00 0.00 H new ATOM 1079 N THR A 188 -6.988 -8.649 0.003 1.00 0.00 N ATOM 1080 CA THR A 188 -8.049 -9.354 -0.705 1.00 0.00 C ATOM 1081 C THR A 188 -8.231 -10.739 -0.078 1.00 0.00 C ATOM 1082 O THR A 188 -9.303 -11.013 0.453 1.00 0.00 O ATOM 1083 CB THR A 188 -7.756 -9.396 -2.220 1.00 0.00 C ATOM 1084 OG1 THR A 188 -7.651 -8.077 -2.730 1.00 0.00 O ATOM 1085 CG2 THR A 188 -8.775 -10.171 -3.060 1.00 0.00 C ATOM 0 H THR A 188 -6.220 -8.367 -0.606 1.00 0.00 H new ATOM 0 HA THR A 188 -8.996 -8.823 -0.603 1.00 0.00 H new ATOM 0 HB THR A 188 -6.815 -9.939 -2.308 1.00 0.00 H new ATOM 0 HG1 THR A 188 -6.902 -7.617 -2.296 1.00 0.00 H new ATOM 0 HG21 THR A 188 -8.480 -10.141 -4.109 1.00 0.00 H new ATOM 0 HG22 THR A 188 -8.812 -11.207 -2.723 1.00 0.00 H new ATOM 0 HG23 THR A 188 -9.760 -9.717 -2.947 1.00 0.00 H new ATOM 1093 N VAL A 189 -7.210 -11.601 -0.089 1.00 0.00 N ATOM 1094 CA VAL A 189 -7.290 -13.056 0.091 1.00 0.00 C ATOM 1095 C VAL A 189 -7.554 -13.512 1.539 1.00 0.00 C ATOM 1096 O VAL A 189 -7.114 -14.573 1.986 1.00 0.00 O ATOM 1097 CB VAL A 189 -6.063 -13.751 -0.536 1.00 0.00 C ATOM 1098 CG1 VAL A 189 -5.948 -13.477 -2.043 1.00 0.00 C ATOM 1099 CG2 VAL A 189 -4.719 -13.456 0.147 1.00 0.00 C ATOM 0 H VAL A 189 -6.251 -11.286 -0.232 1.00 0.00 H new ATOM 0 HA VAL A 189 -8.181 -13.377 -0.449 1.00 0.00 H new ATOM 0 HB VAL A 189 -6.262 -14.809 -0.368 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -5.070 -13.987 -2.439 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -6.841 -13.845 -2.549 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -5.852 -12.404 -2.211 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -3.923 -13.992 -0.370 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -4.519 -12.385 0.110 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -4.760 -13.781 1.186 1.00 0.00 H new ATOM 1109 N THR A 190 -8.277 -12.704 2.294 1.00 0.00 N ATOM 1110 CA THR A 190 -8.775 -13.005 3.612 1.00 0.00 C ATOM 1111 C THR A 190 -10.085 -12.234 3.754 1.00 0.00 C ATOM 1112 O THR A 190 -11.134 -12.835 3.979 1.00 0.00 O ATOM 1113 CB THR A 190 -7.675 -12.718 4.647 1.00 0.00 C ATOM 1114 OG1 THR A 190 -8.063 -13.163 5.927 1.00 0.00 O ATOM 1115 CG2 THR A 190 -7.248 -11.258 4.754 1.00 0.00 C ATOM 0 H THR A 190 -8.543 -11.771 1.981 1.00 0.00 H new ATOM 0 HA THR A 190 -9.012 -14.055 3.785 1.00 0.00 H new ATOM 0 HB THR A 190 -6.812 -13.271 4.277 1.00 0.00 H new ATOM 0 HG1 THR A 190 -7.348 -12.972 6.570 1.00 0.00 H new ATOM 0 HG21 THR A 190 -6.469 -11.161 5.510 1.00 0.00 H new ATOM 0 HG22 THR A 190 -6.864 -10.920 3.792 1.00 0.00 H new ATOM 0 HG23 THR A 190 -8.106 -10.648 5.037 1.00 0.00 H new ATOM 1123 N THR A 191 -10.094 -10.926 3.482 1.00 0.00 N ATOM 1124 CA THR A 191 -11.290 -10.113 3.632 1.00 0.00 C ATOM 1125 C THR A 191 -12.369 -10.506 2.603 1.00 0.00 C ATOM 1126 O THR A 191 -13.568 -10.398 2.843 1.00 0.00 O ATOM 1127 CB THR A 191 -10.898 -8.635 3.638 1.00 0.00 C ATOM 1128 OG1 THR A 191 -9.543 -8.428 4.011 1.00 0.00 O ATOM 1129 CG2 THR A 191 -11.691 -7.871 4.680 1.00 0.00 C ATOM 0 H THR A 191 -9.277 -10.411 3.155 1.00 0.00 H new ATOM 0 HA THR A 191 -11.766 -10.304 4.594 1.00 0.00 H new ATOM 0 HB THR A 191 -11.086 -8.294 2.620 1.00 0.00 H new ATOM 0 HG1 THR A 191 -9.029 -8.139 3.229 1.00 0.00 H new ATOM 0 HG21 THR A 191 -11.395 -6.822 4.666 1.00 0.00 H new ATOM 0 HG22 THR A 191 -12.755 -7.951 4.458 1.00 0.00 H new ATOM 0 HG23 THR A 191 -11.494 -8.290 5.667 1.00 0.00 H new ATOM 1137 N THR A 192 -11.967 -11.104 1.490 1.00 0.00 N ATOM 1138 CA THR A 192 -12.841 -11.661 0.477 1.00 0.00 C ATOM 1139 C THR A 192 -13.687 -12.807 1.062 1.00 0.00 C ATOM 1140 O THR A 192 -14.867 -12.924 0.745 1.00 0.00 O ATOM 1141 CB THR A 192 -11.943 -12.027 -0.718 1.00 0.00 C ATOM 1142 OG1 THR A 192 -12.589 -12.071 -1.976 1.00 0.00 O ATOM 1143 CG2 THR A 192 -11.162 -13.313 -0.495 1.00 0.00 C ATOM 0 H THR A 192 -10.979 -11.217 1.262 1.00 0.00 H new ATOM 0 HA THR A 192 -13.592 -10.956 0.120 1.00 0.00 H new ATOM 0 HB THR A 192 -11.250 -11.187 -0.763 1.00 0.00 H new ATOM 0 HG1 THR A 192 -11.939 -12.309 -2.669 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.546 -13.521 -1.370 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.522 -13.203 0.381 1.00 0.00 H new ATOM 0 HG23 THR A 192 -11.857 -14.138 -0.336 1.00 0.00 H new ATOM 1151 N THR A 193 -13.126 -13.583 1.995 1.00 0.00 N ATOM 1152 CA THR A 193 -13.725 -14.769 2.580 1.00 0.00 C ATOM 1153 C THR A 193 -14.670 -14.349 3.706 1.00 0.00 C ATOM 1154 O THR A 193 -15.526 -15.128 4.127 1.00 0.00 O ATOM 1155 CB THR A 193 -12.563 -15.660 3.070 1.00 0.00 C ATOM 1156 OG1 THR A 193 -12.625 -16.942 2.477 1.00 0.00 O ATOM 1157 CG2 THR A 193 -12.434 -15.778 4.592 1.00 0.00 C ATOM 0 H THR A 193 -12.200 -13.385 2.375 1.00 0.00 H new ATOM 0 HA THR A 193 -14.325 -15.333 1.866 1.00 0.00 H new ATOM 0 HB THR A 193 -11.660 -15.144 2.744 1.00 0.00 H new ATOM 0 HG1 THR A 193 -11.879 -17.488 2.800 1.00 0.00 H new ATOM 0 HG21 THR A 193 -11.590 -16.423 4.837 1.00 0.00 H new ATOM 0 HG22 THR A 193 -12.271 -14.789 5.021 1.00 0.00 H new ATOM 0 HG23 THR A 193 -13.349 -16.205 5.003 1.00 0.00 H new ATOM 1165 N LYS A 194 -14.512 -13.116 4.210 1.00 0.00 N ATOM 1166 CA LYS A 194 -15.420 -12.581 5.217 1.00 0.00 C ATOM 1167 C LYS A 194 -16.772 -12.226 4.593 1.00 0.00 C ATOM 1168 O LYS A 194 -17.709 -11.809 5.278 1.00 0.00 O ATOM 1169 CB LYS A 194 -14.771 -11.405 5.973 1.00 0.00 C ATOM 1170 CG LYS A 194 -13.483 -11.905 6.631 1.00 0.00 C ATOM 1171 CD LYS A 194 -12.742 -10.827 7.424 1.00 0.00 C ATOM 1172 CE LYS A 194 -11.571 -11.528 8.126 1.00 0.00 C ATOM 1173 NZ LYS A 194 -10.682 -10.613 8.867 1.00 0.00 N ATOM 0 H LYS A 194 -13.765 -12.479 3.934 1.00 0.00 H new ATOM 0 HA LYS A 194 -15.617 -13.351 5.963 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -14.553 -10.587 5.286 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -15.455 -11.015 6.727 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -13.723 -12.734 7.297 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -12.820 -12.298 5.860 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -12.382 -10.038 6.763 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -13.404 -10.356 8.151 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -11.968 -12.272 8.817 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -10.984 -12.066 7.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -9.917 -11.158 9.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -10.274 -9.918 8.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -11.228 -10.118 9.601 1.00 0.00 H new ATOM 1187 N GLY A 195 -16.855 -12.353 3.266 1.00 0.00 N ATOM 1188 CA GLY A 195 -17.934 -11.847 2.445 1.00 0.00 C ATOM 1189 C GLY A 195 -17.961 -10.331 2.545 1.00 0.00 C ATOM 1190 O GLY A 195 -19.034 -9.736 2.536 1.00 0.00 O ATOM 0 H GLY A 195 -16.138 -12.832 2.722 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -17.794 -12.154 1.408 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -18.886 -12.263 2.775 1.00 0.00 H new ATOM 1194 N GLU A 196 -16.783 -9.731 2.724 1.00 0.00 N ATOM 1195 CA GLU A 196 -16.597 -8.291 2.707 1.00 0.00 C ATOM 1196 C GLU A 196 -16.194 -7.901 1.299 1.00 0.00 C ATOM 1197 O GLU A 196 -16.914 -7.146 0.646 1.00 0.00 O ATOM 1198 CB GLU A 196 -15.512 -7.892 3.719 1.00 0.00 C ATOM 1199 CG GLU A 196 -16.099 -7.549 5.085 1.00 0.00 C ATOM 1200 CD GLU A 196 -16.530 -6.079 5.126 1.00 0.00 C ATOM 1201 OE1 GLU A 196 -17.118 -5.612 4.121 1.00 0.00 O ATOM 1202 OE2 GLU A 196 -16.239 -5.390 6.135 1.00 0.00 O ATOM 0 H GLU A 196 -15.919 -10.248 2.887 1.00 0.00 H new ATOM 0 HA GLU A 196 -17.515 -7.775 2.988 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -14.799 -8.709 3.826 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -14.959 -7.034 3.337 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -16.955 -8.192 5.292 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -15.361 -7.740 5.864 1.00 0.00 H new ATOM 1209 N ASN A 197 -15.070 -8.479 0.854 1.00 0.00 N ATOM 1210 CA ASN A 197 -14.311 -8.162 -0.351 1.00 0.00 C ATOM 1211 C ASN A 197 -14.219 -6.655 -0.648 1.00 0.00 C ATOM 1212 O ASN A 197 -14.525 -5.806 0.192 1.00 0.00 O ATOM 1213 CB ASN A 197 -14.755 -9.023 -1.551 1.00 0.00 C ATOM 1214 CG ASN A 197 -16.015 -8.517 -2.225 1.00 0.00 C ATOM 1215 OD1 ASN A 197 -15.956 -7.699 -3.136 1.00 0.00 O ATOM 1216 ND2 ASN A 197 -17.156 -9.015 -1.794 1.00 0.00 N ATOM 0 H ASN A 197 -14.638 -9.242 1.374 1.00 0.00 H new ATOM 0 HA ASN A 197 -13.277 -8.444 -0.150 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -13.948 -9.055 -2.283 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -14.919 -10.046 -1.213 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -18.034 -8.722 -2.221 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -17.161 -9.694 -1.033 1.00 0.00 H new ATOM 1223 N PHE A 198 -13.658 -6.338 -1.812 1.00 0.00 N ATOM 1224 CA PHE A 198 -13.309 -5.018 -2.291 1.00 0.00 C ATOM 1225 C PHE A 198 -13.612 -5.016 -3.782 1.00 0.00 C ATOM 1226 O PHE A 198 -13.206 -5.952 -4.476 1.00 0.00 O ATOM 1227 CB PHE A 198 -11.810 -4.780 -2.021 1.00 0.00 C ATOM 1228 CG PHE A 198 -11.431 -4.827 -0.553 1.00 0.00 C ATOM 1229 CD1 PHE A 198 -12.161 -4.064 0.377 1.00 0.00 C ATOM 1230 CD2 PHE A 198 -10.360 -5.627 -0.106 1.00 0.00 C ATOM 1231 CE1 PHE A 198 -11.853 -4.128 1.742 1.00 0.00 C ATOM 1232 CE2 PHE A 198 -10.054 -5.692 1.266 1.00 0.00 C ATOM 1233 CZ PHE A 198 -10.804 -4.946 2.194 1.00 0.00 C ATOM 0 H PHE A 198 -13.420 -7.059 -2.493 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.867 -4.224 -1.794 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -11.231 -5.531 -2.559 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.528 -3.809 -2.427 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -12.963 -3.426 0.037 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -9.774 -6.190 -0.817 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -12.424 -3.546 2.450 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -9.241 -6.316 1.608 1.00 0.00 H new ATOM 0 HZ PHE A 198 -10.574 -5.002 3.248 1.00 0.00 H new ATOM 1243 N THR A 199 -14.297 -3.993 -4.280 1.00 0.00 N ATOM 1244 CA THR A 199 -14.584 -3.882 -5.704 1.00 0.00 C ATOM 1245 C THR A 199 -13.336 -3.359 -6.411 1.00 0.00 C ATOM 1246 O THR A 199 -12.369 -2.976 -5.752 1.00 0.00 O ATOM 1247 CB THR A 199 -15.783 -2.944 -5.903 1.00 0.00 C ATOM 1248 OG1 THR A 199 -15.535 -1.605 -5.534 1.00 0.00 O ATOM 1249 CG2 THR A 199 -17.038 -3.449 -5.188 1.00 0.00 C ATOM 0 H THR A 199 -14.665 -3.227 -3.716 1.00 0.00 H new ATOM 0 HA THR A 199 -14.842 -4.852 -6.129 1.00 0.00 H new ATOM 0 HB THR A 199 -15.954 -2.954 -6.979 1.00 0.00 H new ATOM 0 HG1 THR A 199 -15.711 -1.492 -4.577 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.859 -2.752 -5.358 1.00 0.00 H new ATOM 0 HG22 THR A 199 -17.309 -4.430 -5.577 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.842 -3.524 -4.118 1.00 0.00 H new ATOM 1257 N GLU A 200 -13.347 -3.255 -7.740 1.00 0.00 N ATOM 1258 CA GLU A 200 -12.292 -2.525 -8.427 1.00 0.00 C ATOM 1259 C GLU A 200 -12.199 -1.080 -7.948 1.00 0.00 C ATOM 1260 O GLU A 200 -11.120 -0.505 -7.890 1.00 0.00 O ATOM 1261 CB GLU A 200 -12.555 -2.505 -9.933 1.00 0.00 C ATOM 1262 CG GLU A 200 -11.483 -3.330 -10.640 1.00 0.00 C ATOM 1263 CD GLU A 200 -11.796 -4.820 -10.550 1.00 0.00 C ATOM 1264 OE1 GLU A 200 -11.362 -5.479 -9.570 1.00 0.00 O ATOM 1265 OE2 GLU A 200 -12.485 -5.299 -11.478 1.00 0.00 O ATOM 0 H GLU A 200 -14.060 -3.659 -8.348 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.357 -3.038 -8.204 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.544 -2.911 -10.147 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -12.545 -1.480 -10.303 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.419 -3.030 -11.686 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -10.510 -3.131 -10.191 1.00 0.00 H new ATOM 1272 N THR A 201 -13.335 -0.477 -7.622 1.00 0.00 N ATOM 1273 CA THR A 201 -13.361 0.869 -7.089 1.00 0.00 C ATOM 1274 C THR A 201 -12.616 0.911 -5.747 1.00 0.00 C ATOM 1275 O THR A 201 -11.919 1.892 -5.480 1.00 0.00 O ATOM 1276 CB THR A 201 -14.832 1.306 -7.021 1.00 0.00 C ATOM 1277 OG1 THR A 201 -15.201 1.986 -8.201 1.00 0.00 O ATOM 1278 CG2 THR A 201 -15.175 2.174 -5.827 1.00 0.00 C ATOM 0 H THR A 201 -14.255 -0.907 -7.720 1.00 0.00 H new ATOM 0 HA THR A 201 -12.836 1.582 -7.724 1.00 0.00 H new ATOM 0 HB THR A 201 -15.397 0.380 -6.910 1.00 0.00 H new ATOM 0 HG1 THR A 201 -16.141 2.256 -8.142 1.00 0.00 H new ATOM 0 HG21 THR A 201 -16.233 2.436 -5.859 1.00 0.00 H new ATOM 0 HG22 THR A 201 -14.964 1.628 -4.908 1.00 0.00 H new ATOM 0 HG23 THR A 201 -14.575 3.084 -5.854 1.00 0.00 H new ATOM 1286 N ASP A 202 -12.755 -0.120 -4.907 1.00 0.00 N ATOM 1287 CA ASP A 202 -12.107 -0.157 -3.596 1.00 0.00 C ATOM 1288 C ASP A 202 -10.621 -0.464 -3.771 1.00 0.00 C ATOM 1289 O ASP A 202 -9.781 0.221 -3.203 1.00 0.00 O ATOM 1290 CB ASP A 202 -12.736 -1.208 -2.666 1.00 0.00 C ATOM 1291 CG ASP A 202 -14.200 -0.984 -2.289 1.00 0.00 C ATOM 1292 OD1 ASP A 202 -15.085 -1.421 -3.059 1.00 0.00 O ATOM 1293 OD2 ASP A 202 -14.508 -0.532 -1.168 1.00 0.00 O ATOM 0 H ASP A 202 -13.316 -0.946 -5.116 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.245 0.821 -3.134 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -12.651 -2.184 -3.144 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -12.148 -1.250 -1.749 1.00 0.00 H new ATOM 1298 N ILE A 203 -10.278 -1.441 -4.613 1.00 0.00 N ATOM 1299 CA ILE A 203 -8.903 -1.747 -5.006 1.00 0.00 C ATOM 1300 C ILE A 203 -8.242 -0.500 -5.623 1.00 0.00 C ATOM 1301 O ILE A 203 -7.074 -0.276 -5.343 1.00 0.00 O ATOM 1302 CB ILE A 203 -8.892 -3.008 -5.908 1.00 0.00 C ATOM 1303 CG1 ILE A 203 -9.341 -4.274 -5.123 1.00 0.00 C ATOM 1304 CG2 ILE A 203 -7.529 -3.259 -6.578 1.00 0.00 C ATOM 1305 CD1 ILE A 203 -8.376 -4.779 -4.040 1.00 0.00 C ATOM 0 H ILE A 203 -10.965 -2.055 -5.050 1.00 0.00 H new ATOM 0 HA ILE A 203 -8.291 -1.997 -4.139 1.00 0.00 H new ATOM 0 HB ILE A 203 -9.611 -2.809 -6.702 1.00 0.00 H new ATOM 0 HG12 ILE A 203 -10.302 -4.063 -4.654 1.00 0.00 H new ATOM 0 HG13 ILE A 203 -9.505 -5.080 -5.838 1.00 0.00 H new ATOM 0 HG21 ILE A 203 -7.587 -4.155 -7.196 1.00 0.00 H new ATOM 0 HG22 ILE A 203 -7.268 -2.405 -7.202 1.00 0.00 H new ATOM 0 HG23 ILE A 203 -6.766 -3.395 -5.811 1.00 0.00 H new ATOM 0 HD11 ILE A 203 -8.796 -5.664 -3.562 1.00 0.00 H new ATOM 0 HD12 ILE A 203 -7.418 -5.032 -4.495 1.00 0.00 H new ATOM 0 HD13 ILE A 203 -8.228 -4.000 -3.293 1.00 0.00 H new ATOM 1317 N LYS A 204 -8.954 0.358 -6.366 1.00 0.00 N ATOM 1318 CA LYS A 204 -8.456 1.659 -6.850 1.00 0.00 C ATOM 1319 C LYS A 204 -8.198 2.569 -5.660 1.00 0.00 C ATOM 1320 O LYS A 204 -7.088 3.074 -5.519 1.00 0.00 O ATOM 1321 CB LYS A 204 -9.459 2.298 -7.819 1.00 0.00 C ATOM 1322 CG LYS A 204 -9.267 1.779 -9.252 1.00 0.00 C ATOM 1323 CD LYS A 204 -10.392 2.279 -10.169 1.00 0.00 C ATOM 1324 CE LYS A 204 -10.169 1.862 -11.628 1.00 0.00 C ATOM 1325 NZ LYS A 204 -10.654 0.495 -11.923 1.00 0.00 N ATOM 0 H LYS A 204 -9.913 0.166 -6.655 1.00 0.00 H new ATOM 0 HA LYS A 204 -7.524 1.508 -7.394 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -10.475 2.084 -7.486 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -9.341 3.381 -7.804 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -8.303 2.111 -9.638 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -9.251 0.689 -9.250 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.347 1.885 -9.821 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -10.455 3.365 -10.108 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -10.676 2.570 -12.283 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -9.105 1.921 -11.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -10.475 0.272 -12.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -10.153 -0.189 -11.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -11.675 0.440 -11.733 1.00 0.00 H new ATOM 1339 N MET A 205 -9.208 2.796 -4.812 1.00 0.00 N ATOM 1340 CA MET A 205 -9.041 3.571 -3.589 1.00 0.00 C ATOM 1341 C MET A 205 -7.834 3.128 -2.756 1.00 0.00 C ATOM 1342 O MET A 205 -7.161 3.987 -2.180 1.00 0.00 O ATOM 1343 CB MET A 205 -10.332 3.592 -2.761 1.00 0.00 C ATOM 1344 CG MET A 205 -11.396 4.465 -3.432 1.00 0.00 C ATOM 1345 SD MET A 205 -12.494 5.381 -2.323 1.00 0.00 S ATOM 1346 CE MET A 205 -13.127 6.567 -3.544 1.00 0.00 C ATOM 0 H MET A 205 -10.156 2.448 -4.958 1.00 0.00 H new ATOM 0 HA MET A 205 -8.828 4.594 -3.899 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.710 2.576 -2.643 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.122 3.972 -1.761 1.00 0.00 H new ATOM 0 HG2 MET A 205 -10.892 5.180 -4.083 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.008 3.829 -4.071 1.00 0.00 H new ATOM 0 HE1 MET A 205 -12.804 7.573 -3.276 1.00 0.00 H new ATOM 0 HE2 MET A 205 -12.741 6.313 -4.531 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.216 6.527 -3.559 1.00 0.00 H new ATOM 1356 N MET A 206 -7.544 1.825 -2.719 1.00 0.00 N ATOM 1357 CA MET A 206 -6.329 1.299 -2.129 1.00 0.00 C ATOM 1358 C MET A 206 -5.120 1.636 -2.985 1.00 0.00 C ATOM 1359 O MET A 206 -4.233 2.298 -2.475 1.00 0.00 O ATOM 1360 CB MET A 206 -6.405 -0.212 -1.872 1.00 0.00 C ATOM 1361 CG MET A 206 -6.287 -0.535 -0.374 1.00 0.00 C ATOM 1362 SD MET A 206 -5.723 -2.210 0.027 1.00 0.00 S ATOM 1363 CE MET A 206 -6.749 -3.095 -1.156 1.00 0.00 C ATOM 0 H MET A 206 -8.157 1.106 -3.103 1.00 0.00 H new ATOM 0 HA MET A 206 -6.218 1.782 -1.158 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.348 -0.600 -2.256 1.00 0.00 H new ATOM 0 HB3 MET A 206 -5.607 -0.716 -2.418 1.00 0.00 H new ATOM 0 HG2 MET A 206 -5.599 0.178 0.080 1.00 0.00 H new ATOM 0 HG3 MET A 206 -7.261 -0.378 0.090 1.00 0.00 H new ATOM 0 HE1 MET A 206 -6.762 -4.156 -0.904 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.765 -2.702 -1.122 1.00 0.00 H new ATOM 0 HE3 MET A 206 -6.343 -2.965 -2.159 1.00 0.00 H new ATOM 1373 N GLU A 207 -5.020 1.188 -4.237 1.00 0.00 N ATOM 1374 CA GLU A 207 -3.818 1.332 -5.059 1.00 0.00 C ATOM 1375 C GLU A 207 -3.309 2.770 -5.054 1.00 0.00 C ATOM 1376 O GLU A 207 -2.118 2.987 -4.853 1.00 0.00 O ATOM 1377 CB GLU A 207 -4.059 0.880 -6.507 1.00 0.00 C ATOM 1378 CG GLU A 207 -4.064 -0.644 -6.688 1.00 0.00 C ATOM 1379 CD GLU A 207 -3.543 -1.015 -8.078 1.00 0.00 C ATOM 1380 OE1 GLU A 207 -4.138 -0.565 -9.087 1.00 0.00 O ATOM 1381 OE2 GLU A 207 -2.499 -1.702 -8.181 1.00 0.00 O ATOM 0 H GLU A 207 -5.782 0.708 -4.715 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.061 0.686 -4.615 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -5.014 1.280 -6.848 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -3.287 1.310 -7.145 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -3.443 -1.110 -5.923 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -5.075 -1.029 -6.556 1.00 0.00 H new ATOM 1388 N ARG A 208 -4.212 3.743 -5.195 1.00 0.00 N ATOM 1389 CA ARG A 208 -3.921 5.163 -5.153 1.00 0.00 C ATOM 1390 C ARG A 208 -3.094 5.542 -3.927 1.00 0.00 C ATOM 1391 O ARG A 208 -2.141 6.315 -4.060 1.00 0.00 O ATOM 1392 CB ARG A 208 -5.265 5.899 -5.137 1.00 0.00 C ATOM 1393 CG ARG A 208 -5.204 7.270 -5.794 1.00 0.00 C ATOM 1394 CD ARG A 208 -5.629 7.205 -7.268 1.00 0.00 C ATOM 1395 NE ARG A 208 -5.634 8.564 -7.837 1.00 0.00 N ATOM 1396 CZ ARG A 208 -5.845 8.933 -9.105 1.00 0.00 C ATOM 1397 NH1 ARG A 208 -6.036 8.044 -10.074 1.00 0.00 N ATOM 1398 NH2 ARG A 208 -5.868 10.231 -9.375 1.00 0.00 N ATOM 0 H ARG A 208 -5.201 3.547 -5.347 1.00 0.00 H new ATOM 0 HA ARG A 208 -3.326 5.441 -6.023 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -6.011 5.291 -5.648 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -5.598 6.012 -4.105 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -5.853 7.962 -5.257 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -4.190 7.664 -5.723 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -4.944 6.567 -7.827 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -6.620 6.760 -7.353 1.00 0.00 H new ATOM 0 HE ARG A 208 -5.453 9.322 -7.178 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -6.024 7.047 -9.861 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -6.194 8.359 -11.031 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -5.727 10.910 -8.627 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -6.026 10.550 -10.331 1.00 0.00 H new ATOM 1412 N VAL A 209 -3.456 5.019 -2.752 1.00 0.00 N ATOM 1413 CA VAL A 209 -2.764 5.283 -1.504 1.00 0.00 C ATOM 1414 C VAL A 209 -1.567 4.352 -1.354 1.00 0.00 C ATOM 1415 O VAL A 209 -0.490 4.794 -0.963 1.00 0.00 O ATOM 1416 CB VAL A 209 -3.739 5.199 -0.300 1.00 0.00 C ATOM 1417 CG1 VAL A 209 -3.861 3.858 0.433 1.00 0.00 C ATOM 1418 CG2 VAL A 209 -3.290 6.238 0.719 1.00 0.00 C ATOM 0 H VAL A 209 -4.253 4.391 -2.648 1.00 0.00 H new ATOM 0 HA VAL A 209 -2.379 6.303 -1.521 1.00 0.00 H new ATOM 0 HB VAL A 209 -4.726 5.361 -0.734 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -4.577 3.953 1.249 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -4.204 3.093 -0.263 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -2.889 3.573 0.835 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -3.953 6.210 1.584 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -2.270 6.019 1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -3.325 7.229 0.267 1.00 0.00 H new ATOM 1428 N VAL A 210 -1.748 3.059 -1.617 1.00 0.00 N ATOM 1429 CA VAL A 210 -0.777 2.016 -1.332 1.00 0.00 C ATOM 1430 C VAL A 210 0.467 2.272 -2.182 1.00 0.00 C ATOM 1431 O VAL A 210 1.566 2.040 -1.697 1.00 0.00 O ATOM 1432 CB VAL A 210 -1.412 0.615 -1.515 1.00 0.00 C ATOM 1433 CG1 VAL A 210 -0.402 -0.521 -1.313 1.00 0.00 C ATOM 1434 CG2 VAL A 210 -2.514 0.350 -0.467 1.00 0.00 C ATOM 0 H VAL A 210 -2.601 2.703 -2.047 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.461 2.039 -0.289 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.801 0.624 -2.533 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.900 -1.480 -1.453 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.406 -0.423 -2.038 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.007 -0.469 -0.304 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.937 -0.642 -0.626 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -2.085 0.405 0.534 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.299 1.099 -0.567 1.00 0.00 H new ATOM 1444 N GLU A 211 0.320 2.831 -3.385 1.00 0.00 N ATOM 1445 CA GLU A 211 1.412 3.331 -4.204 1.00 0.00 C ATOM 1446 C GLU A 211 2.265 4.298 -3.381 1.00 0.00 C ATOM 1447 O GLU A 211 3.479 4.135 -3.279 1.00 0.00 O ATOM 1448 CB GLU A 211 0.813 4.014 -5.448 1.00 0.00 C ATOM 1449 CG GLU A 211 1.871 4.627 -6.377 1.00 0.00 C ATOM 1450 CD GLU A 211 1.363 5.917 -7.014 1.00 0.00 C ATOM 1451 OE1 GLU A 211 0.493 5.849 -7.920 1.00 0.00 O ATOM 1452 OE2 GLU A 211 1.834 6.999 -6.604 1.00 0.00 O ATOM 0 H GLU A 211 -0.593 2.949 -3.824 1.00 0.00 H new ATOM 0 HA GLU A 211 2.060 2.517 -4.531 1.00 0.00 H new ATOM 0 HB2 GLU A 211 0.228 3.284 -6.008 1.00 0.00 H new ATOM 0 HB3 GLU A 211 0.125 4.796 -5.128 1.00 0.00 H new ATOM 0 HG2 GLU A 211 2.781 4.831 -5.812 1.00 0.00 H new ATOM 0 HG3 GLU A 211 2.133 3.912 -7.157 1.00 0.00 H new ATOM 1459 N GLN A 212 1.627 5.305 -2.790 1.00 0.00 N ATOM 1460 CA GLN A 212 2.283 6.429 -2.149 1.00 0.00 C ATOM 1461 C GLN A 212 2.959 5.914 -0.880 1.00 0.00 C ATOM 1462 O GLN A 212 4.135 6.187 -0.653 1.00 0.00 O ATOM 1463 CB GLN A 212 1.237 7.514 -1.860 1.00 0.00 C ATOM 1464 CG GLN A 212 0.387 7.974 -3.033 1.00 0.00 C ATOM 1465 CD GLN A 212 0.953 9.211 -3.660 1.00 0.00 C ATOM 1466 OE1 GLN A 212 1.166 10.237 -3.023 1.00 0.00 O ATOM 1467 NE2 GLN A 212 1.241 9.136 -4.927 1.00 0.00 N ATOM 0 H GLN A 212 0.609 5.358 -2.746 1.00 0.00 H new ATOM 0 HA GLN A 212 3.046 6.876 -2.786 1.00 0.00 H new ATOM 0 HB2 GLN A 212 0.570 7.144 -1.081 1.00 0.00 H new ATOM 0 HB3 GLN A 212 1.753 8.383 -1.452 1.00 0.00 H new ATOM 0 HG2 GLN A 212 0.329 7.180 -3.777 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -0.631 8.168 -2.694 1.00 0.00 H new ATOM 0 HE21 GLN A 212 1.057 8.275 -5.442 1.00 0.00 H new ATOM 0 HE22 GLN A 212 1.651 9.938 -5.405 1.00 0.00 H new ATOM 1476 N MET A 213 2.243 5.101 -0.096 1.00 0.00 N ATOM 1477 CA MET A 213 2.746 4.378 1.051 1.00 0.00 C ATOM 1478 C MET A 213 3.975 3.555 0.683 1.00 0.00 C ATOM 1479 O MET A 213 4.982 3.676 1.371 1.00 0.00 O ATOM 1480 CB MET A 213 1.635 3.476 1.613 1.00 0.00 C ATOM 1481 CG MET A 213 0.419 4.262 2.119 1.00 0.00 C ATOM 1482 SD MET A 213 -1.034 3.290 2.641 1.00 0.00 S ATOM 1483 CE MET A 213 -0.364 1.980 3.697 1.00 0.00 C ATOM 0 H MET A 213 1.251 4.929 -0.262 1.00 0.00 H new ATOM 0 HA MET A 213 3.048 5.094 1.815 1.00 0.00 H new ATOM 0 HB2 MET A 213 1.313 2.780 0.838 1.00 0.00 H new ATOM 0 HB3 MET A 213 2.039 2.878 2.430 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.738 4.874 2.962 1.00 0.00 H new ATOM 0 HG3 MET A 213 0.104 4.945 1.330 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.090 1.171 3.778 1.00 0.00 H new ATOM 0 HE2 MET A 213 0.559 1.597 3.261 1.00 0.00 H new ATOM 0 HE3 MET A 213 -0.157 2.382 4.689 1.00 0.00 H new ATOM 1493 N CYS A 214 3.918 2.747 -0.380 1.00 0.00 N ATOM 1494 CA CYS A 214 5.038 1.948 -0.859 1.00 0.00 C ATOM 1495 C CYS A 214 6.232 2.874 -1.098 1.00 0.00 C ATOM 1496 O CYS A 214 7.299 2.619 -0.544 1.00 0.00 O ATOM 1497 CB CYS A 214 4.660 1.129 -2.114 1.00 0.00 C ATOM 1498 SG CYS A 214 3.614 -0.351 -1.873 1.00 0.00 S ATOM 0 H CYS A 214 3.073 2.631 -0.939 1.00 0.00 H new ATOM 0 HA CYS A 214 5.313 1.211 -0.104 1.00 0.00 H new ATOM 0 HB2 CYS A 214 4.146 1.795 -2.808 1.00 0.00 H new ATOM 0 HB3 CYS A 214 5.583 0.813 -2.600 1.00 0.00 H new ATOM 1503 N ILE A 215 6.071 3.954 -1.869 1.00 0.00 N ATOM 1504 CA ILE A 215 7.159 4.880 -2.190 1.00 0.00 C ATOM 1505 C ILE A 215 7.736 5.483 -0.900 1.00 0.00 C ATOM 1506 O ILE A 215 8.951 5.489 -0.729 1.00 0.00 O ATOM 1507 CB ILE A 215 6.684 5.974 -3.172 1.00 0.00 C ATOM 1508 CG1 ILE A 215 6.166 5.374 -4.491 1.00 0.00 C ATOM 1509 CG2 ILE A 215 7.819 6.942 -3.558 1.00 0.00 C ATOM 1510 CD1 ILE A 215 5.197 6.309 -5.200 1.00 0.00 C ATOM 0 H ILE A 215 5.178 4.211 -2.289 1.00 0.00 H new ATOM 0 HA ILE A 215 7.955 4.328 -2.689 1.00 0.00 H new ATOM 0 HB ILE A 215 5.890 6.501 -2.642 1.00 0.00 H new ATOM 0 HG12 ILE A 215 7.009 5.160 -5.148 1.00 0.00 H new ATOM 0 HG13 ILE A 215 5.671 4.425 -4.288 1.00 0.00 H new ATOM 0 HG21 ILE A 215 7.437 7.693 -4.250 1.00 0.00 H new ATOM 0 HG22 ILE A 215 8.199 7.433 -2.662 1.00 0.00 H new ATOM 0 HG23 ILE A 215 8.625 6.385 -4.036 1.00 0.00 H new ATOM 0 HD11 ILE A 215 4.856 5.846 -6.126 1.00 0.00 H new ATOM 0 HD12 ILE A 215 4.340 6.503 -4.555 1.00 0.00 H new ATOM 0 HD13 ILE A 215 5.699 7.249 -5.428 1.00 0.00 H new ATOM 1522 N THR A 216 6.902 6.001 0.004 1.00 0.00 N ATOM 1523 CA THR A 216 7.303 6.541 1.300 1.00 0.00 C ATOM 1524 C THR A 216 8.119 5.517 2.089 1.00 0.00 C ATOM 1525 O THR A 216 9.188 5.834 2.610 1.00 0.00 O ATOM 1526 CB THR A 216 6.016 6.936 2.058 1.00 0.00 C ATOM 1527 OG1 THR A 216 5.377 8.037 1.437 1.00 0.00 O ATOM 1528 CG2 THR A 216 6.241 7.277 3.534 1.00 0.00 C ATOM 0 H THR A 216 5.896 6.057 -0.154 1.00 0.00 H new ATOM 0 HA THR A 216 7.942 7.414 1.167 1.00 0.00 H new ATOM 0 HB THR A 216 5.385 6.048 2.017 1.00 0.00 H new ATOM 0 HG1 THR A 216 4.848 7.721 0.675 1.00 0.00 H new ATOM 0 HG21 THR A 216 5.290 7.544 3.995 1.00 0.00 H new ATOM 0 HG22 THR A 216 6.663 6.413 4.047 1.00 0.00 H new ATOM 0 HG23 THR A 216 6.930 8.118 3.612 1.00 0.00 H new ATOM 1536 N GLN A 217 7.610 4.295 2.221 1.00 0.00 N ATOM 1537 CA GLN A 217 8.242 3.311 3.071 1.00 0.00 C ATOM 1538 C GLN A 217 9.582 2.893 2.459 1.00 0.00 C ATOM 1539 O GLN A 217 10.575 2.748 3.163 1.00 0.00 O ATOM 1540 CB GLN A 217 7.296 2.116 3.264 1.00 0.00 C ATOM 1541 CG GLN A 217 6.856 1.946 4.725 1.00 0.00 C ATOM 1542 CD GLN A 217 8.040 1.864 5.685 1.00 0.00 C ATOM 1543 OE1 GLN A 217 8.119 2.631 6.643 1.00 0.00 O ATOM 1544 NE2 GLN A 217 8.973 0.969 5.426 1.00 0.00 N ATOM 0 H GLN A 217 6.766 3.971 1.750 1.00 0.00 H new ATOM 0 HA GLN A 217 8.445 3.734 4.055 1.00 0.00 H new ATOM 0 HB2 GLN A 217 6.415 2.248 2.636 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.793 1.205 2.929 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.219 2.784 5.009 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.254 1.042 4.817 1.00 0.00 H new ATOM 0 HE21 GLN A 217 8.875 0.348 4.623 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.792 0.897 6.029 1.00 0.00 H new ATOM 1553 N TYR A 218 9.626 2.720 1.142 1.00 0.00 N ATOM 1554 CA TYR A 218 10.835 2.350 0.432 1.00 0.00 C ATOM 1555 C TYR A 218 11.862 3.470 0.441 1.00 0.00 C ATOM 1556 O TYR A 218 13.047 3.181 0.515 1.00 0.00 O ATOM 1557 CB TYR A 218 10.446 1.981 -0.987 1.00 0.00 C ATOM 1558 CG TYR A 218 11.602 1.665 -1.924 1.00 0.00 C ATOM 1559 CD1 TYR A 218 12.250 0.414 -1.881 1.00 0.00 C ATOM 1560 CD2 TYR A 218 12.047 2.650 -2.830 1.00 0.00 C ATOM 1561 CE1 TYR A 218 13.330 0.146 -2.744 1.00 0.00 C ATOM 1562 CE2 TYR A 218 13.129 2.390 -3.689 1.00 0.00 C ATOM 1563 CZ TYR A 218 13.780 1.138 -3.646 1.00 0.00 C ATOM 1564 OH TYR A 218 14.832 0.901 -4.476 1.00 0.00 O ATOM 0 H TYR A 218 8.813 2.835 0.536 1.00 0.00 H new ATOM 0 HA TYR A 218 11.304 1.502 0.930 1.00 0.00 H new ATOM 0 HB2 TYR A 218 9.785 1.115 -0.950 1.00 0.00 H new ATOM 0 HB3 TYR A 218 9.871 2.803 -1.413 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.917 -0.341 -1.184 1.00 0.00 H new ATOM 0 HD2 TYR A 218 11.553 3.610 -2.864 1.00 0.00 H new ATOM 0 HE1 TYR A 218 13.815 -0.818 -2.717 1.00 0.00 H new ATOM 0 HE2 TYR A 218 13.462 3.148 -4.382 1.00 0.00 H new ATOM 0 HH TYR A 218 15.000 1.694 -5.026 1.00 0.00 H new ATOM 1574 N GLN A 219 11.446 4.736 0.407 1.00 0.00 N ATOM 1575 CA GLN A 219 12.342 5.876 0.550 1.00 0.00 C ATOM 1576 C GLN A 219 13.140 5.763 1.850 1.00 0.00 C ATOM 1577 O GLN A 219 14.359 5.930 1.829 1.00 0.00 O ATOM 1578 CB GLN A 219 11.511 7.170 0.517 1.00 0.00 C ATOM 1579 CG GLN A 219 11.367 7.741 -0.892 1.00 0.00 C ATOM 1580 CD GLN A 219 10.593 9.054 -0.854 1.00 0.00 C ATOM 1581 OE1 GLN A 219 11.184 10.128 -0.759 1.00 0.00 O ATOM 1582 NE2 GLN A 219 9.273 8.993 -0.869 1.00 0.00 N ATOM 0 H GLN A 219 10.469 4.998 0.278 1.00 0.00 H new ATOM 0 HA GLN A 219 13.056 5.893 -0.273 1.00 0.00 H new ATOM 0 HB2 GLN A 219 10.521 6.972 0.927 1.00 0.00 H new ATOM 0 HB3 GLN A 219 11.980 7.915 1.160 1.00 0.00 H new ATOM 0 HG2 GLN A 219 12.353 7.904 -1.328 1.00 0.00 H new ATOM 0 HG3 GLN A 219 10.850 7.025 -1.531 1.00 0.00 H new ATOM 0 HE21 GLN A 219 8.805 8.090 -0.949 1.00 0.00 H new ATOM 0 HE22 GLN A 219 8.722 9.849 -0.801 1.00 0.00 H new ATOM 1591 N ARG A 220 12.472 5.413 2.955 1.00 0.00 N ATOM 1592 CA ARG A 220 13.106 5.173 4.254 1.00 0.00 C ATOM 1593 C ARG A 220 14.261 4.192 4.102 1.00 0.00 C ATOM 1594 O ARG A 220 15.368 4.449 4.578 1.00 0.00 O ATOM 1595 CB ARG A 220 12.113 4.605 5.271 1.00 0.00 C ATOM 1596 CG ARG A 220 10.843 5.459 5.323 1.00 0.00 C ATOM 1597 CD ARG A 220 10.533 5.885 6.736 1.00 0.00 C ATOM 1598 NE ARG A 220 9.753 4.878 7.468 1.00 0.00 N ATOM 1599 CZ ARG A 220 9.389 4.949 8.751 1.00 0.00 C ATOM 1600 NH1 ARG A 220 9.643 6.038 9.480 1.00 0.00 N ATOM 1601 NH2 ARG A 220 8.807 3.908 9.323 1.00 0.00 N ATOM 0 H ARG A 220 11.460 5.287 2.971 1.00 0.00 H new ATOM 0 HA ARG A 220 13.471 6.134 4.617 1.00 0.00 H new ATOM 0 HB2 ARG A 220 11.857 3.580 5.003 1.00 0.00 H new ATOM 0 HB3 ARG A 220 12.575 4.571 6.258 1.00 0.00 H new ATOM 0 HG2 ARG A 220 10.967 6.340 4.693 1.00 0.00 H new ATOM 0 HG3 ARG A 220 10.004 4.893 4.918 1.00 0.00 H new ATOM 0 HD2 ARG A 220 11.465 6.075 7.268 1.00 0.00 H new ATOM 0 HD3 ARG A 220 9.980 6.824 6.716 1.00 0.00 H new ATOM 0 HE ARG A 220 9.463 4.049 6.949 1.00 0.00 H new ATOM 0 HH11 ARG A 220 10.122 6.834 9.058 1.00 0.00 H new ATOM 0 HH12 ARG A 220 9.358 6.075 10.459 1.00 0.00 H new ATOM 0 HH21 ARG A 220 8.639 3.058 8.785 1.00 0.00 H new ATOM 0 HH22 ARG A 220 8.526 3.955 10.302 1.00 0.00 H new ATOM 1615 N GLU A 221 13.967 3.052 3.477 1.00 0.00 N ATOM 1616 CA GLU A 221 14.877 1.922 3.390 1.00 0.00 C ATOM 1617 C GLU A 221 15.977 2.160 2.369 1.00 0.00 C ATOM 1618 O GLU A 221 17.106 1.750 2.585 1.00 0.00 O ATOM 1619 CB GLU A 221 14.114 0.654 3.016 1.00 0.00 C ATOM 1620 CG GLU A 221 13.068 0.312 4.076 1.00 0.00 C ATOM 1621 CD GLU A 221 13.109 -1.132 4.539 1.00 0.00 C ATOM 1622 OE1 GLU A 221 13.205 -2.038 3.674 1.00 0.00 O ATOM 1623 OE2 GLU A 221 12.861 -1.337 5.750 1.00 0.00 O ATOM 0 H GLU A 221 13.074 2.890 3.011 1.00 0.00 H new ATOM 0 HA GLU A 221 15.337 1.804 4.371 1.00 0.00 H new ATOM 0 HB2 GLU A 221 13.627 0.790 2.050 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.812 -0.176 2.907 1.00 0.00 H new ATOM 0 HG2 GLU A 221 13.212 0.964 4.938 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.077 0.527 3.676 1.00 0.00 H new ATOM 1630 N SER A 222 15.658 2.841 1.276 1.00 0.00 N ATOM 1631 CA SER A 222 16.572 3.290 0.242 1.00 0.00 C ATOM 1632 C SER A 222 17.736 4.029 0.901 1.00 0.00 C ATOM 1633 O SER A 222 18.896 3.746 0.602 1.00 0.00 O ATOM 1634 CB SER A 222 15.779 4.183 -0.728 1.00 0.00 C ATOM 1635 OG SER A 222 16.549 4.670 -1.812 1.00 0.00 O ATOM 0 H SER A 222 14.694 3.109 1.079 1.00 0.00 H new ATOM 0 HA SER A 222 16.994 2.459 -0.323 1.00 0.00 H new ATOM 0 HB2 SER A 222 14.933 3.618 -1.120 1.00 0.00 H new ATOM 0 HB3 SER A 222 15.369 5.029 -0.176 1.00 0.00 H new ATOM 0 HG SER A 222 15.986 5.227 -2.389 1.00 0.00 H new ATOM 1641 N GLU A 223 17.439 4.942 1.831 1.00 0.00 N ATOM 1642 CA GLU A 223 18.491 5.639 2.544 1.00 0.00 C ATOM 1643 C GLU A 223 19.179 4.701 3.537 1.00 0.00 C ATOM 1644 O GLU A 223 20.384 4.813 3.718 1.00 0.00 O ATOM 1645 CB GLU A 223 17.942 6.896 3.228 1.00 0.00 C ATOM 1646 CG GLU A 223 17.536 7.964 2.196 1.00 0.00 C ATOM 1647 CD GLU A 223 17.686 9.369 2.772 1.00 0.00 C ATOM 1648 OE1 GLU A 223 16.772 9.827 3.502 1.00 0.00 O ATOM 1649 OE2 GLU A 223 18.744 9.992 2.532 1.00 0.00 O ATOM 0 H GLU A 223 16.491 5.207 2.098 1.00 0.00 H new ATOM 0 HA GLU A 223 19.244 5.965 1.827 1.00 0.00 H new ATOM 0 HB2 GLU A 223 17.079 6.632 3.840 1.00 0.00 H new ATOM 0 HB3 GLU A 223 18.696 7.305 3.900 1.00 0.00 H new ATOM 0 HG2 GLU A 223 18.154 7.865 1.304 1.00 0.00 H new ATOM 0 HG3 GLU A 223 16.503 7.802 1.888 1.00 0.00 H new ATOM 1656 N ALA A 224 18.475 3.771 4.191 1.00 0.00 N ATOM 1657 CA ALA A 224 19.050 2.803 5.141 1.00 0.00 C ATOM 1658 C ALA A 224 20.015 1.802 4.489 1.00 0.00 C ATOM 1659 O ALA A 224 20.970 1.364 5.128 1.00 0.00 O ATOM 1660 CB ALA A 224 17.919 2.061 5.859 1.00 0.00 C ATOM 0 H ALA A 224 17.467 3.665 4.074 1.00 0.00 H new ATOM 0 HA ALA A 224 19.645 3.373 5.855 1.00 0.00 H new ATOM 0 HB1 ALA A 224 18.343 1.344 6.562 1.00 0.00 H new ATOM 0 HB2 ALA A 224 17.300 2.777 6.399 1.00 0.00 H new ATOM 0 HB3 ALA A 224 17.308 1.533 5.127 1.00 0.00 H new ATOM 1666 N TYR A 225 19.808 1.497 3.213 1.00 0.00 N ATOM 1667 CA TYR A 225 20.617 0.631 2.371 1.00 0.00 C ATOM 1668 C TYR A 225 21.969 1.294 2.066 1.00 0.00 C ATOM 1669 O TYR A 225 22.880 0.631 1.565 1.00 0.00 O ATOM 1670 CB TYR A 225 19.759 0.321 1.124 1.00 0.00 C ATOM 1671 CG TYR A 225 20.458 0.112 -0.202 1.00 0.00 C ATOM 1672 CD1 TYR A 225 20.731 1.227 -1.016 1.00 0.00 C ATOM 1673 CD2 TYR A 225 20.767 -1.184 -0.652 1.00 0.00 C ATOM 1674 CE1 TYR A 225 21.328 1.057 -2.277 1.00 0.00 C ATOM 1675 CE2 TYR A 225 21.363 -1.363 -1.912 1.00 0.00 C ATOM 1676 CZ TYR A 225 21.650 -0.244 -2.727 1.00 0.00 C ATOM 1677 OH TYR A 225 22.250 -0.437 -3.933 1.00 0.00 O ATOM 0 H TYR A 225 19.010 1.878 2.705 1.00 0.00 H new ATOM 0 HA TYR A 225 20.881 -0.309 2.856 1.00 0.00 H new ATOM 0 HB2 TYR A 225 19.178 -0.576 1.337 1.00 0.00 H new ATOM 0 HB3 TYR A 225 19.049 1.139 0.999 1.00 0.00 H new ATOM 0 HD1 TYR A 225 20.480 2.219 -0.670 1.00 0.00 H new ATOM 0 HD2 TYR A 225 20.547 -2.040 -0.031 1.00 0.00 H new ATOM 0 HE1 TYR A 225 21.539 1.915 -2.898 1.00 0.00 H new ATOM 0 HE2 TYR A 225 21.602 -2.358 -2.258 1.00 0.00 H new ATOM 0 HH TYR A 225 22.397 -1.395 -4.076 1.00 0.00 H new ATOM 1687 N TYR A 226 22.114 2.581 2.397 1.00 0.00 N ATOM 1688 CA TYR A 226 23.188 3.454 1.957 1.00 0.00 C ATOM 1689 C TYR A 226 23.924 4.130 3.121 1.00 0.00 C ATOM 1690 O TYR A 226 25.126 3.940 3.288 1.00 0.00 O ATOM 1691 CB TYR A 226 22.532 4.500 1.054 1.00 0.00 C ATOM 1692 CG TYR A 226 23.520 5.351 0.289 1.00 0.00 C ATOM 1693 CD1 TYR A 226 24.475 4.731 -0.539 1.00 0.00 C ATOM 1694 CD2 TYR A 226 23.490 6.750 0.407 1.00 0.00 C ATOM 1695 CE1 TYR A 226 25.426 5.504 -1.224 1.00 0.00 C ATOM 1696 CE2 TYR A 226 24.410 7.534 -0.316 1.00 0.00 C ATOM 1697 CZ TYR A 226 25.396 6.914 -1.116 1.00 0.00 C ATOM 1698 OH TYR A 226 26.336 7.652 -1.769 1.00 0.00 O ATOM 0 H TYR A 226 21.450 3.057 3.008 1.00 0.00 H new ATOM 0 HA TYR A 226 23.950 2.875 1.435 1.00 0.00 H new ATOM 0 HB2 TYR A 226 21.876 3.995 0.345 1.00 0.00 H new ATOM 0 HB3 TYR A 226 21.903 5.149 1.663 1.00 0.00 H new ATOM 0 HD1 TYR A 226 24.476 3.656 -0.648 1.00 0.00 H new ATOM 0 HD2 TYR A 226 22.763 7.224 1.051 1.00 0.00 H new ATOM 0 HE1 TYR A 226 26.178 5.023 -1.832 1.00 0.00 H new ATOM 0 HE2 TYR A 226 24.362 8.611 -0.259 1.00 0.00 H new ATOM 0 HH TYR A 226 26.181 8.604 -1.598 1.00 0.00 H new