USER MOD reduce.3.24.130724 H: found=0, std=0, add=610, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 501 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 188 MET CE :methyl 146:sc= -2.56! (180deg=-4.73!) USER MOD Set 1.2: A 197 SER OG : rot -40:sc= -0.219 USER MOD Set 2.1: A 174 SER OG : rot -167:sc= 0.517 USER MOD Set 2.2: A 187 SER OG : rot 72:sc= 1.72 USER MOD Single : A 176 SER OG : rot 180:sc= -0.143 USER MOD Single : A 177 SER OG : rot 180:sc= 0 USER MOD Single : A 179 THR OG1 : rot 180:sc= 0.0279 USER MOD Single : A 180 TYR OH : rot 180:sc= 0 USER MOD Single : A 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 MET CE :methyl -144:sc= -1.15 (180deg=-1.72) USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 GLN : amide:sc=-0.00543 X(o=-0.0054,f=-0.0054) USER MOD Single : A 192 ASN : amide:sc= 1.14 K(o=1.1,f=-0.52) USER MOD Single : A 195 LYS NZ :NH3+ -151:sc= 1.2 (180deg=0.495) USER MOD Single : A 198 SER OG : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ 157:sc= 1.27 (180deg=0.713) USER MOD Single : A 204 LYS NZ :NH3+ 171:sc= -0.0276 (180deg=-0.163) USER MOD Single : A 205 TYR OH : rot 180:sc= 0 USER MOD Single : A 207 LYS NZ :NH3+ -123:sc= -0.145 (180deg=-0.989) USER MOD Single : A 209 THR OG1 : rot -71:sc= 0.488 USER MOD Single : A 210 TYR OH : rot 107:sc= -1.01 USER MOD Single : A 215 SER OG : rot -59:sc= 0.177 USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 218 ASN : amide:sc= -2.26 K(o=-2.3,f=-6.7!) USER MOD Single : A 221 TYR OH : rot 180:sc= 0 USER MOD Single : A 224 ASN : amide:sc= 0.276 K(o=0.28,f=-5!) USER MOD Single : A 225 SER OG : rot 73:sc= 1.25 USER MOD Single : A 228 LYS NZ :NH3+ 173:sc=-0.00266 (180deg=-0.0867) USER MOD Single : A 229 LYS NZ :NH3+ -158:sc= -0.105 (180deg=-0.572) USER MOD Single : A 230 CYS SG : rot 75:sc= -2.87! USER MOD Single : A 233 ASN : amide:sc= 0.495 X(o=0.49,f=0) USER MOD Single : A 238 GLN : amide:sc= 1.69 K(o=1.7,f=-7.3!) USER MOD Single : A 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 243 SER OG : rot 180:sc= 0 USER MOD Single : A 247 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 249 ASN : amide:sc= 1.14 K(o=1.1,f=-0.00017) USER MOD ----------------------------------------------------------------- ATOM 41 N SER A 174 -7.398 -8.642 -4.171 1.00 0.00 N ATOM 42 CA SER A 174 -6.225 -8.624 -5.025 1.00 0.00 C ATOM 43 C SER A 174 -6.361 -9.683 -6.121 1.00 0.00 C ATOM 44 O SER A 174 -6.792 -10.804 -5.851 1.00 0.00 O ATOM 45 CB SER A 174 -4.966 -8.862 -4.189 1.00 0.00 C ATOM 46 OG SER A 174 -4.895 -7.947 -3.104 1.00 0.00 O ATOM 0 HA SER A 174 -6.141 -7.647 -5.501 1.00 0.00 H new ATOM 0 HB2 SER A 174 -4.965 -9.883 -3.809 1.00 0.00 H new ATOM 0 HB3 SER A 174 -4.082 -8.755 -4.818 1.00 0.00 H new ATOM 0 HG SER A 174 -4.000 -7.980 -2.706 1.00 0.00 H new ATOM 51 N PRO A 175 -6.110 -9.300 -7.385 1.00 0.00 N ATOM 52 CA PRO A 175 -6.285 -10.192 -8.544 1.00 0.00 C ATOM 53 C PRO A 175 -5.242 -11.318 -8.603 1.00 0.00 C ATOM 54 O PRO A 175 -4.913 -11.929 -7.585 1.00 0.00 O ATOM 55 CB PRO A 175 -6.144 -9.244 -9.742 1.00 0.00 C ATOM 56 CG PRO A 175 -5.337 -8.103 -9.234 1.00 0.00 C ATOM 57 CD PRO A 175 -5.722 -7.938 -7.793 1.00 0.00 C ATOM 0 HA PRO A 175 -7.239 -10.718 -8.509 1.00 0.00 H new ATOM 0 HB2 PRO A 175 -5.649 -9.736 -10.579 1.00 0.00 H new ATOM 0 HB3 PRO A 175 -7.118 -8.911 -10.099 1.00 0.00 H new ATOM 0 HG2 PRO A 175 -4.270 -8.304 -9.333 1.00 0.00 H new ATOM 0 HG3 PRO A 175 -5.544 -7.195 -9.800 1.00 0.00 H new ATOM 0 HD2 PRO A 175 -4.892 -7.561 -7.196 1.00 0.00 H new ATOM 0 HD3 PRO A 175 -6.545 -7.233 -7.675 1.00 0.00 H new ATOM 62 N SER A 176 -4.804 -11.666 -9.807 1.00 0.00 N ATOM 63 CA SER A 176 -3.886 -12.780 -9.995 1.00 0.00 C ATOM 64 C SER A 176 -3.045 -12.581 -11.256 1.00 0.00 C ATOM 65 O SER A 176 -3.386 -11.757 -12.110 1.00 0.00 O ATOM 66 CB SER A 176 -4.672 -14.093 -10.071 1.00 0.00 C ATOM 67 OG SER A 176 -5.438 -14.293 -8.891 1.00 0.00 O ATOM 0 H SER A 176 -5.071 -11.191 -10.669 1.00 0.00 H new ATOM 0 HA SER A 176 -3.208 -12.824 -9.143 1.00 0.00 H new ATOM 0 HB2 SER A 176 -5.331 -14.078 -10.939 1.00 0.00 H new ATOM 0 HB3 SER A 176 -3.983 -14.927 -10.208 1.00 0.00 H new ATOM 0 HG SER A 176 -5.933 -15.136 -8.961 1.00 0.00 H new ATOM 72 N SER A 177 -1.932 -13.315 -11.340 1.00 0.00 N ATOM 73 CA SER A 177 -1.008 -13.235 -12.472 1.00 0.00 C ATOM 74 C SER A 177 -0.403 -11.835 -12.595 1.00 0.00 C ATOM 75 O SER A 177 -0.370 -11.240 -13.672 1.00 0.00 O ATOM 76 CB SER A 177 -1.714 -13.648 -13.765 1.00 0.00 C ATOM 77 OG SER A 177 -2.282 -14.943 -13.631 1.00 0.00 O ATOM 0 H SER A 177 -1.647 -13.982 -10.623 1.00 0.00 H new ATOM 0 HA SER A 177 -0.187 -13.930 -12.293 1.00 0.00 H new ATOM 0 HB2 SER A 177 -2.494 -12.926 -14.007 1.00 0.00 H new ATOM 0 HB3 SER A 177 -1.004 -13.640 -14.592 1.00 0.00 H new ATOM 0 HG SER A 177 -2.731 -15.191 -14.466 1.00 0.00 H new ATOM 82 N LEU A 178 0.111 -11.336 -11.480 1.00 0.00 N ATOM 83 CA LEU A 178 0.750 -10.032 -11.441 1.00 0.00 C ATOM 84 C LEU A 178 2.112 -10.132 -10.784 1.00 0.00 C ATOM 85 O LEU A 178 2.406 -11.109 -10.095 1.00 0.00 O ATOM 86 CB LEU A 178 -0.116 -9.027 -10.680 1.00 0.00 C ATOM 87 CG LEU A 178 -1.351 -8.528 -11.428 1.00 0.00 C ATOM 88 CD1 LEU A 178 -2.149 -7.577 -10.553 1.00 0.00 C ATOM 89 CD2 LEU A 178 -0.950 -7.840 -12.723 1.00 0.00 C ATOM 0 H LEU A 178 0.096 -11.821 -10.583 1.00 0.00 H new ATOM 0 HA LEU A 178 0.872 -9.684 -12.467 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -0.439 -9.486 -9.745 1.00 0.00 H new ATOM 0 HB3 LEU A 178 0.501 -8.168 -10.417 1.00 0.00 H new ATOM 0 HG LEU A 178 -1.976 -9.387 -11.672 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -3.026 -7.229 -11.099 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -2.467 -8.095 -9.648 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -1.528 -6.723 -10.283 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -1.843 -7.492 -13.242 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -0.306 -6.990 -12.499 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -0.413 -8.545 -13.358 1.00 0.00 H new ATOM 100 N THR A 179 2.930 -9.115 -10.992 1.00 0.00 N ATOM 101 CA THR A 179 4.242 -9.043 -10.375 1.00 0.00 C ATOM 102 C THR A 179 4.097 -8.977 -8.852 1.00 0.00 C ATOM 103 O THR A 179 3.076 -8.503 -8.349 1.00 0.00 O ATOM 104 CB THR A 179 4.998 -7.800 -10.879 1.00 0.00 C ATOM 105 OG1 THR A 179 4.703 -7.584 -12.268 1.00 0.00 O ATOM 106 CG2 THR A 179 6.499 -7.960 -10.704 1.00 0.00 C ATOM 0 H THR A 179 2.705 -8.320 -11.590 1.00 0.00 H new ATOM 0 HA THR A 179 4.807 -9.935 -10.645 1.00 0.00 H new ATOM 0 HB THR A 179 4.671 -6.944 -10.290 1.00 0.00 H new ATOM 0 HG1 THR A 179 5.184 -6.791 -12.585 1.00 0.00 H new ATOM 0 HG21 THR A 179 7.005 -7.066 -11.069 1.00 0.00 H new ATOM 0 HG22 THR A 179 6.729 -8.102 -9.648 1.00 0.00 H new ATOM 0 HG23 THR A 179 6.841 -8.827 -11.269 1.00 0.00 H new ATOM 114 N TYR A 180 5.085 -9.495 -8.128 1.00 0.00 N ATOM 115 CA TYR A 180 5.031 -9.530 -6.665 1.00 0.00 C ATOM 116 C TYR A 180 4.783 -8.131 -6.093 1.00 0.00 C ATOM 117 O TYR A 180 3.999 -7.961 -5.159 1.00 0.00 O ATOM 118 CB TYR A 180 6.323 -10.129 -6.086 1.00 0.00 C ATOM 119 CG TYR A 180 6.454 -11.634 -6.271 1.00 0.00 C ATOM 120 CD1 TYR A 180 6.044 -12.258 -7.445 1.00 0.00 C ATOM 121 CD2 TYR A 180 6.990 -12.429 -5.264 1.00 0.00 C ATOM 122 CE1 TYR A 180 6.160 -13.625 -7.609 1.00 0.00 C ATOM 123 CE2 TYR A 180 7.110 -13.801 -5.422 1.00 0.00 C ATOM 124 CZ TYR A 180 6.694 -14.393 -6.597 1.00 0.00 C ATOM 125 OH TYR A 180 6.811 -15.758 -6.759 1.00 0.00 O ATOM 0 H TYR A 180 5.933 -9.897 -8.528 1.00 0.00 H new ATOM 0 HA TYR A 180 4.197 -10.169 -6.375 1.00 0.00 H new ATOM 0 HB2 TYR A 180 7.178 -9.641 -6.555 1.00 0.00 H new ATOM 0 HB3 TYR A 180 6.370 -9.900 -5.021 1.00 0.00 H new ATOM 0 HD1 TYR A 180 5.627 -11.662 -8.244 1.00 0.00 H new ATOM 0 HD2 TYR A 180 7.318 -11.970 -4.343 1.00 0.00 H new ATOM 0 HE1 TYR A 180 5.833 -14.090 -8.527 1.00 0.00 H new ATOM 0 HE2 TYR A 180 7.527 -14.404 -4.629 1.00 0.00 H new ATOM 0 HH TYR A 180 7.208 -16.150 -5.953 1.00 0.00 H new ATOM 134 N LYS A 181 5.381 -7.127 -6.727 1.00 0.00 N ATOM 135 CA LYS A 181 5.166 -5.734 -6.350 1.00 0.00 C ATOM 136 C LYS A 181 3.690 -5.348 -6.490 1.00 0.00 C ATOM 137 O LYS A 181 3.111 -4.735 -5.590 1.00 0.00 O ATOM 138 CB LYS A 181 6.023 -4.819 -7.229 1.00 0.00 C ATOM 139 CG LYS A 181 5.795 -3.335 -6.975 1.00 0.00 C ATOM 140 CD LYS A 181 6.610 -2.465 -7.920 1.00 0.00 C ATOM 141 CE LYS A 181 6.175 -2.644 -9.367 1.00 0.00 C ATOM 142 NZ LYS A 181 6.916 -1.738 -10.281 1.00 0.00 N ATOM 0 H LYS A 181 6.023 -7.254 -7.510 1.00 0.00 H new ATOM 0 HA LYS A 181 5.456 -5.615 -5.306 1.00 0.00 H new ATOM 0 HB2 LYS A 181 7.075 -5.050 -7.061 1.00 0.00 H new ATOM 0 HB3 LYS A 181 5.813 -5.036 -8.276 1.00 0.00 H new ATOM 0 HG2 LYS A 181 4.736 -3.105 -7.093 1.00 0.00 H new ATOM 0 HG3 LYS A 181 6.060 -3.098 -5.945 1.00 0.00 H new ATOM 0 HD2 LYS A 181 6.503 -1.418 -7.635 1.00 0.00 H new ATOM 0 HD3 LYS A 181 7.667 -2.715 -7.824 1.00 0.00 H new ATOM 0 HE2 LYS A 181 6.337 -3.678 -9.670 1.00 0.00 H new ATOM 0 HE3 LYS A 181 5.106 -2.451 -9.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 6.592 -1.889 -11.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 6.741 -0.750 -10.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 7.934 -1.939 -10.219 1.00 0.00 H new ATOM 152 N GLU A 182 3.090 -5.719 -7.620 1.00 0.00 N ATOM 153 CA GLU A 182 1.692 -5.397 -7.904 1.00 0.00 C ATOM 154 C GLU A 182 0.763 -6.026 -6.873 1.00 0.00 C ATOM 155 O GLU A 182 -0.277 -5.459 -6.530 1.00 0.00 O ATOM 156 CB GLU A 182 1.315 -5.878 -9.306 1.00 0.00 C ATOM 157 CG GLU A 182 2.277 -5.415 -10.388 1.00 0.00 C ATOM 158 CD GLU A 182 2.296 -3.909 -10.563 1.00 0.00 C ATOM 159 OE1 GLU A 182 1.435 -3.220 -9.977 1.00 0.00 O ATOM 160 OE2 GLU A 182 3.165 -3.410 -11.306 1.00 0.00 O ATOM 0 H GLU A 182 3.554 -6.247 -8.359 1.00 0.00 H new ATOM 0 HA GLU A 182 1.578 -4.314 -7.852 1.00 0.00 H new ATOM 0 HB2 GLU A 182 1.275 -6.967 -9.309 1.00 0.00 H new ATOM 0 HB3 GLU A 182 0.313 -5.522 -9.546 1.00 0.00 H new ATOM 0 HG2 GLU A 182 3.282 -5.759 -10.144 1.00 0.00 H new ATOM 0 HG3 GLU A 182 2.002 -5.881 -11.334 1.00 0.00 H new ATOM 165 N MET A 183 1.146 -7.203 -6.389 1.00 0.00 N ATOM 166 CA MET A 183 0.364 -7.921 -5.388 1.00 0.00 C ATOM 167 C MET A 183 0.182 -7.066 -4.140 1.00 0.00 C ATOM 168 O MET A 183 -0.936 -6.892 -3.648 1.00 0.00 O ATOM 169 CB MET A 183 1.058 -9.232 -5.005 1.00 0.00 C ATOM 170 CG MET A 183 1.308 -10.162 -6.178 1.00 0.00 C ATOM 171 SD MET A 183 2.182 -11.661 -5.694 1.00 0.00 S ATOM 172 CE MET A 183 2.311 -12.507 -7.268 1.00 0.00 C ATOM 0 H MET A 183 1.999 -7.683 -6.676 1.00 0.00 H new ATOM 0 HA MET A 183 -0.613 -8.143 -5.818 1.00 0.00 H new ATOM 0 HB2 MET A 183 2.010 -9.001 -4.528 1.00 0.00 H new ATOM 0 HB3 MET A 183 0.449 -9.752 -4.266 1.00 0.00 H new ATOM 0 HG2 MET A 183 0.355 -10.432 -6.634 1.00 0.00 H new ATOM 0 HG3 MET A 183 1.887 -9.637 -6.937 1.00 0.00 H new ATOM 0 HE1 MET A 183 2.208 -13.581 -7.113 1.00 0.00 H new ATOM 0 HE2 MET A 183 1.521 -12.159 -7.934 1.00 0.00 H new ATOM 0 HE3 MET A 183 3.282 -12.296 -7.716 1.00 0.00 H new ATOM 180 N ILE A 184 1.284 -6.518 -3.648 1.00 0.00 N ATOM 181 CA ILE A 184 1.251 -5.684 -2.458 1.00 0.00 C ATOM 182 C ILE A 184 0.539 -4.368 -2.733 1.00 0.00 C ATOM 183 O ILE A 184 -0.260 -3.915 -1.919 1.00 0.00 O ATOM 184 CB ILE A 184 2.662 -5.384 -1.921 1.00 0.00 C ATOM 185 CG1 ILE A 184 3.419 -6.683 -1.660 1.00 0.00 C ATOM 186 CG2 ILE A 184 2.571 -4.554 -0.648 1.00 0.00 C ATOM 187 CD1 ILE A 184 4.837 -6.467 -1.174 1.00 0.00 C ATOM 0 H ILE A 184 2.212 -6.637 -4.055 1.00 0.00 H new ATOM 0 HA ILE A 184 0.704 -6.248 -1.703 1.00 0.00 H new ATOM 0 HB ILE A 184 3.209 -4.813 -2.671 1.00 0.00 H new ATOM 0 HG12 ILE A 184 2.875 -7.269 -0.920 1.00 0.00 H new ATOM 0 HG13 ILE A 184 3.443 -7.271 -2.577 1.00 0.00 H new ATOM 0 HG21 ILE A 184 3.574 -4.347 -0.276 1.00 0.00 H new ATOM 0 HG22 ILE A 184 2.062 -3.614 -0.862 1.00 0.00 H new ATOM 0 HG23 ILE A 184 2.011 -5.106 0.107 1.00 0.00 H new ATOM 0 HD11 ILE A 184 5.316 -7.432 -1.009 1.00 0.00 H new ATOM 0 HD12 ILE A 184 5.397 -5.908 -1.923 1.00 0.00 H new ATOM 0 HD13 ILE A 184 4.820 -5.906 -0.240 1.00 0.00 H new ATOM 198 N LEU A 185 0.837 -3.759 -3.878 1.00 0.00 N ATOM 199 CA LEU A 185 0.241 -2.476 -4.251 1.00 0.00 C ATOM 200 C LEU A 185 -1.283 -2.540 -4.178 1.00 0.00 C ATOM 201 O LEU A 185 -1.932 -1.610 -3.703 1.00 0.00 O ATOM 202 CB LEU A 185 0.679 -2.067 -5.659 1.00 0.00 C ATOM 203 CG LEU A 185 2.182 -1.832 -5.831 1.00 0.00 C ATOM 204 CD1 LEU A 185 2.493 -1.418 -7.258 1.00 0.00 C ATOM 205 CD2 LEU A 185 2.679 -0.783 -4.848 1.00 0.00 C ATOM 0 H LEU A 185 1.490 -4.134 -4.566 1.00 0.00 H new ATOM 0 HA LEU A 185 0.591 -1.727 -3.541 1.00 0.00 H new ATOM 0 HB2 LEU A 185 0.366 -2.842 -6.359 1.00 0.00 H new ATOM 0 HB3 LEU A 185 0.151 -1.155 -5.936 1.00 0.00 H new ATOM 0 HG LEU A 185 2.702 -2.767 -5.621 1.00 0.00 H new ATOM 0 HD11 LEU A 185 3.565 -1.255 -7.364 1.00 0.00 H new ATOM 0 HD12 LEU A 185 2.176 -2.205 -7.942 1.00 0.00 H new ATOM 0 HD13 LEU A 185 1.961 -0.496 -7.494 1.00 0.00 H new ATOM 0 HD21 LEU A 185 3.749 -0.632 -4.988 1.00 0.00 H new ATOM 0 HD22 LEU A 185 2.154 0.156 -5.022 1.00 0.00 H new ATOM 0 HD23 LEU A 185 2.490 -1.121 -3.829 1.00 0.00 H new ATOM 216 N LYS A 186 -1.842 -3.663 -4.606 1.00 0.00 N ATOM 217 CA LYS A 186 -3.281 -3.876 -4.539 1.00 0.00 C ATOM 218 C LYS A 186 -3.730 -4.140 -3.098 1.00 0.00 C ATOM 219 O LYS A 186 -4.779 -3.661 -2.666 1.00 0.00 O ATOM 220 CB LYS A 186 -3.683 -5.044 -5.442 1.00 0.00 C ATOM 221 CG LYS A 186 -5.155 -5.407 -5.349 1.00 0.00 C ATOM 222 CD LYS A 186 -6.043 -4.221 -5.678 1.00 0.00 C ATOM 223 CE LYS A 186 -7.493 -4.506 -5.334 1.00 0.00 C ATOM 224 NZ LYS A 186 -8.346 -3.308 -5.527 1.00 0.00 N ATOM 0 H LYS A 186 -1.319 -4.443 -5.005 1.00 0.00 H new ATOM 0 HA LYS A 186 -3.777 -2.970 -4.888 1.00 0.00 H new ATOM 0 HB2 LYS A 186 -3.444 -4.792 -6.475 1.00 0.00 H new ATOM 0 HB3 LYS A 186 -3.085 -5.917 -5.180 1.00 0.00 H new ATOM 0 HG2 LYS A 186 -5.373 -6.227 -6.034 1.00 0.00 H new ATOM 0 HG3 LYS A 186 -5.380 -5.763 -4.344 1.00 0.00 H new ATOM 0 HD2 LYS A 186 -5.702 -3.345 -5.127 1.00 0.00 H new ATOM 0 HD3 LYS A 186 -5.958 -3.984 -6.738 1.00 0.00 H new ATOM 0 HE2 LYS A 186 -7.862 -5.320 -5.958 1.00 0.00 H new ATOM 0 HE3 LYS A 186 -7.563 -4.840 -4.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 186 -9.330 -3.539 -5.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 186 -8.009 -2.539 -4.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 186 -8.298 -3.004 -6.521 1.00 0.00 H new ATOM 234 N SER A 187 -2.952 -4.943 -2.386 1.00 0.00 N ATOM 235 CA SER A 187 -3.290 -5.348 -1.025 1.00 0.00 C ATOM 236 C SER A 187 -3.196 -4.185 -0.031 1.00 0.00 C ATOM 237 O SER A 187 -3.873 -4.193 0.997 1.00 0.00 O ATOM 238 CB SER A 187 -2.375 -6.489 -0.585 1.00 0.00 C ATOM 239 OG SER A 187 -2.457 -7.575 -1.494 1.00 0.00 O ATOM 0 H SER A 187 -2.074 -5.331 -2.731 1.00 0.00 H new ATOM 0 HA SER A 187 -4.327 -5.684 -1.030 1.00 0.00 H new ATOM 0 HB2 SER A 187 -1.346 -6.135 -0.526 1.00 0.00 H new ATOM 0 HB3 SER A 187 -2.655 -6.822 0.414 1.00 0.00 H new ATOM 0 HG SER A 187 -2.004 -7.337 -2.330 1.00 0.00 H new ATOM 244 N MET A 188 -2.305 -3.234 -0.303 1.00 0.00 N ATOM 245 CA MET A 188 -2.059 -2.112 0.611 1.00 0.00 C ATOM 246 C MET A 188 -3.349 -1.389 1.021 1.00 0.00 C ATOM 247 O MET A 188 -3.647 -1.314 2.208 1.00 0.00 O ATOM 248 CB MET A 188 -1.066 -1.116 0.000 1.00 0.00 C ATOM 249 CG MET A 188 0.388 -1.561 0.062 1.00 0.00 C ATOM 250 SD MET A 188 1.156 -1.269 1.669 1.00 0.00 S ATOM 251 CE MET A 188 0.423 -2.567 2.663 1.00 0.00 C ATOM 0 H MET A 188 -1.738 -3.215 -1.151 1.00 0.00 H new ATOM 0 HA MET A 188 -1.626 -2.539 1.516 1.00 0.00 H new ATOM 0 HB2 MET A 188 -1.337 -0.944 -1.042 1.00 0.00 H new ATOM 0 HB3 MET A 188 -1.164 -0.161 0.516 1.00 0.00 H new ATOM 0 HG2 MET A 188 0.446 -2.624 -0.173 1.00 0.00 H new ATOM 0 HG3 MET A 188 0.955 -1.034 -0.705 1.00 0.00 H new ATOM 0 HE1 MET A 188 1.148 -2.914 3.400 1.00 0.00 H new ATOM 0 HE2 MET A 188 -0.458 -2.180 3.175 1.00 0.00 H new ATOM 0 HE3 MET A 188 0.133 -3.398 2.020 1.00 0.00 H new ATOM 259 N PRO A 189 -4.149 -0.859 0.066 1.00 0.00 N ATOM 260 CA PRO A 189 -5.400 -0.159 0.394 1.00 0.00 C ATOM 261 C PRO A 189 -6.377 -1.053 1.155 1.00 0.00 C ATOM 262 O PRO A 189 -7.199 -0.571 1.938 1.00 0.00 O ATOM 263 CB PRO A 189 -5.983 0.219 -0.972 1.00 0.00 C ATOM 264 CG PRO A 189 -4.826 0.189 -1.904 1.00 0.00 C ATOM 265 CD PRO A 189 -3.915 -0.887 -1.389 1.00 0.00 C ATOM 0 HA PRO A 189 -5.222 0.699 1.043 1.00 0.00 H new ATOM 0 HB2 PRO A 189 -6.756 -0.485 -1.280 1.00 0.00 H new ATOM 0 HB3 PRO A 189 -6.443 1.207 -0.945 1.00 0.00 H new ATOM 0 HG2 PRO A 189 -5.149 -0.027 -2.922 1.00 0.00 H new ATOM 0 HG3 PRO A 189 -4.318 1.153 -1.928 1.00 0.00 H new ATOM 0 HD2 PRO A 189 -4.158 -1.859 -1.817 1.00 0.00 H new ATOM 0 HD3 PRO A 189 -2.872 -0.683 -1.633 1.00 0.00 H new ATOM 270 N GLN A 190 -6.282 -2.354 0.914 1.00 0.00 N ATOM 271 CA GLN A 190 -7.151 -3.321 1.565 1.00 0.00 C ATOM 272 C GLN A 190 -6.791 -3.455 3.043 1.00 0.00 C ATOM 273 O GLN A 190 -7.666 -3.622 3.894 1.00 0.00 O ATOM 274 CB GLN A 190 -7.045 -4.692 0.890 1.00 0.00 C ATOM 275 CG GLN A 190 -7.056 -4.649 -0.631 1.00 0.00 C ATOM 276 CD GLN A 190 -8.221 -3.864 -1.200 1.00 0.00 C ATOM 277 OE1 GLN A 190 -9.380 -4.124 -0.880 1.00 0.00 O ATOM 278 NE2 GLN A 190 -7.919 -2.916 -2.071 1.00 0.00 N ATOM 0 H GLN A 190 -5.607 -2.764 0.268 1.00 0.00 H new ATOM 0 HA GLN A 190 -8.176 -2.960 1.475 1.00 0.00 H new ATOM 0 HB2 GLN A 190 -6.126 -5.176 1.221 1.00 0.00 H new ATOM 0 HB3 GLN A 190 -7.873 -5.315 1.229 1.00 0.00 H new ATOM 0 HG2 GLN A 190 -6.123 -4.207 -0.982 1.00 0.00 H new ATOM 0 HG3 GLN A 190 -7.091 -5.668 -1.016 1.00 0.00 H new ATOM 0 HE21 GLN A 190 -6.944 -2.733 -2.308 1.00 0.00 H new ATOM 0 HE22 GLN A 190 -8.661 -2.368 -2.506 1.00 0.00 H new ATOM 285 N LEU A 191 -5.497 -3.439 3.331 1.00 0.00 N ATOM 286 CA LEU A 191 -5.009 -3.604 4.693 1.00 0.00 C ATOM 287 C LEU A 191 -4.855 -2.256 5.399 1.00 0.00 C ATOM 288 O LEU A 191 -4.025 -1.430 5.014 1.00 0.00 O ATOM 289 CB LEU A 191 -3.669 -4.338 4.682 1.00 0.00 C ATOM 290 CG LEU A 191 -3.695 -5.756 4.106 1.00 0.00 C ATOM 291 CD1 LEU A 191 -2.285 -6.302 3.965 1.00 0.00 C ATOM 292 CD2 LEU A 191 -4.524 -6.676 4.984 1.00 0.00 C ATOM 0 H LEU A 191 -4.762 -3.313 2.635 1.00 0.00 H new ATOM 0 HA LEU A 191 -5.744 -4.192 5.243 1.00 0.00 H new ATOM 0 HB2 LEU A 191 -2.956 -3.746 4.109 1.00 0.00 H new ATOM 0 HB3 LEU A 191 -3.294 -4.387 5.704 1.00 0.00 H new ATOM 0 HG LEU A 191 -4.153 -5.711 3.118 1.00 0.00 H new ATOM 0 HD11 LEU A 191 -2.325 -7.311 3.554 1.00 0.00 H new ATOM 0 HD12 LEU A 191 -1.711 -5.660 3.296 1.00 0.00 H new ATOM 0 HD13 LEU A 191 -1.805 -6.328 4.943 1.00 0.00 H new ATOM 0 HD21 LEU A 191 -4.530 -7.679 4.557 1.00 0.00 H new ATOM 0 HD22 LEU A 191 -4.093 -6.710 5.985 1.00 0.00 H new ATOM 0 HD23 LEU A 191 -5.546 -6.301 5.042 1.00 0.00 H new ATOM 303 N ASN A 192 -5.633 -2.068 6.461 1.00 0.00 N ATOM 304 CA ASN A 192 -5.592 -0.853 7.287 1.00 0.00 C ATOM 305 C ASN A 192 -5.722 0.412 6.450 1.00 0.00 C ATOM 306 O ASN A 192 -5.111 1.433 6.767 1.00 0.00 O ATOM 307 CB ASN A 192 -4.297 -0.772 8.106 1.00 0.00 C ATOM 308 CG ASN A 192 -4.171 -1.864 9.147 1.00 0.00 C ATOM 309 OD1 ASN A 192 -5.139 -2.218 9.817 1.00 0.00 O ATOM 310 ND2 ASN A 192 -2.958 -2.364 9.328 1.00 0.00 N ATOM 0 H ASN A 192 -6.316 -2.755 6.779 1.00 0.00 H new ATOM 0 HA ASN A 192 -6.445 -0.920 7.962 1.00 0.00 H new ATOM 0 HB2 ASN A 192 -3.444 -0.826 7.429 1.00 0.00 H new ATOM 0 HB3 ASN A 192 -4.250 0.198 8.601 1.00 0.00 H new ATOM 0 HD21 ASN A 192 -2.800 -3.071 10.046 1.00 0.00 H new ATOM 0 HD22 ASN A 192 -2.182 -2.042 8.750 1.00 0.00 H new ATOM 316 N ASP A 193 -6.519 0.347 5.387 1.00 0.00 N ATOM 317 CA ASP A 193 -6.734 1.492 4.497 1.00 0.00 C ATOM 318 C ASP A 193 -5.413 2.045 3.963 1.00 0.00 C ATOM 319 O ASP A 193 -5.271 3.251 3.753 1.00 0.00 O ATOM 320 CB ASP A 193 -7.515 2.600 5.215 1.00 0.00 C ATOM 321 CG ASP A 193 -8.978 2.258 5.394 1.00 0.00 C ATOM 322 OD1 ASP A 193 -9.720 2.252 4.387 1.00 0.00 O ATOM 323 OD2 ASP A 193 -9.394 1.982 6.537 1.00 0.00 O ATOM 0 H ASP A 193 -7.032 -0.492 5.117 1.00 0.00 H new ATOM 0 HA ASP A 193 -7.320 1.138 3.649 1.00 0.00 H new ATOM 0 HB2 ASP A 193 -7.066 2.782 6.191 1.00 0.00 H new ATOM 0 HB3 ASP A 193 -7.429 3.526 4.647 1.00 0.00 H new ATOM 327 N GLY A 194 -4.460 1.153 3.728 1.00 0.00 N ATOM 328 CA GLY A 194 -3.178 1.543 3.170 1.00 0.00 C ATOM 329 C GLY A 194 -2.345 2.410 4.098 1.00 0.00 C ATOM 330 O GLY A 194 -1.394 3.055 3.658 1.00 0.00 O ATOM 0 H GLY A 194 -4.553 0.155 3.916 1.00 0.00 H new ATOM 0 HA2 GLY A 194 -2.612 0.645 2.921 1.00 0.00 H new ATOM 0 HA3 GLY A 194 -3.347 2.082 2.238 1.00 0.00 H new ATOM 334 N LYS A 195 -2.654 2.392 5.388 1.00 0.00 N ATOM 335 CA LYS A 195 -1.864 3.143 6.356 1.00 0.00 C ATOM 336 C LYS A 195 -0.552 2.428 6.632 1.00 0.00 C ATOM 337 O LYS A 195 0.502 3.054 6.726 1.00 0.00 O ATOM 338 CB LYS A 195 -2.629 3.346 7.667 1.00 0.00 C ATOM 339 CG LYS A 195 -3.773 4.340 7.562 1.00 0.00 C ATOM 340 CD LYS A 195 -4.361 4.650 8.931 1.00 0.00 C ATOM 341 CE LYS A 195 -5.044 3.441 9.545 1.00 0.00 C ATOM 342 NZ LYS A 195 -6.214 3.002 8.747 1.00 0.00 N ATOM 0 H LYS A 195 -3.436 1.872 5.785 1.00 0.00 H new ATOM 0 HA LYS A 195 -1.659 4.124 5.926 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -3.024 2.386 7.999 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -1.933 3.687 8.434 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -3.417 5.261 7.099 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -4.550 3.937 6.913 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -3.569 4.995 9.596 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -5.079 5.465 8.841 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -4.330 2.621 9.623 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -5.365 3.681 10.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -6.913 2.553 9.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -6.645 3.826 8.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -5.906 2.319 8.026 1.00 0.00 H new ATOM 352 N GLY A 196 -0.628 1.115 6.758 1.00 0.00 N ATOM 353 CA GLY A 196 0.545 0.321 7.037 1.00 0.00 C ATOM 354 C GLY A 196 0.170 -1.088 7.426 1.00 0.00 C ATOM 355 O GLY A 196 -0.904 -1.307 7.981 1.00 0.00 O ATOM 0 H GLY A 196 -1.492 0.580 6.671 1.00 0.00 H new ATOM 0 HA2 GLY A 196 1.190 0.299 6.159 1.00 0.00 H new ATOM 0 HA3 GLY A 196 1.117 0.783 7.841 1.00 0.00 H new ATOM 359 N SER A 197 0.992 -2.049 7.051 1.00 0.00 N ATOM 360 CA SER A 197 0.692 -3.446 7.310 1.00 0.00 C ATOM 361 C SER A 197 1.961 -4.219 7.640 1.00 0.00 C ATOM 362 O SER A 197 2.972 -4.093 6.950 1.00 0.00 O ATOM 363 CB SER A 197 0.007 -4.058 6.091 1.00 0.00 C ATOM 364 OG SER A 197 -1.068 -3.244 5.659 1.00 0.00 O ATOM 0 H SER A 197 1.874 -1.889 6.565 1.00 0.00 H new ATOM 0 HA SER A 197 0.024 -3.506 8.169 1.00 0.00 H new ATOM 0 HB2 SER A 197 0.729 -4.175 5.283 1.00 0.00 H new ATOM 0 HB3 SER A 197 -0.361 -5.054 6.336 1.00 0.00 H new ATOM 0 HG SER A 197 -1.550 -2.898 6.439 1.00 0.00 H new ATOM 369 N SER A 198 1.896 -5.018 8.692 1.00 0.00 N ATOM 370 CA SER A 198 3.015 -5.846 9.103 1.00 0.00 C ATOM 371 C SER A 198 3.377 -6.832 7.994 1.00 0.00 C ATOM 372 O SER A 198 2.496 -7.333 7.296 1.00 0.00 O ATOM 373 CB SER A 198 2.647 -6.594 10.390 1.00 0.00 C ATOM 374 OG SER A 198 3.638 -7.540 10.752 1.00 0.00 O ATOM 0 H SER A 198 1.069 -5.110 9.282 1.00 0.00 H new ATOM 0 HA SER A 198 3.883 -5.215 9.294 1.00 0.00 H new ATOM 0 HB2 SER A 198 2.515 -5.878 11.201 1.00 0.00 H new ATOM 0 HB3 SER A 198 1.692 -7.102 10.255 1.00 0.00 H new ATOM 0 HG SER A 198 3.370 -7.995 11.577 1.00 0.00 H new ATOM 379 N ARG A 199 4.666 -7.121 7.847 1.00 0.00 N ATOM 380 CA ARG A 199 5.131 -8.079 6.846 1.00 0.00 C ATOM 381 C ARG A 199 4.402 -9.408 7.003 1.00 0.00 C ATOM 382 O ARG A 199 4.023 -10.039 6.019 1.00 0.00 O ATOM 383 CB ARG A 199 6.644 -8.287 6.975 1.00 0.00 C ATOM 384 CG ARG A 199 7.182 -9.452 6.157 1.00 0.00 C ATOM 385 CD ARG A 199 8.679 -9.624 6.359 1.00 0.00 C ATOM 386 NE ARG A 199 9.447 -8.575 5.692 1.00 0.00 N ATOM 387 CZ ARG A 199 9.870 -8.641 4.428 1.00 0.00 C ATOM 388 NH1 ARG A 199 9.747 -9.773 3.736 1.00 0.00 N ATOM 389 NH2 ARG A 199 10.463 -7.588 3.878 1.00 0.00 N ATOM 0 H ARG A 199 5.409 -6.706 8.409 1.00 0.00 H new ATOM 0 HA ARG A 199 4.914 -7.679 5.855 1.00 0.00 H new ATOM 0 HB2 ARG A 199 7.153 -7.374 6.666 1.00 0.00 H new ATOM 0 HB3 ARG A 199 6.890 -8.450 8.024 1.00 0.00 H new ATOM 0 HG2 ARG A 199 6.667 -10.369 6.443 1.00 0.00 H new ATOM 0 HG3 ARG A 199 6.972 -9.285 5.101 1.00 0.00 H new ATOM 0 HD2 ARG A 199 8.904 -9.615 7.425 1.00 0.00 H new ATOM 0 HD3 ARG A 199 8.987 -10.597 5.976 1.00 0.00 H new ATOM 0 HE ARG A 199 9.675 -7.737 6.228 1.00 0.00 H new ATOM 0 HH11 ARG A 199 9.328 -10.594 4.172 1.00 0.00 H new ATOM 0 HH12 ARG A 199 10.072 -9.818 2.770 1.00 0.00 H new ATOM 0 HH21 ARG A 199 10.593 -6.735 4.421 1.00 0.00 H new ATOM 0 HH22 ARG A 199 10.788 -7.633 2.912 1.00 0.00 H new ATOM 400 N ILE A 200 4.174 -9.796 8.249 1.00 0.00 N ATOM 401 CA ILE A 200 3.476 -11.037 8.559 1.00 0.00 C ATOM 402 C ILE A 200 2.051 -11.039 7.999 1.00 0.00 C ATOM 403 O ILE A 200 1.636 -11.996 7.341 1.00 0.00 O ATOM 404 CB ILE A 200 3.421 -11.272 10.081 1.00 0.00 C ATOM 405 CG1 ILE A 200 4.835 -11.274 10.668 1.00 0.00 C ATOM 406 CG2 ILE A 200 2.711 -12.582 10.391 1.00 0.00 C ATOM 407 CD1 ILE A 200 4.868 -11.336 12.180 1.00 0.00 C ATOM 0 H ILE A 200 4.465 -9.264 9.069 1.00 0.00 H new ATOM 0 HA ILE A 200 4.039 -11.842 8.087 1.00 0.00 H new ATOM 0 HB ILE A 200 2.857 -10.460 10.540 1.00 0.00 H new ATOM 0 HG12 ILE A 200 5.384 -12.126 10.267 1.00 0.00 H new ATOM 0 HG13 ILE A 200 5.356 -10.375 10.339 1.00 0.00 H new ATOM 0 HG21 ILE A 200 2.681 -12.733 11.470 1.00 0.00 H new ATOM 0 HG22 ILE A 200 1.694 -12.546 10.001 1.00 0.00 H new ATOM 0 HG23 ILE A 200 3.249 -13.407 9.924 1.00 0.00 H new ATOM 0 HD11 ILE A 200 5.903 -11.334 12.522 1.00 0.00 H new ATOM 0 HD12 ILE A 200 4.348 -10.471 12.591 1.00 0.00 H new ATOM 0 HD13 ILE A 200 4.376 -12.248 12.518 1.00 0.00 H new ATOM 418 N VAL A 201 1.302 -9.972 8.264 1.00 0.00 N ATOM 419 CA VAL A 201 -0.081 -9.885 7.804 1.00 0.00 C ATOM 420 C VAL A 201 -0.135 -9.644 6.293 1.00 0.00 C ATOM 421 O VAL A 201 -1.019 -10.155 5.605 1.00 0.00 O ATOM 422 CB VAL A 201 -0.885 -8.788 8.557 1.00 0.00 C ATOM 423 CG1 VAL A 201 -0.517 -7.390 8.085 1.00 0.00 C ATOM 424 CG2 VAL A 201 -2.381 -9.028 8.412 1.00 0.00 C ATOM 0 H VAL A 201 1.626 -9.161 8.791 1.00 0.00 H new ATOM 0 HA VAL A 201 -0.551 -10.843 8.027 1.00 0.00 H new ATOM 0 HB VAL A 201 -0.620 -8.854 9.612 1.00 0.00 H new ATOM 0 HG11 VAL A 201 -1.102 -6.654 8.637 1.00 0.00 H new ATOM 0 HG12 VAL A 201 0.545 -7.215 8.259 1.00 0.00 H new ATOM 0 HG13 VAL A 201 -0.730 -7.298 7.020 1.00 0.00 H new ATOM 0 HG21 VAL A 201 -2.928 -8.250 8.946 1.00 0.00 H new ATOM 0 HG22 VAL A 201 -2.653 -9.004 7.357 1.00 0.00 H new ATOM 0 HG23 VAL A 201 -2.635 -10.002 8.830 1.00 0.00 H new ATOM 434 N LEU A 202 0.833 -8.890 5.783 1.00 0.00 N ATOM 435 CA LEU A 202 0.902 -8.598 4.357 1.00 0.00 C ATOM 436 C LEU A 202 1.183 -9.863 3.566 1.00 0.00 C ATOM 437 O LEU A 202 0.473 -10.180 2.619 1.00 0.00 O ATOM 438 CB LEU A 202 1.991 -7.563 4.070 1.00 0.00 C ATOM 439 CG LEU A 202 2.125 -7.154 2.604 1.00 0.00 C ATOM 440 CD1 LEU A 202 0.782 -6.721 2.043 1.00 0.00 C ATOM 441 CD2 LEU A 202 3.151 -6.042 2.464 1.00 0.00 C ATOM 0 H LEU A 202 1.580 -8.470 6.336 1.00 0.00 H new ATOM 0 HA LEU A 202 -0.062 -8.193 4.051 1.00 0.00 H new ATOM 0 HB2 LEU A 202 1.788 -6.671 4.663 1.00 0.00 H new ATOM 0 HB3 LEU A 202 2.947 -7.961 4.409 1.00 0.00 H new ATOM 0 HG LEU A 202 2.467 -8.016 2.031 1.00 0.00 H new ATOM 0 HD11 LEU A 202 0.900 -6.434 0.998 1.00 0.00 H new ATOM 0 HD12 LEU A 202 0.074 -7.547 2.115 1.00 0.00 H new ATOM 0 HD13 LEU A 202 0.407 -5.871 2.613 1.00 0.00 H new ATOM 0 HD21 LEU A 202 3.239 -5.758 1.415 1.00 0.00 H new ATOM 0 HD22 LEU A 202 2.834 -5.178 3.049 1.00 0.00 H new ATOM 0 HD23 LEU A 202 4.118 -6.391 2.828 1.00 0.00 H new ATOM 452 N LYS A 203 2.200 -10.597 3.991 1.00 0.00 N ATOM 453 CA LYS A 203 2.575 -11.845 3.343 1.00 0.00 C ATOM 454 C LYS A 203 1.413 -12.832 3.384 1.00 0.00 C ATOM 455 O LYS A 203 1.115 -13.496 2.394 1.00 0.00 O ATOM 456 CB LYS A 203 3.814 -12.423 4.026 1.00 0.00 C ATOM 457 CG LYS A 203 4.371 -13.660 3.346 1.00 0.00 C ATOM 458 CD LYS A 203 5.768 -13.995 3.845 1.00 0.00 C ATOM 459 CE LYS A 203 5.772 -14.360 5.321 1.00 0.00 C ATOM 460 NZ LYS A 203 7.138 -14.681 5.808 1.00 0.00 N ATOM 0 H LYS A 203 2.785 -10.347 4.789 1.00 0.00 H new ATOM 0 HA LYS A 203 2.813 -11.654 2.297 1.00 0.00 H new ATOM 0 HB2 LYS A 203 4.589 -11.658 4.058 1.00 0.00 H new ATOM 0 HB3 LYS A 203 3.566 -12.669 5.059 1.00 0.00 H new ATOM 0 HG2 LYS A 203 3.707 -14.505 3.528 1.00 0.00 H new ATOM 0 HG3 LYS A 203 4.398 -13.502 2.268 1.00 0.00 H new ATOM 0 HD2 LYS A 203 6.171 -14.825 3.265 1.00 0.00 H new ATOM 0 HD3 LYS A 203 6.426 -13.142 3.680 1.00 0.00 H new ATOM 0 HE2 LYS A 203 5.365 -13.532 5.901 1.00 0.00 H new ATOM 0 HE3 LYS A 203 5.117 -15.216 5.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 203 7.181 -14.543 6.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 203 7.364 -15.671 5.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 203 7.827 -14.054 5.346 1.00 0.00 H new ATOM 470 N LYS A 204 0.680 -12.802 4.489 1.00 0.00 N ATOM 471 CA LYS A 204 -0.547 -13.579 4.640 1.00 0.00 C ATOM 472 C LYS A 204 -1.554 -13.239 3.541 1.00 0.00 C ATOM 473 O LYS A 204 -2.155 -14.130 2.935 1.00 0.00 O ATOM 474 CB LYS A 204 -1.160 -13.291 6.017 1.00 0.00 C ATOM 475 CG LYS A 204 -2.673 -13.441 6.070 1.00 0.00 C ATOM 476 CD LYS A 204 -3.247 -12.841 7.344 1.00 0.00 C ATOM 477 CE LYS A 204 -4.767 -12.908 7.360 1.00 0.00 C ATOM 478 NZ LYS A 204 -5.261 -14.307 7.278 1.00 0.00 N ATOM 0 H LYS A 204 0.917 -12.240 5.306 1.00 0.00 H new ATOM 0 HA LYS A 204 -0.302 -14.638 4.556 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -0.714 -13.964 6.749 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -0.896 -12.276 6.315 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -3.119 -12.953 5.203 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -2.937 -14.497 6.012 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -2.850 -13.373 8.208 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -2.927 -11.803 7.434 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -5.141 -12.444 8.272 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -5.165 -12.333 6.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -6.287 -14.323 7.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -5.057 -14.692 6.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -4.785 -14.886 7.998 1.00 0.00 H new ATOM 488 N TYR A 205 -1.724 -11.949 3.300 1.00 0.00 N ATOM 489 CA TYR A 205 -2.679 -11.452 2.319 1.00 0.00 C ATOM 490 C TYR A 205 -2.199 -11.752 0.912 1.00 0.00 C ATOM 491 O TYR A 205 -2.965 -12.202 0.059 1.00 0.00 O ATOM 492 CB TYR A 205 -2.846 -9.944 2.487 1.00 0.00 C ATOM 493 CG TYR A 205 -4.279 -9.484 2.448 1.00 0.00 C ATOM 494 CD1 TYR A 205 -5.209 -9.994 3.343 1.00 0.00 C ATOM 495 CD2 TYR A 205 -4.697 -8.529 1.532 1.00 0.00 C ATOM 496 CE1 TYR A 205 -6.521 -9.566 3.328 1.00 0.00 C ATOM 497 CE2 TYR A 205 -6.008 -8.092 1.512 1.00 0.00 C ATOM 498 CZ TYR A 205 -6.916 -8.613 2.410 1.00 0.00 C ATOM 499 OH TYR A 205 -8.220 -8.172 2.397 1.00 0.00 O ATOM 0 H TYR A 205 -1.203 -11.215 3.779 1.00 0.00 H new ATOM 0 HA TYR A 205 -3.636 -11.950 2.479 1.00 0.00 H new ATOM 0 HB2 TYR A 205 -2.403 -9.642 3.436 1.00 0.00 H new ATOM 0 HB3 TYR A 205 -2.289 -9.436 1.699 1.00 0.00 H new ATOM 0 HD1 TYR A 205 -4.901 -10.738 4.063 1.00 0.00 H new ATOM 0 HD2 TYR A 205 -3.989 -8.122 0.826 1.00 0.00 H new ATOM 0 HE1 TYR A 205 -7.234 -9.974 4.029 1.00 0.00 H new ATOM 0 HE2 TYR A 205 -6.320 -7.346 0.796 1.00 0.00 H new ATOM 0 HH TYR A 205 -8.331 -7.501 1.691 1.00 0.00 H new ATOM 508 N VAL A 206 -0.920 -11.500 0.697 1.00 0.00 N ATOM 509 CA VAL A 206 -0.273 -11.735 -0.577 1.00 0.00 C ATOM 510 C VAL A 206 -0.439 -13.196 -1.005 1.00 0.00 C ATOM 511 O VAL A 206 -0.905 -13.477 -2.109 1.00 0.00 O ATOM 512 CB VAL A 206 1.222 -11.338 -0.467 1.00 0.00 C ATOM 513 CG1 VAL A 206 2.043 -11.813 -1.646 1.00 0.00 C ATOM 514 CG2 VAL A 206 1.346 -9.830 -0.325 1.00 0.00 C ATOM 0 H VAL A 206 -0.297 -11.123 1.411 1.00 0.00 H new ATOM 0 HA VAL A 206 -0.742 -11.121 -1.346 1.00 0.00 H new ATOM 0 HB VAL A 206 1.620 -11.833 0.419 1.00 0.00 H new ATOM 0 HG11 VAL A 206 3.081 -11.506 -1.514 1.00 0.00 H new ATOM 0 HG12 VAL A 206 1.991 -12.900 -1.711 1.00 0.00 H new ATOM 0 HG13 VAL A 206 1.649 -11.375 -2.563 1.00 0.00 H new ATOM 0 HG21 VAL A 206 2.398 -9.557 -0.248 1.00 0.00 H new ATOM 0 HG22 VAL A 206 0.908 -9.345 -1.198 1.00 0.00 H new ATOM 0 HG23 VAL A 206 0.820 -9.505 0.573 1.00 0.00 H new ATOM 524 N LYS A 207 -0.206 -14.109 -0.067 1.00 0.00 N ATOM 525 CA LYS A 207 -0.418 -15.536 -0.308 1.00 0.00 C ATOM 526 C LYS A 207 -1.894 -15.860 -0.516 1.00 0.00 C ATOM 527 O LYS A 207 -2.241 -16.735 -1.309 1.00 0.00 O ATOM 528 CB LYS A 207 0.101 -16.357 0.874 1.00 0.00 C ATOM 529 CG LYS A 207 1.590 -16.218 1.118 1.00 0.00 C ATOM 530 CD LYS A 207 2.041 -16.979 2.360 1.00 0.00 C ATOM 531 CE LYS A 207 1.742 -18.468 2.264 1.00 0.00 C ATOM 532 NZ LYS A 207 0.415 -18.815 2.839 1.00 0.00 N ATOM 0 H LYS A 207 0.131 -13.887 0.870 1.00 0.00 H new ATOM 0 HA LYS A 207 0.129 -15.793 -1.215 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -0.434 -16.055 1.775 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -0.132 -17.408 0.702 1.00 0.00 H new ATOM 0 HG2 LYS A 207 2.135 -16.587 0.249 1.00 0.00 H new ATOM 0 HG3 LYS A 207 1.842 -15.163 1.228 1.00 0.00 H new ATOM 0 HD2 LYS A 207 3.112 -16.834 2.504 1.00 0.00 H new ATOM 0 HD3 LYS A 207 1.543 -16.566 3.237 1.00 0.00 H new ATOM 0 HE2 LYS A 207 1.775 -18.776 1.219 1.00 0.00 H new ATOM 0 HE3 LYS A 207 2.519 -19.027 2.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 0.536 -19.527 3.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -0.023 -17.962 3.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -0.197 -19.199 2.092 1.00 0.00 H new ATOM 542 N ASP A 208 -2.738 -15.269 0.319 1.00 0.00 N ATOM 543 CA ASP A 208 -4.160 -15.597 0.338 1.00 0.00 C ATOM 544 C ASP A 208 -4.838 -15.216 -0.971 1.00 0.00 C ATOM 545 O ASP A 208 -5.654 -15.972 -1.503 1.00 0.00 O ATOM 546 CB ASP A 208 -4.849 -14.895 1.515 1.00 0.00 C ATOM 547 CG ASP A 208 -6.304 -15.297 1.687 1.00 0.00 C ATOM 548 OD1 ASP A 208 -7.154 -14.867 0.884 1.00 0.00 O ATOM 549 OD2 ASP A 208 -6.607 -16.054 2.639 1.00 0.00 O ATOM 0 H ASP A 208 -2.462 -14.557 0.995 1.00 0.00 H new ATOM 0 HA ASP A 208 -4.252 -16.676 0.460 1.00 0.00 H new ATOM 0 HB2 ASP A 208 -4.306 -15.122 2.432 1.00 0.00 H new ATOM 0 HB3 ASP A 208 -4.792 -13.816 1.369 1.00 0.00 H new ATOM 553 N THR A 209 -4.485 -14.055 -1.495 1.00 0.00 N ATOM 554 CA THR A 209 -5.071 -13.570 -2.728 1.00 0.00 C ATOM 555 C THR A 209 -4.428 -14.232 -3.942 1.00 0.00 C ATOM 556 O THR A 209 -5.119 -14.658 -4.873 1.00 0.00 O ATOM 557 CB THR A 209 -4.956 -12.037 -2.826 1.00 0.00 C ATOM 558 OG1 THR A 209 -3.621 -11.616 -2.511 1.00 0.00 O ATOM 559 CG2 THR A 209 -5.938 -11.365 -1.878 1.00 0.00 C ATOM 0 H THR A 209 -3.793 -13.430 -1.082 1.00 0.00 H new ATOM 0 HA THR A 209 -6.128 -13.836 -2.718 1.00 0.00 H new ATOM 0 HB THR A 209 -5.193 -11.744 -3.849 1.00 0.00 H new ATOM 0 HG1 THR A 209 -3.457 -11.738 -1.553 1.00 0.00 H new ATOM 0 HG21 THR A 209 -5.842 -10.282 -1.962 1.00 0.00 H new ATOM 0 HG22 THR A 209 -6.955 -11.660 -2.138 1.00 0.00 H new ATOM 0 HG23 THR A 209 -5.722 -11.670 -0.854 1.00 0.00 H new ATOM 567 N TYR A 210 -3.108 -14.354 -3.910 1.00 0.00 N ATOM 568 CA TYR A 210 -2.378 -14.994 -4.990 1.00 0.00 C ATOM 569 C TYR A 210 -1.876 -16.373 -4.561 1.00 0.00 C ATOM 570 O TYR A 210 -0.848 -16.486 -3.894 1.00 0.00 O ATOM 571 CB TYR A 210 -1.182 -14.137 -5.420 1.00 0.00 C ATOM 572 CG TYR A 210 -1.539 -12.792 -6.015 1.00 0.00 C ATOM 573 CD1 TYR A 210 -2.092 -11.784 -5.237 1.00 0.00 C ATOM 574 CD2 TYR A 210 -1.300 -12.526 -7.357 1.00 0.00 C ATOM 575 CE1 TYR A 210 -2.397 -10.551 -5.776 1.00 0.00 C ATOM 576 CE2 TYR A 210 -1.606 -11.296 -7.904 1.00 0.00 C ATOM 577 CZ TYR A 210 -2.152 -10.312 -7.109 1.00 0.00 C ATOM 578 OH TYR A 210 -2.449 -9.082 -7.650 1.00 0.00 O ATOM 0 H TYR A 210 -2.522 -14.017 -3.146 1.00 0.00 H new ATOM 0 HA TYR A 210 -3.063 -15.105 -5.831 1.00 0.00 H new ATOM 0 HB2 TYR A 210 -0.540 -13.975 -4.554 1.00 0.00 H new ATOM 0 HB3 TYR A 210 -0.597 -14.697 -6.150 1.00 0.00 H new ATOM 0 HD1 TYR A 210 -2.287 -11.968 -4.191 1.00 0.00 H new ATOM 0 HD2 TYR A 210 -0.868 -13.293 -7.982 1.00 0.00 H new ATOM 0 HE1 TYR A 210 -2.826 -9.778 -5.155 1.00 0.00 H new ATOM 0 HE2 TYR A 210 -1.418 -11.106 -8.950 1.00 0.00 H new ATOM 0 HH TYR A 210 -1.619 -8.589 -7.818 1.00 0.00 H new ATOM 587 N PRO A 211 -2.548 -17.447 -5.001 1.00 0.00 N ATOM 588 CA PRO A 211 -2.127 -18.820 -4.699 1.00 0.00 C ATOM 589 C PRO A 211 -0.746 -19.121 -5.274 1.00 0.00 C ATOM 590 O PRO A 211 0.025 -19.899 -4.713 1.00 0.00 O ATOM 591 CB PRO A 211 -3.191 -19.693 -5.374 1.00 0.00 C ATOM 592 CG PRO A 211 -4.338 -18.777 -5.637 1.00 0.00 C ATOM 593 CD PRO A 211 -3.737 -17.420 -5.863 1.00 0.00 C ATOM 0 HA PRO A 211 -2.047 -18.997 -3.626 1.00 0.00 H new ATOM 0 HB2 PRO A 211 -2.814 -20.128 -6.300 1.00 0.00 H new ATOM 0 HB3 PRO A 211 -3.488 -20.521 -4.730 1.00 0.00 H new ATOM 0 HG2 PRO A 211 -4.906 -19.103 -6.508 1.00 0.00 H new ATOM 0 HG3 PRO A 211 -5.028 -18.763 -4.793 1.00 0.00 H new ATOM 0 HD2 PRO A 211 -3.475 -17.262 -6.909 1.00 0.00 H new ATOM 0 HD3 PRO A 211 -4.423 -16.621 -5.582 1.00 0.00 H new ATOM 598 N ILE A 212 -0.449 -18.489 -6.405 1.00 0.00 N ATOM 599 CA ILE A 212 0.824 -18.672 -7.084 1.00 0.00 C ATOM 600 C ILE A 212 1.996 -18.197 -6.228 1.00 0.00 C ATOM 601 O ILE A 212 3.083 -18.772 -6.278 1.00 0.00 O ATOM 602 CB ILE A 212 0.857 -17.934 -8.442 1.00 0.00 C ATOM 603 CG1 ILE A 212 0.541 -16.446 -8.256 1.00 0.00 C ATOM 604 CG2 ILE A 212 -0.122 -18.573 -9.417 1.00 0.00 C ATOM 605 CD1 ILE A 212 0.700 -15.623 -9.517 1.00 0.00 C ATOM 0 H ILE A 212 -1.082 -17.840 -6.873 1.00 0.00 H new ATOM 0 HA ILE A 212 0.925 -19.743 -7.259 1.00 0.00 H new ATOM 0 HB ILE A 212 1.861 -18.019 -8.857 1.00 0.00 H new ATOM 0 HG12 ILE A 212 -0.482 -16.344 -7.894 1.00 0.00 H new ATOM 0 HG13 ILE A 212 1.194 -16.040 -7.484 1.00 0.00 H new ATOM 0 HG21 ILE A 212 -0.087 -18.042 -10.368 1.00 0.00 H new ATOM 0 HG22 ILE A 212 0.150 -19.617 -9.574 1.00 0.00 H new ATOM 0 HG23 ILE A 212 -1.131 -18.518 -9.008 1.00 0.00 H new ATOM 0 HD11 ILE A 212 0.459 -14.581 -9.305 1.00 0.00 H new ATOM 0 HD12 ILE A 212 1.729 -15.692 -9.869 1.00 0.00 H new ATOM 0 HD13 ILE A 212 0.027 -16.002 -10.286 1.00 0.00 H new ATOM 616 N VAL A 213 1.794 -17.113 -5.490 1.00 0.00 N ATOM 617 CA VAL A 213 2.862 -16.538 -4.696 1.00 0.00 C ATOM 618 C VAL A 213 3.003 -17.279 -3.366 1.00 0.00 C ATOM 619 O VAL A 213 4.113 -17.550 -2.911 1.00 0.00 O ATOM 620 CB VAL A 213 2.636 -15.023 -4.473 1.00 0.00 C ATOM 621 CG1 VAL A 213 1.601 -14.759 -3.394 1.00 0.00 C ATOM 622 CG2 VAL A 213 3.943 -14.320 -4.161 1.00 0.00 C ATOM 0 H VAL A 213 0.904 -16.619 -5.427 1.00 0.00 H new ATOM 0 HA VAL A 213 3.796 -16.653 -5.247 1.00 0.00 H new ATOM 0 HB VAL A 213 2.243 -14.612 -5.403 1.00 0.00 H new ATOM 0 HG11 VAL A 213 1.472 -13.684 -3.269 1.00 0.00 H new ATOM 0 HG12 VAL A 213 0.651 -15.207 -3.684 1.00 0.00 H new ATOM 0 HG13 VAL A 213 1.936 -15.196 -2.454 1.00 0.00 H new ATOM 0 HG21 VAL A 213 3.757 -13.257 -4.009 1.00 0.00 H new ATOM 0 HG22 VAL A 213 4.378 -14.746 -3.257 1.00 0.00 H new ATOM 0 HG23 VAL A 213 4.635 -14.452 -4.993 1.00 0.00 H new ATOM 632 N GLY A 214 1.873 -17.701 -2.805 1.00 0.00 N ATOM 633 CA GLY A 214 1.892 -18.471 -1.576 1.00 0.00 C ATOM 634 C GLY A 214 2.166 -19.941 -1.817 1.00 0.00 C ATOM 635 O GLY A 214 1.555 -20.807 -1.187 1.00 0.00 O ATOM 0 H GLY A 214 0.942 -17.522 -3.182 1.00 0.00 H new ATOM 0 HA2 GLY A 214 2.654 -18.067 -0.910 1.00 0.00 H new ATOM 0 HA3 GLY A 214 0.934 -18.362 -1.068 1.00 0.00 H new ATOM 639 N SER A 215 3.093 -20.219 -2.720 1.00 0.00 N ATOM 640 CA SER A 215 3.450 -21.580 -3.069 1.00 0.00 C ATOM 641 C SER A 215 4.823 -21.591 -3.728 1.00 0.00 C ATOM 642 O SER A 215 4.996 -22.094 -4.838 1.00 0.00 O ATOM 643 CB SER A 215 2.389 -22.183 -3.999 1.00 0.00 C ATOM 644 OG SER A 215 2.635 -23.557 -4.257 1.00 0.00 O ATOM 0 H SER A 215 3.617 -19.507 -3.229 1.00 0.00 H new ATOM 0 HA SER A 215 3.491 -22.189 -2.166 1.00 0.00 H new ATOM 0 HB2 SER A 215 1.403 -22.068 -3.548 1.00 0.00 H new ATOM 0 HB3 SER A 215 2.375 -21.633 -4.940 1.00 0.00 H new ATOM 0 HG SER A 215 3.514 -23.659 -4.678 1.00 0.00 H new ATOM 649 N ALA A 216 5.784 -20.973 -3.058 1.00 0.00 N ATOM 650 CA ALA A 216 7.137 -20.861 -3.581 1.00 0.00 C ATOM 651 C ALA A 216 8.152 -20.889 -2.449 1.00 0.00 C ATOM 652 O ALA A 216 7.873 -20.420 -1.341 1.00 0.00 O ATOM 653 CB ALA A 216 7.288 -19.582 -4.390 1.00 0.00 C ATOM 0 H ALA A 216 5.650 -20.539 -2.145 1.00 0.00 H new ATOM 0 HA ALA A 216 7.324 -21.713 -4.235 1.00 0.00 H new ATOM 0 HB1 ALA A 216 8.306 -19.513 -4.774 1.00 0.00 H new ATOM 0 HB2 ALA A 216 6.585 -19.593 -5.223 1.00 0.00 H new ATOM 0 HB3 ALA A 216 7.082 -18.722 -3.753 1.00 0.00 H new ATOM 659 N SER A 217 9.309 -21.474 -2.714 1.00 0.00 N ATOM 660 CA SER A 217 10.364 -21.560 -1.720 1.00 0.00 C ATOM 661 C SER A 217 11.047 -20.208 -1.545 1.00 0.00 C ATOM 662 O SER A 217 11.057 -19.644 -0.449 1.00 0.00 O ATOM 663 CB SER A 217 11.382 -22.620 -2.131 1.00 0.00 C ATOM 664 OG SER A 217 10.752 -23.875 -2.316 1.00 0.00 O ATOM 0 H SER A 217 9.541 -21.897 -3.613 1.00 0.00 H new ATOM 0 HA SER A 217 9.922 -21.846 -0.765 1.00 0.00 H new ATOM 0 HB2 SER A 217 11.878 -22.317 -3.053 1.00 0.00 H new ATOM 0 HB3 SER A 217 12.155 -22.705 -1.367 1.00 0.00 H new ATOM 0 HG SER A 217 11.421 -24.541 -2.581 1.00 0.00 H new ATOM 669 N ASN A 218 11.498 -19.634 -2.655 1.00 0.00 N ATOM 670 CA ASN A 218 12.082 -18.298 -2.652 1.00 0.00 C ATOM 671 C ASN A 218 10.969 -17.258 -2.756 1.00 0.00 C ATOM 672 O ASN A 218 10.879 -16.504 -3.723 1.00 0.00 O ATOM 673 CB ASN A 218 13.086 -18.152 -3.803 1.00 0.00 C ATOM 674 CG ASN A 218 13.965 -16.917 -3.681 1.00 0.00 C ATOM 675 OD1 ASN A 218 13.490 -15.787 -3.735 1.00 0.00 O ATOM 676 ND2 ASN A 218 15.263 -17.127 -3.533 1.00 0.00 N ATOM 0 H ASN A 218 11.470 -20.076 -3.574 1.00 0.00 H new ATOM 0 HA ASN A 218 12.622 -18.139 -1.719 1.00 0.00 H new ATOM 0 HB2 ASN A 218 13.719 -19.038 -3.838 1.00 0.00 H new ATOM 0 HB3 ASN A 218 12.543 -18.111 -4.747 1.00 0.00 H new ATOM 0 HD21 ASN A 218 15.903 -16.336 -3.460 1.00 0.00 H new ATOM 0 HD22 ASN A 218 15.624 -18.080 -3.492 1.00 0.00 H new ATOM 682 N PHE A 219 10.032 -17.348 -1.835 1.00 0.00 N ATOM 683 CA PHE A 219 8.864 -16.490 -1.837 1.00 0.00 C ATOM 684 C PHE A 219 9.120 -15.204 -1.060 1.00 0.00 C ATOM 685 O PHE A 219 8.977 -14.109 -1.601 1.00 0.00 O ATOM 686 CB PHE A 219 7.665 -17.245 -1.250 1.00 0.00 C ATOM 687 CG PHE A 219 6.540 -16.361 -0.796 1.00 0.00 C ATOM 688 CD1 PHE A 219 6.066 -15.333 -1.596 1.00 0.00 C ATOM 689 CD2 PHE A 219 5.965 -16.556 0.445 1.00 0.00 C ATOM 690 CE1 PHE A 219 5.043 -14.517 -1.160 1.00 0.00 C ATOM 691 CE2 PHE A 219 4.940 -15.747 0.881 1.00 0.00 C ATOM 692 CZ PHE A 219 4.479 -14.724 0.078 1.00 0.00 C ATOM 0 H PHE A 219 10.058 -18.016 -1.065 1.00 0.00 H new ATOM 0 HA PHE A 219 8.643 -16.213 -2.868 1.00 0.00 H new ATOM 0 HB2 PHE A 219 7.286 -17.940 -1.999 1.00 0.00 H new ATOM 0 HB3 PHE A 219 8.006 -17.843 -0.405 1.00 0.00 H new ATOM 0 HD1 PHE A 219 6.502 -15.169 -2.570 1.00 0.00 H new ATOM 0 HD2 PHE A 219 6.324 -17.352 1.080 1.00 0.00 H new ATOM 0 HE1 PHE A 219 4.685 -13.716 -1.790 1.00 0.00 H new ATOM 0 HE2 PHE A 219 4.497 -15.913 1.852 1.00 0.00 H new ATOM 0 HZ PHE A 219 3.677 -14.087 0.420 1.00 0.00 H new ATOM 701 N ASP A 220 9.435 -15.344 0.223 1.00 0.00 N ATOM 702 CA ASP A 220 9.607 -14.193 1.105 1.00 0.00 C ATOM 703 C ASP A 220 10.721 -13.288 0.597 1.00 0.00 C ATOM 704 O ASP A 220 10.594 -12.067 0.631 1.00 0.00 O ATOM 705 CB ASP A 220 9.894 -14.647 2.541 1.00 0.00 C ATOM 706 CG ASP A 220 9.913 -13.498 3.538 1.00 0.00 C ATOM 707 OD1 ASP A 220 10.839 -12.666 3.486 1.00 0.00 O ATOM 708 OD2 ASP A 220 8.998 -13.428 4.388 1.00 0.00 O ATOM 0 H ASP A 220 9.577 -16.246 0.678 1.00 0.00 H new ATOM 0 HA ASP A 220 8.677 -13.624 1.106 1.00 0.00 H new ATOM 0 HB2 ASP A 220 9.138 -15.371 2.845 1.00 0.00 H new ATOM 0 HB3 ASP A 220 10.856 -15.160 2.568 1.00 0.00 H new ATOM 712 N TYR A 221 11.773 -13.887 0.054 1.00 0.00 N ATOM 713 CA TYR A 221 12.869 -13.118 -0.520 1.00 0.00 C ATOM 714 C TYR A 221 12.374 -12.241 -1.668 1.00 0.00 C ATOM 715 O TYR A 221 12.654 -11.044 -1.702 1.00 0.00 O ATOM 716 CB TYR A 221 13.986 -14.038 -1.013 1.00 0.00 C ATOM 717 CG TYR A 221 15.131 -13.294 -1.668 1.00 0.00 C ATOM 718 CD1 TYR A 221 15.853 -12.330 -0.972 1.00 0.00 C ATOM 719 CD2 TYR A 221 15.479 -13.546 -2.989 1.00 0.00 C ATOM 720 CE1 TYR A 221 16.886 -11.639 -1.577 1.00 0.00 C ATOM 721 CE2 TYR A 221 16.511 -12.861 -3.598 1.00 0.00 C ATOM 722 CZ TYR A 221 17.213 -11.912 -2.888 1.00 0.00 C ATOM 723 OH TYR A 221 18.238 -11.224 -3.497 1.00 0.00 O ATOM 0 H TYR A 221 11.890 -14.899 -0.001 1.00 0.00 H new ATOM 0 HA TYR A 221 13.268 -12.477 0.266 1.00 0.00 H new ATOM 0 HB2 TYR A 221 14.371 -14.614 -0.171 1.00 0.00 H new ATOM 0 HB3 TYR A 221 13.571 -14.752 -1.725 1.00 0.00 H new ATOM 0 HD1 TYR A 221 15.603 -12.118 0.057 1.00 0.00 H new ATOM 0 HD2 TYR A 221 14.933 -14.291 -3.549 1.00 0.00 H new ATOM 0 HE1 TYR A 221 17.434 -10.889 -1.026 1.00 0.00 H new ATOM 0 HE2 TYR A 221 16.767 -13.068 -4.627 1.00 0.00 H new ATOM 0 HH TYR A 221 18.340 -11.538 -4.420 1.00 0.00 H new ATOM 732 N LEU A 222 11.612 -12.826 -2.589 1.00 0.00 N ATOM 733 CA LEU A 222 11.064 -12.071 -3.713 1.00 0.00 C ATOM 734 C LEU A 222 10.017 -11.076 -3.227 1.00 0.00 C ATOM 735 O LEU A 222 10.003 -9.923 -3.652 1.00 0.00 O ATOM 736 CB LEU A 222 10.459 -13.002 -4.765 1.00 0.00 C ATOM 737 CG LEU A 222 11.431 -14.000 -5.398 1.00 0.00 C ATOM 738 CD1 LEU A 222 10.818 -14.622 -6.643 1.00 0.00 C ATOM 739 CD2 LEU A 222 12.754 -13.327 -5.729 1.00 0.00 C ATOM 0 H LEU A 222 11.361 -13.815 -2.580 1.00 0.00 H new ATOM 0 HA LEU A 222 11.884 -11.523 -4.177 1.00 0.00 H new ATOM 0 HB2 LEU A 222 9.642 -13.558 -4.306 1.00 0.00 H new ATOM 0 HB3 LEU A 222 10.024 -12.393 -5.557 1.00 0.00 H new ATOM 0 HG LEU A 222 11.626 -14.794 -4.677 1.00 0.00 H new ATOM 0 HD11 LEU A 222 11.522 -15.329 -7.081 1.00 0.00 H new ATOM 0 HD12 LEU A 222 9.899 -15.144 -6.374 1.00 0.00 H new ATOM 0 HD13 LEU A 222 10.592 -13.839 -7.367 1.00 0.00 H new ATOM 0 HD21 LEU A 222 13.430 -14.055 -6.178 1.00 0.00 H new ATOM 0 HD22 LEU A 222 12.582 -12.511 -6.431 1.00 0.00 H new ATOM 0 HD23 LEU A 222 13.200 -12.933 -4.816 1.00 0.00 H new ATOM 750 N PHE A 223 9.211 -11.514 -2.267 1.00 0.00 N ATOM 751 CA PHE A 223 8.229 -10.654 -1.614 1.00 0.00 C ATOM 752 C PHE A 223 8.922 -9.418 -1.050 1.00 0.00 C ATOM 753 O PHE A 223 8.543 -8.287 -1.342 1.00 0.00 O ATOM 754 CB PHE A 223 7.548 -11.440 -0.484 1.00 0.00 C ATOM 755 CG PHE A 223 6.623 -10.638 0.388 1.00 0.00 C ATOM 756 CD1 PHE A 223 5.449 -10.106 -0.113 1.00 0.00 C ATOM 757 CD2 PHE A 223 6.932 -10.429 1.723 1.00 0.00 C ATOM 758 CE1 PHE A 223 4.600 -9.381 0.700 1.00 0.00 C ATOM 759 CE2 PHE A 223 6.088 -9.706 2.539 1.00 0.00 C ATOM 760 CZ PHE A 223 4.923 -9.178 2.027 1.00 0.00 C ATOM 0 H PHE A 223 9.219 -12.473 -1.919 1.00 0.00 H new ATOM 0 HA PHE A 223 7.478 -10.335 -2.337 1.00 0.00 H new ATOM 0 HB2 PHE A 223 6.984 -12.262 -0.924 1.00 0.00 H new ATOM 0 HB3 PHE A 223 8.320 -11.883 0.145 1.00 0.00 H new ATOM 0 HD1 PHE A 223 5.193 -10.259 -1.151 1.00 0.00 H new ATOM 0 HD2 PHE A 223 7.845 -10.838 2.129 1.00 0.00 H new ATOM 0 HE1 PHE A 223 3.684 -8.973 0.298 1.00 0.00 H new ATOM 0 HE2 PHE A 223 6.340 -9.554 3.578 1.00 0.00 H new ATOM 0 HZ PHE A 223 4.263 -8.606 2.663 1.00 0.00 H new ATOM 769 N ASN A 224 9.998 -9.663 -0.318 1.00 0.00 N ATOM 770 CA ASN A 224 10.819 -8.610 0.261 1.00 0.00 C ATOM 771 C ASN A 224 11.457 -7.739 -0.812 1.00 0.00 C ATOM 772 O ASN A 224 11.541 -6.523 -0.671 1.00 0.00 O ATOM 773 CB ASN A 224 11.915 -9.238 1.121 1.00 0.00 C ATOM 774 CG ASN A 224 12.948 -8.229 1.574 1.00 0.00 C ATOM 775 OD1 ASN A 224 12.613 -7.213 2.176 1.00 0.00 O ATOM 776 ND2 ASN A 224 14.208 -8.513 1.295 1.00 0.00 N ATOM 0 H ASN A 224 10.329 -10.605 -0.107 1.00 0.00 H new ATOM 0 HA ASN A 224 10.174 -7.976 0.870 1.00 0.00 H new ATOM 0 HB2 ASN A 224 11.462 -9.707 1.995 1.00 0.00 H new ATOM 0 HB3 ASN A 224 12.408 -10.028 0.555 1.00 0.00 H new ATOM 0 HD21 ASN A 224 14.950 -7.875 1.583 1.00 0.00 H new ATOM 0 HD22 ASN A 224 14.438 -9.370 0.792 1.00 0.00 H new ATOM 782 N SER A 225 11.945 -8.380 -1.855 1.00 0.00 N ATOM 783 CA SER A 225 12.658 -7.688 -2.917 1.00 0.00 C ATOM 784 C SER A 225 11.720 -6.788 -3.714 1.00 0.00 C ATOM 785 O SER A 225 12.104 -5.698 -4.136 1.00 0.00 O ATOM 786 CB SER A 225 13.355 -8.695 -3.823 1.00 0.00 C ATOM 787 OG SER A 225 14.297 -9.463 -3.090 1.00 0.00 O ATOM 0 H SER A 225 11.861 -9.387 -1.993 1.00 0.00 H new ATOM 0 HA SER A 225 13.416 -7.049 -2.464 1.00 0.00 H new ATOM 0 HB2 SER A 225 12.616 -9.355 -4.278 1.00 0.00 H new ATOM 0 HB3 SER A 225 13.859 -8.172 -4.636 1.00 0.00 H new ATOM 0 HG SER A 225 13.823 -10.103 -2.519 1.00 0.00 H new ATOM 792 N ALA A 226 10.458 -7.190 -3.805 1.00 0.00 N ATOM 793 CA ALA A 226 9.440 -6.355 -4.417 1.00 0.00 C ATOM 794 C ALA A 226 9.287 -5.067 -3.622 1.00 0.00 C ATOM 795 O ALA A 226 9.271 -3.972 -4.185 1.00 0.00 O ATOM 796 CB ALA A 226 8.114 -7.098 -4.488 1.00 0.00 C ATOM 0 H ALA A 226 10.119 -8.089 -3.462 1.00 0.00 H new ATOM 0 HA ALA A 226 9.747 -6.109 -5.434 1.00 0.00 H new ATOM 0 HB1 ALA A 226 7.362 -6.458 -4.949 1.00 0.00 H new ATOM 0 HB2 ALA A 226 8.235 -8.003 -5.084 1.00 0.00 H new ATOM 0 HB3 ALA A 226 7.793 -7.367 -3.482 1.00 0.00 H new ATOM 802 N ILE A 227 9.281 -5.206 -2.300 1.00 0.00 N ATOM 803 CA ILE A 227 9.225 -4.062 -1.399 1.00 0.00 C ATOM 804 C ILE A 227 10.507 -3.252 -1.501 1.00 0.00 C ATOM 805 O ILE A 227 10.486 -2.024 -1.475 1.00 0.00 O ATOM 806 CB ILE A 227 9.033 -4.502 0.063 1.00 0.00 C ATOM 807 CG1 ILE A 227 8.123 -5.730 0.122 1.00 0.00 C ATOM 808 CG2 ILE A 227 8.465 -3.356 0.893 1.00 0.00 C ATOM 809 CD1 ILE A 227 7.640 -6.077 1.507 1.00 0.00 C ATOM 0 H ILE A 227 9.315 -6.109 -1.826 1.00 0.00 H new ATOM 0 HA ILE A 227 8.371 -3.455 -1.698 1.00 0.00 H new ATOM 0 HB ILE A 227 10.001 -4.772 0.485 1.00 0.00 H new ATOM 0 HG12 ILE A 227 7.259 -5.558 -0.519 1.00 0.00 H new ATOM 0 HG13 ILE A 227 8.660 -6.586 -0.288 1.00 0.00 H new ATOM 0 HG21 ILE A 227 8.335 -3.683 1.925 1.00 0.00 H new ATOM 0 HG22 ILE A 227 9.152 -2.511 0.864 1.00 0.00 H new ATOM 0 HG23 ILE A 227 7.501 -3.054 0.484 1.00 0.00 H new ATOM 0 HD11 ILE A 227 7.001 -6.959 1.459 1.00 0.00 H new ATOM 0 HD12 ILE A 227 8.496 -6.283 2.150 1.00 0.00 H new ATOM 0 HD13 ILE A 227 7.073 -5.240 1.915 1.00 0.00 H new ATOM 820 N LYS A 228 11.619 -3.964 -1.632 1.00 0.00 N ATOM 821 CA LYS A 228 12.931 -3.349 -1.770 1.00 0.00 C ATOM 822 C LYS A 228 12.954 -2.411 -2.972 1.00 0.00 C ATOM 823 O LYS A 228 13.469 -1.302 -2.898 1.00 0.00 O ATOM 824 CB LYS A 228 14.001 -4.430 -1.928 1.00 0.00 C ATOM 825 CG LYS A 228 15.406 -3.938 -1.654 1.00 0.00 C ATOM 826 CD LYS A 228 15.564 -3.523 -0.203 1.00 0.00 C ATOM 827 CE LYS A 228 17.002 -3.157 0.118 1.00 0.00 C ATOM 828 NZ LYS A 228 17.493 -2.018 -0.700 1.00 0.00 N ATOM 0 H LYS A 228 11.636 -4.984 -1.645 1.00 0.00 H new ATOM 0 HA LYS A 228 13.141 -2.769 -0.871 1.00 0.00 H new ATOM 0 HB2 LYS A 228 13.775 -5.254 -1.251 1.00 0.00 H new ATOM 0 HB3 LYS A 228 13.956 -4.828 -2.942 1.00 0.00 H new ATOM 0 HG2 LYS A 228 16.123 -4.724 -1.891 1.00 0.00 H new ATOM 0 HG3 LYS A 228 15.632 -3.093 -2.304 1.00 0.00 H new ATOM 0 HD2 LYS A 228 14.916 -2.672 0.006 1.00 0.00 H new ATOM 0 HD3 LYS A 228 15.241 -4.337 0.446 1.00 0.00 H new ATOM 0 HE2 LYS A 228 17.082 -2.903 1.175 1.00 0.00 H new ATOM 0 HE3 LYS A 228 17.641 -4.024 -0.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 228 18.434 -1.729 -0.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 228 17.555 -2.308 -1.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 228 16.834 -1.218 -0.613 1.00 0.00 H new ATOM 838 N LYS A 229 12.315 -2.832 -4.053 1.00 0.00 N ATOM 839 CA LYS A 229 12.170 -1.992 -5.231 1.00 0.00 C ATOM 840 C LYS A 229 11.205 -0.846 -4.946 1.00 0.00 C ATOM 841 O LYS A 229 11.410 0.285 -5.389 1.00 0.00 O ATOM 842 CB LYS A 229 11.657 -2.819 -6.408 1.00 0.00 C ATOM 843 CG LYS A 229 12.636 -3.880 -6.871 1.00 0.00 C ATOM 844 CD LYS A 229 12.041 -4.747 -7.966 1.00 0.00 C ATOM 845 CE LYS A 229 13.107 -5.594 -8.638 1.00 0.00 C ATOM 846 NZ LYS A 229 14.125 -4.753 -9.321 1.00 0.00 N ATOM 0 H LYS A 229 11.887 -3.754 -4.138 1.00 0.00 H new ATOM 0 HA LYS A 229 13.146 -1.579 -5.485 1.00 0.00 H new ATOM 0 HB2 LYS A 229 10.720 -3.299 -6.124 1.00 0.00 H new ATOM 0 HB3 LYS A 229 11.434 -2.152 -7.241 1.00 0.00 H new ATOM 0 HG2 LYS A 229 13.545 -3.403 -7.237 1.00 0.00 H new ATOM 0 HG3 LYS A 229 12.923 -4.506 -6.026 1.00 0.00 H new ATOM 0 HD2 LYS A 229 11.272 -5.394 -7.543 1.00 0.00 H new ATOM 0 HD3 LYS A 229 11.553 -4.115 -8.709 1.00 0.00 H new ATOM 0 HE2 LYS A 229 13.595 -6.224 -7.894 1.00 0.00 H new ATOM 0 HE3 LYS A 229 12.639 -6.261 -9.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 229 14.602 -5.314 -10.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 229 13.660 -3.932 -9.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 229 14.826 -4.424 -8.627 1.00 0.00 H new ATOM 856 N CYS A 230 10.136 -1.159 -4.230 1.00 0.00 N ATOM 857 CA CYS A 230 9.106 -0.185 -3.901 1.00 0.00 C ATOM 858 C CYS A 230 9.649 0.971 -3.064 1.00 0.00 C ATOM 859 O CYS A 230 9.203 2.101 -3.228 1.00 0.00 O ATOM 860 CB CYS A 230 7.953 -0.861 -3.165 1.00 0.00 C ATOM 861 SG CYS A 230 7.065 -2.075 -4.159 1.00 0.00 S ATOM 0 H CYS A 230 9.958 -2.093 -3.861 1.00 0.00 H new ATOM 0 HA CYS A 230 8.746 0.231 -4.842 1.00 0.00 H new ATOM 0 HB2 CYS A 230 8.342 -1.351 -2.272 1.00 0.00 H new ATOM 0 HB3 CYS A 230 7.251 -0.097 -2.829 1.00 0.00 H new ATOM 0 HG CYS A 230 7.785 -3.151 -4.274 1.00 0.00 H new ATOM 866 N VAL A 231 10.552 0.684 -2.127 1.00 0.00 N ATOM 867 CA VAL A 231 11.082 1.731 -1.253 1.00 0.00 C ATOM 868 C VAL A 231 11.893 2.751 -2.054 1.00 0.00 C ATOM 869 O VAL A 231 11.834 3.948 -1.781 1.00 0.00 O ATOM 870 CB VAL A 231 11.932 1.175 -0.082 1.00 0.00 C ATOM 871 CG1 VAL A 231 11.123 0.194 0.752 1.00 0.00 C ATOM 872 CG2 VAL A 231 13.212 0.525 -0.577 1.00 0.00 C ATOM 0 H VAL A 231 10.927 -0.249 -1.955 1.00 0.00 H new ATOM 0 HA VAL A 231 10.216 2.224 -0.811 1.00 0.00 H new ATOM 0 HB VAL A 231 12.213 2.019 0.548 1.00 0.00 H new ATOM 0 HG11 VAL A 231 11.739 -0.184 1.568 1.00 0.00 H new ATOM 0 HG12 VAL A 231 10.248 0.699 1.161 1.00 0.00 H new ATOM 0 HG13 VAL A 231 10.801 -0.638 0.125 1.00 0.00 H new ATOM 0 HG21 VAL A 231 13.781 0.148 0.273 1.00 0.00 H new ATOM 0 HG22 VAL A 231 12.966 -0.301 -1.245 1.00 0.00 H new ATOM 0 HG23 VAL A 231 13.809 1.261 -1.115 1.00 0.00 H new ATOM 882 N GLU A 232 12.581 2.279 -3.093 1.00 0.00 N ATOM 883 CA GLU A 232 13.312 3.167 -3.996 1.00 0.00 C ATOM 884 C GLU A 232 12.323 3.913 -4.872 1.00 0.00 C ATOM 885 O GLU A 232 12.419 5.124 -5.068 1.00 0.00 O ATOM 886 CB GLU A 232 14.265 2.364 -4.884 1.00 0.00 C ATOM 887 CG GLU A 232 14.899 1.191 -4.172 1.00 0.00 C ATOM 888 CD GLU A 232 15.854 0.414 -5.054 1.00 0.00 C ATOM 889 OE1 GLU A 232 15.393 -0.242 -6.012 1.00 0.00 O ATOM 890 OE2 GLU A 232 17.078 0.464 -4.807 1.00 0.00 O ATOM 0 H GLU A 232 12.647 1.289 -3.330 1.00 0.00 H new ATOM 0 HA GLU A 232 13.894 3.871 -3.402 1.00 0.00 H new ATOM 0 HB2 GLU A 232 13.720 2.000 -5.755 1.00 0.00 H new ATOM 0 HB3 GLU A 232 15.050 3.024 -5.253 1.00 0.00 H new ATOM 0 HG2 GLU A 232 15.435 1.552 -3.294 1.00 0.00 H new ATOM 0 HG3 GLU A 232 14.116 0.522 -3.815 1.00 0.00 H new ATOM 895 N ASN A 233 11.361 3.158 -5.379 1.00 0.00 N ATOM 896 CA ASN A 233 10.300 3.692 -6.232 1.00 0.00 C ATOM 897 C ASN A 233 9.427 4.698 -5.484 1.00 0.00 C ATOM 898 O ASN A 233 8.730 5.506 -6.098 1.00 0.00 O ATOM 899 CB ASN A 233 9.437 2.550 -6.772 1.00 0.00 C ATOM 900 CG ASN A 233 9.960 2.003 -8.087 1.00 0.00 C ATOM 901 OD1 ASN A 233 9.900 2.674 -9.117 1.00 0.00 O ATOM 902 ND2 ASN A 233 10.493 0.792 -8.060 1.00 0.00 N ATOM 0 H ASN A 233 11.290 2.154 -5.213 1.00 0.00 H new ATOM 0 HA ASN A 233 10.773 4.215 -7.063 1.00 0.00 H new ATOM 0 HB2 ASN A 233 9.400 1.747 -6.036 1.00 0.00 H new ATOM 0 HB3 ASN A 233 8.415 2.904 -6.909 1.00 0.00 H new ATOM 0 HD21 ASN A 233 10.873 0.383 -8.914 1.00 0.00 H new ATOM 0 HD22 ASN A 233 10.524 0.268 -7.186 1.00 0.00 H new ATOM 908 N GLY A 234 9.428 4.601 -4.163 1.00 0.00 N ATOM 909 CA GLY A 234 8.608 5.469 -3.345 1.00 0.00 C ATOM 910 C GLY A 234 7.157 5.039 -3.333 1.00 0.00 C ATOM 911 O GLY A 234 6.259 5.855 -3.131 1.00 0.00 O ATOM 0 H GLY A 234 9.989 3.929 -3.639 1.00 0.00 H new ATOM 0 HA2 GLY A 234 8.992 5.474 -2.325 1.00 0.00 H new ATOM 0 HA3 GLY A 234 8.679 6.491 -3.718 1.00 0.00 H new ATOM 915 N GLU A 235 6.932 3.742 -3.500 1.00 0.00 N ATOM 916 CA GLU A 235 5.586 3.186 -3.458 1.00 0.00 C ATOM 917 C GLU A 235 5.283 2.642 -2.069 1.00 0.00 C ATOM 918 O GLU A 235 4.327 3.061 -1.419 1.00 0.00 O ATOM 919 CB GLU A 235 5.432 2.078 -4.502 1.00 0.00 C ATOM 920 CG GLU A 235 5.598 2.559 -5.939 1.00 0.00 C ATOM 921 CD GLU A 235 4.518 3.536 -6.372 1.00 0.00 C ATOM 922 OE1 GLU A 235 3.629 3.868 -5.555 1.00 0.00 O ATOM 923 OE2 GLU A 235 4.544 3.974 -7.541 1.00 0.00 O ATOM 0 H GLU A 235 7.666 3.054 -3.666 1.00 0.00 H new ATOM 0 HA GLU A 235 4.877 3.981 -3.687 1.00 0.00 H new ATOM 0 HB2 GLU A 235 6.168 1.299 -4.302 1.00 0.00 H new ATOM 0 HB3 GLU A 235 4.448 1.623 -4.393 1.00 0.00 H new ATOM 0 HG2 GLU A 235 6.573 3.035 -6.046 1.00 0.00 H new ATOM 0 HG3 GLU A 235 5.589 1.698 -6.607 1.00 0.00 H new ATOM 928 N LEU A 236 6.167 1.786 -1.578 1.00 0.00 N ATOM 929 CA LEU A 236 6.057 1.272 -0.223 1.00 0.00 C ATOM 930 C LEU A 236 7.177 1.845 0.621 1.00 0.00 C ATOM 931 O LEU A 236 8.332 1.840 0.202 1.00 0.00 O ATOM 932 CB LEU A 236 6.145 -0.259 -0.194 1.00 0.00 C ATOM 933 CG LEU A 236 5.211 -1.008 -1.145 1.00 0.00 C ATOM 934 CD1 LEU A 236 5.345 -2.508 -0.943 1.00 0.00 C ATOM 935 CD2 LEU A 236 3.769 -0.565 -0.954 1.00 0.00 C ATOM 0 H LEU A 236 6.969 1.433 -2.100 1.00 0.00 H new ATOM 0 HA LEU A 236 5.086 1.568 0.174 1.00 0.00 H new ATOM 0 HB2 LEU A 236 7.171 -0.547 -0.424 1.00 0.00 H new ATOM 0 HB3 LEU A 236 5.940 -0.595 0.823 1.00 0.00 H new ATOM 0 HG LEU A 236 5.501 -0.769 -2.168 1.00 0.00 H new ATOM 0 HD11 LEU A 236 4.674 -3.029 -1.627 1.00 0.00 H new ATOM 0 HD12 LEU A 236 6.373 -2.812 -1.142 1.00 0.00 H new ATOM 0 HD13 LEU A 236 5.084 -2.762 0.085 1.00 0.00 H new ATOM 0 HD21 LEU A 236 3.126 -1.113 -1.642 1.00 0.00 H new ATOM 0 HD22 LEU A 236 3.459 -0.767 0.071 1.00 0.00 H new ATOM 0 HD23 LEU A 236 3.687 0.503 -1.154 1.00 0.00 H new ATOM 946 N VAL A 237 6.854 2.299 1.814 1.00 0.00 N ATOM 947 CA VAL A 237 7.874 2.791 2.721 1.00 0.00 C ATOM 948 C VAL A 237 8.035 1.856 3.905 1.00 0.00 C ATOM 949 O VAL A 237 7.054 1.361 4.465 1.00 0.00 O ATOM 950 CB VAL A 237 7.589 4.224 3.217 1.00 0.00 C ATOM 951 CG1 VAL A 237 7.912 5.231 2.129 1.00 0.00 C ATOM 952 CG2 VAL A 237 6.147 4.376 3.674 1.00 0.00 C ATOM 0 H VAL A 237 5.902 2.338 2.178 1.00 0.00 H new ATOM 0 HA VAL A 237 8.804 2.823 2.154 1.00 0.00 H new ATOM 0 HB VAL A 237 8.231 4.416 4.077 1.00 0.00 H new ATOM 0 HG11 VAL A 237 7.706 6.238 2.492 1.00 0.00 H new ATOM 0 HG12 VAL A 237 8.965 5.150 1.860 1.00 0.00 H new ATOM 0 HG13 VAL A 237 7.297 5.029 1.252 1.00 0.00 H new ATOM 0 HG21 VAL A 237 5.980 5.397 4.017 1.00 0.00 H new ATOM 0 HG22 VAL A 237 5.477 4.158 2.842 1.00 0.00 H new ATOM 0 HG23 VAL A 237 5.949 3.682 4.491 1.00 0.00 H new ATOM 962 N GLN A 238 9.284 1.583 4.238 1.00 0.00 N ATOM 963 CA GLN A 238 9.623 0.689 5.334 1.00 0.00 C ATOM 964 C GLN A 238 10.561 1.387 6.310 1.00 0.00 C ATOM 965 O GLN A 238 11.783 1.305 6.183 1.00 0.00 O ATOM 966 CB GLN A 238 10.255 -0.596 4.792 1.00 0.00 C ATOM 967 CG GLN A 238 9.255 -1.727 4.618 1.00 0.00 C ATOM 968 CD GLN A 238 8.960 -2.441 5.924 1.00 0.00 C ATOM 969 OE1 GLN A 238 8.698 -1.813 6.952 1.00 0.00 O ATOM 970 NE2 GLN A 238 9.006 -3.761 5.893 1.00 0.00 N ATOM 0 H GLN A 238 10.093 1.975 3.757 1.00 0.00 H new ATOM 0 HA GLN A 238 8.712 0.421 5.869 1.00 0.00 H new ATOM 0 HB2 GLN A 238 10.726 -0.385 3.832 1.00 0.00 H new ATOM 0 HB3 GLN A 238 11.045 -0.919 5.470 1.00 0.00 H new ATOM 0 HG2 GLN A 238 8.327 -1.329 4.207 1.00 0.00 H new ATOM 0 HG3 GLN A 238 9.643 -2.444 3.894 1.00 0.00 H new ATOM 0 HE21 GLN A 238 9.227 -4.243 5.022 1.00 0.00 H new ATOM 0 HE22 GLN A 238 8.821 -4.298 6.740 1.00 0.00 H new ATOM 977 N PRO A 239 9.990 2.184 7.226 1.00 0.00 N ATOM 978 CA PRO A 239 10.764 2.995 8.168 1.00 0.00 C ATOM 979 C PRO A 239 11.604 2.157 9.130 1.00 0.00 C ATOM 980 O PRO A 239 12.728 2.528 9.474 1.00 0.00 O ATOM 981 CB PRO A 239 9.697 3.779 8.945 1.00 0.00 C ATOM 982 CG PRO A 239 8.415 3.059 8.702 1.00 0.00 C ATOM 983 CD PRO A 239 8.543 2.425 7.350 1.00 0.00 C ATOM 0 HA PRO A 239 11.482 3.625 7.643 1.00 0.00 H new ATOM 0 HB2 PRO A 239 9.932 3.813 10.009 1.00 0.00 H new ATOM 0 HB3 PRO A 239 9.639 4.811 8.599 1.00 0.00 H new ATOM 0 HG2 PRO A 239 8.239 2.306 9.470 1.00 0.00 H new ATOM 0 HG3 PRO A 239 7.570 3.747 8.731 1.00 0.00 H new ATOM 0 HD2 PRO A 239 7.974 1.498 7.285 1.00 0.00 H new ATOM 0 HD3 PRO A 239 8.175 3.081 6.561 1.00 0.00 H new ATOM 988 N LYS A 240 11.020 1.075 9.628 1.00 0.00 N ATOM 989 CA LYS A 240 11.678 0.257 10.639 1.00 0.00 C ATOM 990 C LYS A 240 12.815 -0.571 10.046 1.00 0.00 C ATOM 991 O LYS A 240 13.977 -0.399 10.422 1.00 0.00 O ATOM 992 CB LYS A 240 10.661 -0.654 11.324 1.00 0.00 C ATOM 993 CG LYS A 240 9.563 0.103 12.054 1.00 0.00 C ATOM 994 CD LYS A 240 8.631 -0.839 12.796 1.00 0.00 C ATOM 995 CE LYS A 240 7.557 -0.078 13.555 1.00 0.00 C ATOM 996 NZ LYS A 240 6.678 -0.987 14.336 1.00 0.00 N ATOM 0 H LYS A 240 10.096 0.744 9.350 1.00 0.00 H new ATOM 0 HA LYS A 240 12.112 0.930 11.378 1.00 0.00 H new ATOM 0 HB2 LYS A 240 10.207 -1.305 10.577 1.00 0.00 H new ATOM 0 HB3 LYS A 240 11.181 -1.297 12.034 1.00 0.00 H new ATOM 0 HG2 LYS A 240 10.010 0.803 12.759 1.00 0.00 H new ATOM 0 HG3 LYS A 240 8.990 0.693 11.339 1.00 0.00 H new ATOM 0 HD2 LYS A 240 8.162 -1.522 12.087 1.00 0.00 H new ATOM 0 HD3 LYS A 240 9.207 -1.449 13.492 1.00 0.00 H new ATOM 0 HE2 LYS A 240 8.027 0.638 14.228 1.00 0.00 H new ATOM 0 HE3 LYS A 240 6.953 0.495 12.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 240 5.959 -0.428 14.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 240 6.209 -1.655 13.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 240 7.250 -1.515 15.025 1.00 0.00 H new ATOM 1006 N GLY A 241 12.489 -1.467 9.126 1.00 0.00 N ATOM 1007 CA GLY A 241 13.507 -2.308 8.532 1.00 0.00 C ATOM 1008 C GLY A 241 12.925 -3.432 7.701 1.00 0.00 C ATOM 1009 O GLY A 241 12.058 -3.192 6.861 1.00 0.00 O ATOM 0 H GLY A 241 11.542 -1.626 8.782 1.00 0.00 H new ATOM 0 HA2 GLY A 241 14.157 -1.697 7.905 1.00 0.00 H new ATOM 0 HA3 GLY A 241 14.130 -2.730 9.321 1.00 0.00 H new ATOM 1013 N PRO A 242 13.438 -4.664 7.869 1.00 0.00 N ATOM 1014 CA PRO A 242 13.010 -5.822 7.073 1.00 0.00 C ATOM 1015 C PRO A 242 11.546 -6.196 7.294 1.00 0.00 C ATOM 1016 O PRO A 242 10.746 -6.168 6.359 1.00 0.00 O ATOM 1017 CB PRO A 242 13.925 -6.958 7.544 1.00 0.00 C ATOM 1018 CG PRO A 242 14.484 -6.504 8.849 1.00 0.00 C ATOM 1019 CD PRO A 242 14.533 -5.006 8.790 1.00 0.00 C ATOM 0 HA PRO A 242 13.086 -5.610 6.007 1.00 0.00 H new ATOM 0 HB2 PRO A 242 13.369 -7.888 7.658 1.00 0.00 H new ATOM 0 HB3 PRO A 242 14.719 -7.148 6.822 1.00 0.00 H new ATOM 0 HG2 PRO A 242 13.860 -6.840 9.677 1.00 0.00 H new ATOM 0 HG3 PRO A 242 15.479 -6.919 9.011 1.00 0.00 H new ATOM 0 HD2 PRO A 242 14.385 -4.560 9.774 1.00 0.00 H new ATOM 0 HD3 PRO A 242 15.495 -4.650 8.421 1.00 0.00 H new ATOM 1024 N SER A 243 11.183 -6.519 8.528 1.00 0.00 N ATOM 1025 CA SER A 243 9.802 -6.849 8.837 1.00 0.00 C ATOM 1026 C SER A 243 8.991 -5.570 9.002 1.00 0.00 C ATOM 1027 O SER A 243 8.192 -5.231 8.129 1.00 0.00 O ATOM 1028 CB SER A 243 9.728 -7.720 10.093 1.00 0.00 C ATOM 1029 OG SER A 243 10.505 -8.899 9.934 1.00 0.00 O ATOM 0 H SER A 243 11.820 -6.559 9.323 1.00 0.00 H new ATOM 0 HA SER A 243 9.377 -7.421 8.013 1.00 0.00 H new ATOM 0 HB2 SER A 243 10.086 -7.156 10.954 1.00 0.00 H new ATOM 0 HB3 SER A 243 8.691 -7.987 10.296 1.00 0.00 H new ATOM 0 HG SER A 243 10.446 -9.442 10.748 1.00 0.00 H new ATOM 1034 N GLY A 244 9.361 -4.779 10.013 1.00 0.00 N ATOM 1035 CA GLY A 244 8.805 -3.444 10.191 1.00 0.00 C ATOM 1036 C GLY A 244 7.309 -3.361 9.971 1.00 0.00 C ATOM 1037 O GLY A 244 6.535 -4.109 10.570 1.00 0.00 O ATOM 0 H GLY A 244 10.046 -5.046 10.720 1.00 0.00 H new ATOM 0 HA2 GLY A 244 9.032 -3.099 11.200 1.00 0.00 H new ATOM 0 HA3 GLY A 244 9.301 -2.761 9.501 1.00 0.00 H new ATOM 1041 N ILE A 245 6.926 -2.485 9.059 1.00 0.00 N ATOM 1042 CA ILE A 245 5.539 -2.310 8.674 1.00 0.00 C ATOM 1043 C ILE A 245 5.477 -1.613 7.319 1.00 0.00 C ATOM 1044 O ILE A 245 5.952 -0.488 7.158 1.00 0.00 O ATOM 1045 CB ILE A 245 4.739 -1.508 9.734 1.00 0.00 C ATOM 1046 CG1 ILE A 245 3.314 -1.240 9.242 1.00 0.00 C ATOM 1047 CG2 ILE A 245 5.445 -0.200 10.084 1.00 0.00 C ATOM 1048 CD1 ILE A 245 2.388 -0.707 10.314 1.00 0.00 C ATOM 0 H ILE A 245 7.573 -1.872 8.563 1.00 0.00 H new ATOM 0 HA ILE A 245 5.077 -3.295 8.604 1.00 0.00 H new ATOM 0 HB ILE A 245 4.684 -2.110 10.641 1.00 0.00 H new ATOM 0 HG12 ILE A 245 3.352 -0.526 8.420 1.00 0.00 H new ATOM 0 HG13 ILE A 245 2.898 -2.165 8.842 1.00 0.00 H new ATOM 0 HG21 ILE A 245 4.861 0.341 10.829 1.00 0.00 H new ATOM 0 HG22 ILE A 245 6.435 -0.417 10.486 1.00 0.00 H new ATOM 0 HG23 ILE A 245 5.544 0.411 9.187 1.00 0.00 H new ATOM 0 HD11 ILE A 245 1.398 -0.542 9.890 1.00 0.00 H new ATOM 0 HD12 ILE A 245 2.319 -1.430 11.127 1.00 0.00 H new ATOM 0 HD13 ILE A 245 2.780 0.235 10.698 1.00 0.00 H new ATOM 1059 N ILE A 246 4.969 -2.328 6.329 1.00 0.00 N ATOM 1060 CA ILE A 246 4.901 -1.813 4.977 1.00 0.00 C ATOM 1061 C ILE A 246 3.781 -0.795 4.873 1.00 0.00 C ATOM 1062 O ILE A 246 2.616 -1.115 5.097 1.00 0.00 O ATOM 1063 CB ILE A 246 4.676 -2.936 3.933 1.00 0.00 C ATOM 1064 CG1 ILE A 246 5.858 -3.913 3.906 1.00 0.00 C ATOM 1065 CG2 ILE A 246 4.456 -2.342 2.551 1.00 0.00 C ATOM 1066 CD1 ILE A 246 5.843 -4.941 5.018 1.00 0.00 C ATOM 0 H ILE A 246 4.597 -3.271 6.440 1.00 0.00 H new ATOM 0 HA ILE A 246 5.860 -1.344 4.758 1.00 0.00 H new ATOM 0 HB ILE A 246 3.784 -3.489 4.226 1.00 0.00 H new ATOM 0 HG12 ILE A 246 5.863 -4.432 2.947 1.00 0.00 H new ATOM 0 HG13 ILE A 246 6.786 -3.344 3.966 1.00 0.00 H new ATOM 0 HG21 ILE A 246 4.300 -3.145 1.831 1.00 0.00 H new ATOM 0 HG22 ILE A 246 3.579 -1.695 2.569 1.00 0.00 H new ATOM 0 HG23 ILE A 246 5.331 -1.760 2.262 1.00 0.00 H new ATOM 0 HD11 ILE A 246 6.713 -5.591 4.924 1.00 0.00 H new ATOM 0 HD12 ILE A 246 5.871 -4.434 5.983 1.00 0.00 H new ATOM 0 HD13 ILE A 246 4.934 -5.539 4.949 1.00 0.00 H new ATOM 1077 N LYS A 247 4.145 0.444 4.614 1.00 0.00 N ATOM 1078 CA LYS A 247 3.170 1.512 4.541 1.00 0.00 C ATOM 1079 C LYS A 247 3.065 2.026 3.117 1.00 0.00 C ATOM 1080 O LYS A 247 4.080 2.294 2.472 1.00 0.00 O ATOM 1081 CB LYS A 247 3.556 2.648 5.493 1.00 0.00 C ATOM 1082 CG LYS A 247 3.716 2.194 6.937 1.00 0.00 C ATOM 1083 CD LYS A 247 4.162 3.327 7.846 1.00 0.00 C ATOM 1084 CE LYS A 247 3.104 4.414 7.945 1.00 0.00 C ATOM 1085 NZ LYS A 247 3.514 5.507 8.862 1.00 0.00 N ATOM 0 H LYS A 247 5.109 0.736 4.451 1.00 0.00 H new ATOM 0 HA LYS A 247 2.198 1.123 4.843 1.00 0.00 H new ATOM 0 HB2 LYS A 247 4.491 3.095 5.154 1.00 0.00 H new ATOM 0 HB3 LYS A 247 2.795 3.427 5.446 1.00 0.00 H new ATOM 0 HG2 LYS A 247 2.769 1.792 7.297 1.00 0.00 H new ATOM 0 HG3 LYS A 247 4.444 1.384 6.983 1.00 0.00 H new ATOM 0 HD2 LYS A 247 4.375 2.934 8.840 1.00 0.00 H new ATOM 0 HD3 LYS A 247 5.090 3.755 7.467 1.00 0.00 H new ATOM 0 HE2 LYS A 247 2.913 4.825 6.954 1.00 0.00 H new ATOM 0 HE3 LYS A 247 2.168 3.978 8.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 2.765 6.227 8.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 3.672 5.120 9.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 4.393 5.941 8.514 1.00 0.00 H new ATOM 1095 N LEU A 248 1.840 2.157 2.630 1.00 0.00 N ATOM 1096 CA LEU A 248 1.613 2.676 1.294 1.00 0.00 C ATOM 1097 C LEU A 248 1.954 4.156 1.270 1.00 0.00 C ATOM 1098 O LEU A 248 1.277 4.969 1.903 1.00 0.00 O ATOM 1099 CB LEU A 248 0.157 2.451 0.871 1.00 0.00 C ATOM 1100 CG LEU A 248 -0.185 2.865 -0.562 1.00 0.00 C ATOM 1101 CD1 LEU A 248 0.638 2.069 -1.564 1.00 0.00 C ATOM 1102 CD2 LEU A 248 -1.672 2.675 -0.821 1.00 0.00 C ATOM 0 H LEU A 248 0.992 1.911 3.140 1.00 0.00 H new ATOM 0 HA LEU A 248 2.253 2.148 0.587 1.00 0.00 H new ATOM 0 HB2 LEU A 248 -0.078 1.394 0.991 1.00 0.00 H new ATOM 0 HB3 LEU A 248 -0.490 3.001 1.554 1.00 0.00 H new ATOM 0 HG LEU A 248 0.060 3.920 -0.686 1.00 0.00 H new ATOM 0 HD11 LEU A 248 0.379 2.380 -2.576 1.00 0.00 H new ATOM 0 HD12 LEU A 248 1.699 2.250 -1.389 1.00 0.00 H new ATOM 0 HD13 LEU A 248 0.427 1.006 -1.445 1.00 0.00 H new ATOM 0 HD21 LEU A 248 -1.904 2.973 -1.844 1.00 0.00 H new ATOM 0 HD22 LEU A 248 -1.935 1.627 -0.680 1.00 0.00 H new ATOM 0 HD23 LEU A 248 -2.244 3.289 -0.126 1.00 0.00 H new ATOM 1113 N ASN A 249 3.076 4.477 0.645 1.00 0.00 N ATOM 1114 CA ASN A 249 3.578 5.839 0.623 1.00 0.00 C ATOM 1115 C ASN A 249 2.739 6.709 -0.297 1.00 0.00 C ATOM 1116 O ASN A 249 2.518 6.366 -1.459 1.00 0.00 O ATOM 1117 CB ASN A 249 5.037 5.858 0.166 1.00 0.00 C ATOM 1118 CG ASN A 249 5.619 7.258 0.132 1.00 0.00 C ATOM 1119 OD1 ASN A 249 5.705 7.933 1.157 1.00 0.00 O ATOM 1120 ND2 ASN A 249 6.020 7.702 -1.049 1.00 0.00 N ATOM 0 H ASN A 249 3.659 3.807 0.143 1.00 0.00 H new ATOM 0 HA ASN A 249 3.514 6.240 1.634 1.00 0.00 H new ATOM 0 HB2 ASN A 249 5.632 5.237 0.836 1.00 0.00 H new ATOM 0 HB3 ASN A 249 5.109 5.414 -0.827 1.00 0.00 H new ATOM 0 HD21 ASN A 249 6.419 8.637 -1.134 1.00 0.00 H new ATOM 0 HD22 ASN A 249 5.930 7.109 -1.874 1.00 0.00 H new